data_25685 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 25685 _Entry.PDB_ID 2N4X save_ save_delta_chem_shifts _Entity_delta_chem_shifts.Sf_category delta_chem_shifts _Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts _Entity_delta_chem_shifts.Model_type single _Entity_delta_chem_shifts.Entry_ID 25685 _Entity_delta_chem_shifts.ID 1 loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Conformer_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 1 . 1 1 4 4 ALA N N 4 121.533 121.533 125.027 -3.494 25685 2 1 1 . 1 1 4 4 ALA C C 4 177.632 177.632 178.687 -1.055 25685 3 1 1 . 1 1 4 4 ALA CA C 4 55.117 55.117 55.252 -0.135 25685 4 1 1 . 1 1 4 4 ALA CB C 4 18.448 18.448 18.434 0.014 25685 5 1 1 . 1 1 4 4 ALA H H 4 7.977 7.977 7.487 0.490 25685 6 1 1 . 1 1 5 5 PHE N N 5 119.988 119.988 119.292 0.696 25685 7 1 1 . 1 1 5 5 PHE CA C 5 60.759 60.759 60.371 0.388 25685 8 1 1 . 1 1 5 5 PHE CB C 5 39.221 39.221 38.762 0.459 25685 9 1 1 . 1 1 5 5 PHE H H 5 8.210 8.210 8.403 -0.193 25685 10 1 1 . 1 1 6 6 ALA C C 6 179.794 179.794 179.369 0.425 25685 11 1 1 . 1 1 6 6 ALA CA C 6 55.619 55.619 54.629 0.990 25685 12 1 1 . 1 1 6 6 ALA CB C 6 17.911 17.911 17.901 0.010 25685 13 1 1 . 1 1 6 6 ALA H H 6 8.417 8.417 7.404 1.013 25685 14 1 1 . 1 1 7 7 LEU N N 7 115.852 115.852 119.326 -3.474 25685 15 1 1 . 1 1 7 7 LEU C C 7 180.196 180.196 179.022 1.174 25685 16 1 1 . 1 1 7 7 LEU CA C 7 57.528 57.528 58.022 -0.494 25685 17 1 1 . 1 1 7 7 LEU CB C 7 40.060 40.060 41.980 -1.920 25685 18 1 1 . 1 1 7 7 LEU H H 7 8.741 8.741 7.785 0.956 25685 19 1 1 . 1 1 8 8 GLY N N 8 110.199 110.199 106.804 3.395 25685 20 1 1 . 1 1 8 8 GLY C C 8 176.430 176.430 176.108 0.322 25685 21 1 1 . 1 1 8 8 GLY CA C 8 46.960 46.960 47.381 -0.421 25685 22 1 1 . 1 1 8 8 GLY H H 8 8.179 8.179 7.779 0.400 25685 23 1 1 . 1 1 9 9 ILE N N 9 122.346 122.346 122.673 -0.327 25685 24 1 1 . 1 1 9 9 ILE C C 9 178.143 178.143 177.691 0.452 25685 25 1 1 . 1 1 9 9 ILE CA C 9 65.048 65.048 64.607 0.441 25685 26 1 1 . 1 1 9 9 ILE CB C 9 36.841 36.841 37.630 -0.789 25685 27 1 1 . 1 1 9 9 ILE H H 9 7.788 7.788 7.188 0.600 25685 28 1 1 . 1 1 10 10 LEU N N 10 117.560 117.560 119.333 -1.773 25685 29 1 1 . 1 1 10 10 LEU C C 10 179.501 179.501 178.818 0.683 25685 30 1 1 . 1 1 10 10 LEU CA C 10 58.068 58.068 58.663 -0.595 25685 31 1 1 . 1 1 10 10 LEU CB C 10 40.776 40.776 40.675 0.101 25685 32 1 1 . 1 1 10 10 LEU H H 10 8.044 8.044 7.510 0.534 25685 33 1 1 . 1 1 11 11 SER N N 11 113.830 113.830 113.905 -0.075 25685 34 1 1 . 1 1 11 11 SER CA C 11 61.769 61.769 61.414 0.355 25685 35 1 1 . 1 1 11 11 SER CB C 11 63.395 63.395 63.126 0.269 25685 36 1 1 . 1 1 11 11 SER H H 11 8.140 8.140 7.371 0.769 25685 37 1 1 . 1 1 12 12 VAL N N 12 121.343 121.343 120.741 0.602 25685 38 1 1 . 1 1 12 12 VAL C C 12 176.753 176.753 177.589 -0.836 25685 39 1 1 . 1 1 12 12 VAL CA C 12 64.583 64.583 65.278 -0.695 25685 40 1 1 . 1 1 12 12 VAL CB C 12 31.067 31.067 31.429 -0.362 25685 41 1 1 . 1 1 12 12 VAL H H 12 7.587 7.587 7.762 -0.175 25685 42 1 1 . 1 1 13 13 PHE N N 13 115.225 115.225 119.746 -4.521 25685 43 1 1 . 1 1 13 13 PHE C C 13 177.349 177.349 175.883 1.466 25685 44 1 1 . 1 1 13 13 PHE CA C 13 58.730 58.730 60.664 -1.934 25685 45 1 1 . 1 1 13 13 PHE CB C 13 39.785 39.785 39.209 0.577 25685 46 1 1 . 1 1 13 13 PHE H H 13 7.474 7.474 7.236 0.238 25685 47 1 1 . 1 1 14 14 SER N N 14 116.075 116.075 115.385 0.690 25685 48 1 1 . 1 1 14 14 SER H H 14 7.955 7.955 7.907 0.048 25685 49 1 1 . 1 1 15 15 PRO C C 15 177.590 177.590 176.921 0.669 25685 50 1 1 . 1 1 15 15 PRO CA C 15 65.464 65.464 64.323 1.141 25685 51 1 1 . 1 1 16 16 ALA N N 16 116.288 116.288 118.003 -1.715 25685 52 1 1 . 1 1 16 16 ALA C C 16 177.563 177.563 176.728 0.835 25685 53 1 1 . 1 1 16 16 ALA CA C 16 53.010 53.010 52.135 0.875 25685 54 1 1 . 1 1 16 16 ALA CB C 16 19.975 19.975 18.201 1.774 25685 55 1 1 . 1 1 16 16 ALA H H 16 7.455 7.455 7.799 -0.344 25685 56 1 1 . 1 1 17 17 VAL N N 17 112.072 112.072 118.887 -6.815 25685 57 1 1 . 1 1 17 17 VAL CA C 17 63.117 63.117 62.713 0.404 25685 58 1 1 . 1 1 17 17 VAL CB C 17 33.209 33.209 31.706 1.503 25685 59 1 1 . 1 1 17 17 VAL H H 17 7.525 7.525 8.271 -0.746 25685 60 1 1 . 1 1 18 18 LEU N N 18 121.205 121.205 129.210 -8.005 25685 61 1 1 . 1 1 18 18 LEU CA C 18 58.971 58.971 58.130 0.841 25685 62 1 1 . 1 1 18 18 LEU CB C 18 41.161 41.161 40.308 0.853 25685 63 1 1 . 1 1 18 18 LEU H H 18 8.191 8.191 8.975 -0.784 25685 64 1 1 . 1 1 19 19 PRO C C 19 177.697 177.697 176.647 1.050 25685 65 1 1 . 1 1 19 19 PRO CA C 19 65.181 65.181 63.238 1.943 25685 66 1 1 . 1 1 20 20 VAL N N 20 111.723 111.723 116.351 -4.628 25685 67 1 1 . 1 1 20 20 VAL C C 20 177.137 177.137 174.600 2.537 25685 68 1 1 . 1 1 20 20 VAL CA C 20 62.494 62.494 62.204 0.290 25685 69 1 1 . 1 1 20 20 VAL CB C 20 31.677 31.677 32.032 -0.355 25685 70 1 1 . 1 1 20 20 VAL H H 20 7.571 7.571 7.777 -0.206 25685 71 1 1 . 1 1 21 21 VAL N N 21 121.705 121.705 119.599 2.106 25685 72 1 1 . 1 1 21 21 VAL CA C 21 68.305 68.305 61.827 6.478 25685 73 1 1 . 1 1 21 21 VAL H H 21 7.732 7.732 7.693 0.039 25685 74 1 1 . 1 1 24 24 ILE C C 24 174.359 174.359 175.978 -1.619 25685 75 1 1 . 1 1 25 25 PHE N N 25 120.132 120.132 118.065 2.067 25685 76 1 1 . 1 1 25 25 PHE C C 25 175.945 175.945 174.778 1.167 25685 77 1 1 . 1 1 25 25 PHE CA C 25 60.544 60.544 58.667 1.877 25685 78 1 1 . 1 1 25 25 PHE H H 25 8.082 8.082 8.422 -0.340 25685 79 1 1 . 1 1 26 26 ALA N N 26 121.341 121.341 122.322 -0.981 25685 80 1 1 . 1 1 26 26 ALA CB C 26 19.784 19.784 21.039 -1.255 25685 81 1 1 . 1 1 26 26 ALA H H 26 7.539 7.539 7.675 -0.136 25685 82 1 1 . 1 1 27 27 GLY N N 27 107.530 107.530 105.598 1.932 25685 83 1 1 . 1 1 27 27 GLY C C 27 174.252 174.252 172.757 1.495 25685 84 1 1 . 1 1 27 27 GLY CA C 27 45.474 45.474 45.011 0.463 25685 85 1 1 . 1 1 27 27 GLY H H 27 7.997 7.997 8.551 -0.554 25685 86 1 1 . 1 1 28 28 SER N N 28 116.299 116.299 114.444 1.855 25685 87 1 1 . 1 1 28 28 SER C C 28 175.759 175.759 173.418 2.341 25685 88 1 1 . 1 1 28 28 SER CA C 28 58.526 58.526 58.317 0.209 25685 89 1 1 . 1 1 28 28 SER CB C 28 64.373 64.373 62.788 1.585 25685 90 1 1 . 1 1 28 28 SER H H 28 8.115 8.115 8.342 -0.227 25685 91 1 1 . 1 1 34 34 ASP C C 34 177.621 177.621 178.428 -0.807 25685 92 1 1 . 1 1 34 34 ASP CA C 34 57.082 57.082 57.169 -0.087 25685 93 1 1 . 1 1 35 35 ALA N N 35 120.662 120.662 122.343 -1.681 25685 94 1 1 . 1 1 35 35 ALA C C 35 179.168 179.168 179.803 -0.635 25685 95 1 1 . 1 1 35 35 ALA CA C 35 55.459 55.459 54.712 0.747 25685 96 1 1 . 1 1 35 35 ALA CB C 35 18.819 18.819 18.228 0.591 25685 97 1 1 . 1 1 35 35 ALA H H 35 8.090 8.090 7.504 0.586 25685 98 1 1 . 1 1 36 36 PHE N N 36 117.638 117.638 117.021 0.617 25685 99 1 1 . 1 1 36 36 PHE C C 36 177.057 177.057 177.877 -0.820 25685 100 1 1 . 1 1 36 36 PHE CA C 36 61.472 61.472 61.598 -0.126 25685 101 1 1 . 1 1 36 36 PHE CB C 36 38.860 38.860 38.787 0.073 25685 102 1 1 . 1 1 36 36 PHE H H 36 8.227 8.227 8.293 -0.066 25685 103 1 1 . 1 1 37 37 LEU N N 37 119.312 119.312 119.944 -0.632 25685 104 1 1 . 1 1 37 37 LEU C C 37 179.798 179.798 178.976 0.822 25685 105 1 1 . 1 1 37 37 LEU CA C 37 58.181 58.181 57.649 0.532 25685 106 1 1 . 1 1 37 37 LEU CB C 37 40.835 40.835 41.065 -0.230 25685 107 1 1 . 1 1 37 37 LEU H H 37 8.588 8.588 7.709 0.879 25685 108 1 1 . 1 1 38 38 ILE N N 38 119.057 119.057 119.086 -0.029 25685 109 1 1 . 1 1 38 38 ILE C C 38 177.597 177.597 177.610 -0.013 25685 110 1 1 . 1 1 38 38 ILE CA C 38 64.827 64.827 64.893 -0.066 25685 111 1 1 . 1 1 38 38 ILE CB C 38 36.321 36.321 37.989 -1.668 25685 112 1 1 . 1 1 38 38 ILE H H 38 7.932 7.932 7.569 0.363 25685 113 1 1 . 1 1 39 39 VAL N N 39 118.758 118.758 116.900 1.858 25685 114 1 1 . 1 1 39 39 VAL C C 39 179.533 179.533 177.597 1.936 25685 115 1 1 . 1 1 39 39 VAL CA C 39 66.687 66.687 65.762 0.925 25685 116 1 1 . 1 1 39 39 VAL CB C 39 30.598 30.598 31.165 -0.567 25685 117 1 1 . 1 1 39 39 VAL H H 39 7.922 7.922 7.342 0.580 25685 118 1 1 . 1 1 40 40 ALA N N 40 125.385 125.385 121.650 3.735 25685 119 1 1 . 1 1 40 40 ALA C C 40 179.200 179.200 179.675 -0.475 25685 120 1 1 . 1 1 40 40 ALA CA C 40 55.283 55.283 55.000 0.283 25685 121 1 1 . 1 1 40 40 ALA CB C 40 17.197 17.197 18.385 -1.188 25685 122 1 1 . 1 1 40 40 ALA H H 40 9.091 9.091 7.598 1.493 25685 123 1 1 . 1 1 41 41 GLY N N 41 106.978 106.978 107.210 -0.232 25685 124 1 1 . 1 1 41 41 GLY C C 41 176.171 176.171 175.921 0.250 25685 125 1 1 . 1 1 41 41 GLY CA C 41 47.322 47.322 47.046 0.276 25685 126 1 1 . 1 1 41 41 GLY H H 41 8.565 8.565 7.884 0.681 25685 127 1 1 . 1 1 42 42 LEU N N 42 126.914 126.914 119.278 7.636 25685 128 1 1 . 1 1 42 42 LEU C C 42 178.119 178.119 178.653 -0.534 25685 129 1 1 . 1 1 42 42 LEU CA C 42 58.523 58.523 57.597 0.926 25685 130 1 1 . 1 1 42 42 LEU CB C 42 42.125 42.125 41.316 0.809 25685 131 1 1 . 1 1 42 42 LEU H H 42 8.573 8.573 7.582 0.991 25685 132 1 1 . 1 1 46 46 MET N N 46 121.710 121.710 121.070 0.640 25685 133 1 1 . 1 1 46 46 MET C C 46 179.540 179.540 178.362 1.178 25685 134 1 1 . 1 1 46 46 MET CA C 46 55.968 55.968 58.817 -2.849 25685 135 1 1 . 1 1 46 46 MET H H 46 8.589 8.589 7.471 1.118 25685 136 1 1 . 1 1 47 47 LEU N N 47 117.448 117.448 120.569 -3.121 25685 137 1 1 . 1 1 47 47 LEU HA H 47 3.992 3.992 4.198 -0.206 25685 138 1 1 . 1 1 47 47 LEU C C 47 179.082 179.082 178.241 0.841 25685 139 1 1 . 1 1 47 47 LEU CA C 47 58.157 58.157 57.750 0.407 25685 140 1 1 . 1 1 47 47 LEU CB C 47 41.858 41.858 41.758 0.100 25685 141 1 1 . 1 1 47 47 LEU H H 47 8.769 8.769 7.901 0.868 25685 142 1 1 . 1 1 48 48 ILE N N 48 117.500 117.500 118.297 -0.797 25685 143 1 1 . 1 1 48 48 ILE C C 48 180.298 180.298 177.804 2.494 25685 144 1 1 . 1 1 48 48 ILE CA C 48 65.627 65.627 64.119 1.508 25685 145 1 1 . 1 1 48 48 ILE CB C 48 37.839 37.839 37.841 -0.002 25685 146 1 1 . 1 1 48 48 ILE H H 48 8.093 8.093 7.386 0.707 25685 147 1 1 . 1 1 49 49 LEU N N 49 123.708 123.708 118.046 5.662 25685 148 1 1 . 1 1 49 49 LEU C C 49 179.721 179.721 178.431 1.290 25685 149 1 1 . 1 1 49 49 LEU CA C 49 58.788 58.788 57.047 1.741 25685 150 1 1 . 1 1 49 49 LEU CB C 49 40.761 40.761 41.152 -0.391 25685 151 1 1 . 1 1 49 49 LEU H H 49 8.833 8.833 7.648 1.185 25685 152 1 1 . 1 1 50 50 GLY N N 50 109.284 109.284 106.313 2.971 25685 153 1 1 . 1 1 50 50 GLY C C 50 176.937 176.937 174.632 2.305 25685 154 1 1 . 1 1 50 50 GLY CA C 50 47.821 47.821 47.447 0.374 25685 155 1 1 . 1 1 50 50 GLY H H 50 9.658 9.658 7.900 1.758 25685 156 1 1 . 1 1 51 51 TYR N N 51 125.640 125.640 120.107 5.533 25685 157 1 1 . 1 1 51 51 TYR C C 51 177.102 177.102 175.542 1.560 25685 158 1 1 . 1 1 51 51 TYR CA C 51 61.948 61.948 57.838 4.110 25685 159 1 1 . 1 1 51 51 TYR CB C 51 38.871 38.871 41.245 -2.374 25685 160 1 1 . 1 1 51 51 TYR H H 51 8.795 8.795 7.580 1.215 25685 161 1 1 . 1 1 52 52 THR N N 52 116.273 116.273 113.755 2.518 25685 162 1 1 . 1 1 52 52 THR C C 52 176.969 176.969 174.055 2.914 25685 163 1 1 . 1 1 52 52 THR CA C 52 67.972 67.972 62.581 5.391 25685 164 1 1 . 1 1 52 52 THR H H 52 8.456 8.456 8.195 0.261 25685 165 1 1 . 1 1 53 53 ALA N N 53 122.122 122.122 130.912 -8.790 25685 166 1 1 . 1 1 53 53 ALA C C 53 179.907 179.907 178.670 1.237 25685 167 1 1 . 1 1 53 53 ALA CA C 53 55.722 55.722 54.116 1.606 25685 168 1 1 . 1 1 53 53 ALA CB C 53 18.786 18.786 18.852 -0.066 25685 169 1 1 . 1 1 53 53 ALA H H 53 9.058 9.058 8.796 0.262 25685 170 1 1 . 1 1 54 54 SER N N 54 115.434 115.434 110.774 4.660 25685 171 1 1 . 1 1 54 54 SER C C 54 176.433 176.433 173.941 2.492 25685 172 1 1 . 1 1 54 54 SER CA C 54 55.828 55.828 59.834 -4.006 25685 173 1 1 . 1 1 54 54 SER H H 54 8.040 8.040 8.504 -0.464 25685 174 1 1 . 1 1 55 55 LEU N N 55 123.045 123.045 119.569 3.476 25685 175 1 1 . 1 1 55 55 LEU C C 55 178.789 178.789 174.663 4.126 25685 176 1 1 . 1 1 55 55 LEU CA C 55 57.633 57.633 55.011 2.622 25685 177 1 1 . 1 1 55 55 LEU CB C 55 41.293 41.293 42.311 -1.018 25685 178 1 1 . 1 1 55 55 LEU H H 55 8.255 8.255 7.863 0.392 25685 179 1 1 . 1 1 56 56 PHE N N 56 114.426 114.426 120.660 -6.234 25685 180 1 1 . 1 1 56 56 PHE C C 56 177.507 177.507 175.015 2.492 25685 181 1 1 . 1 1 56 56 PHE CA C 56 61.068 61.068 58.336 2.732 25685 182 1 1 . 1 1 56 56 PHE CB C 56 40.107 40.107 39.823 0.284 25685 183 1 1 . 1 1 56 56 PHE H H 56 7.590 7.590 7.913 -0.323 25685 184 1 1 . 1 1 57 57 PHE N N 57 114.701 114.701 118.918 -4.217 25685 185 1 1 . 1 1 57 57 PHE C C 57 176.203 176.203 176.566 -0.363 25685 186 1 1 . 1 1 57 57 PHE CA C 57 58.503 58.503 58.278 0.225 25685 187 1 1 . 1 1 57 57 PHE CB C 57 41.114 41.114 39.753 1.361 25685 188 1 1 . 1 1 57 57 PHE H H 57 8.514 8.514 8.114 0.400 25685 189 1 1 . 1 1 58 58 GLY N N 58 111.041 111.041 110.163 0.878 25685 190 1 1 . 1 1 58 58 GLY C C 58 174.240 174.240 176.042 -1.802 25685 191 1 1 . 1 1 58 58 GLY CA C 58 44.827 44.827 47.329 -2.502 25685 192 1 1 . 1 1 58 58 GLY H H 58 7.998 7.998 8.511 -0.513 25685 193 1 1 . 1 1 59 59 PHE N N 59 127.950 127.950 120.850 7.100 25685 194 1 1 . 1 1 59 59 PHE C C 59 176.612 176.612 177.246 -0.634 25685 195 1 1 . 1 1 59 59 PHE CA C 59 61.598 61.598 59.756 1.842 25685 196 1 1 . 1 1 59 59 PHE CB C 59 40.870 40.870 38.918 1.952 25685 197 1 1 . 1 1 59 59 PHE H H 59 9.105 9.105 8.287 0.818 25685 198 1 1 . 1 1 60 60 PHE N N 60 114.868 114.868 119.838 -4.970 25685 199 1 1 . 1 1 60 60 PHE C C 60 177.989 177.989 177.186 0.803 25685 200 1 1 . 1 1 60 60 PHE CA C 60 61.517 61.517 61.650 -0.133 25685 201 1 1 . 1 1 60 60 PHE CB C 60 38.248 38.248 39.197 -0.949 25685 202 1 1 . 1 1 60 60 PHE H H 60 8.796 8.796 8.169 0.627 25685 203 1 1 . 1 1 61 61 ARG N N 61 118.812 118.812 117.794 1.018 25685 204 1 1 . 1 1 61 61 ARG C C 61 177.813 177.813 178.405 -0.592 25685 205 1 1 . 1 1 61 61 ARG CA C 61 60.497 60.497 59.210 1.287 25685 206 1 1 . 1 1 61 61 ARG CB C 61 28.915 28.915 29.573 -0.657 25685 207 1 1 . 1 1 61 61 ARG H H 61 7.600 7.600 7.859 -0.259 25685 208 1 1 . 1 1 62 62 VAL N N 62 119.157 119.157 117.495 1.662 25685 209 1 1 . 1 1 62 62 VAL C C 62 177.670 177.670 177.394 0.276 25685 210 1 1 . 1 1 62 62 VAL CA C 62 66.749 66.749 65.699 1.050 25685 211 1 1 . 1 1 62 62 VAL CB C 62 30.306 30.306 30.693 -0.387 25685 212 1 1 . 1 1 62 62 VAL H H 62 7.679 7.679 7.530 0.149 25685 213 1 1 . 1 1 63 63 VAL N N 63 117.999 117.999 120.100 -2.101 25685 214 1 1 . 1 1 63 63 VAL C C 63 177.639 177.639 177.674 -0.035 25685 215 1 1 . 1 1 63 63 VAL CA C 63 66.836 66.836 65.901 0.935 25685 216 1 1 . 1 1 63 63 VAL CB C 63 30.496 30.496 30.592 -0.096 25685 217 1 1 . 1 1 63 63 VAL H H 63 7.429 7.429 7.422 0.007 25685 218 1 1 . 1 1 64 64 ALA N N 64 120.451 120.451 122.253 -1.802 25685 219 1 1 . 1 1 64 64 ALA C C 64 179.134 179.134 179.533 -0.399 25685 220 1 1 . 1 1 64 64 ALA CA C 64 55.618 55.618 54.850 0.768 25685 221 1 1 . 1 1 64 64 ALA CB C 64 17.950 17.950 17.878 0.072 25685 222 1 1 . 1 1 64 64 ALA H H 64 8.169 8.169 7.697 0.472 25685 223 1 1 . 1 1 65 65 MET N N 65 116.532 116.532 117.347 -0.815 25685 224 1 1 . 1 1 65 65 MET C C 65 177.961 177.961 178.370 -0.409 25685 225 1 1 . 1 1 65 65 MET CA C 65 58.161 58.161 56.907 1.254 25685 226 1 1 . 1 1 65 65 MET CB C 65 31.208 31.208 31.894 -0.686 25685 227 1 1 . 1 1 65 65 MET H H 65 7.857 7.857 7.493 0.364 25685 228 1 1 . 1 1 66 66 LEU C C 66 179.022 179.022 178.355 0.667 25685 229 1 1 . 1 1 66 66 LEU CA C 66 58.412 58.412 58.300 0.112 25685 230 1 1 . 1 1 67 67 PHE N N 67 116.877 116.877 118.314 -1.437 25685 231 1 1 . 1 1 67 67 PHE C C 67 177.908 177.908 177.776 0.132 25685 232 1 1 . 1 1 67 67 PHE CA C 67 62.402 62.402 61.174 1.228 25685 233 1 1 . 1 1 67 67 PHE CB C 67 39.203 39.203 39.039 0.164 25685 234 1 1 . 1 1 67 67 PHE H H 67 7.923 7.923 7.616 0.307 25685 235 1 1 . 1 1 68 68 LEU N N 68 118.860 118.860 119.946 -1.086 25685 236 1 1 . 1 1 68 68 LEU C C 68 179.032 179.032 178.316 0.716 25685 237 1 1 . 1 1 68 68 LEU CA C 68 58.397 58.397 57.638 0.759 25685 238 1 1 . 1 1 68 68 LEU CB C 68 40.803 40.803 41.907 -1.104 25685 239 1 1 . 1 1 68 68 LEU H H 68 8.167 8.167 7.435 0.732 25685 240 1 1 . 1 1 71 71 PHE N N 71 120.700 120.700 117.754 2.946 25685 241 1 1 . 1 1 71 71 PHE C C 71 177.670 177.670 177.391 0.279 25685 242 1 1 . 1 1 71 71 PHE CA C 71 60.528 60.528 60.718 -0.190 25685 243 1 1 . 1 1 71 71 PHE H H 71 7.847 7.847 7.151 0.696 25685 244 1 1 . 1 1 72 72 ALA N N 72 120.506 120.506 122.375 -1.869 25685 245 1 1 . 1 1 72 72 ALA C C 72 178.944 178.944 179.374 -0.430 25685 246 1 1 . 1 1 72 72 ALA CA C 72 55.461 55.461 54.693 0.768 25685 247 1 1 . 1 1 72 72 ALA CB C 72 17.829 17.829 18.228 -0.399 25685 248 1 1 . 1 1 72 72 ALA H H 72 8.533 8.533 7.469 1.064 25685 249 1 1 . 1 1 73 73 LEU N N 73 115.071 115.071 118.997 -3.926 25685 250 1 1 . 1 1 73 73 LEU C C 73 180.831 180.831 178.689 2.142 25685 251 1 1 . 1 1 73 73 LEU CA C 73 58.091 58.091 57.431 0.660 25685 252 1 1 . 1 1 73 73 LEU CB C 73 41.082 41.082 40.956 0.126 25685 253 1 1 . 1 1 73 73 LEU H H 73 8.458 8.458 7.872 0.586 25685 254 1 1 . 1 1 74 74 ILE N N 74 121.365 121.365 119.423 1.942 25685 255 1 1 . 1 1 74 74 ILE C C 74 178.287 178.287 177.645 0.642 25685 256 1 1 . 1 1 74 74 ILE CA C 74 65.335 65.335 63.952 1.383 25685 257 1 1 . 1 1 74 74 ILE CB C 74 37.453 37.453 37.864 -0.411 25685 258 1 1 . 1 1 74 74 ILE H H 74 8.220 8.220 7.393 0.827 25685 259 1 1 . 1 1 75 75 LEU N N 75 119.200 119.200 119.990 -0.790 25685 260 1 1 . 1 1 75 75 LEU C C 75 177.548 177.548 179.049 -1.501 25685 261 1 1 . 1 1 75 75 LEU CA C 75 56.938 56.938 57.636 -0.698 25685 262 1 1 . 1 1 75 75 LEU CB C 75 41.541 41.541 40.605 0.936 25685 263 1 1 . 1 1 75 75 LEU H H 75 7.866 7.866 7.472 0.394 25685 264 1 1 . 1 1 76 76 LEU N N 76 116.338 116.338 117.808 -1.470 25685 265 1 1 . 1 1 76 76 LEU C C 76 176.889 176.889 178.282 -1.393 25685 266 1 1 . 1 1 76 76 LEU CA C 76 54.807 54.807 57.392 -2.585 25685 267 1 1 . 1 1 76 76 LEU CB C 76 41.830 41.830 41.434 0.397 25685 268 1 1 . 1 1 76 76 LEU H H 76 7.432 7.432 7.497 -0.065 25685 269 1 1 . 1 1 77 77 SER N N 77 114.630 114.630 112.190 2.440 25685 270 1 1 . 1 1 77 77 SER C C 77 174.752 174.752 174.796 -0.044 25685 271 1 1 . 1 1 77 77 SER CA C 77 58.967 58.967 59.844 -0.877 25685 272 1 1 . 1 1 77 77 SER CB C 77 64.686 64.686 63.301 1.385 25685 273 1 1 . 1 1 77 77 SER H H 77 7.423 7.423 7.712 -0.289 25685 274 1 1 . 1 1 78 78 ASP N N 78 123.054 123.054 121.756 1.298 25685 275 1 1 . 1 1 78 78 ASP C C 78 176.716 176.716 177.147 -0.431 25685 276 1 1 . 1 1 78 78 ASP CA C 78 54.848 54.848 54.775 0.073 25685 277 1 1 . 1 1 78 78 ASP CB C 78 40.423 40.423 40.902 -0.479 25685 278 1 1 . 1 1 78 78 ASP H H 78 8.294 8.294 7.498 0.796 25685 279 1 1 . 1 1 79 79 GLU N N 79 119.104 119.104 122.095 -2.991 25685 280 1 1 . 1 1 79 79 GLU C C 79 176.391 176.391 176.129 0.262 25685 281 1 1 . 1 1 79 79 GLU CA C 79 56.258 56.258 55.628 0.630 25685 282 1 1 . 1 1 79 79 GLU CB C 79 29.656 29.656 27.050 2.606 25685 283 1 1 . 1 1 79 79 GLU H H 79 8.384 8.384 8.627 -0.243 25685 284 1 1 . 1 1 80 80 LEU N N 80 121.254 121.254 120.867 0.387 25685 285 1 1 . 1 1 80 80 LEU C C 80 177.164 177.164 174.773 2.391 25685 286 1 1 . 1 1 80 80 LEU CA C 80 54.670 54.670 56.322 -1.652 25685 287 1 1 . 1 1 80 80 LEU CB C 80 42.633 42.633 42.199 0.434 25685 288 1 1 . 1 1 80 80 LEU H H 80 7.637 7.637 8.452 -0.815 25685 289 1 1 . 1 1 81 81 ASP N N 81 123.410 123.410 121.054 2.356 25685 290 1 1 . 1 1 81 81 ASP C C 81 177.552 177.552 175.646 1.906 25685 291 1 1 . 1 1 81 81 ASP CA C 81 55.110 55.110 53.340 1.770 25685 292 1 1 . 1 1 81 81 ASP CB C 81 42.693 42.693 42.318 0.375 25685 293 1 1 . 1 1 81 81 ASP H H 81 8.403 8.403 7.930 0.473 25685 294 1 1 . 1 1 82 82 GLU N N 82 125.047 125.047 120.809 4.238 25685 295 1 1 . 1 1 82 82 GLU C C 82 178.198 178.198 178.226 -0.028 25685 296 1 1 . 1 1 82 82 GLU CA C 82 59.221 59.221 58.327 0.894 25685 297 1 1 . 1 1 82 82 GLU CB C 82 29.176 29.176 29.357 -0.181 25685 298 1 1 . 1 1 82 82 GLU H H 82 8.744 8.744 8.536 0.208 25685 299 1 1 . 1 1 83 83 LYS N N 83 118.476 118.476 119.870 -1.394 25685 300 1 1 . 1 1 83 83 LYS C C 83 179.356 179.356 178.871 0.485 25685 301 1 1 . 1 1 83 83 LYS CA C 83 59.170 59.170 59.628 -0.458 25685 302 1 1 . 1 1 83 83 LYS CB C 83 31.509 31.509 31.235 0.274 25685 303 1 1 . 1 1 83 83 LYS H H 83 8.607 8.607 8.543 0.064 25685 304 1 1 . 1 1 84 84 VAL N N 84 118.407 118.407 115.919 2.488 25685 305 1 1 . 1 1 84 84 VAL C C 84 177.653 177.653 177.765 -0.112 25685 306 1 1 . 1 1 84 84 VAL CA C 84 65.416 65.416 66.015 -0.599 25685 307 1 1 . 1 1 84 84 VAL CB C 84 31.313 31.313 31.033 0.280 25685 308 1 1 . 1 1 84 84 VAL H H 84 7.870 7.870 7.853 0.017 25685 309 1 1 . 1 1 85 85 SER N N 85 116.146 116.146 117.604 -1.458 25685 310 1 1 . 1 1 85 85 SER C C 85 177.496 177.496 177.092 0.404 25685 311 1 1 . 1 1 85 85 SER CA C 85 61.764 61.764 61.678 0.086 25685 312 1 1 . 1 1 85 85 SER CB C 85 63.654 63.654 62.969 0.685 25685 313 1 1 . 1 1 85 85 SER H H 85 8.083 8.083 8.525 -0.442 25685 314 1 1 . 1 1 86 86 ILE N N 86 122.570 122.570 122.916 -0.346 25685 315 1 1 . 1 1 86 86 ILE C C 86 178.698 178.698 177.679 1.019 25685 316 1 1 . 1 1 86 86 ILE CA C 86 64.526 64.526 64.429 0.097 25685 317 1 1 . 1 1 86 86 ILE CB C 86 37.393 37.393 37.850 -0.457 25685 318 1 1 . 1 1 86 86 ILE H H 86 8.102 8.102 7.454 0.648 25685 319 1 1 . 1 1 87 87 PHE N N 87 121.340 121.340 121.625 -0.285 25685 320 1 1 . 1 1 87 87 PHE C C 87 177.671 177.671 177.732 -0.061 25685 321 1 1 . 1 1 87 87 PHE CA C 87 61.098 61.098 61.141 -0.043 25685 322 1 1 . 1 1 87 87 PHE CB C 87 39.151 39.151 39.033 0.118 25685 323 1 1 . 1 1 87 87 PHE H H 87 7.719 7.719 8.689 -0.970 25685 324 1 1 . 1 1 88 88 ALA N N 88 120.921 120.921 121.570 -0.649 25685 325 1 1 . 1 1 88 88 ALA C C 88 180.030 180.030 179.984 0.046 25685 326 1 1 . 1 1 88 88 ALA CA C 88 55.147 55.147 55.325 -0.178 25685 327 1 1 . 1 1 88 88 ALA CB C 88 19.053 19.053 17.731 1.322 25685 328 1 1 . 1 1 88 88 ALA H H 88 8.679 8.679 8.154 0.525 25685 329 1 1 . 1 1 89 89 SER N N 89 114.285 114.285 113.921 0.364 25685 330 1 1 . 1 1 89 89 SER C C 89 177.040 177.040 176.197 0.843 25685 331 1 1 . 1 1 89 89 SER CA C 89 61.314 61.314 61.560 -0.246 25685 332 1 1 . 1 1 89 89 SER CB C 89 63.371 63.371 62.677 0.694 25685 333 1 1 . 1 1 89 89 SER H H 89 8.242 8.242 7.536 0.706 25685 334 1 1 . 1 1 90 90 ARG N N 90 121.829 121.829 120.686 1.143 25685 335 1 1 . 1 1 90 90 ARG C C 90 179.247 179.247 178.322 0.925 25685 336 1 1 . 1 1 90 90 ARG CA C 90 58.444 58.444 58.636 -0.192 25685 337 1 1 . 1 1 90 90 ARG CB C 90 29.532 29.532 28.988 0.544 25685 338 1 1 . 1 1 90 90 ARG H H 90 7.907 7.907 7.456 0.451 25685 339 1 1 . 1 1 91 91 MET N N 91 117.124 117.124 117.459 -0.335 25685 340 1 1 . 1 1 91 91 MET C C 91 177.504 177.504 177.948 -0.444 25685 341 1 1 . 1 1 91 91 MET CA C 91 57.152 57.152 59.479 -2.327 25685 342 1 1 . 1 1 91 91 MET CB C 91 32.510 32.510 31.358 1.152 25685 343 1 1 . 1 1 91 91 MET H H 91 7.930 7.930 8.235 -0.305 25685 344 1 1 . 1 1 92 92 THR N N 92 108.478 108.478 115.047 -6.569 25685 345 1 1 . 1 1 92 92 THR C C 92 176.367 176.367 176.153 0.214 25685 346 1 1 . 1 1 92 92 THR CA C 92 63.564 63.564 66.191 -2.627 25685 347 1 1 . 1 1 92 92 THR H H 92 7.847 7.847 7.894 -0.047 25685 348 1 1 . 1 1 93 93 SER N N 93 117.950 117.950 116.411 1.539 25685 349 1 1 . 1 1 93 93 SER C C 93 176.552 176.552 177.068 -0.516 25685 350 1 1 . 1 1 93 93 SER CA C 93 60.821 60.821 60.277 0.544 25685 351 1 1 . 1 1 93 93 SER CB C 93 63.311 63.311 63.340 -0.029 25685 352 1 1 . 1 1 93 93 SER H H 93 7.732 7.732 7.548 0.184 25685 353 1 1 . 1 1 94 94 GLY N N 94 111.265 111.265 110.684 0.581 25685 354 1 1 . 1 1 94 94 GLY C C 94 175.198 175.198 175.449 -0.251 25685 355 1 1 . 1 1 94 94 GLY CA C 94 46.021 46.021 45.556 0.466 25685 356 1 1 . 1 1 94 94 GLY H H 94 8.419 8.419 8.293 0.126 25685 357 1 1 . 1 1 95 95 LEU N N 95 121.019 121.019 118.504 2.515 25685 358 1 1 . 1 1 95 95 LEU C C 95 177.810 177.810 175.218 2.592 25685 359 1 1 . 1 1 95 95 LEU CA C 95 56.012 56.012 55.473 0.539 25685 360 1 1 . 1 1 95 95 LEU CB C 95 42.122 42.122 41.666 0.456 25685 361 1 1 . 1 1 95 95 LEU H H 95 7.849 7.849 7.833 0.016 25685 362 1 1 . 1 1 96 96 SER N N 96 115.465 115.465 115.644 -0.179 25685 363 1 1 . 1 1 96 96 SER C C 96 175.543 175.543 173.773 1.770 25685 364 1 1 . 1 1 96 96 SER CA C 96 60.151 60.151 57.742 2.409 25685 365 1 1 . 1 1 96 96 SER H H 96 8.349 8.349 8.011 0.338 25685 366 1 1 . 1 1 97 97 TRP N N 97 121.711 121.711 123.382 -1.671 25685 367 1 1 . 1 1 97 97 TRP C C 97 176.973 176.973 176.347 0.626 25685 368 1 1 . 1 1 97 97 TRP CA C 97 58.250 58.250 57.490 0.760 25685 369 1 1 . 1 1 97 97 TRP CB C 97 28.899 28.899 29.346 -0.447 25685 370 1 1 . 1 1 97 97 TRP H H 97 7.723 7.723 7.519 0.204 25685 371 1 1 . 1 1 98 98 LYS N N 98 119.868 119.868 123.021 -3.153 25685 372 1 1 . 1 1 98 98 LYS C C 98 178.021 178.021 177.147 0.874 25685 373 1 1 . 1 1 98 98 LYS CA C 98 56.340 56.340 56.598 -0.258 25685 374 1 1 . 1 1 98 98 LYS CB C 98 31.933 31.933 34.560 -2.627 25685 375 1 1 . 1 1 98 98 LYS H H 98 7.855 7.855 8.594 -0.739 25685 376 1 1 . 1 1 99 99 ILE N N 99 120.044 120.044 118.146 1.898 25685 377 1 1 . 1 1 99 99 ILE C C 99 176.769 176.769 175.997 0.772 25685 378 1 1 . 1 1 99 99 ILE CA C 99 62.758 62.758 62.345 0.413 25685 379 1 1 . 1 1 99 99 ILE CB C 99 37.809 37.809 37.396 0.413 25685 380 1 1 . 1 1 99 99 ILE H H 99 8.069 8.069 8.234 -0.165 25685 381 1 1 . 1 1 100 100 GLN C C 100 176.315 176.315 174.760 1.555 25685 382 1 1 . 1 1 100 100 GLN CA C 100 57.486 57.486 56.067 1.419 25685 383 1 1 . 1 1 101 101 THR N N 101 109.873 109.873 115.866 -5.993 25685 384 1 1 . 1 1 101 101 THR C C 101 174.664 174.664 173.389 1.275 25685 385 1 1 . 1 1 101 101 THR CA C 101 61.709 61.709 61.635 0.074 25685 386 1 1 . 1 1 101 101 THR CB C 101 69.290 69.290 69.988 -0.698 25685 387 1 1 . 1 1 101 101 THR H H 101 7.508 7.508 8.293 -0.785 25685 388 1 1 . 1 1 102 102 LEU N N 102 124.434 124.434 126.762 -2.328 25685 389 1 1 . 1 1 102 102 LEU C C 102 174.681 174.681 174.892 -0.211 25685 390 1 1 . 1 1 102 102 LEU CA C 102 53.063 53.063 51.833 1.230 25685 391 1 1 . 1 1 102 102 LEU CB C 102 41.139 41.139 41.855 -0.716 25685 392 1 1 . 1 1 102 102 LEU H H 102 7.569 7.569 8.411 -0.842 25685 393 1 1 . 1 1 103 103 PRO C C 103 178.076 178.076 175.666 2.410 25685 394 1 1 . 1 1 103 103 PRO CA C 103 62.570 62.570 64.160 -1.591 25685 395 1 1 . 1 1 103 103 PRO CB C 103 31.534 31.534 32.139 -0.605 25685 396 1 1 . 1 1 104 104 SER N N 104 119.929 119.929 118.579 1.350 25685 397 1 1 . 1 1 104 104 SER C C 104 176.432 176.432 173.080 3.352 25685 398 1 1 . 1 1 104 104 SER CA C 104 61.976 61.976 58.011 3.965 25685 399 1 1 . 1 1 104 104 SER CB C 104 63.611 63.611 63.471 0.140 25685 400 1 1 . 1 1 104 104 SER H H 104 8.784 8.784 7.879 0.905 25685 401 1 1 . 1 1 105 105 PHE N N 105 119.519 119.519 124.271 -4.752 25685 402 1 1 . 1 1 105 105 PHE C C 105 176.852 176.852 174.286 2.566 25685 403 1 1 . 1 1 105 105 PHE CA C 105 60.162 60.162 55.694 4.468 25685 404 1 1 . 1 1 105 105 PHE CB C 105 38.455 38.455 37.500 0.955 25685 405 1 1 . 1 1 105 105 PHE H H 105 8.620 8.620 8.038 0.582 25685 406 1 1 . 1 1 106 106 PHE N N 106 118.809 118.809 118.234 0.575 25685 407 1 1 . 1 1 106 106 PHE C C 106 176.741 176.741 176.729 0.012 25685 408 1 1 . 1 1 106 106 PHE CA C 106 61.421 61.421 57.794 3.627 25685 409 1 1 . 1 1 106 106 PHE CB C 106 38.788 38.788 36.248 2.540 25685 410 1 1 . 1 1 106 106 PHE H H 106 7.519 7.519 6.843 0.676 25685 411 1 1 . 1 1 107 107 PHE N N 107 117.382 117.382 120.329 -2.947 25685 412 1 1 . 1 1 107 107 PHE C C 107 177.771 177.771 177.721 0.050 25685 413 1 1 . 1 1 107 107 PHE CA C 107 61.099 61.099 62.158 -1.059 25685 414 1 1 . 1 1 107 107 PHE CB C 107 38.677 38.677 38.217 0.460 25685 415 1 1 . 1 1 107 107 PHE H H 107 7.903 7.903 8.534 -0.631 25685 416 1 1 . 1 1 108 108 GLY N N 108 105.340 105.340 105.434 -0.094 25685 417 1 1 . 1 1 108 108 GLY C C 108 174.574 174.574 175.889 -1.315 25685 418 1 1 . 1 1 108 108 GLY CA C 108 47.508 47.508 47.312 0.195 25685 419 1 1 . 1 1 108 108 GLY H H 108 8.351 8.351 8.814 -0.463 25685 420 1 1 . 1 1 109 109 MET N N 109 119.831 119.831 121.171 -1.340 25685 421 1 1 . 1 1 109 109 MET C C 109 177.522 177.522 177.713 -0.191 25685 422 1 1 . 1 1 109 109 MET CA C 109 58.658 58.658 58.588 0.070 25685 423 1 1 . 1 1 109 109 MET CB C 109 32.106 32.106 32.367 -0.261 25685 424 1 1 . 1 1 109 109 MET H H 109 7.919 7.919 7.753 0.166 25685 425 1 1 . 1 1 110 110 LEU N N 110 119.908 119.908 118.460 1.448 25685 426 1 1 . 1 1 110 110 LEU C C 110 178.170 178.170 178.882 -0.712 25685 427 1 1 . 1 1 110 110 LEU CA C 110 57.941 57.941 57.281 0.660 25685 428 1 1 . 1 1 110 110 LEU CB C 110 41.055 41.055 40.611 0.444 25685 429 1 1 . 1 1 110 110 LEU H H 110 7.744 7.744 7.610 0.134 25685 430 1 1 . 1 1 111 111 LEU N N 111 116.594 116.594 120.048 -3.454 25685 431 1 1 . 1 1 111 111 LEU C C 111 178.960 178.960 177.671 1.289 25685 432 1 1 . 1 1 111 111 LEU CA C 111 57.366 57.366 57.865 -0.499 25685 433 1 1 . 1 1 111 111 LEU CB C 111 40.259 40.259 41.014 -0.755 25685 434 1 1 . 1 1 111 111 LEU H H 111 7.732 7.732 7.483 0.249 25685 435 1 1 . 1 1 112 112 ALA N N 112 121.020 121.020 120.546 0.474 25685 436 1 1 . 1 1 112 112 ALA C C 112 178.700 178.700 179.142 -0.442 25685 437 1 1 . 1 1 112 112 ALA CA C 112 55.432 55.432 54.799 0.633 25685 438 1 1 . 1 1 112 112 ALA CB C 112 18.214 18.214 17.613 0.601 25685 439 1 1 . 1 1 112 112 ALA H H 112 8.121 8.121 7.265 0.856 25685 440 1 1 . 1 1 113 113 PHE N N 113 118.369 118.369 116.072 2.297 25685 441 1 1 . 1 1 113 113 PHE C C 113 176.091 176.091 177.676 -1.585 25685 442 1 1 . 1 1 113 113 PHE CA C 113 61.388 61.388 57.934 3.454 25685 443 1 1 . 1 1 113 113 PHE CB C 113 39.688 39.688 37.783 1.905 25685 444 1 1 . 1 1 113 113 PHE H H 113 8.237 8.237 6.881 1.356 25685 445 1 1 . 1 1 114 114 LEU N N 114 114.214 114.214 119.748 -5.534 25685 446 1 1 . 1 1 114 114 LEU C C 114 177.038 177.038 178.111 -1.073 25685 447 1 1 . 1 1 114 114 LEU CA C 114 56.358 56.358 57.544 -1.186 25685 448 1 1 . 1 1 114 114 LEU CB C 114 42.716 42.716 42.084 0.632 25685 449 1 1 . 1 1 114 114 LEU H H 114 7.576 7.576 7.357 0.219 25685 450 1 1 . 1 1 115 115 TRP N N 115 112.667 112.667 118.607 -5.940 25685 451 1 1 . 1 1 115 115 TRP C C 115 180.163 180.163 177.571 2.592 25685 452 1 1 . 1 1 115 115 TRP CA C 115 55.930 55.930 59.109 -3.179 25685 453 1 1 . 1 1 115 115 TRP H H 115 8.542 8.542 7.353 1.189 25685 454 1 1 . 1 1 116 116 LEU N N 116 122.144 122.144 119.924 2.220 25685 455 1 1 . 1 1 116 116 LEU C C 116 175.953 175.953 176.260 -0.307 25685 456 1 1 . 1 1 116 116 LEU CA C 116 59.924 59.924 58.895 1.029 25685 457 1 1 . 1 1 116 116 LEU CB C 116 39.097 39.097 39.626 -0.529 25685 458 1 1 . 1 1 116 116 LEU H H 116 8.996 8.996 7.410 1.586 25685 459 1 1 . 1 1 117 117 PRO C C 117 174.220 174.220 177.573 -3.353 25685 460 1 1 . 1 1 117 117 PRO CA C 117 66.300 66.300 64.340 1.960 25685 461 1 1 . 1 1 118 118 ALA N N 118 110.603 110.603 120.652 -10.049 25685 462 1 1 . 1 1 118 118 ALA C C 118 177.162 177.162 178.456 -1.294 25685 463 1 1 . 1 1 118 118 ALA CA C 118 52.670 52.670 52.151 0.519 25685 464 1 1 . 1 1 118 118 ALA CB C 118 18.853 18.853 19.766 -0.913 25685 465 1 1 . 1 1 118 118 ALA H H 118 6.633 6.633 7.609 -0.976 25685 466 1 1 . 1 1 119 119 ILE N N 119 113.492 113.492 116.232 -2.740 25685 467 1 1 . 1 1 119 119 ILE CA C 119 63.703 63.703 63.470 0.233 25685 468 1 1 . 1 1 119 119 ILE CB C 119 39.605 39.605 37.419 2.186 25685 469 1 1 . 1 1 119 119 ILE H H 119 7.693 7.693 8.394 -0.701 25685 470 1 1 . 1 1 121 121 PRO C C 121 178.089 178.089 178.934 -0.845 25685 471 1 1 . 1 1 121 121 PRO CA C 121 66.004 66.004 66.215 -0.211 25685 472 1 1 . 1 1 122 122 PHE N N 122 113.797 113.797 118.698 -4.901 25685 473 1 1 . 1 1 122 122 PHE C C 122 177.713 177.713 176.842 0.871 25685 474 1 1 . 1 1 122 122 PHE CA C 122 61.566 61.566 60.598 0.968 25685 475 1 1 . 1 1 122 122 PHE CB C 122 38.983 38.983 38.911 0.072 25685 476 1 1 . 1 1 122 122 PHE H H 122 6.846 6.846 8.125 -1.279 25685 477 1 1 . 1 1 123 123 ALA N N 123 121.512 121.512 121.633 -0.121 25685 478 1 1 . 1 1 123 123 ALA C C 123 179.318 179.318 179.860 -0.542 25685 479 1 1 . 1 1 123 123 ALA CA C 123 54.975 54.975 54.824 0.151 25685 480 1 1 . 1 1 123 123 ALA CB C 123 17.881 17.881 18.345 -0.463 25685 481 1 1 . 1 1 123 123 ALA H H 123 8.411 8.411 8.739 -0.328 25685 482 1 1 . 1 1 124 124 GLY N N 124 104.093 104.093 107.383 -3.290 25685 483 1 1 . 1 1 124 124 GLY C C 124 175.410 175.410 176.124 -0.714 25685 484 1 1 . 1 1 124 124 GLY CA C 124 47.370 47.370 46.907 0.463 25685 485 1 1 . 1 1 124 124 GLY H H 124 8.455 8.455 8.308 0.147 25685 486 1 1 . 1 1 125 125 ILE N N 125 121.895 121.895 121.856 0.039 25685 487 1 1 . 1 1 125 125 ILE C C 125 178.329 178.329 177.032 1.297 25685 488 1 1 . 1 1 125 125 ILE CA C 125 64.412 64.412 63.575 0.837 25685 489 1 1 . 1 1 125 125 ILE H H 125 7.954 7.954 7.943 0.011 25685 490 1 1 . 1 1 126 126 ALA N N 126 122.768 122.768 122.911 -0.143 25685 491 1 1 . 1 1 126 126 ALA C C 126 180.341 180.341 179.397 0.944 25685 492 1 1 . 1 1 126 126 ALA CA C 126 55.266 55.266 55.379 -0.113 25685 493 1 1 . 1 1 126 126 ALA CB C 126 18.226 18.226 18.067 0.159 25685 494 1 1 . 1 1 126 126 ALA H H 126 8.142 8.142 7.270 0.872 25685 495 1 1 . 1 1 127 127 ILE N N 127 116.752 116.752 118.287 -1.535 25685 496 1 1 . 1 1 127 127 ILE C C 127 177.993 177.993 178.087 -0.094 25685 497 1 1 . 1 1 127 127 ILE CA C 127 63.877 63.877 62.916 0.961 25685 498 1 1 . 1 1 127 127 ILE CB C 127 37.657 37.657 36.511 1.146 25685 499 1 1 . 1 1 127 127 ILE H H 127 8.335 8.335 7.406 0.929 25685 500 1 1 . 1 1 128 128 SER N N 128 116.351 116.351 116.022 0.329 25685 501 1 1 . 1 1 128 128 SER C C 128 175.796 175.796 176.656 -0.860 25685 502 1 1 . 1 1 128 128 SER CA C 128 61.818 61.818 61.098 0.720 25685 503 1 1 . 1 1 128 128 SER H H 128 7.939 7.939 7.545 0.394 25685 504 1 1 . 1 1 129 129 GLN N N 129 118.082 118.082 120.749 -2.667 25685 505 1 1 . 1 1 129 129 GLN C C 129 177.419 177.419 178.548 -1.129 25685 506 1 1 . 1 1 129 129 GLN CA C 129 57.106 57.106 58.422 -1.315 25685 507 1 1 . 1 1 129 129 GLN CB C 129 28.631 28.631 28.752 -0.121 25685 508 1 1 . 1 1 129 129 GLN H H 129 7.943 7.943 7.751 0.192 25685 509 1 1 . 1 1 130 130 THR N N 130 113.484 113.484 114.317 -0.833 25685 510 1 1 . 1 1 130 130 THR C C 130 175.627 175.627 175.517 0.110 25685 511 1 1 . 1 1 130 130 THR CA C 130 63.758 63.758 65.496 -1.738 25685 512 1 1 . 1 1 130 130 THR CB C 130 69.182 69.182 68.896 0.286 25685 513 1 1 . 1 1 130 130 THR H H 130 7.686 7.686 7.550 0.137 25685 514 1 1 . 1 1 131 131 LEU N N 131 121.347 121.347 122.410 -1.063 25685 515 1 1 . 1 1 131 131 LEU C C 131 177.522 177.522 175.233 2.289 25685 516 1 1 . 1 1 131 131 LEU CA C 131 56.307 56.307 53.877 2.430 25685 517 1 1 . 1 1 131 131 LEU CB C 131 41.711 41.711 40.448 1.263 25685 518 1 1 . 1 1 131 131 LEU H H 131 8.071 8.071 7.699 0.372 25685 519 1 1 . 1 1 132 132 LEU N N 132 118.162 118.162 120.546 -2.384 25685 520 1 1 . 1 1 132 132 LEU C C 132 177.461 177.461 175.705 1.756 25685 521 1 1 . 1 1 132 132 LEU CA C 132 55.264 55.264 55.338 -0.074 25685 522 1 1 . 1 1 132 132 LEU CB C 132 41.613 41.613 44.543 -2.930 25685 523 1 1 . 1 1 132 132 LEU H H 132 7.810 7.810 7.593 0.217 25685 524 1 1 . 1 1 133 133 SER N N 133 114.244 114.244 118.824 -4.580 25685 525 1 1 . 1 1 133 133 SER C C 133 174.363 174.363 173.485 0.878 25685 526 1 1 . 1 1 133 133 SER CA C 133 59.019 59.019 59.926 -0.907 25685 527 1 1 . 1 1 133 133 SER CB C 133 64.634 64.634 63.239 1.395 25685 528 1 1 . 1 1 133 133 SER H H 133 7.829 7.829 8.499 -0.670 25685 529 1 1 . 1 1 134 134 GLU N N 134 120.151 120.151 121.316 -1.165 25685 530 1 1 . 1 1 134 134 GLU C C 134 175.935 175.935 175.208 0.727 25685 531 1 1 . 1 1 134 134 GLU CA C 134 56.301 56.301 55.765 0.536 25685 532 1 1 . 1 1 134 134 GLU CB C 134 30.129 30.129 31.754 -1.625 25685 533 1 1 . 1 1 134 134 GLU H H 134 8.054 8.054 8.462 -0.408 25685 534 1 1 . 1 1 135 135 ASN N N 135 118.890 118.890 117.759 1.131 25685 535 1 1 . 1 1 135 135 ASN C C 135 174.272 174.272 173.258 1.014 25685 536 1 1 . 1 1 135 135 ASN CA C 135 51.390 51.390 52.158 -0.769 25685 537 1 1 . 1 1 135 135 ASN CB C 135 39.129 39.129 37.844 1.285 25685 538 1 1 . 1 1 135 135 ASN H H 135 8.305 8.305 8.454 -0.149 25685 539 1 1 . 1 1 136 136 PRO C C 136 177.960 177.960 177.707 0.253 25685 540 1 1 . 1 1 136 136 PRO CA C 136 64.530 64.530 64.776 -0.246 25685 541 1 1 . 1 1 136 136 PRO CB C 136 31.809 31.809 31.865 -0.056 25685 542 1 1 . 1 1 137 137 LEU N N 137 117.735 117.735 117.860 -0.125 25685 543 1 1 . 1 1 137 137 LEU C C 137 179.217 179.217 178.930 0.287 25685 544 1 1 . 1 1 137 137 LEU CA C 137 57.039 57.039 58.458 -1.419 25685 545 1 1 . 1 1 137 137 LEU CB C 137 40.799 40.799 41.186 -0.387 25685 546 1 1 . 1 1 137 137 LEU H H 137 8.248 8.248 7.893 0.355 25685 547 1 1 . 1 1 138 138 VAL N N 138 119.589 119.589 117.955 1.634 25685 548 1 1 . 1 1 138 138 VAL C C 138 177.894 177.894 177.873 0.021 25685 549 1 1 . 1 1 138 138 VAL CA C 138 64.727 64.727 65.644 -0.917 25685 550 1 1 . 1 1 138 138 VAL CB C 138 31.347 31.347 31.077 0.270 25685 551 1 1 . 1 1 138 138 VAL H H 138 7.483 7.483 7.434 0.049 25685 552 1 1 . 1 1 139 139 MET N N 139 119.431 119.431 120.623 -1.192 25685 553 1 1 . 1 1 139 139 MET C C 139 177.988 177.988 178.727 -0.739 25685 554 1 1 . 1 1 139 139 MET CA C 139 57.403 57.403 59.433 -2.030 25685 555 1 1 . 1 1 139 139 MET CB C 139 31.709 31.709 32.566 -0.857 25685 556 1 1 . 1 1 139 139 MET H H 139 7.837 7.837 7.447 0.390 25685 557 1 1 . 1 1 140 140 LEU N N 140 119.686 119.686 119.061 0.625 25685 558 1 1 . 1 1 140 140 LEU C C 140 177.916 177.916 179.045 -1.129 25685 559 1 1 . 1 1 140 140 LEU CA C 140 56.877 56.877 58.243 -1.366 25685 560 1 1 . 1 1 140 140 LEU CB C 140 41.491 41.491 41.029 0.462 25685 561 1 1 . 1 1 140 140 LEU H H 140 7.926 7.926 8.812 -0.886 25685 562 1 1 . 1 1 141 141 SER N N 141 114.167 114.167 115.458 -1.291 25685 563 1 1 . 1 1 141 141 SER C C 141 176.030 176.030 177.017 -0.987 25685 564 1 1 . 1 1 141 141 SER CA C 141 60.425 60.425 61.129 -0.704 25685 565 1 1 . 1 1 141 141 SER CB C 141 63.956 63.956 63.352 0.604 25685 566 1 1 . 1 1 141 141 SER H H 141 7.757 7.757 8.254 -0.497 25685 567 1 1 . 1 1 142 142 TYR N N 142 121.679 121.679 124.032 -2.353 25685 568 1 1 . 1 1 142 142 TYR C C 142 177.659 177.659 177.604 0.055 25685 569 1 1 . 1 1 142 142 TYR CA C 142 59.673 59.673 59.414 0.259 25685 570 1 1 . 1 1 142 142 TYR CB C 142 38.079 38.079 38.441 -0.362 25685 571 1 1 . 1 1 142 142 TYR H H 142 7.965 7.965 8.824 -0.859 25685 572 1 1 . 1 1 143 143 GLY N N 143 107.396 107.396 107.074 0.322 25685 573 1 1 . 1 1 143 143 GLY C C 143 174.877 174.877 175.466 -0.589 25685 574 1 1 . 1 1 143 143 GLY CA C 143 46.343 46.343 47.355 -1.012 25685 575 1 1 . 1 1 143 143 GLY H H 143 8.177 8.177 8.763 -0.586 25685 576 1 1 . 1 1 144 144 LEU N N 144 120.477 120.477 120.583 -0.106 25685 577 1 1 . 1 1 144 144 LEU C C 144 178.504 178.504 178.470 0.034 25685 578 1 1 . 1 1 144 144 LEU CA C 144 56.270 56.270 57.413 -1.143 25685 579 1 1 . 1 1 144 144 LEU CB C 144 41.662 41.662 41.097 0.565 25685 580 1 1 . 1 1 144 144 LEU H H 144 8.055 8.055 7.317 0.738 25685 581 1 1 . 1 1 145 145 GLY N N 145 106.847 106.847 107.358 -0.511 25685 582 1 1 . 1 1 145 145 GLY C C 145 175.375 175.375 175.832 -0.457 25685 583 1 1 . 1 1 145 145 GLY CA C 145 45.582 45.582 46.777 -1.195 25685 584 1 1 . 1 1 145 145 GLY H H 145 8.066 8.066 7.937 0.129 25685 585 1 1 . 1 1 146 146 MET N N 146 120.376 120.376 122.251 -1.875 25685 586 1 1 . 1 1 146 146 MET C C 146 176.663 176.663 177.621 -0.958 25685 587 1 1 . 1 1 146 146 MET CA C 146 57.030 57.030 57.219 -0.189 25685 588 1 1 . 1 1 146 146 MET CB C 146 30.720 30.720 31.366 -0.647 25685 589 1 1 . 1 1 146 146 MET H H 146 8.157 8.157 8.152 0.005 25685 590 1 1 . 1 1 147 147 ALA N N 147 123.038 123.038 121.599 1.439 25685 591 1 1 . 1 1 147 147 ALA C C 147 178.917 178.917 179.553 -0.636 25685 592 1 1 . 1 1 147 147 ALA CA C 147 54.201 54.201 55.228 -1.027 25685 593 1 1 . 1 1 147 147 ALA CB C 147 18.810 18.810 18.075 0.735 25685 594 1 1 . 1 1 147 147 ALA H H 147 8.336 8.336 8.145 0.191 25685 595 1 1 . 1 1 148 148 VAL N N 148 117.795 117.795 117.540 0.255 25685 596 1 1 . 1 1 148 148 VAL C C 148 176.891 176.891 178.071 -1.180 25685 597 1 1 . 1 1 148 148 VAL CA C 148 64.157 64.157 66.533 -2.376 25685 598 1 1 . 1 1 148 148 VAL CB C 148 31.529 31.529 31.407 0.122 25685 599 1 1 . 1 1 148 148 VAL H H 148 7.908 7.908 7.504 0.404 25685 600 1 1 . 1 1 149 149 THR N N 149 116.069 116.069 115.098 0.971 25685 601 1 1 . 1 1 149 149 THR C C 149 176.054 176.054 176.280 -0.226 25685 602 1 1 . 1 1 149 149 THR CA C 149 63.308 63.308 66.180 -2.872 25685 603 1 1 . 1 1 149 149 THR H H 149 7.414 7.414 7.380 0.034 25685 604 1 1 . 1 1 150 150 ILE N N 150 121.971 121.971 121.682 0.289 25685 605 1 1 . 1 1 150 150 ILE C C 150 177.715 177.715 177.149 0.566 25685 606 1 1 . 1 1 150 150 ILE CA C 150 64.319 64.319 62.489 1.830 25685 607 1 1 . 1 1 150 150 ILE CB C 150 36.628 36.628 36.862 -0.234 25685 608 1 1 . 1 1 150 150 ILE H H 150 8.772 8.772 8.098 0.674 25685 609 1 1 . 1 1 151 151 ALA N N 151 122.272 122.272 121.662 0.610 25685 610 1 1 . 1 1 151 151 ALA C C 151 180.370 180.370 179.552 0.818 25685 611 1 1 . 1 1 151 151 ALA CA C 151 55.336 55.336 55.238 0.098 25685 612 1 1 . 1 1 151 151 ALA CB C 151 18.107 18.107 18.147 -0.040 25685 613 1 1 . 1 1 151 151 ALA H H 151 8.163 8.163 7.588 0.575 25685 614 1 1 . 1 1 152 152 ALA N N 152 120.648 120.648 120.956 -0.308 25685 615 1 1 . 1 1 152 152 ALA C C 152 181.019 181.019 179.917 1.102 25685 616 1 1 . 1 1 152 152 ALA CA C 152 54.944 54.944 54.860 0.084 25685 617 1 1 . 1 1 152 152 ALA CB C 152 18.963 18.963 18.596 0.367 25685 618 1 1 . 1 1 152 152 ALA H H 152 7.877 7.877 7.431 0.446 25685 619 1 1 . 1 1 153 153 VAL N N 153 119.372 119.372 119.148 0.224 25685 620 1 1 . 1 1 153 153 VAL C C 153 178.197 178.197 177.711 0.486 25685 621 1 1 . 1 1 153 153 VAL CA C 153 66.289 66.289 65.508 0.781 25685 622 1 1 . 1 1 153 153 VAL CB C 153 30.770 30.770 32.028 -1.258 25685 623 1 1 . 1 1 153 153 VAL H H 153 8.118 8.118 7.823 0.295 25685 624 1 1 . 1 1 154 154 PHE N N 154 120.362 120.362 119.862 0.500 25685 625 1 1 . 1 1 154 154 PHE C C 154 177.733 177.733 177.272 0.461 25685 626 1 1 . 1 1 154 154 PHE CA C 154 61.412 61.412 61.313 0.099 25685 627 1 1 . 1 1 154 154 PHE CB C 154 38.465 38.465 38.841 -0.376 25685 628 1 1 . 1 1 154 154 PHE H H 154 8.508 8.508 8.210 0.298 25685 629 1 1 . 1 1 155 155 LYS N N 155 118.894 118.894 120.200 -1.306 25685 630 1 1 . 1 1 155 155 LYS C C 155 179.940 179.940 178.405 1.535 25685 631 1 1 . 1 1 155 155 LYS CA C 155 58.969 58.969 59.287 -0.318 25685 632 1 1 . 1 1 155 155 LYS CB C 155 31.725 31.725 32.185 -0.460 25685 633 1 1 . 1 1 155 155 LYS H H 155 8.035 8.035 7.731 0.304 25685 634 1 1 . 1 1 156 156 MET N N 156 118.853 118.853 116.800 2.053 25685 635 1 1 . 1 1 156 156 MET C C 156 179.245 179.245 178.209 1.036 25685 636 1 1 . 1 1 156 156 MET CA C 156 58.518 58.518 57.892 0.626 25685 637 1 1 . 1 1 156 156 MET CB C 156 31.912 31.912 30.958 0.954 25685 638 1 1 . 1 1 156 156 MET H H 156 8.014 8.014 7.732 0.282 25685 639 1 1 . 1 1 157 157 GLY N N 157 108.239 108.239 106.704 1.535 25685 640 1 1 . 1 1 157 157 GLY C C 157 174.637 174.637 175.784 -1.147 25685 641 1 1 . 1 1 157 157 GLY CA C 157 47.204 47.204 46.860 0.344 25685 642 1 1 . 1 1 157 157 GLY H H 157 8.614 8.614 7.616 0.998 25685 643 1 1 . 1 1 158 158 GLU N N 158 122.902 122.902 120.655 2.247 25685 644 1 1 . 1 1 158 158 GLU C C 158 177.851 177.851 176.647 1.204 25685 645 1 1 . 1 1 158 158 GLU CA C 158 60.203 60.203 57.019 3.184 25685 646 1 1 . 1 1 158 158 GLU CB C 158 28.870 28.870 30.830 -1.960 25685 647 1 1 . 1 1 158 158 GLU H H 158 8.550 8.550 7.531 1.019 25685 648 1 1 . 1 1 159 159 LYS N N 159 117.932 117.932 117.111 0.821 25685 649 1 1 . 1 1 159 159 LYS C C 159 179.529 179.529 174.884 4.645 25685 650 1 1 . 1 1 159 159 LYS CA C 159 59.419 59.419 56.072 3.347 25685 651 1 1 . 1 1 159 159 LYS CB C 159 31.759 31.759 33.967 -2.208 25685 652 1 1 . 1 1 159 159 LYS H H 159 7.641 7.641 7.987 -0.346 25685 653 1 1 . 1 1 160 160 PHE N N 160 120.614 120.614 121.836 -1.222 25685 654 1 1 . 1 1 160 160 PHE C C 160 178.511 178.511 176.030 2.481 25685 655 1 1 . 1 1 160 160 PHE CA C 160 61.580 61.580 59.131 2.449 25685 656 1 1 . 1 1 160 160 PHE CB C 160 39.909 39.909 39.559 0.350 25685 657 1 1 . 1 1 160 160 PHE H H 160 8.026 8.026 8.565 -0.539 25685 658 1 1 . 1 1 161 161 VAL N N 161 119.870 119.870 118.739 1.131 25685 659 1 1 . 1 1 161 161 VAL C C 161 177.347 177.347 176.204 1.143 25685 660 1 1 . 1 1 161 161 VAL CA C 161 66.121 66.121 60.235 5.886 25685 661 1 1 . 1 1 161 161 VAL CB C 161 30.935 30.935 35.037 -4.102 25685 662 1 1 . 1 1 161 161 VAL H H 161 8.628 8.628 8.282 0.346 25685 663 1 1 . 1 1 162 162 LYS N N 162 116.237 116.237 124.379 -8.142 25685 664 1 1 . 1 1 162 162 LYS C C 162 179.197 179.197 175.934 3.263 25685 665 1 1 . 1 1 162 162 LYS CA C 162 60.037 60.037 58.939 1.098 25685 666 1 1 . 1 1 162 162 LYS CB C 162 31.333 31.333 32.609 -1.276 25685 667 1 1 . 1 1 162 162 LYS H H 162 7.843 7.843 8.656 -0.813 25685 668 1 1 . 1 1 163 163 ALA N N 163 119.197 119.197 117.689 1.508 25685 669 1 1 . 1 1 163 163 ALA C C 163 178.635 178.635 174.846 3.789 25685 670 1 1 . 1 1 163 163 ALA CA C 163 53.681 53.681 51.599 2.082 25685 671 1 1 . 1 1 163 163 ALA CB C 163 19.586 19.586 18.675 0.911 25685 672 1 1 . 1 1 163 163 ALA H H 163 7.630 7.630 7.724 -0.094 25685 673 1 1 . 1 1 164 164 ASN N N 164 115.956 115.956 118.506 -2.550 25685 674 1 1 . 1 1 164 164 ASN C C 164 175.556 175.556 176.108 -0.552 25685 675 1 1 . 1 1 164 164 ASN CA C 164 52.267 52.267 53.278 -1.011 25685 676 1 1 . 1 1 164 164 ASN CB C 164 39.148 39.148 38.752 0.396 25685 677 1 1 . 1 1 164 164 ASN H H 164 7.326 7.326 8.281 -0.955 25685 678 1 1 . 1 1 165 165 PHE N N 165 121.612 121.612 123.981 -2.369 25685 679 1 1 . 1 1 165 165 PHE C C 165 177.069 177.069 176.304 0.765 25685 680 1 1 . 1 1 165 165 PHE CA C 165 62.921 62.921 61.208 1.713 25685 681 1 1 . 1 1 165 165 PHE CB C 165 39.427 39.427 39.253 0.174 25685 682 1 1 . 1 1 165 165 PHE H H 165 7.408 7.408 8.879 -1.471 25685 683 1 1 . 1 1 166 166 GLN N N 166 117.147 117.147 117.151 -0.004 25685 684 1 1 . 1 1 166 166 GLN C C 166 178.922 178.922 178.097 0.825 25685 685 1 1 . 1 1 166 166 GLN CA C 166 59.262 59.262 58.065 1.197 25685 686 1 1 . 1 1 166 166 GLN CB C 166 26.811 26.811 27.555 -0.744 25685 687 1 1 . 1 1 166 166 GLN H H 166 8.605 8.605 8.534 0.071 25685 688 1 1 . 1 1 167 167 LEU N N 167 121.946 121.946 120.394 1.552 25685 689 1 1 . 1 1 167 167 LEU C C 167 178.863 178.863 178.330 0.533 25685 690 1 1 . 1 1 167 167 LEU CA C 167 58.039 58.039 57.862 0.177 25685 691 1 1 . 1 1 167 167 LEU CB C 167 41.130 41.130 41.873 -0.743 25685 692 1 1 . 1 1 167 167 LEU H H 167 7.892 7.892 7.494 0.398 25685 693 1 1 . 1 1 168 168 ILE N N 168 118.751 118.751 117.197 1.554 25685 694 1 1 . 1 1 168 168 ILE C C 168 179.908 179.908 177.523 2.385 25685 695 1 1 . 1 1 168 168 ILE CA C 168 63.886 63.886 63.498 0.388 25685 696 1 1 . 1 1 168 168 ILE CB C 168 36.170 36.170 37.197 -1.027 25685 697 1 1 . 1 1 168 168 ILE H H 168 8.065 8.065 7.315 0.750 25685 698 1 1 . 1 1 169 169 ARG N N 169 125.851 125.851 120.210 5.641 25685 699 1 1 . 1 1 169 169 ARG C C 169 177.579 177.579 178.102 -0.523 25685 700 1 1 . 1 1 169 169 ARG CA C 169 60.306 60.306 59.430 0.876 25685 701 1 1 . 1 1 169 169 ARG CB C 169 29.224 29.224 29.887 -0.663 25685 702 1 1 . 1 1 169 169 ARG H H 169 8.995 8.995 7.642 1.353 25685 703 1 1 . 1 1 170 170 LYS N N 170 119.586 119.586 118.340 1.246 25685 704 1 1 . 1 1 170 170 LYS C C 170 178.584 178.584 178.349 0.235 25685 705 1 1 . 1 1 170 170 LYS CA C 170 60.293 60.293 59.249 1.044 25685 706 1 1 . 1 1 170 170 LYS CB C 170 32.530 32.530 31.541 0.989 25685 707 1 1 . 1 1 170 170 LYS H H 170 7.663 7.663 7.498 0.165 25685 708 1 1 . 1 1 171 171 VAL N N 171 118.348 118.348 120.281 -1.933 25685 709 1 1 . 1 1 171 171 VAL C C 171 177.478 177.478 177.472 0.006 25685 710 1 1 . 1 1 171 171 VAL CA C 171 66.641 66.641 65.689 0.952 25685 711 1 1 . 1 1 171 171 VAL CB C 171 31.565 31.565 30.774 0.791 25685 712 1 1 . 1 1 171 171 VAL H H 171 8.515 8.515 7.620 0.895 25685 713 1 1 . 1 1 172 172 THR N N 172 115.172 115.172 114.769 0.403 25685 714 1 1 . 1 1 172 172 THR C C 172 176.320 176.320 176.460 -0.140 25685 715 1 1 . 1 1 172 172 THR H H 172 8.416 8.416 7.567 0.849 25685 716 1 1 . 1 1 173 173 GLY N N 173 108.801 108.801 108.364 0.437 25685 717 1 1 . 1 1 173 173 GLY C C 173 174.138 174.138 175.209 -1.071 25685 718 1 1 . 1 1 173 173 GLY CA C 173 47.769 47.769 46.767 1.002 25685 719 1 1 . 1 1 173 173 GLY H H 173 8.505 8.505 7.732 0.773 25685 720 1 1 . 1 1 174 174 ALA N N 174 123.573 123.573 124.552 -0.979 25685 721 1 1 . 1 1 174 174 ALA C C 174 178.782 178.782 178.989 -0.207 25685 722 1 1 . 1 1 174 174 ALA CA C 174 55.604 55.604 54.895 0.709 25685 723 1 1 . 1 1 174 174 ALA CB C 174 18.778 18.778 18.619 0.159 25685 724 1 1 . 1 1 174 174 ALA H H 174 8.038 8.038 7.407 0.631 25685 725 1 1 . 1 1 175 175 ILE N N 175 118.501 118.501 119.320 -0.819 25685 726 1 1 . 1 1 175 175 ILE C C 175 178.247 178.247 178.243 0.004 25685 727 1 1 . 1 1 175 175 ILE CA C 175 65.412 65.412 64.302 1.110 25685 728 1 1 . 1 1 175 175 ILE CB C 175 37.671 37.671 37.901 -0.230 25685 729 1 1 . 1 1 175 175 ILE H H 175 7.897 7.897 7.454 0.443 25685 730 1 1 . 1 1 176 176 VAL N N 176 120.104 120.104 120.198 -0.094 25685 731 1 1 . 1 1 176 176 VAL C C 176 177.945 177.945 177.994 -0.049 25685 732 1 1 . 1 1 176 176 VAL CA C 176 67.761 67.761 66.527 1.234 25685 733 1 1 . 1 1 176 176 VAL CB C 176 30.662 30.662 31.425 -0.763 25685 734 1 1 . 1 1 176 176 VAL H H 176 8.321 8.321 7.828 0.493 25685 735 1 1 . 1 1 177 177 LEU N N 177 118.561 118.561 119.709 -1.148 25685 736 1 1 . 1 1 177 177 LEU C C 177 178.563 178.563 178.637 -0.074 25685 737 1 1 . 1 1 177 177 LEU CA C 177 58.094 58.094 57.987 0.107 25685 738 1 1 . 1 1 177 177 LEU CB C 177 41.061 41.061 41.534 -0.473 25685 739 1 1 . 1 1 177 177 LEU H H 177 8.097 8.097 7.604 0.493 25685 740 1 1 . 1 1 178 178 LEU N N 178 120.868 120.868 119.325 1.543 25685 741 1 1 . 1 1 178 178 LEU C C 178 178.524 178.524 177.963 0.561 25685 742 1 1 . 1 1 178 178 LEU CA C 178 57.767 57.767 57.831 -0.064 25685 743 1 1 . 1 1 178 178 LEU CB C 178 40.886 40.886 41.317 -0.431 25685 744 1 1 . 1 1 178 178 LEU H H 178 8.229 8.229 7.371 0.858 25685 745 1 1 . 1 1 179 179 TYR N N 179 119.355 119.355 118.690 0.665 25685 746 1 1 . 1 1 179 179 TYR C C 179 180.059 180.059 177.272 2.787 25685 747 1 1 . 1 1 179 179 TYR CA C 179 63.844 63.844 60.956 2.888 25685 748 1 1 . 1 1 179 179 TYR CB C 179 39.508 39.508 38.261 1.247 25685 749 1 1 . 1 1 179 179 TYR H H 179 8.759 8.759 7.751 1.008 25685 750 1 1 . 1 1 180 180 LEU N N 180 118.984 118.984 118.660 0.324 25685 751 1 1 . 1 1 180 180 LEU C C 180 179.079 179.079 179.021 0.058 25685 752 1 1 . 1 1 180 180 LEU CA C 180 58.879 58.879 57.555 1.324 25685 753 1 1 . 1 1 180 180 LEU CB C 180 41.899 41.899 41.175 0.724 25685 754 1 1 . 1 1 180 180 LEU H H 180 8.315 8.315 7.562 0.753 25685 755 1 1 . 1 1 181 181 ALA N N 181 121.826 121.826 121.868 -0.042 25685 756 1 1 . 1 1 181 181 ALA C C 181 180.009 180.009 179.714 0.295 25685 757 1 1 . 1 1 181 181 ALA CA C 181 55.700 55.700 54.871 0.829 25685 758 1 1 . 1 1 181 181 ALA CB C 181 17.713 17.713 18.328 -0.615 25685 759 1 1 . 1 1 181 181 ALA H H 181 8.480 8.480 7.903 0.577 25685 760 1 1 . 1 1 182 182 TYR N N 182 118.039 118.039 118.107 -0.068 25685 761 1 1 . 1 1 182 182 TYR CA C 182 59.038 59.038 61.777 -2.739 25685 762 1 1 . 1 1 182 182 TYR H H 182 8.856 8.856 7.755 1.101 25685 763 1 1 . 1 1 183 183 PHE N N 183 124.769 124.769 117.144 7.625 25685 764 1 1 . 1 1 183 183 PHE CA C 183 63.566 63.566 59.192 4.374 25685 765 1 1 . 1 1 183 183 PHE H H 183 9.764 9.764 7.428 2.336 25685 766 1 2 . 1 1 4 4 ALA N N 4 121.533 121.533 121.577 -0.044 25685 767 1 2 . 1 1 4 4 ALA C C 4 177.632 177.632 178.728 -1.096 25685 768 1 2 . 1 1 4 4 ALA CA C 4 55.117 55.117 55.319 -0.202 25685 769 1 2 . 1 1 4 4 ALA CB C 4 18.448 18.448 18.490 -0.042 25685 770 1 2 . 1 1 4 4 ALA H H 4 7.977 7.977 8.298 -0.321 25685 771 1 2 . 1 1 5 5 PHE N N 5 119.988 119.988 119.650 0.338 25685 772 1 2 . 1 1 5 5 PHE CA C 5 60.759 60.759 60.475 0.284 25685 773 1 2 . 1 1 5 5 PHE CB C 5 39.221 39.221 38.387 0.834 25685 774 1 2 . 1 1 5 5 PHE H H 5 8.210 8.210 8.241 -0.031 25685 775 1 2 . 1 1 6 6 ALA C C 6 179.794 179.794 179.348 0.446 25685 776 1 2 . 1 1 6 6 ALA CA C 6 55.619 55.619 54.698 0.921 25685 777 1 2 . 1 1 6 6 ALA CB C 6 17.911 17.911 17.621 0.290 25685 778 1 2 . 1 1 6 6 ALA H H 6 8.417 8.417 8.266 0.151 25685 779 1 2 . 1 1 7 7 LEU N N 7 115.852 115.852 119.220 -3.368 25685 780 1 2 . 1 1 7 7 LEU C C 7 180.196 180.196 178.710 1.486 25685 781 1 2 . 1 1 7 7 LEU CA C 7 57.528 57.528 57.496 0.032 25685 782 1 2 . 1 1 7 7 LEU CB C 7 40.060 40.060 41.807 -1.748 25685 783 1 2 . 1 1 7 7 LEU H H 7 8.741 8.741 7.576 1.165 25685 784 1 2 . 1 1 8 8 GLY N N 8 110.199 110.199 107.082 3.117 25685 785 1 2 . 1 1 8 8 GLY C C 8 176.430 176.430 175.735 0.695 25685 786 1 2 . 1 1 8 8 GLY CA C 8 46.960 46.960 47.294 -0.334 25685 787 1 2 . 1 1 8 8 GLY H H 8 8.179 8.179 7.780 0.399 25685 788 1 2 . 1 1 9 9 ILE N N 9 122.346 122.346 122.904 -0.558 25685 789 1 2 . 1 1 9 9 ILE C C 9 178.143 178.143 176.983 1.160 25685 790 1 2 . 1 1 9 9 ILE CA C 9 65.048 65.048 63.203 1.845 25685 791 1 2 . 1 1 9 9 ILE CB C 9 36.841 36.841 38.011 -1.170 25685 792 1 2 . 1 1 9 9 ILE H H 9 7.788 7.788 7.198 0.590 25685 793 1 2 . 1 1 10 10 LEU N N 10 117.560 117.560 120.090 -2.530 25685 794 1 2 . 1 1 10 10 LEU C C 10 179.501 179.501 178.277 1.224 25685 795 1 2 . 1 1 10 10 LEU CA C 10 58.068 58.068 58.451 -0.383 25685 796 1 2 . 1 1 10 10 LEU CB C 10 40.776 40.776 41.575 -0.799 25685 797 1 2 . 1 1 10 10 LEU H H 10 8.044 8.044 7.416 0.628 25685 798 1 2 . 1 1 11 11 SER N N 11 113.830 113.830 114.399 -0.569 25685 799 1 2 . 1 1 11 11 SER CA C 11 61.769 61.769 61.335 0.434 25685 800 1 2 . 1 1 11 11 SER CB C 11 63.395 63.395 63.350 0.045 25685 801 1 2 . 1 1 11 11 SER H H 11 8.140 8.140 7.482 0.658 25685 802 1 2 . 1 1 12 12 VAL N N 12 121.343 121.343 120.688 0.655 25685 803 1 2 . 1 1 12 12 VAL C C 12 176.753 176.753 176.901 -0.148 25685 804 1 2 . 1 1 12 12 VAL CA C 12 64.583 64.583 65.271 -0.688 25685 805 1 2 . 1 1 12 12 VAL CB C 12 31.067 31.067 31.175 -0.108 25685 806 1 2 . 1 1 12 12 VAL H H 12 7.587 7.587 7.231 0.356 25685 807 1 2 . 1 1 13 13 PHE N N 13 115.225 115.225 118.845 -3.620 25685 808 1 2 . 1 1 13 13 PHE C C 13 177.349 177.349 176.525 0.824 25685 809 1 2 . 1 1 13 13 PHE CA C 13 58.730 58.730 60.460 -1.730 25685 810 1 2 . 1 1 13 13 PHE CB C 13 39.785 39.785 39.426 0.359 25685 811 1 2 . 1 1 13 13 PHE H H 13 7.474 7.474 7.549 -0.075 25685 812 1 2 . 1 1 14 14 SER N N 14 116.075 116.075 115.315 0.760 25685 813 1 2 . 1 1 14 14 SER H H 14 7.955 7.955 8.077 -0.122 25685 814 1 2 . 1 1 15 15 PRO C C 15 177.590 177.590 175.699 1.891 25685 815 1 2 . 1 1 15 15 PRO CA C 15 65.464 65.464 62.209 3.255 25685 816 1 2 . 1 1 16 16 ALA N N 16 116.288 116.288 121.362 -5.074 25685 817 1 2 . 1 1 16 16 ALA C C 16 177.563 177.563 177.051 0.512 25685 818 1 2 . 1 1 16 16 ALA CA C 16 53.010 53.010 50.878 2.132 25685 819 1 2 . 1 1 16 16 ALA CB C 16 19.975 19.975 19.904 0.071 25685 820 1 2 . 1 1 16 16 ALA H H 16 7.455 7.455 7.936 -0.481 25685 821 1 2 . 1 1 17 17 VAL N N 17 112.072 112.072 119.155 -7.083 25685 822 1 2 . 1 1 17 17 VAL CA C 17 63.117 63.117 62.418 0.699 25685 823 1 2 . 1 1 17 17 VAL CB C 17 33.209 33.209 32.410 0.799 25685 824 1 2 . 1 1 17 17 VAL H H 17 7.525 7.525 8.203 -0.678 25685 825 1 2 . 1 1 18 18 LEU N N 18 121.205 121.205 120.072 1.133 25685 826 1 2 . 1 1 18 18 LEU CA C 18 58.971 58.971 57.177 1.794 25685 827 1 2 . 1 1 18 18 LEU CB C 18 41.161 41.161 39.950 1.211 25685 828 1 2 . 1 1 18 18 LEU H H 18 8.191 8.191 8.271 -0.080 25685 829 1 2 . 1 1 19 19 PRO C C 19 177.697 177.697 176.621 1.076 25685 830 1 2 . 1 1 19 19 PRO CA C 19 65.181 65.181 63.864 1.317 25685 831 1 2 . 1 1 20 20 VAL N N 20 111.723 111.723 113.622 -1.899 25685 832 1 2 . 1 1 20 20 VAL C C 20 177.137 177.137 175.086 2.051 25685 833 1 2 . 1 1 20 20 VAL CA C 20 62.494 62.494 62.815 -0.321 25685 834 1 2 . 1 1 20 20 VAL CB C 20 31.677 31.677 31.397 0.280 25685 835 1 2 . 1 1 20 20 VAL H H 20 7.571 7.571 7.742 -0.171 25685 836 1 2 . 1 1 21 21 VAL N N 21 121.705 121.705 118.521 3.184 25685 837 1 2 . 1 1 21 21 VAL CA C 21 68.305 68.305 64.744 3.561 25685 838 1 2 . 1 1 21 21 VAL H H 21 7.732 7.732 8.665 -0.933 25685 839 1 2 . 1 1 24 24 ILE C C 24 174.359 174.359 175.049 -0.690 25685 840 1 2 . 1 1 25 25 PHE N N 25 120.132 120.132 128.441 -8.309 25685 841 1 2 . 1 1 25 25 PHE C C 25 175.945 175.945 174.441 1.504 25685 842 1 2 . 1 1 25 25 PHE CA C 25 60.544 60.544 58.670 1.874 25685 843 1 2 . 1 1 25 25 PHE H H 25 8.082 8.082 8.989 -0.907 25685 844 1 2 . 1 1 26 26 ALA N N 26 121.341 121.341 125.422 -4.081 25685 845 1 2 . 1 1 26 26 ALA CB C 26 19.784 19.784 21.256 -1.472 25685 846 1 2 . 1 1 26 26 ALA H H 26 7.539 7.539 8.542 -1.003 25685 847 1 2 . 1 1 27 27 GLY N N 27 107.530 107.530 107.465 0.065 25685 848 1 2 . 1 1 27 27 GLY C C 27 174.252 174.252 173.603 0.649 25685 849 1 2 . 1 1 27 27 GLY CA C 27 45.474 45.474 44.966 0.508 25685 850 1 2 . 1 1 27 27 GLY H H 27 7.997 7.997 8.667 -0.670 25685 851 1 2 . 1 1 28 28 SER N N 28 116.299 116.299 115.359 0.940 25685 852 1 2 . 1 1 28 28 SER C C 28 175.759 175.759 174.067 1.692 25685 853 1 2 . 1 1 28 28 SER CA C 28 58.526 58.526 57.695 0.831 25685 854 1 2 . 1 1 28 28 SER CB C 28 64.373 64.373 62.916 1.457 25685 855 1 2 . 1 1 28 28 SER H H 28 8.115 8.115 8.528 -0.413 25685 856 1 2 . 1 1 34 34 ASP C C 34 177.621 177.621 178.474 -0.853 25685 857 1 2 . 1 1 34 34 ASP CA C 34 57.082 57.082 57.284 -0.202 25685 858 1 2 . 1 1 35 35 ALA N N 35 120.662 120.662 121.879 -1.217 25685 859 1 2 . 1 1 35 35 ALA C C 35 179.168 179.168 179.566 -0.398 25685 860 1 2 . 1 1 35 35 ALA CA C 35 55.459 55.459 54.669 0.790 25685 861 1 2 . 1 1 35 35 ALA CB C 35 18.819 18.819 18.208 0.611 25685 862 1 2 . 1 1 35 35 ALA H H 35 8.090 8.090 7.567 0.523 25685 863 1 2 . 1 1 36 36 PHE N N 36 117.638 117.638 119.273 -1.635 25685 864 1 2 . 1 1 36 36 PHE C C 36 177.057 177.057 177.757 -0.700 25685 865 1 2 . 1 1 36 36 PHE CA C 36 61.472 61.472 62.215 -0.743 25685 866 1 2 . 1 1 36 36 PHE CB C 36 38.860 38.860 39.356 -0.496 25685 867 1 2 . 1 1 36 36 PHE H H 36 8.227 8.227 7.885 0.342 25685 868 1 2 . 1 1 37 37 LEU N N 37 119.312 119.312 120.348 -1.036 25685 869 1 2 . 1 1 37 37 LEU C C 37 179.798 179.798 178.734 1.064 25685 870 1 2 . 1 1 37 37 LEU CA C 37 58.181 58.181 58.114 0.067 25685 871 1 2 . 1 1 37 37 LEU CB C 37 40.835 40.835 42.147 -1.312 25685 872 1 2 . 1 1 37 37 LEU H H 37 8.588 8.588 8.012 0.576 25685 873 1 2 . 1 1 38 38 ILE N N 38 119.057 119.057 119.031 0.026 25685 874 1 2 . 1 1 38 38 ILE C C 38 177.597 177.597 177.455 0.142 25685 875 1 2 . 1 1 38 38 ILE CA C 38 64.827 64.827 64.924 -0.097 25685 876 1 2 . 1 1 38 38 ILE CB C 38 36.321 36.321 37.811 -1.490 25685 877 1 2 . 1 1 38 38 ILE H H 38 7.932 7.932 7.913 0.019 25685 878 1 2 . 1 1 39 39 VAL N N 39 118.758 118.758 118.330 0.428 25685 879 1 2 . 1 1 39 39 VAL C C 39 179.533 179.533 177.402 2.131 25685 880 1 2 . 1 1 39 39 VAL CA C 39 66.687 66.687 65.942 0.745 25685 881 1 2 . 1 1 39 39 VAL CB C 39 30.598 30.598 30.580 0.018 25685 882 1 2 . 1 1 39 39 VAL H H 39 7.922 7.922 7.485 0.437 25685 883 1 2 . 1 1 40 40 ALA N N 40 125.385 125.385 122.546 2.839 25685 884 1 2 . 1 1 40 40 ALA C C 40 179.200 179.200 179.696 -0.496 25685 885 1 2 . 1 1 40 40 ALA CA C 40 55.283 55.283 55.249 0.034 25685 886 1 2 . 1 1 40 40 ALA CB C 40 17.197 17.197 18.282 -1.085 25685 887 1 2 . 1 1 40 40 ALA H H 40 9.091 9.091 7.590 1.501 25685 888 1 2 . 1 1 41 41 GLY N N 41 106.978 106.978 105.973 1.005 25685 889 1 2 . 1 1 41 41 GLY C C 41 176.171 176.171 176.070 0.101 25685 890 1 2 . 1 1 41 41 GLY CA C 41 47.322 47.322 47.018 0.304 25685 891 1 2 . 1 1 41 41 GLY H H 41 8.565 8.565 7.711 0.854 25685 892 1 2 . 1 1 42 42 LEU N N 42 126.914 126.914 120.293 6.621 25685 893 1 2 . 1 1 42 42 LEU C C 42 178.119 178.119 178.827 -0.708 25685 894 1 2 . 1 1 42 42 LEU CA C 42 58.523 58.523 57.819 0.703 25685 895 1 2 . 1 1 42 42 LEU CB C 42 42.125 42.125 41.260 0.866 25685 896 1 2 . 1 1 42 42 LEU H H 42 8.573 8.573 7.559 1.014 25685 897 1 2 . 1 1 46 46 MET N N 46 121.710 121.710 121.402 0.308 25685 898 1 2 . 1 1 46 46 MET C C 46 179.540 179.540 179.123 0.417 25685 899 1 2 . 1 1 46 46 MET CA C 46 55.968 55.968 57.541 -1.573 25685 900 1 2 . 1 1 46 46 MET H H 46 8.589 8.589 7.693 0.896 25685 901 1 2 . 1 1 47 47 LEU N N 47 117.448 117.448 121.817 -4.369 25685 902 1 2 . 1 1 47 47 LEU HA H 47 3.992 3.992 4.195 -0.203 25685 903 1 2 . 1 1 47 47 LEU C C 47 179.082 179.082 178.495 0.587 25685 904 1 2 . 1 1 47 47 LEU CA C 47 58.157 58.157 57.989 0.168 25685 905 1 2 . 1 1 47 47 LEU CB C 47 41.858 41.858 41.484 0.374 25685 906 1 2 . 1 1 47 47 LEU H H 47 8.769 8.769 8.296 0.473 25685 907 1 2 . 1 1 48 48 ILE N N 48 117.500 117.500 118.145 -0.645 25685 908 1 2 . 1 1 48 48 ILE C C 48 180.298 180.298 178.368 1.930 25685 909 1 2 . 1 1 48 48 ILE CA C 48 65.627 65.627 63.521 2.106 25685 910 1 2 . 1 1 48 48 ILE CB C 48 37.839 37.839 37.005 0.834 25685 911 1 2 . 1 1 48 48 ILE H H 48 8.093 8.093 7.541 0.552 25685 912 1 2 . 1 1 49 49 LEU N N 49 123.708 123.708 121.801 1.907 25685 913 1 2 . 1 1 49 49 LEU C C 49 179.721 179.721 178.067 1.654 25685 914 1 2 . 1 1 49 49 LEU CA C 49 58.788 58.788 57.239 1.549 25685 915 1 2 . 1 1 49 49 LEU CB C 49 40.761 40.761 41.653 -0.892 25685 916 1 2 . 1 1 49 49 LEU H H 49 8.833 8.833 7.687 1.146 25685 917 1 2 . 1 1 50 50 GLY N N 50 109.284 109.284 104.350 4.934 25685 918 1 2 . 1 1 50 50 GLY C C 50 176.937 176.937 174.538 2.399 25685 919 1 2 . 1 1 50 50 GLY CA C 50 47.821 47.821 46.776 1.045 25685 920 1 2 . 1 1 50 50 GLY H H 50 9.658 9.658 8.417 1.241 25685 921 1 2 . 1 1 51 51 TYR N N 51 125.640 125.640 122.824 2.816 25685 922 1 2 . 1 1 51 51 TYR C C 51 177.102 177.102 174.605 2.497 25685 923 1 2 . 1 1 51 51 TYR CA C 51 61.948 61.948 55.506 6.442 25685 924 1 2 . 1 1 51 51 TYR CB C 51 38.871 38.871 38.099 0.772 25685 925 1 2 . 1 1 51 51 TYR H H 51 8.795 8.795 7.550 1.245 25685 926 1 2 . 1 1 52 52 THR N N 52 116.273 116.273 115.825 0.448 25685 927 1 2 . 1 1 52 52 THR C C 52 176.969 176.969 174.420 2.549 25685 928 1 2 . 1 1 52 52 THR CA C 52 67.972 67.972 63.858 4.114 25685 929 1 2 . 1 1 52 52 THR H H 52 8.456 8.456 7.969 0.487 25685 930 1 2 . 1 1 53 53 ALA N N 53 122.122 122.122 121.657 0.465 25685 931 1 2 . 1 1 53 53 ALA C C 53 179.907 179.907 177.728 2.179 25685 932 1 2 . 1 1 53 53 ALA CA C 53 55.722 55.722 52.810 2.912 25685 933 1 2 . 1 1 53 53 ALA CB C 53 18.786 18.786 19.071 -0.285 25685 934 1 2 . 1 1 53 53 ALA H H 53 9.058 9.058 8.232 0.826 25685 935 1 2 . 1 1 54 54 SER N N 54 115.434 115.434 114.280 1.154 25685 936 1 2 . 1 1 54 54 SER C C 54 176.433 176.433 173.523 2.910 25685 937 1 2 . 1 1 54 54 SER CA C 54 55.828 55.828 60.928 -5.099 25685 938 1 2 . 1 1 54 54 SER H H 54 8.040 8.040 8.422 -0.382 25685 939 1 2 . 1 1 55 55 LEU N N 55 123.045 123.045 115.450 7.595 25685 940 1 2 . 1 1 55 55 LEU C C 55 178.789 178.789 176.007 2.782 25685 941 1 2 . 1 1 55 55 LEU CA C 55 57.633 57.633 54.716 2.917 25685 942 1 2 . 1 1 55 55 LEU CB C 55 41.293 41.293 42.499 -1.206 25685 943 1 2 . 1 1 55 55 LEU H H 55 8.255 8.255 7.568 0.687 25685 944 1 2 . 1 1 56 56 PHE N N 56 114.426 114.426 122.259 -7.833 25685 945 1 2 . 1 1 56 56 PHE C C 56 177.507 177.507 176.247 1.260 25685 946 1 2 . 1 1 56 56 PHE CA C 56 61.068 61.068 60.038 1.030 25685 947 1 2 . 1 1 56 56 PHE CB C 56 40.107 40.107 39.915 0.192 25685 948 1 2 . 1 1 56 56 PHE H H 56 7.590 7.590 8.271 -0.681 25685 949 1 2 . 1 1 57 57 PHE N N 57 114.701 114.701 116.705 -2.004 25685 950 1 2 . 1 1 57 57 PHE C C 57 176.203 176.203 176.370 -0.167 25685 951 1 2 . 1 1 57 57 PHE CA C 57 58.503 58.503 57.611 0.892 25685 952 1 2 . 1 1 57 57 PHE CB C 57 41.114 41.114 38.728 2.386 25685 953 1 2 . 1 1 57 57 PHE H H 57 8.514 8.514 8.330 0.184 25685 954 1 2 . 1 1 58 58 GLY N N 58 111.041 111.041 110.666 0.375 25685 955 1 2 . 1 1 58 58 GLY C C 58 174.240 174.240 176.119 -1.879 25685 956 1 2 . 1 1 58 58 GLY CA C 58 44.827 44.827 46.971 -2.144 25685 957 1 2 . 1 1 58 58 GLY H H 58 7.998 7.998 8.686 -0.688 25685 958 1 2 . 1 1 59 59 PHE N N 59 127.950 127.950 120.799 7.151 25685 959 1 2 . 1 1 59 59 PHE C C 59 176.612 176.612 177.510 -0.898 25685 960 1 2 . 1 1 59 59 PHE CA C 59 61.598 61.598 58.842 2.756 25685 961 1 2 . 1 1 59 59 PHE CB C 59 40.870 40.870 38.671 2.199 25685 962 1 2 . 1 1 59 59 PHE H H 59 9.105 9.105 8.074 1.031 25685 963 1 2 . 1 1 60 60 PHE N N 60 114.868 114.868 119.745 -4.877 25685 964 1 2 . 1 1 60 60 PHE C C 60 177.989 177.989 177.017 0.972 25685 965 1 2 . 1 1 60 60 PHE CA C 60 61.517 61.517 61.780 -0.263 25685 966 1 2 . 1 1 60 60 PHE CB C 60 38.248 38.248 39.026 -0.777 25685 967 1 2 . 1 1 60 60 PHE H H 60 8.796 8.796 8.445 0.351 25685 968 1 2 . 1 1 61 61 ARG N N 61 118.812 118.812 117.990 0.822 25685 969 1 2 . 1 1 61 61 ARG C C 61 177.813 177.813 178.426 -0.613 25685 970 1 2 . 1 1 61 61 ARG CA C 61 60.497 60.497 59.186 1.311 25685 971 1 2 . 1 1 61 61 ARG CB C 61 28.915 28.915 29.959 -1.044 25685 972 1 2 . 1 1 61 61 ARG H H 61 7.600 7.600 7.834 -0.234 25685 973 1 2 . 1 1 62 62 VAL N N 62 119.157 119.157 120.314 -1.157 25685 974 1 2 . 1 1 62 62 VAL C C 62 177.670 177.670 177.639 0.031 25685 975 1 2 . 1 1 62 62 VAL CA C 62 66.749 66.749 64.990 1.759 25685 976 1 2 . 1 1 62 62 VAL CB C 62 30.306 30.306 32.149 -1.843 25685 977 1 2 . 1 1 62 62 VAL H H 62 7.679 7.679 7.478 0.201 25685 978 1 2 . 1 1 63 63 VAL N N 63 117.999 117.999 119.058 -1.059 25685 979 1 2 . 1 1 63 63 VAL C C 63 177.639 177.639 178.099 -0.460 25685 980 1 2 . 1 1 63 63 VAL CA C 63 66.836 66.836 65.887 0.949 25685 981 1 2 . 1 1 63 63 VAL CB C 63 30.496 30.496 30.531 -0.035 25685 982 1 2 . 1 1 63 63 VAL H H 63 7.429 7.429 7.770 -0.341 25685 983 1 2 . 1 1 64 64 ALA N N 64 120.451 120.451 121.677 -1.226 25685 984 1 2 . 1 1 64 64 ALA C C 64 179.134 179.134 180.089 -0.955 25685 985 1 2 . 1 1 64 64 ALA CA C 64 55.618 55.618 54.650 0.968 25685 986 1 2 . 1 1 64 64 ALA CB C 64 17.950 17.950 17.889 0.061 25685 987 1 2 . 1 1 64 64 ALA H H 64 8.169 8.169 7.427 0.742 25685 988 1 2 . 1 1 65 65 MET N N 65 116.532 116.532 116.830 -0.298 25685 989 1 2 . 1 1 65 65 MET C C 65 177.961 177.961 177.521 0.440 25685 990 1 2 . 1 1 65 65 MET CA C 65 58.161 58.161 58.130 0.031 25685 991 1 2 . 1 1 65 65 MET CB C 65 31.208 31.208 31.727 -0.519 25685 992 1 2 . 1 1 65 65 MET H H 65 7.857 7.857 7.445 0.412 25685 993 1 2 . 1 1 66 66 LEU C C 66 179.022 179.022 178.460 0.562 25685 994 1 2 . 1 1 66 66 LEU CA C 66 58.412 58.412 58.096 0.315 25685 995 1 2 . 1 1 67 67 PHE N N 67 116.877 116.877 119.146 -2.269 25685 996 1 2 . 1 1 67 67 PHE C C 67 177.908 177.908 176.928 0.980 25685 997 1 2 . 1 1 67 67 PHE CA C 67 62.402 62.402 60.950 1.452 25685 998 1 2 . 1 1 67 67 PHE CB C 67 39.203 39.203 38.691 0.512 25685 999 1 2 . 1 1 67 67 PHE H H 67 7.923 7.923 7.713 0.210 25685 1000 1 2 . 1 1 68 68 LEU N N 68 118.860 118.860 119.981 -1.121 25685 1001 1 2 . 1 1 68 68 LEU C C 68 179.032 179.032 178.773 0.259 25685 1002 1 2 . 1 1 68 68 LEU CA C 68 58.397 58.397 57.103 1.294 25685 1003 1 2 . 1 1 68 68 LEU CB C 68 40.803 40.803 40.505 0.298 25685 1004 1 2 . 1 1 68 68 LEU H H 68 8.167 8.167 8.163 0.004 25685 1005 1 2 . 1 1 71 71 PHE N N 71 120.700 120.700 119.630 1.070 25685 1006 1 2 . 1 1 71 71 PHE C C 71 177.670 177.670 177.152 0.518 25685 1007 1 2 . 1 1 71 71 PHE CA C 71 60.528 60.528 60.871 -0.343 25685 1008 1 2 . 1 1 71 71 PHE H H 71 7.847 7.847 7.623 0.224 25685 1009 1 2 . 1 1 72 72 ALA N N 72 120.506 120.506 121.943 -1.437 25685 1010 1 2 . 1 1 72 72 ALA C C 72 178.944 178.944 179.501 -0.557 25685 1011 1 2 . 1 1 72 72 ALA CA C 72 55.461 55.461 55.139 0.322 25685 1012 1 2 . 1 1 72 72 ALA CB C 72 17.829 17.829 18.182 -0.353 25685 1013 1 2 . 1 1 72 72 ALA H H 72 8.533 8.533 7.763 0.770 25685 1014 1 2 . 1 1 73 73 LEU N N 73 115.071 115.071 119.106 -4.035 25685 1015 1 2 . 1 1 73 73 LEU C C 73 180.831 180.831 179.017 1.814 25685 1016 1 2 . 1 1 73 73 LEU CA C 73 58.091 58.091 58.016 0.075 25685 1017 1 2 . 1 1 73 73 LEU CB C 73 41.082 41.082 41.117 -0.035 25685 1018 1 2 . 1 1 73 73 LEU H H 73 8.458 8.458 7.595 0.863 25685 1019 1 2 . 1 1 74 74 ILE N N 74 121.365 121.365 114.692 6.673 25685 1020 1 2 . 1 1 74 74 ILE C C 74 178.287 178.287 177.769 0.518 25685 1021 1 2 . 1 1 74 74 ILE CA C 74 65.335 65.335 64.087 1.248 25685 1022 1 2 . 1 1 74 74 ILE CB C 74 37.453 37.453 37.376 0.077 25685 1023 1 2 . 1 1 74 74 ILE H H 74 8.220 8.220 7.231 0.989 25685 1024 1 2 . 1 1 75 75 LEU N N 75 119.200 119.200 120.670 -1.470 25685 1025 1 2 . 1 1 75 75 LEU C C 75 177.548 177.548 177.717 -0.169 25685 1026 1 2 . 1 1 75 75 LEU CA C 75 56.938 56.938 57.052 -0.114 25685 1027 1 2 . 1 1 75 75 LEU CB C 75 41.541 41.541 41.483 0.058 25685 1028 1 2 . 1 1 75 75 LEU H H 75 7.866 7.866 7.219 0.647 25685 1029 1 2 . 1 1 76 76 LEU N N 76 116.338 116.338 116.404 -0.066 25685 1030 1 2 . 1 1 76 76 LEU C C 76 176.889 176.889 178.520 -1.631 25685 1031 1 2 . 1 1 76 76 LEU CA C 76 54.807 54.807 57.315 -2.508 25685 1032 1 2 . 1 1 76 76 LEU CB C 76 41.830 41.830 41.724 0.106 25685 1033 1 2 . 1 1 76 76 LEU H H 76 7.432 7.432 7.602 -0.170 25685 1034 1 2 . 1 1 77 77 SER N N 77 114.630 114.630 111.784 2.846 25685 1035 1 2 . 1 1 77 77 SER C C 77 174.752 174.752 175.182 -0.430 25685 1036 1 2 . 1 1 77 77 SER CA C 77 58.967 58.967 60.098 -1.131 25685 1037 1 2 . 1 1 77 77 SER CB C 77 64.686 64.686 63.540 1.146 25685 1038 1 2 . 1 1 77 77 SER H H 77 7.423 7.423 7.744 -0.321 25685 1039 1 2 . 1 1 78 78 ASP N N 78 123.054 123.054 120.425 2.629 25685 1040 1 2 . 1 1 78 78 ASP C C 78 176.716 176.716 175.379 1.337 25685 1041 1 2 . 1 1 78 78 ASP CA C 78 54.848 54.848 56.075 -1.227 25685 1042 1 2 . 1 1 78 78 ASP CB C 78 40.423 40.423 41.175 -0.752 25685 1043 1 2 . 1 1 78 78 ASP H H 78 8.294 8.294 7.480 0.814 25685 1044 1 2 . 1 1 79 79 GLU N N 79 119.104 119.104 121.278 -2.174 25685 1045 1 2 . 1 1 79 79 GLU C C 79 176.391 176.391 175.516 0.875 25685 1046 1 2 . 1 1 79 79 GLU CA C 79 56.258 56.258 55.713 0.545 25685 1047 1 2 . 1 1 79 79 GLU CB C 79 29.656 29.656 29.356 0.300 25685 1048 1 2 . 1 1 79 79 GLU H H 79 8.384 8.384 8.466 -0.082 25685 1049 1 2 . 1 1 80 80 LEU N N 80 121.254 121.254 122.159 -0.905 25685 1050 1 2 . 1 1 80 80 LEU C C 80 177.164 177.164 175.865 1.299 25685 1051 1 2 . 1 1 80 80 LEU CA C 80 54.670 54.670 55.756 -1.086 25685 1052 1 2 . 1 1 80 80 LEU CB C 80 42.633 42.633 41.942 0.691 25685 1053 1 2 . 1 1 80 80 LEU H H 80 7.637 7.637 8.370 -0.733 25685 1054 1 2 . 1 1 81 81 ASP N N 81 123.410 123.410 121.184 2.226 25685 1055 1 2 . 1 1 81 81 ASP C C 81 177.552 177.552 175.275 2.277 25685 1056 1 2 . 1 1 81 81 ASP CA C 81 55.110 55.110 53.479 1.631 25685 1057 1 2 . 1 1 81 81 ASP CB C 81 42.693 42.693 42.620 0.073 25685 1058 1 2 . 1 1 81 81 ASP H H 81 8.403 8.403 8.135 0.268 25685 1059 1 2 . 1 1 82 82 GLU N N 82 125.047 125.047 120.911 4.136 25685 1060 1 2 . 1 1 82 82 GLU C C 82 178.198 178.198 178.391 -0.193 25685 1061 1 2 . 1 1 82 82 GLU CA C 82 59.221 59.221 58.552 0.669 25685 1062 1 2 . 1 1 82 82 GLU CB C 82 29.176 29.176 30.108 -0.932 25685 1063 1 2 . 1 1 82 82 GLU H H 82 8.744 8.744 8.709 0.035 25685 1064 1 2 . 1 1 83 83 LYS N N 83 118.476 118.476 120.386 -1.910 25685 1065 1 2 . 1 1 83 83 LYS C C 83 179.356 179.356 179.214 0.142 25685 1066 1 2 . 1 1 83 83 LYS CA C 83 59.170 59.170 59.268 -0.098 25685 1067 1 2 . 1 1 83 83 LYS CB C 83 31.509 31.509 31.988 -0.479 25685 1068 1 2 . 1 1 83 83 LYS H H 83 8.607 8.607 7.868 0.739 25685 1069 1 2 . 1 1 84 84 VAL N N 84 118.407 118.407 115.853 2.554 25685 1070 1 2 . 1 1 84 84 VAL C C 84 177.653 177.653 177.632 0.021 25685 1071 1 2 . 1 1 84 84 VAL CA C 84 65.416 65.416 66.359 -0.943 25685 1072 1 2 . 1 1 84 84 VAL CB C 84 31.313 31.313 31.259 0.054 25685 1073 1 2 . 1 1 84 84 VAL H H 84 7.870 7.870 8.495 -0.625 25685 1074 1 2 . 1 1 85 85 SER N N 85 116.146 116.146 116.571 -0.425 25685 1075 1 2 . 1 1 85 85 SER C C 85 177.496 177.496 177.018 0.478 25685 1076 1 2 . 1 1 85 85 SER CA C 85 61.764 61.764 61.236 0.528 25685 1077 1 2 . 1 1 85 85 SER CB C 85 63.654 63.654 62.657 0.997 25685 1078 1 2 . 1 1 85 85 SER H H 85 8.083 8.083 7.814 0.269 25685 1079 1 2 . 1 1 86 86 ILE N N 86 122.570 122.570 123.002 -0.432 25685 1080 1 2 . 1 1 86 86 ILE C C 86 178.698 178.698 177.778 0.920 25685 1081 1 2 . 1 1 86 86 ILE CA C 86 64.526 64.526 63.796 0.730 25685 1082 1 2 . 1 1 86 86 ILE CB C 86 37.393 37.393 37.305 0.088 25685 1083 1 2 . 1 1 86 86 ILE H H 86 8.102 8.102 7.571 0.531 25685 1084 1 2 . 1 1 87 87 PHE N N 87 121.340 121.340 120.454 0.886 25685 1085 1 2 . 1 1 87 87 PHE C C 87 177.671 177.671 176.114 1.557 25685 1086 1 2 . 1 1 87 87 PHE CA C 87 61.098 61.098 61.339 -0.241 25685 1087 1 2 . 1 1 87 87 PHE CB C 87 39.151 39.151 38.246 0.905 25685 1088 1 2 . 1 1 87 87 PHE H H 87 7.719 7.719 8.953 -1.234 25685 1089 1 2 . 1 1 88 88 ALA N N 88 120.921 120.921 120.953 -0.032 25685 1090 1 2 . 1 1 88 88 ALA C C 88 180.030 180.030 178.982 1.048 25685 1091 1 2 . 1 1 88 88 ALA CA C 88 55.147 55.147 54.710 0.437 25685 1092 1 2 . 1 1 88 88 ALA CB C 88 19.053 19.053 18.035 1.018 25685 1093 1 2 . 1 1 88 88 ALA H H 88 8.679 8.679 7.809 0.870 25685 1094 1 2 . 1 1 89 89 SER N N 89 114.285 114.285 114.530 -0.245 25685 1095 1 2 . 1 1 89 89 SER C C 89 177.040 177.040 176.477 0.563 25685 1096 1 2 . 1 1 89 89 SER CA C 89 61.314 61.314 60.922 0.392 25685 1097 1 2 . 1 1 89 89 SER CB C 89 63.371 63.371 62.675 0.696 25685 1098 1 2 . 1 1 89 89 SER H H 89 8.242 8.242 7.491 0.751 25685 1099 1 2 . 1 1 90 90 ARG N N 90 121.829 121.829 121.587 0.242 25685 1100 1 2 . 1 1 90 90 ARG C C 90 179.247 179.247 177.960 1.287 25685 1101 1 2 . 1 1 90 90 ARG CA C 90 58.444 58.444 58.569 -0.125 25685 1102 1 2 . 1 1 90 90 ARG CB C 90 29.532 29.532 28.934 0.598 25685 1103 1 2 . 1 1 90 90 ARG H H 90 7.907 7.907 7.444 0.463 25685 1104 1 2 . 1 1 91 91 MET N N 91 117.124 117.124 116.933 0.191 25685 1105 1 2 . 1 1 91 91 MET C C 91 177.504 177.504 178.308 -0.804 25685 1106 1 2 . 1 1 91 91 MET CA C 91 57.152 57.152 59.351 -2.199 25685 1107 1 2 . 1 1 91 91 MET CB C 91 32.510 32.510 32.192 0.318 25685 1108 1 2 . 1 1 91 91 MET H H 91 7.930 7.930 7.353 0.577 25685 1109 1 2 . 1 1 92 92 THR N N 92 108.478 108.478 116.212 -7.734 25685 1110 1 2 . 1 1 92 92 THR C C 92 176.367 176.367 176.422 -0.055 25685 1111 1 2 . 1 1 92 92 THR CA C 92 63.564 63.564 66.193 -2.629 25685 1112 1 2 . 1 1 92 92 THR H H 92 7.847 7.847 7.569 0.278 25685 1113 1 2 . 1 1 93 93 SER N N 93 117.950 117.950 116.258 1.692 25685 1114 1 2 . 1 1 93 93 SER C C 93 176.552 176.552 176.977 -0.425 25685 1115 1 2 . 1 1 93 93 SER CA C 93 60.821 60.821 60.916 -0.095 25685 1116 1 2 . 1 1 93 93 SER CB C 93 63.311 63.311 62.945 0.366 25685 1117 1 2 . 1 1 93 93 SER H H 93 7.732 7.732 8.127 -0.395 25685 1118 1 2 . 1 1 94 94 GLY N N 94 111.265 111.265 109.204 2.061 25685 1119 1 2 . 1 1 94 94 GLY C C 94 175.198 175.198 175.591 -0.393 25685 1120 1 2 . 1 1 94 94 GLY CA C 94 46.021 46.021 46.174 -0.153 25685 1121 1 2 . 1 1 94 94 GLY H H 94 8.419 8.419 7.927 0.492 25685 1122 1 2 . 1 1 95 95 LEU N N 95 121.019 121.019 118.032 2.987 25685 1123 1 2 . 1 1 95 95 LEU C C 95 177.810 177.810 177.016 0.794 25685 1124 1 2 . 1 1 95 95 LEU CA C 95 56.012 56.012 56.037 -0.025 25685 1125 1 2 . 1 1 95 95 LEU CB C 95 42.122 42.122 40.472 1.650 25685 1126 1 2 . 1 1 95 95 LEU H H 95 7.849 7.849 7.659 0.190 25685 1127 1 2 . 1 1 96 96 SER N N 96 115.465 115.465 114.352 1.113 25685 1128 1 2 . 1 1 96 96 SER C C 96 175.543 175.543 174.089 1.454 25685 1129 1 2 . 1 1 96 96 SER CA C 96 60.151 60.151 58.812 1.339 25685 1130 1 2 . 1 1 96 96 SER H H 96 8.349 8.349 7.370 0.979 25685 1131 1 2 . 1 1 97 97 TRP N N 97 121.711 121.711 121.623 0.088 25685 1132 1 2 . 1 1 97 97 TRP C C 97 176.973 176.973 175.866 1.107 25685 1133 1 2 . 1 1 97 97 TRP CA C 97 58.250 58.250 57.926 0.324 25685 1134 1 2 . 1 1 97 97 TRP CB C 97 28.899 28.899 28.754 0.145 25685 1135 1 2 . 1 1 97 97 TRP H H 97 7.723 7.723 8.215 -0.492 25685 1136 1 2 . 1 1 98 98 LYS N N 98 119.868 119.868 124.146 -4.278 25685 1137 1 2 . 1 1 98 98 LYS C C 98 178.021 178.021 177.393 0.628 25685 1138 1 2 . 1 1 98 98 LYS CA C 98 56.340 56.340 57.151 -0.811 25685 1139 1 2 . 1 1 98 98 LYS CB C 98 31.933 31.933 33.309 -1.376 25685 1140 1 2 . 1 1 98 98 LYS H H 98 7.855 7.855 8.300 -0.445 25685 1141 1 2 . 1 1 99 99 ILE N N 99 120.044 120.044 120.073 -0.029 25685 1142 1 2 . 1 1 99 99 ILE C C 99 176.769 176.769 175.380 1.389 25685 1143 1 2 . 1 1 99 99 ILE CA C 99 62.758 62.758 60.526 2.232 25685 1144 1 2 . 1 1 99 99 ILE CB C 99 37.809 37.809 38.631 -0.822 25685 1145 1 2 . 1 1 99 99 ILE H H 99 8.069 8.069 7.615 0.454 25685 1146 1 2 . 1 1 100 100 GLN C C 100 176.315 176.315 175.282 1.033 25685 1147 1 2 . 1 1 100 100 GLN CA C 100 57.486 57.486 56.777 0.709 25685 1148 1 2 . 1 1 101 101 THR N N 101 109.873 109.873 113.576 -3.703 25685 1149 1 2 . 1 1 101 101 THR C C 101 174.664 174.664 175.140 -0.476 25685 1150 1 2 . 1 1 101 101 THR CA C 101 61.709 61.709 63.918 -2.209 25685 1151 1 2 . 1 1 101 101 THR CB C 101 69.290 69.290 69.663 -0.373 25685 1152 1 2 . 1 1 101 101 THR H H 101 7.508 7.508 7.600 -0.092 25685 1153 1 2 . 1 1 102 102 LEU N N 102 124.434 124.434 130.416 -5.982 25685 1154 1 2 . 1 1 102 102 LEU C C 102 174.681 174.681 176.275 -1.594 25685 1155 1 2 . 1 1 102 102 LEU CA C 102 53.063 53.063 52.772 0.291 25685 1156 1 2 . 1 1 102 102 LEU CB C 102 41.139 41.139 42.833 -1.694 25685 1157 1 2 . 1 1 102 102 LEU H H 102 7.569 7.569 8.595 -1.026 25685 1158 1 2 . 1 1 103 103 PRO C C 103 178.076 178.076 177.921 0.155 25685 1159 1 2 . 1 1 103 103 PRO CA C 103 62.570 62.570 63.379 -0.809 25685 1160 1 2 . 1 1 103 103 PRO CB C 103 31.534 31.534 32.070 -0.536 25685 1161 1 2 . 1 1 104 104 SER N N 104 119.929 119.929 113.358 6.571 25685 1162 1 2 . 1 1 104 104 SER C C 104 176.432 176.432 175.516 0.916 25685 1163 1 2 . 1 1 104 104 SER CA C 104 61.976 61.976 59.854 2.122 25685 1164 1 2 . 1 1 104 104 SER CB C 104 63.611 63.611 62.957 0.654 25685 1165 1 2 . 1 1 104 104 SER H H 104 8.784 8.784 8.099 0.685 25685 1166 1 2 . 1 1 105 105 PHE N N 105 119.519 119.519 121.226 -1.707 25685 1167 1 2 . 1 1 105 105 PHE C C 105 176.852 176.852 174.982 1.870 25685 1168 1 2 . 1 1 105 105 PHE CA C 105 60.162 60.162 59.347 0.815 25685 1169 1 2 . 1 1 105 105 PHE CB C 105 38.455 38.455 39.480 -1.025 25685 1170 1 2 . 1 1 105 105 PHE H H 105 8.620 8.620 8.449 0.171 25685 1171 1 2 . 1 1 106 106 PHE N N 106 118.809 118.809 114.326 4.483 25685 1172 1 2 . 1 1 106 106 PHE C C 106 176.741 176.741 175.684 1.057 25685 1173 1 2 . 1 1 106 106 PHE CA C 106 61.421 61.421 56.820 4.601 25685 1174 1 2 . 1 1 106 106 PHE CB C 106 38.788 38.788 39.374 -0.586 25685 1175 1 2 . 1 1 106 106 PHE H H 106 7.519 7.519 7.794 -0.275 25685 1176 1 2 . 1 1 107 107 PHE N N 107 117.382 117.382 124.335 -6.953 25685 1177 1 2 . 1 1 107 107 PHE C C 107 177.771 177.771 176.559 1.212 25685 1178 1 2 . 1 1 107 107 PHE CA C 107 61.099 61.099 61.477 -0.378 25685 1179 1 2 . 1 1 107 107 PHE CB C 107 38.677 38.677 38.974 -0.297 25685 1180 1 2 . 1 1 107 107 PHE H H 107 7.903 7.903 8.186 -0.283 25685 1181 1 2 . 1 1 108 108 GLY N N 108 105.340 105.340 105.554 -0.214 25685 1182 1 2 . 1 1 108 108 GLY C C 108 174.574 174.574 175.778 -1.204 25685 1183 1 2 . 1 1 108 108 GLY CA C 108 47.508 47.508 46.920 0.588 25685 1184 1 2 . 1 1 108 108 GLY H H 108 8.351 8.351 8.706 -0.355 25685 1185 1 2 . 1 1 109 109 MET N N 109 119.831 119.831 121.315 -1.484 25685 1186 1 2 . 1 1 109 109 MET C C 109 177.522 177.522 177.888 -0.366 25685 1187 1 2 . 1 1 109 109 MET CA C 109 58.658 58.658 57.149 1.509 25685 1188 1 2 . 1 1 109 109 MET CB C 109 32.106 32.106 32.379 -0.273 25685 1189 1 2 . 1 1 109 109 MET H H 109 7.919 7.919 7.355 0.564 25685 1190 1 2 . 1 1 110 110 LEU N N 110 119.908 119.908 119.030 0.878 25685 1191 1 2 . 1 1 110 110 LEU C C 110 178.170 178.170 178.334 -0.164 25685 1192 1 2 . 1 1 110 110 LEU CA C 110 57.941 57.941 57.205 0.736 25685 1193 1 2 . 1 1 110 110 LEU CB C 110 41.055 41.055 40.884 0.171 25685 1194 1 2 . 1 1 110 110 LEU H H 110 7.744 7.744 8.362 -0.618 25685 1195 1 2 . 1 1 111 111 LEU N N 111 116.594 116.594 119.404 -2.810 25685 1196 1 2 . 1 1 111 111 LEU C C 111 178.960 178.960 177.793 1.167 25685 1197 1 2 . 1 1 111 111 LEU CA C 111 57.366 57.366 57.279 0.087 25685 1198 1 2 . 1 1 111 111 LEU CB C 111 40.259 40.259 41.340 -1.081 25685 1199 1 2 . 1 1 111 111 LEU H H 111 7.732 7.732 7.423 0.309 25685 1200 1 2 . 1 1 112 112 ALA N N 112 121.020 121.020 120.116 0.904 25685 1201 1 2 . 1 1 112 112 ALA C C 112 178.700 178.700 179.563 -0.863 25685 1202 1 2 . 1 1 112 112 ALA CA C 112 55.432 55.432 55.140 0.292 25685 1203 1 2 . 1 1 112 112 ALA CB C 112 18.214 18.214 18.218 -0.004 25685 1204 1 2 . 1 1 112 112 ALA H H 112 8.121 8.121 7.233 0.888 25685 1205 1 2 . 1 1 113 113 PHE N N 113 118.369 118.369 115.332 3.037 25685 1206 1 2 . 1 1 113 113 PHE C C 113 176.091 176.091 177.183 -1.092 25685 1207 1 2 . 1 1 113 113 PHE CA C 113 61.388 61.388 57.853 3.535 25685 1208 1 2 . 1 1 113 113 PHE CB C 113 39.688 39.688 37.442 2.246 25685 1209 1 2 . 1 1 113 113 PHE H H 113 8.237 8.237 7.097 1.140 25685 1210 1 2 . 1 1 114 114 LEU N N 114 114.214 114.214 120.396 -6.182 25685 1211 1 2 . 1 1 114 114 LEU C C 114 177.038 177.038 178.602 -1.564 25685 1212 1 2 . 1 1 114 114 LEU CA C 114 56.358 56.358 57.380 -1.022 25685 1213 1 2 . 1 1 114 114 LEU CB C 114 42.716 42.716 42.156 0.560 25685 1214 1 2 . 1 1 114 114 LEU H H 114 7.576 7.576 7.979 -0.403 25685 1215 1 2 . 1 1 115 115 TRP N N 115 112.667 112.667 116.888 -4.221 25685 1216 1 2 . 1 1 115 115 TRP C C 115 180.163 180.163 177.418 2.745 25685 1217 1 2 . 1 1 115 115 TRP CA C 115 55.930 55.930 58.365 -2.435 25685 1218 1 2 . 1 1 115 115 TRP H H 115 8.542 8.542 7.872 0.670 25685 1219 1 2 . 1 1 116 116 LEU N N 116 122.144 122.144 119.857 2.287 25685 1220 1 2 . 1 1 116 116 LEU C C 116 175.953 175.953 176.120 -0.167 25685 1221 1 2 . 1 1 116 116 LEU CA C 116 59.924 59.924 57.336 2.588 25685 1222 1 2 . 1 1 116 116 LEU CB C 116 39.097 39.097 39.074 0.023 25685 1223 1 2 . 1 1 116 116 LEU H H 116 8.996 8.996 7.157 1.839 25685 1224 1 2 . 1 1 117 117 PRO C C 117 174.220 174.220 177.307 -3.087 25685 1225 1 2 . 1 1 117 117 PRO CA C 117 66.300 66.300 64.052 2.248 25685 1226 1 2 . 1 1 118 118 ALA N N 118 110.603 110.603 118.922 -8.319 25685 1227 1 2 . 1 1 118 118 ALA C C 118 177.162 177.162 178.296 -1.134 25685 1228 1 2 . 1 1 118 118 ALA CA C 118 52.670 52.670 52.863 -0.193 25685 1229 1 2 . 1 1 118 118 ALA CB C 118 18.853 18.853 19.653 -0.800 25685 1230 1 2 . 1 1 118 118 ALA H H 118 6.633 6.633 7.587 -0.954 25685 1231 1 2 . 1 1 119 119 ILE N N 119 113.492 113.492 113.621 -0.129 25685 1232 1 2 . 1 1 119 119 ILE CA C 119 63.703 63.703 63.877 -0.174 25685 1233 1 2 . 1 1 119 119 ILE CB C 119 39.605 39.605 36.696 2.909 25685 1234 1 2 . 1 1 119 119 ILE H H 119 7.693 7.693 8.375 -0.682 25685 1235 1 2 . 1 1 121 121 PRO C C 121 178.089 178.089 179.088 -0.999 25685 1236 1 2 . 1 1 121 121 PRO CA C 121 66.004 66.004 65.721 0.283 25685 1237 1 2 . 1 1 122 122 PHE N N 122 113.797 113.797 119.846 -6.049 25685 1238 1 2 . 1 1 122 122 PHE C C 122 177.713 177.713 176.785 0.928 25685 1239 1 2 . 1 1 122 122 PHE CA C 122 61.566 61.566 60.905 0.661 25685 1240 1 2 . 1 1 122 122 PHE CB C 122 38.983 38.983 38.845 0.138 25685 1241 1 2 . 1 1 122 122 PHE H H 122 6.846 6.846 8.046 -1.200 25685 1242 1 2 . 1 1 123 123 ALA N N 123 121.512 121.512 120.971 0.541 25685 1243 1 2 . 1 1 123 123 ALA C C 123 179.318 179.318 179.680 -0.362 25685 1244 1 2 . 1 1 123 123 ALA CA C 123 54.975 54.975 55.200 -0.226 25685 1245 1 2 . 1 1 123 123 ALA CB C 123 17.881 17.881 17.871 0.010 25685 1246 1 2 . 1 1 123 123 ALA H H 123 8.411 8.411 8.577 -0.166 25685 1247 1 2 . 1 1 124 124 GLY N N 124 104.093 104.093 107.086 -2.993 25685 1248 1 2 . 1 1 124 124 GLY C C 124 175.410 175.410 176.169 -0.759 25685 1249 1 2 . 1 1 124 124 GLY CA C 124 47.370 47.370 46.690 0.680 25685 1250 1 2 . 1 1 124 124 GLY H H 124 8.455 8.455 7.872 0.583 25685 1251 1 2 . 1 1 125 125 ILE N N 125 121.895 121.895 122.932 -1.037 25685 1252 1 2 . 1 1 125 125 ILE C C 125 178.329 178.329 177.367 0.962 25685 1253 1 2 . 1 1 125 125 ILE CA C 125 64.412 64.412 63.907 0.505 25685 1254 1 2 . 1 1 125 125 ILE H H 125 7.954 7.954 8.096 -0.142 25685 1255 1 2 . 1 1 126 126 ALA N N 126 122.768 122.768 122.244 0.524 25685 1256 1 2 . 1 1 126 126 ALA C C 126 180.341 180.341 179.320 1.021 25685 1257 1 2 . 1 1 126 126 ALA CA C 126 55.266 55.266 55.569 -0.303 25685 1258 1 2 . 1 1 126 126 ALA CB C 126 18.226 18.226 17.848 0.378 25685 1259 1 2 . 1 1 126 126 ALA H H 126 8.142 8.142 7.598 0.544 25685 1260 1 2 . 1 1 127 127 ILE N N 127 116.752 116.752 118.579 -1.827 25685 1261 1 2 . 1 1 127 127 ILE C C 127 177.993 177.993 178.148 -0.155 25685 1262 1 2 . 1 1 127 127 ILE CA C 127 63.877 63.877 64.465 -0.588 25685 1263 1 2 . 1 1 127 127 ILE CB C 127 37.657 37.657 37.764 -0.107 25685 1264 1 2 . 1 1 127 127 ILE H H 127 8.335 8.335 7.463 0.872 25685 1265 1 2 . 1 1 128 128 SER N N 128 116.351 116.351 115.076 1.275 25685 1266 1 2 . 1 1 128 128 SER C C 128 175.796 175.796 176.494 -0.698 25685 1267 1 2 . 1 1 128 128 SER CA C 128 61.818 61.818 61.108 0.710 25685 1268 1 2 . 1 1 128 128 SER H H 128 7.939 7.939 7.446 0.493 25685 1269 1 2 . 1 1 129 129 GLN N N 129 118.082 118.082 120.987 -2.905 25685 1270 1 2 . 1 1 129 129 GLN C C 129 177.419 177.419 177.886 -0.467 25685 1271 1 2 . 1 1 129 129 GLN CA C 129 57.106 57.106 58.603 -1.497 25685 1272 1 2 . 1 1 129 129 GLN CB C 129 28.631 28.631 28.834 -0.202 25685 1273 1 2 . 1 1 129 129 GLN H H 129 7.943 7.943 8.020 -0.077 25685 1274 1 2 . 1 1 130 130 THR N N 130 113.484 113.484 113.821 -0.337 25685 1275 1 2 . 1 1 130 130 THR C C 130 175.627 175.627 175.293 0.334 25685 1276 1 2 . 1 1 130 130 THR CA C 130 63.758 63.758 66.056 -2.298 25685 1277 1 2 . 1 1 130 130 THR CB C 130 69.182 69.182 68.884 0.298 25685 1278 1 2 . 1 1 130 130 THR H H 130 7.686 7.686 7.565 0.121 25685 1279 1 2 . 1 1 131 131 LEU N N 131 121.347 121.347 115.539 5.808 25685 1280 1 2 . 1 1 131 131 LEU C C 131 177.522 177.522 177.170 0.352 25685 1281 1 2 . 1 1 131 131 LEU CA C 131 56.307 56.307 53.997 2.310 25685 1282 1 2 . 1 1 131 131 LEU CB C 131 41.711 41.711 43.103 -1.392 25685 1283 1 2 . 1 1 131 131 LEU H H 131 8.071 8.071 7.182 0.889 25685 1284 1 2 . 1 1 132 132 LEU N N 132 118.162 118.162 118.142 0.020 25685 1285 1 2 . 1 1 132 132 LEU C C 132 177.461 177.461 176.026 1.435 25685 1286 1 2 . 1 1 132 132 LEU CA C 132 55.264 55.264 57.041 -1.777 25685 1287 1 2 . 1 1 132 132 LEU CB C 132 41.613 41.613 41.626 -0.013 25685 1288 1 2 . 1 1 132 132 LEU H H 132 7.810 7.810 8.624 -0.814 25685 1289 1 2 . 1 1 133 133 SER N N 133 114.244 114.244 114.187 0.057 25685 1290 1 2 . 1 1 133 133 SER C C 133 174.363 174.363 173.556 0.807 25685 1291 1 2 . 1 1 133 133 SER CA C 133 59.019 59.019 57.839 1.180 25685 1292 1 2 . 1 1 133 133 SER CB C 133 64.634 64.634 66.301 -1.667 25685 1293 1 2 . 1 1 133 133 SER H H 133 7.829 7.829 8.097 -0.268 25685 1294 1 2 . 1 1 134 134 GLU N N 134 120.151 120.151 117.484 2.667 25685 1295 1 2 . 1 1 134 134 GLU C C 134 175.935 175.935 175.206 0.729 25685 1296 1 2 . 1 1 134 134 GLU CA C 134 56.301 56.301 57.178 -0.877 25685 1297 1 2 . 1 1 134 134 GLU CB C 134 30.129 30.129 30.919 -0.790 25685 1298 1 2 . 1 1 134 134 GLU H H 134 8.054 8.054 8.397 -0.343 25685 1299 1 2 . 1 1 135 135 ASN N N 135 118.890 118.890 119.335 -0.445 25685 1300 1 2 . 1 1 135 135 ASN C C 135 174.272 174.272 174.110 0.162 25685 1301 1 2 . 1 1 135 135 ASN CA C 135 51.390 51.390 52.903 -1.513 25685 1302 1 2 . 1 1 135 135 ASN CB C 135 39.129 39.129 36.045 3.084 25685 1303 1 2 . 1 1 135 135 ASN H H 135 8.305 8.305 8.236 0.069 25685 1304 1 2 . 1 1 136 136 PRO C C 136 177.960 177.960 178.380 -0.420 25685 1305 1 2 . 1 1 136 136 PRO CA C 136 64.530 64.530 65.155 -0.625 25685 1306 1 2 . 1 1 136 136 PRO CB C 136 31.809 31.809 31.742 0.067 25685 1307 1 2 . 1 1 137 137 LEU N N 137 117.735 117.735 115.899 1.836 25685 1308 1 2 . 1 1 137 137 LEU C C 137 179.217 179.217 178.950 0.267 25685 1309 1 2 . 1 1 137 137 LEU CA C 137 57.039 57.039 57.821 -0.782 25685 1310 1 2 . 1 1 137 137 LEU CB C 137 40.799 40.799 41.051 -0.252 25685 1311 1 2 . 1 1 137 137 LEU H H 137 8.248 8.248 8.044 0.204 25685 1312 1 2 . 1 1 138 138 VAL N N 138 119.589 119.589 119.209 0.380 25685 1313 1 2 . 1 1 138 138 VAL C C 138 177.894 177.894 177.523 0.371 25685 1314 1 2 . 1 1 138 138 VAL CA C 138 64.727 64.727 66.202 -1.475 25685 1315 1 2 . 1 1 138 138 VAL CB C 138 31.347 31.347 31.296 0.051 25685 1316 1 2 . 1 1 138 138 VAL H H 138 7.483 7.483 7.341 0.142 25685 1317 1 2 . 1 1 139 139 MET N N 139 119.431 119.431 119.813 -0.382 25685 1318 1 2 . 1 1 139 139 MET C C 139 177.988 177.988 178.217 -0.229 25685 1319 1 2 . 1 1 139 139 MET CA C 139 57.403 57.403 58.918 -1.515 25685 1320 1 2 . 1 1 139 139 MET CB C 139 31.709 31.709 32.857 -1.148 25685 1321 1 2 . 1 1 139 139 MET H H 139 7.837 7.837 8.029 -0.192 25685 1322 1 2 . 1 1 140 140 LEU N N 140 119.686 119.686 120.227 -0.541 25685 1323 1 2 . 1 1 140 140 LEU C C 140 177.916 177.916 179.041 -1.125 25685 1324 1 2 . 1 1 140 140 LEU CA C 140 56.877 56.877 58.449 -1.572 25685 1325 1 2 . 1 1 140 140 LEU CB C 140 41.491 41.491 40.848 0.643 25685 1326 1 2 . 1 1 140 140 LEU H H 140 7.926 7.926 8.783 -0.857 25685 1327 1 2 . 1 1 141 141 SER N N 141 114.167 114.167 115.388 -1.221 25685 1328 1 2 . 1 1 141 141 SER C C 141 176.030 176.030 177.274 -1.244 25685 1329 1 2 . 1 1 141 141 SER CA C 141 60.425 60.425 61.967 -1.542 25685 1330 1 2 . 1 1 141 141 SER CB C 141 63.956 63.956 63.071 0.885 25685 1331 1 2 . 1 1 141 141 SER H H 141 7.757 7.757 8.348 -0.591 25685 1332 1 2 . 1 1 142 142 TYR N N 142 121.679 121.679 121.476 0.203 25685 1333 1 2 . 1 1 142 142 TYR C C 142 177.659 177.659 178.612 -0.953 25685 1334 1 2 . 1 1 142 142 TYR CA C 142 59.673 59.673 59.777 -0.104 25685 1335 1 2 . 1 1 142 142 TYR CB C 142 38.079 38.079 37.904 0.175 25685 1336 1 2 . 1 1 142 142 TYR H H 142 7.965 7.965 9.169 -1.204 25685 1337 1 2 . 1 1 143 143 GLY N N 143 107.396 107.396 107.687 -0.291 25685 1338 1 2 . 1 1 143 143 GLY C C 143 174.877 174.877 176.055 -1.178 25685 1339 1 2 . 1 1 143 143 GLY CA C 143 46.343 46.343 47.222 -0.880 25685 1340 1 2 . 1 1 143 143 GLY H H 143 8.177 8.177 8.921 -0.744 25685 1341 1 2 . 1 1 144 144 LEU N N 144 120.477 120.477 123.102 -2.625 25685 1342 1 2 . 1 1 144 144 LEU C C 144 178.504 178.504 178.693 -0.189 25685 1343 1 2 . 1 1 144 144 LEU CA C 144 56.270 56.270 57.186 -0.916 25685 1344 1 2 . 1 1 144 144 LEU CB C 144 41.662 41.662 41.913 -0.251 25685 1345 1 2 . 1 1 144 144 LEU H H 144 8.055 8.055 7.549 0.506 25685 1346 1 2 . 1 1 145 145 GLY N N 145 106.847 106.847 106.494 0.353 25685 1347 1 2 . 1 1 145 145 GLY C C 145 175.375 175.375 176.174 -0.799 25685 1348 1 2 . 1 1 145 145 GLY CA C 145 45.582 45.582 46.859 -1.277 25685 1349 1 2 . 1 1 145 145 GLY H H 145 8.066 8.066 7.678 0.388 25685 1350 1 2 . 1 1 146 146 MET N N 146 120.376 120.376 121.610 -1.234 25685 1351 1 2 . 1 1 146 146 MET C C 146 176.663 176.663 178.177 -1.514 25685 1352 1 2 . 1 1 146 146 MET CA C 146 57.030 57.030 57.712 -0.682 25685 1353 1 2 . 1 1 146 146 MET CB C 146 30.720 30.720 32.407 -1.687 25685 1354 1 2 . 1 1 146 146 MET H H 146 8.157 8.157 8.029 0.128 25685 1355 1 2 . 1 1 147 147 ALA N N 147 123.038 123.038 121.164 1.874 25685 1356 1 2 . 1 1 147 147 ALA C C 147 178.917 178.917 179.484 -0.567 25685 1357 1 2 . 1 1 147 147 ALA CA C 147 54.201 54.201 55.307 -1.106 25685 1358 1 2 . 1 1 147 147 ALA CB C 147 18.810 18.810 18.245 0.565 25685 1359 1 2 . 1 1 147 147 ALA H H 147 8.336 8.336 8.667 -0.331 25685 1360 1 2 . 1 1 148 148 VAL N N 148 117.795 117.795 115.689 2.106 25685 1361 1 2 . 1 1 148 148 VAL C C 148 176.891 176.891 177.973 -1.082 25685 1362 1 2 . 1 1 148 148 VAL CA C 148 64.157 64.157 65.808 -1.651 25685 1363 1 2 . 1 1 148 148 VAL CB C 148 31.529 31.529 31.348 0.181 25685 1364 1 2 . 1 1 148 148 VAL H H 148 7.908 7.908 7.376 0.532 25685 1365 1 2 . 1 1 149 149 THR N N 149 116.069 116.069 114.737 1.332 25685 1366 1 2 . 1 1 149 149 THR C C 149 176.054 176.054 176.622 -0.568 25685 1367 1 2 . 1 1 149 149 THR CA C 149 63.308 63.308 65.878 -2.570 25685 1368 1 2 . 1 1 149 149 THR H H 149 7.414 7.414 7.432 -0.018 25685 1369 1 2 . 1 1 150 150 ILE N N 150 121.971 121.971 121.736 0.235 25685 1370 1 2 . 1 1 150 150 ILE C C 150 177.715 177.715 176.472 1.243 25685 1371 1 2 . 1 1 150 150 ILE CA C 150 64.319 64.319 64.412 -0.093 25685 1372 1 2 . 1 1 150 150 ILE CB C 150 36.628 36.628 37.737 -1.109 25685 1373 1 2 . 1 1 150 150 ILE H H 150 8.772 8.772 8.230 0.542 25685 1374 1 2 . 1 1 151 151 ALA N N 151 122.272 122.272 121.012 1.260 25685 1375 1 2 . 1 1 151 151 ALA C C 151 180.370 180.370 179.296 1.074 25685 1376 1 2 . 1 1 151 151 ALA CA C 151 55.336 55.336 55.211 0.125 25685 1377 1 2 . 1 1 151 151 ALA CB C 151 18.107 18.107 17.842 0.265 25685 1378 1 2 . 1 1 151 151 ALA H H 151 8.163 8.163 7.777 0.386 25685 1379 1 2 . 1 1 152 152 ALA N N 152 120.648 120.648 121.114 -0.466 25685 1380 1 2 . 1 1 152 152 ALA C C 152 181.019 181.019 180.157 0.862 25685 1381 1 2 . 1 1 152 152 ALA CA C 152 54.944 54.944 54.692 0.252 25685 1382 1 2 . 1 1 152 152 ALA CB C 152 18.963 18.963 18.444 0.519 25685 1383 1 2 . 1 1 152 152 ALA H H 152 7.877 7.877 7.738 0.139 25685 1384 1 2 . 1 1 153 153 VAL N N 153 119.372 119.372 119.744 -0.372 25685 1385 1 2 . 1 1 153 153 VAL C C 153 178.197 178.197 177.855 0.342 25685 1386 1 2 . 1 1 153 153 VAL CA C 153 66.289 66.289 65.927 0.362 25685 1387 1 2 . 1 1 153 153 VAL CB C 153 30.770 30.770 32.007 -1.236 25685 1388 1 2 . 1 1 153 153 VAL H H 153 8.118 8.118 7.630 0.488 25685 1389 1 2 . 1 1 154 154 PHE N N 154 120.362 120.362 119.749 0.613 25685 1390 1 2 . 1 1 154 154 PHE C C 154 177.733 177.733 177.209 0.524 25685 1391 1 2 . 1 1 154 154 PHE CA C 154 61.412 61.412 61.401 0.011 25685 1392 1 2 . 1 1 154 154 PHE CB C 154 38.465 38.465 38.779 -0.314 25685 1393 1 2 . 1 1 154 154 PHE H H 154 8.508 8.508 8.657 -0.149 25685 1394 1 2 . 1 1 155 155 LYS N N 155 118.894 118.894 119.015 -0.121 25685 1395 1 2 . 1 1 155 155 LYS C C 155 179.940 179.940 178.296 1.644 25685 1396 1 2 . 1 1 155 155 LYS CA C 155 58.969 58.969 59.040 -0.071 25685 1397 1 2 . 1 1 155 155 LYS CB C 155 31.725 31.725 32.161 -0.436 25685 1398 1 2 . 1 1 155 155 LYS H H 155 8.035 8.035 7.777 0.258 25685 1399 1 2 . 1 1 156 156 MET N N 156 118.853 118.853 116.755 2.098 25685 1400 1 2 . 1 1 156 156 MET C C 156 179.245 179.245 177.657 1.588 25685 1401 1 2 . 1 1 156 156 MET CA C 156 58.518 58.518 58.045 0.472 25685 1402 1 2 . 1 1 156 156 MET CB C 156 31.912 31.912 30.999 0.913 25685 1403 1 2 . 1 1 156 156 MET H H 156 8.014 8.014 7.633 0.381 25685 1404 1 2 . 1 1 157 157 GLY N N 157 108.239 108.239 106.041 2.198 25685 1405 1 2 . 1 1 157 157 GLY C C 157 174.637 174.637 174.565 0.072 25685 1406 1 2 . 1 1 157 157 GLY CA C 157 47.204 47.204 46.167 1.037 25685 1407 1 2 . 1 1 157 157 GLY H H 157 8.614 8.614 7.623 0.991 25685 1408 1 2 . 1 1 158 158 GLU N N 158 122.902 122.902 118.060 4.842 25685 1409 1 2 . 1 1 158 158 GLU C C 158 177.851 177.851 176.743 1.108 25685 1410 1 2 . 1 1 158 158 GLU CA C 158 60.203 60.203 56.497 3.706 25685 1411 1 2 . 1 1 158 158 GLU CB C 158 28.870 28.870 31.028 -2.158 25685 1412 1 2 . 1 1 158 158 GLU H H 158 8.550 8.550 7.708 0.842 25685 1413 1 2 . 1 1 159 159 LYS N N 159 117.932 117.932 116.425 1.507 25685 1414 1 2 . 1 1 159 159 LYS C C 159 179.529 179.529 175.645 3.884 25685 1415 1 2 . 1 1 159 159 LYS CA C 159 59.419 59.419 56.271 3.148 25685 1416 1 2 . 1 1 159 159 LYS CB C 159 31.759 31.759 35.845 -4.086 25685 1417 1 2 . 1 1 159 159 LYS H H 159 7.641 7.641 8.515 -0.875 25685 1418 1 2 . 1 1 160 160 PHE N N 160 120.614 120.614 117.129 3.485 25685 1419 1 2 . 1 1 160 160 PHE C C 160 178.511 178.511 174.857 3.654 25685 1420 1 2 . 1 1 160 160 PHE CA C 160 61.580 61.580 59.400 2.180 25685 1421 1 2 . 1 1 160 160 PHE CB C 160 39.909 39.909 37.644 2.265 25685 1422 1 2 . 1 1 160 160 PHE H H 160 8.026 8.026 7.970 0.056 25685 1423 1 2 . 1 1 161 161 VAL N N 161 119.870 119.870 119.928 -0.058 25685 1424 1 2 . 1 1 161 161 VAL C C 161 177.347 177.347 176.400 0.947 25685 1425 1 2 . 1 1 161 161 VAL CA C 161 66.121 66.121 64.267 1.854 25685 1426 1 2 . 1 1 161 161 VAL CB C 161 30.935 30.935 32.607 -1.672 25685 1427 1 2 . 1 1 161 161 VAL H H 161 8.628 8.628 8.392 0.236 25685 1428 1 2 . 1 1 162 162 LYS N N 162 116.237 116.237 116.800 -0.563 25685 1429 1 2 . 1 1 162 162 LYS C C 162 179.197 179.197 174.371 4.826 25685 1430 1 2 . 1 1 162 162 LYS CA C 162 60.037 60.037 56.785 3.252 25685 1431 1 2 . 1 1 162 162 LYS CB C 162 31.333 31.333 33.355 -2.022 25685 1432 1 2 . 1 1 162 162 LYS H H 162 7.843 7.843 7.822 0.021 25685 1433 1 2 . 1 1 163 163 ALA N N 163 119.197 119.197 122.078 -2.881 25685 1434 1 2 . 1 1 163 163 ALA C C 163 178.635 178.635 175.355 3.280 25685 1435 1 2 . 1 1 163 163 ALA CA C 163 53.681 53.681 52.026 1.655 25685 1436 1 2 . 1 1 163 163 ALA CB C 163 19.586 19.586 18.769 0.817 25685 1437 1 2 . 1 1 163 163 ALA H H 163 7.630 7.630 7.905 -0.275 25685 1438 1 2 . 1 1 164 164 ASN N N 164 115.956 115.956 117.939 -1.983 25685 1439 1 2 . 1 1 164 164 ASN C C 164 175.556 175.556 176.139 -0.583 25685 1440 1 2 . 1 1 164 164 ASN CA C 164 52.267 52.267 52.047 0.219 25685 1441 1 2 . 1 1 164 164 ASN CB C 164 39.148 39.148 38.720 0.428 25685 1442 1 2 . 1 1 164 164 ASN H H 164 7.326 7.326 8.030 -0.704 25685 1443 1 2 . 1 1 165 165 PHE N N 165 121.612 121.612 123.362 -1.750 25685 1444 1 2 . 1 1 165 165 PHE C C 165 177.069 177.069 176.982 0.087 25685 1445 1 2 . 1 1 165 165 PHE CA C 165 62.921 62.921 61.428 1.493 25685 1446 1 2 . 1 1 165 165 PHE CB C 165 39.427 39.427 39.249 0.177 25685 1447 1 2 . 1 1 165 165 PHE H H 165 7.408 7.408 8.946 -1.538 25685 1448 1 2 . 1 1 166 166 GLN N N 166 117.147 117.147 116.934 0.213 25685 1449 1 2 . 1 1 166 166 GLN C C 166 178.922 178.922 178.603 0.319 25685 1450 1 2 . 1 1 166 166 GLN CA C 166 59.262 59.262 58.489 0.773 25685 1451 1 2 . 1 1 166 166 GLN CB C 166 26.811 26.811 27.781 -0.970 25685 1452 1 2 . 1 1 166 166 GLN H H 166 8.605 8.605 8.815 -0.210 25685 1453 1 2 . 1 1 167 167 LEU N N 167 121.946 121.946 118.628 3.318 25685 1454 1 2 . 1 1 167 167 LEU C C 167 178.863 178.863 178.999 -0.136 25685 1455 1 2 . 1 1 167 167 LEU CA C 167 58.039 58.039 57.301 0.738 25685 1456 1 2 . 1 1 167 167 LEU CB C 167 41.130 41.130 41.161 -0.031 25685 1457 1 2 . 1 1 167 167 LEU H H 167 7.892 7.892 7.661 0.231 25685 1458 1 2 . 1 1 168 168 ILE N N 168 118.751 118.751 116.684 2.067 25685 1459 1 2 . 1 1 168 168 ILE C C 168 179.908 179.908 179.010 0.898 25685 1460 1 2 . 1 1 168 168 ILE CA C 168 63.886 63.886 62.922 0.964 25685 1461 1 2 . 1 1 168 168 ILE CB C 168 36.170 36.170 36.592 -0.422 25685 1462 1 2 . 1 1 168 168 ILE H H 168 8.065 8.065 7.582 0.483 25685 1463 1 2 . 1 1 169 169 ARG N N 169 125.851 125.851 118.429 7.422 25685 1464 1 2 . 1 1 169 169 ARG C C 169 177.579 177.579 178.070 -0.491 25685 1465 1 2 . 1 1 169 169 ARG CA C 169 60.306 60.306 59.564 0.742 25685 1466 1 2 . 1 1 169 169 ARG CB C 169 29.224 29.224 29.870 -0.646 25685 1467 1 2 . 1 1 169 169 ARG H H 169 8.995 8.995 7.820 1.175 25685 1468 1 2 . 1 1 170 170 LYS N N 170 119.586 119.586 119.120 0.466 25685 1469 1 2 . 1 1 170 170 LYS C C 170 178.584 178.584 178.242 0.342 25685 1470 1 2 . 1 1 170 170 LYS CA C 170 60.293 60.293 59.434 0.859 25685 1471 1 2 . 1 1 170 170 LYS CB C 170 32.530 32.530 31.744 0.786 25685 1472 1 2 . 1 1 170 170 LYS H H 170 7.663 7.663 7.624 0.039 25685 1473 1 2 . 1 1 171 171 VAL N N 171 118.348 118.348 119.696 -1.348 25685 1474 1 2 . 1 1 171 171 VAL C C 171 177.478 177.478 177.337 0.141 25685 1475 1 2 . 1 1 171 171 VAL CA C 171 66.641 66.641 66.529 0.111 25685 1476 1 2 . 1 1 171 171 VAL CB C 171 31.565 31.565 31.798 -0.233 25685 1477 1 2 . 1 1 171 171 VAL H H 171 8.515 8.515 7.870 0.645 25685 1478 1 2 . 1 1 172 172 THR N N 172 115.172 115.172 113.792 1.380 25685 1479 1 2 . 1 1 172 172 THR C C 172 176.320 176.320 176.736 -0.416 25685 1480 1 2 . 1 1 172 172 THR H H 172 8.416 8.416 7.657 0.759 25685 1481 1 2 . 1 1 173 173 GLY N N 173 108.801 108.801 109.405 -0.604 25685 1482 1 2 . 1 1 173 173 GLY C C 173 174.138 174.138 175.167 -1.029 25685 1483 1 2 . 1 1 173 173 GLY CA C 173 47.769 47.769 46.752 1.017 25685 1484 1 2 . 1 1 173 173 GLY H H 173 8.505 8.505 7.659 0.846 25685 1485 1 2 . 1 1 174 174 ALA N N 174 123.573 123.573 124.394 -0.821 25685 1486 1 2 . 1 1 174 174 ALA C C 174 178.782 178.782 178.972 -0.190 25685 1487 1 2 . 1 1 174 174 ALA CA C 174 55.604 55.604 54.622 0.982 25685 1488 1 2 . 1 1 174 174 ALA CB C 174 18.778 18.778 18.593 0.185 25685 1489 1 2 . 1 1 174 174 ALA H H 174 8.038 8.038 7.742 0.296 25685 1490 1 2 . 1 1 175 175 ILE N N 175 118.501 118.501 119.143 -0.642 25685 1491 1 2 . 1 1 175 175 ILE C C 175 178.247 178.247 177.801 0.446 25685 1492 1 2 . 1 1 175 175 ILE CA C 175 65.412 65.412 64.027 1.385 25685 1493 1 2 . 1 1 175 175 ILE CB C 175 37.671 37.671 38.444 -0.773 25685 1494 1 2 . 1 1 175 175 ILE H H 175 7.897 7.897 7.480 0.417 25685 1495 1 2 . 1 1 176 176 VAL N N 176 120.104 120.104 117.456 2.648 25685 1496 1 2 . 1 1 176 176 VAL C C 176 177.945 177.945 177.800 0.145 25685 1497 1 2 . 1 1 176 176 VAL CA C 176 67.761 67.761 66.020 1.741 25685 1498 1 2 . 1 1 176 176 VAL CB C 176 30.662 30.662 31.485 -0.823 25685 1499 1 2 . 1 1 176 176 VAL H H 176 8.321 8.321 7.776 0.545 25685 1500 1 2 . 1 1 177 177 LEU N N 177 118.561 118.561 118.245 0.316 25685 1501 1 2 . 1 1 177 177 LEU C C 177 178.563 178.563 178.572 -0.009 25685 1502 1 2 . 1 1 177 177 LEU CA C 177 58.094 58.094 57.402 0.692 25685 1503 1 2 . 1 1 177 177 LEU CB C 177 41.061 41.061 40.365 0.696 25685 1504 1 2 . 1 1 177 177 LEU H H 177 8.097 8.097 7.108 0.989 25685 1505 1 2 . 1 1 178 178 LEU N N 178 120.868 120.868 120.072 0.796 25685 1506 1 2 . 1 1 178 178 LEU C C 178 178.524 178.524 178.476 0.048 25685 1507 1 2 . 1 1 178 178 LEU CA C 178 57.767 57.767 58.295 -0.528 25685 1508 1 2 . 1 1 178 178 LEU CB C 178 40.886 40.886 41.849 -0.963 25685 1509 1 2 . 1 1 178 178 LEU H H 178 8.229 8.229 7.590 0.639 25685 1510 1 2 . 1 1 179 179 TYR N N 179 119.355 119.355 118.606 0.749 25685 1511 1 2 . 1 1 179 179 TYR C C 179 180.059 180.059 177.198 2.861 25685 1512 1 2 . 1 1 179 179 TYR CA C 179 63.844 63.844 60.603 3.241 25685 1513 1 2 . 1 1 179 179 TYR CB C 179 39.508 39.508 38.053 1.455 25685 1514 1 2 . 1 1 179 179 TYR H H 179 8.759 8.759 7.879 0.880 25685 1515 1 2 . 1 1 180 180 LEU N N 180 118.984 118.984 119.121 -0.137 25685 1516 1 2 . 1 1 180 180 LEU C C 180 179.079 179.079 179.344 -0.265 25685 1517 1 2 . 1 1 180 180 LEU CA C 180 58.879 58.879 57.410 1.469 25685 1518 1 2 . 1 1 180 180 LEU CB C 180 41.899 41.899 40.676 1.223 25685 1519 1 2 . 1 1 180 180 LEU H H 180 8.315 8.315 7.691 0.624 25685 1520 1 2 . 1 1 181 181 ALA N N 181 121.826 121.826 122.254 -0.428 25685 1521 1 2 . 1 1 181 181 ALA C C 181 180.009 180.009 179.367 0.642 25685 1522 1 2 . 1 1 181 181 ALA CA C 181 55.700 55.700 55.027 0.673 25685 1523 1 2 . 1 1 181 181 ALA CB C 181 17.713 17.713 18.565 -0.852 25685 1524 1 2 . 1 1 181 181 ALA H H 181 8.480 8.480 8.441 0.039 25685 1525 1 2 . 1 1 182 182 TYR N N 182 118.039 118.039 117.748 0.291 25685 1526 1 2 . 1 1 182 182 TYR CA C 182 59.038 59.038 61.499 -2.461 25685 1527 1 2 . 1 1 182 182 TYR H H 182 8.856 8.856 8.008 0.848 25685 1528 1 2 . 1 1 183 183 PHE N N 183 124.769 124.769 117.312 7.457 25685 1529 1 2 . 1 1 183 183 PHE CA C 183 63.566 63.566 59.756 3.810 25685 1530 1 2 . 1 1 183 183 PHE H H 183 9.764 9.764 7.678 2.086 25685 1531 1 3 . 1 1 4 4 ALA N N 4 121.533 121.533 122.878 -1.345 25685 1532 1 3 . 1 1 4 4 ALA C C 4 177.632 177.632 179.259 -1.627 25685 1533 1 3 . 1 1 4 4 ALA CA C 4 55.117 55.117 55.152 -0.035 25685 1534 1 3 . 1 1 4 4 ALA CB C 4 18.448 18.448 17.754 0.694 25685 1535 1 3 . 1 1 4 4 ALA H H 4 7.977 7.977 8.303 -0.326 25685 1536 1 3 . 1 1 5 5 PHE N N 5 119.988 119.988 119.088 0.900 25685 1537 1 3 . 1 1 5 5 PHE CA C 5 60.759 60.759 61.081 -0.323 25685 1538 1 3 . 1 1 5 5 PHE CB C 5 39.221 39.221 38.948 0.273 25685 1539 1 3 . 1 1 5 5 PHE H H 5 8.210 8.210 7.865 0.345 25685 1540 1 3 . 1 1 6 6 ALA C C 6 179.794 179.794 179.262 0.532 25685 1541 1 3 . 1 1 6 6 ALA CA C 6 55.619 55.619 54.981 0.638 25685 1542 1 3 . 1 1 6 6 ALA CB C 6 17.911 17.911 18.165 -0.254 25685 1543 1 3 . 1 1 6 6 ALA H H 6 8.417 8.417 7.888 0.529 25685 1544 1 3 . 1 1 7 7 LEU N N 7 115.852 115.852 119.203 -3.351 25685 1545 1 3 . 1 1 7 7 LEU C C 7 180.196 180.196 178.801 1.395 25685 1546 1 3 . 1 1 7 7 LEU CA C 7 57.528 57.528 57.559 -0.031 25685 1547 1 3 . 1 1 7 7 LEU CB C 7 40.060 40.060 41.829 -1.769 25685 1548 1 3 . 1 1 7 7 LEU H H 7 8.741 8.741 7.971 0.770 25685 1549 1 3 . 1 1 8 8 GLY N N 8 110.199 110.199 107.052 3.147 25685 1550 1 3 . 1 1 8 8 GLY C C 8 176.430 176.430 175.928 0.502 25685 1551 1 3 . 1 1 8 8 GLY CA C 8 46.960 46.960 47.289 -0.329 25685 1552 1 3 . 1 1 8 8 GLY H H 8 8.179 8.179 7.911 0.268 25685 1553 1 3 . 1 1 9 9 ILE N N 9 122.346 122.346 122.523 -0.177 25685 1554 1 3 . 1 1 9 9 ILE C C 9 178.143 178.143 176.960 1.183 25685 1555 1 3 . 1 1 9 9 ILE CA C 9 65.048 65.048 62.405 2.643 25685 1556 1 3 . 1 1 9 9 ILE CB C 9 36.841 36.841 37.833 -0.992 25685 1557 1 3 . 1 1 9 9 ILE H H 9 7.788 7.788 7.519 0.269 25685 1558 1 3 . 1 1 10 10 LEU N N 10 117.560 117.560 119.586 -2.026 25685 1559 1 3 . 1 1 10 10 LEU C C 10 179.501 179.501 178.478 1.023 25685 1560 1 3 . 1 1 10 10 LEU CA C 10 58.068 58.068 58.449 -0.381 25685 1561 1 3 . 1 1 10 10 LEU CB C 10 40.776 40.776 41.242 -0.466 25685 1562 1 3 . 1 1 10 10 LEU H H 10 8.044 8.044 7.530 0.514 25685 1563 1 3 . 1 1 11 11 SER N N 11 113.830 113.830 112.824 1.006 25685 1564 1 3 . 1 1 11 11 SER CA C 11 61.769 61.769 60.942 0.827 25685 1565 1 3 . 1 1 11 11 SER CB C 11 63.395 63.395 63.227 0.168 25685 1566 1 3 . 1 1 11 11 SER H H 11 8.140 8.140 7.523 0.617 25685 1567 1 3 . 1 1 12 12 VAL N N 12 121.343 121.343 120.597 0.746 25685 1568 1 3 . 1 1 12 12 VAL C C 12 176.753 176.753 177.068 -0.315 25685 1569 1 3 . 1 1 12 12 VAL CA C 12 64.583 64.583 65.404 -0.821 25685 1570 1 3 . 1 1 12 12 VAL CB C 12 31.067 31.067 31.800 -0.733 25685 1571 1 3 . 1 1 12 12 VAL H H 12 7.587 7.587 7.205 0.382 25685 1572 1 3 . 1 1 13 13 PHE N N 13 115.225 115.225 119.533 -4.308 25685 1573 1 3 . 1 1 13 13 PHE C C 13 177.349 177.349 175.354 1.995 25685 1574 1 3 . 1 1 13 13 PHE CA C 13 58.730 58.730 60.681 -1.951 25685 1575 1 3 . 1 1 13 13 PHE CB C 13 39.785 39.785 39.325 0.460 25685 1576 1 3 . 1 1 13 13 PHE H H 13 7.474 7.474 7.704 -0.230 25685 1577 1 3 . 1 1 14 14 SER N N 14 116.075 116.075 116.932 -0.857 25685 1578 1 3 . 1 1 14 14 SER H H 14 7.955 7.955 7.997 -0.042 25685 1579 1 3 . 1 1 15 15 PRO C C 15 177.590 177.590 175.953 1.637 25685 1580 1 3 . 1 1 15 15 PRO CA C 15 65.464 65.464 63.212 2.252 25685 1581 1 3 . 1 1 16 16 ALA N N 16 116.288 116.288 119.136 -2.848 25685 1582 1 3 . 1 1 16 16 ALA C C 16 177.563 177.563 176.699 0.864 25685 1583 1 3 . 1 1 16 16 ALA CA C 16 53.010 53.010 51.590 1.420 25685 1584 1 3 . 1 1 16 16 ALA CB C 16 19.975 19.975 19.729 0.246 25685 1585 1 3 . 1 1 16 16 ALA H H 16 7.455 7.455 7.844 -0.389 25685 1586 1 3 . 1 1 17 17 VAL N N 17 112.072 112.072 118.541 -6.469 25685 1587 1 3 . 1 1 17 17 VAL CA C 17 63.117 63.117 63.591 -0.474 25685 1588 1 3 . 1 1 17 17 VAL CB C 17 33.209 33.209 32.212 0.997 25685 1589 1 3 . 1 1 17 17 VAL H H 17 7.525 7.525 8.525 -1.000 25685 1590 1 3 . 1 1 18 18 LEU N N 18 121.205 121.205 122.471 -1.266 25685 1591 1 3 . 1 1 18 18 LEU CA C 18 58.971 58.971 57.734 1.237 25685 1592 1 3 . 1 1 18 18 LEU CB C 18 41.161 41.161 40.155 1.006 25685 1593 1 3 . 1 1 18 18 LEU H H 18 8.191 8.191 8.301 -0.110 25685 1594 1 3 . 1 1 19 19 PRO C C 19 177.697 177.697 176.776 0.921 25685 1595 1 3 . 1 1 19 19 PRO CA C 19 65.181 65.181 64.204 0.977 25685 1596 1 3 . 1 1 20 20 VAL N N 20 111.723 111.723 112.710 -0.987 25685 1597 1 3 . 1 1 20 20 VAL C C 20 177.137 177.137 175.255 1.882 25685 1598 1 3 . 1 1 20 20 VAL CA C 20 62.494 62.494 62.254 0.240 25685 1599 1 3 . 1 1 20 20 VAL CB C 20 31.677 31.677 29.675 2.002 25685 1600 1 3 . 1 1 20 20 VAL H H 20 7.571 7.571 7.827 -0.256 25685 1601 1 3 . 1 1 21 21 VAL N N 21 121.705 121.705 114.233 7.472 25685 1602 1 3 . 1 1 21 21 VAL CA C 21 68.305 68.305 61.180 7.125 25685 1603 1 3 . 1 1 21 21 VAL H H 21 7.732 7.732 7.641 0.091 25685 1604 1 3 . 1 1 24 24 ILE C C 24 174.359 174.359 175.158 -0.799 25685 1605 1 3 . 1 1 25 25 PHE N N 25 120.132 120.132 120.612 -0.480 25685 1606 1 3 . 1 1 25 25 PHE C C 25 175.945 175.945 174.530 1.415 25685 1607 1 3 . 1 1 25 25 PHE CA C 25 60.544 60.544 58.616 1.928 25685 1608 1 3 . 1 1 25 25 PHE H H 25 8.082 8.082 8.087 -0.005 25685 1609 1 3 . 1 1 26 26 ALA N N 26 121.341 121.341 122.718 -1.377 25685 1610 1 3 . 1 1 26 26 ALA CB C 26 19.784 19.784 21.203 -1.419 25685 1611 1 3 . 1 1 26 26 ALA H H 26 7.539 7.539 7.807 -0.268 25685 1612 1 3 . 1 1 27 27 GLY N N 27 107.530 107.530 107.582 -0.052 25685 1613 1 3 . 1 1 27 27 GLY C C 27 174.252 174.252 172.922 1.330 25685 1614 1 3 . 1 1 27 27 GLY CA C 27 45.474 45.474 44.934 0.540 25685 1615 1 3 . 1 1 27 27 GLY H H 27 7.997 7.997 8.603 -0.606 25685 1616 1 3 . 1 1 28 28 SER N N 28 116.299 116.299 115.099 1.200 25685 1617 1 3 . 1 1 28 28 SER C C 28 175.759 175.759 173.161 2.598 25685 1618 1 3 . 1 1 28 28 SER CA C 28 58.526 58.526 57.723 0.803 25685 1619 1 3 . 1 1 28 28 SER CB C 28 64.373 64.373 64.975 -0.602 25685 1620 1 3 . 1 1 28 28 SER H H 28 8.115 8.115 8.352 -0.237 25685 1621 1 3 . 1 1 34 34 ASP C C 34 177.621 177.621 178.047 -0.426 25685 1622 1 3 . 1 1 34 34 ASP CA C 34 57.082 57.082 57.255 -0.173 25685 1623 1 3 . 1 1 35 35 ALA N N 35 120.662 120.662 121.671 -1.009 25685 1624 1 3 . 1 1 35 35 ALA C C 35 179.168 179.168 179.351 -0.183 25685 1625 1 3 . 1 1 35 35 ALA CA C 35 55.459 55.459 54.716 0.743 25685 1626 1 3 . 1 1 35 35 ALA CB C 35 18.819 18.819 18.161 0.658 25685 1627 1 3 . 1 1 35 35 ALA H H 35 8.090 8.090 7.377 0.713 25685 1628 1 3 . 1 1 36 36 PHE N N 36 117.638 117.638 119.819 -2.181 25685 1629 1 3 . 1 1 36 36 PHE C C 36 177.057 177.057 177.139 -0.082 25685 1630 1 3 . 1 1 36 36 PHE CA C 36 61.472 61.472 61.538 -0.066 25685 1631 1 3 . 1 1 36 36 PHE CB C 36 38.860 38.860 39.372 -0.512 25685 1632 1 3 . 1 1 36 36 PHE H H 36 8.227 8.227 7.916 0.311 25685 1633 1 3 . 1 1 37 37 LEU N N 37 119.312 119.312 118.054 1.258 25685 1634 1 3 . 1 1 37 37 LEU C C 37 179.798 179.798 178.762 1.036 25685 1635 1 3 . 1 1 37 37 LEU CA C 37 58.181 58.181 58.212 -0.030 25685 1636 1 3 . 1 1 37 37 LEU CB C 37 40.835 40.835 41.016 -0.181 25685 1637 1 3 . 1 1 37 37 LEU H H 37 8.588 8.588 7.557 1.031 25685 1638 1 3 . 1 1 38 38 ILE N N 38 119.057 119.057 118.808 0.249 25685 1639 1 3 . 1 1 38 38 ILE C C 38 177.597 177.597 177.724 -0.127 25685 1640 1 3 . 1 1 38 38 ILE CA C 38 64.827 64.827 65.276 -0.449 25685 1641 1 3 . 1 1 38 38 ILE CB C 38 36.321 36.321 37.697 -1.376 25685 1642 1 3 . 1 1 38 38 ILE H H 38 7.932 7.932 7.394 0.538 25685 1643 1 3 . 1 1 39 39 VAL N N 39 118.758 118.758 117.240 1.518 25685 1644 1 3 . 1 1 39 39 VAL C C 39 179.533 179.533 177.282 2.251 25685 1645 1 3 . 1 1 39 39 VAL CA C 39 66.687 66.687 65.992 0.695 25685 1646 1 3 . 1 1 39 39 VAL CB C 39 30.598 30.598 31.307 -0.709 25685 1647 1 3 . 1 1 39 39 VAL H H 39 7.922 7.922 7.358 0.564 25685 1648 1 3 . 1 1 40 40 ALA N N 40 125.385 125.385 122.311 3.074 25685 1649 1 3 . 1 1 40 40 ALA C C 40 179.200 179.200 179.510 -0.310 25685 1650 1 3 . 1 1 40 40 ALA CA C 40 55.283 55.283 54.772 0.511 25685 1651 1 3 . 1 1 40 40 ALA CB C 40 17.197 17.197 18.350 -1.153 25685 1652 1 3 . 1 1 40 40 ALA H H 40 9.091 9.091 7.345 1.746 25685 1653 1 3 . 1 1 41 41 GLY N N 41 106.978 106.978 107.085 -0.107 25685 1654 1 3 . 1 1 41 41 GLY C C 41 176.171 176.171 176.002 0.169 25685 1655 1 3 . 1 1 41 41 GLY CA C 41 47.322 47.322 47.009 0.313 25685 1656 1 3 . 1 1 41 41 GLY H H 41 8.565 8.565 7.658 0.907 25685 1657 1 3 . 1 1 42 42 LEU N N 42 126.914 126.914 119.610 7.304 25685 1658 1 3 . 1 1 42 42 LEU C C 42 178.119 178.119 178.430 -0.311 25685 1659 1 3 . 1 1 42 42 LEU CA C 42 58.523 58.523 57.897 0.626 25685 1660 1 3 . 1 1 42 42 LEU CB C 42 42.125 42.125 41.449 0.676 25685 1661 1 3 . 1 1 42 42 LEU H H 42 8.573 8.573 7.521 1.052 25685 1662 1 3 . 1 1 46 46 MET N N 46 121.710 121.710 120.806 0.904 25685 1663 1 3 . 1 1 46 46 MET C C 46 179.540 179.540 178.843 0.697 25685 1664 1 3 . 1 1 46 46 MET CA C 46 55.968 55.968 57.911 -1.943 25685 1665 1 3 . 1 1 46 46 MET H H 46 8.589 8.589 7.656 0.933 25685 1666 1 3 . 1 1 47 47 LEU N N 47 117.448 117.448 119.361 -1.913 25685 1667 1 3 . 1 1 47 47 LEU HA H 47 3.992 3.992 4.171 -0.179 25685 1668 1 3 . 1 1 47 47 LEU C C 47 179.082 179.082 179.778 -0.696 25685 1669 1 3 . 1 1 47 47 LEU CA C 47 58.157 58.157 57.636 0.521 25685 1670 1 3 . 1 1 47 47 LEU CB C 47 41.858 41.858 41.606 0.252 25685 1671 1 3 . 1 1 47 47 LEU H H 47 8.769 8.769 8.220 0.549 25685 1672 1 3 . 1 1 48 48 ILE N N 48 117.500 117.500 117.851 -0.351 25685 1673 1 3 . 1 1 48 48 ILE C C 48 180.298 180.298 177.649 2.649 25685 1674 1 3 . 1 1 48 48 ILE CA C 48 65.627 65.627 64.206 1.421 25685 1675 1 3 . 1 1 48 48 ILE CB C 48 37.839 37.839 38.120 -0.281 25685 1676 1 3 . 1 1 48 48 ILE H H 48 8.093 8.093 7.615 0.478 25685 1677 1 3 . 1 1 49 49 LEU N N 49 123.708 123.708 120.299 3.409 25685 1678 1 3 . 1 1 49 49 LEU C C 49 179.721 179.721 177.825 1.896 25685 1679 1 3 . 1 1 49 49 LEU CA C 49 58.788 58.788 57.232 1.556 25685 1680 1 3 . 1 1 49 49 LEU CB C 49 40.761 40.761 42.033 -1.272 25685 1681 1 3 . 1 1 49 49 LEU H H 49 8.833 8.833 7.536 1.297 25685 1682 1 3 . 1 1 50 50 GLY N N 50 109.284 109.284 105.533 3.751 25685 1683 1 3 . 1 1 50 50 GLY C C 50 176.937 176.937 173.532 3.405 25685 1684 1 3 . 1 1 50 50 GLY CA C 50 47.821 47.821 45.452 2.369 25685 1685 1 3 . 1 1 50 50 GLY H H 50 9.658 9.658 7.685 1.973 25685 1686 1 3 . 1 1 51 51 TYR N N 51 125.640 125.640 122.136 3.504 25685 1687 1 3 . 1 1 51 51 TYR C C 51 177.102 177.102 173.988 3.114 25685 1688 1 3 . 1 1 51 51 TYR CA C 51 61.948 61.948 57.899 4.049 25685 1689 1 3 . 1 1 51 51 TYR CB C 51 38.871 38.871 37.063 1.808 25685 1690 1 3 . 1 1 51 51 TYR H H 51 8.795 8.795 8.907 -0.112 25685 1691 1 3 . 1 1 52 52 THR N N 52 116.273 116.273 113.476 2.797 25685 1692 1 3 . 1 1 52 52 THR C C 52 176.969 176.969 175.475 1.494 25685 1693 1 3 . 1 1 52 52 THR CA C 52 67.972 67.972 63.471 4.501 25685 1694 1 3 . 1 1 52 52 THR H H 52 8.456 8.456 7.569 0.887 25685 1695 1 3 . 1 1 53 53 ALA N N 53 122.122 122.122 129.112 -6.990 25685 1696 1 3 . 1 1 53 53 ALA C C 53 179.907 179.907 177.468 2.439 25685 1697 1 3 . 1 1 53 53 ALA CA C 53 55.722 55.722 51.927 3.795 25685 1698 1 3 . 1 1 53 53 ALA CB C 53 18.786 18.786 19.161 -0.375 25685 1699 1 3 . 1 1 53 53 ALA H H 53 9.058 9.058 8.492 0.566 25685 1700 1 3 . 1 1 54 54 SER N N 54 115.434 115.434 112.642 2.792 25685 1701 1 3 . 1 1 54 54 SER C C 54 176.433 176.433 173.835 2.598 25685 1702 1 3 . 1 1 54 54 SER CA C 54 55.828 55.828 59.451 -3.623 25685 1703 1 3 . 1 1 54 54 SER H H 54 8.040 8.040 8.281 -0.241 25685 1704 1 3 . 1 1 55 55 LEU N N 55 123.045 123.045 117.840 5.205 25685 1705 1 3 . 1 1 55 55 LEU C C 55 178.789 178.789 175.457 3.332 25685 1706 1 3 . 1 1 55 55 LEU CA C 55 57.633 57.633 55.475 2.158 25685 1707 1 3 . 1 1 55 55 LEU CB C 55 41.293 41.293 42.353 -1.060 25685 1708 1 3 . 1 1 55 55 LEU H H 55 8.255 8.255 8.096 0.159 25685 1709 1 3 . 1 1 56 56 PHE N N 56 114.426 114.426 119.855 -5.429 25685 1710 1 3 . 1 1 56 56 PHE C C 56 177.507 177.507 174.872 2.635 25685 1711 1 3 . 1 1 56 56 PHE CA C 56 61.068 61.068 58.328 2.740 25685 1712 1 3 . 1 1 56 56 PHE CB C 56 40.107 40.107 39.446 0.661 25685 1713 1 3 . 1 1 56 56 PHE H H 56 7.590 7.590 7.956 -0.366 25685 1714 1 3 . 1 1 57 57 PHE N N 57 114.701 114.701 117.514 -2.813 25685 1715 1 3 . 1 1 57 57 PHE C C 57 176.203 176.203 176.128 0.075 25685 1716 1 3 . 1 1 57 57 PHE CA C 57 58.503 58.503 57.877 0.626 25685 1717 1 3 . 1 1 57 57 PHE CB C 57 41.114 41.114 38.944 2.170 25685 1718 1 3 . 1 1 57 57 PHE H H 57 8.514 8.514 7.946 0.568 25685 1719 1 3 . 1 1 58 58 GLY N N 58 111.041 111.041 109.825 1.216 25685 1720 1 3 . 1 1 58 58 GLY C C 58 174.240 174.240 176.654 -2.414 25685 1721 1 3 . 1 1 58 58 GLY CA C 58 44.827 44.827 47.253 -2.426 25685 1722 1 3 . 1 1 58 58 GLY H H 58 7.998 7.998 8.450 -0.452 25685 1723 1 3 . 1 1 59 59 PHE N N 59 127.950 127.950 122.779 5.171 25685 1724 1 3 . 1 1 59 59 PHE C C 59 176.612 176.612 176.274 0.338 25685 1725 1 3 . 1 1 59 59 PHE CA C 59 61.598 61.598 58.938 2.660 25685 1726 1 3 . 1 1 59 59 PHE CB C 59 40.870 40.870 39.102 1.768 25685 1727 1 3 . 1 1 59 59 PHE H H 59 9.105 9.105 8.221 0.884 25685 1728 1 3 . 1 1 60 60 PHE N N 60 114.868 114.868 119.267 -4.399 25685 1729 1 3 . 1 1 60 60 PHE C C 60 177.989 177.989 176.882 1.107 25685 1730 1 3 . 1 1 60 60 PHE CA C 60 61.517 61.517 61.228 0.289 25685 1731 1 3 . 1 1 60 60 PHE CB C 60 38.248 38.248 39.120 -0.872 25685 1732 1 3 . 1 1 60 60 PHE H H 60 8.796 8.796 7.781 1.015 25685 1733 1 3 . 1 1 61 61 ARG N N 61 118.812 118.812 117.615 1.197 25685 1734 1 3 . 1 1 61 61 ARG C C 61 177.813 177.813 178.364 -0.551 25685 1735 1 3 . 1 1 61 61 ARG CA C 61 60.497 60.497 59.480 1.016 25685 1736 1 3 . 1 1 61 61 ARG CB C 61 28.915 28.915 29.838 -0.923 25685 1737 1 3 . 1 1 61 61 ARG H H 61 7.600 7.600 7.846 -0.246 25685 1738 1 3 . 1 1 62 62 VAL N N 62 119.157 119.157 117.646 1.511 25685 1739 1 3 . 1 1 62 62 VAL C C 62 177.670 177.670 177.165 0.505 25685 1740 1 3 . 1 1 62 62 VAL CA C 62 66.749 66.749 65.445 1.304 25685 1741 1 3 . 1 1 62 62 VAL CB C 62 30.306 30.306 31.002 -0.696 25685 1742 1 3 . 1 1 62 62 VAL H H 62 7.679 7.679 7.308 0.371 25685 1743 1 3 . 1 1 63 63 VAL N N 63 117.999 117.999 119.529 -1.530 25685 1744 1 3 . 1 1 63 63 VAL C C 63 177.639 177.639 178.694 -1.055 25685 1745 1 3 . 1 1 63 63 VAL CA C 63 66.836 66.836 64.766 2.070 25685 1746 1 3 . 1 1 63 63 VAL CB C 63 30.496 30.496 29.842 0.654 25685 1747 1 3 . 1 1 63 63 VAL H H 63 7.429 7.429 6.938 0.491 25685 1748 1 3 . 1 1 64 64 ALA N N 64 120.451 120.451 122.502 -2.051 25685 1749 1 3 . 1 1 64 64 ALA C C 64 179.134 179.134 179.113 0.021 25685 1750 1 3 . 1 1 64 64 ALA CA C 64 55.618 55.618 55.049 0.569 25685 1751 1 3 . 1 1 64 64 ALA CB C 64 17.950 17.950 17.864 0.086 25685 1752 1 3 . 1 1 64 64 ALA H H 64 8.169 8.169 7.707 0.462 25685 1753 1 3 . 1 1 65 65 MET N N 65 116.532 116.532 116.544 -0.012 25685 1754 1 3 . 1 1 65 65 MET C C 65 177.961 177.961 178.090 -0.129 25685 1755 1 3 . 1 1 65 65 MET CA C 65 58.161 58.161 57.919 0.242 25685 1756 1 3 . 1 1 65 65 MET CB C 65 31.208 31.208 31.613 -0.405 25685 1757 1 3 . 1 1 65 65 MET H H 65 7.857 7.857 7.302 0.555 25685 1758 1 3 . 1 1 66 66 LEU C C 66 179.022 179.022 178.575 0.447 25685 1759 1 3 . 1 1 66 66 LEU CA C 66 58.412 58.412 58.140 0.272 25685 1760 1 3 . 1 1 67 67 PHE N N 67 116.877 116.877 117.046 -0.169 25685 1761 1 3 . 1 1 67 67 PHE C C 67 177.908 177.908 177.828 0.080 25685 1762 1 3 . 1 1 67 67 PHE CA C 67 62.402 62.402 59.947 2.455 25685 1763 1 3 . 1 1 67 67 PHE CB C 67 39.203 39.203 37.759 1.444 25685 1764 1 3 . 1 1 67 67 PHE H H 67 7.923 7.923 7.340 0.583 25685 1765 1 3 . 1 1 68 68 LEU N N 68 118.860 118.860 120.750 -1.890 25685 1766 1 3 . 1 1 68 68 LEU C C 68 179.032 179.032 178.223 0.809 25685 1767 1 3 . 1 1 68 68 LEU CA C 68 58.397 58.397 57.015 1.382 25685 1768 1 3 . 1 1 68 68 LEU CB C 68 40.803 40.803 41.335 -0.532 25685 1769 1 3 . 1 1 68 68 LEU H H 68 8.167 8.167 6.459 1.708 25685 1770 1 3 . 1 1 71 71 PHE N N 71 120.700 120.700 117.331 3.369 25685 1771 1 3 . 1 1 71 71 PHE C C 71 177.670 177.670 177.368 0.302 25685 1772 1 3 . 1 1 71 71 PHE CA C 71 60.528 60.528 60.825 -0.298 25685 1773 1 3 . 1 1 71 71 PHE H H 71 7.847 7.847 7.011 0.836 25685 1774 1 3 . 1 1 72 72 ALA N N 72 120.506 120.506 122.061 -1.555 25685 1775 1 3 . 1 1 72 72 ALA C C 72 178.944 178.944 179.101 -0.157 25685 1776 1 3 . 1 1 72 72 ALA CA C 72 55.461 55.461 54.666 0.795 25685 1777 1 3 . 1 1 72 72 ALA CB C 72 17.829 17.829 18.098 -0.269 25685 1778 1 3 . 1 1 72 72 ALA H H 72 8.533 8.533 7.272 1.261 25685 1779 1 3 . 1 1 73 73 LEU N N 73 115.071 115.071 117.579 -2.508 25685 1780 1 3 . 1 1 73 73 LEU C C 73 180.831 180.831 178.345 2.486 25685 1781 1 3 . 1 1 73 73 LEU CA C 73 58.091 58.091 57.956 0.135 25685 1782 1 3 . 1 1 73 73 LEU CB C 73 41.082 41.082 41.330 -0.248 25685 1783 1 3 . 1 1 73 73 LEU H H 73 8.458 8.458 7.652 0.806 25685 1784 1 3 . 1 1 74 74 ILE N N 74 121.365 121.365 114.702 6.663 25685 1785 1 3 . 1 1 74 74 ILE C C 74 178.287 178.287 177.435 0.852 25685 1786 1 3 . 1 1 74 74 ILE CA C 74 65.335 65.335 63.938 1.397 25685 1787 1 3 . 1 1 74 74 ILE CB C 74 37.453 37.453 37.114 0.340 25685 1788 1 3 . 1 1 74 74 ILE H H 74 8.220 8.220 7.225 0.995 25685 1789 1 3 . 1 1 75 75 LEU N N 75 119.200 119.200 121.146 -1.946 25685 1790 1 3 . 1 1 75 75 LEU C C 75 177.548 177.548 177.771 -0.223 25685 1791 1 3 . 1 1 75 75 LEU CA C 75 56.938 56.938 57.642 -0.704 25685 1792 1 3 . 1 1 75 75 LEU CB C 75 41.541 41.541 41.293 0.248 25685 1793 1 3 . 1 1 75 75 LEU H H 75 7.866 7.866 7.309 0.557 25685 1794 1 3 . 1 1 76 76 LEU N N 76 116.338 116.338 117.300 -0.962 25685 1795 1 3 . 1 1 76 76 LEU C C 76 176.889 176.889 178.357 -1.468 25685 1796 1 3 . 1 1 76 76 LEU CA C 76 54.807 54.807 57.274 -2.467 25685 1797 1 3 . 1 1 76 76 LEU CB C 76 41.830 41.830 41.732 0.098 25685 1798 1 3 . 1 1 76 76 LEU H H 76 7.432 7.432 7.340 0.092 25685 1799 1 3 . 1 1 77 77 SER N N 77 114.630 114.630 112.336 2.294 25685 1800 1 3 . 1 1 77 77 SER C C 77 174.752 174.752 174.553 0.199 25685 1801 1 3 . 1 1 77 77 SER CA C 77 58.967 58.967 59.690 -0.723 25685 1802 1 3 . 1 1 77 77 SER CB C 77 64.686 64.686 63.356 1.330 25685 1803 1 3 . 1 1 77 77 SER H H 77 7.423 7.423 7.368 0.055 25685 1804 1 3 . 1 1 78 78 ASP N N 78 123.054 123.054 122.040 1.014 25685 1805 1 3 . 1 1 78 78 ASP C C 78 176.716 176.716 176.111 0.605 25685 1806 1 3 . 1 1 78 78 ASP CA C 78 54.848 54.848 54.873 -0.025 25685 1807 1 3 . 1 1 78 78 ASP CB C 78 40.423 40.423 39.132 1.291 25685 1808 1 3 . 1 1 78 78 ASP H H 78 8.294 8.294 7.651 0.643 25685 1809 1 3 . 1 1 79 79 GLU N N 79 119.104 119.104 119.302 -0.198 25685 1810 1 3 . 1 1 79 79 GLU C C 79 176.391 176.391 175.538 0.853 25685 1811 1 3 . 1 1 79 79 GLU CA C 79 56.258 56.258 57.812 -1.554 25685 1812 1 3 . 1 1 79 79 GLU CB C 79 29.656 29.656 29.456 0.200 25685 1813 1 3 . 1 1 79 79 GLU H H 79 8.384 8.384 8.042 0.342 25685 1814 1 3 . 1 1 80 80 LEU N N 80 121.254 121.254 122.316 -1.062 25685 1815 1 3 . 1 1 80 80 LEU C C 80 177.164 177.164 176.414 0.750 25685 1816 1 3 . 1 1 80 80 LEU CA C 80 54.670 54.670 55.089 -0.419 25685 1817 1 3 . 1 1 80 80 LEU CB C 80 42.633 42.633 42.483 0.151 25685 1818 1 3 . 1 1 80 80 LEU H H 80 7.637 7.637 8.229 -0.592 25685 1819 1 3 . 1 1 81 81 ASP N N 81 123.410 123.410 119.908 3.502 25685 1820 1 3 . 1 1 81 81 ASP C C 81 177.552 177.552 175.495 2.057 25685 1821 1 3 . 1 1 81 81 ASP CA C 81 55.110 55.110 53.364 1.746 25685 1822 1 3 . 1 1 81 81 ASP CB C 81 42.693 42.693 43.342 -0.649 25685 1823 1 3 . 1 1 81 81 ASP H H 81 8.403 8.403 8.094 0.309 25685 1824 1 3 . 1 1 82 82 GLU N N 82 125.047 125.047 119.640 5.407 25685 1825 1 3 . 1 1 82 82 GLU C C 82 178.198 178.198 177.219 0.979 25685 1826 1 3 . 1 1 82 82 GLU CA C 82 59.221 59.221 57.667 1.554 25685 1827 1 3 . 1 1 82 82 GLU CB C 82 29.176 29.176 29.910 -0.734 25685 1828 1 3 . 1 1 82 82 GLU H H 82 8.744 8.744 8.613 0.131 25685 1829 1 3 . 1 1 83 83 LYS N N 83 118.476 118.476 119.887 -1.411 25685 1830 1 3 . 1 1 83 83 LYS C C 83 179.356 179.356 177.933 1.423 25685 1831 1 3 . 1 1 83 83 LYS CA C 83 59.170 59.170 57.482 1.688 25685 1832 1 3 . 1 1 83 83 LYS CB C 83 31.509 31.509 32.236 -0.727 25685 1833 1 3 . 1 1 83 83 LYS H H 83 8.607 8.607 8.084 0.523 25685 1834 1 3 . 1 1 84 84 VAL N N 84 118.407 118.407 117.253 1.154 25685 1835 1 3 . 1 1 84 84 VAL C C 84 177.653 177.653 177.662 -0.009 25685 1836 1 3 . 1 1 84 84 VAL CA C 84 65.416 65.416 65.563 -0.147 25685 1837 1 3 . 1 1 84 84 VAL CB C 84 31.313 31.313 30.874 0.439 25685 1838 1 3 . 1 1 84 84 VAL H H 84 7.870 7.870 7.936 -0.066 25685 1839 1 3 . 1 1 85 85 SER N N 85 116.146 116.146 115.812 0.334 25685 1840 1 3 . 1 1 85 85 SER C C 85 177.496 177.496 176.579 0.917 25685 1841 1 3 . 1 1 85 85 SER CA C 85 61.764 61.764 61.802 -0.038 25685 1842 1 3 . 1 1 85 85 SER CB C 85 63.654 63.654 62.801 0.853 25685 1843 1 3 . 1 1 85 85 SER H H 85 8.083 8.083 8.354 -0.271 25685 1844 1 3 . 1 1 86 86 ILE N N 86 122.570 122.570 121.397 1.173 25685 1845 1 3 . 1 1 86 86 ILE C C 86 178.698 178.698 177.810 0.888 25685 1846 1 3 . 1 1 86 86 ILE CA C 86 64.526 64.526 62.721 1.804 25685 1847 1 3 . 1 1 86 86 ILE CB C 86 37.393 37.393 36.620 0.773 25685 1848 1 3 . 1 1 86 86 ILE H H 86 8.102 8.102 7.630 0.472 25685 1849 1 3 . 1 1 87 87 PHE N N 87 121.340 121.340 121.667 -0.327 25685 1850 1 3 . 1 1 87 87 PHE C C 87 177.671 177.671 176.751 0.920 25685 1851 1 3 . 1 1 87 87 PHE CA C 87 61.098 61.098 61.739 -0.641 25685 1852 1 3 . 1 1 87 87 PHE CB C 87 39.151 39.151 38.406 0.745 25685 1853 1 3 . 1 1 87 87 PHE H H 87 7.719 7.719 7.940 -0.221 25685 1854 1 3 . 1 1 88 88 ALA N N 88 120.921 120.921 120.802 0.119 25685 1855 1 3 . 1 1 88 88 ALA C C 88 180.030 180.030 179.197 0.833 25685 1856 1 3 . 1 1 88 88 ALA CA C 88 55.147 55.147 54.280 0.867 25685 1857 1 3 . 1 1 88 88 ALA CB C 88 19.053 19.053 18.038 1.015 25685 1858 1 3 . 1 1 88 88 ALA H H 88 8.679 8.679 7.892 0.787 25685 1859 1 3 . 1 1 89 89 SER N N 89 114.285 114.285 114.596 -0.311 25685 1860 1 3 . 1 1 89 89 SER C C 89 177.040 177.040 176.393 0.647 25685 1861 1 3 . 1 1 89 89 SER CA C 89 61.314 61.314 61.325 -0.011 25685 1862 1 3 . 1 1 89 89 SER CB C 89 63.371 63.371 63.028 0.343 25685 1863 1 3 . 1 1 89 89 SER H H 89 8.242 8.242 7.654 0.588 25685 1864 1 3 . 1 1 90 90 ARG N N 90 121.829 121.829 121.334 0.495 25685 1865 1 3 . 1 1 90 90 ARG C C 90 179.247 179.247 178.239 1.008 25685 1866 1 3 . 1 1 90 90 ARG CA C 90 58.444 58.444 58.002 0.442 25685 1867 1 3 . 1 1 90 90 ARG CB C 90 29.532 29.532 28.771 0.761 25685 1868 1 3 . 1 1 90 90 ARG H H 90 7.907 7.907 7.726 0.181 25685 1869 1 3 . 1 1 91 91 MET N N 91 117.124 117.124 116.145 0.979 25685 1870 1 3 . 1 1 91 91 MET C C 91 177.504 177.504 177.869 -0.365 25685 1871 1 3 . 1 1 91 91 MET CA C 91 57.152 57.152 60.034 -2.882 25685 1872 1 3 . 1 1 91 91 MET CB C 91 32.510 32.510 31.792 0.718 25685 1873 1 3 . 1 1 91 91 MET H H 91 7.930 7.930 7.717 0.213 25685 1874 1 3 . 1 1 92 92 THR N N 92 108.478 108.478 112.259 -3.781 25685 1875 1 3 . 1 1 92 92 THR C C 92 176.367 176.367 176.204 0.163 25685 1876 1 3 . 1 1 92 92 THR CA C 92 63.564 63.564 65.530 -1.966 25685 1877 1 3 . 1 1 92 92 THR H H 92 7.847 7.847 7.586 0.261 25685 1878 1 3 . 1 1 93 93 SER N N 93 117.950 117.950 117.604 0.346 25685 1879 1 3 . 1 1 93 93 SER C C 93 176.552 176.552 176.992 -0.440 25685 1880 1 3 . 1 1 93 93 SER CA C 93 60.821 60.821 60.828 -0.007 25685 1881 1 3 . 1 1 93 93 SER CB C 93 63.311 63.311 62.995 0.316 25685 1882 1 3 . 1 1 93 93 SER H H 93 7.732 7.732 7.792 -0.060 25685 1883 1 3 . 1 1 94 94 GLY N N 94 111.265 111.265 110.125 1.140 25685 1884 1 3 . 1 1 94 94 GLY C C 94 175.198 175.198 174.563 0.635 25685 1885 1 3 . 1 1 94 94 GLY CA C 94 46.021 46.021 45.393 0.628 25685 1886 1 3 . 1 1 94 94 GLY H H 94 8.419 8.419 8.208 0.211 25685 1887 1 3 . 1 1 95 95 LEU N N 95 121.019 121.019 120.657 0.362 25685 1888 1 3 . 1 1 95 95 LEU C C 95 177.810 177.810 176.694 1.116 25685 1889 1 3 . 1 1 95 95 LEU CA C 95 56.012 56.012 56.826 -0.814 25685 1890 1 3 . 1 1 95 95 LEU CB C 95 42.122 42.122 42.824 -0.702 25685 1891 1 3 . 1 1 95 95 LEU H H 95 7.849 7.849 7.744 0.105 25685 1892 1 3 . 1 1 96 96 SER N N 96 115.465 115.465 118.607 -3.142 25685 1893 1 3 . 1 1 96 96 SER C C 96 175.543 175.543 175.494 0.049 25685 1894 1 3 . 1 1 96 96 SER CA C 96 60.151 60.151 58.691 1.460 25685 1895 1 3 . 1 1 96 96 SER H H 96 8.349 8.349 8.108 0.241 25685 1896 1 3 . 1 1 97 97 TRP N N 97 121.711 121.711 124.415 -2.704 25685 1897 1 3 . 1 1 97 97 TRP C C 97 176.973 176.973 178.387 -1.414 25685 1898 1 3 . 1 1 97 97 TRP CA C 97 58.250 58.250 59.665 -1.415 25685 1899 1 3 . 1 1 97 97 TRP CB C 97 28.899 28.899 29.238 -0.339 25685 1900 1 3 . 1 1 97 97 TRP H H 97 7.723 7.723 8.013 -0.290 25685 1901 1 3 . 1 1 98 98 LYS N N 98 119.868 119.868 115.620 4.248 25685 1902 1 3 . 1 1 98 98 LYS C C 98 178.021 178.021 176.742 1.279 25685 1903 1 3 . 1 1 98 98 LYS CA C 98 56.340 56.340 58.227 -1.887 25685 1904 1 3 . 1 1 98 98 LYS CB C 98 31.933 31.933 31.001 0.932 25685 1905 1 3 . 1 1 98 98 LYS H H 98 7.855 7.855 8.783 -0.928 25685 1906 1 3 . 1 1 99 99 ILE N N 99 120.044 120.044 114.997 5.047 25685 1907 1 3 . 1 1 99 99 ILE C C 99 176.769 176.769 175.991 0.778 25685 1908 1 3 . 1 1 99 99 ILE CA C 99 62.758 62.758 62.441 0.317 25685 1909 1 3 . 1 1 99 99 ILE CB C 99 37.809 37.809 38.660 -0.852 25685 1910 1 3 . 1 1 99 99 ILE H H 99 8.069 8.069 7.950 0.119 25685 1911 1 3 . 1 1 100 100 GLN C C 100 176.315 176.315 174.860 1.455 25685 1912 1 3 . 1 1 100 100 GLN CA C 100 57.486 57.486 55.923 1.563 25685 1913 1 3 . 1 1 101 101 THR N N 101 109.873 109.873 117.750 -7.877 25685 1914 1 3 . 1 1 101 101 THR C C 101 174.664 174.664 173.484 1.180 25685 1915 1 3 . 1 1 101 101 THR CA C 101 61.709 61.709 62.269 -0.560 25685 1916 1 3 . 1 1 101 101 THR CB C 101 69.290 69.290 69.305 -0.015 25685 1917 1 3 . 1 1 101 101 THR H H 101 7.508 7.508 8.195 -0.687 25685 1918 1 3 . 1 1 102 102 LEU N N 102 124.434 124.434 120.661 3.773 25685 1919 1 3 . 1 1 102 102 LEU C C 102 174.681 174.681 174.192 0.489 25685 1920 1 3 . 1 1 102 102 LEU CA C 102 53.063 53.063 54.671 -1.608 25685 1921 1 3 . 1 1 102 102 LEU CB C 102 41.139 41.139 41.068 0.071 25685 1922 1 3 . 1 1 102 102 LEU H H 102 7.569 7.569 8.012 -0.443 25685 1923 1 3 . 1 1 103 103 PRO C C 103 178.076 178.076 175.860 2.216 25685 1924 1 3 . 1 1 103 103 PRO CA C 103 62.570 62.570 63.287 -0.717 25685 1925 1 3 . 1 1 103 103 PRO CB C 103 31.534 31.534 32.206 -0.673 25685 1926 1 3 . 1 1 104 104 SER N N 104 119.929 119.929 119.797 0.132 25685 1927 1 3 . 1 1 104 104 SER C C 104 176.432 176.432 173.873 2.559 25685 1928 1 3 . 1 1 104 104 SER CA C 104 61.976 61.976 57.949 4.027 25685 1929 1 3 . 1 1 104 104 SER CB C 104 63.611 63.611 64.662 -1.051 25685 1930 1 3 . 1 1 104 104 SER H H 104 8.784 8.784 7.728 1.056 25685 1931 1 3 . 1 1 105 105 PHE N N 105 119.519 119.519 123.531 -4.012 25685 1932 1 3 . 1 1 105 105 PHE C C 105 176.852 176.852 173.990 2.862 25685 1933 1 3 . 1 1 105 105 PHE CA C 105 60.162 60.162 58.858 1.304 25685 1934 1 3 . 1 1 105 105 PHE CB C 105 38.455 38.455 38.124 0.331 25685 1935 1 3 . 1 1 105 105 PHE H H 105 8.620 8.620 8.413 0.207 25685 1936 1 3 . 1 1 106 106 PHE N N 106 118.809 118.809 112.894 5.915 25685 1937 1 3 . 1 1 106 106 PHE C C 106 176.741 176.741 173.322 3.419 25685 1938 1 3 . 1 1 106 106 PHE CA C 106 61.421 61.421 57.903 3.518 25685 1939 1 3 . 1 1 106 106 PHE CB C 106 38.788 38.788 36.580 2.208 25685 1940 1 3 . 1 1 106 106 PHE H H 106 7.519 7.519 7.312 0.207 25685 1941 1 3 . 1 1 107 107 PHE N N 107 117.382 117.382 121.794 -4.412 25685 1942 1 3 . 1 1 107 107 PHE C C 107 177.771 177.771 176.965 0.806 25685 1943 1 3 . 1 1 107 107 PHE CA C 107 61.099 61.099 60.007 1.092 25685 1944 1 3 . 1 1 107 107 PHE CB C 107 38.677 38.677 40.569 -1.892 25685 1945 1 3 . 1 1 107 107 PHE H H 107 7.903 7.903 8.007 -0.104 25685 1946 1 3 . 1 1 108 108 GLY N N 108 105.340 105.340 107.791 -2.451 25685 1947 1 3 . 1 1 108 108 GLY C C 108 174.574 174.574 176.133 -1.559 25685 1948 1 3 . 1 1 108 108 GLY CA C 108 47.508 47.508 47.446 0.062 25685 1949 1 3 . 1 1 108 108 GLY H H 108 8.351 8.351 8.658 -0.307 25685 1950 1 3 . 1 1 109 109 MET N N 109 119.831 119.831 120.263 -0.432 25685 1951 1 3 . 1 1 109 109 MET C C 109 177.522 177.522 176.673 0.849 25685 1952 1 3 . 1 1 109 109 MET CA C 109 58.658 58.658 57.427 1.231 25685 1953 1 3 . 1 1 109 109 MET CB C 109 32.106 32.106 31.984 0.122 25685 1954 1 3 . 1 1 109 109 MET H H 109 7.919 7.919 7.818 0.101 25685 1955 1 3 . 1 1 110 110 LEU N N 110 119.908 119.908 118.491 1.417 25685 1956 1 3 . 1 1 110 110 LEU C C 110 178.170 178.170 177.946 0.224 25685 1957 1 3 . 1 1 110 110 LEU CA C 110 57.941 57.941 57.117 0.824 25685 1958 1 3 . 1 1 110 110 LEU CB C 110 41.055 41.055 41.284 -0.229 25685 1959 1 3 . 1 1 110 110 LEU H H 110 7.744 7.744 7.301 0.443 25685 1960 1 3 . 1 1 111 111 LEU N N 111 116.594 116.594 119.597 -3.003 25685 1961 1 3 . 1 1 111 111 LEU C C 111 178.960 178.960 177.642 1.318 25685 1962 1 3 . 1 1 111 111 LEU CA C 111 57.366 57.366 57.715 -0.349 25685 1963 1 3 . 1 1 111 111 LEU CB C 111 40.259 40.259 41.023 -0.764 25685 1964 1 3 . 1 1 111 111 LEU H H 111 7.732 7.732 7.113 0.619 25685 1965 1 3 . 1 1 112 112 ALA N N 112 121.020 121.020 120.142 0.878 25685 1966 1 3 . 1 1 112 112 ALA C C 112 178.700 178.700 179.149 -0.449 25685 1967 1 3 . 1 1 112 112 ALA CA C 112 55.432 55.432 54.747 0.685 25685 1968 1 3 . 1 1 112 112 ALA CB C 112 18.214 18.214 18.213 0.001 25685 1969 1 3 . 1 1 112 112 ALA H H 112 8.121 8.121 7.011 1.110 25685 1970 1 3 . 1 1 113 113 PHE N N 113 118.369 118.369 115.446 2.923 25685 1971 1 3 . 1 1 113 113 PHE C C 113 176.091 176.091 177.427 -1.336 25685 1972 1 3 . 1 1 113 113 PHE CA C 113 61.388 61.388 58.440 2.948 25685 1973 1 3 . 1 1 113 113 PHE CB C 113 39.688 39.688 37.546 2.142 25685 1974 1 3 . 1 1 113 113 PHE H H 113 8.237 8.237 7.268 0.969 25685 1975 1 3 . 1 1 114 114 LEU N N 114 114.214 114.214 116.929 -2.715 25685 1976 1 3 . 1 1 114 114 LEU C C 114 177.038 177.038 178.101 -1.063 25685 1977 1 3 . 1 1 114 114 LEU CA C 114 56.358 56.358 57.701 -1.343 25685 1978 1 3 . 1 1 114 114 LEU CB C 114 42.716 42.716 41.402 1.314 25685 1979 1 3 . 1 1 114 114 LEU H H 114 7.576 7.576 7.239 0.337 25685 1980 1 3 . 1 1 115 115 TRP N N 115 112.667 112.667 117.896 -5.229 25685 1981 1 3 . 1 1 115 115 TRP C C 115 180.163 180.163 177.642 2.521 25685 1982 1 3 . 1 1 115 115 TRP CA C 115 55.930 55.930 58.590 -2.660 25685 1983 1 3 . 1 1 115 115 TRP H H 115 8.542 8.542 6.976 1.566 25685 1984 1 3 . 1 1 116 116 LEU N N 116 122.144 122.144 120.520 1.624 25685 1985 1 3 . 1 1 116 116 LEU C C 116 175.953 175.953 176.173 -0.220 25685 1986 1 3 . 1 1 116 116 LEU CA C 116 59.924 59.924 58.181 1.743 25685 1987 1 3 . 1 1 116 116 LEU CB C 116 39.097 39.097 40.607 -1.510 25685 1988 1 3 . 1 1 116 116 LEU H H 116 8.996 8.996 7.148 1.848 25685 1989 1 3 . 1 1 117 117 PRO C C 117 174.220 174.220 177.658 -3.438 25685 1990 1 3 . 1 1 117 117 PRO CA C 117 66.300 66.300 64.421 1.879 25685 1991 1 3 . 1 1 118 118 ALA N N 118 110.603 110.603 120.697 -10.094 25685 1992 1 3 . 1 1 118 118 ALA C C 118 177.162 177.162 178.190 -1.028 25685 1993 1 3 . 1 1 118 118 ALA CA C 118 52.670 52.670 52.242 0.428 25685 1994 1 3 . 1 1 118 118 ALA CB C 118 18.853 18.853 19.815 -0.962 25685 1995 1 3 . 1 1 118 118 ALA H H 118 6.633 6.633 7.613 -0.980 25685 1996 1 3 . 1 1 119 119 ILE N N 119 113.492 113.492 114.380 -0.888 25685 1997 1 3 . 1 1 119 119 ILE CA C 119 63.703 63.703 63.817 -0.114 25685 1998 1 3 . 1 1 119 119 ILE CB C 119 39.605 39.605 36.712 2.893 25685 1999 1 3 . 1 1 119 119 ILE H H 119 7.693 7.693 8.301 -0.608 25685 2000 1 3 . 1 1 121 121 PRO C C 121 178.089 178.089 179.098 -1.009 25685 2001 1 3 . 1 1 121 121 PRO CA C 121 66.004 66.004 65.614 0.390 25685 2002 1 3 . 1 1 122 122 PHE N N 122 113.797 113.797 119.546 -5.749 25685 2003 1 3 . 1 1 122 122 PHE C C 122 177.713 177.713 176.818 0.895 25685 2004 1 3 . 1 1 122 122 PHE CA C 122 61.566 61.566 60.880 0.686 25685 2005 1 3 . 1 1 122 122 PHE CB C 122 38.983 38.983 38.837 0.147 25685 2006 1 3 . 1 1 122 122 PHE H H 122 6.846 6.846 8.037 -1.191 25685 2007 1 3 . 1 1 123 123 ALA N N 123 121.512 121.512 121.438 0.074 25685 2008 1 3 . 1 1 123 123 ALA C C 123 179.318 179.318 179.634 -0.316 25685 2009 1 3 . 1 1 123 123 ALA CA C 123 54.975 54.975 54.898 0.077 25685 2010 1 3 . 1 1 123 123 ALA CB C 123 17.881 17.881 18.209 -0.328 25685 2011 1 3 . 1 1 123 123 ALA H H 123 8.411 8.411 8.407 0.004 25685 2012 1 3 . 1 1 124 124 GLY N N 124 104.093 104.093 106.789 -2.696 25685 2013 1 3 . 1 1 124 124 GLY C C 124 175.410 175.410 176.002 -0.592 25685 2014 1 3 . 1 1 124 124 GLY CA C 124 47.370 47.370 46.851 0.519 25685 2015 1 3 . 1 1 124 124 GLY H H 124 8.455 8.455 7.963 0.492 25685 2016 1 3 . 1 1 125 125 ILE N N 125 121.895 121.895 120.158 1.737 25685 2017 1 3 . 1 1 125 125 ILE C C 125 178.329 178.329 177.223 1.106 25685 2018 1 3 . 1 1 125 125 ILE CA C 125 64.412 64.412 63.824 0.588 25685 2019 1 3 . 1 1 125 125 ILE H H 125 7.954 7.954 7.638 0.316 25685 2020 1 3 . 1 1 126 126 ALA N N 126 122.768 122.768 122.332 0.436 25685 2021 1 3 . 1 1 126 126 ALA C C 126 180.341 180.341 179.476 0.865 25685 2022 1 3 . 1 1 126 126 ALA CA C 126 55.266 55.266 55.400 -0.134 25685 2023 1 3 . 1 1 126 126 ALA CB C 126 18.226 18.226 17.943 0.283 25685 2024 1 3 . 1 1 126 126 ALA H H 126 8.142 8.142 7.724 0.418 25685 2025 1 3 . 1 1 127 127 ILE N N 127 116.752 116.752 117.425 -0.673 25685 2026 1 3 . 1 1 127 127 ILE C C 127 177.993 177.993 177.392 0.601 25685 2027 1 3 . 1 1 127 127 ILE CA C 127 63.877 63.877 63.996 -0.119 25685 2028 1 3 . 1 1 127 127 ILE CB C 127 37.657 37.657 36.773 0.884 25685 2029 1 3 . 1 1 127 127 ILE H H 127 8.335 8.335 7.519 0.816 25685 2030 1 3 . 1 1 128 128 SER N N 128 116.351 116.351 116.041 0.310 25685 2031 1 3 . 1 1 128 128 SER C C 128 175.796 175.796 176.923 -1.127 25685 2032 1 3 . 1 1 128 128 SER CA C 128 61.818 61.818 61.209 0.609 25685 2033 1 3 . 1 1 128 128 SER H H 128 7.939 7.939 7.708 0.231 25685 2034 1 3 . 1 1 129 129 GLN N N 129 118.082 118.082 120.201 -2.119 25685 2035 1 3 . 1 1 129 129 GLN C C 129 177.419 177.419 178.430 -1.011 25685 2036 1 3 . 1 1 129 129 GLN CA C 129 57.106 57.106 59.090 -1.984 25685 2037 1 3 . 1 1 129 129 GLN CB C 129 28.631 28.631 28.951 -0.320 25685 2038 1 3 . 1 1 129 129 GLN H H 129 7.943 7.943 7.736 0.207 25685 2039 1 3 . 1 1 130 130 THR N N 130 113.484 113.484 112.775 0.709 25685 2040 1 3 . 1 1 130 130 THR C C 130 175.627 175.627 175.595 0.032 25685 2041 1 3 . 1 1 130 130 THR CA C 130 63.758 63.758 65.049 -1.291 25685 2042 1 3 . 1 1 130 130 THR CB C 130 69.182 69.182 68.912 0.270 25685 2043 1 3 . 1 1 130 130 THR H H 130 7.686 7.686 7.808 -0.122 25685 2044 1 3 . 1 1 131 131 LEU N N 131 121.347 121.347 119.190 2.157 25685 2045 1 3 . 1 1 131 131 LEU C C 131 177.522 177.522 175.880 1.642 25685 2046 1 3 . 1 1 131 131 LEU CA C 131 56.307 56.307 54.394 1.913 25685 2047 1 3 . 1 1 131 131 LEU CB C 131 41.711 41.711 40.812 0.899 25685 2048 1 3 . 1 1 131 131 LEU H H 131 8.071 8.071 7.292 0.779 25685 2049 1 3 . 1 1 132 132 LEU N N 132 118.162 118.162 120.245 -2.083 25685 2050 1 3 . 1 1 132 132 LEU C C 132 177.461 177.461 175.060 2.401 25685 2051 1 3 . 1 1 132 132 LEU CA C 132 55.264 55.264 55.248 0.015 25685 2052 1 3 . 1 1 132 132 LEU CB C 132 41.613 41.613 44.209 -2.596 25685 2053 1 3 . 1 1 132 132 LEU H H 132 7.810 7.810 7.560 0.250 25685 2054 1 3 . 1 1 133 133 SER N N 133 114.244 114.244 119.084 -4.840 25685 2055 1 3 . 1 1 133 133 SER C C 133 174.363 174.363 173.605 0.758 25685 2056 1 3 . 1 1 133 133 SER CA C 133 59.019 59.019 59.433 -0.414 25685 2057 1 3 . 1 1 133 133 SER CB C 133 64.634 64.634 63.474 1.160 25685 2058 1 3 . 1 1 133 133 SER H H 133 7.829 7.829 8.486 -0.657 25685 2059 1 3 . 1 1 134 134 GLU N N 134 120.151 120.151 120.790 -0.639 25685 2060 1 3 . 1 1 134 134 GLU C C 134 175.935 175.935 175.082 0.853 25685 2061 1 3 . 1 1 134 134 GLU CA C 134 56.301 56.301 56.009 0.292 25685 2062 1 3 . 1 1 134 134 GLU CB C 134 30.129 30.129 29.994 0.135 25685 2063 1 3 . 1 1 134 134 GLU H H 134 8.054 8.054 8.508 -0.454 25685 2064 1 3 . 1 1 135 135 ASN N N 135 118.890 118.890 120.842 -1.952 25685 2065 1 3 . 1 1 135 135 ASN C C 135 174.272 174.272 174.783 -0.511 25685 2066 1 3 . 1 1 135 135 ASN CA C 135 51.390 51.390 50.191 1.198 25685 2067 1 3 . 1 1 135 135 ASN CB C 135 39.129 39.129 38.105 1.024 25685 2068 1 3 . 1 1 135 135 ASN H H 135 8.305 8.305 8.356 -0.051 25685 2069 1 3 . 1 1 136 136 PRO C C 136 177.960 177.960 178.026 -0.066 25685 2070 1 3 . 1 1 136 136 PRO CA C 136 64.530 64.530 64.071 0.459 25685 2071 1 3 . 1 1 136 136 PRO CB C 136 31.809 31.809 32.524 -0.715 25685 2072 1 3 . 1 1 137 137 LEU N N 137 117.735 117.735 120.025 -2.290 25685 2073 1 3 . 1 1 137 137 LEU C C 137 179.217 179.217 178.198 1.019 25685 2074 1 3 . 1 1 137 137 LEU CA C 137 57.039 57.039 57.910 -0.871 25685 2075 1 3 . 1 1 137 137 LEU CB C 137 40.799 40.799 41.602 -0.803 25685 2076 1 3 . 1 1 137 137 LEU H H 137 8.248 8.248 8.073 0.175 25685 2077 1 3 . 1 1 138 138 VAL N N 138 119.589 119.589 115.239 4.350 25685 2078 1 3 . 1 1 138 138 VAL C C 138 177.894 177.894 176.389 1.505 25685 2079 1 3 . 1 1 138 138 VAL CA C 138 64.727 64.727 65.630 -0.903 25685 2080 1 3 . 1 1 138 138 VAL CB C 138 31.347 31.347 30.932 0.415 25685 2081 1 3 . 1 1 138 138 VAL H H 138 7.483 7.483 7.740 -0.257 25685 2082 1 3 . 1 1 139 139 MET N N 139 119.431 119.431 119.504 -0.073 25685 2083 1 3 . 1 1 139 139 MET C C 139 177.988 177.988 178.194 -0.206 25685 2084 1 3 . 1 1 139 139 MET CA C 139 57.403 57.403 58.986 -1.583 25685 2085 1 3 . 1 1 139 139 MET CB C 139 31.709 31.709 32.554 -0.845 25685 2086 1 3 . 1 1 139 139 MET H H 139 7.837 7.837 7.182 0.655 25685 2087 1 3 . 1 1 140 140 LEU N N 140 119.686 119.686 119.969 -0.283 25685 2088 1 3 . 1 1 140 140 LEU C C 140 177.916 177.916 179.258 -1.342 25685 2089 1 3 . 1 1 140 140 LEU CA C 140 56.877 56.877 58.283 -1.406 25685 2090 1 3 . 1 1 140 140 LEU CB C 140 41.491 41.491 40.531 0.960 25685 2091 1 3 . 1 1 140 140 LEU H H 140 7.926 7.926 8.831 -0.905 25685 2092 1 3 . 1 1 141 141 SER N N 141 114.167 114.167 115.387 -1.220 25685 2093 1 3 . 1 1 141 141 SER C C 141 176.030 176.030 177.286 -1.256 25685 2094 1 3 . 1 1 141 141 SER CA C 141 60.425 60.425 61.379 -0.954 25685 2095 1 3 . 1 1 141 141 SER CB C 141 63.956 63.956 63.064 0.892 25685 2096 1 3 . 1 1 141 141 SER H H 141 7.757 7.757 8.127 -0.370 25685 2097 1 3 . 1 1 142 142 TYR N N 142 121.679 121.679 120.755 0.924 25685 2098 1 3 . 1 1 142 142 TYR C C 142 177.659 177.659 178.636 -0.977 25685 2099 1 3 . 1 1 142 142 TYR CA C 142 59.673 59.673 58.042 1.631 25685 2100 1 3 . 1 1 142 142 TYR CB C 142 38.079 38.079 37.192 0.887 25685 2101 1 3 . 1 1 142 142 TYR H H 142 7.965 7.965 8.488 -0.523 25685 2102 1 3 . 1 1 143 143 GLY N N 143 107.396 107.396 108.452 -1.056 25685 2103 1 3 . 1 1 143 143 GLY C C 143 174.877 174.877 175.884 -1.007 25685 2104 1 3 . 1 1 143 143 GLY CA C 143 46.343 46.343 47.343 -1.000 25685 2105 1 3 . 1 1 143 143 GLY H H 143 8.177 8.177 8.649 -0.472 25685 2106 1 3 . 1 1 144 144 LEU N N 144 120.477 120.477 122.739 -2.262 25685 2107 1 3 . 1 1 144 144 LEU C C 144 178.504 178.504 178.884 -0.380 25685 2108 1 3 . 1 1 144 144 LEU CA C 144 56.270 56.270 57.818 -1.548 25685 2109 1 3 . 1 1 144 144 LEU CB C 144 41.662 41.662 41.774 -0.112 25685 2110 1 3 . 1 1 144 144 LEU H H 144 8.055 8.055 7.419 0.636 25685 2111 1 3 . 1 1 145 145 GLY N N 145 106.847 106.847 106.798 0.049 25685 2112 1 3 . 1 1 145 145 GLY C C 145 175.375 175.375 176.381 -1.006 25685 2113 1 3 . 1 1 145 145 GLY CA C 145 45.582 45.582 47.101 -1.519 25685 2114 1 3 . 1 1 145 145 GLY H H 145 8.066 8.066 7.621 0.445 25685 2115 1 3 . 1 1 146 146 MET N N 146 120.376 120.376 121.351 -0.975 25685 2116 1 3 . 1 1 146 146 MET C C 146 176.663 176.663 178.599 -1.936 25685 2117 1 3 . 1 1 146 146 MET CA C 146 57.030 57.030 57.489 -0.459 25685 2118 1 3 . 1 1 146 146 MET CB C 146 30.720 30.720 31.930 -1.210 25685 2119 1 3 . 1 1 146 146 MET H H 146 8.157 8.157 8.769 -0.612 25685 2120 1 3 . 1 1 147 147 ALA N N 147 123.038 123.038 121.791 1.247 25685 2121 1 3 . 1 1 147 147 ALA C C 147 178.917 178.917 179.511 -0.594 25685 2122 1 3 . 1 1 147 147 ALA CA C 147 54.201 54.201 55.431 -1.230 25685 2123 1 3 . 1 1 147 147 ALA CB C 147 18.810 18.810 18.117 0.693 25685 2124 1 3 . 1 1 147 147 ALA H H 147 8.336 8.336 8.328 0.008 25685 2125 1 3 . 1 1 148 148 VAL N N 148 117.795 117.795 115.418 2.377 25685 2126 1 3 . 1 1 148 148 VAL C C 148 176.891 176.891 177.956 -1.065 25685 2127 1 3 . 1 1 148 148 VAL CA C 148 64.157 64.157 65.943 -1.786 25685 2128 1 3 . 1 1 148 148 VAL CB C 148 31.529 31.529 31.143 0.386 25685 2129 1 3 . 1 1 148 148 VAL H H 148 7.908 7.908 7.422 0.486 25685 2130 1 3 . 1 1 149 149 THR N N 149 116.069 116.069 117.154 -1.085 25685 2131 1 3 . 1 1 149 149 THR C C 149 176.054 176.054 176.521 -0.467 25685 2132 1 3 . 1 1 149 149 THR CA C 149 63.308 63.308 67.533 -4.225 25685 2133 1 3 . 1 1 149 149 THR H H 149 7.414 7.414 7.583 -0.169 25685 2134 1 3 . 1 1 150 150 ILE N N 150 121.971 121.971 121.838 0.133 25685 2135 1 3 . 1 1 150 150 ILE C C 150 177.715 177.715 176.331 1.384 25685 2136 1 3 . 1 1 150 150 ILE CA C 150 64.319 64.319 62.924 1.395 25685 2137 1 3 . 1 1 150 150 ILE CB C 150 36.628 36.628 37.458 -0.830 25685 2138 1 3 . 1 1 150 150 ILE H H 150 8.772 8.772 8.533 0.239 25685 2139 1 3 . 1 1 151 151 ALA N N 151 122.272 122.272 121.456 0.816 25685 2140 1 3 . 1 1 151 151 ALA C C 151 180.370 180.370 179.581 0.789 25685 2141 1 3 . 1 1 151 151 ALA CA C 151 55.336 55.336 55.282 0.054 25685 2142 1 3 . 1 1 151 151 ALA CB C 151 18.107 18.107 17.819 0.288 25685 2143 1 3 . 1 1 151 151 ALA H H 151 8.163 8.163 7.569 0.594 25685 2144 1 3 . 1 1 152 152 ALA N N 152 120.648 120.648 120.398 0.250 25685 2145 1 3 . 1 1 152 152 ALA C C 152 181.019 181.019 180.288 0.731 25685 2146 1 3 . 1 1 152 152 ALA CA C 152 54.944 54.944 54.760 0.184 25685 2147 1 3 . 1 1 152 152 ALA CB C 152 18.963 18.963 18.733 0.230 25685 2148 1 3 . 1 1 152 152 ALA H H 152 7.877 7.877 7.438 0.439 25685 2149 1 3 . 1 1 153 153 VAL N N 153 119.372 119.372 119.130 0.242 25685 2150 1 3 . 1 1 153 153 VAL C C 153 178.197 178.197 178.514 -0.317 25685 2151 1 3 . 1 1 153 153 VAL CA C 153 66.289 66.289 66.342 -0.053 25685 2152 1 3 . 1 1 153 153 VAL CB C 153 30.770 30.770 31.169 -0.399 25685 2153 1 3 . 1 1 153 153 VAL H H 153 8.118 8.118 7.810 0.308 25685 2154 1 3 . 1 1 154 154 PHE N N 154 120.362 120.362 119.397 0.965 25685 2155 1 3 . 1 1 154 154 PHE C C 154 177.733 177.733 177.890 -0.157 25685 2156 1 3 . 1 1 154 154 PHE CA C 154 61.412 61.412 60.641 0.771 25685 2157 1 3 . 1 1 154 154 PHE CB C 154 38.465 38.465 37.709 0.756 25685 2158 1 3 . 1 1 154 154 PHE H H 154 8.508 8.508 8.875 -0.367 25685 2159 1 3 . 1 1 155 155 LYS N N 155 118.894 118.894 119.542 -0.648 25685 2160 1 3 . 1 1 155 155 LYS C C 155 179.940 179.940 178.570 1.370 25685 2161 1 3 . 1 1 155 155 LYS CA C 155 58.969 58.969 59.001 -0.032 25685 2162 1 3 . 1 1 155 155 LYS CB C 155 31.725 31.725 32.071 -0.346 25685 2163 1 3 . 1 1 155 155 LYS H H 155 8.035 8.035 7.649 0.386 25685 2164 1 3 . 1 1 156 156 MET N N 156 118.853 118.853 117.116 1.737 25685 2165 1 3 . 1 1 156 156 MET C C 156 179.245 179.245 178.330 0.915 25685 2166 1 3 . 1 1 156 156 MET CA C 156 58.518 58.518 59.072 -0.554 25685 2167 1 3 . 1 1 156 156 MET CB C 156 31.912 31.912 31.924 -0.012 25685 2168 1 3 . 1 1 156 156 MET H H 156 8.014 8.014 7.830 0.184 25685 2169 1 3 . 1 1 157 157 GLY N N 157 108.239 108.239 104.727 3.512 25685 2170 1 3 . 1 1 157 157 GLY C C 157 174.637 174.637 175.425 -0.788 25685 2171 1 3 . 1 1 157 157 GLY CA C 157 47.204 47.204 47.110 0.094 25685 2172 1 3 . 1 1 157 157 GLY H H 157 8.614 8.614 7.899 0.715 25685 2173 1 3 . 1 1 158 158 GLU N N 158 122.902 122.902 118.359 4.543 25685 2174 1 3 . 1 1 158 158 GLU C C 158 177.851 177.851 175.959 1.892 25685 2175 1 3 . 1 1 158 158 GLU CA C 158 60.203 60.203 56.597 3.606 25685 2176 1 3 . 1 1 158 158 GLU CB C 158 28.870 28.870 32.370 -3.500 25685 2177 1 3 . 1 1 158 158 GLU H H 158 8.550 8.550 7.704 0.846 25685 2178 1 3 . 1 1 159 159 LYS N N 159 117.932 117.932 118.616 -0.684 25685 2179 1 3 . 1 1 159 159 LYS C C 159 179.529 179.529 174.905 4.624 25685 2180 1 3 . 1 1 159 159 LYS CA C 159 59.419 59.419 56.086 3.333 25685 2181 1 3 . 1 1 159 159 LYS CB C 159 31.759 31.759 34.141 -2.382 25685 2182 1 3 . 1 1 159 159 LYS H H 159 7.641 7.641 8.093 -0.452 25685 2183 1 3 . 1 1 160 160 PHE N N 160 120.614 120.614 123.646 -3.032 25685 2184 1 3 . 1 1 160 160 PHE C C 160 178.511 178.511 176.279 2.232 25685 2185 1 3 . 1 1 160 160 PHE CA C 160 61.580 61.580 58.837 2.743 25685 2186 1 3 . 1 1 160 160 PHE CB C 160 39.909 39.909 39.559 0.351 25685 2187 1 3 . 1 1 160 160 PHE H H 160 8.026 8.026 8.642 -0.616 25685 2188 1 3 . 1 1 161 161 VAL N N 161 119.870 119.870 118.139 1.731 25685 2189 1 3 . 1 1 161 161 VAL C C 161 177.347 177.347 176.006 1.341 25685 2190 1 3 . 1 1 161 161 VAL CA C 161 66.121 66.121 60.736 5.385 25685 2191 1 3 . 1 1 161 161 VAL CB C 161 30.935 30.935 33.877 -2.942 25685 2192 1 3 . 1 1 161 161 VAL H H 161 8.628 8.628 8.097 0.531 25685 2193 1 3 . 1 1 162 162 LYS N N 162 116.237 116.237 120.899 -4.662 25685 2194 1 3 . 1 1 162 162 LYS C C 162 179.197 179.197 176.191 3.006 25685 2195 1 3 . 1 1 162 162 LYS CA C 162 60.037 60.037 58.741 1.296 25685 2196 1 3 . 1 1 162 162 LYS CB C 162 31.333 31.333 32.383 -1.050 25685 2197 1 3 . 1 1 162 162 LYS H H 162 7.843 7.843 8.400 -0.557 25685 2198 1 3 . 1 1 163 163 ALA N N 163 119.197 119.197 119.805 -0.608 25685 2199 1 3 . 1 1 163 163 ALA C C 163 178.635 178.635 175.714 2.921 25685 2200 1 3 . 1 1 163 163 ALA CA C 163 53.681 53.681 51.974 1.707 25685 2201 1 3 . 1 1 163 163 ALA CB C 163 19.586 19.586 17.750 1.836 25685 2202 1 3 . 1 1 163 163 ALA H H 163 7.630 7.630 7.970 -0.340 25685 2203 1 3 . 1 1 164 164 ASN N N 164 115.956 115.956 117.819 -1.863 25685 2204 1 3 . 1 1 164 164 ASN C C 164 175.556 175.556 175.884 -0.328 25685 2205 1 3 . 1 1 164 164 ASN CA C 164 52.267 52.267 52.168 0.099 25685 2206 1 3 . 1 1 164 164 ASN CB C 164 39.148 39.148 38.968 0.180 25685 2207 1 3 . 1 1 164 164 ASN H H 164 7.326 7.326 8.018 -0.692 25685 2208 1 3 . 1 1 165 165 PHE N N 165 121.612 121.612 121.687 -0.075 25685 2209 1 3 . 1 1 165 165 PHE C C 165 177.069 177.069 177.690 -0.621 25685 2210 1 3 . 1 1 165 165 PHE CA C 165 62.921 62.921 61.130 1.792 25685 2211 1 3 . 1 1 165 165 PHE CB C 165 39.427 39.427 38.891 0.536 25685 2212 1 3 . 1 1 165 165 PHE H H 165 7.408 7.408 8.485 -1.077 25685 2213 1 3 . 1 1 166 166 GLN N N 166 117.147 117.147 119.490 -2.343 25685 2214 1 3 . 1 1 166 166 GLN C C 166 178.922 178.922 178.088 0.834 25685 2215 1 3 . 1 1 166 166 GLN CA C 166 59.262 59.262 59.000 0.262 25685 2216 1 3 . 1 1 166 166 GLN CB C 166 26.811 26.811 28.411 -1.600 25685 2217 1 3 . 1 1 166 166 GLN H H 166 8.605 8.605 8.678 -0.073 25685 2218 1 3 . 1 1 167 167 LEU N N 167 121.946 121.946 118.146 3.800 25685 2219 1 3 . 1 1 167 167 LEU C C 167 178.863 178.863 179.091 -0.228 25685 2220 1 3 . 1 1 167 167 LEU CA C 167 58.039 58.039 57.328 0.711 25685 2221 1 3 . 1 1 167 167 LEU CB C 167 41.130 41.130 40.573 0.557 25685 2222 1 3 . 1 1 167 167 LEU H H 167 7.892 7.892 8.113 -0.221 25685 2223 1 3 . 1 1 168 168 ILE N N 168 118.751 118.751 119.865 -1.114 25685 2224 1 3 . 1 1 168 168 ILE C C 168 179.908 179.908 177.962 1.946 25685 2225 1 3 . 1 1 168 168 ILE CA C 168 63.886 63.886 65.361 -1.475 25685 2226 1 3 . 1 1 168 168 ILE CB C 168 36.170 36.170 37.646 -1.476 25685 2227 1 3 . 1 1 168 168 ILE H H 168 8.065 8.065 7.285 0.780 25685 2228 1 3 . 1 1 169 169 ARG N N 169 125.851 125.851 119.316 6.535 25685 2229 1 3 . 1 1 169 169 ARG C C 169 177.579 177.579 178.449 -0.870 25685 2230 1 3 . 1 1 169 169 ARG CA C 169 60.306 60.306 59.775 0.531 25685 2231 1 3 . 1 1 169 169 ARG CB C 169 29.224 29.224 30.335 -1.111 25685 2232 1 3 . 1 1 169 169 ARG H H 169 8.995 8.995 7.659 1.336 25685 2233 1 3 . 1 1 170 170 LYS N N 170 119.586 119.586 118.944 0.642 25685 2234 1 3 . 1 1 170 170 LYS C C 170 178.584 178.584 178.740 -0.156 25685 2235 1 3 . 1 1 170 170 LYS CA C 170 60.293 60.293 59.065 1.228 25685 2236 1 3 . 1 1 170 170 LYS CB C 170 32.530 32.530 31.803 0.727 25685 2237 1 3 . 1 1 170 170 LYS H H 170 7.663 7.663 7.467 0.196 25685 2238 1 3 . 1 1 171 171 VAL N N 171 118.348 118.348 120.448 -2.100 25685 2239 1 3 . 1 1 171 171 VAL C C 171 177.478 177.478 177.718 -0.240 25685 2240 1 3 . 1 1 171 171 VAL CA C 171 66.641 66.641 65.616 1.025 25685 2241 1 3 . 1 1 171 171 VAL CB C 171 31.565 31.565 31.386 0.179 25685 2242 1 3 . 1 1 171 171 VAL H H 171 8.515 8.515 7.713 0.802 25685 2243 1 3 . 1 1 172 172 THR N N 172 115.172 115.172 116.005 -0.833 25685 2244 1 3 . 1 1 172 172 THR C C 172 176.320 176.320 176.663 -0.343 25685 2245 1 3 . 1 1 172 172 THR H H 172 8.416 8.416 7.590 0.826 25685 2246 1 3 . 1 1 173 173 GLY N N 173 108.801 108.801 108.678 0.123 25685 2247 1 3 . 1 1 173 173 GLY C C 173 174.138 174.138 175.105 -0.967 25685 2248 1 3 . 1 1 173 173 GLY CA C 173 47.769 47.769 46.768 1.001 25685 2249 1 3 . 1 1 173 173 GLY H H 173 8.505 8.505 7.643 0.862 25685 2250 1 3 . 1 1 174 174 ALA N N 174 123.573 123.573 123.855 -0.282 25685 2251 1 3 . 1 1 174 174 ALA C C 174 178.782 178.782 179.226 -0.444 25685 2252 1 3 . 1 1 174 174 ALA CA C 174 55.604 55.604 54.826 0.778 25685 2253 1 3 . 1 1 174 174 ALA CB C 174 18.778 18.778 18.633 0.145 25685 2254 1 3 . 1 1 174 174 ALA H H 174 8.038 8.038 7.463 0.575 25685 2255 1 3 . 1 1 175 175 ILE N N 175 118.501 118.501 118.609 -0.108 25685 2256 1 3 . 1 1 175 175 ILE C C 175 178.247 178.247 178.068 0.179 25685 2257 1 3 . 1 1 175 175 ILE CA C 175 65.412 65.412 63.322 2.090 25685 2258 1 3 . 1 1 175 175 ILE CB C 175 37.671 37.671 36.851 0.820 25685 2259 1 3 . 1 1 175 175 ILE H H 175 7.897 7.897 7.531 0.366 25685 2260 1 3 . 1 1 176 176 VAL N N 176 120.104 120.104 118.398 1.706 25685 2261 1 3 . 1 1 176 176 VAL C C 176 177.945 177.945 178.459 -0.514 25685 2262 1 3 . 1 1 176 176 VAL CA C 176 67.761 67.761 66.223 1.538 25685 2263 1 3 . 1 1 176 176 VAL CB C 176 30.662 30.662 31.169 -0.507 25685 2264 1 3 . 1 1 176 176 VAL H H 176 8.321 8.321 7.938 0.383 25685 2265 1 3 . 1 1 177 177 LEU N N 177 118.561 118.561 119.566 -1.005 25685 2266 1 3 . 1 1 177 177 LEU C C 177 178.563 178.563 178.494 0.069 25685 2267 1 3 . 1 1 177 177 LEU CA C 177 58.094 58.094 58.041 0.054 25685 2268 1 3 . 1 1 177 177 LEU CB C 177 41.061 41.061 40.997 0.064 25685 2269 1 3 . 1 1 177 177 LEU H H 177 8.097 8.097 7.292 0.805 25685 2270 1 3 . 1 1 178 178 LEU N N 178 120.868 120.868 119.735 1.133 25685 2271 1 3 . 1 1 178 178 LEU C C 178 178.524 178.524 178.257 0.267 25685 2272 1 3 . 1 1 178 178 LEU CA C 178 57.767 57.767 57.905 -0.138 25685 2273 1 3 . 1 1 178 178 LEU CB C 178 40.886 40.886 41.411 -0.525 25685 2274 1 3 . 1 1 178 178 LEU H H 178 8.229 8.229 7.260 0.969 25685 2275 1 3 . 1 1 179 179 TYR N N 179 119.355 119.355 118.398 0.957 25685 2276 1 3 . 1 1 179 179 TYR C C 179 180.059 180.059 177.253 2.806 25685 2277 1 3 . 1 1 179 179 TYR CA C 179 63.844 63.844 60.381 3.463 25685 2278 1 3 . 1 1 179 179 TYR CB C 179 39.508 39.508 38.009 1.499 25685 2279 1 3 . 1 1 179 179 TYR H H 179 8.759 8.759 7.775 0.984 25685 2280 1 3 . 1 1 180 180 LEU N N 180 118.984 118.984 119.063 -0.079 25685 2281 1 3 . 1 1 180 180 LEU C C 180 179.079 179.079 179.240 -0.161 25685 2282 1 3 . 1 1 180 180 LEU CA C 180 58.879 58.879 57.511 1.368 25685 2283 1 3 . 1 1 180 180 LEU CB C 180 41.899 41.899 40.593 1.306 25685 2284 1 3 . 1 1 180 180 LEU H H 180 8.315 8.315 7.470 0.845 25685 2285 1 3 . 1 1 181 181 ALA N N 181 121.826 121.826 122.219 -0.393 25685 2286 1 3 . 1 1 181 181 ALA C C 181 180.009 180.009 179.106 0.903 25685 2287 1 3 . 1 1 181 181 ALA CA C 181 55.700 55.700 55.007 0.693 25685 2288 1 3 . 1 1 181 181 ALA CB C 181 17.713 17.713 18.690 -0.977 25685 2289 1 3 . 1 1 181 181 ALA H H 181 8.480 8.480 8.069 0.411 25685 2290 1 3 . 1 1 182 182 TYR N N 182 118.039 118.039 117.222 0.817 25685 2291 1 3 . 1 1 182 182 TYR CA C 182 59.038 59.038 61.535 -2.497 25685 2292 1 3 . 1 1 182 182 TYR H H 182 8.856 8.856 7.893 0.963 25685 2293 1 3 . 1 1 183 183 PHE N N 183 124.769 124.769 116.801 7.968 25685 2294 1 3 . 1 1 183 183 PHE CA C 183 63.566 63.566 59.803 3.764 25685 2295 1 3 . 1 1 183 183 PHE H H 183 9.764 9.764 7.652 2.112 25685 2296 1 4 . 1 1 4 4 ALA N N 4 121.533 121.533 123.752 -2.219 25685 2297 1 4 . 1 1 4 4 ALA C C 4 177.632 177.632 178.957 -1.325 25685 2298 1 4 . 1 1 4 4 ALA CA C 4 55.117 55.117 55.281 -0.164 25685 2299 1 4 . 1 1 4 4 ALA CB C 4 18.448 18.448 17.939 0.509 25685 2300 1 4 . 1 1 4 4 ALA H H 4 7.977 7.977 8.407 -0.430 25685 2301 1 4 . 1 1 5 5 PHE N N 5 119.988 119.988 117.898 2.090 25685 2302 1 4 . 1 1 5 5 PHE CA C 5 60.759 60.759 59.948 0.811 25685 2303 1 4 . 1 1 5 5 PHE CB C 5 39.221 39.221 38.409 0.812 25685 2304 1 4 . 1 1 5 5 PHE H H 5 8.210 8.210 8.284 -0.074 25685 2305 1 4 . 1 1 6 6 ALA C C 6 179.794 179.794 179.016 0.778 25685 2306 1 4 . 1 1 6 6 ALA CA C 6 55.619 55.619 54.256 1.363 25685 2307 1 4 . 1 1 6 6 ALA CB C 6 17.911 17.911 17.887 0.024 25685 2308 1 4 . 1 1 6 6 ALA H H 6 8.417 8.417 7.892 0.525 25685 2309 1 4 . 1 1 7 7 LEU N N 7 115.852 115.852 119.510 -3.658 25685 2310 1 4 . 1 1 7 7 LEU C C 7 180.196 180.196 178.791 1.405 25685 2311 1 4 . 1 1 7 7 LEU CA C 7 57.528 57.528 57.316 0.213 25685 2312 1 4 . 1 1 7 7 LEU CB C 7 40.060 40.060 41.589 -1.529 25685 2313 1 4 . 1 1 7 7 LEU H H 7 8.741 8.741 7.837 0.904 25685 2314 1 4 . 1 1 8 8 GLY N N 8 110.199 110.199 106.957 3.242 25685 2315 1 4 . 1 1 8 8 GLY C C 8 176.430 176.430 175.869 0.561 25685 2316 1 4 . 1 1 8 8 GLY CA C 8 46.960 46.960 47.296 -0.336 25685 2317 1 4 . 1 1 8 8 GLY H H 8 8.179 8.179 7.771 0.408 25685 2318 1 4 . 1 1 9 9 ILE N N 9 122.346 122.346 122.966 -0.620 25685 2319 1 4 . 1 1 9 9 ILE C C 9 178.143 178.143 177.215 0.928 25685 2320 1 4 . 1 1 9 9 ILE CA C 9 65.048 65.048 63.002 2.046 25685 2321 1 4 . 1 1 9 9 ILE CB C 9 36.841 36.841 37.789 -0.948 25685 2322 1 4 . 1 1 9 9 ILE H H 9 7.788 7.788 7.258 0.530 25685 2323 1 4 . 1 1 10 10 LEU N N 10 117.560 117.560 119.137 -1.577 25685 2324 1 4 . 1 1 10 10 LEU C C 10 179.501 179.501 178.877 0.624 25685 2325 1 4 . 1 1 10 10 LEU CA C 10 58.068 58.068 58.117 -0.049 25685 2326 1 4 . 1 1 10 10 LEU CB C 10 40.776 40.776 41.349 -0.573 25685 2327 1 4 . 1 1 10 10 LEU H H 10 8.044 8.044 7.355 0.689 25685 2328 1 4 . 1 1 11 11 SER N N 11 113.830 113.830 113.810 0.020 25685 2329 1 4 . 1 1 11 11 SER CA C 11 61.769 61.769 61.095 0.674 25685 2330 1 4 . 1 1 11 11 SER CB C 11 63.395 63.395 63.331 0.064 25685 2331 1 4 . 1 1 11 11 SER H H 11 8.140 8.140 7.503 0.637 25685 2332 1 4 . 1 1 12 12 VAL N N 12 121.343 121.343 119.440 1.903 25685 2333 1 4 . 1 1 12 12 VAL C C 12 176.753 176.753 177.041 -0.288 25685 2334 1 4 . 1 1 12 12 VAL CA C 12 64.583 64.583 64.588 -0.005 25685 2335 1 4 . 1 1 12 12 VAL CB C 12 31.067 31.067 30.869 0.198 25685 2336 1 4 . 1 1 12 12 VAL H H 12 7.587 7.587 7.356 0.231 25685 2337 1 4 . 1 1 13 13 PHE N N 13 115.225 115.225 119.490 -4.265 25685 2338 1 4 . 1 1 13 13 PHE C C 13 177.349 177.349 176.442 0.907 25685 2339 1 4 . 1 1 13 13 PHE CA C 13 58.730 58.730 60.444 -1.714 25685 2340 1 4 . 1 1 13 13 PHE CB C 13 39.785 39.785 39.227 0.558 25685 2341 1 4 . 1 1 13 13 PHE H H 13 7.474 7.474 7.782 -0.308 25685 2342 1 4 . 1 1 14 14 SER N N 14 116.075 116.075 115.060 1.015 25685 2343 1 4 . 1 1 14 14 SER H H 14 7.955 7.955 7.755 0.200 25685 2344 1 4 . 1 1 15 15 PRO C C 15 177.590 177.590 175.920 1.670 25685 2345 1 4 . 1 1 15 15 PRO CA C 15 65.464 65.464 63.658 1.806 25685 2346 1 4 . 1 1 16 16 ALA N N 16 116.288 116.288 117.712 -1.424 25685 2347 1 4 . 1 1 16 16 ALA C C 16 177.563 177.563 175.895 1.668 25685 2348 1 4 . 1 1 16 16 ALA CA C 16 53.010 53.010 52.382 0.628 25685 2349 1 4 . 1 1 16 16 ALA CB C 16 19.975 19.975 20.183 -0.208 25685 2350 1 4 . 1 1 16 16 ALA H H 16 7.455 7.455 8.023 -0.568 25685 2351 1 4 . 1 1 17 17 VAL N N 17 112.072 112.072 119.807 -7.735 25685 2352 1 4 . 1 1 17 17 VAL CA C 17 63.117 63.117 61.676 1.441 25685 2353 1 4 . 1 1 17 17 VAL CB C 17 33.209 33.209 33.536 -0.327 25685 2354 1 4 . 1 1 17 17 VAL H H 17 7.525 7.525 7.860 -0.335 25685 2355 1 4 . 1 1 18 18 LEU N N 18 121.205 121.205 124.486 -3.281 25685 2356 1 4 . 1 1 18 18 LEU CA C 18 58.971 58.971 58.003 0.968 25685 2357 1 4 . 1 1 18 18 LEU CB C 18 41.161 41.161 40.026 1.135 25685 2358 1 4 . 1 1 18 18 LEU H H 18 8.191 8.191 8.617 -0.426 25685 2359 1 4 . 1 1 19 19 PRO C C 19 177.697 177.697 177.191 0.506 25685 2360 1 4 . 1 1 19 19 PRO CA C 19 65.181 65.181 63.952 1.230 25685 2361 1 4 . 1 1 20 20 VAL N N 20 111.723 111.723 115.453 -3.730 25685 2362 1 4 . 1 1 20 20 VAL C C 20 177.137 177.137 175.913 1.224 25685 2363 1 4 . 1 1 20 20 VAL CA C 20 62.494 62.494 63.320 -0.826 25685 2364 1 4 . 1 1 20 20 VAL CB C 20 31.677 31.677 31.510 0.167 25685 2365 1 4 . 1 1 20 20 VAL H H 20 7.571 7.571 7.996 -0.425 25685 2366 1 4 . 1 1 21 21 VAL N N 21 121.705 121.705 115.730 5.975 25685 2367 1 4 . 1 1 21 21 VAL CA C 21 68.305 68.305 63.716 4.589 25685 2368 1 4 . 1 1 21 21 VAL H H 21 7.732 7.732 7.897 -0.165 25685 2369 1 4 . 1 1 24 24 ILE C C 24 174.359 174.359 176.966 -2.607 25685 2370 1 4 . 1 1 25 25 PHE N N 25 120.132 120.132 126.764 -6.632 25685 2371 1 4 . 1 1 25 25 PHE C C 25 175.945 175.945 174.529 1.416 25685 2372 1 4 . 1 1 25 25 PHE CA C 25 60.544 60.544 56.265 4.279 25685 2373 1 4 . 1 1 25 25 PHE H H 25 8.082 8.082 8.986 -0.904 25685 2374 1 4 . 1 1 26 26 ALA N N 26 121.341 121.341 121.710 -0.369 25685 2375 1 4 . 1 1 26 26 ALA CB C 26 19.784 19.784 21.000 -1.216 25685 2376 1 4 . 1 1 26 26 ALA H H 26 7.539 7.539 7.794 -0.255 25685 2377 1 4 . 1 1 27 27 GLY N N 27 107.530 107.530 106.556 0.974 25685 2378 1 4 . 1 1 27 27 GLY C C 27 174.252 174.252 174.110 0.142 25685 2379 1 4 . 1 1 27 27 GLY CA C 27 45.474 45.474 45.024 0.450 25685 2380 1 4 . 1 1 27 27 GLY H H 27 7.997 7.997 8.612 -0.615 25685 2381 1 4 . 1 1 28 28 SER N N 28 116.299 116.299 116.372 -0.073 25685 2382 1 4 . 1 1 28 28 SER C C 28 175.759 175.759 174.909 0.850 25685 2383 1 4 . 1 1 28 28 SER CA C 28 58.526 58.526 58.401 0.125 25685 2384 1 4 . 1 1 28 28 SER CB C 28 64.373 64.373 62.874 1.499 25685 2385 1 4 . 1 1 28 28 SER H H 28 8.115 8.115 8.410 -0.295 25685 2386 1 4 . 1 1 34 34 ASP C C 34 177.621 177.621 178.100 -0.479 25685 2387 1 4 . 1 1 34 34 ASP CA C 34 57.082 57.082 57.475 -0.393 25685 2388 1 4 . 1 1 35 35 ALA N N 35 120.662 120.662 121.509 -0.847 25685 2389 1 4 . 1 1 35 35 ALA C C 35 179.168 179.168 179.606 -0.438 25685 2390 1 4 . 1 1 35 35 ALA CA C 35 55.459 55.459 54.888 0.571 25685 2391 1 4 . 1 1 35 35 ALA CB C 35 18.819 18.819 18.337 0.482 25685 2392 1 4 . 1 1 35 35 ALA H H 35 8.090 8.090 7.400 0.690 25685 2393 1 4 . 1 1 36 36 PHE N N 36 117.638 117.638 118.875 -1.237 25685 2394 1 4 . 1 1 36 36 PHE C C 36 177.057 177.057 177.062 -0.005 25685 2395 1 4 . 1 1 36 36 PHE CA C 36 61.472 61.472 61.025 0.447 25685 2396 1 4 . 1 1 36 36 PHE CB C 36 38.860 38.860 38.977 -0.117 25685 2397 1 4 . 1 1 36 36 PHE H H 36 8.227 8.227 7.751 0.476 25685 2398 1 4 . 1 1 37 37 LEU N N 37 119.312 119.312 118.486 0.826 25685 2399 1 4 . 1 1 37 37 LEU C C 37 179.798 179.798 178.733 1.065 25685 2400 1 4 . 1 1 37 37 LEU CA C 37 58.181 58.181 57.199 0.982 25685 2401 1 4 . 1 1 37 37 LEU CB C 37 40.835 40.835 41.473 -0.638 25685 2402 1 4 . 1 1 37 37 LEU H H 37 8.588 8.588 7.426 1.162 25685 2403 1 4 . 1 1 38 38 ILE N N 38 119.057 119.057 118.928 0.129 25685 2404 1 4 . 1 1 38 38 ILE C C 38 177.597 177.597 177.200 0.397 25685 2405 1 4 . 1 1 38 38 ILE CA C 38 64.827 64.827 64.001 0.826 25685 2406 1 4 . 1 1 38 38 ILE CB C 38 36.321 36.321 37.889 -1.568 25685 2407 1 4 . 1 1 38 38 ILE H H 38 7.932 7.932 7.498 0.434 25685 2408 1 4 . 1 1 39 39 VAL N N 39 118.758 118.758 117.560 1.198 25685 2409 1 4 . 1 1 39 39 VAL C C 39 179.533 179.533 177.259 2.274 25685 2410 1 4 . 1 1 39 39 VAL CA C 39 66.687 66.687 66.384 0.303 25685 2411 1 4 . 1 1 39 39 VAL CB C 39 30.598 30.598 31.279 -0.681 25685 2412 1 4 . 1 1 39 39 VAL H H 39 7.922 7.922 7.324 0.598 25685 2413 1 4 . 1 1 40 40 ALA N N 40 125.385 125.385 122.205 3.180 25685 2414 1 4 . 1 1 40 40 ALA C C 40 179.200 179.200 179.570 -0.370 25685 2415 1 4 . 1 1 40 40 ALA CA C 40 55.283 55.283 54.850 0.433 25685 2416 1 4 . 1 1 40 40 ALA CB C 40 17.197 17.197 17.977 -0.780 25685 2417 1 4 . 1 1 40 40 ALA H H 40 9.091 9.091 7.301 1.790 25685 2418 1 4 . 1 1 41 41 GLY N N 41 106.978 106.978 106.351 0.627 25685 2419 1 4 . 1 1 41 41 GLY C C 41 176.171 176.171 175.713 0.458 25685 2420 1 4 . 1 1 41 41 GLY CA C 41 47.322 47.322 47.112 0.210 25685 2421 1 4 . 1 1 41 41 GLY H H 41 8.565 8.565 7.825 0.740 25685 2422 1 4 . 1 1 42 42 LEU N N 42 126.914 126.914 119.193 7.721 25685 2423 1 4 . 1 1 42 42 LEU C C 42 178.119 178.119 178.817 -0.698 25685 2424 1 4 . 1 1 42 42 LEU CA C 42 58.523 58.523 57.356 1.167 25685 2425 1 4 . 1 1 42 42 LEU CB C 42 42.125 42.125 41.293 0.832 25685 2426 1 4 . 1 1 42 42 LEU H H 42 8.573 8.573 7.422 1.151 25685 2427 1 4 . 1 1 46 46 MET N N 46 121.710 121.710 120.860 0.850 25685 2428 1 4 . 1 1 46 46 MET C C 46 179.540 179.540 178.775 0.765 25685 2429 1 4 . 1 1 46 46 MET CA C 46 55.968 55.968 57.664 -1.696 25685 2430 1 4 . 1 1 46 46 MET H H 46 8.589 8.589 7.826 0.763 25685 2431 1 4 . 1 1 47 47 LEU N N 47 117.448 117.448 120.161 -2.713 25685 2432 1 4 . 1 1 47 47 LEU HA H 47 3.992 3.992 4.079 -0.087 25685 2433 1 4 . 1 1 47 47 LEU C C 47 179.082 179.082 178.612 0.470 25685 2434 1 4 . 1 1 47 47 LEU CA C 47 58.157 58.157 57.889 0.268 25685 2435 1 4 . 1 1 47 47 LEU CB C 47 41.858 41.858 41.031 0.827 25685 2436 1 4 . 1 1 47 47 LEU H H 47 8.769 8.769 8.091 0.678 25685 2437 1 4 . 1 1 48 48 ILE N N 48 117.500 117.500 116.913 0.587 25685 2438 1 4 . 1 1 48 48 ILE C C 48 180.298 180.298 178.505 1.793 25685 2439 1 4 . 1 1 48 48 ILE CA C 48 65.627 65.627 64.004 1.623 25685 2440 1 4 . 1 1 48 48 ILE CB C 48 37.839 37.839 36.880 0.959 25685 2441 1 4 . 1 1 48 48 ILE H H 48 8.093 8.093 7.440 0.653 25685 2442 1 4 . 1 1 49 49 LEU N N 49 123.708 123.708 120.984 2.724 25685 2443 1 4 . 1 1 49 49 LEU C C 49 179.721 179.721 178.506 1.215 25685 2444 1 4 . 1 1 49 49 LEU CA C 49 58.788 58.788 57.082 1.706 25685 2445 1 4 . 1 1 49 49 LEU CB C 49 40.761 40.761 41.187 -0.426 25685 2446 1 4 . 1 1 49 49 LEU H H 49 8.833 8.833 7.770 1.063 25685 2447 1 4 . 1 1 50 50 GLY N N 50 109.284 109.284 104.639 4.645 25685 2448 1 4 . 1 1 50 50 GLY C C 50 176.937 176.937 174.174 2.763 25685 2449 1 4 . 1 1 50 50 GLY CA C 50 47.821 47.821 47.464 0.357 25685 2450 1 4 . 1 1 50 50 GLY H H 50 9.658 9.658 8.718 0.940 25685 2451 1 4 . 1 1 51 51 TYR N N 51 125.640 125.640 113.098 12.542 25685 2452 1 4 . 1 1 51 51 TYR C C 51 177.102 177.102 173.377 3.725 25685 2453 1 4 . 1 1 51 51 TYR CA C 51 61.948 61.948 55.134 6.814 25685 2454 1 4 . 1 1 51 51 TYR CB C 51 38.871 38.871 39.422 -0.551 25685 2455 1 4 . 1 1 51 51 TYR H H 51 8.795 8.795 7.239 1.556 25685 2456 1 4 . 1 1 52 52 THR N N 52 116.273 116.273 113.783 2.490 25685 2457 1 4 . 1 1 52 52 THR C C 52 176.969 176.969 174.166 2.803 25685 2458 1 4 . 1 1 52 52 THR CA C 52 67.972 67.972 62.407 5.565 25685 2459 1 4 . 1 1 52 52 THR H H 52 8.456 8.456 8.239 0.217 25685 2460 1 4 . 1 1 53 53 ALA N N 53 122.122 122.122 130.448 -8.326 25685 2461 1 4 . 1 1 53 53 ALA C C 53 179.907 179.907 177.732 2.175 25685 2462 1 4 . 1 1 53 53 ALA CA C 53 55.722 55.722 51.064 4.658 25685 2463 1 4 . 1 1 53 53 ALA CB C 53 18.786 18.786 20.551 -1.765 25685 2464 1 4 . 1 1 53 53 ALA H H 53 9.058 9.058 8.148 0.910 25685 2465 1 4 . 1 1 54 54 SER N N 54 115.434 115.434 119.935 -4.501 25685 2466 1 4 . 1 1 54 54 SER C C 54 176.433 176.433 173.983 2.450 25685 2467 1 4 . 1 1 54 54 SER CA C 54 55.828 55.828 57.427 -1.599 25685 2468 1 4 . 1 1 54 54 SER H H 54 8.040 8.040 9.186 -1.146 25685 2469 1 4 . 1 1 55 55 LEU N N 55 123.045 123.045 125.596 -2.551 25685 2470 1 4 . 1 1 55 55 LEU C C 55 178.789 178.789 174.223 4.566 25685 2471 1 4 . 1 1 55 55 LEU CA C 55 57.633 57.633 55.403 2.230 25685 2472 1 4 . 1 1 55 55 LEU CB C 55 41.293 41.293 41.221 0.072 25685 2473 1 4 . 1 1 55 55 LEU H H 55 8.255 8.255 8.380 -0.125 25685 2474 1 4 . 1 1 56 56 PHE N N 56 114.426 114.426 121.625 -7.199 25685 2475 1 4 . 1 1 56 56 PHE C C 56 177.507 177.507 174.729 2.778 25685 2476 1 4 . 1 1 56 56 PHE CA C 56 61.068 61.068 57.139 3.929 25685 2477 1 4 . 1 1 56 56 PHE CB C 56 40.107 40.107 40.006 0.101 25685 2478 1 4 . 1 1 56 56 PHE H H 56 7.590 7.590 7.887 -0.297 25685 2479 1 4 . 1 1 57 57 PHE N N 57 114.701 114.701 116.674 -1.973 25685 2480 1 4 . 1 1 57 57 PHE C C 57 176.203 176.203 177.097 -0.894 25685 2481 1 4 . 1 1 57 57 PHE CA C 57 58.503 58.503 57.344 1.159 25685 2482 1 4 . 1 1 57 57 PHE CB C 57 41.114 41.114 36.393 4.721 25685 2483 1 4 . 1 1 57 57 PHE H H 57 8.514 8.514 7.480 1.034 25685 2484 1 4 . 1 1 58 58 GLY N N 58 111.041 111.041 109.854 1.187 25685 2485 1 4 . 1 1 58 58 GLY C C 58 174.240 174.240 176.107 -1.867 25685 2486 1 4 . 1 1 58 58 GLY CA C 58 44.827 44.827 46.564 -1.737 25685 2487 1 4 . 1 1 58 58 GLY H H 58 7.998 7.998 8.689 -0.691 25685 2488 1 4 . 1 1 59 59 PHE N N 59 127.950 127.950 121.280 6.670 25685 2489 1 4 . 1 1 59 59 PHE C C 59 176.612 176.612 177.151 -0.539 25685 2490 1 4 . 1 1 59 59 PHE CA C 59 61.598 61.598 59.372 2.226 25685 2491 1 4 . 1 1 59 59 PHE CB C 59 40.870 40.870 38.584 2.286 25685 2492 1 4 . 1 1 59 59 PHE H H 59 9.105 9.105 8.021 1.084 25685 2493 1 4 . 1 1 60 60 PHE N N 60 114.868 114.868 120.104 -5.236 25685 2494 1 4 . 1 1 60 60 PHE C C 60 177.989 177.989 176.902 1.087 25685 2495 1 4 . 1 1 60 60 PHE CA C 60 61.517 61.517 61.758 -0.242 25685 2496 1 4 . 1 1 60 60 PHE CB C 60 38.248 38.248 39.302 -1.054 25685 2497 1 4 . 1 1 60 60 PHE H H 60 8.796 8.796 8.405 0.391 25685 2498 1 4 . 1 1 61 61 ARG N N 61 118.812 118.812 119.059 -0.247 25685 2499 1 4 . 1 1 61 61 ARG C C 61 177.813 177.813 178.454 -0.641 25685 2500 1 4 . 1 1 61 61 ARG CA C 61 60.497 60.497 59.358 1.139 25685 2501 1 4 . 1 1 61 61 ARG CB C 61 28.915 28.915 29.414 -0.499 25685 2502 1 4 . 1 1 61 61 ARG H H 61 7.600 7.600 7.706 -0.106 25685 2503 1 4 . 1 1 62 62 VAL N N 62 119.157 119.157 120.094 -0.937 25685 2504 1 4 . 1 1 62 62 VAL C C 62 177.670 177.670 178.067 -0.397 25685 2505 1 4 . 1 1 62 62 VAL CA C 62 66.749 66.749 65.804 0.945 25685 2506 1 4 . 1 1 62 62 VAL CB C 62 30.306 30.306 31.907 -1.601 25685 2507 1 4 . 1 1 62 62 VAL H H 62 7.679 7.679 7.534 0.145 25685 2508 1 4 . 1 1 63 63 VAL N N 63 117.999 117.999 118.845 -0.846 25685 2509 1 4 . 1 1 63 63 VAL C C 63 177.639 177.639 178.599 -0.960 25685 2510 1 4 . 1 1 63 63 VAL CA C 63 66.836 66.836 65.140 1.696 25685 2511 1 4 . 1 1 63 63 VAL CB C 63 30.496 30.496 30.506 -0.010 25685 2512 1 4 . 1 1 63 63 VAL H H 63 7.429 7.429 7.941 -0.512 25685 2513 1 4 . 1 1 64 64 ALA N N 64 120.451 120.451 122.810 -2.359 25685 2514 1 4 . 1 1 64 64 ALA C C 64 179.134 179.134 179.473 -0.339 25685 2515 1 4 . 1 1 64 64 ALA CA C 64 55.618 55.618 54.847 0.771 25685 2516 1 4 . 1 1 64 64 ALA CB C 64 17.950 17.950 17.506 0.444 25685 2517 1 4 . 1 1 64 64 ALA H H 64 8.169 8.169 7.913 0.256 25685 2518 1 4 . 1 1 65 65 MET N N 65 116.532 116.532 117.715 -1.183 25685 2519 1 4 . 1 1 65 65 MET C C 65 177.961 177.961 178.488 -0.527 25685 2520 1 4 . 1 1 65 65 MET CA C 65 58.161 58.161 58.876 -0.715 25685 2521 1 4 . 1 1 65 65 MET CB C 65 31.208 31.208 32.691 -1.483 25685 2522 1 4 . 1 1 65 65 MET H H 65 7.857 7.857 7.529 0.328 25685 2523 1 4 . 1 1 66 66 LEU C C 66 179.022 179.022 179.300 -0.278 25685 2524 1 4 . 1 1 66 66 LEU CA C 66 58.412 58.412 57.546 0.866 25685 2525 1 4 . 1 1 67 67 PHE N N 67 116.877 116.877 120.090 -3.213 25685 2526 1 4 . 1 1 67 67 PHE C C 67 177.908 177.908 176.986 0.922 25685 2527 1 4 . 1 1 67 67 PHE CA C 67 62.402 62.402 61.005 1.397 25685 2528 1 4 . 1 1 67 67 PHE CB C 67 39.203 39.203 38.881 0.322 25685 2529 1 4 . 1 1 67 67 PHE H H 67 7.923 7.923 7.513 0.410 25685 2530 1 4 . 1 1 68 68 LEU N N 68 118.860 118.860 119.414 -0.554 25685 2531 1 4 . 1 1 68 68 LEU C C 68 179.032 179.032 178.308 0.724 25685 2532 1 4 . 1 1 68 68 LEU CA C 68 58.397 58.397 57.566 0.831 25685 2533 1 4 . 1 1 68 68 LEU CB C 68 40.803 40.803 41.848 -1.045 25685 2534 1 4 . 1 1 68 68 LEU H H 68 8.167 8.167 7.618 0.549 25685 2535 1 4 . 1 1 71 71 PHE N N 71 120.700 120.700 118.549 2.151 25685 2536 1 4 . 1 1 71 71 PHE C C 71 177.670 177.670 177.583 0.087 25685 2537 1 4 . 1 1 71 71 PHE CA C 71 60.528 60.528 61.186 -0.658 25685 2538 1 4 . 1 1 71 71 PHE H H 71 7.847 7.847 7.436 0.411 25685 2539 1 4 . 1 1 72 72 ALA N N 72 120.506 120.506 122.721 -2.215 25685 2540 1 4 . 1 1 72 72 ALA C C 72 178.944 178.944 179.175 -0.231 25685 2541 1 4 . 1 1 72 72 ALA CA C 72 55.461 55.461 54.816 0.645 25685 2542 1 4 . 1 1 72 72 ALA CB C 72 17.829 17.829 18.241 -0.412 25685 2543 1 4 . 1 1 72 72 ALA H H 72 8.533 8.533 8.306 0.227 25685 2544 1 4 . 1 1 73 73 LEU N N 73 115.071 115.071 119.441 -4.370 25685 2545 1 4 . 1 1 73 73 LEU C C 73 180.831 180.831 178.168 2.663 25685 2546 1 4 . 1 1 73 73 LEU CA C 73 58.091 58.091 57.681 0.410 25685 2547 1 4 . 1 1 73 73 LEU CB C 73 41.082 41.082 41.886 -0.804 25685 2548 1 4 . 1 1 73 73 LEU H H 73 8.458 8.458 8.346 0.112 25685 2549 1 4 . 1 1 74 74 ILE N N 74 121.365 121.365 118.974 2.391 25685 2550 1 4 . 1 1 74 74 ILE C C 74 178.287 178.287 177.213 1.074 25685 2551 1 4 . 1 1 74 74 ILE CA C 74 65.335 65.335 64.417 0.918 25685 2552 1 4 . 1 1 74 74 ILE CB C 74 37.453 37.453 37.672 -0.219 25685 2553 1 4 . 1 1 74 74 ILE H H 74 8.220 8.220 7.291 0.929 25685 2554 1 4 . 1 1 75 75 LEU N N 75 119.200 119.200 120.690 -1.490 25685 2555 1 4 . 1 1 75 75 LEU C C 75 177.548 177.548 177.687 -0.139 25685 2556 1 4 . 1 1 75 75 LEU CA C 75 56.938 56.938 57.541 -0.603 25685 2557 1 4 . 1 1 75 75 LEU CB C 75 41.541 41.541 41.384 0.157 25685 2558 1 4 . 1 1 75 75 LEU H H 75 7.866 7.866 7.391 0.475 25685 2559 1 4 . 1 1 76 76 LEU N N 76 116.338 116.338 116.865 -0.527 25685 2560 1 4 . 1 1 76 76 LEU C C 76 176.889 176.889 178.674 -1.785 25685 2561 1 4 . 1 1 76 76 LEU CA C 76 54.807 54.807 57.098 -2.291 25685 2562 1 4 . 1 1 76 76 LEU CB C 76 41.830 41.830 41.778 0.052 25685 2563 1 4 . 1 1 76 76 LEU H H 76 7.432 7.432 7.456 -0.024 25685 2564 1 4 . 1 1 77 77 SER N N 77 114.630 114.630 112.922 1.708 25685 2565 1 4 . 1 1 77 77 SER C C 77 174.752 174.752 175.349 -0.597 25685 2566 1 4 . 1 1 77 77 SER CA C 77 58.967 58.967 60.157 -1.190 25685 2567 1 4 . 1 1 77 77 SER CB C 77 64.686 64.686 63.542 1.144 25685 2568 1 4 . 1 1 77 77 SER H H 77 7.423 7.423 7.883 -0.460 25685 2569 1 4 . 1 1 78 78 ASP N N 78 123.054 123.054 121.575 1.479 25685 2570 1 4 . 1 1 78 78 ASP C C 78 176.716 176.716 175.619 1.097 25685 2571 1 4 . 1 1 78 78 ASP CA C 78 54.848 54.848 55.125 -0.277 25685 2572 1 4 . 1 1 78 78 ASP CB C 78 40.423 40.423 41.646 -1.223 25685 2573 1 4 . 1 1 78 78 ASP H H 78 8.294 8.294 7.652 0.642 25685 2574 1 4 . 1 1 79 79 GLU N N 79 119.104 119.104 120.359 -1.255 25685 2575 1 4 . 1 1 79 79 GLU C C 79 176.391 176.391 176.209 0.182 25685 2576 1 4 . 1 1 79 79 GLU CA C 79 56.258 56.258 56.239 0.019 25685 2577 1 4 . 1 1 79 79 GLU CB C 79 29.656 29.656 30.509 -0.853 25685 2578 1 4 . 1 1 79 79 GLU H H 79 8.384 8.384 8.449 -0.065 25685 2579 1 4 . 1 1 80 80 LEU N N 80 121.254 121.254 124.575 -3.321 25685 2580 1 4 . 1 1 80 80 LEU C C 80 177.164 177.164 176.500 0.664 25685 2581 1 4 . 1 1 80 80 LEU CA C 80 54.670 54.670 55.344 -0.674 25685 2582 1 4 . 1 1 80 80 LEU CB C 80 42.633 42.633 41.681 0.952 25685 2583 1 4 . 1 1 80 80 LEU H H 80 7.637 7.637 8.469 -0.832 25685 2584 1 4 . 1 1 81 81 ASP N N 81 123.410 123.410 126.198 -2.788 25685 2585 1 4 . 1 1 81 81 ASP C C 81 177.552 177.552 176.605 0.947 25685 2586 1 4 . 1 1 81 81 ASP CA C 81 55.110 55.110 53.833 1.277 25685 2587 1 4 . 1 1 81 81 ASP CB C 81 42.693 42.693 40.188 2.505 25685 2588 1 4 . 1 1 81 81 ASP H H 81 8.403 8.403 8.430 -0.027 25685 2589 1 4 . 1 1 82 82 GLU N N 82 125.047 125.047 123.641 1.406 25685 2590 1 4 . 1 1 82 82 GLU C C 82 178.198 178.198 177.615 0.583 25685 2591 1 4 . 1 1 82 82 GLU CA C 82 59.221 59.221 59.633 -0.412 25685 2592 1 4 . 1 1 82 82 GLU CB C 82 29.176 29.176 29.163 0.013 25685 2593 1 4 . 1 1 82 82 GLU H H 82 8.744 8.744 7.902 0.842 25685 2594 1 4 . 1 1 83 83 LYS N N 83 118.476 118.476 119.984 -1.508 25685 2595 1 4 . 1 1 83 83 LYS C C 83 179.356 179.356 179.024 0.332 25685 2596 1 4 . 1 1 83 83 LYS CA C 83 59.170 59.170 58.608 0.562 25685 2597 1 4 . 1 1 83 83 LYS CB C 83 31.509 31.509 31.997 -0.488 25685 2598 1 4 . 1 1 83 83 LYS H H 83 8.607 8.607 8.436 0.171 25685 2599 1 4 . 1 1 84 84 VAL N N 84 118.407 118.407 119.603 -1.196 25685 2600 1 4 . 1 1 84 84 VAL C C 84 177.653 177.653 177.552 0.101 25685 2601 1 4 . 1 1 84 84 VAL CA C 84 65.416 65.416 65.932 -0.516 25685 2602 1 4 . 1 1 84 84 VAL CB C 84 31.313 31.313 31.785 -0.472 25685 2603 1 4 . 1 1 84 84 VAL H H 84 7.870 7.870 8.266 -0.396 25685 2604 1 4 . 1 1 85 85 SER N N 85 116.146 116.146 116.593 -0.447 25685 2605 1 4 . 1 1 85 85 SER C C 85 177.496 177.496 176.978 0.518 25685 2606 1 4 . 1 1 85 85 SER CA C 85 61.764 61.764 62.078 -0.314 25685 2607 1 4 . 1 1 85 85 SER CB C 85 63.654 63.654 63.114 0.540 25685 2608 1 4 . 1 1 85 85 SER H H 85 8.083 8.083 8.354 -0.271 25685 2609 1 4 . 1 1 86 86 ILE N N 86 122.570 122.570 121.909 0.661 25685 2610 1 4 . 1 1 86 86 ILE C C 86 178.698 178.698 177.158 1.540 25685 2611 1 4 . 1 1 86 86 ILE CA C 86 64.526 64.526 63.692 0.834 25685 2612 1 4 . 1 1 86 86 ILE CB C 86 37.393 37.393 37.786 -0.393 25685 2613 1 4 . 1 1 86 86 ILE H H 86 8.102 8.102 7.314 0.788 25685 2614 1 4 . 1 1 87 87 PHE N N 87 121.340 121.340 121.690 -0.350 25685 2615 1 4 . 1 1 87 87 PHE C C 87 177.671 177.671 177.327 0.344 25685 2616 1 4 . 1 1 87 87 PHE CA C 87 61.098 61.098 61.771 -0.673 25685 2617 1 4 . 1 1 87 87 PHE CB C 87 39.151 39.151 38.872 0.279 25685 2618 1 4 . 1 1 87 87 PHE H H 87 7.719 7.719 8.365 -0.646 25685 2619 1 4 . 1 1 88 88 ALA N N 88 120.921 120.921 120.949 -0.028 25685 2620 1 4 . 1 1 88 88 ALA C C 88 180.030 180.030 179.378 0.652 25685 2621 1 4 . 1 1 88 88 ALA CA C 88 55.147 55.147 54.857 0.290 25685 2622 1 4 . 1 1 88 88 ALA CB C 88 19.053 19.053 18.094 0.959 25685 2623 1 4 . 1 1 88 88 ALA H H 88 8.679 8.679 8.071 0.608 25685 2624 1 4 . 1 1 89 89 SER N N 89 114.285 114.285 115.157 -0.872 25685 2625 1 4 . 1 1 89 89 SER C C 89 177.040 177.040 176.317 0.723 25685 2626 1 4 . 1 1 89 89 SER CA C 89 61.314 61.314 61.399 -0.085 25685 2627 1 4 . 1 1 89 89 SER CB C 89 63.371 63.371 62.309 1.062 25685 2628 1 4 . 1 1 89 89 SER H H 89 8.242 8.242 7.642 0.600 25685 2629 1 4 . 1 1 90 90 ARG N N 90 121.829 121.829 121.733 0.096 25685 2630 1 4 . 1 1 90 90 ARG C C 90 179.247 179.247 177.840 1.407 25685 2631 1 4 . 1 1 90 90 ARG CA C 90 58.444 58.444 58.388 0.056 25685 2632 1 4 . 1 1 90 90 ARG CB C 90 29.532 29.532 28.986 0.546 25685 2633 1 4 . 1 1 90 90 ARG H H 90 7.907 7.907 7.356 0.551 25685 2634 1 4 . 1 1 91 91 MET N N 91 117.124 117.124 116.437 0.687 25685 2635 1 4 . 1 1 91 91 MET C C 91 177.504 177.504 178.058 -0.554 25685 2636 1 4 . 1 1 91 91 MET CA C 91 57.152 57.152 59.547 -2.395 25685 2637 1 4 . 1 1 91 91 MET CB C 91 32.510 32.510 31.712 0.798 25685 2638 1 4 . 1 1 91 91 MET H H 91 7.930 7.930 7.541 0.389 25685 2639 1 4 . 1 1 92 92 THR N N 92 108.478 108.478 114.100 -5.622 25685 2640 1 4 . 1 1 92 92 THR C C 92 176.367 176.367 175.988 0.379 25685 2641 1 4 . 1 1 92 92 THR CA C 92 63.564 63.564 65.591 -2.027 25685 2642 1 4 . 1 1 92 92 THR H H 92 7.847 7.847 7.604 0.243 25685 2643 1 4 . 1 1 93 93 SER N N 93 117.950 117.950 115.305 2.645 25685 2644 1 4 . 1 1 93 93 SER C C 93 176.552 176.552 176.091 0.461 25685 2645 1 4 . 1 1 93 93 SER CA C 93 60.821 60.821 60.800 0.021 25685 2646 1 4 . 1 1 93 93 SER CB C 93 63.311 63.311 63.407 -0.096 25685 2647 1 4 . 1 1 93 93 SER H H 93 7.732 7.732 7.386 0.346 25685 2648 1 4 . 1 1 94 94 GLY N N 94 111.265 111.265 108.800 2.465 25685 2649 1 4 . 1 1 94 94 GLY C C 94 175.198 175.198 174.611 0.587 25685 2650 1 4 . 1 1 94 94 GLY CA C 94 46.021 46.021 44.981 1.040 25685 2651 1 4 . 1 1 94 94 GLY H H 94 8.419 8.419 7.823 0.596 25685 2652 1 4 . 1 1 95 95 LEU N N 95 121.019 121.019 121.566 -0.547 25685 2653 1 4 . 1 1 95 95 LEU C C 95 177.810 177.810 176.708 1.102 25685 2654 1 4 . 1 1 95 95 LEU CA C 95 56.012 56.012 55.781 0.231 25685 2655 1 4 . 1 1 95 95 LEU CB C 95 42.122 42.122 42.429 -0.307 25685 2656 1 4 . 1 1 95 95 LEU H H 95 7.849 7.849 7.663 0.186 25685 2657 1 4 . 1 1 96 96 SER N N 96 115.465 115.465 115.507 -0.042 25685 2658 1 4 . 1 1 96 96 SER C C 96 175.543 175.543 174.287 1.256 25685 2659 1 4 . 1 1 96 96 SER CA C 96 60.151 60.151 57.264 2.887 25685 2660 1 4 . 1 1 96 96 SER H H 96 8.349 8.349 8.149 0.200 25685 2661 1 4 . 1 1 97 97 TRP N N 97 121.711 121.711 120.187 1.524 25685 2662 1 4 . 1 1 97 97 TRP C C 97 176.973 176.973 177.994 -1.021 25685 2663 1 4 . 1 1 97 97 TRP CA C 97 58.250 58.250 59.825 -1.575 25685 2664 1 4 . 1 1 97 97 TRP CB C 97 28.899 28.899 28.102 0.797 25685 2665 1 4 . 1 1 97 97 TRP H H 97 7.723 7.723 8.160 -0.437 25685 2666 1 4 . 1 1 98 98 LYS N N 98 119.868 119.868 115.153 4.715 25685 2667 1 4 . 1 1 98 98 LYS C C 98 178.021 178.021 177.219 0.802 25685 2668 1 4 . 1 1 98 98 LYS CA C 98 56.340 56.340 58.652 -2.312 25685 2669 1 4 . 1 1 98 98 LYS CB C 98 31.933 31.933 30.784 1.149 25685 2670 1 4 . 1 1 98 98 LYS H H 98 7.855 7.855 8.617 -0.762 25685 2671 1 4 . 1 1 99 99 ILE N N 99 120.044 120.044 116.519 3.525 25685 2672 1 4 . 1 1 99 99 ILE C C 99 176.769 176.769 177.330 -0.561 25685 2673 1 4 . 1 1 99 99 ILE CA C 99 62.758 62.758 63.341 -0.583 25685 2674 1 4 . 1 1 99 99 ILE CB C 99 37.809 37.809 37.931 -0.122 25685 2675 1 4 . 1 1 99 99 ILE H H 99 8.069 8.069 8.380 -0.311 25685 2676 1 4 . 1 1 100 100 GLN C C 100 176.315 176.315 176.941 -0.626 25685 2677 1 4 . 1 1 100 100 GLN CA C 100 57.486 57.486 57.931 -0.445 25685 2678 1 4 . 1 1 101 101 THR N N 101 109.873 109.873 112.765 -2.892 25685 2679 1 4 . 1 1 101 101 THR C C 101 174.664 174.664 173.944 0.720 25685 2680 1 4 . 1 1 101 101 THR CA C 101 61.709 61.709 63.752 -2.043 25685 2681 1 4 . 1 1 101 101 THR CB C 101 69.290 69.290 68.526 0.764 25685 2682 1 4 . 1 1 101 101 THR H H 101 7.508 7.508 8.036 -0.528 25685 2683 1 4 . 1 1 102 102 LEU N N 102 124.434 124.434 120.023 4.411 25685 2684 1 4 . 1 1 102 102 LEU C C 102 174.681 174.681 174.882 -0.201 25685 2685 1 4 . 1 1 102 102 LEU CA C 102 53.063 53.063 54.763 -1.700 25685 2686 1 4 . 1 1 102 102 LEU CB C 102 41.139 41.139 41.243 -0.104 25685 2687 1 4 . 1 1 102 102 LEU H H 102 7.569 7.569 8.114 -0.545 25685 2688 1 4 . 1 1 103 103 PRO C C 103 178.076 178.076 176.220 1.856 25685 2689 1 4 . 1 1 103 103 PRO CA C 103 62.570 62.570 63.698 -1.128 25685 2690 1 4 . 1 1 103 103 PRO CB C 103 31.534 31.534 31.985 -0.451 25685 2691 1 4 . 1 1 104 104 SER N N 104 119.929 119.929 112.117 7.812 25685 2692 1 4 . 1 1 104 104 SER C C 104 176.432 176.432 174.461 1.971 25685 2693 1 4 . 1 1 104 104 SER CA C 104 61.976 61.976 59.226 2.750 25685 2694 1 4 . 1 1 104 104 SER CB C 104 63.611 63.611 63.331 0.280 25685 2695 1 4 . 1 1 104 104 SER H H 104 8.784 8.784 8.494 0.290 25685 2696 1 4 . 1 1 105 105 PHE N N 105 119.519 119.519 125.786 -6.267 25685 2697 1 4 . 1 1 105 105 PHE C C 105 176.852 176.852 174.030 2.822 25685 2698 1 4 . 1 1 105 105 PHE CA C 105 60.162 60.162 59.991 0.171 25685 2699 1 4 . 1 1 105 105 PHE CB C 105 38.455 38.455 39.015 -0.560 25685 2700 1 4 . 1 1 105 105 PHE H H 105 8.620 8.620 8.811 -0.191 25685 2701 1 4 . 1 1 106 106 PHE N N 106 118.809 118.809 114.246 4.563 25685 2702 1 4 . 1 1 106 106 PHE C C 106 176.741 176.741 174.937 1.804 25685 2703 1 4 . 1 1 106 106 PHE CA C 106 61.421 61.421 58.111 3.311 25685 2704 1 4 . 1 1 106 106 PHE CB C 106 38.788 38.788 37.223 1.565 25685 2705 1 4 . 1 1 106 106 PHE H H 106 7.519 7.519 7.924 -0.405 25685 2706 1 4 . 1 1 107 107 PHE N N 107 117.382 117.382 124.961 -7.579 25685 2707 1 4 . 1 1 107 107 PHE C C 107 177.771 177.771 175.748 2.023 25685 2708 1 4 . 1 1 107 107 PHE CA C 107 61.099 61.099 60.813 0.285 25685 2709 1 4 . 1 1 107 107 PHE CB C 107 38.677 38.677 39.459 -0.782 25685 2710 1 4 . 1 1 107 107 PHE H H 107 7.903 7.903 8.170 -0.267 25685 2711 1 4 . 1 1 108 108 GLY N N 108 105.340 105.340 106.776 -1.436 25685 2712 1 4 . 1 1 108 108 GLY C C 108 174.574 174.574 175.760 -1.186 25685 2713 1 4 . 1 1 108 108 GLY CA C 108 47.508 47.508 47.428 0.080 25685 2714 1 4 . 1 1 108 108 GLY H H 108 8.351 8.351 8.521 -0.170 25685 2715 1 4 . 1 1 109 109 MET N N 109 119.831 119.831 118.987 0.844 25685 2716 1 4 . 1 1 109 109 MET C C 109 177.522 177.522 177.581 -0.059 25685 2717 1 4 . 1 1 109 109 MET CA C 109 58.658 58.658 57.616 1.042 25685 2718 1 4 . 1 1 109 109 MET CB C 109 32.106 32.106 32.129 -0.023 25685 2719 1 4 . 1 1 109 109 MET H H 109 7.919 7.919 7.861 0.058 25685 2720 1 4 . 1 1 110 110 LEU N N 110 119.908 119.908 119.143 0.765 25685 2721 1 4 . 1 1 110 110 LEU C C 110 178.170 178.170 177.872 0.298 25685 2722 1 4 . 1 1 110 110 LEU CA C 110 57.941 57.941 57.566 0.375 25685 2723 1 4 . 1 1 110 110 LEU CB C 110 41.055 41.055 41.409 -0.354 25685 2724 1 4 . 1 1 110 110 LEU H H 110 7.744 7.744 7.495 0.249 25685 2725 1 4 . 1 1 111 111 LEU N N 111 116.594 116.594 118.976 -2.382 25685 2726 1 4 . 1 1 111 111 LEU C C 111 178.960 178.960 177.469 1.491 25685 2727 1 4 . 1 1 111 111 LEU CA C 111 57.366 57.366 57.440 -0.074 25685 2728 1 4 . 1 1 111 111 LEU CB C 111 40.259 40.259 41.057 -0.798 25685 2729 1 4 . 1 1 111 111 LEU H H 111 7.732 7.732 7.004 0.728 25685 2730 1 4 . 1 1 112 112 ALA N N 112 121.020 121.020 120.340 0.680 25685 2731 1 4 . 1 1 112 112 ALA C C 112 178.700 178.700 179.723 -1.023 25685 2732 1 4 . 1 1 112 112 ALA CA C 112 55.432 55.432 54.787 0.645 25685 2733 1 4 . 1 1 112 112 ALA CB C 112 18.214 18.214 17.811 0.403 25685 2734 1 4 . 1 1 112 112 ALA H H 112 8.121 8.121 7.189 0.932 25685 2735 1 4 . 1 1 113 113 PHE N N 113 118.369 118.369 115.846 2.523 25685 2736 1 4 . 1 1 113 113 PHE C C 113 176.091 176.091 177.937 -1.846 25685 2737 1 4 . 1 1 113 113 PHE CA C 113 61.388 61.388 58.429 2.959 25685 2738 1 4 . 1 1 113 113 PHE CB C 113 39.688 39.688 37.777 1.911 25685 2739 1 4 . 1 1 113 113 PHE H H 113 8.237 8.237 6.989 1.248 25685 2740 1 4 . 1 1 114 114 LEU N N 114 114.214 114.214 119.934 -5.720 25685 2741 1 4 . 1 1 114 114 LEU C C 114 177.038 177.038 178.436 -1.398 25685 2742 1 4 . 1 1 114 114 LEU CA C 114 56.358 56.358 57.094 -0.736 25685 2743 1 4 . 1 1 114 114 LEU CB C 114 42.716 42.716 42.123 0.593 25685 2744 1 4 . 1 1 114 114 LEU H H 114 7.576 7.576 7.638 -0.062 25685 2745 1 4 . 1 1 115 115 TRP N N 115 112.667 112.667 118.726 -6.059 25685 2746 1 4 . 1 1 115 115 TRP C C 115 180.163 180.163 177.530 2.633 25685 2747 1 4 . 1 1 115 115 TRP CA C 115 55.930 55.930 58.864 -2.934 25685 2748 1 4 . 1 1 115 115 TRP H H 115 8.542 8.542 7.798 0.744 25685 2749 1 4 . 1 1 116 116 LEU N N 116 122.144 122.144 120.987 1.157 25685 2750 1 4 . 1 1 116 116 LEU C C 116 175.953 175.953 175.874 0.079 25685 2751 1 4 . 1 1 116 116 LEU CA C 116 59.924 59.924 58.619 1.305 25685 2752 1 4 . 1 1 116 116 LEU CB C 116 39.097 39.097 40.408 -1.311 25685 2753 1 4 . 1 1 116 116 LEU H H 116 8.996 8.996 7.826 1.170 25685 2754 1 4 . 1 1 117 117 PRO C C 117 174.220 174.220 177.677 -3.457 25685 2755 1 4 . 1 1 117 117 PRO CA C 117 66.300 66.300 64.443 1.857 25685 2756 1 4 . 1 1 118 118 ALA N N 118 110.603 110.603 120.595 -9.992 25685 2757 1 4 . 1 1 118 118 ALA C C 118 177.162 177.162 178.516 -1.354 25685 2758 1 4 . 1 1 118 118 ALA CA C 118 52.670 52.670 52.367 0.303 25685 2759 1 4 . 1 1 118 118 ALA CB C 118 18.853 18.853 19.627 -0.773 25685 2760 1 4 . 1 1 118 118 ALA H H 118 6.633 6.633 7.546 -0.913 25685 2761 1 4 . 1 1 119 119 ILE N N 119 113.492 113.492 115.668 -2.176 25685 2762 1 4 . 1 1 119 119 ILE CA C 119 63.703 63.703 64.007 -0.304 25685 2763 1 4 . 1 1 119 119 ILE CB C 119 39.605 39.605 37.229 2.376 25685 2764 1 4 . 1 1 119 119 ILE H H 119 7.693 7.693 8.456 -0.763 25685 2765 1 4 . 1 1 121 121 PRO C C 121 178.089 178.089 179.151 -1.062 25685 2766 1 4 . 1 1 121 121 PRO CA C 121 66.004 66.004 65.796 0.208 25685 2767 1 4 . 1 1 122 122 PHE N N 122 113.797 113.797 119.293 -5.496 25685 2768 1 4 . 1 1 122 122 PHE C C 122 177.713 177.713 177.380 0.333 25685 2769 1 4 . 1 1 122 122 PHE CA C 122 61.566 61.566 60.744 0.822 25685 2770 1 4 . 1 1 122 122 PHE CB C 122 38.983 38.983 38.912 0.071 25685 2771 1 4 . 1 1 122 122 PHE H H 122 6.846 6.846 8.170 -1.324 25685 2772 1 4 . 1 1 123 123 ALA N N 123 121.512 121.512 120.857 0.655 25685 2773 1 4 . 1 1 123 123 ALA C C 123 179.318 179.318 179.724 -0.406 25685 2774 1 4 . 1 1 123 123 ALA CA C 123 54.975 54.975 55.153 -0.178 25685 2775 1 4 . 1 1 123 123 ALA CB C 123 17.881 17.881 18.029 -0.148 25685 2776 1 4 . 1 1 123 123 ALA H H 123 8.411 8.411 8.591 -0.180 25685 2777 1 4 . 1 1 124 124 GLY N N 124 104.093 104.093 107.075 -2.982 25685 2778 1 4 . 1 1 124 124 GLY C C 124 175.410 175.410 176.048 -0.638 25685 2779 1 4 . 1 1 124 124 GLY CA C 124 47.370 47.370 46.684 0.686 25685 2780 1 4 . 1 1 124 124 GLY H H 124 8.455 8.455 7.701 0.754 25685 2781 1 4 . 1 1 125 125 ILE N N 125 121.895 121.895 122.668 -0.773 25685 2782 1 4 . 1 1 125 125 ILE C C 125 178.329 178.329 176.936 1.393 25685 2783 1 4 . 1 1 125 125 ILE CA C 125 64.412 64.412 63.824 0.588 25685 2784 1 4 . 1 1 125 125 ILE H H 125 7.954 7.954 8.078 -0.124 25685 2785 1 4 . 1 1 126 126 ALA N N 126 122.768 122.768 121.647 1.121 25685 2786 1 4 . 1 1 126 126 ALA C C 126 180.341 180.341 179.207 1.134 25685 2787 1 4 . 1 1 126 126 ALA CA C 126 55.266 55.266 55.286 -0.020 25685 2788 1 4 . 1 1 126 126 ALA CB C 126 18.226 18.226 17.835 0.391 25685 2789 1 4 . 1 1 126 126 ALA H H 126 8.142 8.142 7.267 0.875 25685 2790 1 4 . 1 1 127 127 ILE N N 127 116.752 116.752 114.828 1.924 25685 2791 1 4 . 1 1 127 127 ILE C C 127 177.993 177.993 177.590 0.403 25685 2792 1 4 . 1 1 127 127 ILE CA C 127 63.877 63.877 64.138 -0.261 25685 2793 1 4 . 1 1 127 127 ILE CB C 127 37.657 37.657 37.308 0.349 25685 2794 1 4 . 1 1 127 127 ILE H H 127 8.335 8.335 7.290 1.045 25685 2795 1 4 . 1 1 128 128 SER N N 128 116.351 116.351 115.727 0.624 25685 2796 1 4 . 1 1 128 128 SER C C 128 175.796 175.796 176.434 -0.638 25685 2797 1 4 . 1 1 128 128 SER CA C 128 61.818 61.818 60.910 0.908 25685 2798 1 4 . 1 1 128 128 SER H H 128 7.939 7.939 7.549 0.390 25685 2799 1 4 . 1 1 129 129 GLN N N 129 118.082 118.082 120.580 -2.498 25685 2800 1 4 . 1 1 129 129 GLN C C 129 177.419 177.419 178.010 -0.591 25685 2801 1 4 . 1 1 129 129 GLN CA C 129 57.106 57.106 58.203 -1.097 25685 2802 1 4 . 1 1 129 129 GLN CB C 129 28.631 28.631 28.747 -0.116 25685 2803 1 4 . 1 1 129 129 GLN H H 129 7.943 7.943 7.766 0.177 25685 2804 1 4 . 1 1 130 130 THR N N 130 113.484 113.484 114.402 -0.918 25685 2805 1 4 . 1 1 130 130 THR C C 130 175.627 175.627 174.640 0.987 25685 2806 1 4 . 1 1 130 130 THR CA C 130 63.758 63.758 65.798 -2.040 25685 2807 1 4 . 1 1 130 130 THR CB C 130 69.182 69.182 69.102 0.080 25685 2808 1 4 . 1 1 130 130 THR H H 130 7.686 7.686 7.548 0.138 25685 2809 1 4 . 1 1 131 131 LEU N N 131 121.347 121.347 122.158 -0.811 25685 2810 1 4 . 1 1 131 131 LEU C C 131 177.522 177.522 176.044 1.478 25685 2811 1 4 . 1 1 131 131 LEU CA C 131 56.307 56.307 54.718 1.589 25685 2812 1 4 . 1 1 131 131 LEU CB C 131 41.711 41.711 40.487 1.224 25685 2813 1 4 . 1 1 131 131 LEU H H 131 8.071 8.071 7.556 0.515 25685 2814 1 4 . 1 1 132 132 LEU N N 132 118.162 118.162 124.428 -6.266 25685 2815 1 4 . 1 1 132 132 LEU C C 132 177.461 177.461 174.947 2.514 25685 2816 1 4 . 1 1 132 132 LEU CA C 132 55.264 55.264 55.391 -0.127 25685 2817 1 4 . 1 1 132 132 LEU CB C 132 41.613 41.613 42.235 -0.622 25685 2818 1 4 . 1 1 132 132 LEU H H 132 7.810 7.810 7.992 -0.182 25685 2819 1 4 . 1 1 133 133 SER N N 133 114.244 114.244 115.175 -0.931 25685 2820 1 4 . 1 1 133 133 SER C C 133 174.363 174.363 172.395 1.968 25685 2821 1 4 . 1 1 133 133 SER CA C 133 59.019 59.019 58.986 0.033 25685 2822 1 4 . 1 1 133 133 SER CB C 133 64.634 64.634 63.221 1.413 25685 2823 1 4 . 1 1 133 133 SER H H 133 7.829 7.829 8.415 -0.586 25685 2824 1 4 . 1 1 134 134 GLU N N 134 120.151 120.151 120.816 -0.665 25685 2825 1 4 . 1 1 134 134 GLU C C 134 175.935 175.935 173.626 2.309 25685 2826 1 4 . 1 1 134 134 GLU CA C 134 56.301 56.301 55.746 0.555 25685 2827 1 4 . 1 1 134 134 GLU CB C 134 30.129 30.129 32.257 -2.128 25685 2828 1 4 . 1 1 134 134 GLU H H 134 8.054 8.054 8.294 -0.240 25685 2829 1 4 . 1 1 135 135 ASN N N 135 118.890 118.890 120.493 -1.603 25685 2830 1 4 . 1 1 135 135 ASN C C 135 174.272 174.272 173.859 0.413 25685 2831 1 4 . 1 1 135 135 ASN CA C 135 51.390 51.390 51.189 0.201 25685 2832 1 4 . 1 1 135 135 ASN CB C 135 39.129 39.129 40.602 -1.473 25685 2833 1 4 . 1 1 135 135 ASN H H 135 8.305 8.305 8.455 -0.150 25685 2834 1 4 . 1 1 136 136 PRO C C 136 177.960 177.960 178.470 -0.510 25685 2835 1 4 . 1 1 136 136 PRO CA C 136 64.530 64.530 66.092 -1.562 25685 2836 1 4 . 1 1 136 136 PRO CB C 136 31.809 31.809 31.837 -0.028 25685 2837 1 4 . 1 1 137 137 LEU N N 137 117.735 117.735 115.281 2.454 25685 2838 1 4 . 1 1 137 137 LEU C C 137 179.217 179.217 178.968 0.249 25685 2839 1 4 . 1 1 137 137 LEU CA C 137 57.039 57.039 58.100 -1.061 25685 2840 1 4 . 1 1 137 137 LEU CB C 137 40.799 40.799 40.665 0.134 25685 2841 1 4 . 1 1 137 137 LEU H H 137 8.248 8.248 8.086 0.162 25685 2842 1 4 . 1 1 138 138 VAL N N 138 119.589 119.589 116.461 3.128 25685 2843 1 4 . 1 1 138 138 VAL C C 138 177.894 177.894 178.094 -0.200 25685 2844 1 4 . 1 1 138 138 VAL CA C 138 64.727 64.727 65.124 -0.397 25685 2845 1 4 . 1 1 138 138 VAL CB C 138 31.347 31.347 31.938 -0.591 25685 2846 1 4 . 1 1 138 138 VAL H H 138 7.483 7.483 7.842 -0.359 25685 2847 1 4 . 1 1 139 139 MET N N 139 119.431 119.431 120.314 -0.883 25685 2848 1 4 . 1 1 139 139 MET C C 139 177.988 177.988 179.091 -1.103 25685 2849 1 4 . 1 1 139 139 MET CA C 139 57.403 57.403 59.276 -1.873 25685 2850 1 4 . 1 1 139 139 MET CB C 139 31.709 31.709 32.630 -0.921 25685 2851 1 4 . 1 1 139 139 MET H H 139 7.837 7.837 8.073 -0.236 25685 2852 1 4 . 1 1 140 140 LEU N N 140 119.686 119.686 120.727 -1.041 25685 2853 1 4 . 1 1 140 140 LEU C C 140 177.916 177.916 178.431 -0.515 25685 2854 1 4 . 1 1 140 140 LEU CA C 140 56.877 56.877 58.471 -1.594 25685 2855 1 4 . 1 1 140 140 LEU CB C 140 41.491 41.491 41.653 -0.162 25685 2856 1 4 . 1 1 140 140 LEU H H 140 7.926 7.926 8.612 -0.686 25685 2857 1 4 . 1 1 141 141 SER N N 141 114.167 114.167 115.750 -1.583 25685 2858 1 4 . 1 1 141 141 SER C C 141 176.030 176.030 177.029 -0.999 25685 2859 1 4 . 1 1 141 141 SER CA C 141 60.425 60.425 61.841 -1.416 25685 2860 1 4 . 1 1 141 141 SER CB C 141 63.956 63.956 62.964 0.992 25685 2861 1 4 . 1 1 141 141 SER H H 141 7.757 7.757 8.319 -0.562 25685 2862 1 4 . 1 1 142 142 TYR N N 142 121.679 121.679 123.582 -1.903 25685 2863 1 4 . 1 1 142 142 TYR C C 142 177.659 177.659 178.353 -0.694 25685 2864 1 4 . 1 1 142 142 TYR CA C 142 59.673 59.673 61.470 -1.797 25685 2865 1 4 . 1 1 142 142 TYR CB C 142 38.079 38.079 38.200 -0.121 25685 2866 1 4 . 1 1 142 142 TYR H H 142 7.965 7.965 8.698 -0.733 25685 2867 1 4 . 1 1 143 143 GLY N N 143 107.396 107.396 107.621 -0.225 25685 2868 1 4 . 1 1 143 143 GLY C C 143 174.877 174.877 175.821 -0.944 25685 2869 1 4 . 1 1 143 143 GLY CA C 143 46.343 46.343 47.318 -0.975 25685 2870 1 4 . 1 1 143 143 GLY H H 143 8.177 8.177 8.962 -0.785 25685 2871 1 4 . 1 1 144 144 LEU N N 144 120.477 120.477 123.111 -2.634 25685 2872 1 4 . 1 1 144 144 LEU C C 144 178.504 178.504 178.484 0.020 25685 2873 1 4 . 1 1 144 144 LEU CA C 144 56.270 56.270 57.724 -1.454 25685 2874 1 4 . 1 1 144 144 LEU CB C 144 41.662 41.662 41.967 -0.305 25685 2875 1 4 . 1 1 144 144 LEU H H 144 8.055 8.055 7.495 0.560 25685 2876 1 4 . 1 1 145 145 GLY N N 145 106.847 106.847 106.398 0.449 25685 2877 1 4 . 1 1 145 145 GLY C C 145 175.375 175.375 176.215 -0.840 25685 2878 1 4 . 1 1 145 145 GLY CA C 145 45.582 45.582 47.083 -1.501 25685 2879 1 4 . 1 1 145 145 GLY H H 145 8.066 8.066 7.683 0.383 25685 2880 1 4 . 1 1 146 146 MET N N 146 120.376 120.376 121.910 -1.534 25685 2881 1 4 . 1 1 146 146 MET C C 146 176.663 176.663 178.194 -1.531 25685 2882 1 4 . 1 1 146 146 MET CA C 146 57.030 57.030 57.782 -0.752 25685 2883 1 4 . 1 1 146 146 MET CB C 146 30.720 30.720 32.298 -1.578 25685 2884 1 4 . 1 1 146 146 MET H H 146 8.157 8.157 8.699 -0.542 25685 2885 1 4 . 1 1 147 147 ALA N N 147 123.038 123.038 121.861 1.177 25685 2886 1 4 . 1 1 147 147 ALA C C 147 178.917 178.917 179.642 -0.725 25685 2887 1 4 . 1 1 147 147 ALA CA C 147 54.201 54.201 55.280 -1.079 25685 2888 1 4 . 1 1 147 147 ALA CB C 147 18.810 18.810 18.212 0.598 25685 2889 1 4 . 1 1 147 147 ALA H H 147 8.336 8.336 8.472 -0.136 25685 2890 1 4 . 1 1 148 148 VAL N N 148 117.795 117.795 117.691 0.104 25685 2891 1 4 . 1 1 148 148 VAL C C 148 176.891 176.891 178.111 -1.220 25685 2892 1 4 . 1 1 148 148 VAL CA C 148 64.157 64.157 66.663 -2.506 25685 2893 1 4 . 1 1 148 148 VAL CB C 148 31.529 31.529 31.580 -0.051 25685 2894 1 4 . 1 1 148 148 VAL H H 148 7.908 7.908 7.536 0.372 25685 2895 1 4 . 1 1 149 149 THR N N 149 116.069 116.069 115.201 0.868 25685 2896 1 4 . 1 1 149 149 THR C C 149 176.054 176.054 176.203 -0.149 25685 2897 1 4 . 1 1 149 149 THR CA C 149 63.308 63.308 66.255 -2.947 25685 2898 1 4 . 1 1 149 149 THR H H 149 7.414 7.414 7.417 -0.003 25685 2899 1 4 . 1 1 150 150 ILE N N 150 121.971 121.971 121.397 0.574 25685 2900 1 4 . 1 1 150 150 ILE C C 150 177.715 177.715 176.748 0.967 25685 2901 1 4 . 1 1 150 150 ILE CA C 150 64.319 64.319 63.419 0.900 25685 2902 1 4 . 1 1 150 150 ILE CB C 150 36.628 36.628 37.675 -1.047 25685 2903 1 4 . 1 1 150 150 ILE H H 150 8.772 8.772 8.029 0.743 25685 2904 1 4 . 1 1 151 151 ALA N N 151 122.272 122.272 121.431 0.841 25685 2905 1 4 . 1 1 151 151 ALA C C 151 180.370 180.370 179.516 0.854 25685 2906 1 4 . 1 1 151 151 ALA CA C 151 55.336 55.336 55.241 0.095 25685 2907 1 4 . 1 1 151 151 ALA CB C 151 18.107 18.107 17.927 0.180 25685 2908 1 4 . 1 1 151 151 ALA H H 151 8.163 8.163 7.533 0.630 25685 2909 1 4 . 1 1 152 152 ALA N N 152 120.648 120.648 121.436 -0.788 25685 2910 1 4 . 1 1 152 152 ALA C C 152 181.019 181.019 180.092 0.927 25685 2911 1 4 . 1 1 152 152 ALA CA C 152 54.944 54.944 54.912 0.032 25685 2912 1 4 . 1 1 152 152 ALA CB C 152 18.963 18.963 18.454 0.509 25685 2913 1 4 . 1 1 152 152 ALA H H 152 7.877 7.877 7.564 0.313 25685 2914 1 4 . 1 1 153 153 VAL N N 153 119.372 119.372 119.475 -0.103 25685 2915 1 4 . 1 1 153 153 VAL C C 153 178.197 178.197 177.647 0.550 25685 2916 1 4 . 1 1 153 153 VAL CA C 153 66.289 66.289 65.189 1.100 25685 2917 1 4 . 1 1 153 153 VAL CB C 153 30.770 30.770 30.884 -0.114 25685 2918 1 4 . 1 1 153 153 VAL H H 153 8.118 8.118 7.813 0.305 25685 2919 1 4 . 1 1 154 154 PHE N N 154 120.362 120.362 120.329 0.033 25685 2920 1 4 . 1 1 154 154 PHE C C 154 177.733 177.733 177.016 0.717 25685 2921 1 4 . 1 1 154 154 PHE CA C 154 61.412 61.412 61.500 -0.088 25685 2922 1 4 . 1 1 154 154 PHE CB C 154 38.465 38.465 38.717 -0.252 25685 2923 1 4 . 1 1 154 154 PHE H H 154 8.508 8.508 8.063 0.445 25685 2924 1 4 . 1 1 155 155 LYS N N 155 118.894 118.894 118.652 0.242 25685 2925 1 4 . 1 1 155 155 LYS C C 155 179.940 179.940 178.682 1.258 25685 2926 1 4 . 1 1 155 155 LYS CA C 155 58.969 58.969 58.930 0.039 25685 2927 1 4 . 1 1 155 155 LYS CB C 155 31.725 31.725 31.841 -0.116 25685 2928 1 4 . 1 1 155 155 LYS H H 155 8.035 8.035 7.670 0.365 25685 2929 1 4 . 1 1 156 156 MET N N 156 118.853 118.853 116.647 2.206 25685 2930 1 4 . 1 1 156 156 MET C C 156 179.245 179.245 177.462 1.783 25685 2931 1 4 . 1 1 156 156 MET CA C 156 58.518 58.518 57.196 1.322 25685 2932 1 4 . 1 1 156 156 MET CB C 156 31.912 31.912 30.723 1.189 25685 2933 1 4 . 1 1 156 156 MET H H 156 8.014 8.014 7.526 0.488 25685 2934 1 4 . 1 1 157 157 GLY N N 157 108.239 108.239 106.290 1.949 25685 2935 1 4 . 1 1 157 157 GLY C C 157 174.637 174.637 175.372 -0.735 25685 2936 1 4 . 1 1 157 157 GLY CA C 157 47.204 47.204 46.382 0.822 25685 2937 1 4 . 1 1 157 157 GLY H H 157 8.614 8.614 7.552 1.062 25685 2938 1 4 . 1 1 158 158 GLU N N 158 122.902 122.902 119.858 3.044 25685 2939 1 4 . 1 1 158 158 GLU C C 158 177.851 177.851 176.717 1.134 25685 2940 1 4 . 1 1 158 158 GLU CA C 158 60.203 60.203 56.984 3.219 25685 2941 1 4 . 1 1 158 158 GLU CB C 158 28.870 28.870 31.771 -2.901 25685 2942 1 4 . 1 1 158 158 GLU H H 158 8.550 8.550 7.734 0.816 25685 2943 1 4 . 1 1 159 159 LYS N N 159 117.932 117.932 114.108 3.824 25685 2944 1 4 . 1 1 159 159 LYS C C 159 179.529 179.529 175.914 3.615 25685 2945 1 4 . 1 1 159 159 LYS CA C 159 59.419 59.419 55.501 3.918 25685 2946 1 4 . 1 1 159 159 LYS CB C 159 31.759 31.759 33.862 -2.103 25685 2947 1 4 . 1 1 159 159 LYS H H 159 7.641 7.641 7.704 -0.063 25685 2948 1 4 . 1 1 160 160 PHE N N 160 120.614 120.614 119.731 0.883 25685 2949 1 4 . 1 1 160 160 PHE C C 160 178.511 178.511 175.383 3.128 25685 2950 1 4 . 1 1 160 160 PHE CA C 160 61.580 61.580 60.016 1.564 25685 2951 1 4 . 1 1 160 160 PHE CB C 160 39.909 39.909 38.621 1.288 25685 2952 1 4 . 1 1 160 160 PHE H H 160 8.026 8.026 7.528 0.498 25685 2953 1 4 . 1 1 161 161 VAL N N 161 119.870 119.870 117.688 2.182 25685 2954 1 4 . 1 1 161 161 VAL C C 161 177.347 177.347 174.678 2.669 25685 2955 1 4 . 1 1 161 161 VAL CA C 161 66.121 66.121 61.073 5.048 25685 2956 1 4 . 1 1 161 161 VAL CB C 161 30.935 30.935 34.710 -3.775 25685 2957 1 4 . 1 1 161 161 VAL H H 161 8.628 8.628 8.200 0.428 25685 2958 1 4 . 1 1 162 162 LYS N N 162 116.237 116.237 118.126 -1.889 25685 2959 1 4 . 1 1 162 162 LYS C C 162 179.197 179.197 176.427 2.770 25685 2960 1 4 . 1 1 162 162 LYS CA C 162 60.037 60.037 57.530 2.507 25685 2961 1 4 . 1 1 162 162 LYS CB C 162 31.333 31.333 33.097 -1.764 25685 2962 1 4 . 1 1 162 162 LYS H H 162 7.843 7.843 8.415 -0.572 25685 2963 1 4 . 1 1 163 163 ALA N N 163 119.197 119.197 119.768 -0.571 25685 2964 1 4 . 1 1 163 163 ALA C C 163 178.635 178.635 174.825 3.810 25685 2965 1 4 . 1 1 163 163 ALA CA C 163 53.681 53.681 51.495 2.186 25685 2966 1 4 . 1 1 163 163 ALA CB C 163 19.586 19.586 18.771 0.815 25685 2967 1 4 . 1 1 163 163 ALA H H 163 7.630 7.630 7.615 0.015 25685 2968 1 4 . 1 1 164 164 ASN N N 164 115.956 115.956 118.418 -2.462 25685 2969 1 4 . 1 1 164 164 ASN C C 164 175.556 175.556 176.387 -0.831 25685 2970 1 4 . 1 1 164 164 ASN CA C 164 52.267 52.267 53.437 -1.170 25685 2971 1 4 . 1 1 164 164 ASN CB C 164 39.148 39.148 38.512 0.636 25685 2972 1 4 . 1 1 164 164 ASN H H 164 7.326 7.326 8.225 -0.899 25685 2973 1 4 . 1 1 165 165 PHE N N 165 121.612 121.612 125.609 -3.997 25685 2974 1 4 . 1 1 165 165 PHE C C 165 177.069 177.069 177.147 -0.078 25685 2975 1 4 . 1 1 165 165 PHE CA C 165 62.921 62.921 60.812 2.109 25685 2976 1 4 . 1 1 165 165 PHE CB C 165 39.427 39.427 39.451 -0.024 25685 2977 1 4 . 1 1 165 165 PHE H H 165 7.408 7.408 8.775 -1.367 25685 2978 1 4 . 1 1 166 166 GLN N N 166 117.147 117.147 117.639 -0.492 25685 2979 1 4 . 1 1 166 166 GLN C C 166 178.922 178.922 178.570 0.352 25685 2980 1 4 . 1 1 166 166 GLN CA C 166 59.262 59.262 58.577 0.685 25685 2981 1 4 . 1 1 166 166 GLN CB C 166 26.811 26.811 27.746 -0.935 25685 2982 1 4 . 1 1 166 166 GLN H H 166 8.605 8.605 8.692 -0.087 25685 2983 1 4 . 1 1 167 167 LEU N N 167 121.946 121.946 119.627 2.319 25685 2984 1 4 . 1 1 167 167 LEU C C 167 178.863 178.863 178.842 0.021 25685 2985 1 4 . 1 1 167 167 LEU CA C 167 58.039 58.039 57.743 0.296 25685 2986 1 4 . 1 1 167 167 LEU CB C 167 41.130 41.130 41.563 -0.433 25685 2987 1 4 . 1 1 167 167 LEU H H 167 7.892 7.892 7.574 0.318 25685 2988 1 4 . 1 1 168 168 ILE N N 168 118.751 118.751 118.804 -0.053 25685 2989 1 4 . 1 1 168 168 ILE C C 168 179.908 179.908 177.107 2.801 25685 2990 1 4 . 1 1 168 168 ILE CA C 168 63.886 63.886 63.550 0.336 25685 2991 1 4 . 1 1 168 168 ILE CB C 168 36.170 36.170 37.854 -1.684 25685 2992 1 4 . 1 1 168 168 ILE H H 168 8.065 8.065 7.363 0.702 25685 2993 1 4 . 1 1 169 169 ARG N N 169 125.851 125.851 117.287 8.564 25685 2994 1 4 . 1 1 169 169 ARG C C 169 177.579 177.579 178.273 -0.694 25685 2995 1 4 . 1 1 169 169 ARG CA C 169 60.306 60.306 59.208 1.098 25685 2996 1 4 . 1 1 169 169 ARG CB C 169 29.224 29.224 29.654 -0.430 25685 2997 1 4 . 1 1 169 169 ARG H H 169 8.995 8.995 7.466 1.529 25685 2998 1 4 . 1 1 170 170 LYS N N 170 119.586 119.586 118.857 0.729 25685 2999 1 4 . 1 1 170 170 LYS C C 170 178.584 178.584 178.214 0.370 25685 3000 1 4 . 1 1 170 170 LYS CA C 170 60.293 60.293 59.560 0.733 25685 3001 1 4 . 1 1 170 170 LYS CB C 170 32.530 32.530 31.692 0.838 25685 3002 1 4 . 1 1 170 170 LYS H H 170 7.663 7.663 7.677 -0.014 25685 3003 1 4 . 1 1 171 171 VAL N N 171 118.348 118.348 119.046 -0.698 25685 3004 1 4 . 1 1 171 171 VAL C C 171 177.478 177.478 177.962 -0.484 25685 3005 1 4 . 1 1 171 171 VAL CA C 171 66.641 66.641 66.077 0.564 25685 3006 1 4 . 1 1 171 171 VAL CB C 171 31.565 31.565 30.910 0.655 25685 3007 1 4 . 1 1 171 171 VAL H H 171 8.515 8.515 7.532 0.983 25685 3008 1 4 . 1 1 172 172 THR N N 172 115.172 115.172 114.773 0.399 25685 3009 1 4 . 1 1 172 172 THR C C 172 176.320 176.320 176.447 -0.127 25685 3010 1 4 . 1 1 172 172 THR H H 172 8.416 8.416 7.530 0.886 25685 3011 1 4 . 1 1 173 173 GLY N N 173 108.801 108.801 109.082 -0.281 25685 3012 1 4 . 1 1 173 173 GLY C C 173 174.138 174.138 175.261 -1.123 25685 3013 1 4 . 1 1 173 173 GLY CA C 173 47.769 47.769 46.662 1.107 25685 3014 1 4 . 1 1 173 173 GLY H H 173 8.505 8.505 7.802 0.703 25685 3015 1 4 . 1 1 174 174 ALA N N 174 123.573 123.573 124.488 -0.915 25685 3016 1 4 . 1 1 174 174 ALA C C 174 178.782 178.782 178.841 -0.059 25685 3017 1 4 . 1 1 174 174 ALA CA C 174 55.604 55.604 54.991 0.613 25685 3018 1 4 . 1 1 174 174 ALA CB C 174 18.778 18.778 18.767 0.011 25685 3019 1 4 . 1 1 174 174 ALA H H 174 8.038 8.038 7.455 0.583 25685 3020 1 4 . 1 1 175 175 ILE N N 175 118.501 118.501 119.047 -0.546 25685 3021 1 4 . 1 1 175 175 ILE C C 175 178.247 178.247 177.441 0.806 25685 3022 1 4 . 1 1 175 175 ILE CA C 175 65.412 65.412 64.336 1.076 25685 3023 1 4 . 1 1 175 175 ILE CB C 175 37.671 37.671 38.369 -0.698 25685 3024 1 4 . 1 1 175 175 ILE H H 175 7.897 7.897 7.341 0.556 25685 3025 1 4 . 1 1 176 176 VAL N N 176 120.104 120.104 118.320 1.784 25685 3026 1 4 . 1 1 176 176 VAL C C 176 177.945 177.945 177.620 0.325 25685 3027 1 4 . 1 1 176 176 VAL CA C 176 67.761 67.761 66.085 1.676 25685 3028 1 4 . 1 1 176 176 VAL CB C 176 30.662 30.662 31.209 -0.547 25685 3029 1 4 . 1 1 176 176 VAL H H 176 8.321 8.321 7.516 0.805 25685 3030 1 4 . 1 1 177 177 LEU N N 177 118.561 118.561 120.068 -1.507 25685 3031 1 4 . 1 1 177 177 LEU C C 177 178.563 178.563 178.938 -0.375 25685 3032 1 4 . 1 1 177 177 LEU CA C 177 58.094 58.094 57.592 0.502 25685 3033 1 4 . 1 1 177 177 LEU CB C 177 41.061 41.061 41.242 -0.181 25685 3034 1 4 . 1 1 177 177 LEU H H 177 8.097 8.097 7.293 0.804 25685 3035 1 4 . 1 1 178 178 LEU N N 178 120.868 120.868 119.345 1.523 25685 3036 1 4 . 1 1 178 178 LEU C C 178 178.524 178.524 178.553 -0.029 25685 3037 1 4 . 1 1 178 178 LEU CA C 178 57.767 57.767 57.847 -0.080 25685 3038 1 4 . 1 1 178 178 LEU CB C 178 40.886 40.886 41.655 -0.769 25685 3039 1 4 . 1 1 178 178 LEU H H 178 8.229 8.229 7.295 0.934 25685 3040 1 4 . 1 1 179 179 TYR N N 179 119.355 119.355 118.750 0.605 25685 3041 1 4 . 1 1 179 179 TYR C C 179 180.059 180.059 177.639 2.420 25685 3042 1 4 . 1 1 179 179 TYR CA C 179 63.844 63.844 61.222 2.622 25685 3043 1 4 . 1 1 179 179 TYR CB C 179 39.508 39.508 38.163 1.345 25685 3044 1 4 . 1 1 179 179 TYR H H 179 8.759 8.759 7.645 1.114 25685 3045 1 4 . 1 1 180 180 LEU N N 180 118.984 118.984 119.056 -0.072 25685 3046 1 4 . 1 1 180 180 LEU C C 180 179.079 179.079 179.230 -0.151 25685 3047 1 4 . 1 1 180 180 LEU CA C 180 58.879 58.879 57.743 1.135 25685 3048 1 4 . 1 1 180 180 LEU CB C 180 41.899 41.899 40.699 1.200 25685 3049 1 4 . 1 1 180 180 LEU H H 180 8.315 8.315 7.620 0.695 25685 3050 1 4 . 1 1 181 181 ALA N N 181 121.826 121.826 121.577 0.249 25685 3051 1 4 . 1 1 181 181 ALA C C 181 180.009 180.009 179.400 0.609 25685 3052 1 4 . 1 1 181 181 ALA CA C 181 55.700 55.700 54.858 0.841 25685 3053 1 4 . 1 1 181 181 ALA CB C 181 17.713 17.713 18.524 -0.811 25685 3054 1 4 . 1 1 181 181 ALA H H 181 8.480 8.480 8.327 0.153 25685 3055 1 4 . 1 1 182 182 TYR N N 182 118.039 118.039 117.958 0.081 25685 3056 1 4 . 1 1 182 182 TYR CA C 182 59.038 59.038 61.898 -2.860 25685 3057 1 4 . 1 1 182 182 TYR H H 182 8.856 8.856 7.864 0.992 25685 3058 1 4 . 1 1 183 183 PHE N N 183 124.769 124.769 117.893 6.876 25685 3059 1 4 . 1 1 183 183 PHE CA C 183 63.566 63.566 58.797 4.769 25685 3060 1 4 . 1 1 183 183 PHE H H 183 9.764 9.764 7.549 2.215 25685 3061 1 5 . 1 1 4 4 ALA N N 4 121.533 121.533 125.018 -3.485 25685 3062 1 5 . 1 1 4 4 ALA C C 4 177.632 177.632 178.759 -1.127 25685 3063 1 5 . 1 1 4 4 ALA CA C 4 55.117 55.117 55.556 -0.439 25685 3064 1 5 . 1 1 4 4 ALA CB C 4 18.448 18.448 18.483 -0.035 25685 3065 1 5 . 1 1 4 4 ALA H H 4 7.977 7.977 8.467 -0.490 25685 3066 1 5 . 1 1 5 5 PHE N N 5 119.988 119.988 116.866 3.122 25685 3067 1 5 . 1 1 5 5 PHE CA C 5 60.759 60.759 59.792 0.967 25685 3068 1 5 . 1 1 5 5 PHE CB C 5 39.221 39.221 37.890 1.331 25685 3069 1 5 . 1 1 5 5 PHE H H 5 8.210 8.210 8.259 -0.049 25685 3070 1 5 . 1 1 6 6 ALA C C 6 179.794 179.794 179.165 0.629 25685 3071 1 5 . 1 1 6 6 ALA CA C 6 55.619 55.619 54.046 1.573 25685 3072 1 5 . 1 1 6 6 ALA CB C 6 17.911 17.911 17.347 0.564 25685 3073 1 5 . 1 1 6 6 ALA H H 6 8.417 8.417 6.172 2.245 25685 3074 1 5 . 1 1 7 7 LEU N N 7 115.852 115.852 119.083 -3.231 25685 3075 1 5 . 1 1 7 7 LEU C C 7 180.196 180.196 178.790 1.406 25685 3076 1 5 . 1 1 7 7 LEU CA C 7 57.528 57.528 57.445 0.083 25685 3077 1 5 . 1 1 7 7 LEU CB C 7 40.060 40.060 41.744 -1.684 25685 3078 1 5 . 1 1 7 7 LEU H H 7 8.741 8.741 7.379 1.362 25685 3079 1 5 . 1 1 8 8 GLY N N 8 110.199 110.199 106.878 3.321 25685 3080 1 5 . 1 1 8 8 GLY C C 8 176.430 176.430 176.324 0.106 25685 3081 1 5 . 1 1 8 8 GLY CA C 8 46.960 46.960 47.677 -0.717 25685 3082 1 5 . 1 1 8 8 GLY H H 8 8.179 8.179 7.890 0.289 25685 3083 1 5 . 1 1 9 9 ILE N N 9 122.346 122.346 121.862 0.484 25685 3084 1 5 . 1 1 9 9 ILE C C 9 178.143 178.143 177.646 0.497 25685 3085 1 5 . 1 1 9 9 ILE CA C 9 65.048 65.048 63.676 1.371 25685 3086 1 5 . 1 1 9 9 ILE CB C 9 36.841 36.841 37.017 -0.175 25685 3087 1 5 . 1 1 9 9 ILE H H 9 7.788 7.788 7.226 0.562 25685 3088 1 5 . 1 1 10 10 LEU N N 10 117.560 117.560 120.155 -2.595 25685 3089 1 5 . 1 1 10 10 LEU C C 10 179.501 179.501 178.870 0.631 25685 3090 1 5 . 1 1 10 10 LEU CA C 10 58.068 58.068 57.943 0.125 25685 3091 1 5 . 1 1 10 10 LEU CB C 10 40.776 40.776 40.392 0.384 25685 3092 1 5 . 1 1 10 10 LEU H H 10 8.044 8.044 7.619 0.425 25685 3093 1 5 . 1 1 11 11 SER N N 11 113.830 113.830 113.738 0.092 25685 3094 1 5 . 1 1 11 11 SER CA C 11 61.769 61.769 60.997 0.772 25685 3095 1 5 . 1 1 11 11 SER CB C 11 63.395 63.395 63.147 0.248 25685 3096 1 5 . 1 1 11 11 SER H H 11 8.140 8.140 7.593 0.547 25685 3097 1 5 . 1 1 12 12 VAL N N 12 121.343 121.343 121.101 0.242 25685 3098 1 5 . 1 1 12 12 VAL C C 12 176.753 176.753 177.456 -0.703 25685 3099 1 5 . 1 1 12 12 VAL CA C 12 64.583 64.583 65.647 -1.064 25685 3100 1 5 . 1 1 12 12 VAL CB C 12 31.067 31.067 31.355 -0.288 25685 3101 1 5 . 1 1 12 12 VAL H H 12 7.587 7.587 7.054 0.533 25685 3102 1 5 . 1 1 13 13 PHE N N 13 115.225 115.225 119.492 -4.267 25685 3103 1 5 . 1 1 13 13 PHE C C 13 177.349 177.349 175.952 1.397 25685 3104 1 5 . 1 1 13 13 PHE CA C 13 58.730 58.730 60.330 -1.600 25685 3105 1 5 . 1 1 13 13 PHE CB C 13 39.785 39.785 39.240 0.544 25685 3106 1 5 . 1 1 13 13 PHE H H 13 7.474 7.474 7.872 -0.398 25685 3107 1 5 . 1 1 14 14 SER N N 14 116.075 116.075 113.379 2.696 25685 3108 1 5 . 1 1 14 14 SER H H 14 7.955 7.955 7.712 0.243 25685 3109 1 5 . 1 1 15 15 PRO C C 15 177.590 177.590 176.026 1.564 25685 3110 1 5 . 1 1 15 15 PRO CA C 15 65.464 65.464 62.354 3.110 25685 3111 1 5 . 1 1 16 16 ALA N N 16 116.288 116.288 120.539 -4.251 25685 3112 1 5 . 1 1 16 16 ALA C C 16 177.563 177.563 176.363 1.200 25685 3113 1 5 . 1 1 16 16 ALA CA C 16 53.010 53.010 52.017 0.993 25685 3114 1 5 . 1 1 16 16 ALA CB C 16 19.975 19.975 19.082 0.893 25685 3115 1 5 . 1 1 16 16 ALA H H 16 7.455 7.455 7.826 -0.371 25685 3116 1 5 . 1 1 17 17 VAL N N 17 112.072 112.072 119.459 -7.387 25685 3117 1 5 . 1 1 17 17 VAL CA C 17 63.117 63.117 61.180 1.937 25685 3118 1 5 . 1 1 17 17 VAL CB C 17 33.209 33.209 33.005 0.204 25685 3119 1 5 . 1 1 17 17 VAL H H 17 7.525 7.525 8.322 -0.797 25685 3120 1 5 . 1 1 18 18 LEU N N 18 121.205 121.205 123.394 -2.189 25685 3121 1 5 . 1 1 18 18 LEU CA C 18 58.971 58.971 58.775 0.196 25685 3122 1 5 . 1 1 18 18 LEU CB C 18 41.161 41.161 39.767 1.393 25685 3123 1 5 . 1 1 18 18 LEU H H 18 8.191 8.191 8.517 -0.326 25685 3124 1 5 . 1 1 19 19 PRO C C 19 177.697 177.697 177.078 0.619 25685 3125 1 5 . 1 1 19 19 PRO CA C 19 65.181 65.181 63.761 1.420 25685 3126 1 5 . 1 1 20 20 VAL N N 20 111.723 111.723 116.761 -5.038 25685 3127 1 5 . 1 1 20 20 VAL C C 20 177.137 177.137 174.920 2.217 25685 3128 1 5 . 1 1 20 20 VAL CA C 20 62.494 62.494 63.471 -0.978 25685 3129 1 5 . 1 1 20 20 VAL CB C 20 31.677 31.677 31.526 0.151 25685 3130 1 5 . 1 1 20 20 VAL H H 20 7.571 7.571 8.018 -0.447 25685 3131 1 5 . 1 1 21 21 VAL N N 21 121.705 121.705 121.579 0.126 25685 3132 1 5 . 1 1 21 21 VAL CA C 21 68.305 68.305 64.212 4.093 25685 3133 1 5 . 1 1 21 21 VAL H H 21 7.732 7.732 7.926 -0.194 25685 3134 1 5 . 1 1 24 24 ILE C C 24 174.359 174.359 174.661 -0.302 25685 3135 1 5 . 1 1 25 25 PHE N N 25 120.132 120.132 127.415 -7.283 25685 3136 1 5 . 1 1 25 25 PHE C C 25 175.945 175.945 174.896 1.049 25685 3137 1 5 . 1 1 25 25 PHE CA C 25 60.544 60.544 59.574 0.970 25685 3138 1 5 . 1 1 25 25 PHE H H 25 8.082 8.082 9.038 -0.956 25685 3139 1 5 . 1 1 26 26 ALA N N 26 121.341 121.341 125.627 -4.286 25685 3140 1 5 . 1 1 26 26 ALA CB C 26 19.784 19.784 22.110 -2.325 25685 3141 1 5 . 1 1 26 26 ALA H H 26 7.539 7.539 8.075 -0.536 25685 3142 1 5 . 1 1 27 27 GLY N N 27 107.530 107.530 104.855 2.675 25685 3143 1 5 . 1 1 27 27 GLY C C 27 174.252 174.252 172.344 1.908 25685 3144 1 5 . 1 1 27 27 GLY CA C 27 45.474 45.474 44.804 0.669 25685 3145 1 5 . 1 1 27 27 GLY H H 27 7.997 7.997 8.605 -0.608 25685 3146 1 5 . 1 1 28 28 SER N N 28 116.299 116.299 114.583 1.716 25685 3147 1 5 . 1 1 28 28 SER C C 28 175.759 175.759 174.442 1.317 25685 3148 1 5 . 1 1 28 28 SER CA C 28 58.526 58.526 57.130 1.396 25685 3149 1 5 . 1 1 28 28 SER CB C 28 64.373 64.373 65.718 -1.345 25685 3150 1 5 . 1 1 28 28 SER H H 28 8.115 8.115 8.260 -0.145 25685 3151 1 5 . 1 1 34 34 ASP C C 34 177.621 177.621 178.148 -0.527 25685 3152 1 5 . 1 1 34 34 ASP CA C 34 57.082 57.082 57.452 -0.370 25685 3153 1 5 . 1 1 35 35 ALA N N 35 120.662 120.662 121.525 -0.863 25685 3154 1 5 . 1 1 35 35 ALA C C 35 179.168 179.168 179.790 -0.622 25685 3155 1 5 . 1 1 35 35 ALA CA C 35 55.459 55.459 54.872 0.587 25685 3156 1 5 . 1 1 35 35 ALA CB C 35 18.819 18.819 18.272 0.547 25685 3157 1 5 . 1 1 35 35 ALA H H 35 8.090 8.090 7.488 0.602 25685 3158 1 5 . 1 1 36 36 PHE N N 36 117.638 117.638 117.598 0.040 25685 3159 1 5 . 1 1 36 36 PHE C C 36 177.057 177.057 177.735 -0.678 25685 3160 1 5 . 1 1 36 36 PHE CA C 36 61.472 61.472 61.630 -0.158 25685 3161 1 5 . 1 1 36 36 PHE CB C 36 38.860 38.860 38.944 -0.084 25685 3162 1 5 . 1 1 36 36 PHE H H 36 8.227 8.227 7.550 0.677 25685 3163 1 5 . 1 1 37 37 LEU N N 37 119.312 119.312 120.185 -0.873 25685 3164 1 5 . 1 1 37 37 LEU C C 37 179.798 179.798 178.308 1.490 25685 3165 1 5 . 1 1 37 37 LEU CA C 37 58.181 58.181 57.852 0.329 25685 3166 1 5 . 1 1 37 37 LEU CB C 37 40.835 40.835 41.861 -1.026 25685 3167 1 5 . 1 1 37 37 LEU H H 37 8.588 8.588 7.595 0.993 25685 3168 1 5 . 1 1 38 38 ILE N N 38 119.057 119.057 118.707 0.350 25685 3169 1 5 . 1 1 38 38 ILE C C 38 177.597 177.597 177.161 0.436 25685 3170 1 5 . 1 1 38 38 ILE CA C 38 64.827 64.827 64.459 0.368 25685 3171 1 5 . 1 1 38 38 ILE CB C 38 36.321 36.321 37.668 -1.347 25685 3172 1 5 . 1 1 38 38 ILE H H 38 7.932 7.932 7.410 0.522 25685 3173 1 5 . 1 1 39 39 VAL N N 39 118.758 118.758 118.578 0.180 25685 3174 1 5 . 1 1 39 39 VAL C C 39 179.533 179.533 177.929 1.604 25685 3175 1 5 . 1 1 39 39 VAL CA C 39 66.687 66.687 65.781 0.906 25685 3176 1 5 . 1 1 39 39 VAL CB C 39 30.598 30.598 31.214 -0.616 25685 3177 1 5 . 1 1 39 39 VAL H H 39 7.922 7.922 7.267 0.655 25685 3178 1 5 . 1 1 40 40 ALA N N 40 125.385 125.385 121.529 3.856 25685 3179 1 5 . 1 1 40 40 ALA C C 40 179.200 179.200 179.690 -0.490 25685 3180 1 5 . 1 1 40 40 ALA CA C 40 55.283 55.283 54.798 0.485 25685 3181 1 5 . 1 1 40 40 ALA CB C 40 17.197 17.197 18.532 -1.335 25685 3182 1 5 . 1 1 40 40 ALA H H 40 9.091 9.091 7.327 1.764 25685 3183 1 5 . 1 1 41 41 GLY N N 41 106.978 106.978 107.055 -0.077 25685 3184 1 5 . 1 1 41 41 GLY C C 41 176.171 176.171 175.994 0.177 25685 3185 1 5 . 1 1 41 41 GLY CA C 41 47.322 47.322 47.060 0.262 25685 3186 1 5 . 1 1 41 41 GLY H H 41 8.565 8.565 7.963 0.602 25685 3187 1 5 . 1 1 42 42 LEU N N 42 126.914 126.914 118.567 8.347 25685 3188 1 5 . 1 1 42 42 LEU C C 42 178.119 178.119 178.932 -0.813 25685 3189 1 5 . 1 1 42 42 LEU CA C 42 58.523 58.523 57.567 0.956 25685 3190 1 5 . 1 1 42 42 LEU CB C 42 42.125 42.125 41.199 0.926 25685 3191 1 5 . 1 1 42 42 LEU H H 42 8.573 8.573 7.457 1.116 25685 3192 1 5 . 1 1 46 46 MET N N 46 121.710 121.710 122.347 -0.637 25685 3193 1 5 . 1 1 46 46 MET C C 46 179.540 179.540 178.520 1.020 25685 3194 1 5 . 1 1 46 46 MET CA C 46 55.968 55.968 57.590 -1.622 25685 3195 1 5 . 1 1 46 46 MET H H 46 8.589 8.589 7.694 0.895 25685 3196 1 5 . 1 1 47 47 LEU N N 47 117.448 117.448 121.199 -3.751 25685 3197 1 5 . 1 1 47 47 LEU HA H 47 3.992 3.992 4.197 -0.205 25685 3198 1 5 . 1 1 47 47 LEU C C 47 179.082 179.082 178.681 0.401 25685 3199 1 5 . 1 1 47 47 LEU CA C 47 58.157 58.157 58.579 -0.422 25685 3200 1 5 . 1 1 47 47 LEU CB C 47 41.858 41.858 41.886 -0.028 25685 3201 1 5 . 1 1 47 47 LEU H H 47 8.769 8.769 8.328 0.441 25685 3202 1 5 . 1 1 48 48 ILE N N 48 117.500 117.500 115.172 2.328 25685 3203 1 5 . 1 1 48 48 ILE C C 48 180.298 180.298 178.641 1.657 25685 3204 1 5 . 1 1 48 48 ILE CA C 48 65.627 65.627 63.490 2.137 25685 3205 1 5 . 1 1 48 48 ILE CB C 48 37.839 37.839 36.580 1.260 25685 3206 1 5 . 1 1 48 48 ILE H H 48 8.093 8.093 7.530 0.563 25685 3207 1 5 . 1 1 49 49 LEU N N 49 123.708 123.708 121.442 2.266 25685 3208 1 5 . 1 1 49 49 LEU C C 49 179.721 179.721 178.911 0.810 25685 3209 1 5 . 1 1 49 49 LEU CA C 49 58.788 58.788 57.912 0.876 25685 3210 1 5 . 1 1 49 49 LEU CB C 49 40.761 40.761 41.089 -0.327 25685 3211 1 5 . 1 1 49 49 LEU H H 49 8.833 8.833 7.758 1.075 25685 3212 1 5 . 1 1 50 50 GLY N N 50 109.284 109.284 107.400 1.884 25685 3213 1 5 . 1 1 50 50 GLY C C 50 176.937 176.937 174.699 2.238 25685 3214 1 5 . 1 1 50 50 GLY CA C 50 47.821 47.821 46.783 1.038 25685 3215 1 5 . 1 1 50 50 GLY H H 50 9.658 9.658 7.806 1.852 25685 3216 1 5 . 1 1 51 51 TYR N N 51 125.640 125.640 119.336 6.304 25685 3217 1 5 . 1 1 51 51 TYR C C 51 177.102 177.102 174.899 2.203 25685 3218 1 5 . 1 1 51 51 TYR CA C 51 61.948 61.948 56.730 5.218 25685 3219 1 5 . 1 1 51 51 TYR CB C 51 38.871 38.871 38.781 0.090 25685 3220 1 5 . 1 1 51 51 TYR H H 51 8.795 8.795 7.824 0.971 25685 3221 1 5 . 1 1 52 52 THR N N 52 116.273 116.273 118.456 -2.183 25685 3222 1 5 . 1 1 52 52 THR C C 52 176.969 176.969 174.199 2.770 25685 3223 1 5 . 1 1 52 52 THR CA C 52 67.972 67.972 63.235 4.737 25685 3224 1 5 . 1 1 52 52 THR H H 52 8.456 8.456 7.722 0.734 25685 3225 1 5 . 1 1 53 53 ALA N N 53 122.122 122.122 128.733 -6.611 25685 3226 1 5 . 1 1 53 53 ALA C C 53 179.907 179.907 177.743 2.164 25685 3227 1 5 . 1 1 53 53 ALA CA C 53 55.722 55.722 51.056 4.666 25685 3228 1 5 . 1 1 53 53 ALA CB C 53 18.786 18.786 21.079 -2.293 25685 3229 1 5 . 1 1 53 53 ALA H H 53 9.058 9.058 8.171 0.887 25685 3230 1 5 . 1 1 54 54 SER N N 54 115.434 115.434 116.838 -1.404 25685 3231 1 5 . 1 1 54 54 SER C C 54 176.433 176.433 173.949 2.484 25685 3232 1 5 . 1 1 54 54 SER CA C 54 55.828 55.828 59.675 -3.848 25685 3233 1 5 . 1 1 54 54 SER H H 54 8.040 8.040 8.767 -0.727 25685 3234 1 5 . 1 1 55 55 LEU N N 55 123.045 123.045 119.517 3.528 25685 3235 1 5 . 1 1 55 55 LEU C C 55 178.789 178.789 174.611 4.178 25685 3236 1 5 . 1 1 55 55 LEU CA C 55 57.633 57.633 55.600 2.033 25685 3237 1 5 . 1 1 55 55 LEU CB C 55 41.293 41.293 42.608 -1.315 25685 3238 1 5 . 1 1 55 55 LEU H H 55 8.255 8.255 7.509 0.746 25685 3239 1 5 . 1 1 56 56 PHE N N 56 114.426 114.426 120.547 -6.121 25685 3240 1 5 . 1 1 56 56 PHE C C 56 177.507 177.507 174.582 2.925 25685 3241 1 5 . 1 1 56 56 PHE CA C 56 61.068 61.068 57.773 3.295 25685 3242 1 5 . 1 1 56 56 PHE CB C 56 40.107 40.107 40.583 -0.476 25685 3243 1 5 . 1 1 56 56 PHE H H 56 7.590 7.590 7.553 0.037 25685 3244 1 5 . 1 1 57 57 PHE N N 57 114.701 114.701 116.510 -1.809 25685 3245 1 5 . 1 1 57 57 PHE C C 57 176.203 176.203 177.292 -1.089 25685 3246 1 5 . 1 1 57 57 PHE CA C 57 58.503 58.503 57.291 1.212 25685 3247 1 5 . 1 1 57 57 PHE CB C 57 41.114 41.114 36.546 4.568 25685 3248 1 5 . 1 1 57 57 PHE H H 57 8.514 8.514 7.346 1.168 25685 3249 1 5 . 1 1 58 58 GLY N N 58 111.041 111.041 109.930 1.111 25685 3250 1 5 . 1 1 58 58 GLY C C 58 174.240 174.240 176.162 -1.922 25685 3251 1 5 . 1 1 58 58 GLY CA C 58 44.827 44.827 46.696 -1.869 25685 3252 1 5 . 1 1 58 58 GLY H H 58 7.998 7.998 8.888 -0.890 25685 3253 1 5 . 1 1 59 59 PHE N N 59 127.950 127.950 121.420 6.530 25685 3254 1 5 . 1 1 59 59 PHE C C 59 176.612 176.612 177.119 -0.507 25685 3255 1 5 . 1 1 59 59 PHE CA C 59 61.598 61.598 59.327 2.271 25685 3256 1 5 . 1 1 59 59 PHE CB C 59 40.870 40.870 38.479 2.391 25685 3257 1 5 . 1 1 59 59 PHE H H 59 9.105 9.105 7.956 1.149 25685 3258 1 5 . 1 1 60 60 PHE N N 60 114.868 114.868 119.786 -4.918 25685 3259 1 5 . 1 1 60 60 PHE C C 60 177.989 177.989 177.200 0.789 25685 3260 1 5 . 1 1 60 60 PHE CA C 60 61.517 61.517 61.993 -0.476 25685 3261 1 5 . 1 1 60 60 PHE CB C 60 38.248 38.248 39.167 -0.919 25685 3262 1 5 . 1 1 60 60 PHE H H 60 8.796 8.796 8.257 0.539 25685 3263 1 5 . 1 1 61 61 ARG N N 61 118.812 118.812 118.356 0.456 25685 3264 1 5 . 1 1 61 61 ARG C C 61 177.813 177.813 178.501 -0.688 25685 3265 1 5 . 1 1 61 61 ARG CA C 61 60.497 60.497 59.510 0.987 25685 3266 1 5 . 1 1 61 61 ARG CB C 61 28.915 28.915 30.202 -1.287 25685 3267 1 5 . 1 1 61 61 ARG H H 61 7.600 7.600 7.820 -0.220 25685 3268 1 5 . 1 1 62 62 VAL N N 62 119.157 119.157 118.898 0.259 25685 3269 1 5 . 1 1 62 62 VAL C C 62 177.670 177.670 178.411 -0.741 25685 3270 1 5 . 1 1 62 62 VAL CA C 62 66.749 66.749 65.356 1.393 25685 3271 1 5 . 1 1 62 62 VAL CB C 62 30.306 30.306 31.305 -0.999 25685 3272 1 5 . 1 1 62 62 VAL H H 62 7.679 7.679 7.462 0.217 25685 3273 1 5 . 1 1 63 63 VAL N N 63 117.999 117.999 119.860 -1.861 25685 3274 1 5 . 1 1 63 63 VAL C C 63 177.639 177.639 178.188 -0.549 25685 3275 1 5 . 1 1 63 63 VAL CA C 63 66.836 66.836 65.536 1.300 25685 3276 1 5 . 1 1 63 63 VAL CB C 63 30.496 30.496 30.635 -0.139 25685 3277 1 5 . 1 1 63 63 VAL H H 63 7.429 7.429 8.190 -0.761 25685 3278 1 5 . 1 1 64 64 ALA N N 64 120.451 120.451 122.398 -1.947 25685 3279 1 5 . 1 1 64 64 ALA C C 64 179.134 179.134 179.112 0.022 25685 3280 1 5 . 1 1 64 64 ALA CA C 64 55.618 55.618 54.954 0.664 25685 3281 1 5 . 1 1 64 64 ALA CB C 64 17.950 17.950 17.704 0.246 25685 3282 1 5 . 1 1 64 64 ALA H H 64 8.169 8.169 7.651 0.518 25685 3283 1 5 . 1 1 65 65 MET N N 65 116.532 116.532 117.364 -0.832 25685 3284 1 5 . 1 1 65 65 MET C C 65 177.961 177.961 178.330 -0.369 25685 3285 1 5 . 1 1 65 65 MET CA C 65 58.161 58.161 58.837 -0.676 25685 3286 1 5 . 1 1 65 65 MET CB C 65 31.208 31.208 32.513 -1.305 25685 3287 1 5 . 1 1 65 65 MET H H 65 7.857 7.857 7.462 0.395 25685 3288 1 5 . 1 1 66 66 LEU C C 66 179.022 179.022 178.694 0.328 25685 3289 1 5 . 1 1 66 66 LEU CA C 66 58.412 58.412 58.060 0.351 25685 3290 1 5 . 1 1 67 67 PHE N N 67 116.877 116.877 119.085 -2.208 25685 3291 1 5 . 1 1 67 67 PHE C C 67 177.908 177.908 178.105 -0.197 25685 3292 1 5 . 1 1 67 67 PHE CA C 67 62.402 62.402 61.356 1.046 25685 3293 1 5 . 1 1 67 67 PHE CB C 67 39.203 39.203 39.000 0.203 25685 3294 1 5 . 1 1 67 67 PHE H H 67 7.923 7.923 7.488 0.435 25685 3295 1 5 . 1 1 68 68 LEU N N 68 118.860 118.860 118.569 0.291 25685 3296 1 5 . 1 1 68 68 LEU C C 68 179.032 179.032 178.422 0.610 25685 3297 1 5 . 1 1 68 68 LEU CA C 68 58.397 58.397 57.397 1.000 25685 3298 1 5 . 1 1 68 68 LEU CB C 68 40.803 40.803 41.169 -0.366 25685 3299 1 5 . 1 1 68 68 LEU H H 68 8.167 8.167 7.768 0.399 25685 3300 1 5 . 1 1 71 71 PHE N N 71 120.700 120.700 118.389 2.311 25685 3301 1 5 . 1 1 71 71 PHE C C 71 177.670 177.670 177.190 0.480 25685 3302 1 5 . 1 1 71 71 PHE CA C 71 60.528 60.528 61.024 -0.496 25685 3303 1 5 . 1 1 71 71 PHE H H 71 7.847 7.847 7.590 0.257 25685 3304 1 5 . 1 1 72 72 ALA N N 72 120.506 120.506 121.889 -1.383 25685 3305 1 5 . 1 1 72 72 ALA C C 72 178.944 178.944 179.345 -0.401 25685 3306 1 5 . 1 1 72 72 ALA CA C 72 55.461 55.461 54.636 0.825 25685 3307 1 5 . 1 1 72 72 ALA CB C 72 17.829 17.829 18.325 -0.496 25685 3308 1 5 . 1 1 72 72 ALA H H 72 8.533 8.533 7.569 0.964 25685 3309 1 5 . 1 1 73 73 LEU N N 73 115.071 115.071 118.923 -3.852 25685 3310 1 5 . 1 1 73 73 LEU C C 73 180.831 180.831 178.594 2.237 25685 3311 1 5 . 1 1 73 73 LEU CA C 73 58.091 58.091 57.388 0.703 25685 3312 1 5 . 1 1 73 73 LEU CB C 73 41.082 41.082 40.932 0.150 25685 3313 1 5 . 1 1 73 73 LEU H H 73 8.458 8.458 8.165 0.293 25685 3314 1 5 . 1 1 74 74 ILE N N 74 121.365 121.365 118.893 2.472 25685 3315 1 5 . 1 1 74 74 ILE C C 74 178.287 178.287 177.583 0.704 25685 3316 1 5 . 1 1 74 74 ILE CA C 74 65.335 65.335 63.763 1.572 25685 3317 1 5 . 1 1 74 74 ILE CB C 74 37.453 37.453 37.816 -0.363 25685 3318 1 5 . 1 1 74 74 ILE H H 74 8.220 8.220 7.301 0.919 25685 3319 1 5 . 1 1 75 75 LEU N N 75 119.200 119.200 119.619 -0.419 25685 3320 1 5 . 1 1 75 75 LEU C C 75 177.548 177.548 179.014 -1.466 25685 3321 1 5 . 1 1 75 75 LEU CA C 75 56.938 56.938 57.398 -0.460 25685 3322 1 5 . 1 1 75 75 LEU CB C 75 41.541 41.541 41.605 -0.064 25685 3323 1 5 . 1 1 75 75 LEU H H 75 7.866 7.866 7.294 0.572 25685 3324 1 5 . 1 1 76 76 LEU N N 76 116.338 116.338 116.813 -0.475 25685 3325 1 5 . 1 1 76 76 LEU C C 76 176.889 176.889 178.093 -1.204 25685 3326 1 5 . 1 1 76 76 LEU CA C 76 54.807 54.807 56.810 -2.003 25685 3327 1 5 . 1 1 76 76 LEU CB C 76 41.830 41.830 40.821 1.009 25685 3328 1 5 . 1 1 76 76 LEU H H 76 7.432 7.432 7.356 0.076 25685 3329 1 5 . 1 1 77 77 SER N N 77 114.630 114.630 112.672 1.958 25685 3330 1 5 . 1 1 77 77 SER C C 77 174.752 174.752 175.559 -0.807 25685 3331 1 5 . 1 1 77 77 SER CA C 77 58.967 58.967 60.452 -1.485 25685 3332 1 5 . 1 1 77 77 SER CB C 77 64.686 64.686 63.535 1.151 25685 3333 1 5 . 1 1 77 77 SER H H 77 7.423 7.423 7.782 -0.359 25685 3334 1 5 . 1 1 78 78 ASP N N 78 123.054 123.054 121.940 1.114 25685 3335 1 5 . 1 1 78 78 ASP C C 78 176.716 176.716 176.992 -0.276 25685 3336 1 5 . 1 1 78 78 ASP CA C 78 54.848 54.848 56.387 -1.539 25685 3337 1 5 . 1 1 78 78 ASP CB C 78 40.423 40.423 40.087 0.337 25685 3338 1 5 . 1 1 78 78 ASP H H 78 8.294 8.294 7.743 0.551 25685 3339 1 5 . 1 1 79 79 GLU N N 79 119.104 119.104 119.974 -0.870 25685 3340 1 5 . 1 1 79 79 GLU C C 79 176.391 176.391 175.229 1.162 25685 3341 1 5 . 1 1 79 79 GLU CA C 79 56.258 56.258 56.372 -0.114 25685 3342 1 5 . 1 1 79 79 GLU CB C 79 29.656 29.656 32.037 -2.381 25685 3343 1 5 . 1 1 79 79 GLU H H 79 8.384 8.384 8.592 -0.208 25685 3344 1 5 . 1 1 80 80 LEU N N 80 121.254 121.254 123.211 -1.957 25685 3345 1 5 . 1 1 80 80 LEU C C 80 177.164 177.164 175.018 2.146 25685 3346 1 5 . 1 1 80 80 LEU CA C 80 54.670 54.670 55.245 -0.576 25685 3347 1 5 . 1 1 80 80 LEU CB C 80 42.633 42.633 41.720 0.913 25685 3348 1 5 . 1 1 80 80 LEU H H 80 7.637 7.637 8.016 -0.379 25685 3349 1 5 . 1 1 81 81 ASP N N 81 123.410 123.410 122.903 0.507 25685 3350 1 5 . 1 1 81 81 ASP C C 81 177.552 177.552 175.464 2.088 25685 3351 1 5 . 1 1 81 81 ASP CA C 81 55.110 55.110 52.874 2.236 25685 3352 1 5 . 1 1 81 81 ASP CB C 81 42.693 42.693 43.234 -0.541 25685 3353 1 5 . 1 1 81 81 ASP H H 81 8.403 8.403 8.412 -0.009 25685 3354 1 5 . 1 1 82 82 GLU N N 82 125.047 125.047 117.925 7.122 25685 3355 1 5 . 1 1 82 82 GLU C C 82 178.198 178.198 177.186 1.012 25685 3356 1 5 . 1 1 82 82 GLU CA C 82 59.221 59.221 55.714 3.507 25685 3357 1 5 . 1 1 82 82 GLU CB C 82 29.176 29.176 30.979 -1.803 25685 3358 1 5 . 1 1 82 82 GLU H H 82 8.744 8.744 8.336 0.408 25685 3359 1 5 . 1 1 83 83 LYS N N 83 118.476 118.476 117.173 1.303 25685 3360 1 5 . 1 1 83 83 LYS C C 83 179.356 179.356 177.236 2.120 25685 3361 1 5 . 1 1 83 83 LYS CA C 83 59.170 59.170 58.419 0.751 25685 3362 1 5 . 1 1 83 83 LYS CB C 83 31.509 31.509 31.458 0.051 25685 3363 1 5 . 1 1 83 83 LYS H H 83 8.607 8.607 8.814 -0.207 25685 3364 1 5 . 1 1 84 84 VAL N N 84 118.407 118.407 116.224 2.183 25685 3365 1 5 . 1 1 84 84 VAL C C 84 177.653 177.653 177.387 0.266 25685 3366 1 5 . 1 1 84 84 VAL CA C 84 65.416 65.416 66.135 -0.719 25685 3367 1 5 . 1 1 84 84 VAL CB C 84 31.313 31.313 31.648 -0.336 25685 3368 1 5 . 1 1 84 84 VAL H H 84 7.870 7.870 8.032 -0.162 25685 3369 1 5 . 1 1 85 85 SER N N 85 116.146 116.146 115.872 0.274 25685 3370 1 5 . 1 1 85 85 SER C C 85 177.496 177.496 176.750 0.746 25685 3371 1 5 . 1 1 85 85 SER CA C 85 61.764 61.764 61.414 0.350 25685 3372 1 5 . 1 1 85 85 SER CB C 85 63.654 63.654 62.861 0.793 25685 3373 1 5 . 1 1 85 85 SER H H 85 8.083 8.083 8.418 -0.335 25685 3374 1 5 . 1 1 86 86 ILE N N 86 122.570 122.570 117.213 5.357 25685 3375 1 5 . 1 1 86 86 ILE C C 86 178.698 178.698 177.180 1.518 25685 3376 1 5 . 1 1 86 86 ILE CA C 86 64.526 64.526 64.115 0.411 25685 3377 1 5 . 1 1 86 86 ILE CB C 86 37.393 37.393 37.029 0.364 25685 3378 1 5 . 1 1 86 86 ILE H H 86 8.102 8.102 8.102 0.000 25685 3379 1 5 . 1 1 87 87 PHE N N 87 121.340 121.340 121.543 -0.203 25685 3380 1 5 . 1 1 87 87 PHE C C 87 177.671 177.671 176.500 1.171 25685 3381 1 5 . 1 1 87 87 PHE CA C 87 61.098 61.098 60.758 0.340 25685 3382 1 5 . 1 1 87 87 PHE CB C 87 39.151 39.151 38.297 0.854 25685 3383 1 5 . 1 1 87 87 PHE H H 87 7.719 7.719 7.685 0.034 25685 3384 1 5 . 1 1 88 88 ALA N N 88 120.921 120.921 121.501 -0.580 25685 3385 1 5 . 1 1 88 88 ALA C C 88 180.030 180.030 179.464 0.566 25685 3386 1 5 . 1 1 88 88 ALA CA C 88 55.147 55.147 54.348 0.799 25685 3387 1 5 . 1 1 88 88 ALA CB C 88 19.053 19.053 17.873 1.180 25685 3388 1 5 . 1 1 88 88 ALA H H 88 8.679 8.679 7.969 0.710 25685 3389 1 5 . 1 1 89 89 SER N N 89 114.285 114.285 114.789 -0.504 25685 3390 1 5 . 1 1 89 89 SER C C 89 177.040 177.040 176.303 0.737 25685 3391 1 5 . 1 1 89 89 SER CA C 89 61.314 61.314 60.712 0.602 25685 3392 1 5 . 1 1 89 89 SER CB C 89 63.371 63.371 63.031 0.340 25685 3393 1 5 . 1 1 89 89 SER H H 89 8.242 8.242 7.638 0.604 25685 3394 1 5 . 1 1 90 90 ARG N N 90 121.829 121.829 120.890 0.939 25685 3395 1 5 . 1 1 90 90 ARG C C 90 179.247 179.247 178.262 0.985 25685 3396 1 5 . 1 1 90 90 ARG CA C 90 58.444 58.444 59.158 -0.714 25685 3397 1 5 . 1 1 90 90 ARG CB C 90 29.532 29.532 29.462 0.070 25685 3398 1 5 . 1 1 90 90 ARG H H 90 7.907 7.907 8.312 -0.405 25685 3399 1 5 . 1 1 91 91 MET N N 91 117.124 117.124 116.427 0.697 25685 3400 1 5 . 1 1 91 91 MET C C 91 177.504 177.504 178.175 -0.671 25685 3401 1 5 . 1 1 91 91 MET CA C 91 57.152 57.152 59.953 -2.801 25685 3402 1 5 . 1 1 91 91 MET CB C 91 32.510 32.510 31.753 0.757 25685 3403 1 5 . 1 1 91 91 MET H H 91 7.930 7.930 7.562 0.368 25685 3404 1 5 . 1 1 92 92 THR N N 92 108.478 108.478 114.640 -6.162 25685 3405 1 5 . 1 1 92 92 THR C C 92 176.367 176.367 176.368 -0.001 25685 3406 1 5 . 1 1 92 92 THR CA C 92 63.564 63.564 65.299 -1.735 25685 3407 1 5 . 1 1 92 92 THR H H 92 7.847 7.847 7.510 0.337 25685 3408 1 5 . 1 1 93 93 SER N N 93 117.950 117.950 116.872 1.078 25685 3409 1 5 . 1 1 93 93 SER C C 93 176.552 176.552 176.278 0.274 25685 3410 1 5 . 1 1 93 93 SER CA C 93 60.821 60.821 61.680 -0.859 25685 3411 1 5 . 1 1 93 93 SER CB C 93 63.311 63.311 63.455 -0.144 25685 3412 1 5 . 1 1 93 93 SER H H 93 7.732 7.732 7.777 -0.045 25685 3413 1 5 . 1 1 94 94 GLY N N 94 111.265 111.265 107.846 3.419 25685 3414 1 5 . 1 1 94 94 GLY C C 94 175.198 175.198 174.612 0.586 25685 3415 1 5 . 1 1 94 94 GLY CA C 94 46.021 46.021 45.179 0.841 25685 3416 1 5 . 1 1 94 94 GLY H H 94 8.419 8.419 8.025 0.394 25685 3417 1 5 . 1 1 95 95 LEU N N 95 121.019 121.019 119.794 1.225 25685 3418 1 5 . 1 1 95 95 LEU C C 95 177.810 177.810 176.054 1.756 25685 3419 1 5 . 1 1 95 95 LEU CA C 95 56.012 56.012 55.872 0.140 25685 3420 1 5 . 1 1 95 95 LEU CB C 95 42.122 42.122 42.307 -0.185 25685 3421 1 5 . 1 1 95 95 LEU H H 95 7.849 7.849 7.595 0.254 25685 3422 1 5 . 1 1 96 96 SER N N 96 115.465 115.465 116.379 -0.914 25685 3423 1 5 . 1 1 96 96 SER C C 96 175.543 175.543 173.398 2.145 25685 3424 1 5 . 1 1 96 96 SER CA C 96 60.151 60.151 57.906 2.245 25685 3425 1 5 . 1 1 96 96 SER H H 96 8.349 8.349 8.288 0.061 25685 3426 1 5 . 1 1 97 97 TRP N N 97 121.711 121.711 123.289 -1.578 25685 3427 1 5 . 1 1 97 97 TRP C C 97 176.973 176.973 175.076 1.897 25685 3428 1 5 . 1 1 97 97 TRP CA C 97 58.250 58.250 57.871 0.379 25685 3429 1 5 . 1 1 97 97 TRP CB C 97 28.899 28.899 29.510 -0.611 25685 3430 1 5 . 1 1 97 97 TRP H H 97 7.723 7.723 8.612 -0.889 25685 3431 1 5 . 1 1 98 98 LYS N N 98 119.868 119.868 121.291 -1.423 25685 3432 1 5 . 1 1 98 98 LYS C C 98 178.021 178.021 176.692 1.329 25685 3433 1 5 . 1 1 98 98 LYS CA C 98 56.340 56.340 56.273 0.067 25685 3434 1 5 . 1 1 98 98 LYS CB C 98 31.933 31.933 33.416 -1.483 25685 3435 1 5 . 1 1 98 98 LYS H H 98 7.855 7.855 8.135 -0.280 25685 3436 1 5 . 1 1 99 99 ILE N N 99 120.044 120.044 121.817 -1.773 25685 3437 1 5 . 1 1 99 99 ILE C C 99 176.769 176.769 177.035 -0.266 25685 3438 1 5 . 1 1 99 99 ILE CA C 99 62.758 62.758 63.419 -0.661 25685 3439 1 5 . 1 1 99 99 ILE CB C 99 37.809 37.809 37.584 0.225 25685 3440 1 5 . 1 1 99 99 ILE H H 99 8.069 8.069 7.991 0.078 25685 3441 1 5 . 1 1 100 100 GLN C C 100 176.315 176.315 175.013 1.302 25685 3442 1 5 . 1 1 100 100 GLN CA C 100 57.486 57.486 55.764 1.722 25685 3443 1 5 . 1 1 101 101 THR N N 101 109.873 109.873 112.077 -2.204 25685 3444 1 5 . 1 1 101 101 THR C C 101 174.664 174.664 173.865 0.799 25685 3445 1 5 . 1 1 101 101 THR CA C 101 61.709 61.709 61.381 0.328 25685 3446 1 5 . 1 1 101 101 THR CB C 101 69.290 69.290 69.739 -0.449 25685 3447 1 5 . 1 1 101 101 THR H H 101 7.508 7.508 8.260 -0.752 25685 3448 1 5 . 1 1 102 102 LEU N N 102 124.434 124.434 125.765 -1.331 25685 3449 1 5 . 1 1 102 102 LEU C C 102 174.681 174.681 176.277 -1.596 25685 3450 1 5 . 1 1 102 102 LEU CA C 102 53.063 53.063 53.432 -0.369 25685 3451 1 5 . 1 1 102 102 LEU CB C 102 41.139 41.139 40.500 0.639 25685 3452 1 5 . 1 1 102 102 LEU H H 102 7.569 7.569 8.446 -0.877 25685 3453 1 5 . 1 1 103 103 PRO C C 103 178.076 178.076 177.791 0.285 25685 3454 1 5 . 1 1 103 103 PRO CA C 103 62.570 62.570 63.514 -0.944 25685 3455 1 5 . 1 1 103 103 PRO CB C 103 31.534 31.534 32.403 -0.869 25685 3456 1 5 . 1 1 104 104 SER N N 104 119.929 119.929 117.512 2.417 25685 3457 1 5 . 1 1 104 104 SER C C 104 176.432 176.432 175.891 0.541 25685 3458 1 5 . 1 1 104 104 SER CA C 104 61.976 61.976 59.932 2.043 25685 3459 1 5 . 1 1 104 104 SER CB C 104 63.611 63.611 63.427 0.184 25685 3460 1 5 . 1 1 104 104 SER H H 104 8.784 8.784 8.345 0.439 25685 3461 1 5 . 1 1 105 105 PHE N N 105 119.519 119.519 116.090 3.429 25685 3462 1 5 . 1 1 105 105 PHE C C 105 176.852 176.852 174.088 2.764 25685 3463 1 5 . 1 1 105 105 PHE CA C 105 60.162 60.162 58.998 1.163 25685 3464 1 5 . 1 1 105 105 PHE CB C 105 38.455 38.455 38.471 -0.016 25685 3465 1 5 . 1 1 105 105 PHE H H 105 8.620 8.620 8.051 0.569 25685 3466 1 5 . 1 1 106 106 PHE N N 106 118.809 118.809 114.375 4.434 25685 3467 1 5 . 1 1 106 106 PHE C C 106 176.741 176.741 175.382 1.359 25685 3468 1 5 . 1 1 106 106 PHE CA C 106 61.421 61.421 57.950 3.470 25685 3469 1 5 . 1 1 106 106 PHE CB C 106 38.788 38.788 36.442 2.346 25685 3470 1 5 . 1 1 106 106 PHE H H 106 7.519 7.519 7.146 0.373 25685 3471 1 5 . 1 1 107 107 PHE N N 107 117.382 117.382 123.064 -5.682 25685 3472 1 5 . 1 1 107 107 PHE C C 107 177.771 177.771 176.735 1.036 25685 3473 1 5 . 1 1 107 107 PHE CA C 107 61.099 61.099 61.594 -0.495 25685 3474 1 5 . 1 1 107 107 PHE CB C 107 38.677 38.677 39.792 -1.115 25685 3475 1 5 . 1 1 107 107 PHE H H 107 7.903 7.903 7.892 0.011 25685 3476 1 5 . 1 1 108 108 GLY N N 108 105.340 105.340 106.791 -1.451 25685 3477 1 5 . 1 1 108 108 GLY C C 108 174.574 174.574 176.093 -1.519 25685 3478 1 5 . 1 1 108 108 GLY CA C 108 47.508 47.508 47.258 0.250 25685 3479 1 5 . 1 1 108 108 GLY H H 108 8.351 8.351 9.049 -0.698 25685 3480 1 5 . 1 1 109 109 MET N N 109 119.831 119.831 119.550 0.281 25685 3481 1 5 . 1 1 109 109 MET C C 109 177.522 177.522 177.637 -0.115 25685 3482 1 5 . 1 1 109 109 MET CA C 109 58.658 58.658 57.086 1.572 25685 3483 1 5 . 1 1 109 109 MET CB C 109 32.106 32.106 31.163 0.943 25685 3484 1 5 . 1 1 109 109 MET H H 109 7.919 7.919 7.647 0.272 25685 3485 1 5 . 1 1 110 110 LEU N N 110 119.908 119.908 119.189 0.719 25685 3486 1 5 . 1 1 110 110 LEU C C 110 178.170 178.170 178.590 -0.420 25685 3487 1 5 . 1 1 110 110 LEU CA C 110 57.941 57.941 57.318 0.623 25685 3488 1 5 . 1 1 110 110 LEU CB C 110 41.055 41.055 40.821 0.235 25685 3489 1 5 . 1 1 110 110 LEU H H 110 7.744 7.744 7.223 0.521 25685 3490 1 5 . 1 1 111 111 LEU N N 111 116.594 116.594 119.794 -3.200 25685 3491 1 5 . 1 1 111 111 LEU C C 111 178.960 178.960 178.221 0.739 25685 3492 1 5 . 1 1 111 111 LEU CA C 111 57.366 57.366 57.787 -0.421 25685 3493 1 5 . 1 1 111 111 LEU CB C 111 40.259 40.259 41.412 -1.153 25685 3494 1 5 . 1 1 111 111 LEU H H 111 7.732 7.732 7.123 0.609 25685 3495 1 5 . 1 1 112 112 ALA N N 112 121.020 121.020 119.987 1.033 25685 3496 1 5 . 1 1 112 112 ALA C C 112 178.700 178.700 179.252 -0.552 25685 3497 1 5 . 1 1 112 112 ALA CA C 112 55.432 55.432 54.800 0.632 25685 3498 1 5 . 1 1 112 112 ALA CB C 112 18.214 18.214 18.184 0.030 25685 3499 1 5 . 1 1 112 112 ALA H H 112 8.121 8.121 7.183 0.938 25685 3500 1 5 . 1 1 113 113 PHE N N 113 118.369 118.369 115.725 2.644 25685 3501 1 5 . 1 1 113 113 PHE C C 113 176.091 176.091 177.511 -1.420 25685 3502 1 5 . 1 1 113 113 PHE CA C 113 61.388 61.388 58.178 3.210 25685 3503 1 5 . 1 1 113 113 PHE CB C 113 39.688 39.688 37.429 2.259 25685 3504 1 5 . 1 1 113 113 PHE H H 113 8.237 8.237 6.983 1.254 25685 3505 1 5 . 1 1 114 114 LEU N N 114 114.214 114.214 119.552 -5.338 25685 3506 1 5 . 1 1 114 114 LEU C C 114 177.038 177.038 177.844 -0.806 25685 3507 1 5 . 1 1 114 114 LEU CA C 114 56.358 56.358 58.135 -1.777 25685 3508 1 5 . 1 1 114 114 LEU CB C 114 42.716 42.716 42.029 0.687 25685 3509 1 5 . 1 1 114 114 LEU H H 114 7.576 7.576 7.373 0.203 25685 3510 1 5 . 1 1 115 115 TRP N N 115 112.667 112.667 116.270 -3.603 25685 3511 1 5 . 1 1 115 115 TRP C C 115 180.163 180.163 178.126 2.037 25685 3512 1 5 . 1 1 115 115 TRP CA C 115 55.930 55.930 59.090 -3.159 25685 3513 1 5 . 1 1 115 115 TRP H H 115 8.542 8.542 7.105 1.437 25685 3514 1 5 . 1 1 116 116 LEU N N 116 122.144 122.144 121.662 0.482 25685 3515 1 5 . 1 1 116 116 LEU C C 116 175.953 175.953 176.667 -0.714 25685 3516 1 5 . 1 1 116 116 LEU CA C 116 59.924 59.924 58.041 1.883 25685 3517 1 5 . 1 1 116 116 LEU CB C 116 39.097 39.097 40.231 -1.134 25685 3518 1 5 . 1 1 116 116 LEU H H 116 8.996 8.996 7.376 1.620 25685 3519 1 5 . 1 1 117 117 PRO C C 117 174.220 174.220 177.418 -3.198 25685 3520 1 5 . 1 1 117 117 PRO CA C 117 66.300 66.300 64.583 1.717 25685 3521 1 5 . 1 1 118 118 ALA N N 118 110.603 110.603 119.688 -9.085 25685 3522 1 5 . 1 1 118 118 ALA C C 118 177.162 177.162 177.548 -0.386 25685 3523 1 5 . 1 1 118 118 ALA CA C 118 52.670 52.670 52.172 0.498 25685 3524 1 5 . 1 1 118 118 ALA CB C 118 18.853 18.853 19.715 -0.862 25685 3525 1 5 . 1 1 118 118 ALA H H 118 6.633 6.633 7.446 -0.813 25685 3526 1 5 . 1 1 119 119 ILE N N 119 113.492 113.492 114.024 -0.532 25685 3527 1 5 . 1 1 119 119 ILE CA C 119 63.703 63.703 62.766 0.937 25685 3528 1 5 . 1 1 119 119 ILE CB C 119 39.605 39.605 36.764 2.841 25685 3529 1 5 . 1 1 119 119 ILE H H 119 7.693 7.693 8.313 -0.620 25685 3530 1 5 . 1 1 121 121 PRO C C 121 178.089 178.089 179.119 -1.030 25685 3531 1 5 . 1 1 121 121 PRO CA C 121 66.004 66.004 65.897 0.107 25685 3532 1 5 . 1 1 122 122 PHE N N 122 113.797 113.797 118.664 -4.867 25685 3533 1 5 . 1 1 122 122 PHE C C 122 177.713 177.713 177.234 0.479 25685 3534 1 5 . 1 1 122 122 PHE CA C 122 61.566 61.566 61.012 0.554 25685 3535 1 5 . 1 1 122 122 PHE CB C 122 38.983 38.983 38.671 0.312 25685 3536 1 5 . 1 1 122 122 PHE H H 122 6.846 6.846 8.224 -1.378 25685 3537 1 5 . 1 1 123 123 ALA N N 123 121.512 121.512 121.120 0.392 25685 3538 1 5 . 1 1 123 123 ALA C C 123 179.318 179.318 179.430 -0.112 25685 3539 1 5 . 1 1 123 123 ALA CA C 123 54.975 54.975 54.997 -0.022 25685 3540 1 5 . 1 1 123 123 ALA CB C 123 17.881 17.881 17.995 -0.114 25685 3541 1 5 . 1 1 123 123 ALA H H 123 8.411 8.411 8.153 0.258 25685 3542 1 5 . 1 1 124 124 GLY N N 124 104.093 104.093 106.848 -2.755 25685 3543 1 5 . 1 1 124 124 GLY C C 124 175.410 175.410 176.051 -0.641 25685 3544 1 5 . 1 1 124 124 GLY CA C 124 47.370 47.370 46.860 0.510 25685 3545 1 5 . 1 1 124 124 GLY H H 124 8.455 8.455 8.122 0.333 25685 3546 1 5 . 1 1 125 125 ILE N N 125 121.895 121.895 119.665 2.230 25685 3547 1 5 . 1 1 125 125 ILE C C 125 178.329 178.329 177.628 0.701 25685 3548 1 5 . 1 1 125 125 ILE CA C 125 64.412 64.412 63.940 0.472 25685 3549 1 5 . 1 1 125 125 ILE H H 125 7.954 7.954 7.676 0.278 25685 3550 1 5 . 1 1 126 126 ALA N N 126 122.768 122.768 122.588 0.180 25685 3551 1 5 . 1 1 126 126 ALA C C 126 180.341 180.341 179.479 0.862 25685 3552 1 5 . 1 1 126 126 ALA CA C 126 55.266 55.266 55.219 0.047 25685 3553 1 5 . 1 1 126 126 ALA CB C 126 18.226 18.226 18.241 -0.015 25685 3554 1 5 . 1 1 126 126 ALA H H 126 8.142 8.142 7.605 0.537 25685 3555 1 5 . 1 1 127 127 ILE N N 127 116.752 116.752 114.902 1.850 25685 3556 1 5 . 1 1 127 127 ILE C C 127 177.993 177.993 177.903 0.090 25685 3557 1 5 . 1 1 127 127 ILE CA C 127 63.877 63.877 64.146 -0.269 25685 3558 1 5 . 1 1 127 127 ILE CB C 127 37.657 37.657 37.260 0.397 25685 3559 1 5 . 1 1 127 127 ILE H H 127 8.335 8.335 7.379 0.956 25685 3560 1 5 . 1 1 128 128 SER N N 128 116.351 116.351 116.282 0.069 25685 3561 1 5 . 1 1 128 128 SER C C 128 175.796 175.796 177.068 -1.272 25685 3562 1 5 . 1 1 128 128 SER CA C 128 61.818 61.818 61.149 0.669 25685 3563 1 5 . 1 1 128 128 SER H H 128 7.939 7.939 7.799 0.140 25685 3564 1 5 . 1 1 129 129 GLN N N 129 118.082 118.082 120.511 -2.429 25685 3565 1 5 . 1 1 129 129 GLN C C 129 177.419 177.419 177.605 -0.186 25685 3566 1 5 . 1 1 129 129 GLN CA C 129 57.106 57.106 58.278 -1.172 25685 3567 1 5 . 1 1 129 129 GLN CB C 129 28.631 28.631 28.545 0.086 25685 3568 1 5 . 1 1 129 129 GLN H H 129 7.943 7.943 7.540 0.403 25685 3569 1 5 . 1 1 130 130 THR N N 130 113.484 113.484 113.495 -0.011 25685 3570 1 5 . 1 1 130 130 THR C C 130 175.627 175.627 174.471 1.156 25685 3571 1 5 . 1 1 130 130 THR CA C 130 63.758 63.758 64.905 -1.147 25685 3572 1 5 . 1 1 130 130 THR CB C 130 69.182 69.182 69.103 0.079 25685 3573 1 5 . 1 1 130 130 THR H H 130 7.686 7.686 7.548 0.138 25685 3574 1 5 . 1 1 131 131 LEU N N 131 121.347 121.347 120.322 1.025 25685 3575 1 5 . 1 1 131 131 LEU C C 131 177.522 177.522 176.002 1.520 25685 3576 1 5 . 1 1 131 131 LEU CA C 131 56.307 56.307 54.066 2.241 25685 3577 1 5 . 1 1 131 131 LEU CB C 131 41.711 41.711 42.433 -0.722 25685 3578 1 5 . 1 1 131 131 LEU H H 131 8.071 8.071 7.327 0.744 25685 3579 1 5 . 1 1 132 132 LEU N N 132 118.162 118.162 121.290 -3.128 25685 3580 1 5 . 1 1 132 132 LEU C C 132 177.461 177.461 176.173 1.288 25685 3581 1 5 . 1 1 132 132 LEU CA C 132 55.264 55.264 54.773 0.491 25685 3582 1 5 . 1 1 132 132 LEU CB C 132 41.613 41.613 42.187 -0.574 25685 3583 1 5 . 1 1 132 132 LEU H H 132 7.810 7.810 8.324 -0.514 25685 3584 1 5 . 1 1 133 133 SER N N 133 114.244 114.244 113.857 0.387 25685 3585 1 5 . 1 1 133 133 SER C C 133 174.363 174.363 172.892 1.471 25685 3586 1 5 . 1 1 133 133 SER CA C 133 59.019 59.019 59.426 -0.407 25685 3587 1 5 . 1 1 133 133 SER CB C 133 64.634 64.634 63.440 1.194 25685 3588 1 5 . 1 1 133 133 SER H H 133 7.829 7.829 8.444 -0.615 25685 3589 1 5 . 1 1 134 134 GLU N N 134 120.151 120.151 121.762 -1.611 25685 3590 1 5 . 1 1 134 134 GLU C C 134 175.935 175.935 174.493 1.442 25685 3591 1 5 . 1 1 134 134 GLU CA C 134 56.301 56.301 55.799 0.502 25685 3592 1 5 . 1 1 134 134 GLU CB C 134 30.129 30.129 32.220 -2.091 25685 3593 1 5 . 1 1 134 134 GLU H H 134 8.054 8.054 8.501 -0.447 25685 3594 1 5 . 1 1 135 135 ASN N N 135 118.890 118.890 120.792 -1.902 25685 3595 1 5 . 1 1 135 135 ASN C C 135 174.272 174.272 173.805 0.467 25685 3596 1 5 . 1 1 135 135 ASN CA C 135 51.390 51.390 52.042 -0.652 25685 3597 1 5 . 1 1 135 135 ASN CB C 135 39.129 39.129 38.750 0.379 25685 3598 1 5 . 1 1 135 135 ASN H H 135 8.305 8.305 8.494 -0.189 25685 3599 1 5 . 1 1 136 136 PRO C C 136 177.960 177.960 178.170 -0.210 25685 3600 1 5 . 1 1 136 136 PRO CA C 136 64.530 64.530 65.623 -1.093 25685 3601 1 5 . 1 1 136 136 PRO CB C 136 31.809 31.809 31.920 -0.111 25685 3602 1 5 . 1 1 137 137 LEU N N 137 117.735 117.735 116.469 1.266 25685 3603 1 5 . 1 1 137 137 LEU C C 137 179.217 179.217 179.377 -0.160 25685 3604 1 5 . 1 1 137 137 LEU CA C 137 57.039 57.039 58.113 -1.074 25685 3605 1 5 . 1 1 137 137 LEU CB C 137 40.799 40.799 41.038 -0.239 25685 3606 1 5 . 1 1 137 137 LEU H H 137 8.248 8.248 8.157 0.091 25685 3607 1 5 . 1 1 138 138 VAL N N 138 119.589 119.589 119.622 -0.033 25685 3608 1 5 . 1 1 138 138 VAL C C 138 177.894 177.894 177.078 0.816 25685 3609 1 5 . 1 1 138 138 VAL CA C 138 64.727 64.727 66.718 -1.991 25685 3610 1 5 . 1 1 138 138 VAL CB C 138 31.347 31.347 31.456 -0.109 25685 3611 1 5 . 1 1 138 138 VAL H H 138 7.483 7.483 7.559 -0.076 25685 3612 1 5 . 1 1 139 139 MET N N 139 119.431 119.431 119.854 -0.423 25685 3613 1 5 . 1 1 139 139 MET C C 139 177.988 177.988 177.909 0.079 25685 3614 1 5 . 1 1 139 139 MET CA C 139 57.403 57.403 59.422 -2.019 25685 3615 1 5 . 1 1 139 139 MET CB C 139 31.709 31.709 32.644 -0.935 25685 3616 1 5 . 1 1 139 139 MET H H 139 7.837 7.837 8.083 -0.246 25685 3617 1 5 . 1 1 140 140 LEU N N 140 119.686 119.686 120.103 -0.417 25685 3618 1 5 . 1 1 140 140 LEU C C 140 177.916 177.916 178.893 -0.977 25685 3619 1 5 . 1 1 140 140 LEU CA C 140 56.877 56.877 57.799 -0.922 25685 3620 1 5 . 1 1 140 140 LEU CB C 140 41.491 41.491 40.628 0.863 25685 3621 1 5 . 1 1 140 140 LEU H H 140 7.926 7.926 8.830 -0.904 25685 3622 1 5 . 1 1 141 141 SER N N 141 114.167 114.167 114.904 -0.737 25685 3623 1 5 . 1 1 141 141 SER C C 141 176.030 176.030 177.198 -1.168 25685 3624 1 5 . 1 1 141 141 SER CA C 141 60.425 60.425 61.621 -1.196 25685 3625 1 5 . 1 1 141 141 SER CB C 141 63.956 63.956 63.243 0.713 25685 3626 1 5 . 1 1 141 141 SER H H 141 7.757 7.757 8.216 -0.459 25685 3627 1 5 . 1 1 142 142 TYR N N 142 121.679 121.679 121.581 0.098 25685 3628 1 5 . 1 1 142 142 TYR C C 142 177.659 177.659 178.440 -0.781 25685 3629 1 5 . 1 1 142 142 TYR CA C 142 59.673 59.673 58.743 0.930 25685 3630 1 5 . 1 1 142 142 TYR CB C 142 38.079 38.079 37.879 0.200 25685 3631 1 5 . 1 1 142 142 TYR H H 142 7.965 7.965 8.834 -0.869 25685 3632 1 5 . 1 1 143 143 GLY N N 143 107.396 107.396 108.170 -0.774 25685 3633 1 5 . 1 1 143 143 GLY C C 143 174.877 174.877 175.998 -1.121 25685 3634 1 5 . 1 1 143 143 GLY CA C 143 46.343 46.343 47.318 -0.975 25685 3635 1 5 . 1 1 143 143 GLY H H 143 8.177 8.177 9.017 -0.840 25685 3636 1 5 . 1 1 144 144 LEU N N 144 120.477 120.477 122.687 -2.210 25685 3637 1 5 . 1 1 144 144 LEU C C 144 178.504 178.504 178.876 -0.372 25685 3638 1 5 . 1 1 144 144 LEU CA C 144 56.270 56.270 57.253 -0.983 25685 3639 1 5 . 1 1 144 144 LEU CB C 144 41.662 41.662 41.785 -0.123 25685 3640 1 5 . 1 1 144 144 LEU H H 144 8.055 8.055 7.481 0.574 25685 3641 1 5 . 1 1 145 145 GLY N N 145 106.847 106.847 106.610 0.237 25685 3642 1 5 . 1 1 145 145 GLY C C 145 175.375 175.375 175.849 -0.474 25685 3643 1 5 . 1 1 145 145 GLY CA C 145 45.582 45.582 46.795 -1.213 25685 3644 1 5 . 1 1 145 145 GLY H H 145 8.066 8.066 7.590 0.476 25685 3645 1 5 . 1 1 146 146 MET N N 146 120.376 120.376 121.649 -1.273 25685 3646 1 5 . 1 1 146 146 MET C C 146 176.663 176.663 178.157 -1.494 25685 3647 1 5 . 1 1 146 146 MET CA C 146 57.030 57.030 58.656 -1.626 25685 3648 1 5 . 1 1 146 146 MET CB C 146 30.720 30.720 32.773 -2.053 25685 3649 1 5 . 1 1 146 146 MET H H 146 8.157 8.157 8.747 -0.590 25685 3650 1 5 . 1 1 147 147 ALA N N 147 123.038 123.038 121.225 1.813 25685 3651 1 5 . 1 1 147 147 ALA C C 147 178.917 178.917 179.636 -0.719 25685 3652 1 5 . 1 1 147 147 ALA CA C 147 54.201 54.201 55.415 -1.214 25685 3653 1 5 . 1 1 147 147 ALA CB C 147 18.810 18.810 18.255 0.555 25685 3654 1 5 . 1 1 147 147 ALA H H 147 8.336 8.336 8.434 -0.098 25685 3655 1 5 . 1 1 148 148 VAL N N 148 117.795 117.795 115.739 2.056 25685 3656 1 5 . 1 1 148 148 VAL C C 148 176.891 176.891 178.037 -1.146 25685 3657 1 5 . 1 1 148 148 VAL CA C 148 64.157 64.157 65.783 -1.626 25685 3658 1 5 . 1 1 148 148 VAL CB C 148 31.529 31.529 30.553 0.976 25685 3659 1 5 . 1 1 148 148 VAL H H 148 7.908 7.908 7.410 0.498 25685 3660 1 5 . 1 1 149 149 THR N N 149 116.069 116.069 115.299 0.770 25685 3661 1 5 . 1 1 149 149 THR C C 149 176.054 176.054 176.301 -0.247 25685 3662 1 5 . 1 1 149 149 THR CA C 149 63.308 63.308 66.394 -3.086 25685 3663 1 5 . 1 1 149 149 THR H H 149 7.414 7.414 7.472 -0.058 25685 3664 1 5 . 1 1 150 150 ILE N N 150 121.971 121.971 121.276 0.695 25685 3665 1 5 . 1 1 150 150 ILE C C 150 177.715 177.715 176.680 1.035 25685 3666 1 5 . 1 1 150 150 ILE CA C 150 64.319 64.319 63.355 0.964 25685 3667 1 5 . 1 1 150 150 ILE CB C 150 36.628 36.628 37.815 -1.187 25685 3668 1 5 . 1 1 150 150 ILE H H 150 8.772 8.772 7.783 0.989 25685 3669 1 5 . 1 1 151 151 ALA N N 151 122.272 122.272 121.466 0.806 25685 3670 1 5 . 1 1 151 151 ALA C C 151 180.370 180.370 179.370 1.000 25685 3671 1 5 . 1 1 151 151 ALA CA C 151 55.336 55.336 55.432 -0.096 25685 3672 1 5 . 1 1 151 151 ALA CB C 151 18.107 18.107 17.850 0.257 25685 3673 1 5 . 1 1 151 151 ALA H H 151 8.163 8.163 7.702 0.461 25685 3674 1 5 . 1 1 152 152 ALA N N 152 120.648 120.648 121.319 -0.671 25685 3675 1 5 . 1 1 152 152 ALA C C 152 181.019 181.019 179.758 1.261 25685 3676 1 5 . 1 1 152 152 ALA CA C 152 54.944 54.944 54.934 0.010 25685 3677 1 5 . 1 1 152 152 ALA CB C 152 18.963 18.963 18.176 0.787 25685 3678 1 5 . 1 1 152 152 ALA H H 152 7.877 7.877 7.557 0.320 25685 3679 1 5 . 1 1 153 153 VAL N N 153 119.372 119.372 118.666 0.706 25685 3680 1 5 . 1 1 153 153 VAL C C 153 178.197 178.197 177.876 0.321 25685 3681 1 5 . 1 1 153 153 VAL CA C 153 66.289 66.289 65.044 1.245 25685 3682 1 5 . 1 1 153 153 VAL CB C 153 30.770 30.770 31.052 -0.282 25685 3683 1 5 . 1 1 153 153 VAL H H 153 8.118 8.118 7.459 0.659 25685 3684 1 5 . 1 1 154 154 PHE N N 154 120.362 120.362 118.655 1.707 25685 3685 1 5 . 1 1 154 154 PHE C C 154 177.733 177.733 176.892 0.841 25685 3686 1 5 . 1 1 154 154 PHE CA C 154 61.412 61.412 61.398 0.014 25685 3687 1 5 . 1 1 154 154 PHE CB C 154 38.465 38.465 38.160 0.305 25685 3688 1 5 . 1 1 154 154 PHE H H 154 8.508 8.508 7.848 0.660 25685 3689 1 5 . 1 1 155 155 LYS N N 155 118.894 118.894 117.349 1.545 25685 3690 1 5 . 1 1 155 155 LYS C C 155 179.940 179.940 178.474 1.466 25685 3691 1 5 . 1 1 155 155 LYS CA C 155 58.969 58.969 58.930 0.039 25685 3692 1 5 . 1 1 155 155 LYS CB C 155 31.725 31.725 32.252 -0.527 25685 3693 1 5 . 1 1 155 155 LYS H H 155 8.035 8.035 7.603 0.432 25685 3694 1 5 . 1 1 156 156 MET N N 156 118.853 118.853 119.183 -0.330 25685 3695 1 5 . 1 1 156 156 MET C C 156 179.245 179.245 177.878 1.367 25685 3696 1 5 . 1 1 156 156 MET CA C 156 58.518 58.518 57.662 0.856 25685 3697 1 5 . 1 1 156 156 MET CB C 156 31.912 31.912 30.965 0.948 25685 3698 1 5 . 1 1 156 156 MET H H 156 8.014 8.014 7.591 0.423 25685 3699 1 5 . 1 1 157 157 GLY N N 157 108.239 108.239 105.487 2.752 25685 3700 1 5 . 1 1 157 157 GLY C C 157 174.637 174.637 175.506 -0.869 25685 3701 1 5 . 1 1 157 157 GLY CA C 157 47.204 47.204 47.066 0.138 25685 3702 1 5 . 1 1 157 157 GLY H H 157 8.614 8.614 7.782 0.833 25685 3703 1 5 . 1 1 158 158 GLU N N 158 122.902 122.902 120.391 2.511 25685 3704 1 5 . 1 1 158 158 GLU C C 158 177.851 177.851 175.735 2.116 25685 3705 1 5 . 1 1 158 158 GLU CA C 158 60.203 60.203 56.919 3.284 25685 3706 1 5 . 1 1 158 158 GLU CB C 158 28.870 28.870 31.323 -2.453 25685 3707 1 5 . 1 1 158 158 GLU H H 158 8.550 8.550 7.705 0.845 25685 3708 1 5 . 1 1 159 159 LYS N N 159 117.932 117.932 117.043 0.889 25685 3709 1 5 . 1 1 159 159 LYS C C 159 179.529 179.529 175.636 3.893 25685 3710 1 5 . 1 1 159 159 LYS CA C 159 59.419 59.419 55.851 3.568 25685 3711 1 5 . 1 1 159 159 LYS CB C 159 31.759 31.759 33.097 -1.338 25685 3712 1 5 . 1 1 159 159 LYS H H 159 7.641 7.641 7.815 -0.174 25685 3713 1 5 . 1 1 160 160 PHE N N 160 120.614 120.614 123.516 -2.902 25685 3714 1 5 . 1 1 160 160 PHE C C 160 178.511 178.511 176.002 2.509 25685 3715 1 5 . 1 1 160 160 PHE CA C 160 61.580 61.580 59.142 2.438 25685 3716 1 5 . 1 1 160 160 PHE CB C 160 39.909 39.909 39.804 0.105 25685 3717 1 5 . 1 1 160 160 PHE H H 160 8.026 8.026 8.176 -0.150 25685 3718 1 5 . 1 1 161 161 VAL N N 161 119.870 119.870 119.620 0.250 25685 3719 1 5 . 1 1 161 161 VAL C C 161 177.347 177.347 176.742 0.605 25685 3720 1 5 . 1 1 161 161 VAL CA C 161 66.121 66.121 61.397 4.724 25685 3721 1 5 . 1 1 161 161 VAL CB C 161 30.935 30.935 34.370 -3.435 25685 3722 1 5 . 1 1 161 161 VAL H H 161 8.628 8.628 8.464 0.164 25685 3723 1 5 . 1 1 162 162 LYS N N 162 116.237 116.237 123.928 -7.691 25685 3724 1 5 . 1 1 162 162 LYS C C 162 179.197 179.197 175.671 3.526 25685 3725 1 5 . 1 1 162 162 LYS CA C 162 60.037 60.037 58.784 1.253 25685 3726 1 5 . 1 1 162 162 LYS CB C 162 31.333 31.333 32.490 -1.157 25685 3727 1 5 . 1 1 162 162 LYS H H 162 7.843 7.843 8.833 -0.990 25685 3728 1 5 . 1 1 163 163 ALA N N 163 119.197 119.197 115.355 3.842 25685 3729 1 5 . 1 1 163 163 ALA C C 163 178.635 178.635 174.901 3.734 25685 3730 1 5 . 1 1 163 163 ALA CA C 163 53.681 53.681 51.753 1.928 25685 3731 1 5 . 1 1 163 163 ALA CB C 163 19.586 19.586 19.747 -0.161 25685 3732 1 5 . 1 1 163 163 ALA H H 163 7.630 7.630 7.680 -0.050 25685 3733 1 5 . 1 1 164 164 ASN N N 164 115.956 115.956 117.811 -1.855 25685 3734 1 5 . 1 1 164 164 ASN C C 164 175.556 175.556 175.884 -0.328 25685 3735 1 5 . 1 1 164 164 ASN CA C 164 52.267 52.267 53.338 -1.071 25685 3736 1 5 . 1 1 164 164 ASN CB C 164 39.148 39.148 38.188 0.960 25685 3737 1 5 . 1 1 164 164 ASN H H 164 7.326 7.326 8.270 -0.944 25685 3738 1 5 . 1 1 165 165 PHE N N 165 121.612 121.612 125.825 -4.213 25685 3739 1 5 . 1 1 165 165 PHE C C 165 177.069 177.069 176.637 0.432 25685 3740 1 5 . 1 1 165 165 PHE CA C 165 62.921 62.921 60.599 2.322 25685 3741 1 5 . 1 1 165 165 PHE CB C 165 39.427 39.427 39.225 0.202 25685 3742 1 5 . 1 1 165 165 PHE H H 165 7.408 7.408 8.834 -1.426 25685 3743 1 5 . 1 1 166 166 GLN N N 166 117.147 117.147 119.300 -2.153 25685 3744 1 5 . 1 1 166 166 GLN C C 166 178.922 178.922 178.137 0.785 25685 3745 1 5 . 1 1 166 166 GLN CA C 166 59.262 59.262 58.735 0.527 25685 3746 1 5 . 1 1 166 166 GLN CB C 166 26.811 26.811 28.647 -1.836 25685 3747 1 5 . 1 1 166 166 GLN H H 166 8.605 8.605 8.168 0.437 25685 3748 1 5 . 1 1 167 167 LEU N N 167 121.946 121.946 118.227 3.719 25685 3749 1 5 . 1 1 167 167 LEU C C 167 178.863 178.863 178.809 0.054 25685 3750 1 5 . 1 1 167 167 LEU CA C 167 58.039 58.039 57.298 0.741 25685 3751 1 5 . 1 1 167 167 LEU CB C 167 41.130 41.130 41.428 -0.298 25685 3752 1 5 . 1 1 167 167 LEU H H 167 7.892 7.892 8.042 -0.150 25685 3753 1 5 . 1 1 168 168 ILE N N 168 118.751 118.751 117.080 1.671 25685 3754 1 5 . 1 1 168 168 ILE C C 168 179.908 179.908 177.959 1.949 25685 3755 1 5 . 1 1 168 168 ILE CA C 168 63.886 63.886 63.680 0.206 25685 3756 1 5 . 1 1 168 168 ILE CB C 168 36.170 36.170 37.216 -1.046 25685 3757 1 5 . 1 1 168 168 ILE H H 168 8.065 8.065 7.465 0.600 25685 3758 1 5 . 1 1 169 169 ARG N N 169 125.851 125.851 120.732 5.119 25685 3759 1 5 . 1 1 169 169 ARG C C 169 177.579 177.579 177.543 0.036 25685 3760 1 5 . 1 1 169 169 ARG CA C 169 60.306 60.306 58.714 1.592 25685 3761 1 5 . 1 1 169 169 ARG CB C 169 29.224 29.224 29.080 0.144 25685 3762 1 5 . 1 1 169 169 ARG H H 169 8.995 8.995 7.634 1.361 25685 3763 1 5 . 1 1 170 170 LYS N N 170 119.586 119.586 119.070 0.516 25685 3764 1 5 . 1 1 170 170 LYS C C 170 178.584 178.584 178.624 -0.040 25685 3765 1 5 . 1 1 170 170 LYS CA C 170 60.293 60.293 59.195 1.098 25685 3766 1 5 . 1 1 170 170 LYS CB C 170 32.530 32.530 31.447 1.083 25685 3767 1 5 . 1 1 170 170 LYS H H 170 7.663 7.663 7.592 0.071 25685 3768 1 5 . 1 1 171 171 VAL N N 171 118.348 118.348 115.099 3.249 25685 3769 1 5 . 1 1 171 171 VAL C C 171 177.478 177.478 177.413 0.065 25685 3770 1 5 . 1 1 171 171 VAL CA C 171 66.641 66.641 65.752 0.888 25685 3771 1 5 . 1 1 171 171 VAL CB C 171 31.565 31.565 31.096 0.469 25685 3772 1 5 . 1 1 171 171 VAL H H 171 8.515 8.515 7.452 1.063 25685 3773 1 5 . 1 1 172 172 THR N N 172 115.172 115.172 114.790 0.382 25685 3774 1 5 . 1 1 172 172 THR C C 172 176.320 176.320 176.391 -0.071 25685 3775 1 5 . 1 1 172 172 THR H H 172 8.416 8.416 7.623 0.793 25685 3776 1 5 . 1 1 173 173 GLY N N 173 108.801 108.801 108.164 0.637 25685 3777 1 5 . 1 1 173 173 GLY C C 173 174.138 174.138 175.298 -1.160 25685 3778 1 5 . 1 1 173 173 GLY CA C 173 47.769 47.769 46.692 1.077 25685 3779 1 5 . 1 1 173 173 GLY H H 173 8.505 8.505 7.670 0.835 25685 3780 1 5 . 1 1 174 174 ALA N N 174 123.573 123.573 124.327 -0.754 25685 3781 1 5 . 1 1 174 174 ALA C C 174 178.782 178.782 179.083 -0.301 25685 3782 1 5 . 1 1 174 174 ALA CA C 174 55.604 55.604 54.746 0.858 25685 3783 1 5 . 1 1 174 174 ALA CB C 174 18.778 18.778 18.514 0.265 25685 3784 1 5 . 1 1 174 174 ALA H H 174 8.038 8.038 7.302 0.736 25685 3785 1 5 . 1 1 175 175 ILE N N 175 118.501 118.501 119.381 -0.880 25685 3786 1 5 . 1 1 175 175 ILE C C 175 178.247 178.247 177.821 0.426 25685 3787 1 5 . 1 1 175 175 ILE CA C 175 65.412 65.412 64.366 1.046 25685 3788 1 5 . 1 1 175 175 ILE CB C 175 37.671 37.671 38.112 -0.441 25685 3789 1 5 . 1 1 175 175 ILE H H 175 7.897 7.897 7.431 0.466 25685 3790 1 5 . 1 1 176 176 VAL N N 176 120.104 120.104 118.846 1.258 25685 3791 1 5 . 1 1 176 176 VAL C C 176 177.945 177.945 177.908 0.037 25685 3792 1 5 . 1 1 176 176 VAL CA C 176 67.761 67.761 66.536 1.225 25685 3793 1 5 . 1 1 176 176 VAL CB C 176 30.662 30.662 31.649 -0.987 25685 3794 1 5 . 1 1 176 176 VAL H H 176 8.321 8.321 7.647 0.674 25685 3795 1 5 . 1 1 177 177 LEU N N 177 118.561 118.561 118.616 -0.055 25685 3796 1 5 . 1 1 177 177 LEU C C 177 178.563 178.563 178.608 -0.045 25685 3797 1 5 . 1 1 177 177 LEU CA C 177 58.094 58.094 57.883 0.211 25685 3798 1 5 . 1 1 177 177 LEU CB C 177 41.061 41.061 40.902 0.159 25685 3799 1 5 . 1 1 177 177 LEU H H 177 8.097 8.097 7.304 0.793 25685 3800 1 5 . 1 1 178 178 LEU N N 178 120.868 120.868 119.898 0.970 25685 3801 1 5 . 1 1 178 178 LEU C C 178 178.524 178.524 178.146 0.378 25685 3802 1 5 . 1 1 178 178 LEU CA C 178 57.767 57.767 57.692 0.075 25685 3803 1 5 . 1 1 178 178 LEU CB C 178 40.886 40.886 41.370 -0.484 25685 3804 1 5 . 1 1 178 178 LEU H H 178 8.229 8.229 7.477 0.752 25685 3805 1 5 . 1 1 179 179 TYR N N 179 119.355 119.355 118.540 0.815 25685 3806 1 5 . 1 1 179 179 TYR C C 179 180.059 180.059 177.380 2.679 25685 3807 1 5 . 1 1 179 179 TYR CA C 179 63.844 63.844 60.514 3.330 25685 3808 1 5 . 1 1 179 179 TYR CB C 179 39.508 39.508 38.022 1.486 25685 3809 1 5 . 1 1 179 179 TYR H H 179 8.759 8.759 7.614 1.145 25685 3810 1 5 . 1 1 180 180 LEU N N 180 118.984 118.984 119.066 -0.082 25685 3811 1 5 . 1 1 180 180 LEU C C 180 179.079 179.079 179.244 -0.165 25685 3812 1 5 . 1 1 180 180 LEU CA C 180 58.879 58.879 57.365 1.514 25685 3813 1 5 . 1 1 180 180 LEU CB C 180 41.899 41.899 40.549 1.350 25685 3814 1 5 . 1 1 180 180 LEU H H 180 8.315 8.315 7.596 0.719 25685 3815 1 5 . 1 1 181 181 ALA N N 181 121.826 121.826 122.138 -0.312 25685 3816 1 5 . 1 1 181 181 ALA C C 181 180.009 180.009 179.898 0.111 25685 3817 1 5 . 1 1 181 181 ALA CA C 181 55.700 55.700 55.040 0.660 25685 3818 1 5 . 1 1 181 181 ALA CB C 181 17.713 17.713 18.614 -0.902 25685 3819 1 5 . 1 1 181 181 ALA H H 181 8.480 8.480 7.910 0.570 25685 3820 1 5 . 1 1 182 182 TYR N N 182 118.039 118.039 118.389 -0.350 25685 3821 1 5 . 1 1 182 182 TYR CA C 182 59.038 59.038 61.607 -2.569 25685 3822 1 5 . 1 1 182 182 TYR H H 182 8.856 8.856 7.800 1.056 25685 3823 1 5 . 1 1 183 183 PHE N N 183 124.769 124.769 118.337 6.432 25685 3824 1 5 . 1 1 183 183 PHE CA C 183 63.566 63.566 59.803 3.763 25685 3825 1 5 . 1 1 183 183 PHE H H 183 9.764 9.764 7.601 2.163 25685 3826 1 6 . 1 1 4 4 ALA N N 4 121.533 121.533 122.293 -0.760 25685 3827 1 6 . 1 1 4 4 ALA C C 4 177.632 177.632 178.860 -1.228 25685 3828 1 6 . 1 1 4 4 ALA CA C 4 55.117 55.117 55.099 0.018 25685 3829 1 6 . 1 1 4 4 ALA CB C 4 18.448 18.448 17.876 0.572 25685 3830 1 6 . 1 1 4 4 ALA H H 4 7.977 7.977 8.013 -0.036 25685 3831 1 6 . 1 1 5 5 PHE N N 5 119.988 119.988 118.653 1.335 25685 3832 1 6 . 1 1 5 5 PHE CA C 5 60.759 60.759 60.116 0.643 25685 3833 1 6 . 1 1 5 5 PHE CB C 5 39.221 39.221 38.731 0.490 25685 3834 1 6 . 1 1 5 5 PHE H H 5 8.210 8.210 8.164 0.046 25685 3835 1 6 . 1 1 6 6 ALA C C 6 179.794 179.794 179.171 0.623 25685 3836 1 6 . 1 1 6 6 ALA CA C 6 55.619 55.619 54.860 0.759 25685 3837 1 6 . 1 1 6 6 ALA CB C 6 17.911 17.911 17.925 -0.014 25685 3838 1 6 . 1 1 6 6 ALA H H 6 8.417 8.417 7.804 0.613 25685 3839 1 6 . 1 1 7 7 LEU N N 7 115.852 115.852 118.775 -2.923 25685 3840 1 6 . 1 1 7 7 LEU C C 7 180.196 180.196 178.911 1.285 25685 3841 1 6 . 1 1 7 7 LEU CA C 7 57.528 57.528 57.752 -0.223 25685 3842 1 6 . 1 1 7 7 LEU CB C 7 40.060 40.060 41.283 -1.224 25685 3843 1 6 . 1 1 7 7 LEU H H 7 8.741 8.741 7.413 1.328 25685 3844 1 6 . 1 1 8 8 GLY N N 8 110.199 110.199 106.601 3.598 25685 3845 1 6 . 1 1 8 8 GLY C C 8 176.430 176.430 176.224 0.206 25685 3846 1 6 . 1 1 8 8 GLY CA C 8 46.960 46.960 47.176 -0.216 25685 3847 1 6 . 1 1 8 8 GLY H H 8 8.179 8.179 7.541 0.638 25685 3848 1 6 . 1 1 9 9 ILE N N 9 122.346 122.346 120.691 1.655 25685 3849 1 6 . 1 1 9 9 ILE C C 9 178.143 178.143 177.888 0.255 25685 3850 1 6 . 1 1 9 9 ILE CA C 9 65.048 65.048 62.015 3.033 25685 3851 1 6 . 1 1 9 9 ILE CB C 9 36.841 36.841 36.337 0.503 25685 3852 1 6 . 1 1 9 9 ILE H H 9 7.788 7.788 6.621 1.167 25685 3853 1 6 . 1 1 10 10 LEU N N 10 117.560 117.560 119.902 -2.342 25685 3854 1 6 . 1 1 10 10 LEU C C 10 179.501 179.501 178.444 1.057 25685 3855 1 6 . 1 1 10 10 LEU CA C 10 58.068 58.068 57.931 0.137 25685 3856 1 6 . 1 1 10 10 LEU CB C 10 40.776 40.776 41.374 -0.598 25685 3857 1 6 . 1 1 10 10 LEU H H 10 8.044 8.044 7.474 0.570 25685 3858 1 6 . 1 1 11 11 SER N N 11 113.830 113.830 113.901 -0.071 25685 3859 1 6 . 1 1 11 11 SER CA C 11 61.769 61.769 60.972 0.797 25685 3860 1 6 . 1 1 11 11 SER CB C 11 63.395 63.395 62.849 0.546 25685 3861 1 6 . 1 1 11 11 SER H H 11 8.140 8.140 7.625 0.515 25685 3862 1 6 . 1 1 12 12 VAL N N 12 121.343 121.343 121.391 -0.048 25685 3863 1 6 . 1 1 12 12 VAL C C 12 176.753 176.753 177.299 -0.546 25685 3864 1 6 . 1 1 12 12 VAL CA C 12 64.583 64.583 65.167 -0.584 25685 3865 1 6 . 1 1 12 12 VAL CB C 12 31.067 31.067 31.937 -0.870 25685 3866 1 6 . 1 1 12 12 VAL H H 12 7.587 7.587 7.515 0.072 25685 3867 1 6 . 1 1 13 13 PHE N N 13 115.225 115.225 118.580 -3.355 25685 3868 1 6 . 1 1 13 13 PHE C C 13 177.349 177.349 176.085 1.264 25685 3869 1 6 . 1 1 13 13 PHE CA C 13 58.730 58.730 60.316 -1.586 25685 3870 1 6 . 1 1 13 13 PHE CB C 13 39.785 39.785 39.230 0.555 25685 3871 1 6 . 1 1 13 13 PHE H H 13 7.474 7.474 7.759 -0.285 25685 3872 1 6 . 1 1 14 14 SER N N 14 116.075 116.075 112.467 3.608 25685 3873 1 6 . 1 1 14 14 SER H H 14 7.955 7.955 7.739 0.216 25685 3874 1 6 . 1 1 15 15 PRO C C 15 177.590 177.590 176.025 1.565 25685 3875 1 6 . 1 1 15 15 PRO CA C 15 65.464 65.464 62.431 3.033 25685 3876 1 6 . 1 1 16 16 ALA N N 16 116.288 116.288 120.222 -3.934 25685 3877 1 6 . 1 1 16 16 ALA C C 16 177.563 177.563 176.401 1.162 25685 3878 1 6 . 1 1 16 16 ALA CA C 16 53.010 53.010 51.599 1.411 25685 3879 1 6 . 1 1 16 16 ALA CB C 16 19.975 19.975 20.491 -0.516 25685 3880 1 6 . 1 1 16 16 ALA H H 16 7.455 7.455 7.878 -0.423 25685 3881 1 6 . 1 1 17 17 VAL N N 17 112.072 112.072 121.838 -9.766 25685 3882 1 6 . 1 1 17 17 VAL CA C 17 63.117 63.117 63.270 -0.153 25685 3883 1 6 . 1 1 17 17 VAL CB C 17 33.209 33.209 31.074 2.135 25685 3884 1 6 . 1 1 17 17 VAL H H 17 7.525 7.525 8.278 -0.753 25685 3885 1 6 . 1 1 18 18 LEU N N 18 121.205 121.205 129.810 -8.605 25685 3886 1 6 . 1 1 18 18 LEU CA C 18 58.971 58.971 59.232 -0.261 25685 3887 1 6 . 1 1 18 18 LEU CB C 18 41.161 41.161 38.193 2.968 25685 3888 1 6 . 1 1 18 18 LEU H H 18 8.191 8.191 8.453 -0.262 25685 3889 1 6 . 1 1 19 19 PRO C C 19 177.697 177.697 177.482 0.215 25685 3890 1 6 . 1 1 19 19 PRO CA C 19 65.181 65.181 63.948 1.233 25685 3891 1 6 . 1 1 20 20 VAL N N 20 111.723 111.723 117.840 -6.117 25685 3892 1 6 . 1 1 20 20 VAL C C 20 177.137 177.137 176.612 0.525 25685 3893 1 6 . 1 1 20 20 VAL CA C 20 62.494 62.494 63.730 -1.236 25685 3894 1 6 . 1 1 20 20 VAL CB C 20 31.677 31.677 31.349 0.328 25685 3895 1 6 . 1 1 20 20 VAL H H 20 7.571 7.571 8.216 -0.645 25685 3896 1 6 . 1 1 21 21 VAL N N 21 121.705 121.705 112.674 9.031 25685 3897 1 6 . 1 1 21 21 VAL CA C 21 68.305 68.305 65.700 2.605 25685 3898 1 6 . 1 1 21 21 VAL H H 21 7.732 7.732 8.693 -0.961 25685 3899 1 6 . 1 1 24 24 ILE C C 24 174.359 174.359 175.145 -0.786 25685 3900 1 6 . 1 1 25 25 PHE N N 25 120.132 120.132 114.189 5.943 25685 3901 1 6 . 1 1 25 25 PHE C C 25 175.945 175.945 174.896 1.049 25685 3902 1 6 . 1 1 25 25 PHE CA C 25 60.544 60.544 58.441 2.103 25685 3903 1 6 . 1 1 25 25 PHE H H 25 8.082 8.082 7.852 0.230 25685 3904 1 6 . 1 1 26 26 ALA N N 26 121.341 121.341 120.786 0.555 25685 3905 1 6 . 1 1 26 26 ALA CB C 26 19.784 19.784 21.468 -1.684 25685 3906 1 6 . 1 1 26 26 ALA H H 26 7.539 7.539 8.225 -0.686 25685 3907 1 6 . 1 1 27 27 GLY N N 27 107.530 107.530 105.306 2.224 25685 3908 1 6 . 1 1 27 27 GLY C C 27 174.252 174.252 172.124 2.128 25685 3909 1 6 . 1 1 27 27 GLY CA C 27 45.474 45.474 44.711 0.763 25685 3910 1 6 . 1 1 27 27 GLY H H 27 7.997 7.997 8.496 -0.499 25685 3911 1 6 . 1 1 28 28 SER N N 28 116.299 116.299 114.318 1.981 25685 3912 1 6 . 1 1 28 28 SER C C 28 175.759 175.759 173.799 1.960 25685 3913 1 6 . 1 1 28 28 SER CA C 28 58.526 58.526 57.696 0.830 25685 3914 1 6 . 1 1 28 28 SER CB C 28 64.373 64.373 64.691 -0.318 25685 3915 1 6 . 1 1 28 28 SER H H 28 8.115 8.115 8.266 -0.151 25685 3916 1 6 . 1 1 34 34 ASP C C 34 177.621 177.621 178.425 -0.804 25685 3917 1 6 . 1 1 34 34 ASP CA C 34 57.082 57.082 57.077 0.005 25685 3918 1 6 . 1 1 35 35 ALA N N 35 120.662 120.662 122.401 -1.739 25685 3919 1 6 . 1 1 35 35 ALA C C 35 179.168 179.168 179.654 -0.486 25685 3920 1 6 . 1 1 35 35 ALA CA C 35 55.459 55.459 54.860 0.599 25685 3921 1 6 . 1 1 35 35 ALA CB C 35 18.819 18.819 18.209 0.611 25685 3922 1 6 . 1 1 35 35 ALA H H 35 8.090 8.090 7.593 0.497 25685 3923 1 6 . 1 1 36 36 PHE N N 36 117.638 117.638 116.683 0.955 25685 3924 1 6 . 1 1 36 36 PHE C C 36 177.057 177.057 178.069 -1.012 25685 3925 1 6 . 1 1 36 36 PHE CA C 36 61.472 61.472 61.395 0.077 25685 3926 1 6 . 1 1 36 36 PHE CB C 36 38.860 38.860 38.307 0.553 25685 3927 1 6 . 1 1 36 36 PHE H H 36 8.227 8.227 7.594 0.633 25685 3928 1 6 . 1 1 37 37 LEU N N 37 119.312 119.312 119.977 -0.665 25685 3929 1 6 . 1 1 37 37 LEU C C 37 179.798 179.798 178.947 0.851 25685 3930 1 6 . 1 1 37 37 LEU CA C 37 58.181 58.181 58.558 -0.377 25685 3931 1 6 . 1 1 37 37 LEU CB C 37 40.835 40.835 41.585 -0.750 25685 3932 1 6 . 1 1 37 37 LEU H H 37 8.588 8.588 7.756 0.832 25685 3933 1 6 . 1 1 38 38 ILE N N 38 119.057 119.057 119.754 -0.697 25685 3934 1 6 . 1 1 38 38 ILE C C 38 177.597 177.597 177.831 -0.234 25685 3935 1 6 . 1 1 38 38 ILE CA C 38 64.827 64.827 64.903 -0.076 25685 3936 1 6 . 1 1 38 38 ILE CB C 38 36.321 36.321 38.180 -1.859 25685 3937 1 6 . 1 1 38 38 ILE H H 38 7.932 7.932 7.552 0.380 25685 3938 1 6 . 1 1 39 39 VAL N N 39 118.758 118.758 117.365 1.393 25685 3939 1 6 . 1 1 39 39 VAL C C 39 179.533 179.533 177.786 1.747 25685 3940 1 6 . 1 1 39 39 VAL CA C 39 66.687 66.687 66.124 0.563 25685 3941 1 6 . 1 1 39 39 VAL CB C 39 30.598 30.598 31.431 -0.834 25685 3942 1 6 . 1 1 39 39 VAL H H 39 7.922 7.922 7.706 0.216 25685 3943 1 6 . 1 1 40 40 ALA N N 40 125.385 125.385 122.573 2.812 25685 3944 1 6 . 1 1 40 40 ALA C C 40 179.200 179.200 179.733 -0.533 25685 3945 1 6 . 1 1 40 40 ALA CA C 40 55.283 55.283 54.947 0.336 25685 3946 1 6 . 1 1 40 40 ALA CB C 40 17.197 17.197 18.618 -1.421 25685 3947 1 6 . 1 1 40 40 ALA H H 40 9.091 9.091 7.844 1.247 25685 3948 1 6 . 1 1 41 41 GLY N N 41 106.978 106.978 106.176 0.802 25685 3949 1 6 . 1 1 41 41 GLY C C 41 176.171 176.171 175.771 0.400 25685 3950 1 6 . 1 1 41 41 GLY CA C 41 47.322 47.322 47.110 0.212 25685 3951 1 6 . 1 1 41 41 GLY H H 41 8.565 8.565 8.219 0.346 25685 3952 1 6 . 1 1 42 42 LEU N N 42 126.914 126.914 121.665 5.249 25685 3953 1 6 . 1 1 42 42 LEU C C 42 178.119 178.119 178.110 0.009 25685 3954 1 6 . 1 1 42 42 LEU CA C 42 58.523 58.523 58.040 0.483 25685 3955 1 6 . 1 1 42 42 LEU CB C 42 42.125 42.125 41.587 0.538 25685 3956 1 6 . 1 1 42 42 LEU H H 42 8.573 8.573 7.650 0.923 25685 3957 1 6 . 1 1 46 46 MET N N 46 121.710 121.710 123.300 -1.590 25685 3958 1 6 . 1 1 46 46 MET C C 46 179.540 179.540 177.765 1.775 25685 3959 1 6 . 1 1 46 46 MET CA C 46 55.968 55.968 58.723 -2.755 25685 3960 1 6 . 1 1 46 46 MET H H 46 8.589 8.589 8.471 0.118 25685 3961 1 6 . 1 1 47 47 LEU N N 47 117.448 117.448 120.376 -2.928 25685 3962 1 6 . 1 1 47 47 LEU HA H 47 3.992 3.992 4.121 -0.129 25685 3963 1 6 . 1 1 47 47 LEU C C 47 179.082 179.082 178.691 0.391 25685 3964 1 6 . 1 1 47 47 LEU CA C 47 58.157 58.157 58.101 0.056 25685 3965 1 6 . 1 1 47 47 LEU CB C 47 41.858 41.858 41.874 -0.016 25685 3966 1 6 . 1 1 47 47 LEU H H 47 8.769 8.769 8.035 0.734 25685 3967 1 6 . 1 1 48 48 ILE N N 48 117.500 117.500 117.851 -0.351 25685 3968 1 6 . 1 1 48 48 ILE C C 48 180.298 180.298 178.335 1.963 25685 3969 1 6 . 1 1 48 48 ILE CA C 48 65.627 65.627 64.260 1.367 25685 3970 1 6 . 1 1 48 48 ILE CB C 48 37.839 37.839 37.393 0.446 25685 3971 1 6 . 1 1 48 48 ILE H H 48 8.093 8.093 7.312 0.781 25685 3972 1 6 . 1 1 49 49 LEU N N 49 123.708 123.708 119.549 4.159 25685 3973 1 6 . 1 1 49 49 LEU C C 49 179.721 179.721 179.217 0.504 25685 3974 1 6 . 1 1 49 49 LEU CA C 49 58.788 58.788 57.502 1.286 25685 3975 1 6 . 1 1 49 49 LEU CB C 49 40.761 40.761 41.913 -1.152 25685 3976 1 6 . 1 1 49 49 LEU H H 49 8.833 8.833 7.645 1.188 25685 3977 1 6 . 1 1 50 50 GLY N N 50 109.284 109.284 107.270 2.014 25685 3978 1 6 . 1 1 50 50 GLY C C 50 176.937 176.937 175.295 1.642 25685 3979 1 6 . 1 1 50 50 GLY CA C 50 47.821 47.821 47.111 0.710 25685 3980 1 6 . 1 1 50 50 GLY H H 50 9.658 9.658 7.694 1.964 25685 3981 1 6 . 1 1 51 51 TYR N N 51 125.640 125.640 123.833 1.807 25685 3982 1 6 . 1 1 51 51 TYR C C 51 177.102 177.102 174.622 2.480 25685 3983 1 6 . 1 1 51 51 TYR CA C 51 61.948 61.948 56.261 5.687 25685 3984 1 6 . 1 1 51 51 TYR CB C 51 38.871 38.871 37.382 1.489 25685 3985 1 6 . 1 1 51 51 TYR H H 51 8.795 8.795 7.730 1.065 25685 3986 1 6 . 1 1 52 52 THR N N 52 116.273 116.273 117.286 -1.013 25685 3987 1 6 . 1 1 52 52 THR C C 52 176.969 176.969 174.202 2.767 25685 3988 1 6 . 1 1 52 52 THR CA C 52 67.972 67.972 62.617 5.355 25685 3989 1 6 . 1 1 52 52 THR H H 52 8.456 8.456 7.664 0.792 25685 3990 1 6 . 1 1 53 53 ALA N N 53 122.122 122.122 129.030 -6.908 25685 3991 1 6 . 1 1 53 53 ALA C C 53 179.907 179.907 177.754 2.153 25685 3992 1 6 . 1 1 53 53 ALA CA C 53 55.722 55.722 51.191 4.531 25685 3993 1 6 . 1 1 53 53 ALA CB C 53 18.786 18.786 19.965 -1.179 25685 3994 1 6 . 1 1 53 53 ALA H H 53 9.058 9.058 7.849 1.209 25685 3995 1 6 . 1 1 54 54 SER N N 54 115.434 115.434 113.556 1.878 25685 3996 1 6 . 1 1 54 54 SER C C 54 176.433 176.433 174.745 1.688 25685 3997 1 6 . 1 1 54 54 SER CA C 54 55.828 55.828 58.230 -2.402 25685 3998 1 6 . 1 1 54 54 SER H H 54 8.040 8.040 8.162 -0.122 25685 3999 1 6 . 1 1 55 55 LEU N N 55 123.045 123.045 121.910 1.135 25685 4000 1 6 . 1 1 55 55 LEU C C 55 178.789 178.789 176.170 2.619 25685 4001 1 6 . 1 1 55 55 LEU CA C 55 57.633 57.633 55.955 1.678 25685 4002 1 6 . 1 1 55 55 LEU CB C 55 41.293 41.293 38.824 2.470 25685 4003 1 6 . 1 1 55 55 LEU H H 55 8.255 8.255 8.367 -0.112 25685 4004 1 6 . 1 1 56 56 PHE N N 56 114.426 114.426 125.648 -11.222 25685 4005 1 6 . 1 1 56 56 PHE C C 56 177.507 177.507 175.233 2.274 25685 4006 1 6 . 1 1 56 56 PHE CA C 56 61.068 61.068 58.428 2.640 25685 4007 1 6 . 1 1 56 56 PHE CB C 56 40.107 40.107 40.931 -0.824 25685 4008 1 6 . 1 1 56 56 PHE H H 56 7.590 7.590 8.495 -0.905 25685 4009 1 6 . 1 1 57 57 PHE N N 57 114.701 114.701 117.496 -2.795 25685 4010 1 6 . 1 1 57 57 PHE C C 57 176.203 176.203 177.049 -0.846 25685 4011 1 6 . 1 1 57 57 PHE CA C 57 58.503 58.503 57.957 0.546 25685 4012 1 6 . 1 1 57 57 PHE CB C 57 41.114 41.114 38.942 2.172 25685 4013 1 6 . 1 1 57 57 PHE H H 57 8.514 8.514 8.494 0.020 25685 4014 1 6 . 1 1 58 58 GLY N N 58 111.041 111.041 111.349 -0.308 25685 4015 1 6 . 1 1 58 58 GLY C C 58 174.240 174.240 176.495 -2.255 25685 4016 1 6 . 1 1 58 58 GLY CA C 58 44.827 44.827 47.239 -2.412 25685 4017 1 6 . 1 1 58 58 GLY H H 58 7.998 7.998 8.917 -0.919 25685 4018 1 6 . 1 1 59 59 PHE N N 59 127.950 127.950 122.807 5.143 25685 4019 1 6 . 1 1 59 59 PHE C C 59 176.612 176.612 176.575 0.037 25685 4020 1 6 . 1 1 59 59 PHE CA C 59 61.598 61.598 58.951 2.647 25685 4021 1 6 . 1 1 59 59 PHE CB C 59 40.870 40.870 39.157 1.712 25685 4022 1 6 . 1 1 59 59 PHE H H 59 9.105 9.105 8.260 0.845 25685 4023 1 6 . 1 1 60 60 PHE N N 60 114.868 114.868 119.578 -4.710 25685 4024 1 6 . 1 1 60 60 PHE C C 60 177.989 177.989 176.812 1.177 25685 4025 1 6 . 1 1 60 60 PHE CA C 60 61.517 61.517 61.623 -0.106 25685 4026 1 6 . 1 1 60 60 PHE CB C 60 38.248 38.248 39.240 -0.993 25685 4027 1 6 . 1 1 60 60 PHE H H 60 8.796 8.796 8.344 0.452 25685 4028 1 6 . 1 1 61 61 ARG N N 61 118.812 118.812 118.371 0.441 25685 4029 1 6 . 1 1 61 61 ARG C C 61 177.813 177.813 178.296 -0.483 25685 4030 1 6 . 1 1 61 61 ARG CA C 61 60.497 60.497 58.655 1.842 25685 4031 1 6 . 1 1 61 61 ARG CB C 61 28.915 28.915 29.382 -0.467 25685 4032 1 6 . 1 1 61 61 ARG H H 61 7.600 7.600 7.654 -0.054 25685 4033 1 6 . 1 1 62 62 VAL N N 62 119.157 119.157 119.145 0.012 25685 4034 1 6 . 1 1 62 62 VAL C C 62 177.670 177.670 177.355 0.315 25685 4035 1 6 . 1 1 62 62 VAL CA C 62 66.749 66.749 65.110 1.639 25685 4036 1 6 . 1 1 62 62 VAL CB C 62 30.306 30.306 31.788 -1.482 25685 4037 1 6 . 1 1 62 62 VAL H H 62 7.679 7.679 7.316 0.363 25685 4038 1 6 . 1 1 63 63 VAL N N 63 117.999 117.999 118.277 -0.278 25685 4039 1 6 . 1 1 63 63 VAL C C 63 177.639 177.639 178.364 -0.725 25685 4040 1 6 . 1 1 63 63 VAL CA C 63 66.836 66.836 64.841 1.994 25685 4041 1 6 . 1 1 63 63 VAL CB C 63 30.496 30.496 30.241 0.255 25685 4042 1 6 . 1 1 63 63 VAL H H 63 7.429 7.429 7.300 0.129 25685 4043 1 6 . 1 1 64 64 ALA N N 64 120.451 120.451 122.800 -2.349 25685 4044 1 6 . 1 1 64 64 ALA C C 64 179.134 179.134 179.651 -0.517 25685 4045 1 6 . 1 1 64 64 ALA CA C 64 55.618 55.618 54.842 0.776 25685 4046 1 6 . 1 1 64 64 ALA CB C 64 17.950 17.950 17.965 -0.015 25685 4047 1 6 . 1 1 64 64 ALA H H 64 8.169 8.169 7.503 0.666 25685 4048 1 6 . 1 1 65 65 MET N N 65 116.532 116.532 116.274 0.258 25685 4049 1 6 . 1 1 65 65 MET C C 65 177.961 177.961 178.323 -0.362 25685 4050 1 6 . 1 1 65 65 MET CA C 65 58.161 58.161 58.433 -0.272 25685 4051 1 6 . 1 1 65 65 MET CB C 65 31.208 31.208 31.926 -0.718 25685 4052 1 6 . 1 1 65 65 MET H H 65 7.857 7.857 7.423 0.434 25685 4053 1 6 . 1 1 66 66 LEU C C 66 179.022 179.022 179.263 -0.241 25685 4054 1 6 . 1 1 66 66 LEU CA C 66 58.412 58.412 57.484 0.928 25685 4055 1 6 . 1 1 67 67 PHE N N 67 116.877 116.877 119.915 -3.038 25685 4056 1 6 . 1 1 67 67 PHE C C 67 177.908 177.908 177.672 0.236 25685 4057 1 6 . 1 1 67 67 PHE CA C 67 62.402 62.402 61.751 0.651 25685 4058 1 6 . 1 1 67 67 PHE CB C 67 39.203 39.203 39.044 0.159 25685 4059 1 6 . 1 1 67 67 PHE H H 67 7.923 7.923 7.901 0.022 25685 4060 1 6 . 1 1 68 68 LEU N N 68 118.860 118.860 119.312 -0.452 25685 4061 1 6 . 1 1 68 68 LEU C C 68 179.032 179.032 178.336 0.696 25685 4062 1 6 . 1 1 68 68 LEU CA C 68 58.397 58.397 57.577 0.820 25685 4063 1 6 . 1 1 68 68 LEU CB C 68 40.803 40.803 41.276 -0.473 25685 4064 1 6 . 1 1 68 68 LEU H H 68 8.167 8.167 8.110 0.057 25685 4065 1 6 . 1 1 71 71 PHE N N 71 120.700 120.700 120.815 -0.115 25685 4066 1 6 . 1 1 71 71 PHE C C 71 177.670 177.670 176.949 0.721 25685 4067 1 6 . 1 1 71 71 PHE CA C 71 60.528 60.528 60.275 0.253 25685 4068 1 6 . 1 1 71 71 PHE H H 71 7.847 7.847 7.394 0.453 25685 4069 1 6 . 1 1 72 72 ALA N N 72 120.506 120.506 122.192 -1.686 25685 4070 1 6 . 1 1 72 72 ALA C C 72 178.944 178.944 179.182 -0.238 25685 4071 1 6 . 1 1 72 72 ALA CA C 72 55.461 55.461 54.856 0.605 25685 4072 1 6 . 1 1 72 72 ALA CB C 72 17.829 17.829 18.043 -0.214 25685 4073 1 6 . 1 1 72 72 ALA H H 72 8.533 8.533 8.552 -0.019 25685 4074 1 6 . 1 1 73 73 LEU N N 73 115.071 115.071 119.482 -4.411 25685 4075 1 6 . 1 1 73 73 LEU C C 73 180.831 180.831 178.500 2.331 25685 4076 1 6 . 1 1 73 73 LEU CA C 73 58.091 58.091 58.194 -0.103 25685 4077 1 6 . 1 1 73 73 LEU CB C 73 41.082 41.082 42.042 -0.960 25685 4078 1 6 . 1 1 73 73 LEU H H 73 8.458 8.458 8.214 0.244 25685 4079 1 6 . 1 1 74 74 ILE N N 74 121.365 121.365 118.534 2.831 25685 4080 1 6 . 1 1 74 74 ILE C C 74 178.287 178.287 177.511 0.776 25685 4081 1 6 . 1 1 74 74 ILE CA C 74 65.335 65.335 64.127 1.208 25685 4082 1 6 . 1 1 74 74 ILE CB C 74 37.453 37.453 37.858 -0.405 25685 4083 1 6 . 1 1 74 74 ILE H H 74 8.220 8.220 7.339 0.881 25685 4084 1 6 . 1 1 75 75 LEU N N 75 119.200 119.200 120.791 -1.591 25685 4085 1 6 . 1 1 75 75 LEU C C 75 177.548 177.548 178.715 -1.167 25685 4086 1 6 . 1 1 75 75 LEU CA C 75 56.938 56.938 57.779 -0.841 25685 4087 1 6 . 1 1 75 75 LEU CB C 75 41.541 41.541 41.490 0.051 25685 4088 1 6 . 1 1 75 75 LEU H H 75 7.866 7.866 7.335 0.531 25685 4089 1 6 . 1 1 76 76 LEU N N 76 116.338 116.338 117.457 -1.119 25685 4090 1 6 . 1 1 76 76 LEU C C 76 176.889 176.889 177.854 -0.965 25685 4091 1 6 . 1 1 76 76 LEU CA C 76 54.807 54.807 57.071 -2.264 25685 4092 1 6 . 1 1 76 76 LEU CB C 76 41.830 41.830 42.111 -0.281 25685 4093 1 6 . 1 1 76 76 LEU H H 76 7.432 7.432 7.910 -0.478 25685 4094 1 6 . 1 1 77 77 SER N N 77 114.630 114.630 111.118 3.512 25685 4095 1 6 . 1 1 77 77 SER C C 77 174.752 174.752 174.613 0.139 25685 4096 1 6 . 1 1 77 77 SER CA C 77 58.967 58.967 59.758 -0.791 25685 4097 1 6 . 1 1 77 77 SER CB C 77 64.686 64.686 63.124 1.562 25685 4098 1 6 . 1 1 77 77 SER H H 77 7.423 7.423 7.736 -0.313 25685 4099 1 6 . 1 1 78 78 ASP N N 78 123.054 123.054 122.321 0.733 25685 4100 1 6 . 1 1 78 78 ASP C C 78 176.716 176.716 176.253 0.463 25685 4101 1 6 . 1 1 78 78 ASP CA C 78 54.848 54.848 54.627 0.221 25685 4102 1 6 . 1 1 78 78 ASP CB C 78 40.423 40.423 41.005 -0.582 25685 4103 1 6 . 1 1 78 78 ASP H H 78 8.294 8.294 7.471 0.823 25685 4104 1 6 . 1 1 79 79 GLU N N 79 119.104 119.104 117.934 1.170 25685 4105 1 6 . 1 1 79 79 GLU C C 79 176.391 176.391 176.459 -0.068 25685 4106 1 6 . 1 1 79 79 GLU CA C 79 56.258 56.258 55.401 0.857 25685 4107 1 6 . 1 1 79 79 GLU CB C 79 29.656 29.656 30.252 -0.596 25685 4108 1 6 . 1 1 79 79 GLU H H 79 8.384 8.384 8.325 0.059 25685 4109 1 6 . 1 1 80 80 LEU N N 80 121.254 121.254 122.001 -0.747 25685 4110 1 6 . 1 1 80 80 LEU C C 80 177.164 177.164 175.792 1.372 25685 4111 1 6 . 1 1 80 80 LEU CA C 80 54.670 54.670 56.260 -1.589 25685 4112 1 6 . 1 1 80 80 LEU CB C 80 42.633 42.633 41.744 0.889 25685 4113 1 6 . 1 1 80 80 LEU H H 80 7.637 7.637 8.401 -0.764 25685 4114 1 6 . 1 1 81 81 ASP N N 81 123.410 123.410 124.341 -0.931 25685 4115 1 6 . 1 1 81 81 ASP C C 81 177.552 177.552 175.244 2.308 25685 4116 1 6 . 1 1 81 81 ASP CA C 81 55.110 55.110 52.951 2.159 25685 4117 1 6 . 1 1 81 81 ASP CB C 81 42.693 42.693 44.441 -1.748 25685 4118 1 6 . 1 1 81 81 ASP H H 81 8.403 8.403 8.199 0.204 25685 4119 1 6 . 1 1 82 82 GLU N N 82 125.047 125.047 118.400 6.647 25685 4120 1 6 . 1 1 82 82 GLU C C 82 178.198 178.198 177.775 0.423 25685 4121 1 6 . 1 1 82 82 GLU CA C 82 59.221 59.221 56.383 2.838 25685 4122 1 6 . 1 1 82 82 GLU CB C 82 29.176 29.176 30.663 -1.487 25685 4123 1 6 . 1 1 82 82 GLU H H 82 8.744 8.744 8.548 0.196 25685 4124 1 6 . 1 1 83 83 LYS N N 83 118.476 118.476 117.357 1.119 25685 4125 1 6 . 1 1 83 83 LYS C C 83 179.356 179.356 177.744 1.612 25685 4126 1 6 . 1 1 83 83 LYS CA C 83 59.170 59.170 59.373 -0.203 25685 4127 1 6 . 1 1 83 83 LYS CB C 83 31.509 31.509 31.242 0.267 25685 4128 1 6 . 1 1 83 83 LYS H H 83 8.607 8.607 9.005 -0.398 25685 4129 1 6 . 1 1 84 84 VAL N N 84 118.407 118.407 115.538 2.869 25685 4130 1 6 . 1 1 84 84 VAL C C 84 177.653 177.653 176.899 0.754 25685 4131 1 6 . 1 1 84 84 VAL CA C 84 65.416 65.416 65.898 -0.482 25685 4132 1 6 . 1 1 84 84 VAL CB C 84 31.313 31.313 31.572 -0.259 25685 4133 1 6 . 1 1 84 84 VAL H H 84 7.870 7.870 8.006 -0.136 25685 4134 1 6 . 1 1 85 85 SER N N 85 116.146 116.146 115.677 0.469 25685 4135 1 6 . 1 1 85 85 SER C C 85 177.496 177.496 176.669 0.827 25685 4136 1 6 . 1 1 85 85 SER CA C 85 61.764 61.764 61.551 0.213 25685 4137 1 6 . 1 1 85 85 SER CB C 85 63.654 63.654 62.719 0.935 25685 4138 1 6 . 1 1 85 85 SER H H 85 8.083 8.083 7.984 0.099 25685 4139 1 6 . 1 1 86 86 ILE N N 86 122.570 122.570 118.821 3.749 25685 4140 1 6 . 1 1 86 86 ILE C C 86 178.698 178.698 177.266 1.432 25685 4141 1 6 . 1 1 86 86 ILE CA C 86 64.526 64.526 63.073 1.453 25685 4142 1 6 . 1 1 86 86 ILE CB C 86 37.393 37.393 37.557 -0.164 25685 4143 1 6 . 1 1 86 86 ILE H H 86 8.102 8.102 7.423 0.679 25685 4144 1 6 . 1 1 87 87 PHE N N 87 121.340 121.340 121.024 0.316 25685 4145 1 6 . 1 1 87 87 PHE C C 87 177.671 177.671 176.235 1.436 25685 4146 1 6 . 1 1 87 87 PHE CA C 87 61.098 61.098 60.920 0.178 25685 4147 1 6 . 1 1 87 87 PHE CB C 87 39.151 39.151 38.205 0.946 25685 4148 1 6 . 1 1 87 87 PHE H H 87 7.719 7.719 7.943 -0.224 25685 4149 1 6 . 1 1 88 88 ALA N N 88 120.921 120.921 120.837 0.084 25685 4150 1 6 . 1 1 88 88 ALA C C 88 180.030 180.030 179.650 0.380 25685 4151 1 6 . 1 1 88 88 ALA CA C 88 55.147 55.147 54.321 0.827 25685 4152 1 6 . 1 1 88 88 ALA CB C 88 19.053 19.053 17.964 1.089 25685 4153 1 6 . 1 1 88 88 ALA H H 88 8.679 8.679 7.850 0.829 25685 4154 1 6 . 1 1 89 89 SER N N 89 114.285 114.285 114.694 -0.409 25685 4155 1 6 . 1 1 89 89 SER C C 89 177.040 177.040 176.331 0.709 25685 4156 1 6 . 1 1 89 89 SER CA C 89 61.314 61.314 61.318 -0.004 25685 4157 1 6 . 1 1 89 89 SER CB C 89 63.371 63.371 62.990 0.381 25685 4158 1 6 . 1 1 89 89 SER H H 89 8.242 8.242 7.469 0.773 25685 4159 1 6 . 1 1 90 90 ARG N N 90 121.829 121.829 121.144 0.685 25685 4160 1 6 . 1 1 90 90 ARG C C 90 179.247 179.247 177.926 1.321 25685 4161 1 6 . 1 1 90 90 ARG CA C 90 58.444 58.444 58.543 -0.099 25685 4162 1 6 . 1 1 90 90 ARG CB C 90 29.532 29.532 29.260 0.272 25685 4163 1 6 . 1 1 90 90 ARG H H 90 7.907 7.907 7.714 0.193 25685 4164 1 6 . 1 1 91 91 MET N N 91 117.124 117.124 115.848 1.276 25685 4165 1 6 . 1 1 91 91 MET C C 91 177.504 177.504 177.801 -0.297 25685 4166 1 6 . 1 1 91 91 MET CA C 91 57.152 57.152 59.471 -2.320 25685 4167 1 6 . 1 1 91 91 MET CB C 91 32.510 32.510 31.659 0.851 25685 4168 1 6 . 1 1 91 91 MET H H 91 7.930 7.930 7.703 0.227 25685 4169 1 6 . 1 1 92 92 THR N N 92 108.478 108.478 114.088 -5.610 25685 4170 1 6 . 1 1 92 92 THR C C 92 176.367 176.367 176.547 -0.180 25685 4171 1 6 . 1 1 92 92 THR CA C 92 63.564 63.564 65.493 -1.929 25685 4172 1 6 . 1 1 92 92 THR H H 92 7.847 7.847 7.828 0.019 25685 4173 1 6 . 1 1 93 93 SER N N 93 117.950 117.950 117.768 0.182 25685 4174 1 6 . 1 1 93 93 SER C C 93 176.552 176.552 176.534 0.018 25685 4175 1 6 . 1 1 93 93 SER CA C 93 60.821 60.821 60.820 0.001 25685 4176 1 6 . 1 1 93 93 SER CB C 93 63.311 63.311 63.064 0.247 25685 4177 1 6 . 1 1 93 93 SER H H 93 7.732 7.732 7.671 0.061 25685 4178 1 6 . 1 1 94 94 GLY N N 94 111.265 111.265 110.143 1.122 25685 4179 1 6 . 1 1 94 94 GLY C C 94 175.198 175.198 175.517 -0.319 25685 4180 1 6 . 1 1 94 94 GLY CA C 94 46.021 46.021 45.161 0.860 25685 4181 1 6 . 1 1 94 94 GLY H H 94 8.419 8.419 7.755 0.664 25685 4182 1 6 . 1 1 95 95 LEU N N 95 121.019 121.019 118.468 2.551 25685 4183 1 6 . 1 1 95 95 LEU C C 95 177.810 177.810 176.105 1.705 25685 4184 1 6 . 1 1 95 95 LEU CA C 95 56.012 56.012 55.925 0.088 25685 4185 1 6 . 1 1 95 95 LEU CB C 95 42.122 42.122 42.052 0.070 25685 4186 1 6 . 1 1 95 95 LEU H H 95 7.849 7.849 7.416 0.433 25685 4187 1 6 . 1 1 96 96 SER N N 96 115.465 115.465 117.088 -1.623 25685 4188 1 6 . 1 1 96 96 SER C C 96 175.543 175.543 173.195 2.348 25685 4189 1 6 . 1 1 96 96 SER CA C 96 60.151 60.151 57.942 2.209 25685 4190 1 6 . 1 1 96 96 SER H H 96 8.349 8.349 8.141 0.208 25685 4191 1 6 . 1 1 97 97 TRP N N 97 121.711 121.711 119.877 1.834 25685 4192 1 6 . 1 1 97 97 TRP C C 97 176.973 176.973 175.561 1.412 25685 4193 1 6 . 1 1 97 97 TRP CA C 97 58.250 58.250 58.199 0.051 25685 4194 1 6 . 1 1 97 97 TRP CB C 97 28.899 28.899 29.156 -0.257 25685 4195 1 6 . 1 1 97 97 TRP H H 97 7.723 7.723 8.433 -0.710 25685 4196 1 6 . 1 1 98 98 LYS N N 98 119.868 119.868 122.808 -2.940 25685 4197 1 6 . 1 1 98 98 LYS C C 98 178.021 178.021 175.917 2.104 25685 4198 1 6 . 1 1 98 98 LYS CA C 98 56.340 56.340 56.747 -0.407 25685 4199 1 6 . 1 1 98 98 LYS CB C 98 31.933 31.933 34.292 -2.359 25685 4200 1 6 . 1 1 98 98 LYS H H 98 7.855 7.855 8.549 -0.694 25685 4201 1 6 . 1 1 99 99 ILE N N 99 120.044 120.044 121.946 -1.902 25685 4202 1 6 . 1 1 99 99 ILE C C 99 176.769 176.769 176.295 0.474 25685 4203 1 6 . 1 1 99 99 ILE CA C 99 62.758 62.758 61.666 1.092 25685 4204 1 6 . 1 1 99 99 ILE CB C 99 37.809 37.809 37.488 0.321 25685 4205 1 6 . 1 1 99 99 ILE H H 99 8.069 8.069 8.087 -0.018 25685 4206 1 6 . 1 1 100 100 GLN C C 100 176.315 176.315 175.720 0.595 25685 4207 1 6 . 1 1 100 100 GLN CA C 100 57.486 57.486 56.322 1.164 25685 4208 1 6 . 1 1 101 101 THR N N 101 109.873 109.873 114.377 -4.504 25685 4209 1 6 . 1 1 101 101 THR C C 101 174.664 174.664 173.977 0.687 25685 4210 1 6 . 1 1 101 101 THR CA C 101 61.709 61.709 63.938 -2.229 25685 4211 1 6 . 1 1 101 101 THR CB C 101 69.290 69.290 69.724 -0.434 25685 4212 1 6 . 1 1 101 101 THR H H 101 7.508 7.508 8.427 -0.919 25685 4213 1 6 . 1 1 102 102 LEU N N 102 124.434 124.434 128.548 -4.114 25685 4214 1 6 . 1 1 102 102 LEU C C 102 174.681 174.681 174.559 0.122 25685 4215 1 6 . 1 1 102 102 LEU CA C 102 53.063 53.063 51.697 1.366 25685 4216 1 6 . 1 1 102 102 LEU CB C 102 41.139 41.139 42.254 -1.115 25685 4217 1 6 . 1 1 102 102 LEU H H 102 7.569 7.569 7.808 -0.239 25685 4218 1 6 . 1 1 103 103 PRO C C 103 178.076 178.076 175.944 2.132 25685 4219 1 6 . 1 1 103 103 PRO CA C 103 62.570 62.570 63.793 -1.223 25685 4220 1 6 . 1 1 103 103 PRO CB C 103 31.534 31.534 31.918 -0.384 25685 4221 1 6 . 1 1 104 104 SER N N 104 119.929 119.929 118.172 1.757 25685 4222 1 6 . 1 1 104 104 SER C C 104 176.432 176.432 174.052 2.380 25685 4223 1 6 . 1 1 104 104 SER CA C 104 61.976 61.976 58.200 3.776 25685 4224 1 6 . 1 1 104 104 SER CB C 104 63.611 63.611 64.371 -0.760 25685 4225 1 6 . 1 1 104 104 SER H H 104 8.784 8.784 8.093 0.691 25685 4226 1 6 . 1 1 105 105 PHE N N 105 119.519 119.519 125.085 -5.566 25685 4227 1 6 . 1 1 105 105 PHE C C 105 176.852 176.852 173.793 3.059 25685 4228 1 6 . 1 1 105 105 PHE CA C 105 60.162 60.162 55.453 4.708 25685 4229 1 6 . 1 1 105 105 PHE CB C 105 38.455 38.455 37.192 1.263 25685 4230 1 6 . 1 1 105 105 PHE H H 105 8.620 8.620 8.498 0.122 25685 4231 1 6 . 1 1 106 106 PHE N N 106 118.809 118.809 119.416 -0.607 25685 4232 1 6 . 1 1 106 106 PHE C C 106 176.741 176.741 175.811 0.930 25685 4233 1 6 . 1 1 106 106 PHE CA C 106 61.421 61.421 57.788 3.633 25685 4234 1 6 . 1 1 106 106 PHE CB C 106 38.788 38.788 35.912 2.876 25685 4235 1 6 . 1 1 106 106 PHE H H 106 7.519 7.519 7.862 -0.343 25685 4236 1 6 . 1 1 107 107 PHE N N 107 117.382 117.382 119.232 -1.850 25685 4237 1 6 . 1 1 107 107 PHE C C 107 177.771 177.771 177.355 0.416 25685 4238 1 6 . 1 1 107 107 PHE CA C 107 61.099 61.099 61.114 -0.015 25685 4239 1 6 . 1 1 107 107 PHE CB C 107 38.677 38.677 37.815 0.862 25685 4240 1 6 . 1 1 107 107 PHE H H 107 7.903 7.903 8.453 -0.550 25685 4241 1 6 . 1 1 108 108 GLY N N 108 105.340 105.340 107.016 -1.676 25685 4242 1 6 . 1 1 108 108 GLY C C 108 174.574 174.574 175.924 -1.350 25685 4243 1 6 . 1 1 108 108 GLY CA C 108 47.508 47.508 46.752 0.756 25685 4244 1 6 . 1 1 108 108 GLY H H 108 8.351 8.351 7.222 1.129 25685 4245 1 6 . 1 1 109 109 MET N N 109 119.831 119.831 120.590 -0.759 25685 4246 1 6 . 1 1 109 109 MET C C 109 177.522 177.522 178.286 -0.764 25685 4247 1 6 . 1 1 109 109 MET CA C 109 58.658 58.658 58.434 0.224 25685 4248 1 6 . 1 1 109 109 MET CB C 109 32.106 32.106 32.119 -0.013 25685 4249 1 6 . 1 1 109 109 MET H H 109 7.919 7.919 7.251 0.668 25685 4250 1 6 . 1 1 110 110 LEU N N 110 119.908 119.908 118.261 1.647 25685 4251 1 6 . 1 1 110 110 LEU C C 110 178.170 178.170 179.618 -1.448 25685 4252 1 6 . 1 1 110 110 LEU CA C 110 57.941 57.941 57.275 0.666 25685 4253 1 6 . 1 1 110 110 LEU CB C 110 41.055 41.055 40.926 0.129 25685 4254 1 6 . 1 1 110 110 LEU H H 110 7.744 7.744 7.786 -0.042 25685 4255 1 6 . 1 1 111 111 LEU N N 111 116.594 116.594 116.304 0.290 25685 4256 1 6 . 1 1 111 111 LEU C C 111 178.960 178.960 178.194 0.766 25685 4257 1 6 . 1 1 111 111 LEU CA C 111 57.366 57.366 58.239 -0.872 25685 4258 1 6 . 1 1 111 111 LEU CB C 111 40.259 40.259 40.744 -0.485 25685 4259 1 6 . 1 1 111 111 LEU H H 111 7.732 7.732 7.452 0.280 25685 4260 1 6 . 1 1 112 112 ALA N N 112 121.020 121.020 121.098 -0.078 25685 4261 1 6 . 1 1 112 112 ALA C C 112 178.700 178.700 179.109 -0.409 25685 4262 1 6 . 1 1 112 112 ALA CA C 112 55.432 55.432 54.998 0.434 25685 4263 1 6 . 1 1 112 112 ALA CB C 112 18.214 18.214 18.253 -0.039 25685 4264 1 6 . 1 1 112 112 ALA H H 112 8.121 8.121 7.567 0.554 25685 4265 1 6 . 1 1 113 113 PHE N N 113 118.369 118.369 116.503 1.866 25685 4266 1 6 . 1 1 113 113 PHE C C 113 176.091 176.091 177.208 -1.117 25685 4267 1 6 . 1 1 113 113 PHE CA C 113 61.388 61.388 59.719 1.669 25685 4268 1 6 . 1 1 113 113 PHE CB C 113 39.688 39.688 38.271 1.417 25685 4269 1 6 . 1 1 113 113 PHE H H 113 8.237 8.237 7.671 0.566 25685 4270 1 6 . 1 1 114 114 LEU N N 114 114.214 114.214 117.001 -2.787 25685 4271 1 6 . 1 1 114 114 LEU C C 114 177.038 177.038 178.620 -1.582 25685 4272 1 6 . 1 1 114 114 LEU CA C 114 56.358 56.358 57.346 -0.987 25685 4273 1 6 . 1 1 114 114 LEU CB C 114 42.716 42.716 41.165 1.551 25685 4274 1 6 . 1 1 114 114 LEU H H 114 7.576 7.576 7.407 0.169 25685 4275 1 6 . 1 1 115 115 TRP N N 115 112.667 112.667 116.854 -4.187 25685 4276 1 6 . 1 1 115 115 TRP C C 115 180.163 180.163 177.512 2.651 25685 4277 1 6 . 1 1 115 115 TRP CA C 115 55.930 55.930 58.660 -2.730 25685 4278 1 6 . 1 1 115 115 TRP H H 115 8.542 8.542 7.209 1.333 25685 4279 1 6 . 1 1 116 116 LEU N N 116 122.144 122.144 121.360 0.784 25685 4280 1 6 . 1 1 116 116 LEU C C 116 175.953 175.953 175.675 0.278 25685 4281 1 6 . 1 1 116 116 LEU CA C 116 59.924 59.924 57.725 2.199 25685 4282 1 6 . 1 1 116 116 LEU CB C 116 39.097 39.097 40.107 -1.010 25685 4283 1 6 . 1 1 116 116 LEU H H 116 8.996 8.996 6.997 1.999 25685 4284 1 6 . 1 1 117 117 PRO C C 117 174.220 174.220 177.694 -3.474 25685 4285 1 6 . 1 1 117 117 PRO CA C 117 66.300 66.300 64.308 1.992 25685 4286 1 6 . 1 1 118 118 ALA N N 118 110.603 110.603 119.239 -8.636 25685 4287 1 6 . 1 1 118 118 ALA C C 118 177.162 177.162 178.568 -1.406 25685 4288 1 6 . 1 1 118 118 ALA CA C 118 52.670 52.670 53.008 -0.338 25685 4289 1 6 . 1 1 118 118 ALA CB C 118 18.853 18.853 19.525 -0.672 25685 4290 1 6 . 1 1 118 118 ALA H H 118 6.633 6.633 7.557 -0.924 25685 4291 1 6 . 1 1 119 119 ILE N N 119 113.492 113.492 115.786 -2.294 25685 4292 1 6 . 1 1 119 119 ILE CA C 119 63.703 63.703 63.927 -0.224 25685 4293 1 6 . 1 1 119 119 ILE CB C 119 39.605 39.605 37.297 2.308 25685 4294 1 6 . 1 1 119 119 ILE H H 119 7.693 7.693 8.459 -0.766 25685 4295 1 6 . 1 1 121 121 PRO C C 121 178.089 178.089 178.905 -0.816 25685 4296 1 6 . 1 1 121 121 PRO CA C 121 66.004 66.004 65.953 0.051 25685 4297 1 6 . 1 1 122 122 PHE N N 122 113.797 113.797 118.653 -4.856 25685 4298 1 6 . 1 1 122 122 PHE C C 122 177.713 177.713 176.680 1.033 25685 4299 1 6 . 1 1 122 122 PHE CA C 122 61.566 61.566 60.872 0.694 25685 4300 1 6 . 1 1 122 122 PHE CB C 122 38.983 38.983 38.935 0.048 25685 4301 1 6 . 1 1 122 122 PHE H H 122 6.846 6.846 8.029 -1.183 25685 4302 1 6 . 1 1 123 123 ALA N N 123 121.512 121.512 120.920 0.592 25685 4303 1 6 . 1 1 123 123 ALA C C 123 179.318 179.318 179.692 -0.374 25685 4304 1 6 . 1 1 123 123 ALA CA C 123 54.975 54.975 55.208 -0.233 25685 4305 1 6 . 1 1 123 123 ALA CB C 123 17.881 17.881 18.018 -0.137 25685 4306 1 6 . 1 1 123 123 ALA H H 123 8.411 8.411 8.710 -0.299 25685 4307 1 6 . 1 1 124 124 GLY N N 124 104.093 104.093 107.034 -2.941 25685 4308 1 6 . 1 1 124 124 GLY C C 124 175.410 175.410 176.199 -0.789 25685 4309 1 6 . 1 1 124 124 GLY CA C 124 47.370 47.370 46.894 0.476 25685 4310 1 6 . 1 1 124 124 GLY H H 124 8.455 8.455 7.912 0.543 25685 4311 1 6 . 1 1 125 125 ILE N N 125 121.895 121.895 119.233 2.662 25685 4312 1 6 . 1 1 125 125 ILE C C 125 178.329 178.329 177.557 0.772 25685 4313 1 6 . 1 1 125 125 ILE CA C 125 64.412 64.412 64.401 0.011 25685 4314 1 6 . 1 1 125 125 ILE H H 125 7.954 7.954 8.070 -0.116 25685 4315 1 6 . 1 1 126 126 ALA N N 126 122.768 122.768 122.143 0.625 25685 4316 1 6 . 1 1 126 126 ALA C C 126 180.341 180.341 179.367 0.974 25685 4317 1 6 . 1 1 126 126 ALA CA C 126 55.266 55.266 55.382 -0.116 25685 4318 1 6 . 1 1 126 126 ALA CB C 126 18.226 18.226 18.365 -0.139 25685 4319 1 6 . 1 1 126 126 ALA H H 126 8.142 8.142 7.646 0.496 25685 4320 1 6 . 1 1 127 127 ILE N N 127 116.752 116.752 117.541 -0.789 25685 4321 1 6 . 1 1 127 127 ILE C C 127 177.993 177.993 177.392 0.601 25685 4322 1 6 . 1 1 127 127 ILE CA C 127 63.877 63.877 63.906 -0.029 25685 4323 1 6 . 1 1 127 127 ILE CB C 127 37.657 37.657 36.700 0.957 25685 4324 1 6 . 1 1 127 127 ILE H H 127 8.335 8.335 7.513 0.822 25685 4325 1 6 . 1 1 128 128 SER N N 128 116.351 116.351 116.314 0.037 25685 4326 1 6 . 1 1 128 128 SER C C 128 175.796 175.796 176.709 -0.913 25685 4327 1 6 . 1 1 128 128 SER CA C 128 61.818 61.818 61.843 -0.025 25685 4328 1 6 . 1 1 128 128 SER H H 128 7.939 7.939 7.701 0.238 25685 4329 1 6 . 1 1 129 129 GLN N N 129 118.082 118.082 119.367 -1.285 25685 4330 1 6 . 1 1 129 129 GLN C C 129 177.419 177.419 177.728 -0.309 25685 4331 1 6 . 1 1 129 129 GLN CA C 129 57.106 57.106 58.431 -1.325 25685 4332 1 6 . 1 1 129 129 GLN CB C 129 28.631 28.631 28.555 0.076 25685 4333 1 6 . 1 1 129 129 GLN H H 129 7.943 7.943 7.755 0.188 25685 4334 1 6 . 1 1 130 130 THR N N 130 113.484 113.484 112.445 1.039 25685 4335 1 6 . 1 1 130 130 THR C C 130 175.627 175.627 175.799 -0.172 25685 4336 1 6 . 1 1 130 130 THR CA C 130 63.758 63.758 64.654 -0.896 25685 4337 1 6 . 1 1 130 130 THR CB C 130 69.182 69.182 68.933 0.249 25685 4338 1 6 . 1 1 130 130 THR H H 130 7.686 7.686 7.601 0.085 25685 4339 1 6 . 1 1 131 131 LEU N N 131 121.347 121.347 122.424 -1.077 25685 4340 1 6 . 1 1 131 131 LEU C C 131 177.522 177.522 177.895 -0.373 25685 4341 1 6 . 1 1 131 131 LEU CA C 131 56.307 56.307 56.783 -0.476 25685 4342 1 6 . 1 1 131 131 LEU CB C 131 41.711 41.711 42.360 -0.649 25685 4343 1 6 . 1 1 131 131 LEU H H 131 8.071 8.071 7.600 0.471 25685 4344 1 6 . 1 1 132 132 LEU N N 132 118.162 118.162 115.592 2.570 25685 4345 1 6 . 1 1 132 132 LEU C C 132 177.461 177.461 177.089 0.372 25685 4346 1 6 . 1 1 132 132 LEU CA C 132 55.264 55.264 55.437 -0.173 25685 4347 1 6 . 1 1 132 132 LEU CB C 132 41.613 41.613 41.240 0.373 25685 4348 1 6 . 1 1 132 132 LEU H H 132 7.810 7.810 8.146 -0.336 25685 4349 1 6 . 1 1 133 133 SER N N 133 114.244 114.244 117.148 -2.904 25685 4350 1 6 . 1 1 133 133 SER C C 133 174.363 174.363 173.811 0.552 25685 4351 1 6 . 1 1 133 133 SER CA C 133 59.019 59.019 58.764 0.255 25685 4352 1 6 . 1 1 133 133 SER CB C 133 64.634 64.634 64.136 0.498 25685 4353 1 6 . 1 1 133 133 SER H H 133 7.829 7.829 7.704 0.125 25685 4354 1 6 . 1 1 134 134 GLU N N 134 120.151 120.151 121.801 -1.650 25685 4355 1 6 . 1 1 134 134 GLU C C 134 175.935 175.935 175.606 0.329 25685 4356 1 6 . 1 1 134 134 GLU CA C 134 56.301 56.301 55.999 0.302 25685 4357 1 6 . 1 1 134 134 GLU CB C 134 30.129 30.129 31.337 -1.208 25685 4358 1 6 . 1 1 134 134 GLU H H 134 8.054 8.054 8.427 -0.373 25685 4359 1 6 . 1 1 135 135 ASN N N 135 118.890 118.890 117.763 1.127 25685 4360 1 6 . 1 1 135 135 ASN C C 135 174.272 174.272 173.963 0.309 25685 4361 1 6 . 1 1 135 135 ASN CA C 135 51.390 51.390 53.128 -1.738 25685 4362 1 6 . 1 1 135 135 ASN CB C 135 39.129 39.129 36.551 2.578 25685 4363 1 6 . 1 1 135 135 ASN H H 135 8.305 8.305 8.487 -0.182 25685 4364 1 6 . 1 1 136 136 PRO C C 136 177.960 177.960 178.068 -0.108 25685 4365 1 6 . 1 1 136 136 PRO CA C 136 64.530 64.530 64.805 -0.275 25685 4366 1 6 . 1 1 136 136 PRO CB C 136 31.809 31.809 31.785 0.024 25685 4367 1 6 . 1 1 137 137 LEU N N 137 117.735 117.735 119.301 -1.566 25685 4368 1 6 . 1 1 137 137 LEU C C 137 179.217 179.217 178.233 0.984 25685 4369 1 6 . 1 1 137 137 LEU CA C 137 57.039 57.039 57.980 -0.941 25685 4370 1 6 . 1 1 137 137 LEU CB C 137 40.799 40.799 41.695 -0.896 25685 4371 1 6 . 1 1 137 137 LEU H H 137 8.248 8.248 7.897 0.350 25685 4372 1 6 . 1 1 138 138 VAL N N 138 119.589 119.589 116.506 3.083 25685 4373 1 6 . 1 1 138 138 VAL C C 138 177.894 177.894 176.904 0.990 25685 4374 1 6 . 1 1 138 138 VAL CA C 138 64.727 64.727 65.627 -0.900 25685 4375 1 6 . 1 1 138 138 VAL CB C 138 31.347 31.347 31.031 0.316 25685 4376 1 6 . 1 1 138 138 VAL H H 138 7.483 7.483 7.470 0.013 25685 4377 1 6 . 1 1 139 139 MET N N 139 119.431 119.431 120.242 -0.811 25685 4378 1 6 . 1 1 139 139 MET C C 139 177.988 177.988 178.248 -0.260 25685 4379 1 6 . 1 1 139 139 MET CA C 139 57.403 57.403 57.698 -0.295 25685 4380 1 6 . 1 1 139 139 MET CB C 139 31.709 31.709 31.828 -0.119 25685 4381 1 6 . 1 1 139 139 MET H H 139 7.837 7.837 7.272 0.565 25685 4382 1 6 . 1 1 140 140 LEU N N 140 119.686 119.686 120.933 -1.247 25685 4383 1 6 . 1 1 140 140 LEU C C 140 177.916 177.916 178.793 -0.877 25685 4384 1 6 . 1 1 140 140 LEU CA C 140 56.877 56.877 58.300 -1.423 25685 4385 1 6 . 1 1 140 140 LEU CB C 140 41.491 41.491 41.705 -0.214 25685 4386 1 6 . 1 1 140 140 LEU H H 140 7.926 7.926 8.683 -0.757 25685 4387 1 6 . 1 1 141 141 SER N N 141 114.167 114.167 114.863 -0.696 25685 4388 1 6 . 1 1 141 141 SER C C 141 176.030 176.030 177.385 -1.355 25685 4389 1 6 . 1 1 141 141 SER CA C 141 60.425 60.425 62.133 -1.708 25685 4390 1 6 . 1 1 141 141 SER CB C 141 63.956 63.956 63.260 0.696 25685 4391 1 6 . 1 1 141 141 SER H H 141 7.757 7.757 8.161 -0.404 25685 4392 1 6 . 1 1 142 142 TYR N N 142 121.679 121.679 120.599 1.080 25685 4393 1 6 . 1 1 142 142 TYR C C 142 177.659 177.659 178.603 -0.944 25685 4394 1 6 . 1 1 142 142 TYR CA C 142 59.673 59.673 58.108 1.565 25685 4395 1 6 . 1 1 142 142 TYR CB C 142 38.079 38.079 37.338 0.741 25685 4396 1 6 . 1 1 142 142 TYR H H 142 7.965 7.965 8.620 -0.655 25685 4397 1 6 . 1 1 143 143 GLY N N 143 107.396 107.396 108.627 -1.231 25685 4398 1 6 . 1 1 143 143 GLY C C 143 174.877 174.877 176.255 -1.378 25685 4399 1 6 . 1 1 143 143 GLY CA C 143 46.343 46.343 47.241 -0.898 25685 4400 1 6 . 1 1 143 143 GLY H H 143 8.177 8.177 8.873 -0.696 25685 4401 1 6 . 1 1 144 144 LEU N N 144 120.477 120.477 123.223 -2.746 25685 4402 1 6 . 1 1 144 144 LEU C C 144 178.504 178.504 179.233 -0.729 25685 4403 1 6 . 1 1 144 144 LEU CA C 144 56.270 56.270 57.293 -1.023 25685 4404 1 6 . 1 1 144 144 LEU CB C 144 41.662 41.662 41.156 0.506 25685 4405 1 6 . 1 1 144 144 LEU H H 144 8.055 8.055 7.470 0.585 25685 4406 1 6 . 1 1 145 145 GLY N N 145 106.847 106.847 106.614 0.233 25685 4407 1 6 . 1 1 145 145 GLY C C 145 175.375 175.375 176.293 -0.918 25685 4408 1 6 . 1 1 145 145 GLY CA C 145 45.582 45.582 46.898 -1.316 25685 4409 1 6 . 1 1 145 145 GLY H H 145 8.066 8.066 7.772 0.294 25685 4410 1 6 . 1 1 146 146 MET N N 146 120.376 120.376 123.215 -2.839 25685 4411 1 6 . 1 1 146 146 MET C C 146 176.663 176.663 178.570 -1.907 25685 4412 1 6 . 1 1 146 146 MET CA C 146 57.030 57.030 57.825 -0.795 25685 4413 1 6 . 1 1 146 146 MET CB C 146 30.720 30.720 32.162 -1.442 25685 4414 1 6 . 1 1 146 146 MET H H 146 8.157 8.157 8.355 -0.198 25685 4415 1 6 . 1 1 147 147 ALA N N 147 123.038 123.038 121.538 1.500 25685 4416 1 6 . 1 1 147 147 ALA C C 147 178.917 178.917 179.660 -0.743 25685 4417 1 6 . 1 1 147 147 ALA CA C 147 54.201 54.201 55.199 -0.998 25685 4418 1 6 . 1 1 147 147 ALA CB C 147 18.810 18.810 18.249 0.561 25685 4419 1 6 . 1 1 147 147 ALA H H 147 8.336 8.336 8.502 -0.166 25685 4420 1 6 . 1 1 148 148 VAL N N 148 117.795 117.795 117.190 0.605 25685 4421 1 6 . 1 1 148 148 VAL C C 148 176.891 176.891 178.125 -1.234 25685 4422 1 6 . 1 1 148 148 VAL CA C 148 64.157 64.157 66.292 -2.135 25685 4423 1 6 . 1 1 148 148 VAL CB C 148 31.529 31.529 31.524 0.005 25685 4424 1 6 . 1 1 148 148 VAL H H 148 7.908 7.908 7.621 0.287 25685 4425 1 6 . 1 1 149 149 THR N N 149 116.069 116.069 114.580 1.489 25685 4426 1 6 . 1 1 149 149 THR C C 149 176.054 176.054 176.660 -0.606 25685 4427 1 6 . 1 1 149 149 THR CA C 149 63.308 63.308 65.201 -1.893 25685 4428 1 6 . 1 1 149 149 THR H H 149 7.414 7.414 7.480 -0.066 25685 4429 1 6 . 1 1 150 150 ILE N N 150 121.971 121.971 121.934 0.037 25685 4430 1 6 . 1 1 150 150 ILE C C 150 177.715 177.715 177.344 0.371 25685 4431 1 6 . 1 1 150 150 ILE CA C 150 64.319 64.319 63.027 1.292 25685 4432 1 6 . 1 1 150 150 ILE CB C 150 36.628 36.628 36.854 -0.226 25685 4433 1 6 . 1 1 150 150 ILE H H 150 8.772 8.772 7.950 0.822 25685 4434 1 6 . 1 1 151 151 ALA N N 151 122.272 122.272 121.458 0.814 25685 4435 1 6 . 1 1 151 151 ALA C C 151 180.370 180.370 179.469 0.901 25685 4436 1 6 . 1 1 151 151 ALA CA C 151 55.336 55.336 55.204 0.132 25685 4437 1 6 . 1 1 151 151 ALA CB C 151 18.107 18.107 17.768 0.339 25685 4438 1 6 . 1 1 151 151 ALA H H 151 8.163 8.163 7.848 0.315 25685 4439 1 6 . 1 1 152 152 ALA N N 152 120.648 120.648 120.834 -0.186 25685 4440 1 6 . 1 1 152 152 ALA C C 152 181.019 181.019 180.005 1.014 25685 4441 1 6 . 1 1 152 152 ALA CA C 152 54.944 54.944 54.684 0.260 25685 4442 1 6 . 1 1 152 152 ALA CB C 152 18.963 18.963 18.517 0.446 25685 4443 1 6 . 1 1 152 152 ALA H H 152 7.877 7.877 7.554 0.323 25685 4444 1 6 . 1 1 153 153 VAL N N 153 119.372 119.372 119.760 -0.388 25685 4445 1 6 . 1 1 153 153 VAL C C 153 178.197 178.197 178.241 -0.044 25685 4446 1 6 . 1 1 153 153 VAL CA C 153 66.289 66.289 65.306 0.983 25685 4447 1 6 . 1 1 153 153 VAL CB C 153 30.770 30.770 31.278 -0.508 25685 4448 1 6 . 1 1 153 153 VAL H H 153 8.118 8.118 7.705 0.413 25685 4449 1 6 . 1 1 154 154 PHE N N 154 120.362 120.362 119.506 0.856 25685 4450 1 6 . 1 1 154 154 PHE C C 154 177.733 177.733 177.772 -0.039 25685 4451 1 6 . 1 1 154 154 PHE CA C 154 61.412 61.412 61.190 0.222 25685 4452 1 6 . 1 1 154 154 PHE CB C 154 38.465 38.465 37.993 0.472 25685 4453 1 6 . 1 1 154 154 PHE H H 154 8.508 8.508 8.936 -0.428 25685 4454 1 6 . 1 1 155 155 LYS N N 155 118.894 118.894 120.047 -1.153 25685 4455 1 6 . 1 1 155 155 LYS C C 155 179.940 179.940 178.821 1.119 25685 4456 1 6 . 1 1 155 155 LYS CA C 155 58.969 58.969 58.886 0.083 25685 4457 1 6 . 1 1 155 155 LYS CB C 155 31.725 31.725 32.000 -0.275 25685 4458 1 6 . 1 1 155 155 LYS H H 155 8.035 8.035 7.610 0.425 25685 4459 1 6 . 1 1 156 156 MET N N 156 118.853 118.853 118.839 0.014 25685 4460 1 6 . 1 1 156 156 MET C C 156 179.245 179.245 177.471 1.774 25685 4461 1 6 . 1 1 156 156 MET CA C 156 58.518 58.518 58.230 0.288 25685 4462 1 6 . 1 1 156 156 MET CB C 156 31.912 31.912 31.773 0.139 25685 4463 1 6 . 1 1 156 156 MET H H 156 8.014 8.014 7.705 0.309 25685 4464 1 6 . 1 1 157 157 GLY N N 157 108.239 108.239 104.808 3.431 25685 4465 1 6 . 1 1 157 157 GLY C C 157 174.637 174.637 175.396 -0.759 25685 4466 1 6 . 1 1 157 157 GLY CA C 157 47.204 47.204 46.189 1.015 25685 4467 1 6 . 1 1 157 157 GLY H H 157 8.614 8.614 7.574 1.040 25685 4468 1 6 . 1 1 158 158 GLU N N 158 122.902 122.902 120.488 2.414 25685 4469 1 6 . 1 1 158 158 GLU C C 158 177.851 177.851 175.020 2.831 25685 4470 1 6 . 1 1 158 158 GLU CA C 158 60.203 60.203 55.048 5.155 25685 4471 1 6 . 1 1 158 158 GLU CB C 158 28.870 28.870 29.819 -0.949 25685 4472 1 6 . 1 1 158 158 GLU H H 158 8.550 8.550 7.770 0.780 25685 4473 1 6 . 1 1 159 159 LYS N N 159 117.932 117.932 120.111 -2.179 25685 4474 1 6 . 1 1 159 159 LYS C C 159 179.529 179.529 175.252 4.277 25685 4475 1 6 . 1 1 159 159 LYS CA C 159 59.419 59.419 57.422 1.997 25685 4476 1 6 . 1 1 159 159 LYS CB C 159 31.759 31.759 31.969 -0.210 25685 4477 1 6 . 1 1 159 159 LYS H H 159 7.641 7.641 8.216 -0.575 25685 4478 1 6 . 1 1 160 160 PHE N N 160 120.614 120.614 122.017 -1.403 25685 4479 1 6 . 1 1 160 160 PHE C C 160 178.511 178.511 176.011 2.500 25685 4480 1 6 . 1 1 160 160 PHE CA C 160 61.580 61.580 59.171 2.409 25685 4481 1 6 . 1 1 160 160 PHE CB C 160 39.909 39.909 39.701 0.208 25685 4482 1 6 . 1 1 160 160 PHE H H 160 8.026 8.026 7.975 0.051 25685 4483 1 6 . 1 1 161 161 VAL N N 161 119.870 119.870 117.554 2.316 25685 4484 1 6 . 1 1 161 161 VAL C C 161 177.347 177.347 175.871 1.476 25685 4485 1 6 . 1 1 161 161 VAL CA C 161 66.121 66.121 60.387 5.734 25685 4486 1 6 . 1 1 161 161 VAL CB C 161 30.935 30.935 34.950 -4.015 25685 4487 1 6 . 1 1 161 161 VAL H H 161 8.628 8.628 8.163 0.465 25685 4488 1 6 . 1 1 162 162 LYS N N 162 116.237 116.237 120.960 -4.723 25685 4489 1 6 . 1 1 162 162 LYS C C 162 179.197 179.197 176.084 3.113 25685 4490 1 6 . 1 1 162 162 LYS CA C 162 60.037 60.037 59.099 0.938 25685 4491 1 6 . 1 1 162 162 LYS CB C 162 31.333 31.333 32.419 -1.086 25685 4492 1 6 . 1 1 162 162 LYS H H 162 7.843 7.843 8.666 -0.823 25685 4493 1 6 . 1 1 163 163 ALA N N 163 119.197 119.197 116.122 3.075 25685 4494 1 6 . 1 1 163 163 ALA C C 163 178.635 178.635 174.982 3.653 25685 4495 1 6 . 1 1 163 163 ALA CA C 163 53.681 53.681 51.533 2.148 25685 4496 1 6 . 1 1 163 163 ALA CB C 163 19.586 19.586 19.536 0.050 25685 4497 1 6 . 1 1 163 163 ALA H H 163 7.630 7.630 7.557 0.073 25685 4498 1 6 . 1 1 164 164 ASN N N 164 115.956 115.956 116.445 -0.489 25685 4499 1 6 . 1 1 164 164 ASN C C 164 175.556 175.556 175.317 0.239 25685 4500 1 6 . 1 1 164 164 ASN CA C 164 52.267 52.267 52.964 -0.697 25685 4501 1 6 . 1 1 164 164 ASN CB C 164 39.148 39.148 38.423 0.725 25685 4502 1 6 . 1 1 164 164 ASN H H 164 7.326 7.326 8.260 -0.934 25685 4503 1 6 . 1 1 165 165 PHE N N 165 121.612 121.612 122.959 -1.347 25685 4504 1 6 . 1 1 165 165 PHE C C 165 177.069 177.069 176.703 0.366 25685 4505 1 6 . 1 1 165 165 PHE CA C 165 62.921 62.921 61.186 1.735 25685 4506 1 6 . 1 1 165 165 PHE CB C 165 39.427 39.427 39.065 0.362 25685 4507 1 6 . 1 1 165 165 PHE H H 165 7.408 7.408 8.606 -1.198 25685 4508 1 6 . 1 1 166 166 GLN N N 166 117.147 117.147 118.104 -0.957 25685 4509 1 6 . 1 1 166 166 GLN C C 166 178.922 178.922 178.535 0.387 25685 4510 1 6 . 1 1 166 166 GLN CA C 166 59.262 59.262 58.968 0.294 25685 4511 1 6 . 1 1 166 166 GLN CB C 166 26.811 26.811 28.011 -1.200 25685 4512 1 6 . 1 1 166 166 GLN H H 166 8.605 8.605 8.903 -0.298 25685 4513 1 6 . 1 1 167 167 LEU N N 167 121.946 121.946 117.995 3.951 25685 4514 1 6 . 1 1 167 167 LEU C C 167 178.863 178.863 178.759 0.104 25685 4515 1 6 . 1 1 167 167 LEU CA C 167 58.039 58.039 57.218 0.821 25685 4516 1 6 . 1 1 167 167 LEU CB C 167 41.130 41.130 41.665 -0.535 25685 4517 1 6 . 1 1 167 167 LEU H H 167 7.892 7.892 7.548 0.344 25685 4518 1 6 . 1 1 168 168 ILE N N 168 118.751 118.751 115.400 3.351 25685 4519 1 6 . 1 1 168 168 ILE C C 168 179.908 179.908 177.001 2.907 25685 4520 1 6 . 1 1 168 168 ILE CA C 168 63.886 63.886 64.130 -0.244 25685 4521 1 6 . 1 1 168 168 ILE CB C 168 36.170 36.170 37.353 -1.183 25685 4522 1 6 . 1 1 168 168 ILE H H 168 8.065 8.065 7.287 0.778 25685 4523 1 6 . 1 1 169 169 ARG N N 169 125.851 125.851 119.340 6.511 25685 4524 1 6 . 1 1 169 169 ARG C C 169 177.579 177.579 177.858 -0.279 25685 4525 1 6 . 1 1 169 169 ARG CA C 169 60.306 60.306 59.032 1.274 25685 4526 1 6 . 1 1 169 169 ARG CB C 169 29.224 29.224 29.674 -0.450 25685 4527 1 6 . 1 1 169 169 ARG H H 169 8.995 8.995 7.651 1.344 25685 4528 1 6 . 1 1 170 170 LYS N N 170 119.586 119.586 119.355 0.231 25685 4529 1 6 . 1 1 170 170 LYS C C 170 178.584 178.584 178.499 0.085 25685 4530 1 6 . 1 1 170 170 LYS CA C 170 60.293 60.293 59.222 1.071 25685 4531 1 6 . 1 1 170 170 LYS CB C 170 32.530 32.530 31.919 0.611 25685 4532 1 6 . 1 1 170 170 LYS H H 170 7.663 7.663 7.768 -0.104 25685 4533 1 6 . 1 1 171 171 VAL N N 171 118.348 118.348 117.169 1.179 25685 4534 1 6 . 1 1 171 171 VAL C C 171 177.478 177.478 177.632 -0.154 25685 4535 1 6 . 1 1 171 171 VAL CA C 171 66.641 66.641 66.079 0.562 25685 4536 1 6 . 1 1 171 171 VAL CB C 171 31.565 31.565 30.630 0.935 25685 4537 1 6 . 1 1 171 171 VAL H H 171 8.515 8.515 7.678 0.837 25685 4538 1 6 . 1 1 172 172 THR N N 172 115.172 115.172 117.335 -2.163 25685 4539 1 6 . 1 1 172 172 THR C C 172 176.320 176.320 176.378 -0.058 25685 4540 1 6 . 1 1 172 172 THR H H 172 8.416 8.416 7.484 0.932 25685 4541 1 6 . 1 1 173 173 GLY N N 173 108.801 108.801 108.906 -0.105 25685 4542 1 6 . 1 1 173 173 GLY C C 173 174.138 174.138 175.017 -0.879 25685 4543 1 6 . 1 1 173 173 GLY CA C 173 47.769 47.769 46.812 0.957 25685 4544 1 6 . 1 1 173 173 GLY H H 173 8.505 8.505 7.655 0.850 25685 4545 1 6 . 1 1 174 174 ALA N N 174 123.573 123.573 124.331 -0.758 25685 4546 1 6 . 1 1 174 174 ALA C C 174 178.782 178.782 179.241 -0.459 25685 4547 1 6 . 1 1 174 174 ALA CA C 174 55.604 55.604 54.536 1.068 25685 4548 1 6 . 1 1 174 174 ALA CB C 174 18.778 18.778 17.972 0.806 25685 4549 1 6 . 1 1 174 174 ALA H H 174 8.038 8.038 7.448 0.590 25685 4550 1 6 . 1 1 175 175 ILE N N 175 118.501 118.501 118.401 0.100 25685 4551 1 6 . 1 1 175 175 ILE C C 175 178.247 178.247 178.187 0.060 25685 4552 1 6 . 1 1 175 175 ILE CA C 175 65.412 65.412 63.207 2.205 25685 4553 1 6 . 1 1 175 175 ILE CB C 175 37.671 37.671 36.763 0.909 25685 4554 1 6 . 1 1 175 175 ILE H H 175 7.897 7.897 7.501 0.396 25685 4555 1 6 . 1 1 176 176 VAL N N 176 120.104 120.104 119.345 0.759 25685 4556 1 6 . 1 1 176 176 VAL C C 176 177.945 177.945 178.255 -0.310 25685 4557 1 6 . 1 1 176 176 VAL CA C 176 67.761 67.761 66.616 1.145 25685 4558 1 6 . 1 1 176 176 VAL CB C 176 30.662 30.662 31.305 -0.643 25685 4559 1 6 . 1 1 176 176 VAL H H 176 8.321 8.321 7.858 0.463 25685 4560 1 6 . 1 1 177 177 LEU N N 177 118.561 118.561 119.435 -0.874 25685 4561 1 6 . 1 1 177 177 LEU C C 177 178.563 178.563 179.030 -0.467 25685 4562 1 6 . 1 1 177 177 LEU CA C 177 58.094 58.094 58.026 0.068 25685 4563 1 6 . 1 1 177 177 LEU CB C 177 41.061 41.061 41.597 -0.536 25685 4564 1 6 . 1 1 177 177 LEU H H 177 8.097 8.097 7.382 0.715 25685 4565 1 6 . 1 1 178 178 LEU N N 178 120.868 120.868 120.296 0.572 25685 4566 1 6 . 1 1 178 178 LEU C C 178 178.524 178.524 178.495 0.029 25685 4567 1 6 . 1 1 178 178 LEU CA C 178 57.767 57.767 58.702 -0.935 25685 4568 1 6 . 1 1 178 178 LEU CB C 178 40.886 40.886 42.183 -1.297 25685 4569 1 6 . 1 1 178 178 LEU H H 178 8.229 8.229 7.706 0.523 25685 4570 1 6 . 1 1 179 179 TYR N N 179 119.355 119.355 118.456 0.899 25685 4571 1 6 . 1 1 179 179 TYR C C 179 180.059 180.059 177.676 2.383 25685 4572 1 6 . 1 1 179 179 TYR CA C 179 63.844 63.844 61.820 2.024 25685 4573 1 6 . 1 1 179 179 TYR CB C 179 39.508 39.508 38.331 1.177 25685 4574 1 6 . 1 1 179 179 TYR H H 179 8.759 8.759 7.834 0.925 25685 4575 1 6 . 1 1 180 180 LEU N N 180 118.984 118.984 119.203 -0.219 25685 4576 1 6 . 1 1 180 180 LEU C C 180 179.079 179.079 179.394 -0.315 25685 4577 1 6 . 1 1 180 180 LEU CA C 180 58.879 58.879 57.757 1.122 25685 4578 1 6 . 1 1 180 180 LEU CB C 180 41.899 41.899 40.764 1.135 25685 4579 1 6 . 1 1 180 180 LEU H H 180 8.315 8.315 7.738 0.577 25685 4580 1 6 . 1 1 181 181 ALA N N 181 121.826 121.826 122.451 -0.625 25685 4581 1 6 . 1 1 181 181 ALA C C 181 180.009 180.009 179.121 0.888 25685 4582 1 6 . 1 1 181 181 ALA CA C 181 55.700 55.700 55.051 0.649 25685 4583 1 6 . 1 1 181 181 ALA CB C 181 17.713 17.713 18.498 -0.785 25685 4584 1 6 . 1 1 181 181 ALA H H 181 8.480 8.480 8.401 0.079 25685 4585 1 6 . 1 1 182 182 TYR N N 182 118.039 118.039 118.100 -0.061 25685 4586 1 6 . 1 1 182 182 TYR CA C 182 59.038 59.038 61.166 -2.128 25685 4587 1 6 . 1 1 182 182 TYR H H 182 8.856 8.856 8.005 0.851 25685 4588 1 6 . 1 1 183 183 PHE N N 183 124.769 124.769 117.549 7.220 25685 4589 1 6 . 1 1 183 183 PHE CA C 183 63.566 63.566 60.492 3.074 25685 4590 1 6 . 1 1 183 183 PHE H H 183 9.764 9.764 7.756 2.008 25685 4591 1 7 . 1 1 4 4 ALA N N 4 121.533 121.533 124.218 -2.685 25685 4592 1 7 . 1 1 4 4 ALA C C 4 177.632 177.632 178.909 -1.277 25685 4593 1 7 . 1 1 4 4 ALA CA C 4 55.117 55.117 54.910 0.207 25685 4594 1 7 . 1 1 4 4 ALA CB C 4 18.448 18.448 18.264 0.184 25685 4595 1 7 . 1 1 4 4 ALA H H 4 7.977 7.977 8.384 -0.407 25685 4596 1 7 . 1 1 5 5 PHE N N 5 119.988 119.988 119.227 0.761 25685 4597 1 7 . 1 1 5 5 PHE CA C 5 60.759 60.759 60.670 0.089 25685 4598 1 7 . 1 1 5 5 PHE CB C 5 39.221 39.221 39.095 0.126 25685 4599 1 7 . 1 1 5 5 PHE H H 5 8.210 8.210 8.446 -0.236 25685 4600 1 7 . 1 1 6 6 ALA C C 6 179.794 179.794 179.627 0.167 25685 4601 1 7 . 1 1 6 6 ALA CA C 6 55.619 55.619 55.134 0.485 25685 4602 1 7 . 1 1 6 6 ALA CB C 6 17.911 17.911 18.122 -0.211 25685 4603 1 7 . 1 1 6 6 ALA H H 6 8.417 8.417 7.902 0.515 25685 4604 1 7 . 1 1 7 7 LEU N N 7 115.852 115.852 118.278 -2.426 25685 4605 1 7 . 1 1 7 7 LEU C C 7 180.196 180.196 179.247 0.949 25685 4606 1 7 . 1 1 7 7 LEU CA C 7 57.528 57.528 57.600 -0.072 25685 4607 1 7 . 1 1 7 7 LEU CB C 7 40.060 40.060 40.913 -0.853 25685 4608 1 7 . 1 1 7 7 LEU H H 7 8.741 8.741 7.661 1.080 25685 4609 1 7 . 1 1 8 8 GLY N N 8 110.199 110.199 106.980 3.219 25685 4610 1 7 . 1 1 8 8 GLY C C 8 176.430 176.430 176.667 -0.237 25685 4611 1 7 . 1 1 8 8 GLY CA C 8 46.960 46.960 47.217 -0.257 25685 4612 1 7 . 1 1 8 8 GLY H H 8 8.179 8.179 7.717 0.462 25685 4613 1 7 . 1 1 9 9 ILE N N 9 122.346 122.346 119.486 2.860 25685 4614 1 7 . 1 1 9 9 ILE C C 9 178.143 178.143 177.548 0.595 25685 4615 1 7 . 1 1 9 9 ILE CA C 9 65.048 65.048 64.435 0.613 25685 4616 1 7 . 1 1 9 9 ILE CB C 9 36.841 36.841 37.616 -0.775 25685 4617 1 7 . 1 1 9 9 ILE H H 9 7.788 7.788 7.557 0.231 25685 4618 1 7 . 1 1 10 10 LEU N N 10 117.560 117.560 120.655 -3.095 25685 4619 1 7 . 1 1 10 10 LEU C C 10 179.501 179.501 179.335 0.166 25685 4620 1 7 . 1 1 10 10 LEU CA C 10 58.068 58.068 58.163 -0.095 25685 4621 1 7 . 1 1 10 10 LEU CB C 10 40.776 40.776 40.234 0.542 25685 4622 1 7 . 1 1 10 10 LEU H H 10 8.044 8.044 7.795 0.249 25685 4623 1 7 . 1 1 11 11 SER N N 11 113.830 113.830 113.750 0.080 25685 4624 1 7 . 1 1 11 11 SER CA C 11 61.769 61.769 61.630 0.140 25685 4625 1 7 . 1 1 11 11 SER CB C 11 63.395 63.395 63.116 0.279 25685 4626 1 7 . 1 1 11 11 SER H H 11 8.140 8.140 7.514 0.626 25685 4627 1 7 . 1 1 12 12 VAL N N 12 121.343 121.343 121.013 0.330 25685 4628 1 7 . 1 1 12 12 VAL C C 12 176.753 176.753 177.734 -0.981 25685 4629 1 7 . 1 1 12 12 VAL CA C 12 64.583 64.583 65.418 -0.835 25685 4630 1 7 . 1 1 12 12 VAL CB C 12 31.067 31.067 31.028 0.039 25685 4631 1 7 . 1 1 12 12 VAL H H 12 7.587 7.587 7.354 0.233 25685 4632 1 7 . 1 1 13 13 PHE N N 13 115.225 115.225 119.779 -4.554 25685 4633 1 7 . 1 1 13 13 PHE C C 13 177.349 177.349 175.879 1.470 25685 4634 1 7 . 1 1 13 13 PHE CA C 13 58.730 58.730 60.794 -2.064 25685 4635 1 7 . 1 1 13 13 PHE CB C 13 39.785 39.785 39.405 0.380 25685 4636 1 7 . 1 1 13 13 PHE H H 13 7.474 7.474 7.987 -0.513 25685 4637 1 7 . 1 1 14 14 SER N N 14 116.075 116.075 116.554 -0.479 25685 4638 1 7 . 1 1 14 14 SER H H 14 7.955 7.955 8.000 -0.045 25685 4639 1 7 . 1 1 15 15 PRO C C 15 177.590 177.590 176.259 1.331 25685 4640 1 7 . 1 1 15 15 PRO CA C 15 65.464 65.464 62.367 3.097 25685 4641 1 7 . 1 1 16 16 ALA N N 16 116.288 116.288 120.800 -4.512 25685 4642 1 7 . 1 1 16 16 ALA C C 16 177.563 177.563 176.786 0.777 25685 4643 1 7 . 1 1 16 16 ALA CA C 16 53.010 53.010 51.178 1.831 25685 4644 1 7 . 1 1 16 16 ALA CB C 16 19.975 19.975 20.256 -0.281 25685 4645 1 7 . 1 1 16 16 ALA H H 16 7.455 7.455 7.766 -0.311 25685 4646 1 7 . 1 1 17 17 VAL N N 17 112.072 112.072 119.104 -7.032 25685 4647 1 7 . 1 1 17 17 VAL CA C 17 63.117 63.117 62.718 0.399 25685 4648 1 7 . 1 1 17 17 VAL CB C 17 33.209 33.209 32.765 0.444 25685 4649 1 7 . 1 1 17 17 VAL H H 17 7.525 7.525 8.408 -0.883 25685 4650 1 7 . 1 1 18 18 LEU N N 18 121.205 121.205 123.626 -2.421 25685 4651 1 7 . 1 1 18 18 LEU CA C 18 58.971 58.971 57.868 1.103 25685 4652 1 7 . 1 1 18 18 LEU CB C 18 41.161 41.161 39.487 1.673 25685 4653 1 7 . 1 1 18 18 LEU H H 18 8.191 8.191 8.395 -0.204 25685 4654 1 7 . 1 1 19 19 PRO C C 19 177.697 177.697 178.071 -0.374 25685 4655 1 7 . 1 1 19 19 PRO CA C 19 65.181 65.181 64.324 0.857 25685 4656 1 7 . 1 1 20 20 VAL N N 20 111.723 111.723 116.195 -4.472 25685 4657 1 7 . 1 1 20 20 VAL C C 20 177.137 177.137 176.821 0.316 25685 4658 1 7 . 1 1 20 20 VAL CA C 20 62.494 62.494 64.772 -2.278 25685 4659 1 7 . 1 1 20 20 VAL CB C 20 31.677 31.677 31.762 -0.085 25685 4660 1 7 . 1 1 20 20 VAL H H 20 7.571 7.571 7.636 -0.065 25685 4661 1 7 . 1 1 21 21 VAL N N 21 121.705 121.705 116.095 5.610 25685 4662 1 7 . 1 1 21 21 VAL CA C 21 68.305 68.305 64.578 3.727 25685 4663 1 7 . 1 1 21 21 VAL H H 21 7.732 7.732 8.430 -0.698 25685 4664 1 7 . 1 1 24 24 ILE C C 24 174.359 174.359 176.379 -2.020 25685 4665 1 7 . 1 1 25 25 PHE N N 25 120.132 120.132 119.255 0.877 25685 4666 1 7 . 1 1 25 25 PHE C C 25 175.945 175.945 176.572 -0.627 25685 4667 1 7 . 1 1 25 25 PHE CA C 25 60.544 60.544 59.553 0.991 25685 4668 1 7 . 1 1 25 25 PHE H H 25 8.082 8.082 8.130 -0.048 25685 4669 1 7 . 1 1 26 26 ALA N N 26 121.341 121.341 121.362 -0.021 25685 4670 1 7 . 1 1 26 26 ALA CB C 26 19.784 19.784 19.077 0.707 25685 4671 1 7 . 1 1 26 26 ALA H H 26 7.539 7.539 8.349 -0.810 25685 4672 1 7 . 1 1 27 27 GLY N N 27 107.530 107.530 106.207 1.323 25685 4673 1 7 . 1 1 27 27 GLY C C 27 174.252 174.252 172.835 1.417 25685 4674 1 7 . 1 1 27 27 GLY CA C 27 45.474 45.474 44.747 0.727 25685 4675 1 7 . 1 1 27 27 GLY H H 27 7.997 7.997 8.132 -0.135 25685 4676 1 7 . 1 1 28 28 SER N N 28 116.299 116.299 117.103 -0.804 25685 4677 1 7 . 1 1 28 28 SER C C 28 175.759 175.759 173.116 2.643 25685 4678 1 7 . 1 1 28 28 SER CA C 28 58.526 58.526 57.856 0.670 25685 4679 1 7 . 1 1 28 28 SER CB C 28 64.373 64.373 63.053 1.321 25685 4680 1 7 . 1 1 28 28 SER H H 28 8.115 8.115 8.491 -0.376 25685 4681 1 7 . 1 1 34 34 ASP C C 34 177.621 177.621 178.255 -0.634 25685 4682 1 7 . 1 1 34 34 ASP CA C 34 57.082 57.082 57.504 -0.422 25685 4683 1 7 . 1 1 35 35 ALA N N 35 120.662 120.662 121.161 -0.499 25685 4684 1 7 . 1 1 35 35 ALA C C 35 179.168 179.168 179.240 -0.072 25685 4685 1 7 . 1 1 35 35 ALA CA C 35 55.459 55.459 54.571 0.888 25685 4686 1 7 . 1 1 35 35 ALA CB C 35 18.819 18.819 18.033 0.786 25685 4687 1 7 . 1 1 35 35 ALA H H 35 8.090 8.090 7.419 0.671 25685 4688 1 7 . 1 1 36 36 PHE N N 36 117.638 117.638 118.287 -0.649 25685 4689 1 7 . 1 1 36 36 PHE C C 36 177.057 177.057 176.762 0.295 25685 4690 1 7 . 1 1 36 36 PHE CA C 36 61.472 61.472 59.855 1.617 25685 4691 1 7 . 1 1 36 36 PHE CB C 36 38.860 38.860 38.409 0.451 25685 4692 1 7 . 1 1 36 36 PHE H H 36 8.227 8.227 7.530 0.697 25685 4693 1 7 . 1 1 37 37 LEU N N 37 119.312 119.312 119.683 -0.371 25685 4694 1 7 . 1 1 37 37 LEU C C 37 179.798 179.798 178.529 1.269 25685 4695 1 7 . 1 1 37 37 LEU CA C 37 58.181 58.181 57.246 0.935 25685 4696 1 7 . 1 1 37 37 LEU CB C 37 40.835 40.835 41.853 -1.018 25685 4697 1 7 . 1 1 37 37 LEU H H 37 8.588 8.588 7.609 0.979 25685 4698 1 7 . 1 1 38 38 ILE N N 38 119.057 119.057 117.909 1.148 25685 4699 1 7 . 1 1 38 38 ILE C C 38 177.597 177.597 177.621 -0.024 25685 4700 1 7 . 1 1 38 38 ILE CA C 38 64.827 64.827 64.736 0.092 25685 4701 1 7 . 1 1 38 38 ILE CB C 38 36.321 36.321 37.431 -1.109 25685 4702 1 7 . 1 1 38 38 ILE H H 38 7.932 7.932 7.429 0.503 25685 4703 1 7 . 1 1 39 39 VAL N N 39 118.758 118.758 117.764 0.994 25685 4704 1 7 . 1 1 39 39 VAL C C 39 179.533 179.533 177.323 2.210 25685 4705 1 7 . 1 1 39 39 VAL CA C 39 66.687 66.687 66.057 0.630 25685 4706 1 7 . 1 1 39 39 VAL CB C 39 30.598 30.598 31.272 -0.674 25685 4707 1 7 . 1 1 39 39 VAL H H 39 7.922 7.922 7.411 0.511 25685 4708 1 7 . 1 1 40 40 ALA N N 40 125.385 125.385 122.482 2.903 25685 4709 1 7 . 1 1 40 40 ALA C C 40 179.200 179.200 179.598 -0.398 25685 4710 1 7 . 1 1 40 40 ALA CA C 40 55.283 55.283 54.776 0.506 25685 4711 1 7 . 1 1 40 40 ALA CB C 40 17.197 17.197 18.197 -1.000 25685 4712 1 7 . 1 1 40 40 ALA H H 40 9.091 9.091 7.227 1.864 25685 4713 1 7 . 1 1 41 41 GLY N N 41 106.978 106.978 107.072 -0.094 25685 4714 1 7 . 1 1 41 41 GLY C C 41 176.171 176.171 176.000 0.171 25685 4715 1 7 . 1 1 41 41 GLY CA C 41 47.322 47.322 47.032 0.290 25685 4716 1 7 . 1 1 41 41 GLY H H 41 8.565 8.565 7.714 0.851 25685 4717 1 7 . 1 1 42 42 LEU N N 42 126.914 126.914 120.044 6.870 25685 4718 1 7 . 1 1 42 42 LEU C C 42 178.119 178.119 178.804 -0.685 25685 4719 1 7 . 1 1 42 42 LEU CA C 42 58.523 58.523 57.867 0.656 25685 4720 1 7 . 1 1 42 42 LEU CB C 42 42.125 42.125 41.364 0.761 25685 4721 1 7 . 1 1 42 42 LEU H H 42 8.573 8.573 7.773 0.800 25685 4722 1 7 . 1 1 46 46 MET N N 46 121.710 121.710 122.531 -0.821 25685 4723 1 7 . 1 1 46 46 MET C C 46 179.540 179.540 178.114 1.426 25685 4724 1 7 . 1 1 46 46 MET CA C 46 55.968 55.968 57.936 -1.968 25685 4725 1 7 . 1 1 46 46 MET H H 46 8.589 8.589 7.513 1.076 25685 4726 1 7 . 1 1 47 47 LEU N N 47 117.448 117.448 119.923 -2.475 25685 4727 1 7 . 1 1 47 47 LEU HA H 47 3.992 3.992 4.279 -0.287 25685 4728 1 7 . 1 1 47 47 LEU C C 47 179.082 179.082 179.721 -0.639 25685 4729 1 7 . 1 1 47 47 LEU CA C 47 58.157 58.157 57.901 0.256 25685 4730 1 7 . 1 1 47 47 LEU CB C 47 41.858 41.858 41.887 -0.029 25685 4731 1 7 . 1 1 47 47 LEU H H 47 8.769 8.769 8.313 0.456 25685 4732 1 7 . 1 1 48 48 ILE N N 48 117.500 117.500 117.819 -0.319 25685 4733 1 7 . 1 1 48 48 ILE C C 48 180.298 180.298 177.878 2.420 25685 4734 1 7 . 1 1 48 48 ILE CA C 48 65.627 65.627 64.904 0.723 25685 4735 1 7 . 1 1 48 48 ILE CB C 48 37.839 37.839 37.763 0.076 25685 4736 1 7 . 1 1 48 48 ILE H H 48 8.093 8.093 7.471 0.622 25685 4737 1 7 . 1 1 49 49 LEU N N 49 123.708 123.708 120.929 2.779 25685 4738 1 7 . 1 1 49 49 LEU C C 49 179.721 179.721 179.342 0.379 25685 4739 1 7 . 1 1 49 49 LEU CA C 49 58.788 58.788 57.962 0.827 25685 4740 1 7 . 1 1 49 49 LEU CB C 49 40.761 40.761 40.965 -0.204 25685 4741 1 7 . 1 1 49 49 LEU H H 49 8.833 8.833 7.638 1.195 25685 4742 1 7 . 1 1 50 50 GLY N N 50 109.284 109.284 106.072 3.212 25685 4743 1 7 . 1 1 50 50 GLY C C 50 176.937 176.937 175.287 1.650 25685 4744 1 7 . 1 1 50 50 GLY CA C 50 47.821 47.821 47.295 0.526 25685 4745 1 7 . 1 1 50 50 GLY H H 50 9.658 9.658 8.059 1.599 25685 4746 1 7 . 1 1 51 51 TYR N N 51 125.640 125.640 120.924 4.716 25685 4747 1 7 . 1 1 51 51 TYR C C 51 177.102 177.102 175.986 1.116 25685 4748 1 7 . 1 1 51 51 TYR CA C 51 61.948 61.948 60.327 1.621 25685 4749 1 7 . 1 1 51 51 TYR CB C 51 38.871 38.871 40.257 -1.386 25685 4750 1 7 . 1 1 51 51 TYR H H 51 8.795 8.795 7.717 1.078 25685 4751 1 7 . 1 1 52 52 THR N N 52 116.273 116.273 113.532 2.741 25685 4752 1 7 . 1 1 52 52 THR C C 52 176.969 176.969 173.289 3.680 25685 4753 1 7 . 1 1 52 52 THR CA C 52 67.972 67.972 62.674 5.298 25685 4754 1 7 . 1 1 52 52 THR H H 52 8.456 8.456 7.812 0.644 25685 4755 1 7 . 1 1 53 53 ALA N N 53 122.122 122.122 128.625 -6.503 25685 4756 1 7 . 1 1 53 53 ALA C C 53 179.907 179.907 176.733 3.174 25685 4757 1 7 . 1 1 53 53 ALA CA C 53 55.722 55.722 52.290 3.432 25685 4758 1 7 . 1 1 53 53 ALA CB C 53 18.786 18.786 19.055 -0.269 25685 4759 1 7 . 1 1 53 53 ALA H H 53 9.058 9.058 7.963 1.095 25685 4760 1 7 . 1 1 54 54 SER N N 54 115.434 115.434 112.744 2.690 25685 4761 1 7 . 1 1 54 54 SER C C 54 176.433 176.433 174.285 2.148 25685 4762 1 7 . 1 1 54 54 SER CA C 54 55.828 55.828 58.603 -2.775 25685 4763 1 7 . 1 1 54 54 SER H H 54 8.040 8.040 8.246 -0.206 25685 4764 1 7 . 1 1 55 55 LEU N N 55 123.045 123.045 122.695 0.350 25685 4765 1 7 . 1 1 55 55 LEU C C 55 178.789 178.789 176.184 2.605 25685 4766 1 7 . 1 1 55 55 LEU CA C 55 57.633 57.633 54.836 2.797 25685 4767 1 7 . 1 1 55 55 LEU CB C 55 41.293 41.293 42.748 -1.455 25685 4768 1 7 . 1 1 55 55 LEU H H 55 8.255 8.255 7.920 0.335 25685 4769 1 7 . 1 1 56 56 PHE N N 56 114.426 114.426 119.591 -5.165 25685 4770 1 7 . 1 1 56 56 PHE C C 56 177.507 177.507 175.203 2.304 25685 4771 1 7 . 1 1 56 56 PHE CA C 56 61.068 61.068 56.541 4.527 25685 4772 1 7 . 1 1 56 56 PHE CB C 56 40.107 40.107 39.215 0.892 25685 4773 1 7 . 1 1 56 56 PHE H H 56 7.590 7.590 8.169 -0.579 25685 4774 1 7 . 1 1 57 57 PHE N N 57 114.701 114.701 118.143 -3.442 25685 4775 1 7 . 1 1 57 57 PHE C C 57 176.203 176.203 176.577 -0.374 25685 4776 1 7 . 1 1 57 57 PHE CA C 57 58.503 58.503 57.389 1.115 25685 4777 1 7 . 1 1 57 57 PHE CB C 57 41.114 41.114 36.811 4.303 25685 4778 1 7 . 1 1 57 57 PHE H H 57 8.514 8.514 7.886 0.628 25685 4779 1 7 . 1 1 58 58 GLY N N 58 111.041 111.041 109.333 1.708 25685 4780 1 7 . 1 1 58 58 GLY C C 58 174.240 174.240 176.205 -1.965 25685 4781 1 7 . 1 1 58 58 GLY CA C 58 44.827 44.827 46.758 -1.931 25685 4782 1 7 . 1 1 58 58 GLY H H 58 7.998 7.998 8.823 -0.825 25685 4783 1 7 . 1 1 59 59 PHE N N 59 127.950 127.950 121.553 6.397 25685 4784 1 7 . 1 1 59 59 PHE C C 59 176.612 176.612 177.160 -0.548 25685 4785 1 7 . 1 1 59 59 PHE CA C 59 61.598 61.598 59.581 2.018 25685 4786 1 7 . 1 1 59 59 PHE CB C 59 40.870 40.870 38.726 2.144 25685 4787 1 7 . 1 1 59 59 PHE H H 59 9.105 9.105 8.101 1.004 25685 4788 1 7 . 1 1 60 60 PHE N N 60 114.868 114.868 119.810 -4.942 25685 4789 1 7 . 1 1 60 60 PHE C C 60 177.989 177.989 177.177 0.812 25685 4790 1 7 . 1 1 60 60 PHE CA C 60 61.517 61.517 61.624 -0.108 25685 4791 1 7 . 1 1 60 60 PHE CB C 60 38.248 38.248 39.347 -1.099 25685 4792 1 7 . 1 1 60 60 PHE H H 60 8.796 8.796 8.246 0.550 25685 4793 1 7 . 1 1 61 61 ARG N N 61 118.812 118.812 118.312 0.500 25685 4794 1 7 . 1 1 61 61 ARG C C 61 177.813 177.813 178.674 -0.861 25685 4795 1 7 . 1 1 61 61 ARG CA C 61 60.497 60.497 58.346 2.151 25685 4796 1 7 . 1 1 61 61 ARG CB C 61 28.915 28.915 29.328 -0.412 25685 4797 1 7 . 1 1 61 61 ARG H H 61 7.600 7.600 7.989 -0.389 25685 4798 1 7 . 1 1 62 62 VAL N N 62 119.157 119.157 120.196 -1.039 25685 4799 1 7 . 1 1 62 62 VAL C C 62 177.670 177.670 178.434 -0.764 25685 4800 1 7 . 1 1 62 62 VAL CA C 62 66.749 66.749 64.901 1.848 25685 4801 1 7 . 1 1 62 62 VAL CB C 62 30.306 30.306 31.905 -1.599 25685 4802 1 7 . 1 1 62 62 VAL H H 62 7.679 7.679 7.548 0.131 25685 4803 1 7 . 1 1 63 63 VAL N N 63 117.999 117.999 119.586 -1.587 25685 4804 1 7 . 1 1 63 63 VAL C C 63 177.639 177.639 177.839 -0.200 25685 4805 1 7 . 1 1 63 63 VAL CA C 63 66.836 66.836 65.769 1.067 25685 4806 1 7 . 1 1 63 63 VAL CB C 63 30.496 30.496 31.168 -0.672 25685 4807 1 7 . 1 1 63 63 VAL H H 63 7.429 7.429 7.684 -0.255 25685 4808 1 7 . 1 1 64 64 ALA N N 64 120.451 120.451 122.113 -1.662 25685 4809 1 7 . 1 1 64 64 ALA C C 64 179.134 179.134 178.936 0.198 25685 4810 1 7 . 1 1 64 64 ALA CA C 64 55.618 55.618 54.910 0.708 25685 4811 1 7 . 1 1 64 64 ALA CB C 64 17.950 17.950 17.810 0.140 25685 4812 1 7 . 1 1 64 64 ALA H H 64 8.169 8.169 7.580 0.589 25685 4813 1 7 . 1 1 65 65 MET N N 65 116.532 116.532 116.972 -0.440 25685 4814 1 7 . 1 1 65 65 MET C C 65 177.961 177.961 178.378 -0.417 25685 4815 1 7 . 1 1 65 65 MET CA C 65 58.161 58.161 58.971 -0.810 25685 4816 1 7 . 1 1 65 65 MET CB C 65 31.208 31.208 32.459 -1.251 25685 4817 1 7 . 1 1 65 65 MET H H 65 7.857 7.857 7.525 0.332 25685 4818 1 7 . 1 1 66 66 LEU C C 66 179.022 179.022 178.590 0.432 25685 4819 1 7 . 1 1 66 66 LEU CA C 66 58.412 58.412 57.288 1.124 25685 4820 1 7 . 1 1 67 67 PHE N N 67 116.877 116.877 119.692 -2.815 25685 4821 1 7 . 1 1 67 67 PHE C C 67 177.908 177.908 177.563 0.345 25685 4822 1 7 . 1 1 67 67 PHE CA C 67 62.402 62.402 61.145 1.256 25685 4823 1 7 . 1 1 67 67 PHE CB C 67 39.203 39.203 39.135 0.068 25685 4824 1 7 . 1 1 67 67 PHE H H 67 7.923 7.923 7.554 0.369 25685 4825 1 7 . 1 1 68 68 LEU N N 68 118.860 118.860 117.916 0.944 25685 4826 1 7 . 1 1 68 68 LEU C C 68 179.032 179.032 178.346 0.686 25685 4827 1 7 . 1 1 68 68 LEU CA C 68 58.397 58.397 58.017 0.380 25685 4828 1 7 . 1 1 68 68 LEU CB C 68 40.803 40.803 40.863 -0.060 25685 4829 1 7 . 1 1 68 68 LEU H H 68 8.167 8.167 7.581 0.586 25685 4830 1 7 . 1 1 71 71 PHE N N 71 120.700 120.700 117.325 3.375 25685 4831 1 7 . 1 1 71 71 PHE C C 71 177.670 177.670 177.806 -0.136 25685 4832 1 7 . 1 1 71 71 PHE CA C 71 60.528 60.528 60.838 -0.310 25685 4833 1 7 . 1 1 71 71 PHE H H 71 7.847 7.847 7.242 0.605 25685 4834 1 7 . 1 1 72 72 ALA N N 72 120.506 120.506 122.780 -2.274 25685 4835 1 7 . 1 1 72 72 ALA C C 72 178.944 178.944 179.091 -0.147 25685 4836 1 7 . 1 1 72 72 ALA CA C 72 55.461 55.461 54.638 0.823 25685 4837 1 7 . 1 1 72 72 ALA CB C 72 17.829 17.829 18.125 -0.296 25685 4838 1 7 . 1 1 72 72 ALA H H 72 8.533 8.533 7.648 0.885 25685 4839 1 7 . 1 1 73 73 LEU N N 73 115.071 115.071 119.857 -4.786 25685 4840 1 7 . 1 1 73 73 LEU C C 73 180.831 180.831 178.176 2.655 25685 4841 1 7 . 1 1 73 73 LEU CA C 73 58.091 58.091 57.686 0.405 25685 4842 1 7 . 1 1 73 73 LEU CB C 73 41.082 41.082 41.836 -0.754 25685 4843 1 7 . 1 1 73 73 LEU H H 73 8.458 8.458 8.286 0.172 25685 4844 1 7 . 1 1 74 74 ILE N N 74 121.365 121.365 117.951 3.414 25685 4845 1 7 . 1 1 74 74 ILE C C 74 178.287 178.287 177.358 0.929 25685 4846 1 7 . 1 1 74 74 ILE CA C 74 65.335 65.335 63.508 1.827 25685 4847 1 7 . 1 1 74 74 ILE CB C 74 37.453 37.453 36.673 0.779 25685 4848 1 7 . 1 1 74 74 ILE H H 74 8.220 8.220 7.394 0.826 25685 4849 1 7 . 1 1 75 75 LEU N N 75 119.200 119.200 121.634 -2.434 25685 4850 1 7 . 1 1 75 75 LEU C C 75 177.548 177.548 178.108 -0.560 25685 4851 1 7 . 1 1 75 75 LEU CA C 75 56.938 56.938 57.138 -0.200 25685 4852 1 7 . 1 1 75 75 LEU CB C 75 41.541 41.541 40.670 0.871 25685 4853 1 7 . 1 1 75 75 LEU H H 75 7.866 7.866 7.410 0.456 25685 4854 1 7 . 1 1 76 76 LEU N N 76 116.338 116.338 116.558 -0.220 25685 4855 1 7 . 1 1 76 76 LEU C C 76 176.889 176.889 178.196 -1.307 25685 4856 1 7 . 1 1 76 76 LEU CA C 76 54.807 54.807 56.952 -2.145 25685 4857 1 7 . 1 1 76 76 LEU CB C 76 41.830 41.830 42.532 -0.702 25685 4858 1 7 . 1 1 76 76 LEU H H 76 7.432 7.432 7.395 0.037 25685 4859 1 7 . 1 1 77 77 SER N N 77 114.630 114.630 111.969 2.661 25685 4860 1 7 . 1 1 77 77 SER C C 77 174.752 174.752 175.206 -0.454 25685 4861 1 7 . 1 1 77 77 SER CA C 77 58.967 58.967 59.812 -0.845 25685 4862 1 7 . 1 1 77 77 SER CB C 77 64.686 64.686 63.501 1.185 25685 4863 1 7 . 1 1 77 77 SER H H 77 7.423 7.423 7.674 -0.251 25685 4864 1 7 . 1 1 78 78 ASP N N 78 123.054 123.054 123.050 0.004 25685 4865 1 7 . 1 1 78 78 ASP C C 78 176.716 176.716 176.215 0.501 25685 4866 1 7 . 1 1 78 78 ASP CA C 78 54.848 54.848 54.885 -0.037 25685 4867 1 7 . 1 1 78 78 ASP CB C 78 40.423 40.423 42.028 -1.605 25685 4868 1 7 . 1 1 78 78 ASP H H 78 8.294 8.294 7.753 0.541 25685 4869 1 7 . 1 1 79 79 GLU N N 79 119.104 119.104 121.308 -2.204 25685 4870 1 7 . 1 1 79 79 GLU C C 79 176.391 176.391 176.172 0.219 25685 4871 1 7 . 1 1 79 79 GLU CA C 79 56.258 56.258 56.991 -0.733 25685 4872 1 7 . 1 1 79 79 GLU CB C 79 29.656 29.656 29.981 -0.325 25685 4873 1 7 . 1 1 79 79 GLU H H 79 8.384 8.384 8.398 -0.014 25685 4874 1 7 . 1 1 80 80 LEU N N 80 121.254 121.254 117.146 4.108 25685 4875 1 7 . 1 1 80 80 LEU C C 80 177.164 177.164 176.224 0.940 25685 4876 1 7 . 1 1 80 80 LEU CA C 80 54.670 54.670 55.541 -0.871 25685 4877 1 7 . 1 1 80 80 LEU CB C 80 42.633 42.633 42.321 0.312 25685 4878 1 7 . 1 1 80 80 LEU H H 80 7.637 7.637 8.210 -0.573 25685 4879 1 7 . 1 1 81 81 ASP N N 81 123.410 123.410 121.825 1.585 25685 4880 1 7 . 1 1 81 81 ASP C C 81 177.552 177.552 175.920 1.632 25685 4881 1 7 . 1 1 81 81 ASP CA C 81 55.110 55.110 53.089 2.021 25685 4882 1 7 . 1 1 81 81 ASP CB C 81 42.693 42.693 42.882 -0.189 25685 4883 1 7 . 1 1 81 81 ASP H H 81 8.403 8.403 8.062 0.341 25685 4884 1 7 . 1 1 82 82 GLU N N 82 125.047 125.047 120.510 4.537 25685 4885 1 7 . 1 1 82 82 GLU C C 82 178.198 178.198 178.313 -0.115 25685 4886 1 7 . 1 1 82 82 GLU CA C 82 59.221 59.221 58.606 0.615 25685 4887 1 7 . 1 1 82 82 GLU CB C 82 29.176 29.176 29.990 -0.814 25685 4888 1 7 . 1 1 82 82 GLU H H 82 8.744 8.744 8.767 -0.023 25685 4889 1 7 . 1 1 83 83 LYS N N 83 118.476 118.476 120.276 -1.800 25685 4890 1 7 . 1 1 83 83 LYS C C 83 179.356 179.356 178.838 0.518 25685 4891 1 7 . 1 1 83 83 LYS CA C 83 59.170 59.170 59.179 -0.009 25685 4892 1 7 . 1 1 83 83 LYS CB C 83 31.509 31.509 31.577 -0.068 25685 4893 1 7 . 1 1 83 83 LYS H H 83 8.607 8.607 8.633 -0.026 25685 4894 1 7 . 1 1 84 84 VAL N N 84 118.407 118.407 116.294 2.113 25685 4895 1 7 . 1 1 84 84 VAL C C 84 177.653 177.653 178.073 -0.420 25685 4896 1 7 . 1 1 84 84 VAL CA C 84 65.416 65.416 66.081 -0.665 25685 4897 1 7 . 1 1 84 84 VAL CB C 84 31.313 31.313 31.255 0.059 25685 4898 1 7 . 1 1 84 84 VAL H H 84 7.870 7.870 7.755 0.116 25685 4899 1 7 . 1 1 85 85 SER N N 85 116.146 116.146 115.879 0.267 25685 4900 1 7 . 1 1 85 85 SER C C 85 177.496 177.496 176.731 0.765 25685 4901 1 7 . 1 1 85 85 SER CA C 85 61.764 61.764 61.378 0.386 25685 4902 1 7 . 1 1 85 85 SER CB C 85 63.654 63.654 62.812 0.841 25685 4903 1 7 . 1 1 85 85 SER H H 85 8.083 8.083 8.471 -0.388 25685 4904 1 7 . 1 1 86 86 ILE N N 86 122.570 122.570 122.784 -0.214 25685 4905 1 7 . 1 1 86 86 ILE C C 86 178.698 178.698 177.820 0.878 25685 4906 1 7 . 1 1 86 86 ILE CA C 86 64.526 64.526 63.667 0.859 25685 4907 1 7 . 1 1 86 86 ILE CB C 86 37.393 37.393 37.683 -0.290 25685 4908 1 7 . 1 1 86 86 ILE H H 86 8.102 8.102 7.335 0.767 25685 4909 1 7 . 1 1 87 87 PHE N N 87 121.340 121.340 121.535 -0.195 25685 4910 1 7 . 1 1 87 87 PHE C C 87 177.671 177.671 176.805 0.866 25685 4911 1 7 . 1 1 87 87 PHE CA C 87 61.098 61.098 61.500 -0.402 25685 4912 1 7 . 1 1 87 87 PHE CB C 87 39.151 39.151 39.126 0.025 25685 4913 1 7 . 1 1 87 87 PHE H H 87 7.719 7.719 8.500 -0.781 25685 4914 1 7 . 1 1 88 88 ALA N N 88 120.921 120.921 120.093 0.828 25685 4915 1 7 . 1 1 88 88 ALA C C 88 180.030 180.030 180.008 0.022 25685 4916 1 7 . 1 1 88 88 ALA CA C 88 55.147 55.147 54.552 0.595 25685 4917 1 7 . 1 1 88 88 ALA CB C 88 19.053 19.053 18.268 0.784 25685 4918 1 7 . 1 1 88 88 ALA H H 88 8.679 8.679 7.724 0.955 25685 4919 1 7 . 1 1 89 89 SER N N 89 114.285 114.285 115.118 -0.833 25685 4920 1 7 . 1 1 89 89 SER C C 89 177.040 177.040 176.243 0.797 25685 4921 1 7 . 1 1 89 89 SER CA C 89 61.314 61.314 61.856 -0.542 25685 4922 1 7 . 1 1 89 89 SER CB C 89 63.371 63.371 62.711 0.660 25685 4923 1 7 . 1 1 89 89 SER H H 89 8.242 8.242 7.725 0.517 25685 4924 1 7 . 1 1 90 90 ARG N N 90 121.829 121.829 120.306 1.523 25685 4925 1 7 . 1 1 90 90 ARG C C 90 179.247 179.247 178.396 0.851 25685 4926 1 7 . 1 1 90 90 ARG CA C 90 58.444 58.444 58.999 -0.555 25685 4927 1 7 . 1 1 90 90 ARG CB C 90 29.532 29.532 28.877 0.655 25685 4928 1 7 . 1 1 90 90 ARG H H 90 7.907 7.907 7.349 0.558 25685 4929 1 7 . 1 1 91 91 MET N N 91 117.124 117.124 116.992 0.132 25685 4930 1 7 . 1 1 91 91 MET C C 91 177.504 177.504 177.969 -0.465 25685 4931 1 7 . 1 1 91 91 MET CA C 91 57.152 57.152 60.035 -2.884 25685 4932 1 7 . 1 1 91 91 MET CB C 91 32.510 32.510 32.093 0.417 25685 4933 1 7 . 1 1 91 91 MET H H 91 7.930 7.930 8.184 -0.254 25685 4934 1 7 . 1 1 92 92 THR N N 92 108.478 108.478 112.112 -3.634 25685 4935 1 7 . 1 1 92 92 THR C C 92 176.367 176.367 176.058 0.309 25685 4936 1 7 . 1 1 92 92 THR CA C 92 63.564 63.564 65.145 -1.581 25685 4937 1 7 . 1 1 92 92 THR H H 92 7.847 7.847 7.880 -0.033 25685 4938 1 7 . 1 1 93 93 SER N N 93 117.950 117.950 116.470 1.480 25685 4939 1 7 . 1 1 93 93 SER C C 93 176.552 176.552 175.834 0.718 25685 4940 1 7 . 1 1 93 93 SER CA C 93 60.821 60.821 60.939 -0.118 25685 4941 1 7 . 1 1 93 93 SER CB C 93 63.311 63.311 63.401 -0.090 25685 4942 1 7 . 1 1 93 93 SER H H 93 7.732 7.732 7.488 0.244 25685 4943 1 7 . 1 1 94 94 GLY N N 94 111.265 111.265 108.035 3.230 25685 4944 1 7 . 1 1 94 94 GLY C C 94 175.198 175.198 175.166 0.032 25685 4945 1 7 . 1 1 94 94 GLY CA C 94 46.021 46.021 45.305 0.716 25685 4946 1 7 . 1 1 94 94 GLY H H 94 8.419 8.419 8.116 0.303 25685 4947 1 7 . 1 1 95 95 LEU N N 95 121.019 121.019 118.362 2.657 25685 4948 1 7 . 1 1 95 95 LEU C C 95 177.810 177.810 175.275 2.535 25685 4949 1 7 . 1 1 95 95 LEU CA C 95 56.012 56.012 55.760 0.252 25685 4950 1 7 . 1 1 95 95 LEU CB C 95 42.122 42.122 41.624 0.498 25685 4951 1 7 . 1 1 95 95 LEU H H 95 7.849 7.849 7.724 0.125 25685 4952 1 7 . 1 1 96 96 SER N N 96 115.465 115.465 114.370 1.095 25685 4953 1 7 . 1 1 96 96 SER C C 96 175.543 175.543 173.400 2.143 25685 4954 1 7 . 1 1 96 96 SER CA C 96 60.151 60.151 57.392 2.759 25685 4955 1 7 . 1 1 96 96 SER H H 96 8.349 8.349 7.611 0.738 25685 4956 1 7 . 1 1 97 97 TRP N N 97 121.711 121.711 123.408 -1.697 25685 4957 1 7 . 1 1 97 97 TRP C C 97 176.973 176.973 175.986 0.987 25685 4958 1 7 . 1 1 97 97 TRP CA C 97 58.250 58.250 57.269 0.981 25685 4959 1 7 . 1 1 97 97 TRP CB C 97 28.899 28.899 29.218 -0.319 25685 4960 1 7 . 1 1 97 97 TRP H H 97 7.723 7.723 7.179 0.544 25685 4961 1 7 . 1 1 98 98 LYS N N 98 119.868 119.868 124.908 -5.040 25685 4962 1 7 . 1 1 98 98 LYS C C 98 178.021 178.021 177.505 0.516 25685 4963 1 7 . 1 1 98 98 LYS CA C 98 56.340 56.340 56.602 -0.262 25685 4964 1 7 . 1 1 98 98 LYS CB C 98 31.933 31.933 33.735 -1.802 25685 4965 1 7 . 1 1 98 98 LYS H H 98 7.855 7.855 8.345 -0.490 25685 4966 1 7 . 1 1 99 99 ILE N N 99 120.044 120.044 121.397 -1.353 25685 4967 1 7 . 1 1 99 99 ILE C C 99 176.769 176.769 177.392 -0.623 25685 4968 1 7 . 1 1 99 99 ILE CA C 99 62.758 62.758 63.355 -0.597 25685 4969 1 7 . 1 1 99 99 ILE CB C 99 37.809 37.809 38.544 -0.735 25685 4970 1 7 . 1 1 99 99 ILE H H 99 8.069 8.069 8.369 -0.300 25685 4971 1 7 . 1 1 100 100 GLN C C 100 176.315 176.315 175.024 1.291 25685 4972 1 7 . 1 1 100 100 GLN CA C 100 57.486 57.486 55.722 1.764 25685 4973 1 7 . 1 1 101 101 THR N N 101 109.873 109.873 115.995 -6.122 25685 4974 1 7 . 1 1 101 101 THR C C 101 174.664 174.664 173.518 1.146 25685 4975 1 7 . 1 1 101 101 THR CA C 101 61.709 61.709 62.751 -1.042 25685 4976 1 7 . 1 1 101 101 THR CB C 101 69.290 69.290 69.188 0.102 25685 4977 1 7 . 1 1 101 101 THR H H 101 7.508 7.508 8.260 -0.752 25685 4978 1 7 . 1 1 102 102 LEU N N 102 124.434 124.434 123.553 0.881 25685 4979 1 7 . 1 1 102 102 LEU C C 102 174.681 174.681 176.034 -1.353 25685 4980 1 7 . 1 1 102 102 LEU CA C 102 53.063 53.063 52.255 0.808 25685 4981 1 7 . 1 1 102 102 LEU CB C 102 41.139 41.139 41.738 -0.599 25685 4982 1 7 . 1 1 102 102 LEU H H 102 7.569 7.569 8.305 -0.736 25685 4983 1 7 . 1 1 103 103 PRO C C 103 178.076 178.076 176.784 1.292 25685 4984 1 7 . 1 1 103 103 PRO CA C 103 62.570 62.570 64.262 -1.692 25685 4985 1 7 . 1 1 103 103 PRO CB C 103 31.534 31.534 31.573 -0.039 25685 4986 1 7 . 1 1 104 104 SER N N 104 119.929 119.929 113.703 6.226 25685 4987 1 7 . 1 1 104 104 SER C C 104 176.432 176.432 174.255 2.177 25685 4988 1 7 . 1 1 104 104 SER CA C 104 61.976 61.976 58.175 3.801 25685 4989 1 7 . 1 1 104 104 SER CB C 104 63.611 63.611 63.734 -0.123 25685 4990 1 7 . 1 1 104 104 SER H H 104 8.784 8.784 7.600 1.184 25685 4991 1 7 . 1 1 105 105 PHE N N 105 119.519 119.519 121.485 -1.966 25685 4992 1 7 . 1 1 105 105 PHE C C 105 176.852 176.852 174.485 2.367 25685 4993 1 7 . 1 1 105 105 PHE CA C 105 60.162 60.162 57.258 2.904 25685 4994 1 7 . 1 1 105 105 PHE CB C 105 38.455 38.455 37.000 1.455 25685 4995 1 7 . 1 1 105 105 PHE H H 105 8.620 8.620 8.142 0.478 25685 4996 1 7 . 1 1 106 106 PHE N N 106 118.809 118.809 122.740 -3.931 25685 4997 1 7 . 1 1 106 106 PHE C C 106 176.741 176.741 176.876 -0.135 25685 4998 1 7 . 1 1 106 106 PHE CA C 106 61.421 61.421 61.410 0.011 25685 4999 1 7 . 1 1 106 106 PHE CB C 106 38.788 38.788 38.515 0.273 25685 5000 1 7 . 1 1 106 106 PHE H H 106 7.519 7.519 7.822 -0.303 25685 5001 1 7 . 1 1 107 107 PHE N N 107 117.382 117.382 111.980 5.402 25685 5002 1 7 . 1 1 107 107 PHE C C 107 177.771 177.771 176.974 0.797 25685 5003 1 7 . 1 1 107 107 PHE CA C 107 61.099 61.099 60.320 0.779 25685 5004 1 7 . 1 1 107 107 PHE CB C 107 38.677 38.677 36.647 2.030 25685 5005 1 7 . 1 1 107 107 PHE H H 107 7.903 7.903 8.154 -0.251 25685 5006 1 7 . 1 1 108 108 GLY N N 108 105.340 105.340 107.422 -2.082 25685 5007 1 7 . 1 1 108 108 GLY C C 108 174.574 174.574 175.739 -1.165 25685 5008 1 7 . 1 1 108 108 GLY CA C 108 47.508 47.508 47.183 0.325 25685 5009 1 7 . 1 1 108 108 GLY H H 108 8.351 8.351 8.134 0.217 25685 5010 1 7 . 1 1 109 109 MET N N 109 119.831 119.831 119.782 0.049 25685 5011 1 7 . 1 1 109 109 MET C C 109 177.522 177.522 177.585 -0.063 25685 5012 1 7 . 1 1 109 109 MET CA C 109 58.658 58.658 57.515 1.143 25685 5013 1 7 . 1 1 109 109 MET CB C 109 32.106 32.106 31.743 0.363 25685 5014 1 7 . 1 1 109 109 MET H H 109 7.919 7.919 7.963 -0.044 25685 5015 1 7 . 1 1 110 110 LEU N N 110 119.908 119.908 117.466 2.442 25685 5016 1 7 . 1 1 110 110 LEU C C 110 178.170 178.170 179.113 -0.943 25685 5017 1 7 . 1 1 110 110 LEU CA C 110 57.941 57.941 57.111 0.830 25685 5018 1 7 . 1 1 110 110 LEU CB C 110 41.055 41.055 40.024 1.031 25685 5019 1 7 . 1 1 110 110 LEU H H 110 7.744 7.744 7.660 0.084 25685 5020 1 7 . 1 1 111 111 LEU N N 111 116.594 116.594 119.834 -3.240 25685 5021 1 7 . 1 1 111 111 LEU C C 111 178.960 178.960 177.767 1.193 25685 5022 1 7 . 1 1 111 111 LEU CA C 111 57.366 57.366 57.708 -0.342 25685 5023 1 7 . 1 1 111 111 LEU CB C 111 40.259 40.259 41.185 -0.926 25685 5024 1 7 . 1 1 111 111 LEU H H 111 7.732 7.732 7.672 0.060 25685 5025 1 7 . 1 1 112 112 ALA N N 112 121.020 121.020 120.276 0.744 25685 5026 1 7 . 1 1 112 112 ALA C C 112 178.700 178.700 179.089 -0.389 25685 5027 1 7 . 1 1 112 112 ALA CA C 112 55.432 55.432 54.645 0.786 25685 5028 1 7 . 1 1 112 112 ALA CB C 112 18.214 18.214 17.574 0.640 25685 5029 1 7 . 1 1 112 112 ALA H H 112 8.121 8.121 7.168 0.953 25685 5030 1 7 . 1 1 113 113 PHE N N 113 118.369 118.369 115.504 2.865 25685 5031 1 7 . 1 1 113 113 PHE C C 113 176.091 176.091 177.613 -1.522 25685 5032 1 7 . 1 1 113 113 PHE CA C 113 61.388 61.388 58.469 2.919 25685 5033 1 7 . 1 1 113 113 PHE CB C 113 39.688 39.688 37.650 2.038 25685 5034 1 7 . 1 1 113 113 PHE H H 113 8.237 8.237 6.902 1.335 25685 5035 1 7 . 1 1 114 114 LEU N N 114 114.214 114.214 118.775 -4.561 25685 5036 1 7 . 1 1 114 114 LEU C C 114 177.038 177.038 177.994 -0.956 25685 5037 1 7 . 1 1 114 114 LEU CA C 114 56.358 56.358 58.018 -1.660 25685 5038 1 7 . 1 1 114 114 LEU CB C 114 42.716 42.716 41.735 0.981 25685 5039 1 7 . 1 1 114 114 LEU H H 114 7.576 7.576 7.446 0.130 25685 5040 1 7 . 1 1 115 115 TRP N N 115 112.667 112.667 118.146 -5.479 25685 5041 1 7 . 1 1 115 115 TRP C C 115 180.163 180.163 177.616 2.547 25685 5042 1 7 . 1 1 115 115 TRP CA C 115 55.930 55.930 59.034 -3.104 25685 5043 1 7 . 1 1 115 115 TRP H H 115 8.542 8.542 7.324 1.218 25685 5044 1 7 . 1 1 116 116 LEU N N 116 122.144 122.144 120.923 1.221 25685 5045 1 7 . 1 1 116 116 LEU C C 116 175.953 175.953 176.697 -0.744 25685 5046 1 7 . 1 1 116 116 LEU CA C 116 59.924 59.924 58.346 1.578 25685 5047 1 7 . 1 1 116 116 LEU CB C 116 39.097 39.097 40.270 -1.173 25685 5048 1 7 . 1 1 116 116 LEU H H 116 8.996 8.996 7.757 1.239 25685 5049 1 7 . 1 1 117 117 PRO C C 117 174.220 174.220 177.295 -3.075 25685 5050 1 7 . 1 1 117 117 PRO CA C 117 66.300 66.300 64.250 2.050 25685 5051 1 7 . 1 1 118 118 ALA N N 118 110.603 110.603 119.912 -9.309 25685 5052 1 7 . 1 1 118 118 ALA C C 118 177.162 177.162 178.532 -1.370 25685 5053 1 7 . 1 1 118 118 ALA CA C 118 52.670 52.670 53.651 -0.981 25685 5054 1 7 . 1 1 118 118 ALA CB C 118 18.853 18.853 19.281 -0.428 25685 5055 1 7 . 1 1 118 118 ALA H H 118 6.633 6.633 7.509 -0.876 25685 5056 1 7 . 1 1 119 119 ILE N N 119 113.492 113.492 115.045 -1.553 25685 5057 1 7 . 1 1 119 119 ILE CA C 119 63.703 63.703 64.010 -0.307 25685 5058 1 7 . 1 1 119 119 ILE CB C 119 39.605 39.605 36.626 2.979 25685 5059 1 7 . 1 1 119 119 ILE H H 119 7.693 7.693 8.429 -0.736 25685 5060 1 7 . 1 1 121 121 PRO C C 121 178.089 178.089 179.101 -1.012 25685 5061 1 7 . 1 1 121 121 PRO CA C 121 66.004 66.004 65.754 0.250 25685 5062 1 7 . 1 1 122 122 PHE N N 122 113.797 113.797 119.109 -5.312 25685 5063 1 7 . 1 1 122 122 PHE C C 122 177.713 177.713 177.125 0.588 25685 5064 1 7 . 1 1 122 122 PHE CA C 122 61.566 61.566 60.877 0.689 25685 5065 1 7 . 1 1 122 122 PHE CB C 122 38.983 38.983 38.856 0.127 25685 5066 1 7 . 1 1 122 122 PHE H H 122 6.846 6.846 8.256 -1.410 25685 5067 1 7 . 1 1 123 123 ALA N N 123 121.512 121.512 121.169 0.343 25685 5068 1 7 . 1 1 123 123 ALA C C 123 179.318 179.318 179.477 -0.159 25685 5069 1 7 . 1 1 123 123 ALA CA C 123 54.975 54.975 54.992 -0.017 25685 5070 1 7 . 1 1 123 123 ALA CB C 123 17.881 17.881 18.148 -0.267 25685 5071 1 7 . 1 1 123 123 ALA H H 123 8.411 8.411 8.363 0.048 25685 5072 1 7 . 1 1 124 124 GLY N N 124 104.093 104.093 107.336 -3.243 25685 5073 1 7 . 1 1 124 124 GLY C C 124 175.410 175.410 176.289 -0.879 25685 5074 1 7 . 1 1 124 124 GLY CA C 124 47.370 47.370 46.879 0.491 25685 5075 1 7 . 1 1 124 124 GLY H H 124 8.455 8.455 8.395 0.060 25685 5076 1 7 . 1 1 125 125 ILE N N 125 121.895 121.895 122.653 -0.758 25685 5077 1 7 . 1 1 125 125 ILE C C 125 178.329 178.329 177.135 1.194 25685 5078 1 7 . 1 1 125 125 ILE CA C 125 64.412 64.412 63.248 1.164 25685 5079 1 7 . 1 1 125 125 ILE H H 125 7.954 7.954 8.130 -0.176 25685 5080 1 7 . 1 1 126 126 ALA N N 126 122.768 122.768 123.406 -0.638 25685 5081 1 7 . 1 1 126 126 ALA C C 126 180.341 180.341 179.487 0.854 25685 5082 1 7 . 1 1 126 126 ALA CA C 126 55.266 55.266 55.134 0.132 25685 5083 1 7 . 1 1 126 126 ALA CB C 126 18.226 18.226 17.959 0.267 25685 5084 1 7 . 1 1 126 126 ALA H H 126 8.142 8.142 7.460 0.682 25685 5085 1 7 . 1 1 127 127 ILE N N 127 116.752 116.752 118.353 -1.601 25685 5086 1 7 . 1 1 127 127 ILE C C 127 177.993 177.993 177.389 0.604 25685 5087 1 7 . 1 1 127 127 ILE CA C 127 63.877 63.877 64.562 -0.686 25685 5088 1 7 . 1 1 127 127 ILE CB C 127 37.657 37.657 38.104 -0.447 25685 5089 1 7 . 1 1 127 127 ILE H H 127 8.335 8.335 7.541 0.794 25685 5090 1 7 . 1 1 128 128 SER N N 128 116.351 116.351 114.922 1.429 25685 5091 1 7 . 1 1 128 128 SER C C 128 175.796 175.796 176.326 -0.530 25685 5092 1 7 . 1 1 128 128 SER CA C 128 61.818 61.818 61.914 -0.096 25685 5093 1 7 . 1 1 128 128 SER H H 128 7.939 7.939 7.589 0.350 25685 5094 1 7 . 1 1 129 129 GLN N N 129 118.082 118.082 120.972 -2.890 25685 5095 1 7 . 1 1 129 129 GLN C C 129 177.419 177.419 178.273 -0.854 25685 5096 1 7 . 1 1 129 129 GLN CA C 129 57.106 57.106 58.959 -1.853 25685 5097 1 7 . 1 1 129 129 GLN CB C 129 28.631 28.631 28.557 0.074 25685 5098 1 7 . 1 1 129 129 GLN H H 129 7.943 7.943 7.773 0.170 25685 5099 1 7 . 1 1 130 130 THR N N 130 113.484 113.484 113.597 -0.113 25685 5100 1 7 . 1 1 130 130 THR C C 130 175.627 175.627 175.863 -0.236 25685 5101 1 7 . 1 1 130 130 THR CA C 130 63.758 63.758 65.831 -2.073 25685 5102 1 7 . 1 1 130 130 THR CB C 130 69.182 69.182 68.708 0.474 25685 5103 1 7 . 1 1 130 130 THR H H 130 7.686 7.686 7.708 -0.022 25685 5104 1 7 . 1 1 131 131 LEU N N 131 121.347 121.347 116.686 4.661 25685 5105 1 7 . 1 1 131 131 LEU C C 131 177.522 177.522 177.242 0.280 25685 5106 1 7 . 1 1 131 131 LEU CA C 131 56.307 56.307 55.500 0.807 25685 5107 1 7 . 1 1 131 131 LEU CB C 131 41.711 41.711 42.386 -0.675 25685 5108 1 7 . 1 1 131 131 LEU H H 131 8.071 8.071 7.473 0.598 25685 5109 1 7 . 1 1 132 132 LEU N N 132 118.162 118.162 121.251 -3.089 25685 5110 1 7 . 1 1 132 132 LEU C C 132 177.461 177.461 177.122 0.339 25685 5111 1 7 . 1 1 132 132 LEU CA C 132 55.264 55.264 55.827 -0.563 25685 5112 1 7 . 1 1 132 132 LEU CB C 132 41.613 41.613 42.981 -1.368 25685 5113 1 7 . 1 1 132 132 LEU H H 132 7.810 7.810 7.722 0.088 25685 5114 1 7 . 1 1 133 133 SER N N 133 114.244 114.244 111.762 2.482 25685 5115 1 7 . 1 1 133 133 SER C C 133 174.363 174.363 172.215 2.148 25685 5116 1 7 . 1 1 133 133 SER CA C 133 59.019 59.019 57.612 1.407 25685 5117 1 7 . 1 1 133 133 SER CB C 133 64.634 64.634 64.588 0.046 25685 5118 1 7 . 1 1 133 133 SER H H 133 7.829 7.829 7.846 -0.017 25685 5119 1 7 . 1 1 134 134 GLU N N 134 120.151 120.151 118.650 1.501 25685 5120 1 7 . 1 1 134 134 GLU C C 134 175.935 175.935 174.330 1.605 25685 5121 1 7 . 1 1 134 134 GLU CA C 134 56.301 56.301 55.751 0.550 25685 5122 1 7 . 1 1 134 134 GLU CB C 134 30.129 30.129 32.334 -2.205 25685 5123 1 7 . 1 1 134 134 GLU H H 134 8.054 8.054 8.240 -0.186 25685 5124 1 7 . 1 1 135 135 ASN N N 135 118.890 118.890 121.385 -2.495 25685 5125 1 7 . 1 1 135 135 ASN C C 135 174.272 174.272 173.451 0.821 25685 5126 1 7 . 1 1 135 135 ASN CA C 135 51.390 51.390 51.199 0.191 25685 5127 1 7 . 1 1 135 135 ASN CB C 135 39.129 39.129 40.677 -1.548 25685 5128 1 7 . 1 1 135 135 ASN H H 135 8.305 8.305 8.438 -0.133 25685 5129 1 7 . 1 1 136 136 PRO C C 136 177.960 177.960 178.766 -0.806 25685 5130 1 7 . 1 1 136 136 PRO CA C 136 64.530 64.530 64.739 -0.209 25685 5131 1 7 . 1 1 136 136 PRO CB C 136 31.809 31.809 32.159 -0.350 25685 5132 1 7 . 1 1 137 137 LEU N N 137 117.735 117.735 119.404 -1.669 25685 5133 1 7 . 1 1 137 137 LEU C C 137 179.217 179.217 178.966 0.251 25685 5134 1 7 . 1 1 137 137 LEU CA C 137 57.039 57.039 58.050 -1.011 25685 5135 1 7 . 1 1 137 137 LEU CB C 137 40.799 40.799 41.679 -0.880 25685 5136 1 7 . 1 1 137 137 LEU H H 137 8.248 8.248 8.000 0.248 25685 5137 1 7 . 1 1 138 138 VAL N N 138 119.589 119.589 119.209 0.380 25685 5138 1 7 . 1 1 138 138 VAL C C 138 177.894 177.894 178.072 -0.178 25685 5139 1 7 . 1 1 138 138 VAL CA C 138 64.727 64.727 66.909 -2.182 25685 5140 1 7 . 1 1 138 138 VAL CB C 138 31.347 31.347 31.074 0.273 25685 5141 1 7 . 1 1 138 138 VAL H H 138 7.483 7.483 9.354 -1.871 25685 5142 1 7 . 1 1 139 139 MET N N 139 119.431 119.431 118.247 1.184 25685 5143 1 7 . 1 1 139 139 MET C C 139 177.988 177.988 178.738 -0.750 25685 5144 1 7 . 1 1 139 139 MET CA C 139 57.403 57.403 57.817 -0.414 25685 5145 1 7 . 1 1 139 139 MET CB C 139 31.709 31.709 31.658 0.051 25685 5146 1 7 . 1 1 139 139 MET H H 139 7.837 7.837 7.625 0.212 25685 5147 1 7 . 1 1 140 140 LEU N N 140 119.686 119.686 121.092 -1.406 25685 5148 1 7 . 1 1 140 140 LEU C C 140 177.916 177.916 179.222 -1.306 25685 5149 1 7 . 1 1 140 140 LEU CA C 140 56.877 56.877 58.133 -1.256 25685 5150 1 7 . 1 1 140 140 LEU CB C 140 41.491 41.491 40.961 0.530 25685 5151 1 7 . 1 1 140 140 LEU H H 140 7.926 7.926 8.915 -0.989 25685 5152 1 7 . 1 1 141 141 SER N N 141 114.167 114.167 115.321 -1.154 25685 5153 1 7 . 1 1 141 141 SER C C 141 176.030 176.030 177.344 -1.314 25685 5154 1 7 . 1 1 141 141 SER CA C 141 60.425 60.425 62.285 -1.860 25685 5155 1 7 . 1 1 141 141 SER CB C 141 63.956 63.956 63.356 0.600 25685 5156 1 7 . 1 1 141 141 SER H H 141 7.757 7.757 8.673 -0.916 25685 5157 1 7 . 1 1 142 142 TYR N N 142 121.679 121.679 121.248 0.431 25685 5158 1 7 . 1 1 142 142 TYR C C 142 177.659 177.659 178.170 -0.511 25685 5159 1 7 . 1 1 142 142 TYR CA C 142 59.673 59.673 60.629 -0.956 25685 5160 1 7 . 1 1 142 142 TYR CB C 142 38.079 38.079 37.903 0.176 25685 5161 1 7 . 1 1 142 142 TYR H H 142 7.965 7.965 9.044 -1.079 25685 5162 1 7 . 1 1 143 143 GLY N N 143 107.396 107.396 107.817 -0.421 25685 5163 1 7 . 1 1 143 143 GLY C C 143 174.877 174.877 176.045 -1.168 25685 5164 1 7 . 1 1 143 143 GLY CA C 143 46.343 46.343 47.368 -1.025 25685 5165 1 7 . 1 1 143 143 GLY H H 143 8.177 8.177 8.253 -0.076 25685 5166 1 7 . 1 1 144 144 LEU N N 144 120.477 120.477 122.298 -1.821 25685 5167 1 7 . 1 1 144 144 LEU C C 144 178.504 178.504 179.303 -0.799 25685 5168 1 7 . 1 1 144 144 LEU CA C 144 56.270 56.270 57.304 -1.034 25685 5169 1 7 . 1 1 144 144 LEU CB C 144 41.662 41.662 41.642 0.020 25685 5170 1 7 . 1 1 144 144 LEU H H 144 8.055 8.055 7.402 0.653 25685 5171 1 7 . 1 1 145 145 GLY N N 145 106.847 106.847 106.717 0.130 25685 5172 1 7 . 1 1 145 145 GLY C C 145 175.375 175.375 175.658 -0.283 25685 5173 1 7 . 1 1 145 145 GLY CA C 145 45.582 45.582 46.720 -1.138 25685 5174 1 7 . 1 1 145 145 GLY H H 145 8.066 8.066 7.555 0.511 25685 5175 1 7 . 1 1 146 146 MET N N 146 120.376 120.376 121.618 -1.242 25685 5176 1 7 . 1 1 146 146 MET C C 146 176.663 176.663 177.952 -1.289 25685 5177 1 7 . 1 1 146 146 MET CA C 146 57.030 57.030 58.643 -1.613 25685 5178 1 7 . 1 1 146 146 MET CB C 146 30.720 30.720 32.696 -1.976 25685 5179 1 7 . 1 1 146 146 MET H H 146 8.157 8.157 8.622 -0.465 25685 5180 1 7 . 1 1 147 147 ALA N N 147 123.038 123.038 121.459 1.579 25685 5181 1 7 . 1 1 147 147 ALA C C 147 178.917 178.917 179.591 -0.674 25685 5182 1 7 . 1 1 147 147 ALA CA C 147 54.201 54.201 55.489 -1.288 25685 5183 1 7 . 1 1 147 147 ALA CB C 147 18.810 18.810 18.039 0.771 25685 5184 1 7 . 1 1 147 147 ALA H H 147 8.336 8.336 8.289 0.047 25685 5185 1 7 . 1 1 148 148 VAL N N 148 117.795 117.795 114.953 2.842 25685 5186 1 7 . 1 1 148 148 VAL C C 148 176.891 176.891 178.194 -1.303 25685 5187 1 7 . 1 1 148 148 VAL CA C 148 64.157 64.157 65.986 -1.829 25685 5188 1 7 . 1 1 148 148 VAL CB C 148 31.529 31.529 30.532 0.997 25685 5189 1 7 . 1 1 148 148 VAL H H 148 7.908 7.908 7.487 0.421 25685 5190 1 7 . 1 1 149 149 THR N N 149 116.069 116.069 117.200 -1.131 25685 5191 1 7 . 1 1 149 149 THR C C 149 176.054 176.054 176.421 -0.367 25685 5192 1 7 . 1 1 149 149 THR CA C 149 63.308 63.308 67.551 -4.243 25685 5193 1 7 . 1 1 149 149 THR H H 149 7.414 7.414 7.377 0.037 25685 5194 1 7 . 1 1 150 150 ILE N N 150 121.971 121.971 121.167 0.804 25685 5195 1 7 . 1 1 150 150 ILE C C 150 177.715 177.715 176.808 0.907 25685 5196 1 7 . 1 1 150 150 ILE CA C 150 64.319 64.319 64.353 -0.035 25685 5197 1 7 . 1 1 150 150 ILE CB C 150 36.628 36.628 37.951 -1.323 25685 5198 1 7 . 1 1 150 150 ILE H H 150 8.772 8.772 8.607 0.165 25685 5199 1 7 . 1 1 151 151 ALA N N 151 122.272 122.272 121.536 0.736 25685 5200 1 7 . 1 1 151 151 ALA C C 151 180.370 180.370 179.438 0.932 25685 5201 1 7 . 1 1 151 151 ALA CA C 151 55.336 55.336 55.179 0.157 25685 5202 1 7 . 1 1 151 151 ALA CB C 151 18.107 18.107 18.017 0.090 25685 5203 1 7 . 1 1 151 151 ALA H H 151 8.163 8.163 7.578 0.585 25685 5204 1 7 . 1 1 152 152 ALA N N 152 120.648 120.648 121.070 -0.422 25685 5205 1 7 . 1 1 152 152 ALA C C 152 181.019 181.019 179.683 1.336 25685 5206 1 7 . 1 1 152 152 ALA CA C 152 54.944 54.944 54.896 0.048 25685 5207 1 7 . 1 1 152 152 ALA CB C 152 18.963 18.963 18.442 0.520 25685 5208 1 7 . 1 1 152 152 ALA H H 152 7.877 7.877 7.439 0.438 25685 5209 1 7 . 1 1 153 153 VAL N N 153 119.372 119.372 118.536 0.836 25685 5210 1 7 . 1 1 153 153 VAL C C 153 178.197 178.197 177.783 0.414 25685 5211 1 7 . 1 1 153 153 VAL CA C 153 66.289 66.289 65.253 1.036 25685 5212 1 7 . 1 1 153 153 VAL CB C 153 30.770 30.770 31.863 -1.093 25685 5213 1 7 . 1 1 153 153 VAL H H 153 8.118 8.118 7.547 0.571 25685 5214 1 7 . 1 1 154 154 PHE N N 154 120.362 120.362 120.100 0.262 25685 5215 1 7 . 1 1 154 154 PHE C C 154 177.733 177.733 177.318 0.415 25685 5216 1 7 . 1 1 154 154 PHE CA C 154 61.412 61.412 61.034 0.378 25685 5217 1 7 . 1 1 154 154 PHE CB C 154 38.465 38.465 38.728 -0.263 25685 5218 1 7 . 1 1 154 154 PHE H H 154 8.508 8.508 8.258 0.250 25685 5219 1 7 . 1 1 155 155 LYS N N 155 118.894 118.894 119.394 -0.500 25685 5220 1 7 . 1 1 155 155 LYS C C 155 179.940 179.940 178.670 1.270 25685 5221 1 7 . 1 1 155 155 LYS CA C 155 58.969 58.969 58.915 0.054 25685 5222 1 7 . 1 1 155 155 LYS CB C 155 31.725 31.725 32.065 -0.340 25685 5223 1 7 . 1 1 155 155 LYS H H 155 8.035 8.035 7.544 0.491 25685 5224 1 7 . 1 1 156 156 MET N N 156 118.853 118.853 118.065 0.788 25685 5225 1 7 . 1 1 156 156 MET C C 156 179.245 179.245 177.539 1.706 25685 5226 1 7 . 1 1 156 156 MET CA C 156 58.518 58.518 57.722 0.796 25685 5227 1 7 . 1 1 156 156 MET CB C 156 31.912 31.912 30.832 1.080 25685 5228 1 7 . 1 1 156 156 MET H H 156 8.014 8.014 7.412 0.602 25685 5229 1 7 . 1 1 157 157 GLY N N 157 108.239 108.239 106.987 1.252 25685 5230 1 7 . 1 1 157 157 GLY C C 157 174.637 174.637 174.812 -0.175 25685 5231 1 7 . 1 1 157 157 GLY CA C 157 47.204 47.204 45.950 1.254 25685 5232 1 7 . 1 1 157 157 GLY H H 157 8.614 8.614 7.602 1.012 25685 5233 1 7 . 1 1 158 158 GLU N N 158 122.902 122.902 119.868 3.034 25685 5234 1 7 . 1 1 158 158 GLU C C 158 177.851 177.851 175.111 2.740 25685 5235 1 7 . 1 1 158 158 GLU CA C 158 60.203 60.203 55.175 5.028 25685 5236 1 7 . 1 1 158 158 GLU CB C 158 28.870 28.870 30.717 -1.847 25685 5237 1 7 . 1 1 158 158 GLU H H 158 8.550 8.550 7.578 0.972 25685 5238 1 7 . 1 1 159 159 LYS N N 159 117.932 117.932 120.181 -2.249 25685 5239 1 7 . 1 1 159 159 LYS C C 159 179.529 179.529 175.494 4.035 25685 5240 1 7 . 1 1 159 159 LYS CA C 159 59.419 59.419 57.095 2.324 25685 5241 1 7 . 1 1 159 159 LYS CB C 159 31.759 31.759 30.309 1.450 25685 5242 1 7 . 1 1 159 159 LYS H H 159 7.641 7.641 8.412 -0.771 25685 5243 1 7 . 1 1 160 160 PHE N N 160 120.614 120.614 125.192 -4.578 25685 5244 1 7 . 1 1 160 160 PHE C C 160 178.511 178.511 175.695 2.816 25685 5245 1 7 . 1 1 160 160 PHE CA C 160 61.580 61.580 59.881 1.699 25685 5246 1 7 . 1 1 160 160 PHE CB C 160 39.909 39.909 39.706 0.203 25685 5247 1 7 . 1 1 160 160 PHE H H 160 8.026 8.026 8.412 -0.386 25685 5248 1 7 . 1 1 161 161 VAL N N 161 119.870 119.870 115.091 4.779 25685 5249 1 7 . 1 1 161 161 VAL C C 161 177.347 177.347 175.922 1.425 25685 5250 1 7 . 1 1 161 161 VAL CA C 161 66.121 66.121 60.635 5.486 25685 5251 1 7 . 1 1 161 161 VAL CB C 161 30.935 30.935 34.818 -3.883 25685 5252 1 7 . 1 1 161 161 VAL H H 161 8.628 8.628 7.960 0.668 25685 5253 1 7 . 1 1 162 162 LYS N N 162 116.237 116.237 121.807 -5.570 25685 5254 1 7 . 1 1 162 162 LYS C C 162 179.197 179.197 176.596 2.601 25685 5255 1 7 . 1 1 162 162 LYS CA C 162 60.037 60.037 59.535 0.502 25685 5256 1 7 . 1 1 162 162 LYS CB C 162 31.333 31.333 32.704 -1.371 25685 5257 1 7 . 1 1 162 162 LYS H H 162 7.843 7.843 8.650 -0.807 25685 5258 1 7 . 1 1 163 163 ALA N N 163 119.197 119.197 115.833 3.364 25685 5259 1 7 . 1 1 163 163 ALA C C 163 178.635 178.635 175.498 3.137 25685 5260 1 7 . 1 1 163 163 ALA CA C 163 53.681 53.681 51.974 1.707 25685 5261 1 7 . 1 1 163 163 ALA CB C 163 19.586 19.586 20.008 -0.422 25685 5262 1 7 . 1 1 163 163 ALA H H 163 7.630 7.630 7.779 -0.149 25685 5263 1 7 . 1 1 164 164 ASN N N 164 115.956 115.956 116.150 -0.194 25685 5264 1 7 . 1 1 164 164 ASN C C 164 175.556 175.556 175.345 0.211 25685 5265 1 7 . 1 1 164 164 ASN CA C 164 52.267 52.267 53.091 -0.824 25685 5266 1 7 . 1 1 164 164 ASN CB C 164 39.148 39.148 38.385 0.763 25685 5267 1 7 . 1 1 164 164 ASN H H 164 7.326 7.326 8.212 -0.886 25685 5268 1 7 . 1 1 165 165 PHE N N 165 121.612 121.612 122.979 -1.367 25685 5269 1 7 . 1 1 165 165 PHE C C 165 177.069 177.069 176.625 0.444 25685 5270 1 7 . 1 1 165 165 PHE CA C 165 62.921 62.921 60.895 2.026 25685 5271 1 7 . 1 1 165 165 PHE CB C 165 39.427 39.427 39.126 0.301 25685 5272 1 7 . 1 1 165 165 PHE H H 165 7.408 7.408 8.606 -1.198 25685 5273 1 7 . 1 1 166 166 GLN N N 166 117.147 117.147 116.739 0.408 25685 5274 1 7 . 1 1 166 166 GLN C C 166 178.922 178.922 178.086 0.836 25685 5275 1 7 . 1 1 166 166 GLN CA C 166 59.262 59.262 58.444 0.818 25685 5276 1 7 . 1 1 166 166 GLN CB C 166 26.811 26.811 28.049 -1.238 25685 5277 1 7 . 1 1 166 166 GLN H H 166 8.605 8.605 8.503 0.102 25685 5278 1 7 . 1 1 167 167 LEU N N 167 121.946 121.946 119.563 2.383 25685 5279 1 7 . 1 1 167 167 LEU C C 167 178.863 178.863 178.451 0.412 25685 5280 1 7 . 1 1 167 167 LEU CA C 167 58.039 58.039 57.499 0.540 25685 5281 1 7 . 1 1 167 167 LEU CB C 167 41.130 41.130 41.576 -0.446 25685 5282 1 7 . 1 1 167 167 LEU H H 167 7.892 7.892 7.536 0.356 25685 5283 1 7 . 1 1 168 168 ILE N N 168 118.751 118.751 118.757 -0.006 25685 5284 1 7 . 1 1 168 168 ILE C C 168 179.908 179.908 177.623 2.285 25685 5285 1 7 . 1 1 168 168 ILE CA C 168 63.886 63.886 63.806 0.081 25685 5286 1 7 . 1 1 168 168 ILE CB C 168 36.170 36.170 37.724 -1.554 25685 5287 1 7 . 1 1 168 168 ILE H H 168 8.065 8.065 7.181 0.884 25685 5288 1 7 . 1 1 169 169 ARG N N 169 125.851 125.851 117.609 8.242 25685 5289 1 7 . 1 1 169 169 ARG C C 169 177.579 177.579 178.083 -0.504 25685 5290 1 7 . 1 1 169 169 ARG CA C 169 60.306 60.306 59.051 1.255 25685 5291 1 7 . 1 1 169 169 ARG CB C 169 29.224 29.224 29.732 -0.508 25685 5292 1 7 . 1 1 169 169 ARG H H 169 8.995 8.995 7.474 1.521 25685 5293 1 7 . 1 1 170 170 LYS N N 170 119.586 119.586 117.945 1.641 25685 5294 1 7 . 1 1 170 170 LYS C C 170 178.584 178.584 178.256 0.328 25685 5295 1 7 . 1 1 170 170 LYS CA C 170 60.293 60.293 59.011 1.282 25685 5296 1 7 . 1 1 170 170 LYS CB C 170 32.530 32.530 31.169 1.361 25685 5297 1 7 . 1 1 170 170 LYS H H 170 7.663 7.663 7.314 0.349 25685 5298 1 7 . 1 1 171 171 VAL N N 171 118.348 118.348 118.661 -0.313 25685 5299 1 7 . 1 1 171 171 VAL C C 171 177.478 177.478 177.001 0.477 25685 5300 1 7 . 1 1 171 171 VAL CA C 171 66.641 66.641 66.158 0.483 25685 5301 1 7 . 1 1 171 171 VAL CB C 171 31.565 31.565 31.590 -0.025 25685 5302 1 7 . 1 1 171 171 VAL H H 171 8.515 8.515 7.488 1.027 25685 5303 1 7 . 1 1 172 172 THR N N 172 115.172 115.172 113.250 1.922 25685 5304 1 7 . 1 1 172 172 THR C C 172 176.320 176.320 176.536 -0.216 25685 5305 1 7 . 1 1 172 172 THR H H 172 8.416 8.416 7.484 0.932 25685 5306 1 7 . 1 1 173 173 GLY N N 173 108.801 108.801 108.958 -0.157 25685 5307 1 7 . 1 1 173 173 GLY C C 173 174.138 174.138 175.359 -1.221 25685 5308 1 7 . 1 1 173 173 GLY CA C 173 47.769 47.769 46.438 1.331 25685 5309 1 7 . 1 1 173 173 GLY H H 173 8.505 8.505 7.620 0.885 25685 5310 1 7 . 1 1 174 174 ALA N N 174 123.573 123.573 123.453 0.120 25685 5311 1 7 . 1 1 174 174 ALA C C 174 178.782 178.782 179.144 -0.362 25685 5312 1 7 . 1 1 174 174 ALA CA C 174 55.604 55.604 54.834 0.770 25685 5313 1 7 . 1 1 174 174 ALA CB C 174 18.778 18.778 18.557 0.221 25685 5314 1 7 . 1 1 174 174 ALA H H 174 8.038 8.038 7.285 0.753 25685 5315 1 7 . 1 1 175 175 ILE N N 175 118.501 118.501 118.054 0.447 25685 5316 1 7 . 1 1 175 175 ILE C C 175 178.247 178.247 178.022 0.225 25685 5317 1 7 . 1 1 175 175 ILE CA C 175 65.412 65.412 63.285 2.127 25685 5318 1 7 . 1 1 175 175 ILE CB C 175 37.671 37.671 36.481 1.190 25685 5319 1 7 . 1 1 175 175 ILE H H 175 7.897 7.897 7.322 0.575 25685 5320 1 7 . 1 1 176 176 VAL N N 176 120.104 120.104 117.815 2.289 25685 5321 1 7 . 1 1 176 176 VAL C C 176 177.945 177.945 178.133 -0.188 25685 5322 1 7 . 1 1 176 176 VAL CA C 176 67.761 67.761 65.853 1.908 25685 5323 1 7 . 1 1 176 176 VAL CB C 176 30.662 30.662 30.720 -0.058 25685 5324 1 7 . 1 1 176 176 VAL H H 176 8.321 8.321 7.837 0.484 25685 5325 1 7 . 1 1 177 177 LEU N N 177 118.561 118.561 121.389 -2.828 25685 5326 1 7 . 1 1 177 177 LEU C C 177 178.563 178.563 178.361 0.202 25685 5327 1 7 . 1 1 177 177 LEU CA C 177 58.094 58.094 57.471 0.623 25685 5328 1 7 . 1 1 177 177 LEU CB C 177 41.061 41.061 41.468 -0.407 25685 5329 1 7 . 1 1 177 177 LEU H H 177 8.097 8.097 7.276 0.821 25685 5330 1 7 . 1 1 178 178 LEU N N 178 120.868 120.868 119.217 1.651 25685 5331 1 7 . 1 1 178 178 LEU C C 178 178.524 178.524 177.976 0.548 25685 5332 1 7 . 1 1 178 178 LEU CA C 178 57.767 57.767 57.631 0.136 25685 5333 1 7 . 1 1 178 178 LEU CB C 178 40.886 40.886 41.192 -0.306 25685 5334 1 7 . 1 1 178 178 LEU H H 178 8.229 8.229 7.498 0.731 25685 5335 1 7 . 1 1 179 179 TYR N N 179 119.355 119.355 119.046 0.309 25685 5336 1 7 . 1 1 179 179 TYR C C 179 180.059 180.059 177.484 2.575 25685 5337 1 7 . 1 1 179 179 TYR CA C 179 63.844 63.844 60.637 3.207 25685 5338 1 7 . 1 1 179 179 TYR CB C 179 39.508 39.508 38.167 1.341 25685 5339 1 7 . 1 1 179 179 TYR H H 179 8.759 8.759 7.523 1.236 25685 5340 1 7 . 1 1 180 180 LEU N N 180 118.984 118.984 118.998 -0.014 25685 5341 1 7 . 1 1 180 180 LEU C C 180 179.079 179.079 178.957 0.122 25685 5342 1 7 . 1 1 180 180 LEU CA C 180 58.879 58.879 57.092 1.787 25685 5343 1 7 . 1 1 180 180 LEU CB C 180 41.899 41.899 40.555 1.344 25685 5344 1 7 . 1 1 180 180 LEU H H 180 8.315 8.315 7.516 0.799 25685 5345 1 7 . 1 1 181 181 ALA N N 181 121.826 121.826 122.370 -0.544 25685 5346 1 7 . 1 1 181 181 ALA C C 181 180.009 180.009 179.110 0.899 25685 5347 1 7 . 1 1 181 181 ALA CA C 181 55.700 55.700 55.070 0.630 25685 5348 1 7 . 1 1 181 181 ALA CB C 181 17.713 17.713 18.745 -1.032 25685 5349 1 7 . 1 1 181 181 ALA H H 181 8.480 8.480 8.238 0.242 25685 5350 1 7 . 1 1 182 182 TYR N N 182 118.039 118.039 117.996 0.043 25685 5351 1 7 . 1 1 182 182 TYR CA C 182 59.038 59.038 61.797 -2.759 25685 5352 1 7 . 1 1 182 182 TYR H H 182 8.856 8.856 8.010 0.846 25685 5353 1 7 . 1 1 183 183 PHE N N 183 124.769 124.769 116.232 8.537 25685 5354 1 7 . 1 1 183 183 PHE CA C 183 63.566 63.566 59.660 3.906 25685 5355 1 7 . 1 1 183 183 PHE H H 183 9.764 9.764 7.611 2.153 25685 5356 1 8 . 1 1 4 4 ALA N N 4 121.533 121.533 121.762 -0.229 25685 5357 1 8 . 1 1 4 4 ALA C C 4 177.632 177.632 178.371 -0.739 25685 5358 1 8 . 1 1 4 4 ALA CA C 4 55.117 55.117 54.900 0.217 25685 5359 1 8 . 1 1 4 4 ALA CB C 4 18.448 18.448 18.108 0.340 25685 5360 1 8 . 1 1 4 4 ALA H H 4 7.977 7.977 8.187 -0.210 25685 5361 1 8 . 1 1 5 5 PHE N N 5 119.988 119.988 118.263 1.725 25685 5362 1 8 . 1 1 5 5 PHE CA C 5 60.759 60.759 61.039 -0.280 25685 5363 1 8 . 1 1 5 5 PHE CB C 5 39.221 39.221 38.080 1.141 25685 5364 1 8 . 1 1 5 5 PHE H H 5 8.210 8.210 8.008 0.202 25685 5365 1 8 . 1 1 6 6 ALA C C 6 179.794 179.794 179.486 0.308 25685 5366 1 8 . 1 1 6 6 ALA CA C 6 55.619 55.619 54.855 0.764 25685 5367 1 8 . 1 1 6 6 ALA CB C 6 17.911 17.911 17.933 -0.022 25685 5368 1 8 . 1 1 6 6 ALA H H 6 8.417 8.417 8.128 0.289 25685 5369 1 8 . 1 1 7 7 LEU N N 7 115.852 115.852 119.461 -3.609 25685 5370 1 8 . 1 1 7 7 LEU C C 7 180.196 180.196 178.903 1.293 25685 5371 1 8 . 1 1 7 7 LEU CA C 7 57.528 57.528 57.298 0.230 25685 5372 1 8 . 1 1 7 7 LEU CB C 7 40.060 40.060 41.650 -1.590 25685 5373 1 8 . 1 1 7 7 LEU H H 7 8.741 8.741 7.679 1.062 25685 5374 1 8 . 1 1 8 8 GLY N N 8 110.199 110.199 106.750 3.449 25685 5375 1 8 . 1 1 8 8 GLY C C 8 176.430 176.430 176.223 0.207 25685 5376 1 8 . 1 1 8 8 GLY CA C 8 46.960 46.960 47.255 -0.295 25685 5377 1 8 . 1 1 8 8 GLY H H 8 8.179 8.179 7.734 0.445 25685 5378 1 8 . 1 1 9 9 ILE N N 9 122.346 122.346 122.954 -0.608 25685 5379 1 8 . 1 1 9 9 ILE C C 9 178.143 178.143 177.202 0.941 25685 5380 1 8 . 1 1 9 9 ILE CA C 9 65.048 65.048 64.189 0.859 25685 5381 1 8 . 1 1 9 9 ILE CB C 9 36.841 36.841 38.326 -1.485 25685 5382 1 8 . 1 1 9 9 ILE H H 9 7.788 7.788 7.479 0.309 25685 5383 1 8 . 1 1 10 10 LEU N N 10 117.560 117.560 117.988 -0.428 25685 5384 1 8 . 1 1 10 10 LEU C C 10 179.501 179.501 178.835 0.666 25685 5385 1 8 . 1 1 10 10 LEU CA C 10 58.068 58.068 58.722 -0.654 25685 5386 1 8 . 1 1 10 10 LEU CB C 10 40.776 40.776 40.742 0.034 25685 5387 1 8 . 1 1 10 10 LEU H H 10 8.044 8.044 7.621 0.423 25685 5388 1 8 . 1 1 11 11 SER N N 11 113.830 113.830 114.782 -0.952 25685 5389 1 8 . 1 1 11 11 SER CA C 11 61.769 61.769 61.429 0.340 25685 5390 1 8 . 1 1 11 11 SER CB C 11 63.395 63.395 63.097 0.298 25685 5391 1 8 . 1 1 11 11 SER H H 11 8.140 8.140 7.805 0.335 25685 5392 1 8 . 1 1 12 12 VAL N N 12 121.343 121.343 120.714 0.629 25685 5393 1 8 . 1 1 12 12 VAL C C 12 176.753 176.753 178.150 -1.397 25685 5394 1 8 . 1 1 12 12 VAL CA C 12 64.583 64.583 65.133 -0.550 25685 5395 1 8 . 1 1 12 12 VAL CB C 12 31.067 31.067 30.920 0.147 25685 5396 1 8 . 1 1 12 12 VAL H H 12 7.587 7.587 7.332 0.255 25685 5397 1 8 . 1 1 13 13 PHE N N 13 115.225 115.225 120.265 -5.040 25685 5398 1 8 . 1 1 13 13 PHE C C 13 177.349 177.349 176.261 1.088 25685 5399 1 8 . 1 1 13 13 PHE CA C 13 58.730 58.730 60.358 -1.628 25685 5400 1 8 . 1 1 13 13 PHE CB C 13 39.785 39.785 38.903 0.882 25685 5401 1 8 . 1 1 13 13 PHE H H 13 7.474 7.474 7.616 -0.142 25685 5402 1 8 . 1 1 14 14 SER N N 14 116.075 116.075 115.459 0.616 25685 5403 1 8 . 1 1 14 14 SER H H 14 7.955 7.955 7.813 0.142 25685 5404 1 8 . 1 1 15 15 PRO C C 15 177.590 177.590 176.618 0.972 25685 5405 1 8 . 1 1 15 15 PRO CA C 15 65.464 65.464 62.458 3.006 25685 5406 1 8 . 1 1 16 16 ALA N N 16 116.288 116.288 122.615 -6.327 25685 5407 1 8 . 1 1 16 16 ALA C C 16 177.563 177.563 176.843 0.720 25685 5408 1 8 . 1 1 16 16 ALA CA C 16 53.010 53.010 51.449 1.561 25685 5409 1 8 . 1 1 16 16 ALA CB C 16 19.975 19.975 20.174 -0.199 25685 5410 1 8 . 1 1 16 16 ALA H H 16 7.455 7.455 7.873 -0.418 25685 5411 1 8 . 1 1 17 17 VAL N N 17 112.072 112.072 119.229 -7.157 25685 5412 1 8 . 1 1 17 17 VAL CA C 17 63.117 63.117 62.888 0.229 25685 5413 1 8 . 1 1 17 17 VAL CB C 17 33.209 33.209 32.388 0.821 25685 5414 1 8 . 1 1 17 17 VAL H H 17 7.525 7.525 8.503 -0.978 25685 5415 1 8 . 1 1 18 18 LEU N N 18 121.205 121.205 121.645 -0.440 25685 5416 1 8 . 1 1 18 18 LEU CA C 18 58.971 58.971 57.026 1.945 25685 5417 1 8 . 1 1 18 18 LEU CB C 18 41.161 41.161 40.280 0.881 25685 5418 1 8 . 1 1 18 18 LEU H H 18 8.191 8.191 8.318 -0.127 25685 5419 1 8 . 1 1 19 19 PRO C C 19 177.697 177.697 177.044 0.653 25685 5420 1 8 . 1 1 19 19 PRO CA C 19 65.181 65.181 64.417 0.764 25685 5421 1 8 . 1 1 20 20 VAL N N 20 111.723 111.723 109.819 1.904 25685 5422 1 8 . 1 1 20 20 VAL C C 20 177.137 177.137 175.099 2.038 25685 5423 1 8 . 1 1 20 20 VAL CA C 20 62.494 62.494 63.852 -1.358 25685 5424 1 8 . 1 1 20 20 VAL CB C 20 31.677 31.677 30.452 1.225 25685 5425 1 8 . 1 1 20 20 VAL H H 20 7.571 7.571 8.044 -0.473 25685 5426 1 8 . 1 1 21 21 VAL N N 21 121.705 121.705 117.304 4.401 25685 5427 1 8 . 1 1 21 21 VAL CA C 21 68.305 68.305 63.714 4.591 25685 5428 1 8 . 1 1 21 21 VAL H H 21 7.732 7.732 7.981 -0.249 25685 5429 1 8 . 1 1 24 24 ILE C C 24 174.359 174.359 176.029 -1.670 25685 5430 1 8 . 1 1 25 25 PHE N N 25 120.132 120.132 121.608 -1.476 25685 5431 1 8 . 1 1 25 25 PHE C C 25 175.945 175.945 175.706 0.239 25685 5432 1 8 . 1 1 25 25 PHE CA C 25 60.544 60.544 57.224 3.320 25685 5433 1 8 . 1 1 25 25 PHE H H 25 8.082 8.082 8.565 -0.483 25685 5434 1 8 . 1 1 26 26 ALA N N 26 121.341 121.341 122.080 -0.739 25685 5435 1 8 . 1 1 26 26 ALA CB C 26 19.784 19.784 20.571 -0.787 25685 5436 1 8 . 1 1 26 26 ALA H H 26 7.539 7.539 7.458 0.081 25685 5437 1 8 . 1 1 27 27 GLY N N 27 107.530 107.530 104.422 3.108 25685 5438 1 8 . 1 1 27 27 GLY C C 27 174.252 174.252 172.331 1.921 25685 5439 1 8 . 1 1 27 27 GLY CA C 27 45.474 45.474 44.336 1.138 25685 5440 1 8 . 1 1 27 27 GLY H H 27 7.997 7.997 8.487 -0.490 25685 5441 1 8 . 1 1 28 28 SER N N 28 116.299 116.299 116.877 -0.578 25685 5442 1 8 . 1 1 28 28 SER C C 28 175.759 175.759 173.788 1.971 25685 5443 1 8 . 1 1 28 28 SER CA C 28 58.526 58.526 56.705 1.821 25685 5444 1 8 . 1 1 28 28 SER CB C 28 64.373 64.373 64.975 -0.603 25685 5445 1 8 . 1 1 28 28 SER H H 28 8.115 8.115 8.127 -0.012 25685 5446 1 8 . 1 1 34 34 ASP C C 34 177.621 177.621 178.624 -1.003 25685 5447 1 8 . 1 1 34 34 ASP CA C 34 57.082 57.082 57.498 -0.416 25685 5448 1 8 . 1 1 35 35 ALA N N 35 120.662 120.662 122.280 -1.618 25685 5449 1 8 . 1 1 35 35 ALA C C 35 179.168 179.168 179.783 -0.615 25685 5450 1 8 . 1 1 35 35 ALA CA C 35 55.459 55.459 54.656 0.803 25685 5451 1 8 . 1 1 35 35 ALA CB C 35 18.819 18.819 18.390 0.430 25685 5452 1 8 . 1 1 35 35 ALA H H 35 8.090 8.090 7.443 0.647 25685 5453 1 8 . 1 1 36 36 PHE N N 36 117.638 117.638 118.187 -0.549 25685 5454 1 8 . 1 1 36 36 PHE C C 36 177.057 177.057 177.861 -0.804 25685 5455 1 8 . 1 1 36 36 PHE CA C 36 61.472 61.472 61.217 0.255 25685 5456 1 8 . 1 1 36 36 PHE CB C 36 38.860 38.860 38.918 -0.058 25685 5457 1 8 . 1 1 36 36 PHE H H 36 8.227 8.227 8.341 -0.114 25685 5458 1 8 . 1 1 37 37 LEU N N 37 119.312 119.312 120.030 -0.718 25685 5459 1 8 . 1 1 37 37 LEU C C 37 179.798 179.798 178.480 1.318 25685 5460 1 8 . 1 1 37 37 LEU CA C 37 58.181 58.181 58.288 -0.108 25685 5461 1 8 . 1 1 37 37 LEU CB C 37 40.835 40.835 41.912 -1.077 25685 5462 1 8 . 1 1 37 37 LEU H H 37 8.588 8.588 7.939 0.649 25685 5463 1 8 . 1 1 38 38 ILE N N 38 119.057 119.057 117.054 2.003 25685 5464 1 8 . 1 1 38 38 ILE C C 38 177.597 177.597 178.055 -0.458 25685 5465 1 8 . 1 1 38 38 ILE CA C 38 64.827 64.827 63.665 1.162 25685 5466 1 8 . 1 1 38 38 ILE CB C 38 36.321 36.321 36.173 0.148 25685 5467 1 8 . 1 1 38 38 ILE H H 38 7.932 7.932 7.460 0.472 25685 5468 1 8 . 1 1 39 39 VAL N N 39 118.758 118.758 117.839 0.919 25685 5469 1 8 . 1 1 39 39 VAL C C 39 179.533 179.533 177.241 2.292 25685 5470 1 8 . 1 1 39 39 VAL CA C 39 66.687 66.687 66.511 0.176 25685 5471 1 8 . 1 1 39 39 VAL CB C 39 30.598 30.598 30.839 -0.241 25685 5472 1 8 . 1 1 39 39 VAL H H 39 7.922 7.922 7.453 0.469 25685 5473 1 8 . 1 1 40 40 ALA N N 40 125.385 125.385 122.068 3.317 25685 5474 1 8 . 1 1 40 40 ALA C C 40 179.200 179.200 179.578 -0.378 25685 5475 1 8 . 1 1 40 40 ALA CA C 40 55.283 55.283 54.693 0.590 25685 5476 1 8 . 1 1 40 40 ALA CB C 40 17.197 17.197 17.951 -0.753 25685 5477 1 8 . 1 1 40 40 ALA H H 40 9.091 9.091 7.341 1.750 25685 5478 1 8 . 1 1 41 41 GLY N N 41 106.978 106.978 107.052 -0.074 25685 5479 1 8 . 1 1 41 41 GLY C C 41 176.171 176.171 176.005 0.166 25685 5480 1 8 . 1 1 41 41 GLY CA C 41 47.322 47.322 47.155 0.167 25685 5481 1 8 . 1 1 41 41 GLY H H 41 8.565 8.565 7.762 0.803 25685 5482 1 8 . 1 1 42 42 LEU N N 42 126.914 126.914 119.715 7.199 25685 5483 1 8 . 1 1 42 42 LEU C C 42 178.119 178.119 178.603 -0.484 25685 5484 1 8 . 1 1 42 42 LEU CA C 42 58.523 58.523 58.053 0.470 25685 5485 1 8 . 1 1 42 42 LEU CB C 42 42.125 42.125 41.187 0.938 25685 5486 1 8 . 1 1 42 42 LEU H H 42 8.573 8.573 7.634 0.939 25685 5487 1 8 . 1 1 46 46 MET N N 46 121.710 121.710 121.516 0.194 25685 5488 1 8 . 1 1 46 46 MET C C 46 179.540 179.540 179.064 0.476 25685 5489 1 8 . 1 1 46 46 MET CA C 46 55.968 55.968 58.800 -2.832 25685 5490 1 8 . 1 1 46 46 MET H H 46 8.589 8.589 7.837 0.752 25685 5491 1 8 . 1 1 47 47 LEU N N 47 117.448 117.448 120.080 -2.632 25685 5492 1 8 . 1 1 47 47 LEU HA H 47 3.992 3.992 4.187 -0.195 25685 5493 1 8 . 1 1 47 47 LEU C C 47 179.082 179.082 179.275 -0.193 25685 5494 1 8 . 1 1 47 47 LEU CA C 47 58.157 58.157 57.819 0.338 25685 5495 1 8 . 1 1 47 47 LEU CB C 47 41.858 41.858 41.702 0.156 25685 5496 1 8 . 1 1 47 47 LEU H H 47 8.769 8.769 8.091 0.678 25685 5497 1 8 . 1 1 48 48 ILE N N 48 117.500 117.500 117.246 0.254 25685 5498 1 8 . 1 1 48 48 ILE C C 48 180.298 180.298 178.622 1.676 25685 5499 1 8 . 1 1 48 48 ILE CA C 48 65.627 65.627 64.502 1.125 25685 5500 1 8 . 1 1 48 48 ILE CB C 48 37.839 37.839 37.775 0.064 25685 5501 1 8 . 1 1 48 48 ILE H H 48 8.093 8.093 7.441 0.652 25685 5502 1 8 . 1 1 49 49 LEU N N 49 123.708 123.708 120.598 3.110 25685 5503 1 8 . 1 1 49 49 LEU C C 49 179.721 179.721 178.709 1.012 25685 5504 1 8 . 1 1 49 49 LEU CA C 49 58.788 58.788 57.493 1.295 25685 5505 1 8 . 1 1 49 49 LEU CB C 49 40.761 40.761 41.909 -1.148 25685 5506 1 8 . 1 1 49 49 LEU H H 49 8.833 8.833 7.842 0.991 25685 5507 1 8 . 1 1 50 50 GLY N N 50 109.284 109.284 107.034 2.250 25685 5508 1 8 . 1 1 50 50 GLY C C 50 176.937 176.937 174.657 2.280 25685 5509 1 8 . 1 1 50 50 GLY CA C 50 47.821 47.821 46.993 0.828 25685 5510 1 8 . 1 1 50 50 GLY H H 50 9.658 9.658 8.489 1.169 25685 5511 1 8 . 1 1 51 51 TYR N N 51 125.640 125.640 118.712 6.928 25685 5512 1 8 . 1 1 51 51 TYR C C 51 177.102 177.102 175.049 2.053 25685 5513 1 8 . 1 1 51 51 TYR CA C 51 61.948 61.948 56.919 5.029 25685 5514 1 8 . 1 1 51 51 TYR CB C 51 38.871 38.871 41.067 -2.196 25685 5515 1 8 . 1 1 51 51 TYR H H 51 8.795 8.795 7.573 1.222 25685 5516 1 8 . 1 1 52 52 THR N N 52 116.273 116.273 112.550 3.723 25685 5517 1 8 . 1 1 52 52 THR C C 52 176.969 176.969 173.974 2.995 25685 5518 1 8 . 1 1 52 52 THR CA C 52 67.972 67.972 62.950 5.022 25685 5519 1 8 . 1 1 52 52 THR H H 52 8.456 8.456 8.547 -0.091 25685 5520 1 8 . 1 1 53 53 ALA N N 53 122.122 122.122 122.604 -0.482 25685 5521 1 8 . 1 1 53 53 ALA C C 53 179.907 179.907 175.884 4.023 25685 5522 1 8 . 1 1 53 53 ALA CA C 53 55.722 55.722 52.211 3.511 25685 5523 1 8 . 1 1 53 53 ALA CB C 53 18.786 18.786 20.326 -1.540 25685 5524 1 8 . 1 1 53 53 ALA H H 53 9.058 9.058 8.122 0.936 25685 5525 1 8 . 1 1 54 54 SER N N 54 115.434 115.434 118.382 -2.948 25685 5526 1 8 . 1 1 54 54 SER C C 54 176.433 176.433 174.498 1.935 25685 5527 1 8 . 1 1 54 54 SER CA C 54 55.828 55.828 59.278 -3.450 25685 5528 1 8 . 1 1 54 54 SER H H 54 8.040 8.040 7.649 0.391 25685 5529 1 8 . 1 1 55 55 LEU N N 55 123.045 123.045 121.066 1.979 25685 5530 1 8 . 1 1 55 55 LEU C C 55 178.789 178.789 176.689 2.100 25685 5531 1 8 . 1 1 55 55 LEU CA C 55 57.633 57.633 55.106 2.527 25685 5532 1 8 . 1 1 55 55 LEU CB C 55 41.293 41.293 42.307 -1.014 25685 5533 1 8 . 1 1 55 55 LEU H H 55 8.255 8.255 7.529 0.726 25685 5534 1 8 . 1 1 56 56 PHE N N 56 114.426 114.426 118.727 -4.301 25685 5535 1 8 . 1 1 56 56 PHE C C 56 177.507 177.507 175.740 1.767 25685 5536 1 8 . 1 1 56 56 PHE CA C 56 61.068 61.068 56.683 4.385 25685 5537 1 8 . 1 1 56 56 PHE CB C 56 40.107 40.107 38.209 1.898 25685 5538 1 8 . 1 1 56 56 PHE H H 56 7.590 7.590 7.665 -0.075 25685 5539 1 8 . 1 1 57 57 PHE N N 57 114.701 114.701 117.826 -3.125 25685 5540 1 8 . 1 1 57 57 PHE C C 57 176.203 176.203 175.885 0.318 25685 5541 1 8 . 1 1 57 57 PHE CA C 57 58.503 58.503 58.509 -0.006 25685 5542 1 8 . 1 1 57 57 PHE CB C 57 41.114 41.114 38.186 2.928 25685 5543 1 8 . 1 1 57 57 PHE H H 57 8.514 8.514 8.325 0.189 25685 5544 1 8 . 1 1 58 58 GLY N N 58 111.041 111.041 107.775 3.266 25685 5545 1 8 . 1 1 58 58 GLY C C 58 174.240 174.240 175.711 -1.471 25685 5546 1 8 . 1 1 58 58 GLY CA C 58 44.827 44.827 46.652 -1.825 25685 5547 1 8 . 1 1 58 58 GLY H H 58 7.998 7.998 8.584 -0.586 25685 5548 1 8 . 1 1 59 59 PHE N N 59 127.950 127.950 121.125 6.825 25685 5549 1 8 . 1 1 59 59 PHE C C 59 176.612 176.612 176.186 0.426 25685 5550 1 8 . 1 1 59 59 PHE CA C 59 61.598 61.598 58.245 3.353 25685 5551 1 8 . 1 1 59 59 PHE CB C 59 40.870 40.870 38.302 2.568 25685 5552 1 8 . 1 1 59 59 PHE H H 59 9.105 9.105 7.912 1.193 25685 5553 1 8 . 1 1 60 60 PHE N N 60 114.868 114.868 120.077 -5.209 25685 5554 1 8 . 1 1 60 60 PHE C C 60 177.989 177.989 176.578 1.411 25685 5555 1 8 . 1 1 60 60 PHE CA C 60 61.517 61.517 60.386 1.131 25685 5556 1 8 . 1 1 60 60 PHE CB C 60 38.248 38.248 38.808 -0.560 25685 5557 1 8 . 1 1 60 60 PHE H H 60 8.796 8.796 6.962 1.834 25685 5558 1 8 . 1 1 61 61 ARG N N 61 118.812 118.812 117.882 0.930 25685 5559 1 8 . 1 1 61 61 ARG C C 61 177.813 177.813 178.276 -0.463 25685 5560 1 8 . 1 1 61 61 ARG CA C 61 60.497 60.497 59.153 1.344 25685 5561 1 8 . 1 1 61 61 ARG CB C 61 28.915 28.915 29.912 -0.997 25685 5562 1 8 . 1 1 61 61 ARG H H 61 7.600 7.600 7.616 -0.016 25685 5563 1 8 . 1 1 62 62 VAL N N 62 119.157 119.157 116.785 2.372 25685 5564 1 8 . 1 1 62 62 VAL C C 62 177.670 177.670 177.686 -0.016 25685 5565 1 8 . 1 1 62 62 VAL CA C 62 66.749 66.749 65.392 1.357 25685 5566 1 8 . 1 1 62 62 VAL CB C 62 30.306 30.306 31.563 -1.257 25685 5567 1 8 . 1 1 62 62 VAL H H 62 7.679 7.679 7.251 0.428 25685 5568 1 8 . 1 1 63 63 VAL N N 63 117.999 117.999 119.495 -1.496 25685 5569 1 8 . 1 1 63 63 VAL C C 63 177.639 177.639 178.247 -0.608 25685 5570 1 8 . 1 1 63 63 VAL CA C 63 66.836 66.836 64.515 2.321 25685 5571 1 8 . 1 1 63 63 VAL CB C 63 30.496 30.496 29.897 0.599 25685 5572 1 8 . 1 1 63 63 VAL H H 63 7.429 7.429 7.287 0.142 25685 5573 1 8 . 1 1 64 64 ALA N N 64 120.451 120.451 122.462 -2.011 25685 5574 1 8 . 1 1 64 64 ALA C C 64 179.134 179.134 178.827 0.307 25685 5575 1 8 . 1 1 64 64 ALA CA C 64 55.618 55.618 54.958 0.660 25685 5576 1 8 . 1 1 64 64 ALA CB C 64 17.950 17.950 17.782 0.168 25685 5577 1 8 . 1 1 64 64 ALA H H 64 8.169 8.169 7.497 0.672 25685 5578 1 8 . 1 1 65 65 MET N N 65 116.532 116.532 116.986 -0.454 25685 5579 1 8 . 1 1 65 65 MET C C 65 177.961 177.961 177.948 0.013 25685 5580 1 8 . 1 1 65 65 MET CA C 65 58.161 58.161 56.981 1.180 25685 5581 1 8 . 1 1 65 65 MET CB C 65 31.208 31.208 31.699 -0.491 25685 5582 1 8 . 1 1 65 65 MET H H 65 7.857 7.857 7.382 0.475 25685 5583 1 8 . 1 1 66 66 LEU C C 66 179.022 179.022 179.446 -0.424 25685 5584 1 8 . 1 1 66 66 LEU CA C 66 58.412 58.412 58.136 0.276 25685 5585 1 8 . 1 1 67 67 PHE N N 67 116.877 116.877 118.183 -1.306 25685 5586 1 8 . 1 1 67 67 PHE C C 67 177.908 177.908 177.646 0.262 25685 5587 1 8 . 1 1 67 67 PHE CA C 67 62.402 62.402 59.889 2.513 25685 5588 1 8 . 1 1 67 67 PHE CB C 67 39.203 39.203 37.420 1.783 25685 5589 1 8 . 1 1 67 67 PHE H H 67 7.923 7.923 7.386 0.537 25685 5590 1 8 . 1 1 68 68 LEU N N 68 118.860 118.860 120.210 -1.350 25685 5591 1 8 . 1 1 68 68 LEU C C 68 179.032 179.032 178.425 0.607 25685 5592 1 8 . 1 1 68 68 LEU CA C 68 58.397 58.397 57.575 0.822 25685 5593 1 8 . 1 1 68 68 LEU CB C 68 40.803 40.803 41.436 -0.633 25685 5594 1 8 . 1 1 68 68 LEU H H 68 8.167 8.167 6.622 1.545 25685 5595 1 8 . 1 1 71 71 PHE N N 71 120.700 120.700 118.340 2.360 25685 5596 1 8 . 1 1 71 71 PHE C C 71 177.670 177.670 177.596 0.074 25685 5597 1 8 . 1 1 71 71 PHE CA C 71 60.528 60.528 61.417 -0.889 25685 5598 1 8 . 1 1 71 71 PHE H H 71 7.847 7.847 7.406 0.441 25685 5599 1 8 . 1 1 72 72 ALA N N 72 120.506 120.506 122.343 -1.837 25685 5600 1 8 . 1 1 72 72 ALA C C 72 178.944 178.944 179.340 -0.396 25685 5601 1 8 . 1 1 72 72 ALA CA C 72 55.461 55.461 54.713 0.748 25685 5602 1 8 . 1 1 72 72 ALA CB C 72 17.829 17.829 18.109 -0.280 25685 5603 1 8 . 1 1 72 72 ALA H H 72 8.533 8.533 7.750 0.783 25685 5604 1 8 . 1 1 73 73 LEU N N 73 115.071 115.071 120.318 -5.247 25685 5605 1 8 . 1 1 73 73 LEU C C 73 180.831 180.831 178.704 2.127 25685 5606 1 8 . 1 1 73 73 LEU CA C 73 58.091 58.091 57.796 0.295 25685 5607 1 8 . 1 1 73 73 LEU CB C 73 41.082 41.082 41.978 -0.896 25685 5608 1 8 . 1 1 73 73 LEU H H 73 8.458 8.458 8.460 -0.002 25685 5609 1 8 . 1 1 74 74 ILE N N 74 121.365 121.365 119.339 2.026 25685 5610 1 8 . 1 1 74 74 ILE C C 74 178.287 178.287 177.569 0.718 25685 5611 1 8 . 1 1 74 74 ILE CA C 74 65.335 65.335 64.613 0.722 25685 5612 1 8 . 1 1 74 74 ILE CB C 74 37.453 37.453 37.938 -0.485 25685 5613 1 8 . 1 1 74 74 ILE H H 74 8.220 8.220 7.272 0.948 25685 5614 1 8 . 1 1 75 75 LEU N N 75 119.200 119.200 120.862 -1.662 25685 5615 1 8 . 1 1 75 75 LEU C C 75 177.548 177.548 178.316 -0.768 25685 5616 1 8 . 1 1 75 75 LEU CA C 75 56.938 56.938 57.928 -0.990 25685 5617 1 8 . 1 1 75 75 LEU CB C 75 41.541 41.541 41.539 0.002 25685 5618 1 8 . 1 1 75 75 LEU H H 75 7.866 7.866 7.244 0.622 25685 5619 1 8 . 1 1 76 76 LEU N N 76 116.338 116.338 117.621 -1.283 25685 5620 1 8 . 1 1 76 76 LEU C C 76 176.889 176.889 178.770 -1.881 25685 5621 1 8 . 1 1 76 76 LEU CA C 76 54.807 54.807 57.648 -2.841 25685 5622 1 8 . 1 1 76 76 LEU CB C 76 41.830 41.830 41.590 0.240 25685 5623 1 8 . 1 1 76 76 LEU H H 76 7.432 7.432 7.570 -0.138 25685 5624 1 8 . 1 1 77 77 SER N N 77 114.630 114.630 112.633 1.997 25685 5625 1 8 . 1 1 77 77 SER C C 77 174.752 174.752 175.463 -0.711 25685 5626 1 8 . 1 1 77 77 SER CA C 77 58.967 58.967 60.648 -1.681 25685 5627 1 8 . 1 1 77 77 SER CB C 77 64.686 64.686 63.444 1.242 25685 5628 1 8 . 1 1 77 77 SER H H 77 7.423 7.423 7.687 -0.264 25685 5629 1 8 . 1 1 78 78 ASP N N 78 123.054 123.054 121.955 1.099 25685 5630 1 8 . 1 1 78 78 ASP C C 78 176.716 176.716 176.138 0.578 25685 5631 1 8 . 1 1 78 78 ASP CA C 78 54.848 54.848 56.477 -1.629 25685 5632 1 8 . 1 1 78 78 ASP CB C 78 40.423 40.423 41.505 -1.082 25685 5633 1 8 . 1 1 78 78 ASP H H 78 8.294 8.294 8.118 0.176 25685 5634 1 8 . 1 1 79 79 GLU N N 79 119.104 119.104 116.989 2.115 25685 5635 1 8 . 1 1 79 79 GLU C C 79 176.391 176.391 175.124 1.267 25685 5636 1 8 . 1 1 79 79 GLU CA C 79 56.258 56.258 56.003 0.255 25685 5637 1 8 . 1 1 79 79 GLU CB C 79 29.656 29.656 31.357 -1.701 25685 5638 1 8 . 1 1 79 79 GLU H H 79 8.384 8.384 8.413 -0.029 25685 5639 1 8 . 1 1 80 80 LEU N N 80 121.254 121.254 121.823 -0.569 25685 5640 1 8 . 1 1 80 80 LEU C C 80 177.164 177.164 176.884 0.280 25685 5641 1 8 . 1 1 80 80 LEU CA C 80 54.670 54.670 55.006 -0.336 25685 5642 1 8 . 1 1 80 80 LEU CB C 80 42.633 42.633 42.255 0.378 25685 5643 1 8 . 1 1 80 80 LEU H H 80 7.637 7.637 8.184 -0.547 25685 5644 1 8 . 1 1 81 81 ASP N N 81 123.410 123.410 120.226 3.184 25685 5645 1 8 . 1 1 81 81 ASP C C 81 177.552 177.552 175.238 2.314 25685 5646 1 8 . 1 1 81 81 ASP CA C 81 55.110 55.110 53.736 1.374 25685 5647 1 8 . 1 1 81 81 ASP CB C 81 42.693 42.693 41.097 1.596 25685 5648 1 8 . 1 1 81 81 ASP H H 81 8.403 8.403 8.577 -0.174 25685 5649 1 8 . 1 1 82 82 GLU N N 82 125.047 125.047 118.120 6.927 25685 5650 1 8 . 1 1 82 82 GLU C C 82 178.198 178.198 176.536 1.662 25685 5651 1 8 . 1 1 82 82 GLU CA C 82 59.221 59.221 56.937 2.284 25685 5652 1 8 . 1 1 82 82 GLU CB C 82 29.176 29.176 29.666 -0.490 25685 5653 1 8 . 1 1 82 82 GLU H H 82 8.744 8.744 7.957 0.787 25685 5654 1 8 . 1 1 83 83 LYS N N 83 118.476 118.476 118.938 -0.462 25685 5655 1 8 . 1 1 83 83 LYS C C 83 179.356 179.356 177.021 2.335 25685 5656 1 8 . 1 1 83 83 LYS CA C 83 59.170 59.170 58.508 0.662 25685 5657 1 8 . 1 1 83 83 LYS CB C 83 31.509 31.509 31.665 -0.156 25685 5658 1 8 . 1 1 83 83 LYS H H 83 8.607 8.607 8.735 -0.128 25685 5659 1 8 . 1 1 84 84 VAL N N 84 118.407 118.407 114.668 3.739 25685 5660 1 8 . 1 1 84 84 VAL C C 84 177.653 177.653 177.328 0.325 25685 5661 1 8 . 1 1 84 84 VAL CA C 84 65.416 65.416 66.199 -0.783 25685 5662 1 8 . 1 1 84 84 VAL CB C 84 31.313 31.313 31.559 -0.246 25685 5663 1 8 . 1 1 84 84 VAL H H 84 7.870 7.870 8.056 -0.186 25685 5664 1 8 . 1 1 85 85 SER N N 85 116.146 116.146 115.378 0.768 25685 5665 1 8 . 1 1 85 85 SER C C 85 177.496 177.496 176.261 1.235 25685 5666 1 8 . 1 1 85 85 SER CA C 85 61.764 61.764 61.019 0.745 25685 5667 1 8 . 1 1 85 85 SER CB C 85 63.654 63.654 62.684 0.970 25685 5668 1 8 . 1 1 85 85 SER H H 85 8.083 8.083 8.300 -0.217 25685 5669 1 8 . 1 1 86 86 ILE N N 86 122.570 122.570 120.636 1.934 25685 5670 1 8 . 1 1 86 86 ILE C C 86 178.698 178.698 177.322 1.376 25685 5671 1 8 . 1 1 86 86 ILE CA C 86 64.526 64.526 64.129 0.397 25685 5672 1 8 . 1 1 86 86 ILE CB C 86 37.393 37.393 37.635 -0.242 25685 5673 1 8 . 1 1 86 86 ILE H H 86 8.102 8.102 7.240 0.862 25685 5674 1 8 . 1 1 87 87 PHE N N 87 121.340 121.340 120.796 0.544 25685 5675 1 8 . 1 1 87 87 PHE C C 87 177.671 177.671 176.172 1.499 25685 5676 1 8 . 1 1 87 87 PHE CA C 87 61.098 61.098 60.745 0.353 25685 5677 1 8 . 1 1 87 87 PHE CB C 87 39.151 39.151 38.284 0.867 25685 5678 1 8 . 1 1 87 87 PHE H H 87 7.719 7.719 7.526 0.193 25685 5679 1 8 . 1 1 88 88 ALA N N 88 120.921 120.921 120.601 0.320 25685 5680 1 8 . 1 1 88 88 ALA C C 88 180.030 180.030 179.473 0.557 25685 5681 1 8 . 1 1 88 88 ALA CA C 88 55.147 55.147 54.224 0.923 25685 5682 1 8 . 1 1 88 88 ALA CB C 88 19.053 19.053 17.799 1.254 25685 5683 1 8 . 1 1 88 88 ALA H H 88 8.679 8.679 7.319 1.360 25685 5684 1 8 . 1 1 89 89 SER N N 89 114.285 114.285 115.149 -0.864 25685 5685 1 8 . 1 1 89 89 SER C C 89 177.040 177.040 176.509 0.531 25685 5686 1 8 . 1 1 89 89 SER CA C 89 61.314 61.314 61.352 -0.038 25685 5687 1 8 . 1 1 89 89 SER CB C 89 63.371 63.371 62.769 0.602 25685 5688 1 8 . 1 1 89 89 SER H H 89 8.242 8.242 7.531 0.711 25685 5689 1 8 . 1 1 90 90 ARG N N 90 121.829 121.829 121.357 0.472 25685 5690 1 8 . 1 1 90 90 ARG C C 90 179.247 179.247 178.106 1.141 25685 5691 1 8 . 1 1 90 90 ARG CA C 90 58.444 58.444 58.752 -0.307 25685 5692 1 8 . 1 1 90 90 ARG CB C 90 29.532 29.532 29.482 0.050 25685 5693 1 8 . 1 1 90 90 ARG H H 90 7.907 7.907 7.515 0.392 25685 5694 1 8 . 1 1 91 91 MET N N 91 117.124 117.124 116.974 0.150 25685 5695 1 8 . 1 1 91 91 MET C C 91 177.504 177.504 178.330 -0.826 25685 5696 1 8 . 1 1 91 91 MET CA C 91 57.152 57.152 59.860 -2.708 25685 5697 1 8 . 1 1 91 91 MET CB C 91 32.510 32.510 31.976 0.534 25685 5698 1 8 . 1 1 91 91 MET H H 91 7.930 7.930 8.042 -0.112 25685 5699 1 8 . 1 1 92 92 THR N N 92 108.478 108.478 113.695 -5.217 25685 5700 1 8 . 1 1 92 92 THR C C 92 176.367 176.367 176.147 0.220 25685 5701 1 8 . 1 1 92 92 THR CA C 92 63.564 63.564 65.894 -2.330 25685 5702 1 8 . 1 1 92 92 THR H H 92 7.847 7.847 7.633 0.214 25685 5703 1 8 . 1 1 93 93 SER N N 93 117.950 117.950 116.369 1.581 25685 5704 1 8 . 1 1 93 93 SER C C 93 176.552 176.552 176.654 -0.102 25685 5705 1 8 . 1 1 93 93 SER CA C 93 60.821 60.821 61.388 -0.567 25685 5706 1 8 . 1 1 93 93 SER CB C 93 63.311 63.311 63.705 -0.394 25685 5707 1 8 . 1 1 93 93 SER H H 93 7.732 7.732 7.662 0.070 25685 5708 1 8 . 1 1 94 94 GLY N N 94 111.265 111.265 109.030 2.235 25685 5709 1 8 . 1 1 94 94 GLY C C 94 175.198 175.198 174.339 0.859 25685 5710 1 8 . 1 1 94 94 GLY CA C 94 46.021 46.021 45.441 0.580 25685 5711 1 8 . 1 1 94 94 GLY H H 94 8.419 8.419 8.092 0.327 25685 5712 1 8 . 1 1 95 95 LEU N N 95 121.019 121.019 116.840 4.179 25685 5713 1 8 . 1 1 95 95 LEU C C 95 177.810 177.810 175.542 2.268 25685 5714 1 8 . 1 1 95 95 LEU CA C 95 56.012 56.012 56.183 -0.171 25685 5715 1 8 . 1 1 95 95 LEU CB C 95 42.122 42.122 42.292 -0.170 25685 5716 1 8 . 1 1 95 95 LEU H H 95 7.849 7.849 7.664 0.185 25685 5717 1 8 . 1 1 96 96 SER N N 96 115.465 115.465 117.055 -1.590 25685 5718 1 8 . 1 1 96 96 SER C C 96 175.543 175.543 174.419 1.124 25685 5719 1 8 . 1 1 96 96 SER CA C 96 60.151 60.151 57.590 2.561 25685 5720 1 8 . 1 1 96 96 SER H H 96 8.349 8.349 8.190 0.159 25685 5721 1 8 . 1 1 97 97 TRP N N 97 121.711 121.711 124.218 -2.507 25685 5722 1 8 . 1 1 97 97 TRP C C 97 176.973 176.973 176.388 0.585 25685 5723 1 8 . 1 1 97 97 TRP CA C 97 58.250 58.250 57.320 0.930 25685 5724 1 8 . 1 1 97 97 TRP CB C 97 28.899 28.899 26.830 2.069 25685 5725 1 8 . 1 1 97 97 TRP H H 97 7.723 7.723 8.209 -0.485 25685 5726 1 8 . 1 1 98 98 LYS N N 98 119.868 119.868 123.937 -4.069 25685 5727 1 8 . 1 1 98 98 LYS C C 98 178.021 178.021 177.478 0.543 25685 5728 1 8 . 1 1 98 98 LYS CA C 98 56.340 56.340 57.642 -1.302 25685 5729 1 8 . 1 1 98 98 LYS CB C 98 31.933 31.933 33.022 -1.089 25685 5730 1 8 . 1 1 98 98 LYS H H 98 7.855 7.855 8.359 -0.504 25685 5731 1 8 . 1 1 99 99 ILE N N 99 120.044 120.044 118.559 1.485 25685 5732 1 8 . 1 1 99 99 ILE C C 99 176.769 176.769 176.025 0.744 25685 5733 1 8 . 1 1 99 99 ILE CA C 99 62.758 62.758 60.569 2.189 25685 5734 1 8 . 1 1 99 99 ILE CB C 99 37.809 37.809 37.331 0.478 25685 5735 1 8 . 1 1 99 99 ILE H H 99 8.069 8.069 8.121 -0.052 25685 5736 1 8 . 1 1 100 100 GLN C C 100 176.315 176.315 174.836 1.479 25685 5737 1 8 . 1 1 100 100 GLN CA C 100 57.486 57.486 57.158 0.327 25685 5738 1 8 . 1 1 101 101 THR N N 101 109.873 109.873 119.802 -9.929 25685 5739 1 8 . 1 1 101 101 THR C C 101 174.664 174.664 173.252 1.412 25685 5740 1 8 . 1 1 101 101 THR CA C 101 61.709 61.709 62.553 -0.844 25685 5741 1 8 . 1 1 101 101 THR CB C 101 69.290 69.290 69.701 -0.411 25685 5742 1 8 . 1 1 101 101 THR H H 101 7.508 7.508 8.450 -0.942 25685 5743 1 8 . 1 1 102 102 LEU N N 102 124.434 124.434 125.701 -1.267 25685 5744 1 8 . 1 1 102 102 LEU C C 102 174.681 174.681 174.364 0.317 25685 5745 1 8 . 1 1 102 102 LEU CA C 102 53.063 53.063 52.402 0.661 25685 5746 1 8 . 1 1 102 102 LEU CB C 102 41.139 41.139 42.381 -1.242 25685 5747 1 8 . 1 1 102 102 LEU H H 102 7.569 7.569 8.241 -0.672 25685 5748 1 8 . 1 1 103 103 PRO C C 103 178.076 178.076 176.372 1.704 25685 5749 1 8 . 1 1 103 103 PRO CA C 103 62.570 62.570 62.879 -0.309 25685 5750 1 8 . 1 1 103 103 PRO CB C 103 31.534 31.534 32.733 -1.199 25685 5751 1 8 . 1 1 104 104 SER N N 104 119.929 119.929 118.466 1.463 25685 5752 1 8 . 1 1 104 104 SER C C 104 176.432 176.432 174.141 2.291 25685 5753 1 8 . 1 1 104 104 SER CA C 104 61.976 61.976 57.892 4.084 25685 5754 1 8 . 1 1 104 104 SER CB C 104 63.611 63.611 63.801 -0.190 25685 5755 1 8 . 1 1 104 104 SER H H 104 8.784 8.784 8.507 0.277 25685 5756 1 8 . 1 1 105 105 PHE N N 105 119.519 119.519 124.993 -5.474 25685 5757 1 8 . 1 1 105 105 PHE C C 105 176.852 176.852 173.947 2.905 25685 5758 1 8 . 1 1 105 105 PHE CA C 105 60.162 60.162 56.139 4.023 25685 5759 1 8 . 1 1 105 105 PHE CB C 105 38.455 38.455 37.742 0.713 25685 5760 1 8 . 1 1 105 105 PHE H H 105 8.620 8.620 8.466 0.154 25685 5761 1 8 . 1 1 106 106 PHE N N 106 118.809 118.809 118.330 0.479 25685 5762 1 8 . 1 1 106 106 PHE C C 106 176.741 176.741 175.501 1.240 25685 5763 1 8 . 1 1 106 106 PHE CA C 106 61.421 61.421 57.367 4.054 25685 5764 1 8 . 1 1 106 106 PHE CB C 106 38.788 38.788 35.611 3.177 25685 5765 1 8 . 1 1 106 106 PHE H H 106 7.519 7.519 7.792 -0.273 25685 5766 1 8 . 1 1 107 107 PHE N N 107 117.382 117.382 121.648 -4.266 25685 5767 1 8 . 1 1 107 107 PHE C C 107 177.771 177.771 177.336 0.435 25685 5768 1 8 . 1 1 107 107 PHE CA C 107 61.099 61.099 62.494 -1.395 25685 5769 1 8 . 1 1 107 107 PHE CB C 107 38.677 38.677 39.369 -0.692 25685 5770 1 8 . 1 1 107 107 PHE H H 107 7.903 7.903 8.701 -0.798 25685 5771 1 8 . 1 1 108 108 GLY N N 108 105.340 105.340 106.673 -1.333 25685 5772 1 8 . 1 1 108 108 GLY C C 108 174.574 174.574 175.823 -1.249 25685 5773 1 8 . 1 1 108 108 GLY CA C 108 47.508 47.508 47.483 0.025 25685 5774 1 8 . 1 1 108 108 GLY H H 108 8.351 8.351 9.042 -0.691 25685 5775 1 8 . 1 1 109 109 MET N N 109 119.831 119.831 119.920 -0.089 25685 5776 1 8 . 1 1 109 109 MET C C 109 177.522 177.522 177.835 -0.313 25685 5777 1 8 . 1 1 109 109 MET CA C 109 58.658 58.658 56.115 2.543 25685 5778 1 8 . 1 1 109 109 MET CB C 109 32.106 32.106 31.258 0.848 25685 5779 1 8 . 1 1 109 109 MET H H 109 7.919 7.919 7.945 -0.026 25685 5780 1 8 . 1 1 110 110 LEU N N 110 119.908 119.908 119.246 0.662 25685 5781 1 8 . 1 1 110 110 LEU C C 110 178.170 178.170 178.734 -0.564 25685 5782 1 8 . 1 1 110 110 LEU CA C 110 57.941 57.941 57.634 0.307 25685 5783 1 8 . 1 1 110 110 LEU CB C 110 41.055 41.055 40.967 0.088 25685 5784 1 8 . 1 1 110 110 LEU H H 110 7.744 7.744 7.806 -0.062 25685 5785 1 8 . 1 1 111 111 LEU N N 111 116.594 116.594 119.537 -2.943 25685 5786 1 8 . 1 1 111 111 LEU C C 111 178.960 178.960 177.948 1.012 25685 5787 1 8 . 1 1 111 111 LEU CA C 111 57.366 57.366 57.533 -0.167 25685 5788 1 8 . 1 1 111 111 LEU CB C 111 40.259 40.259 41.362 -1.103 25685 5789 1 8 . 1 1 111 111 LEU H H 111 7.732 7.732 7.238 0.494 25685 5790 1 8 . 1 1 112 112 ALA N N 112 121.020 121.020 121.093 -0.073 25685 5791 1 8 . 1 1 112 112 ALA C C 112 178.700 178.700 179.398 -0.698 25685 5792 1 8 . 1 1 112 112 ALA CA C 112 55.432 55.432 54.875 0.557 25685 5793 1 8 . 1 1 112 112 ALA CB C 112 18.214 18.214 17.748 0.466 25685 5794 1 8 . 1 1 112 112 ALA H H 112 8.121 8.121 7.088 1.033 25685 5795 1 8 . 1 1 113 113 PHE N N 113 118.369 118.369 115.893 2.476 25685 5796 1 8 . 1 1 113 113 PHE C C 113 176.091 176.091 177.325 -1.234 25685 5797 1 8 . 1 1 113 113 PHE CA C 113 61.388 61.388 58.319 3.068 25685 5798 1 8 . 1 1 113 113 PHE CB C 113 39.688 39.688 37.397 2.291 25685 5799 1 8 . 1 1 113 113 PHE H H 113 8.237 8.237 6.832 1.405 25685 5800 1 8 . 1 1 114 114 LEU N N 114 114.214 114.214 119.128 -4.914 25685 5801 1 8 . 1 1 114 114 LEU C C 114 177.038 177.038 177.824 -0.786 25685 5802 1 8 . 1 1 114 114 LEU CA C 114 56.358 56.358 57.744 -1.386 25685 5803 1 8 . 1 1 114 114 LEU CB C 114 42.716 42.716 41.574 1.142 25685 5804 1 8 . 1 1 114 114 LEU H H 114 7.576 7.576 7.334 0.242 25685 5805 1 8 . 1 1 115 115 TRP N N 115 112.667 112.667 117.946 -5.279 25685 5806 1 8 . 1 1 115 115 TRP C C 115 180.163 180.163 177.764 2.399 25685 5807 1 8 . 1 1 115 115 TRP CA C 115 55.930 55.930 59.117 -3.187 25685 5808 1 8 . 1 1 115 115 TRP H H 115 8.542 8.542 7.308 1.234 25685 5809 1 8 . 1 1 116 116 LEU N N 116 122.144 122.144 120.872 1.272 25685 5810 1 8 . 1 1 116 116 LEU C C 116 175.953 175.953 176.095 -0.142 25685 5811 1 8 . 1 1 116 116 LEU CA C 116 59.924 59.924 57.408 2.516 25685 5812 1 8 . 1 1 116 116 LEU CB C 116 39.097 39.097 39.038 0.059 25685 5813 1 8 . 1 1 116 116 LEU H H 116 8.996 8.996 7.376 1.620 25685 5814 1 8 . 1 1 117 117 PRO C C 117 174.220 174.220 177.395 -3.175 25685 5815 1 8 . 1 1 117 117 PRO CA C 117 66.300 66.300 64.359 1.941 25685 5816 1 8 . 1 1 118 118 ALA N N 118 110.603 110.603 119.105 -8.502 25685 5817 1 8 . 1 1 118 118 ALA C C 118 177.162 177.162 178.330 -1.168 25685 5818 1 8 . 1 1 118 118 ALA CA C 118 52.670 52.670 52.545 0.125 25685 5819 1 8 . 1 1 118 118 ALA CB C 118 18.853 18.853 19.490 -0.637 25685 5820 1 8 . 1 1 118 118 ALA H H 118 6.633 6.633 7.485 -0.852 25685 5821 1 8 . 1 1 119 119 ILE N N 119 113.492 113.492 115.103 -1.611 25685 5822 1 8 . 1 1 119 119 ILE CA C 119 63.703 63.703 64.001 -0.298 25685 5823 1 8 . 1 1 119 119 ILE CB C 119 39.605 39.605 37.297 2.308 25685 5824 1 8 . 1 1 119 119 ILE H H 119 7.693 7.693 8.237 -0.544 25685 5825 1 8 . 1 1 121 121 PRO C C 121 178.089 178.089 178.994 -0.905 25685 5826 1 8 . 1 1 121 121 PRO CA C 121 66.004 66.004 65.728 0.276 25685 5827 1 8 . 1 1 122 122 PHE N N 122 113.797 113.797 119.444 -5.647 25685 5828 1 8 . 1 1 122 122 PHE C C 122 177.713 177.713 177.086 0.627 25685 5829 1 8 . 1 1 122 122 PHE CA C 122 61.566 61.566 61.157 0.409 25685 5830 1 8 . 1 1 122 122 PHE CB C 122 38.983 38.983 38.770 0.213 25685 5831 1 8 . 1 1 122 122 PHE H H 122 6.846 6.846 8.018 -1.172 25685 5832 1 8 . 1 1 123 123 ALA N N 123 121.512 121.512 121.128 0.384 25685 5833 1 8 . 1 1 123 123 ALA C C 123 179.318 179.318 179.486 -0.168 25685 5834 1 8 . 1 1 123 123 ALA CA C 123 54.975 54.975 55.078 -0.103 25685 5835 1 8 . 1 1 123 123 ALA CB C 123 17.881 17.881 18.012 -0.131 25685 5836 1 8 . 1 1 123 123 ALA H H 123 8.411 8.411 8.627 -0.216 25685 5837 1 8 . 1 1 124 124 GLY N N 124 104.093 104.093 107.022 -2.929 25685 5838 1 8 . 1 1 124 124 GLY C C 124 175.410 175.410 176.119 -0.709 25685 5839 1 8 . 1 1 124 124 GLY CA C 124 47.370 47.370 46.678 0.692 25685 5840 1 8 . 1 1 124 124 GLY H H 124 8.455 8.455 7.882 0.573 25685 5841 1 8 . 1 1 125 125 ILE N N 125 121.895 121.895 122.458 -0.563 25685 5842 1 8 . 1 1 125 125 ILE C C 125 178.329 178.329 177.196 1.133 25685 5843 1 8 . 1 1 125 125 ILE CA C 125 64.412 64.412 63.838 0.574 25685 5844 1 8 . 1 1 125 125 ILE H H 125 7.954 7.954 8.033 -0.079 25685 5845 1 8 . 1 1 126 126 ALA N N 126 122.768 122.768 122.040 0.728 25685 5846 1 8 . 1 1 126 126 ALA C C 126 180.341 180.341 179.371 0.970 25685 5847 1 8 . 1 1 126 126 ALA CA C 126 55.266 55.266 55.592 -0.326 25685 5848 1 8 . 1 1 126 126 ALA CB C 126 18.226 18.226 17.802 0.424 25685 5849 1 8 . 1 1 126 126 ALA H H 126 8.142 8.142 7.776 0.366 25685 5850 1 8 . 1 1 127 127 ILE N N 127 116.752 116.752 117.681 -0.929 25685 5851 1 8 . 1 1 127 127 ILE C C 127 177.993 177.993 177.385 0.608 25685 5852 1 8 . 1 1 127 127 ILE CA C 127 63.877 63.877 63.882 -0.005 25685 5853 1 8 . 1 1 127 127 ILE CB C 127 37.657 37.657 36.731 0.926 25685 5854 1 8 . 1 1 127 127 ILE H H 127 8.335 8.335 7.468 0.867 25685 5855 1 8 . 1 1 128 128 SER N N 128 116.351 116.351 116.546 -0.195 25685 5856 1 8 . 1 1 128 128 SER C C 128 175.796 175.796 176.499 -0.703 25685 5857 1 8 . 1 1 128 128 SER CA C 128 61.818 61.818 61.390 0.428 25685 5858 1 8 . 1 1 128 128 SER H H 128 7.939 7.939 7.593 0.346 25685 5859 1 8 . 1 1 129 129 GLN N N 129 118.082 118.082 121.384 -3.302 25685 5860 1 8 . 1 1 129 129 GLN C C 129 177.419 177.419 178.310 -0.891 25685 5861 1 8 . 1 1 129 129 GLN CA C 129 57.106 57.106 58.577 -1.471 25685 5862 1 8 . 1 1 129 129 GLN CB C 129 28.631 28.631 28.528 0.103 25685 5863 1 8 . 1 1 129 129 GLN H H 129 7.943 7.943 7.641 0.302 25685 5864 1 8 . 1 1 130 130 THR N N 130 113.484 113.484 114.661 -1.177 25685 5865 1 8 . 1 1 130 130 THR C C 130 175.627 175.627 176.939 -1.312 25685 5866 1 8 . 1 1 130 130 THR CA C 130 63.758 63.758 65.569 -1.810 25685 5867 1 8 . 1 1 130 130 THR CB C 130 69.182 69.182 68.718 0.464 25685 5868 1 8 . 1 1 130 130 THR H H 130 7.686 7.686 7.596 0.090 25685 5869 1 8 . 1 1 131 131 LEU N N 131 121.347 121.347 120.484 0.863 25685 5870 1 8 . 1 1 131 131 LEU C C 131 177.522 177.522 176.682 0.840 25685 5871 1 8 . 1 1 131 131 LEU CA C 131 56.307 56.307 57.003 -0.696 25685 5872 1 8 . 1 1 131 131 LEU CB C 131 41.711 41.711 42.689 -0.978 25685 5873 1 8 . 1 1 131 131 LEU H H 131 8.071 8.071 7.373 0.698 25685 5874 1 8 . 1 1 132 132 LEU N N 132 118.162 118.162 116.030 2.132 25685 5875 1 8 . 1 1 132 132 LEU C C 132 177.461 177.461 175.268 2.193 25685 5876 1 8 . 1 1 132 132 LEU CA C 132 55.264 55.264 55.496 -0.232 25685 5877 1 8 . 1 1 132 132 LEU CB C 132 41.613 41.613 42.937 -1.324 25685 5878 1 8 . 1 1 132 132 LEU H H 132 7.810 7.810 7.518 0.292 25685 5879 1 8 . 1 1 133 133 SER N N 133 114.244 114.244 119.172 -4.928 25685 5880 1 8 . 1 1 133 133 SER C C 133 174.363 174.363 173.445 0.918 25685 5881 1 8 . 1 1 133 133 SER CA C 133 59.019 59.019 58.507 0.512 25685 5882 1 8 . 1 1 133 133 SER CB C 133 64.634 64.634 64.159 0.475 25685 5883 1 8 . 1 1 133 133 SER H H 133 7.829 7.829 8.677 -0.848 25685 5884 1 8 . 1 1 134 134 GLU N N 134 120.151 120.151 119.950 0.201 25685 5885 1 8 . 1 1 134 134 GLU C C 134 175.935 175.935 174.560 1.375 25685 5886 1 8 . 1 1 134 134 GLU CA C 134 56.301 56.301 57.374 -1.073 25685 5887 1 8 . 1 1 134 134 GLU CB C 134 30.129 30.129 28.504 1.625 25685 5888 1 8 . 1 1 134 134 GLU H H 134 8.054 8.054 8.528 -0.474 25685 5889 1 8 . 1 1 135 135 ASN N N 135 118.890 118.890 120.862 -1.972 25685 5890 1 8 . 1 1 135 135 ASN C C 135 174.272 174.272 174.308 -0.036 25685 5891 1 8 . 1 1 135 135 ASN CA C 135 51.390 51.390 50.604 0.786 25685 5892 1 8 . 1 1 135 135 ASN CB C 135 39.129 39.129 40.218 -1.089 25685 5893 1 8 . 1 1 135 135 ASN H H 135 8.305 8.305 8.060 0.245 25685 5894 1 8 . 1 1 136 136 PRO C C 136 177.960 177.960 178.199 -0.239 25685 5895 1 8 . 1 1 136 136 PRO CA C 136 64.530 64.530 64.780 -0.250 25685 5896 1 8 . 1 1 136 136 PRO CB C 136 31.809 31.809 32.228 -0.419 25685 5897 1 8 . 1 1 137 137 LEU N N 137 117.735 117.735 119.101 -1.366 25685 5898 1 8 . 1 1 137 137 LEU C C 137 179.217 179.217 179.361 -0.144 25685 5899 1 8 . 1 1 137 137 LEU CA C 137 57.039 57.039 58.146 -1.107 25685 5900 1 8 . 1 1 137 137 LEU CB C 137 40.799 40.799 40.911 -0.112 25685 5901 1 8 . 1 1 137 137 LEU H H 137 8.248 8.248 7.979 0.270 25685 5902 1 8 . 1 1 138 138 VAL N N 138 119.589 119.589 118.902 0.687 25685 5903 1 8 . 1 1 138 138 VAL C C 138 177.894 177.894 177.874 0.020 25685 5904 1 8 . 1 1 138 138 VAL CA C 138 64.727 64.727 66.284 -1.557 25685 5905 1 8 . 1 1 138 138 VAL CB C 138 31.347 31.347 31.220 0.128 25685 5906 1 8 . 1 1 138 138 VAL H H 138 7.483 7.483 8.128 -0.645 25685 5907 1 8 . 1 1 139 139 MET N N 139 119.431 119.431 118.729 0.702 25685 5908 1 8 . 1 1 139 139 MET C C 139 177.988 177.988 178.199 -0.211 25685 5909 1 8 . 1 1 139 139 MET CA C 139 57.403 57.403 58.771 -1.368 25685 5910 1 8 . 1 1 139 139 MET CB C 139 31.709 31.709 32.422 -0.713 25685 5911 1 8 . 1 1 139 139 MET H H 139 7.837 7.837 7.306 0.531 25685 5912 1 8 . 1 1 140 140 LEU N N 140 119.686 119.686 121.142 -1.456 25685 5913 1 8 . 1 1 140 140 LEU C C 140 177.916 177.916 178.925 -1.009 25685 5914 1 8 . 1 1 140 140 LEU CA C 140 56.877 56.877 57.851 -0.974 25685 5915 1 8 . 1 1 140 140 LEU CB C 140 41.491 41.491 40.814 0.677 25685 5916 1 8 . 1 1 140 140 LEU H H 140 7.926 7.926 8.270 -0.344 25685 5917 1 8 . 1 1 141 141 SER N N 141 114.167 114.167 115.183 -1.016 25685 5918 1 8 . 1 1 141 141 SER C C 141 176.030 176.030 177.076 -1.046 25685 5919 1 8 . 1 1 141 141 SER CA C 141 60.425 60.425 61.790 -1.365 25685 5920 1 8 . 1 1 141 141 SER CB C 141 63.956 63.956 63.326 0.630 25685 5921 1 8 . 1 1 141 141 SER H H 141 7.757 7.757 8.685 -0.928 25685 5922 1 8 . 1 1 142 142 TYR N N 142 121.679 121.679 121.250 0.429 25685 5923 1 8 . 1 1 142 142 TYR C C 142 177.659 177.659 178.587 -0.928 25685 5924 1 8 . 1 1 142 142 TYR CA C 142 59.673 59.673 59.423 0.250 25685 5925 1 8 . 1 1 142 142 TYR CB C 142 38.079 38.079 38.026 0.053 25685 5926 1 8 . 1 1 142 142 TYR H H 142 7.965 7.965 8.813 -0.848 25685 5927 1 8 . 1 1 143 143 GLY N N 143 107.396 107.396 107.668 -0.272 25685 5928 1 8 . 1 1 143 143 GLY C C 143 174.877 174.877 176.210 -1.333 25685 5929 1 8 . 1 1 143 143 GLY CA C 143 46.343 46.343 47.337 -0.994 25685 5930 1 8 . 1 1 143 143 GLY H H 143 8.177 8.177 8.623 -0.446 25685 5931 1 8 . 1 1 144 144 LEU N N 144 120.477 120.477 122.860 -2.383 25685 5932 1 8 . 1 1 144 144 LEU C C 144 178.504 178.504 179.479 -0.975 25685 5933 1 8 . 1 1 144 144 LEU CA C 144 56.270 56.270 57.795 -1.525 25685 5934 1 8 . 1 1 144 144 LEU CB C 144 41.662 41.662 41.561 0.101 25685 5935 1 8 . 1 1 144 144 LEU H H 144 8.055 8.055 7.601 0.454 25685 5936 1 8 . 1 1 145 145 GLY N N 145 106.847 106.847 106.741 0.106 25685 5937 1 8 . 1 1 145 145 GLY C C 145 175.375 175.375 175.892 -0.517 25685 5938 1 8 . 1 1 145 145 GLY CA C 145 45.582 45.582 47.053 -1.471 25685 5939 1 8 . 1 1 145 145 GLY H H 145 8.066 8.066 7.566 0.500 25685 5940 1 8 . 1 1 146 146 MET N N 146 120.376 120.376 121.081 -0.705 25685 5941 1 8 . 1 1 146 146 MET C C 146 176.663 176.663 178.541 -1.878 25685 5942 1 8 . 1 1 146 146 MET CA C 146 57.030 57.030 56.907 0.122 25685 5943 1 8 . 1 1 146 146 MET CB C 146 30.720 30.720 31.964 -1.244 25685 5944 1 8 . 1 1 146 146 MET H H 146 8.157 8.157 7.929 0.228 25685 5945 1 8 . 1 1 147 147 ALA N N 147 123.038 123.038 121.789 1.249 25685 5946 1 8 . 1 1 147 147 ALA C C 147 178.917 178.917 179.881 -0.964 25685 5947 1 8 . 1 1 147 147 ALA CA C 147 54.201 54.201 55.163 -0.962 25685 5948 1 8 . 1 1 147 147 ALA CB C 147 18.810 18.810 17.983 0.827 25685 5949 1 8 . 1 1 147 147 ALA H H 147 8.336 8.336 8.502 -0.166 25685 5950 1 8 . 1 1 148 148 VAL N N 148 117.795 117.795 117.089 0.706 25685 5951 1 8 . 1 1 148 148 VAL C C 148 176.891 176.891 178.238 -1.347 25685 5952 1 8 . 1 1 148 148 VAL CA C 148 64.157 64.157 66.182 -2.025 25685 5953 1 8 . 1 1 148 148 VAL CB C 148 31.529 31.529 31.695 -0.166 25685 5954 1 8 . 1 1 148 148 VAL H H 148 7.908 7.908 7.446 0.462 25685 5955 1 8 . 1 1 149 149 THR N N 149 116.069 116.069 116.857 -0.788 25685 5956 1 8 . 1 1 149 149 THR C C 149 176.054 176.054 176.716 -0.662 25685 5957 1 8 . 1 1 149 149 THR CA C 149 63.308 63.308 67.229 -3.921 25685 5958 1 8 . 1 1 149 149 THR H H 149 7.414 7.414 7.433 -0.019 25685 5959 1 8 . 1 1 150 150 ILE N N 150 121.971 121.971 118.805 3.166 25685 5960 1 8 . 1 1 150 150 ILE C C 150 177.715 177.715 177.488 0.227 25685 5961 1 8 . 1 1 150 150 ILE CA C 150 64.319 64.319 65.126 -0.807 25685 5962 1 8 . 1 1 150 150 ILE CB C 150 36.628 36.628 36.580 0.048 25685 5963 1 8 . 1 1 150 150 ILE H H 150 8.772 8.772 8.082 0.690 25685 5964 1 8 . 1 1 151 151 ALA N N 151 122.272 122.272 122.734 -0.462 25685 5965 1 8 . 1 1 151 151 ALA C C 151 180.370 180.370 179.365 1.005 25685 5966 1 8 . 1 1 151 151 ALA CA C 151 55.336 55.336 55.368 -0.033 25685 5967 1 8 . 1 1 151 151 ALA CB C 151 18.107 18.107 17.682 0.425 25685 5968 1 8 . 1 1 151 151 ALA H H 151 8.163 8.163 7.788 0.375 25685 5969 1 8 . 1 1 152 152 ALA N N 152 120.648 120.648 120.718 -0.070 25685 5970 1 8 . 1 1 152 152 ALA C C 152 181.019 181.019 179.931 1.088 25685 5971 1 8 . 1 1 152 152 ALA CA C 152 54.944 54.944 54.772 0.173 25685 5972 1 8 . 1 1 152 152 ALA CB C 152 18.963 18.963 18.501 0.462 25685 5973 1 8 . 1 1 152 152 ALA H H 152 7.877 7.877 7.521 0.356 25685 5974 1 8 . 1 1 153 153 VAL N N 153 119.372 119.372 119.745 -0.373 25685 5975 1 8 . 1 1 153 153 VAL C C 153 178.197 178.197 178.332 -0.135 25685 5976 1 8 . 1 1 153 153 VAL CA C 153 66.289 66.289 66.450 -0.161 25685 5977 1 8 . 1 1 153 153 VAL CB C 153 30.770 30.770 31.898 -1.128 25685 5978 1 8 . 1 1 153 153 VAL H H 153 8.118 8.118 8.709 -0.591 25685 5979 1 8 . 1 1 154 154 PHE N N 154 120.362 120.362 119.849 0.513 25685 5980 1 8 . 1 1 154 154 PHE C C 154 177.733 177.733 177.738 -0.005 25685 5981 1 8 . 1 1 154 154 PHE CA C 154 61.412 61.412 61.350 0.062 25685 5982 1 8 . 1 1 154 154 PHE CB C 154 38.465 38.465 38.390 0.075 25685 5983 1 8 . 1 1 154 154 PHE H H 154 8.508 8.508 8.969 -0.461 25685 5984 1 8 . 1 1 155 155 LYS N N 155 118.894 118.894 118.597 0.297 25685 5985 1 8 . 1 1 155 155 LYS C C 155 179.940 179.940 178.775 1.165 25685 5986 1 8 . 1 1 155 155 LYS CA C 155 58.969 58.969 59.166 -0.197 25685 5987 1 8 . 1 1 155 155 LYS CB C 155 31.725 31.725 31.753 -0.028 25685 5988 1 8 . 1 1 155 155 LYS H H 155 8.035 8.035 8.011 0.024 25685 5989 1 8 . 1 1 156 156 MET N N 156 118.853 118.853 116.533 2.320 25685 5990 1 8 . 1 1 156 156 MET C C 156 179.245 179.245 177.665 1.580 25685 5991 1 8 . 1 1 156 156 MET CA C 156 58.518 58.518 58.061 0.457 25685 5992 1 8 . 1 1 156 156 MET CB C 156 31.912 31.912 31.047 0.865 25685 5993 1 8 . 1 1 156 156 MET H H 156 8.014 8.014 7.437 0.577 25685 5994 1 8 . 1 1 157 157 GLY N N 157 108.239 108.239 106.355 1.884 25685 5995 1 8 . 1 1 157 157 GLY C C 157 174.637 174.637 175.235 -0.598 25685 5996 1 8 . 1 1 157 157 GLY CA C 157 47.204 47.204 46.853 0.351 25685 5997 1 8 . 1 1 157 157 GLY H H 157 8.614 8.614 7.588 1.026 25685 5998 1 8 . 1 1 158 158 GLU N N 158 122.902 122.902 119.287 3.615 25685 5999 1 8 . 1 1 158 158 GLU C C 158 177.851 177.851 175.953 1.898 25685 6000 1 8 . 1 1 158 158 GLU CA C 158 60.203 60.203 56.154 4.049 25685 6001 1 8 . 1 1 158 158 GLU CB C 158 28.870 28.870 32.359 -3.489 25685 6002 1 8 . 1 1 158 158 GLU H H 158 8.550 8.550 7.646 0.904 25685 6003 1 8 . 1 1 159 159 LYS N N 159 117.932 117.932 119.384 -1.452 25685 6004 1 8 . 1 1 159 159 LYS C C 159 179.529 179.529 175.035 4.494 25685 6005 1 8 . 1 1 159 159 LYS CA C 159 59.419 59.419 56.053 3.366 25685 6006 1 8 . 1 1 159 159 LYS CB C 159 31.759 31.759 33.206 -1.447 25685 6007 1 8 . 1 1 159 159 LYS H H 159 7.641 7.641 7.592 0.049 25685 6008 1 8 . 1 1 160 160 PHE N N 160 120.614 120.614 126.620 -6.006 25685 6009 1 8 . 1 1 160 160 PHE C C 160 178.511 178.511 176.808 1.703 25685 6010 1 8 . 1 1 160 160 PHE CA C 160 61.580 61.580 59.981 1.599 25685 6011 1 8 . 1 1 160 160 PHE CB C 160 39.909 39.909 39.297 0.612 25685 6012 1 8 . 1 1 160 160 PHE H H 160 8.026 8.026 8.626 -0.600 25685 6013 1 8 . 1 1 161 161 VAL N N 161 119.870 119.870 115.593 4.277 25685 6014 1 8 . 1 1 161 161 VAL C C 161 177.347 177.347 175.814 1.533 25685 6015 1 8 . 1 1 161 161 VAL CA C 161 66.121 66.121 64.356 1.764 25685 6016 1 8 . 1 1 161 161 VAL CB C 161 30.935 30.935 32.764 -1.829 25685 6017 1 8 . 1 1 161 161 VAL H H 161 8.628 8.628 7.985 0.643 25685 6018 1 8 . 1 1 162 162 LYS N N 162 116.237 116.237 120.201 -3.964 25685 6019 1 8 . 1 1 162 162 LYS C C 162 179.197 179.197 174.423 4.774 25685 6020 1 8 . 1 1 162 162 LYS CA C 162 60.037 60.037 57.274 2.763 25685 6021 1 8 . 1 1 162 162 LYS CB C 162 31.333 31.333 33.368 -2.035 25685 6022 1 8 . 1 1 162 162 LYS H H 162 7.843 7.843 7.994 -0.151 25685 6023 1 8 . 1 1 163 163 ALA N N 163 119.197 119.197 120.859 -1.662 25685 6024 1 8 . 1 1 163 163 ALA C C 163 178.635 178.635 175.218 3.417 25685 6025 1 8 . 1 1 163 163 ALA CA C 163 53.681 53.681 51.972 1.709 25685 6026 1 8 . 1 1 163 163 ALA CB C 163 19.586 19.586 18.980 0.606 25685 6027 1 8 . 1 1 163 163 ALA H H 163 7.630 7.630 7.996 -0.366 25685 6028 1 8 . 1 1 164 164 ASN N N 164 115.956 115.956 118.370 -2.414 25685 6029 1 8 . 1 1 164 164 ASN C C 164 175.556 175.556 176.103 -0.547 25685 6030 1 8 . 1 1 164 164 ASN CA C 164 52.267 52.267 53.422 -1.155 25685 6031 1 8 . 1 1 164 164 ASN CB C 164 39.148 39.148 38.302 0.846 25685 6032 1 8 . 1 1 164 164 ASN H H 164 7.326 7.326 8.247 -0.921 25685 6033 1 8 . 1 1 165 165 PHE N N 165 121.612 121.612 120.426 1.186 25685 6034 1 8 . 1 1 165 165 PHE C C 165 177.069 177.069 176.671 0.398 25685 6035 1 8 . 1 1 165 165 PHE CA C 165 62.921 62.921 60.631 2.290 25685 6036 1 8 . 1 1 165 165 PHE CB C 165 39.427 39.427 38.635 0.792 25685 6037 1 8 . 1 1 165 165 PHE H H 165 7.408 7.408 8.533 -1.125 25685 6038 1 8 . 1 1 166 166 GLN N N 166 117.147 117.147 118.587 -1.440 25685 6039 1 8 . 1 1 166 166 GLN C C 166 178.922 178.922 177.663 1.259 25685 6040 1 8 . 1 1 166 166 GLN CA C 166 59.262 59.262 58.311 0.951 25685 6041 1 8 . 1 1 166 166 GLN CB C 166 26.811 26.811 27.563 -0.752 25685 6042 1 8 . 1 1 166 166 GLN H H 166 8.605 8.605 7.384 1.221 25685 6043 1 8 . 1 1 167 167 LEU N N 167 121.946 121.946 120.293 1.653 25685 6044 1 8 . 1 1 167 167 LEU C C 167 178.863 178.863 178.920 -0.057 25685 6045 1 8 . 1 1 167 167 LEU CA C 167 58.039 58.039 56.783 1.256 25685 6046 1 8 . 1 1 167 167 LEU CB C 167 41.130 41.130 41.909 -0.779 25685 6047 1 8 . 1 1 167 167 LEU H H 167 7.892 7.892 7.327 0.565 25685 6048 1 8 . 1 1 168 168 ILE N N 168 118.751 118.751 118.207 0.544 25685 6049 1 8 . 1 1 168 168 ILE C C 168 179.908 179.908 177.446 2.462 25685 6050 1 8 . 1 1 168 168 ILE CA C 168 63.886 63.886 63.967 -0.081 25685 6051 1 8 . 1 1 168 168 ILE CB C 168 36.170 36.170 38.076 -1.906 25685 6052 1 8 . 1 1 168 168 ILE H H 168 8.065 8.065 7.506 0.559 25685 6053 1 8 . 1 1 169 169 ARG N N 169 125.851 125.851 118.800 7.051 25685 6054 1 8 . 1 1 169 169 ARG C C 169 177.579 177.579 177.990 -0.411 25685 6055 1 8 . 1 1 169 169 ARG CA C 169 60.306 60.306 59.301 1.004 25685 6056 1 8 . 1 1 169 169 ARG CB C 169 29.224 29.224 29.921 -0.697 25685 6057 1 8 . 1 1 169 169 ARG H H 169 8.995 8.995 7.768 1.227 25685 6058 1 8 . 1 1 170 170 LYS N N 170 119.586 119.586 118.747 0.839 25685 6059 1 8 . 1 1 170 170 LYS C C 170 178.584 178.584 178.616 -0.032 25685 6060 1 8 . 1 1 170 170 LYS CA C 170 60.293 60.293 59.154 1.139 25685 6061 1 8 . 1 1 170 170 LYS CB C 170 32.530 32.530 31.034 1.496 25685 6062 1 8 . 1 1 170 170 LYS H H 170 7.663 7.663 7.582 0.081 25685 6063 1 8 . 1 1 171 171 VAL N N 171 118.348 118.348 118.825 -0.477 25685 6064 1 8 . 1 1 171 171 VAL C C 171 177.478 177.478 177.668 -0.190 25685 6065 1 8 . 1 1 171 171 VAL CA C 171 66.641 66.641 66.456 0.185 25685 6066 1 8 . 1 1 171 171 VAL CB C 171 31.565 31.565 31.217 0.348 25685 6067 1 8 . 1 1 171 171 VAL H H 171 8.515 8.515 7.732 0.783 25685 6068 1 8 . 1 1 172 172 THR N N 172 115.172 115.172 113.244 1.928 25685 6069 1 8 . 1 1 172 172 THR C C 172 176.320 176.320 176.663 -0.343 25685 6070 1 8 . 1 1 172 172 THR H H 172 8.416 8.416 7.593 0.823 25685 6071 1 8 . 1 1 173 173 GLY N N 173 108.801 108.801 109.049 -0.248 25685 6072 1 8 . 1 1 173 173 GLY C C 173 174.138 174.138 175.274 -1.136 25685 6073 1 8 . 1 1 173 173 GLY CA C 173 47.769 47.769 46.536 1.233 25685 6074 1 8 . 1 1 173 173 GLY H H 173 8.505 8.505 7.607 0.898 25685 6075 1 8 . 1 1 174 174 ALA N N 174 123.573 123.573 125.129 -1.556 25685 6076 1 8 . 1 1 174 174 ALA C C 174 178.782 178.782 179.199 -0.417 25685 6077 1 8 . 1 1 174 174 ALA CA C 174 55.604 55.604 54.607 0.997 25685 6078 1 8 . 1 1 174 174 ALA CB C 174 18.778 18.778 18.526 0.252 25685 6079 1 8 . 1 1 174 174 ALA H H 174 8.038 8.038 7.786 0.252 25685 6080 1 8 . 1 1 175 175 ILE N N 175 118.501 118.501 118.839 -0.338 25685 6081 1 8 . 1 1 175 175 ILE C C 175 178.247 178.247 177.728 0.519 25685 6082 1 8 . 1 1 175 175 ILE CA C 175 65.412 65.412 65.119 0.293 25685 6083 1 8 . 1 1 175 175 ILE CB C 175 37.671 37.671 38.229 -0.558 25685 6084 1 8 . 1 1 175 175 ILE H H 175 7.897 7.897 7.545 0.352 25685 6085 1 8 . 1 1 176 176 VAL N N 176 120.104 120.104 117.314 2.790 25685 6086 1 8 . 1 1 176 176 VAL C C 176 177.945 177.945 177.842 0.103 25685 6087 1 8 . 1 1 176 176 VAL CA C 176 67.761 67.761 65.707 2.054 25685 6088 1 8 . 1 1 176 176 VAL CB C 176 30.662 30.662 31.615 -0.953 25685 6089 1 8 . 1 1 176 176 VAL H H 176 8.321 8.321 7.585 0.736 25685 6090 1 8 . 1 1 177 177 LEU N N 177 118.561 118.561 119.542 -0.981 25685 6091 1 8 . 1 1 177 177 LEU C C 177 178.563 178.563 178.321 0.242 25685 6092 1 8 . 1 1 177 177 LEU CA C 177 58.094 58.094 57.872 0.222 25685 6093 1 8 . 1 1 177 177 LEU CB C 177 41.061 41.061 41.168 -0.107 25685 6094 1 8 . 1 1 177 177 LEU H H 177 8.097 8.097 7.307 0.790 25685 6095 1 8 . 1 1 178 178 LEU N N 178 120.868 120.868 119.557 1.311 25685 6096 1 8 . 1 1 178 178 LEU C C 178 178.524 178.524 178.085 0.439 25685 6097 1 8 . 1 1 178 178 LEU CA C 178 57.767 57.767 57.886 -0.119 25685 6098 1 8 . 1 1 178 178 LEU CB C 178 40.886 40.886 41.102 -0.216 25685 6099 1 8 . 1 1 178 178 LEU H H 178 8.229 8.229 7.225 1.004 25685 6100 1 8 . 1 1 179 179 TYR N N 179 119.355 119.355 119.590 -0.235 25685 6101 1 8 . 1 1 179 179 TYR C C 179 180.059 180.059 177.423 2.636 25685 6102 1 8 . 1 1 179 179 TYR CA C 179 63.844 63.844 60.764 3.079 25685 6103 1 8 . 1 1 179 179 TYR CB C 179 39.508 39.508 38.432 1.076 25685 6104 1 8 . 1 1 179 179 TYR H H 179 8.759 8.759 7.557 1.202 25685 6105 1 8 . 1 1 180 180 LEU N N 180 118.984 118.984 118.800 0.184 25685 6106 1 8 . 1 1 180 180 LEU C C 180 179.079 179.079 179.033 0.046 25685 6107 1 8 . 1 1 180 180 LEU CA C 180 58.879 58.879 57.401 1.478 25685 6108 1 8 . 1 1 180 180 LEU CB C 180 41.899 41.899 41.108 0.791 25685 6109 1 8 . 1 1 180 180 LEU H H 180 8.315 8.315 7.491 0.824 25685 6110 1 8 . 1 1 181 181 ALA N N 181 121.826 121.826 122.227 -0.401 25685 6111 1 8 . 1 1 181 181 ALA C C 181 180.009 180.009 179.140 0.869 25685 6112 1 8 . 1 1 181 181 ALA CA C 181 55.700 55.700 54.976 0.724 25685 6113 1 8 . 1 1 181 181 ALA CB C 181 17.713 17.713 18.538 -0.825 25685 6114 1 8 . 1 1 181 181 ALA H H 181 8.480 8.480 8.276 0.204 25685 6115 1 8 . 1 1 182 182 TYR N N 182 118.039 118.039 118.212 -0.173 25685 6116 1 8 . 1 1 182 182 TYR CA C 182 59.038 59.038 61.812 -2.774 25685 6117 1 8 . 1 1 182 182 TYR H H 182 8.856 8.856 7.930 0.926 25685 6118 1 8 . 1 1 183 183 PHE N N 183 124.769 124.769 116.421 8.348 25685 6119 1 8 . 1 1 183 183 PHE CA C 183 63.566 63.566 60.004 3.562 25685 6120 1 8 . 1 1 183 183 PHE H H 183 9.764 9.764 7.602 2.162 25685 6121 1 9 . 1 1 4 4 ALA N N 4 121.533 121.533 124.002 -2.469 25685 6122 1 9 . 1 1 4 4 ALA C C 4 177.632 177.632 178.722 -1.090 25685 6123 1 9 . 1 1 4 4 ALA CA C 4 55.117 55.117 55.116 0.001 25685 6124 1 9 . 1 1 4 4 ALA CB C 4 18.448 18.448 18.037 0.411 25685 6125 1 9 . 1 1 4 4 ALA H H 4 7.977 7.977 8.424 -0.447 25685 6126 1 9 . 1 1 5 5 PHE N N 5 119.988 119.988 119.484 0.504 25685 6127 1 9 . 1 1 5 5 PHE CA C 5 60.759 60.759 60.320 0.439 25685 6128 1 9 . 1 1 5 5 PHE CB C 5 39.221 39.221 38.674 0.547 25685 6129 1 9 . 1 1 5 5 PHE H H 5 8.210 8.210 8.288 -0.078 25685 6130 1 9 . 1 1 6 6 ALA C C 6 179.794 179.794 179.569 0.225 25685 6131 1 9 . 1 1 6 6 ALA CA C 6 55.619 55.619 54.837 0.782 25685 6132 1 9 . 1 1 6 6 ALA CB C 6 17.911 17.911 17.950 -0.039 25685 6133 1 9 . 1 1 6 6 ALA H H 6 8.417 8.417 8.415 0.002 25685 6134 1 9 . 1 1 7 7 LEU N N 7 115.852 115.852 117.899 -2.047 25685 6135 1 9 . 1 1 7 7 LEU C C 7 180.196 180.196 179.429 0.767 25685 6136 1 9 . 1 1 7 7 LEU CA C 7 57.528 57.528 57.284 0.244 25685 6137 1 9 . 1 1 7 7 LEU CB C 7 40.060 40.060 41.088 -1.028 25685 6138 1 9 . 1 1 7 7 LEU H H 7 8.741 8.741 7.502 1.239 25685 6139 1 9 . 1 1 8 8 GLY N N 8 110.199 110.199 107.317 2.882 25685 6140 1 9 . 1 1 8 8 GLY C C 8 176.430 176.430 175.648 0.782 25685 6141 1 9 . 1 1 8 8 GLY CA C 8 46.960 46.960 47.075 -0.115 25685 6142 1 9 . 1 1 8 8 GLY H H 8 8.179 8.179 7.699 0.480 25685 6143 1 9 . 1 1 9 9 ILE N N 9 122.346 122.346 122.067 0.279 25685 6144 1 9 . 1 1 9 9 ILE C C 9 178.143 178.143 176.788 1.355 25685 6145 1 9 . 1 1 9 9 ILE CA C 9 65.048 65.048 63.766 1.282 25685 6146 1 9 . 1 1 9 9 ILE CB C 9 36.841 36.841 37.756 -0.915 25685 6147 1 9 . 1 1 9 9 ILE H H 9 7.788 7.788 7.149 0.639 25685 6148 1 9 . 1 1 10 10 LEU N N 10 117.560 117.560 120.403 -2.843 25685 6149 1 9 . 1 1 10 10 LEU C C 10 179.501 179.501 178.498 1.003 25685 6150 1 9 . 1 1 10 10 LEU CA C 10 58.068 58.068 57.918 0.150 25685 6151 1 9 . 1 1 10 10 LEU CB C 10 40.776 40.776 41.658 -0.882 25685 6152 1 9 . 1 1 10 10 LEU H H 10 8.044 8.044 7.484 0.560 25685 6153 1 9 . 1 1 11 11 SER N N 11 113.830 113.830 113.995 -0.165 25685 6154 1 9 . 1 1 11 11 SER CA C 11 61.769 61.769 61.587 0.182 25685 6155 1 9 . 1 1 11 11 SER CB C 11 63.395 63.395 63.484 -0.089 25685 6156 1 9 . 1 1 11 11 SER H H 11 8.140 8.140 7.775 0.365 25685 6157 1 9 . 1 1 12 12 VAL N N 12 121.343 121.343 118.230 3.113 25685 6158 1 9 . 1 1 12 12 VAL C C 12 176.753 176.753 177.917 -1.164 25685 6159 1 9 . 1 1 12 12 VAL CA C 12 64.583 64.583 64.710 -0.127 25685 6160 1 9 . 1 1 12 12 VAL CB C 12 31.067 31.067 31.116 -0.049 25685 6161 1 9 . 1 1 12 12 VAL H H 12 7.587 7.587 7.494 0.093 25685 6162 1 9 . 1 1 13 13 PHE N N 13 115.225 115.225 121.134 -5.909 25685 6163 1 9 . 1 1 13 13 PHE C C 13 177.349 177.349 176.290 1.059 25685 6164 1 9 . 1 1 13 13 PHE CA C 13 58.730 58.730 61.080 -2.350 25685 6165 1 9 . 1 1 13 13 PHE CB C 13 39.785 39.785 38.739 1.046 25685 6166 1 9 . 1 1 13 13 PHE H H 13 7.474 7.474 7.699 -0.225 25685 6167 1 9 . 1 1 14 14 SER N N 14 116.075 116.075 115.105 0.970 25685 6168 1 9 . 1 1 14 14 SER H H 14 7.955 7.955 8.327 -0.372 25685 6169 1 9 . 1 1 15 15 PRO C C 15 177.590 177.590 175.741 1.849 25685 6170 1 9 . 1 1 15 15 PRO CA C 15 65.464 65.464 62.213 3.251 25685 6171 1 9 . 1 1 16 16 ALA N N 16 116.288 116.288 121.540 -5.252 25685 6172 1 9 . 1 1 16 16 ALA C C 16 177.563 177.563 176.499 1.064 25685 6173 1 9 . 1 1 16 16 ALA CA C 16 53.010 53.010 51.768 1.242 25685 6174 1 9 . 1 1 16 16 ALA CB C 16 19.975 19.975 19.424 0.551 25685 6175 1 9 . 1 1 16 16 ALA H H 16 7.455 7.455 8.029 -0.574 25685 6176 1 9 . 1 1 17 17 VAL N N 17 112.072 112.072 119.691 -7.619 25685 6177 1 9 . 1 1 17 17 VAL CA C 17 63.117 63.117 62.423 0.694 25685 6178 1 9 . 1 1 17 17 VAL CB C 17 33.209 33.209 32.940 0.270 25685 6179 1 9 . 1 1 17 17 VAL H H 17 7.525 7.525 8.319 -0.794 25685 6180 1 9 . 1 1 18 18 LEU N N 18 121.205 121.205 126.129 -4.924 25685 6181 1 9 . 1 1 18 18 LEU CA C 18 58.971 58.971 58.382 0.589 25685 6182 1 9 . 1 1 18 18 LEU CB C 18 41.161 41.161 40.093 1.068 25685 6183 1 9 . 1 1 18 18 LEU H H 18 8.191 8.191 8.377 -0.186 25685 6184 1 9 . 1 1 19 19 PRO C C 19 177.697 177.697 176.203 1.494 25685 6185 1 9 . 1 1 19 19 PRO CA C 19 65.181 65.181 63.498 1.683 25685 6186 1 9 . 1 1 20 20 VAL N N 20 111.723 111.723 113.772 -2.049 25685 6187 1 9 . 1 1 20 20 VAL C C 20 177.137 177.137 174.393 2.744 25685 6188 1 9 . 1 1 20 20 VAL CA C 20 62.494 62.494 62.833 -0.339 25685 6189 1 9 . 1 1 20 20 VAL CB C 20 31.677 31.677 30.581 1.097 25685 6190 1 9 . 1 1 20 20 VAL H H 20 7.571 7.571 7.614 -0.043 25685 6191 1 9 . 1 1 21 21 VAL N N 21 121.705 121.705 118.816 2.889 25685 6192 1 9 . 1 1 21 21 VAL CA C 21 68.305 68.305 63.136 5.170 25685 6193 1 9 . 1 1 21 21 VAL H H 21 7.732 7.732 7.833 -0.101 25685 6194 1 9 . 1 1 24 24 ILE C C 24 174.359 174.359 175.470 -1.111 25685 6195 1 9 . 1 1 25 25 PHE N N 25 120.132 120.132 119.051 1.081 25685 6196 1 9 . 1 1 25 25 PHE C C 25 175.945 175.945 173.771 2.174 25685 6197 1 9 . 1 1 25 25 PHE CA C 25 60.544 60.544 58.130 2.414 25685 6198 1 9 . 1 1 25 25 PHE H H 25 8.082 8.082 8.107 -0.025 25685 6199 1 9 . 1 1 26 26 ALA N N 26 121.341 121.341 122.314 -0.973 25685 6200 1 9 . 1 1 26 26 ALA CB C 26 19.784 19.784 20.725 -0.941 25685 6201 1 9 . 1 1 26 26 ALA H H 26 7.539 7.539 7.429 0.110 25685 6202 1 9 . 1 1 27 27 GLY N N 27 107.530 107.530 107.875 -0.345 25685 6203 1 9 . 1 1 27 27 GLY C C 27 174.252 174.252 173.834 0.418 25685 6204 1 9 . 1 1 27 27 GLY CA C 27 45.474 45.474 45.971 -0.497 25685 6205 1 9 . 1 1 27 27 GLY H H 27 7.997 7.997 8.704 -0.707 25685 6206 1 9 . 1 1 28 28 SER N N 28 116.299 116.299 116.129 0.170 25685 6207 1 9 . 1 1 28 28 SER C C 28 175.759 175.759 172.546 3.213 25685 6208 1 9 . 1 1 28 28 SER CA C 28 58.526 58.526 57.812 0.714 25685 6209 1 9 . 1 1 28 28 SER CB C 28 64.373 64.373 65.356 -0.983 25685 6210 1 9 . 1 1 28 28 SER H H 28 8.115 8.115 8.463 -0.348 25685 6211 1 9 . 1 1 34 34 ASP C C 34 177.621 177.621 177.930 -0.309 25685 6212 1 9 . 1 1 34 34 ASP CA C 34 57.082 57.082 57.669 -0.587 25685 6213 1 9 . 1 1 35 35 ALA N N 35 120.662 120.662 121.395 -0.733 25685 6214 1 9 . 1 1 35 35 ALA C C 35 179.168 179.168 179.344 -0.176 25685 6215 1 9 . 1 1 35 35 ALA CA C 35 55.459 55.459 54.606 0.853 25685 6216 1 9 . 1 1 35 35 ALA CB C 35 18.819 18.819 18.207 0.612 25685 6217 1 9 . 1 1 35 35 ALA H H 35 8.090 8.090 7.358 0.732 25685 6218 1 9 . 1 1 36 36 PHE N N 36 117.638 117.638 119.615 -1.977 25685 6219 1 9 . 1 1 36 36 PHE C C 36 177.057 177.057 177.011 0.046 25685 6220 1 9 . 1 1 36 36 PHE CA C 36 61.472 61.472 61.073 0.399 25685 6221 1 9 . 1 1 36 36 PHE CB C 36 38.860 38.860 38.946 -0.086 25685 6222 1 9 . 1 1 36 36 PHE H H 36 8.227 8.227 7.699 0.528 25685 6223 1 9 . 1 1 37 37 LEU N N 37 119.312 119.312 119.071 0.241 25685 6224 1 9 . 1 1 37 37 LEU C C 37 179.798 179.798 178.760 1.038 25685 6225 1 9 . 1 1 37 37 LEU CA C 37 58.181 58.181 57.602 0.579 25685 6226 1 9 . 1 1 37 37 LEU CB C 37 40.835 40.835 41.668 -0.833 25685 6227 1 9 . 1 1 37 37 LEU H H 37 8.588 8.588 7.592 0.996 25685 6228 1 9 . 1 1 38 38 ILE N N 38 119.057 119.057 117.902 1.155 25685 6229 1 9 . 1 1 38 38 ILE C C 38 177.597 177.597 178.067 -0.470 25685 6230 1 9 . 1 1 38 38 ILE CA C 38 64.827 64.827 63.955 0.872 25685 6231 1 9 . 1 1 38 38 ILE CB C 38 36.321 36.321 36.093 0.228 25685 6232 1 9 . 1 1 38 38 ILE H H 38 7.932 7.932 7.384 0.548 25685 6233 1 9 . 1 1 39 39 VAL N N 39 118.758 118.758 116.640 2.118 25685 6234 1 9 . 1 1 39 39 VAL C C 39 179.533 179.533 177.679 1.854 25685 6235 1 9 . 1 1 39 39 VAL CA C 39 66.687 66.687 65.969 0.718 25685 6236 1 9 . 1 1 39 39 VAL CB C 39 30.598 30.598 31.142 -0.544 25685 6237 1 9 . 1 1 39 39 VAL H H 39 7.922 7.922 7.229 0.693 25685 6238 1 9 . 1 1 40 40 ALA N N 40 125.385 125.385 122.159 3.226 25685 6239 1 9 . 1 1 40 40 ALA C C 40 179.200 179.200 179.609 -0.409 25685 6240 1 9 . 1 1 40 40 ALA CA C 40 55.283 55.283 54.789 0.493 25685 6241 1 9 . 1 1 40 40 ALA CB C 40 17.197 17.197 18.375 -1.178 25685 6242 1 9 . 1 1 40 40 ALA H H 40 9.091 9.091 7.237 1.854 25685 6243 1 9 . 1 1 41 41 GLY N N 41 106.978 106.978 105.894 1.084 25685 6244 1 9 . 1 1 41 41 GLY C C 41 176.171 176.171 175.759 0.412 25685 6245 1 9 . 1 1 41 41 GLY CA C 41 47.322 47.322 46.942 0.380 25685 6246 1 9 . 1 1 41 41 GLY H H 41 8.565 8.565 7.915 0.650 25685 6247 1 9 . 1 1 42 42 LEU N N 42 126.914 126.914 119.655 7.259 25685 6248 1 9 . 1 1 42 42 LEU C C 42 178.119 178.119 178.323 -0.204 25685 6249 1 9 . 1 1 42 42 LEU CA C 42 58.523 58.523 57.596 0.927 25685 6250 1 9 . 1 1 42 42 LEU CB C 42 42.125 42.125 41.503 0.622 25685 6251 1 9 . 1 1 42 42 LEU H H 42 8.573 8.573 7.563 1.010 25685 6252 1 9 . 1 1 46 46 MET N N 46 121.710 121.710 124.050 -2.340 25685 6253 1 9 . 1 1 46 46 MET C C 46 179.540 179.540 178.005 1.535 25685 6254 1 9 . 1 1 46 46 MET CA C 46 55.968 55.968 58.973 -3.005 25685 6255 1 9 . 1 1 46 46 MET H H 46 8.589 8.589 8.380 0.209 25685 6256 1 9 . 1 1 47 47 LEU N N 47 117.448 117.448 120.430 -2.982 25685 6257 1 9 . 1 1 47 47 LEU HA H 47 3.992 3.992 4.005 -0.013 25685 6258 1 9 . 1 1 47 47 LEU C C 47 179.082 179.082 178.691 0.391 25685 6259 1 9 . 1 1 47 47 LEU CA C 47 58.157 58.157 57.746 0.411 25685 6260 1 9 . 1 1 47 47 LEU CB C 47 41.858 41.858 41.363 0.495 25685 6261 1 9 . 1 1 47 47 LEU H H 47 8.769 8.769 7.831 0.938 25685 6262 1 9 . 1 1 48 48 ILE N N 48 117.500 117.500 117.800 -0.300 25685 6263 1 9 . 1 1 48 48 ILE C C 48 180.298 180.298 178.823 1.475 25685 6264 1 9 . 1 1 48 48 ILE CA C 48 65.627 65.627 64.273 1.354 25685 6265 1 9 . 1 1 48 48 ILE CB C 48 37.839 37.839 37.843 -0.004 25685 6266 1 9 . 1 1 48 48 ILE H H 48 8.093 8.093 7.490 0.603 25685 6267 1 9 . 1 1 49 49 LEU N N 49 123.708 123.708 120.082 3.626 25685 6268 1 9 . 1 1 49 49 LEU C C 49 179.721 179.721 178.466 1.255 25685 6269 1 9 . 1 1 49 49 LEU CA C 49 58.788 58.788 57.562 1.226 25685 6270 1 9 . 1 1 49 49 LEU CB C 49 40.761 40.761 41.914 -1.153 25685 6271 1 9 . 1 1 49 49 LEU H H 49 8.833 8.833 8.336 0.497 25685 6272 1 9 . 1 1 50 50 GLY N N 50 109.284 109.284 104.574 4.710 25685 6273 1 9 . 1 1 50 50 GLY C C 50 176.937 176.937 174.314 2.623 25685 6274 1 9 . 1 1 50 50 GLY CA C 50 47.821 47.821 46.488 1.333 25685 6275 1 9 . 1 1 50 50 GLY H H 50 9.658 9.658 7.733 1.925 25685 6276 1 9 . 1 1 51 51 TYR N N 51 125.640 125.640 119.467 6.173 25685 6277 1 9 . 1 1 51 51 TYR C C 51 177.102 177.102 174.858 2.244 25685 6278 1 9 . 1 1 51 51 TYR CA C 51 61.948 61.948 56.810 5.138 25685 6279 1 9 . 1 1 51 51 TYR CB C 51 38.871 38.871 40.999 -2.128 25685 6280 1 9 . 1 1 51 51 TYR H H 51 8.795 8.795 7.716 1.079 25685 6281 1 9 . 1 1 52 52 THR N N 52 116.273 116.273 114.421 1.852 25685 6282 1 9 . 1 1 52 52 THR C C 52 176.969 176.969 174.362 2.607 25685 6283 1 9 . 1 1 52 52 THR CA C 52 67.972 67.972 64.249 3.723 25685 6284 1 9 . 1 1 52 52 THR H H 52 8.456 8.456 6.290 2.166 25685 6285 1 9 . 1 1 53 53 ALA N N 53 122.122 122.122 120.148 1.974 25685 6286 1 9 . 1 1 53 53 ALA C C 53 179.907 179.907 176.962 2.945 25685 6287 1 9 . 1 1 53 53 ALA CA C 53 55.722 55.722 52.391 3.331 25685 6288 1 9 . 1 1 53 53 ALA CB C 53 18.786 18.786 18.931 -0.145 25685 6289 1 9 . 1 1 53 53 ALA H H 53 9.058 9.058 8.090 0.968 25685 6290 1 9 . 1 1 54 54 SER N N 54 115.434 115.434 114.752 0.682 25685 6291 1 9 . 1 1 54 54 SER C C 54 176.433 176.433 175.039 1.394 25685 6292 1 9 . 1 1 54 54 SER CA C 54 55.828 55.828 60.840 -5.012 25685 6293 1 9 . 1 1 54 54 SER H H 54 8.040 8.040 8.264 -0.224 25685 6294 1 9 . 1 1 55 55 LEU N N 55 123.045 123.045 121.548 1.497 25685 6295 1 9 . 1 1 55 55 LEU C C 55 178.789 178.789 176.222 2.567 25685 6296 1 9 . 1 1 55 55 LEU CA C 55 57.633 57.633 54.518 3.115 25685 6297 1 9 . 1 1 55 55 LEU CB C 55 41.293 41.293 42.071 -0.778 25685 6298 1 9 . 1 1 55 55 LEU H H 55 8.255 8.255 8.243 0.012 25685 6299 1 9 . 1 1 56 56 PHE N N 56 114.426 114.426 119.092 -4.666 25685 6300 1 9 . 1 1 56 56 PHE C C 56 177.507 177.507 174.498 3.009 25685 6301 1 9 . 1 1 56 56 PHE CA C 56 61.068 61.068 56.856 4.212 25685 6302 1 9 . 1 1 56 56 PHE CB C 56 40.107 40.107 38.902 1.205 25685 6303 1 9 . 1 1 56 56 PHE H H 56 7.590 7.590 7.200 0.390 25685 6304 1 9 . 1 1 57 57 PHE N N 57 114.701 114.701 115.125 -0.424 25685 6305 1 9 . 1 1 57 57 PHE C C 57 176.203 176.203 177.391 -1.188 25685 6306 1 9 . 1 1 57 57 PHE CA C 57 58.503 58.503 57.647 0.856 25685 6307 1 9 . 1 1 57 57 PHE CB C 57 41.114 41.114 36.648 4.465 25685 6308 1 9 . 1 1 57 57 PHE H H 57 8.514 8.514 7.482 1.032 25685 6309 1 9 . 1 1 58 58 GLY N N 58 111.041 111.041 107.873 3.168 25685 6310 1 9 . 1 1 58 58 GLY C C 58 174.240 174.240 175.744 -1.504 25685 6311 1 9 . 1 1 58 58 GLY CA C 58 44.827 44.827 46.834 -2.007 25685 6312 1 9 . 1 1 58 58 GLY H H 58 7.998 7.998 8.698 -0.701 25685 6313 1 9 . 1 1 59 59 PHE N N 59 127.950 127.950 119.975 7.975 25685 6314 1 9 . 1 1 59 59 PHE C C 59 176.612 176.612 177.208 -0.596 25685 6315 1 9 . 1 1 59 59 PHE CA C 59 61.598 61.598 59.429 2.169 25685 6316 1 9 . 1 1 59 59 PHE CB C 59 40.870 40.870 38.730 2.140 25685 6317 1 9 . 1 1 59 59 PHE H H 59 9.105 9.105 7.548 1.557 25685 6318 1 9 . 1 1 60 60 PHE N N 60 114.868 114.868 120.202 -5.334 25685 6319 1 9 . 1 1 60 60 PHE C C 60 177.989 177.989 177.089 0.900 25685 6320 1 9 . 1 1 60 60 PHE CA C 60 61.517 61.517 61.948 -0.431 25685 6321 1 9 . 1 1 60 60 PHE CB C 60 38.248 38.248 39.458 -1.210 25685 6322 1 9 . 1 1 60 60 PHE H H 60 8.796 8.796 8.238 0.558 25685 6323 1 9 . 1 1 61 61 ARG N N 61 118.812 118.812 118.418 0.394 25685 6324 1 9 . 1 1 61 61 ARG C C 61 177.813 177.813 178.564 -0.751 25685 6325 1 9 . 1 1 61 61 ARG CA C 61 60.497 60.497 58.559 1.938 25685 6326 1 9 . 1 1 61 61 ARG CB C 61 28.915 28.915 29.221 -0.305 25685 6327 1 9 . 1 1 61 61 ARG H H 61 7.600 7.600 7.987 -0.387 25685 6328 1 9 . 1 1 62 62 VAL N N 62 119.157 119.157 117.072 2.085 25685 6329 1 9 . 1 1 62 62 VAL C C 62 177.670 177.670 177.781 -0.111 25685 6330 1 9 . 1 1 62 62 VAL CA C 62 66.749 66.749 65.075 1.675 25685 6331 1 9 . 1 1 62 62 VAL CB C 62 30.306 30.306 31.905 -1.599 25685 6332 1 9 . 1 1 62 62 VAL H H 62 7.679 7.679 7.260 0.419 25685 6333 1 9 . 1 1 63 63 VAL N N 63 117.999 117.999 119.981 -1.982 25685 6334 1 9 . 1 1 63 63 VAL C C 63 177.639 177.639 178.332 -0.693 25685 6335 1 9 . 1 1 63 63 VAL CA C 63 66.836 66.836 65.759 1.077 25685 6336 1 9 . 1 1 63 63 VAL CB C 63 30.496 30.496 31.279 -0.783 25685 6337 1 9 . 1 1 63 63 VAL H H 63 7.429 7.429 8.067 -0.638 25685 6338 1 9 . 1 1 64 64 ALA N N 64 120.451 120.451 122.329 -1.878 25685 6339 1 9 . 1 1 64 64 ALA C C 64 179.134 179.134 179.212 -0.078 25685 6340 1 9 . 1 1 64 64 ALA CA C 64 55.618 55.618 54.815 0.803 25685 6341 1 9 . 1 1 64 64 ALA CB C 64 17.950 17.950 17.630 0.320 25685 6342 1 9 . 1 1 64 64 ALA H H 64 8.169 8.169 7.603 0.567 25685 6343 1 9 . 1 1 65 65 MET N N 65 116.532 116.532 117.751 -1.219 25685 6344 1 9 . 1 1 65 65 MET C C 65 177.961 177.961 178.121 -0.160 25685 6345 1 9 . 1 1 65 65 MET CA C 65 58.161 58.161 58.651 -0.490 25685 6346 1 9 . 1 1 65 65 MET CB C 65 31.208 31.208 32.669 -1.461 25685 6347 1 9 . 1 1 65 65 MET H H 65 7.857 7.857 7.392 0.465 25685 6348 1 9 . 1 1 66 66 LEU C C 66 179.022 179.022 178.879 0.143 25685 6349 1 9 . 1 1 66 66 LEU CA C 66 58.412 58.412 58.132 0.280 25685 6350 1 9 . 1 1 67 67 PHE N N 67 116.877 116.877 118.933 -2.056 25685 6351 1 9 . 1 1 67 67 PHE C C 67 177.908 177.908 176.517 1.391 25685 6352 1 9 . 1 1 67 67 PHE CA C 67 62.402 62.402 60.325 2.077 25685 6353 1 9 . 1 1 67 67 PHE CB C 67 39.203 39.203 38.409 0.794 25685 6354 1 9 . 1 1 67 67 PHE H H 67 7.923 7.923 7.430 0.493 25685 6355 1 9 . 1 1 68 68 LEU N N 68 118.860 118.860 116.936 1.924 25685 6356 1 9 . 1 1 68 68 LEU C C 68 179.032 179.032 178.480 0.552 25685 6357 1 9 . 1 1 68 68 LEU CA C 68 58.397 58.397 56.733 1.664 25685 6358 1 9 . 1 1 68 68 LEU CB C 68 40.803 40.803 41.023 -0.220 25685 6359 1 9 . 1 1 68 68 LEU H H 68 8.167 8.167 7.102 1.065 25685 6360 1 9 . 1 1 71 71 PHE N N 71 120.700 120.700 120.238 0.462 25685 6361 1 9 . 1 1 71 71 PHE C C 71 177.670 177.670 176.420 1.250 25685 6362 1 9 . 1 1 71 71 PHE CA C 71 60.528 60.528 60.526 0.002 25685 6363 1 9 . 1 1 71 71 PHE H H 71 7.847 7.847 7.453 0.394 25685 6364 1 9 . 1 1 72 72 ALA N N 72 120.506 120.506 122.436 -1.930 25685 6365 1 9 . 1 1 72 72 ALA C C 72 178.944 178.944 179.316 -0.372 25685 6366 1 9 . 1 1 72 72 ALA CA C 72 55.461 55.461 54.721 0.740 25685 6367 1 9 . 1 1 72 72 ALA CB C 72 17.829 17.829 17.870 -0.041 25685 6368 1 9 . 1 1 72 72 ALA H H 72 8.533 8.533 7.210 1.323 25685 6369 1 9 . 1 1 73 73 LEU N N 73 115.071 115.071 118.635 -3.564 25685 6370 1 9 . 1 1 73 73 LEU C C 73 180.831 180.831 178.794 2.037 25685 6371 1 9 . 1 1 73 73 LEU CA C 73 58.091 58.091 57.702 0.389 25685 6372 1 9 . 1 1 73 73 LEU CB C 73 41.082 41.082 41.579 -0.497 25685 6373 1 9 . 1 1 73 73 LEU H H 73 8.458 8.458 7.561 0.897 25685 6374 1 9 . 1 1 74 74 ILE N N 74 121.365 121.365 118.223 3.142 25685 6375 1 9 . 1 1 74 74 ILE C C 74 178.287 178.287 178.170 0.117 25685 6376 1 9 . 1 1 74 74 ILE CA C 74 65.335 65.335 63.681 1.654 25685 6377 1 9 . 1 1 74 74 ILE CB C 74 37.453 37.453 35.939 1.514 25685 6378 1 9 . 1 1 74 74 ILE H H 74 8.220 8.220 7.265 0.955 25685 6379 1 9 . 1 1 75 75 LEU N N 75 119.200 119.200 120.762 -1.562 25685 6380 1 9 . 1 1 75 75 LEU C C 75 177.548 177.548 177.748 -0.200 25685 6381 1 9 . 1 1 75 75 LEU CA C 75 56.938 56.938 57.292 -0.354 25685 6382 1 9 . 1 1 75 75 LEU CB C 75 41.541 41.541 41.315 0.226 25685 6383 1 9 . 1 1 75 75 LEU H H 75 7.866 7.866 7.189 0.677 25685 6384 1 9 . 1 1 76 76 LEU N N 76 116.338 116.338 116.940 -0.602 25685 6385 1 9 . 1 1 76 76 LEU C C 76 176.889 176.889 178.222 -1.333 25685 6386 1 9 . 1 1 76 76 LEU CA C 76 54.807 54.807 56.801 -1.994 25685 6387 1 9 . 1 1 76 76 LEU CB C 76 41.830 41.830 42.252 -0.422 25685 6388 1 9 . 1 1 76 76 LEU H H 76 7.432 7.432 7.546 -0.114 25685 6389 1 9 . 1 1 77 77 SER N N 77 114.630 114.630 113.236 1.394 25685 6390 1 9 . 1 1 77 77 SER C C 77 174.752 174.752 174.682 0.070 25685 6391 1 9 . 1 1 77 77 SER CA C 77 58.967 58.967 60.122 -1.155 25685 6392 1 9 . 1 1 77 77 SER CB C 77 64.686 64.686 63.639 1.047 25685 6393 1 9 . 1 1 77 77 SER H H 77 7.423 7.423 7.900 -0.477 25685 6394 1 9 . 1 1 78 78 ASP N N 78 123.054 123.054 120.474 2.580 25685 6395 1 9 . 1 1 78 78 ASP C C 78 176.716 176.716 174.516 2.200 25685 6396 1 9 . 1 1 78 78 ASP CA C 78 54.848 54.848 53.770 1.078 25685 6397 1 9 . 1 1 78 78 ASP CB C 78 40.423 40.423 41.818 -1.395 25685 6398 1 9 . 1 1 78 78 ASP H H 78 8.294 8.294 7.663 0.631 25685 6399 1 9 . 1 1 79 79 GLU N N 79 119.104 119.104 118.695 0.409 25685 6400 1 9 . 1 1 79 79 GLU C C 79 176.391 176.391 174.664 1.727 25685 6401 1 9 . 1 1 79 79 GLU CA C 79 56.258 56.258 57.437 -1.179 25685 6402 1 9 . 1 1 79 79 GLU CB C 79 29.656 29.656 29.702 -0.046 25685 6403 1 9 . 1 1 79 79 GLU H H 79 8.384 8.384 8.588 -0.204 25685 6404 1 9 . 1 1 80 80 LEU N N 80 121.254 121.254 126.319 -5.065 25685 6405 1 9 . 1 1 80 80 LEU C C 80 177.164 177.164 175.561 1.603 25685 6406 1 9 . 1 1 80 80 LEU CA C 80 54.670 54.670 54.627 0.043 25685 6407 1 9 . 1 1 80 80 LEU CB C 80 42.633 42.633 42.193 0.440 25685 6408 1 9 . 1 1 80 80 LEU H H 80 7.637 7.637 8.331 -0.694 25685 6409 1 9 . 1 1 81 81 ASP N N 81 123.410 123.410 122.467 0.943 25685 6410 1 9 . 1 1 81 81 ASP C C 81 177.552 177.552 175.832 1.720 25685 6411 1 9 . 1 1 81 81 ASP CA C 81 55.110 55.110 52.680 2.430 25685 6412 1 9 . 1 1 81 81 ASP CB C 81 42.693 42.693 43.695 -1.002 25685 6413 1 9 . 1 1 81 81 ASP H H 81 8.403 8.403 8.025 0.378 25685 6414 1 9 . 1 1 82 82 GLU N N 82 125.047 125.047 119.466 5.581 25685 6415 1 9 . 1 1 82 82 GLU C C 82 178.198 178.198 178.010 0.188 25685 6416 1 9 . 1 1 82 82 GLU CA C 82 59.221 59.221 58.167 1.054 25685 6417 1 9 . 1 1 82 82 GLU CB C 82 29.176 29.176 29.816 -0.639 25685 6418 1 9 . 1 1 82 82 GLU H H 82 8.744 8.744 8.487 0.257 25685 6419 1 9 . 1 1 83 83 LYS N N 83 118.476 118.476 120.592 -2.116 25685 6420 1 9 . 1 1 83 83 LYS C C 83 179.356 179.356 178.515 0.841 25685 6421 1 9 . 1 1 83 83 LYS CA C 83 59.170 59.170 58.796 0.374 25685 6422 1 9 . 1 1 83 83 LYS CB C 83 31.509 31.509 31.459 0.051 25685 6423 1 9 . 1 1 83 83 LYS H H 83 8.607 8.607 8.428 0.179 25685 6424 1 9 . 1 1 84 84 VAL N N 84 118.407 118.407 115.713 2.694 25685 6425 1 9 . 1 1 84 84 VAL C C 84 177.653 177.653 177.392 0.261 25685 6426 1 9 . 1 1 84 84 VAL CA C 84 65.416 65.416 65.908 -0.492 25685 6427 1 9 . 1 1 84 84 VAL CB C 84 31.313 31.313 30.897 0.416 25685 6428 1 9 . 1 1 84 84 VAL H H 84 7.870 7.870 7.886 -0.016 25685 6429 1 9 . 1 1 85 85 SER N N 85 116.146 116.146 117.399 -1.253 25685 6430 1 9 . 1 1 85 85 SER C C 85 177.496 177.496 177.066 0.430 25685 6431 1 9 . 1 1 85 85 SER CA C 85 61.764 61.764 61.501 0.263 25685 6432 1 9 . 1 1 85 85 SER CB C 85 63.654 63.654 62.644 1.010 25685 6433 1 9 . 1 1 85 85 SER H H 85 8.083 8.083 7.743 0.340 25685 6434 1 9 . 1 1 86 86 ILE N N 86 122.570 122.570 118.766 3.804 25685 6435 1 9 . 1 1 86 86 ILE C C 86 178.698 178.698 177.245 1.453 25685 6436 1 9 . 1 1 86 86 ILE CA C 86 64.526 64.526 63.983 0.543 25685 6437 1 9 . 1 1 86 86 ILE CB C 86 37.393 37.393 37.434 -0.041 25685 6438 1 9 . 1 1 86 86 ILE H H 86 8.102 8.102 7.201 0.901 25685 6439 1 9 . 1 1 87 87 PHE N N 87 121.340 121.340 121.669 -0.329 25685 6440 1 9 . 1 1 87 87 PHE C C 87 177.671 177.671 176.960 0.711 25685 6441 1 9 . 1 1 87 87 PHE CA C 87 61.098 61.098 61.044 0.054 25685 6442 1 9 . 1 1 87 87 PHE CB C 87 39.151 39.151 38.707 0.444 25685 6443 1 9 . 1 1 87 87 PHE H H 87 7.719 7.719 7.841 -0.122 25685 6444 1 9 . 1 1 88 88 ALA N N 88 120.921 120.921 121.650 -0.729 25685 6445 1 9 . 1 1 88 88 ALA C C 88 180.030 180.030 179.770 0.260 25685 6446 1 9 . 1 1 88 88 ALA CA C 88 55.147 55.147 54.755 0.392 25685 6447 1 9 . 1 1 88 88 ALA CB C 88 19.053 19.053 17.875 1.179 25685 6448 1 9 . 1 1 88 88 ALA H H 88 8.679 8.679 7.979 0.700 25685 6449 1 9 . 1 1 89 89 SER N N 89 114.285 114.285 115.251 -0.966 25685 6450 1 9 . 1 1 89 89 SER C C 89 177.040 177.040 176.370 0.670 25685 6451 1 9 . 1 1 89 89 SER CA C 89 61.314 61.314 61.283 0.031 25685 6452 1 9 . 1 1 89 89 SER CB C 89 63.371 63.371 62.723 0.648 25685 6453 1 9 . 1 1 89 89 SER H H 89 8.242 8.242 7.530 0.712 25685 6454 1 9 . 1 1 90 90 ARG N N 90 121.829 121.829 120.561 1.268 25685 6455 1 9 . 1 1 90 90 ARG C C 90 179.247 179.247 178.257 0.990 25685 6456 1 9 . 1 1 90 90 ARG CA C 90 58.444 58.444 58.199 0.245 25685 6457 1 9 . 1 1 90 90 ARG CB C 90 29.532 29.532 28.566 0.966 25685 6458 1 9 . 1 1 90 90 ARG H H 90 7.907 7.907 7.313 0.594 25685 6459 1 9 . 1 1 91 91 MET N N 91 117.124 117.124 117.119 0.005 25685 6460 1 9 . 1 1 91 91 MET C C 91 177.504 177.504 178.309 -0.805 25685 6461 1 9 . 1 1 91 91 MET CA C 91 57.152 57.152 60.019 -2.867 25685 6462 1 9 . 1 1 91 91 MET CB C 91 32.510 32.510 31.932 0.578 25685 6463 1 9 . 1 1 91 91 MET H H 91 7.930 7.930 7.929 0.001 25685 6464 1 9 . 1 1 92 92 THR N N 92 108.478 108.478 114.040 -5.562 25685 6465 1 9 . 1 1 92 92 THR C C 92 176.367 176.367 175.863 0.504 25685 6466 1 9 . 1 1 92 92 THR CA C 92 63.564 63.564 65.361 -1.797 25685 6467 1 9 . 1 1 92 92 THR H H 92 7.847 7.847 7.805 0.042 25685 6468 1 9 . 1 1 93 93 SER N N 93 117.950 117.950 115.041 2.909 25685 6469 1 9 . 1 1 93 93 SER C C 93 176.552 176.552 175.992 0.560 25685 6470 1 9 . 1 1 93 93 SER CA C 93 60.821 60.821 60.594 0.227 25685 6471 1 9 . 1 1 93 93 SER CB C 93 63.311 63.311 63.361 -0.050 25685 6472 1 9 . 1 1 93 93 SER H H 93 7.732 7.732 7.634 0.098 25685 6473 1 9 . 1 1 94 94 GLY N N 94 111.265 111.265 107.560 3.705 25685 6474 1 9 . 1 1 94 94 GLY C C 94 175.198 175.198 174.156 1.042 25685 6475 1 9 . 1 1 94 94 GLY CA C 94 46.021 46.021 44.782 1.239 25685 6476 1 9 . 1 1 94 94 GLY H H 94 8.419 8.419 7.904 0.515 25685 6477 1 9 . 1 1 95 95 LEU N N 95 121.019 121.019 118.569 2.450 25685 6478 1 9 . 1 1 95 95 LEU C C 95 177.810 177.810 175.619 2.191 25685 6479 1 9 . 1 1 95 95 LEU CA C 95 56.012 56.012 55.963 0.049 25685 6480 1 9 . 1 1 95 95 LEU CB C 95 42.122 42.122 42.087 0.036 25685 6481 1 9 . 1 1 95 95 LEU H H 95 7.849 7.849 8.051 -0.202 25685 6482 1 9 . 1 1 96 96 SER N N 96 115.465 115.465 112.438 3.027 25685 6483 1 9 . 1 1 96 96 SER C C 96 175.543 175.543 172.929 2.614 25685 6484 1 9 . 1 1 96 96 SER CA C 96 60.151 60.151 57.556 2.595 25685 6485 1 9 . 1 1 96 96 SER H H 96 8.349 8.349 7.968 0.381 25685 6486 1 9 . 1 1 97 97 TRP N N 97 121.711 121.711 122.932 -1.221 25685 6487 1 9 . 1 1 97 97 TRP C C 97 176.973 176.973 175.758 1.215 25685 6488 1 9 . 1 1 97 97 TRP CA C 97 58.250 58.250 58.106 0.144 25685 6489 1 9 . 1 1 97 97 TRP CB C 97 28.899 28.899 29.827 -0.928 25685 6490 1 9 . 1 1 97 97 TRP H H 97 7.723 7.723 8.483 -0.760 25685 6491 1 9 . 1 1 98 98 LYS N N 98 119.868 119.868 122.918 -3.050 25685 6492 1 9 . 1 1 98 98 LYS C C 98 178.021 178.021 175.520 2.501 25685 6493 1 9 . 1 1 98 98 LYS CA C 98 56.340 56.340 56.364 -0.023 25685 6494 1 9 . 1 1 98 98 LYS CB C 98 31.933 31.933 32.913 -0.980 25685 6495 1 9 . 1 1 98 98 LYS H H 98 7.855 7.855 8.400 -0.545 25685 6496 1 9 . 1 1 99 99 ILE N N 99 120.044 120.044 119.070 0.974 25685 6497 1 9 . 1 1 99 99 ILE C C 99 176.769 176.769 176.023 0.746 25685 6498 1 9 . 1 1 99 99 ILE CA C 99 62.758 62.758 61.541 1.217 25685 6499 1 9 . 1 1 99 99 ILE CB C 99 37.809 37.809 39.674 -1.865 25685 6500 1 9 . 1 1 99 99 ILE H H 99 8.069 8.069 8.126 -0.057 25685 6501 1 9 . 1 1 100 100 GLN C C 100 176.315 176.315 175.581 0.734 25685 6502 1 9 . 1 1 100 100 GLN CA C 100 57.486 57.486 55.399 2.087 25685 6503 1 9 . 1 1 101 101 THR N N 101 109.873 109.873 114.049 -4.176 25685 6504 1 9 . 1 1 101 101 THR C C 101 174.664 174.664 173.142 1.522 25685 6505 1 9 . 1 1 101 101 THR CA C 101 61.709 61.709 62.196 -0.487 25685 6506 1 9 . 1 1 101 101 THR CB C 101 69.290 69.290 69.595 -0.305 25685 6507 1 9 . 1 1 101 101 THR H H 101 7.508 7.508 7.632 -0.124 25685 6508 1 9 . 1 1 102 102 LEU N N 102 124.434 124.434 122.589 1.845 25685 6509 1 9 . 1 1 102 102 LEU C C 102 174.681 174.681 174.640 0.041 25685 6510 1 9 . 1 1 102 102 LEU CA C 102 53.063 53.063 51.153 1.910 25685 6511 1 9 . 1 1 102 102 LEU CB C 102 41.139 41.139 41.424 -0.285 25685 6512 1 9 . 1 1 102 102 LEU H H 102 7.569 7.569 7.840 -0.271 25685 6513 1 9 . 1 1 103 103 PRO C C 103 178.076 178.076 175.600 2.476 25685 6514 1 9 . 1 1 103 103 PRO CA C 103 62.570 62.570 63.633 -1.063 25685 6515 1 9 . 1 1 103 103 PRO CB C 103 31.534 31.534 32.188 -0.654 25685 6516 1 9 . 1 1 104 104 SER N N 104 119.929 119.929 114.788 5.141 25685 6517 1 9 . 1 1 104 104 SER C C 104 176.432 176.432 174.120 2.312 25685 6518 1 9 . 1 1 104 104 SER CA C 104 61.976 61.976 57.352 4.624 25685 6519 1 9 . 1 1 104 104 SER CB C 104 63.611 63.611 63.865 -0.254 25685 6520 1 9 . 1 1 104 104 SER H H 104 8.784 8.784 8.052 0.732 25685 6521 1 9 . 1 1 105 105 PHE N N 105 119.519 119.519 116.463 3.056 25685 6522 1 9 . 1 1 105 105 PHE C C 105 176.852 176.852 174.894 1.958 25685 6523 1 9 . 1 1 105 105 PHE CA C 105 60.162 60.162 57.028 3.135 25685 6524 1 9 . 1 1 105 105 PHE CB C 105 38.455 38.455 38.900 -0.445 25685 6525 1 9 . 1 1 105 105 PHE H H 105 8.620 8.620 7.316 1.304 25685 6526 1 9 . 1 1 106 106 PHE N N 106 118.809 118.809 115.547 3.262 25685 6527 1 9 . 1 1 106 106 PHE C C 106 176.741 176.741 174.493 2.248 25685 6528 1 9 . 1 1 106 106 PHE CA C 106 61.421 61.421 58.118 3.303 25685 6529 1 9 . 1 1 106 106 PHE CB C 106 38.788 38.788 38.023 0.765 25685 6530 1 9 . 1 1 106 106 PHE H H 106 7.519 7.519 7.759 -0.240 25685 6531 1 9 . 1 1 107 107 PHE N N 107 117.382 117.382 124.706 -7.324 25685 6532 1 9 . 1 1 107 107 PHE C C 107 177.771 177.771 176.909 0.862 25685 6533 1 9 . 1 1 107 107 PHE CA C 107 61.099 61.099 60.125 0.974 25685 6534 1 9 . 1 1 107 107 PHE CB C 107 38.677 38.677 40.308 -1.631 25685 6535 1 9 . 1 1 107 107 PHE H H 107 7.903 7.903 8.854 -0.952 25685 6536 1 9 . 1 1 108 108 GLY N N 108 105.340 105.340 108.048 -2.708 25685 6537 1 9 . 1 1 108 108 GLY C C 108 174.574 174.574 175.983 -1.409 25685 6538 1 9 . 1 1 108 108 GLY CA C 108 47.508 47.508 47.376 0.132 25685 6539 1 9 . 1 1 108 108 GLY H H 108 8.351 8.351 8.931 -0.580 25685 6540 1 9 . 1 1 109 109 MET N N 109 119.831 119.831 119.724 0.107 25685 6541 1 9 . 1 1 109 109 MET C C 109 177.522 177.522 177.286 0.236 25685 6542 1 9 . 1 1 109 109 MET CA C 109 58.658 58.658 58.119 0.539 25685 6543 1 9 . 1 1 109 109 MET CB C 109 32.106 32.106 31.729 0.377 25685 6544 1 9 . 1 1 109 109 MET H H 109 7.919 7.919 7.967 -0.048 25685 6545 1 9 . 1 1 110 110 LEU N N 110 119.908 119.908 117.166 2.742 25685 6546 1 9 . 1 1 110 110 LEU C C 110 178.170 178.170 178.820 -0.650 25685 6547 1 9 . 1 1 110 110 LEU CA C 110 57.941 57.941 57.461 0.480 25685 6548 1 9 . 1 1 110 110 LEU CB C 110 41.055 41.055 40.566 0.489 25685 6549 1 9 . 1 1 110 110 LEU H H 110 7.744 7.744 7.191 0.553 25685 6550 1 9 . 1 1 111 111 LEU N N 111 116.594 116.594 119.270 -2.676 25685 6551 1 9 . 1 1 111 111 LEU C C 111 178.960 178.960 178.922 0.038 25685 6552 1 9 . 1 1 111 111 LEU CA C 111 57.366 57.366 57.446 -0.080 25685 6553 1 9 . 1 1 111 111 LEU CB C 111 40.259 40.259 41.501 -1.242 25685 6554 1 9 . 1 1 111 111 LEU H H 111 7.732 7.732 7.162 0.570 25685 6555 1 9 . 1 1 112 112 ALA N N 112 121.020 121.020 121.713 -0.693 25685 6556 1 9 . 1 1 112 112 ALA C C 112 178.700 178.700 179.243 -0.543 25685 6557 1 9 . 1 1 112 112 ALA CA C 112 55.432 55.432 54.879 0.553 25685 6558 1 9 . 1 1 112 112 ALA CB C 112 18.214 18.214 18.205 0.009 25685 6559 1 9 . 1 1 112 112 ALA H H 112 8.121 8.121 7.219 0.902 25685 6560 1 9 . 1 1 113 113 PHE N N 113 118.369 118.369 115.291 3.078 25685 6561 1 9 . 1 1 113 113 PHE C C 113 176.091 176.091 177.470 -1.379 25685 6562 1 9 . 1 1 113 113 PHE CA C 113 61.388 61.388 58.386 3.002 25685 6563 1 9 . 1 1 113 113 PHE CB C 113 39.688 39.688 37.631 2.057 25685 6564 1 9 . 1 1 113 113 PHE H H 113 8.237 8.237 7.398 0.839 25685 6565 1 9 . 1 1 114 114 LEU N N 114 114.214 114.214 117.727 -3.513 25685 6566 1 9 . 1 1 114 114 LEU C C 114 177.038 177.038 178.874 -1.836 25685 6567 1 9 . 1 1 114 114 LEU CA C 114 56.358 56.358 57.573 -1.215 25685 6568 1 9 . 1 1 114 114 LEU CB C 114 42.716 42.716 40.914 1.802 25685 6569 1 9 . 1 1 114 114 LEU H H 114 7.576 7.576 7.604 -0.028 25685 6570 1 9 . 1 1 115 115 TRP N N 115 112.667 112.667 116.974 -4.307 25685 6571 1 9 . 1 1 115 115 TRP C C 115 180.163 180.163 177.409 2.754 25685 6572 1 9 . 1 1 115 115 TRP CA C 115 55.930 55.930 58.795 -2.865 25685 6573 1 9 . 1 1 115 115 TRP H H 115 8.542 8.542 7.400 1.142 25685 6574 1 9 . 1 1 116 116 LEU N N 116 122.144 122.144 120.452 1.692 25685 6575 1 9 . 1 1 116 116 LEU C C 116 175.953 175.953 177.148 -1.195 25685 6576 1 9 . 1 1 116 116 LEU CA C 116 59.924 59.924 58.045 1.879 25685 6577 1 9 . 1 1 116 116 LEU CB C 116 39.097 39.097 39.233 -0.136 25685 6578 1 9 . 1 1 116 116 LEU H H 116 8.996 8.996 7.314 1.682 25685 6579 1 9 . 1 1 117 117 PRO C C 117 174.220 174.220 177.622 -3.402 25685 6580 1 9 . 1 1 117 117 PRO CA C 117 66.300 66.300 64.319 1.981 25685 6581 1 9 . 1 1 118 118 ALA N N 118 110.603 110.603 120.833 -10.230 25685 6582 1 9 . 1 1 118 118 ALA C C 118 177.162 177.162 178.747 -1.585 25685 6583 1 9 . 1 1 118 118 ALA CA C 118 52.670 52.670 53.646 -0.976 25685 6584 1 9 . 1 1 118 118 ALA CB C 118 18.853 18.853 19.604 -0.751 25685 6585 1 9 . 1 1 118 118 ALA H H 118 6.633 6.633 7.512 -0.879 25685 6586 1 9 . 1 1 119 119 ILE N N 119 113.492 113.492 114.843 -1.351 25685 6587 1 9 . 1 1 119 119 ILE CA C 119 63.703 63.703 64.105 -0.402 25685 6588 1 9 . 1 1 119 119 ILE CB C 119 39.605 39.605 37.253 2.352 25685 6589 1 9 . 1 1 119 119 ILE H H 119 7.693 7.693 8.422 -0.729 25685 6590 1 9 . 1 1 121 121 PRO C C 121 178.089 178.089 179.096 -1.007 25685 6591 1 9 . 1 1 121 121 PRO CA C 121 66.004 66.004 65.843 0.161 25685 6592 1 9 . 1 1 122 122 PHE N N 122 113.797 113.797 119.723 -5.926 25685 6593 1 9 . 1 1 122 122 PHE C C 122 177.713 177.713 177.898 -0.185 25685 6594 1 9 . 1 1 122 122 PHE CA C 122 61.566 61.566 60.930 0.636 25685 6595 1 9 . 1 1 122 122 PHE CB C 122 38.983 38.983 38.761 0.223 25685 6596 1 9 . 1 1 122 122 PHE H H 122 6.846 6.846 8.176 -1.330 25685 6597 1 9 . 1 1 123 123 ALA N N 123 121.512 121.512 121.895 -0.383 25685 6598 1 9 . 1 1 123 123 ALA C C 123 179.318 179.318 179.703 -0.385 25685 6599 1 9 . 1 1 123 123 ALA CA C 123 54.975 54.975 54.993 -0.018 25685 6600 1 9 . 1 1 123 123 ALA CB C 123 17.881 17.881 18.184 -0.303 25685 6601 1 9 . 1 1 123 123 ALA H H 123 8.411 8.411 8.763 -0.352 25685 6602 1 9 . 1 1 124 124 GLY N N 124 104.093 104.093 107.138 -3.045 25685 6603 1 9 . 1 1 124 124 GLY C C 124 175.410 175.410 176.026 -0.616 25685 6604 1 9 . 1 1 124 124 GLY CA C 124 47.370 47.370 46.739 0.631 25685 6605 1 9 . 1 1 124 124 GLY H H 124 8.455 8.455 7.999 0.456 25685 6606 1 9 . 1 1 125 125 ILE N N 125 121.895 121.895 122.721 -0.826 25685 6607 1 9 . 1 1 125 125 ILE C C 125 178.329 178.329 176.929 1.400 25685 6608 1 9 . 1 1 125 125 ILE CA C 125 64.412 64.412 63.913 0.499 25685 6609 1 9 . 1 1 125 125 ILE H H 125 7.954 7.954 7.954 -0.000 25685 6610 1 9 . 1 1 126 126 ALA N N 126 122.768 122.768 121.677 1.091 25685 6611 1 9 . 1 1 126 126 ALA C C 126 180.341 180.341 179.192 1.149 25685 6612 1 9 . 1 1 126 126 ALA CA C 126 55.266 55.266 55.209 0.057 25685 6613 1 9 . 1 1 126 126 ALA CB C 126 18.226 18.226 17.578 0.648 25685 6614 1 9 . 1 1 126 126 ALA H H 126 8.142 8.142 7.184 0.958 25685 6615 1 9 . 1 1 127 127 ILE N N 127 116.752 116.752 115.070 1.682 25685 6616 1 9 . 1 1 127 127 ILE C C 127 177.993 177.993 177.822 0.171 25685 6617 1 9 . 1 1 127 127 ILE CA C 127 63.877 63.877 63.836 0.041 25685 6618 1 9 . 1 1 127 127 ILE CB C 127 37.657 37.657 37.342 0.315 25685 6619 1 9 . 1 1 127 127 ILE H H 127 8.335 8.335 7.304 1.031 25685 6620 1 9 . 1 1 128 128 SER N N 128 116.351 116.351 116.182 0.169 25685 6621 1 9 . 1 1 128 128 SER C C 128 175.796 175.796 176.662 -0.866 25685 6622 1 9 . 1 1 128 128 SER CA C 128 61.818 61.818 61.550 0.268 25685 6623 1 9 . 1 1 128 128 SER H H 128 7.939 7.939 7.635 0.304 25685 6624 1 9 . 1 1 129 129 GLN N N 129 118.082 118.082 121.240 -3.158 25685 6625 1 9 . 1 1 129 129 GLN C C 129 177.419 177.419 177.757 -0.338 25685 6626 1 9 . 1 1 129 129 GLN CA C 129 57.106 57.106 58.596 -1.490 25685 6627 1 9 . 1 1 129 129 GLN CB C 129 28.631 28.631 28.517 0.114 25685 6628 1 9 . 1 1 129 129 GLN H H 129 7.943 7.943 7.431 0.512 25685 6629 1 9 . 1 1 130 130 THR N N 130 113.484 113.484 113.433 0.051 25685 6630 1 9 . 1 1 130 130 THR C C 130 175.627 175.627 175.811 -0.184 25685 6631 1 9 . 1 1 130 130 THR CA C 130 63.758 63.758 65.342 -1.584 25685 6632 1 9 . 1 1 130 130 THR CB C 130 69.182 69.182 68.964 0.218 25685 6633 1 9 . 1 1 130 130 THR H H 130 7.686 7.686 7.543 0.143 25685 6634 1 9 . 1 1 131 131 LEU N N 131 121.347 121.347 120.682 0.665 25685 6635 1 9 . 1 1 131 131 LEU C C 131 177.522 177.522 177.324 0.198 25685 6636 1 9 . 1 1 131 131 LEU CA C 131 56.307 56.307 56.428 -0.122 25685 6637 1 9 . 1 1 131 131 LEU CB C 131 41.711 41.711 42.285 -0.574 25685 6638 1 9 . 1 1 131 131 LEU H H 131 8.071 8.071 7.366 0.705 25685 6639 1 9 . 1 1 132 132 LEU N N 132 118.162 118.162 118.366 -0.204 25685 6640 1 9 . 1 1 132 132 LEU C C 132 177.461 177.461 177.424 0.037 25685 6641 1 9 . 1 1 132 132 LEU CA C 132 55.264 55.264 55.545 -0.281 25685 6642 1 9 . 1 1 132 132 LEU CB C 132 41.613 41.613 41.463 0.150 25685 6643 1 9 . 1 1 132 132 LEU H H 132 7.810 7.810 7.903 -0.093 25685 6644 1 9 . 1 1 133 133 SER N N 133 114.244 114.244 114.754 -0.510 25685 6645 1 9 . 1 1 133 133 SER C C 133 174.363 174.363 174.097 0.266 25685 6646 1 9 . 1 1 133 133 SER CA C 133 59.019 59.019 58.519 0.500 25685 6647 1 9 . 1 1 133 133 SER CB C 133 64.634 64.634 63.955 0.680 25685 6648 1 9 . 1 1 133 133 SER H H 133 7.829 7.829 8.203 -0.374 25685 6649 1 9 . 1 1 134 134 GLU N N 134 120.151 120.151 119.432 0.719 25685 6650 1 9 . 1 1 134 134 GLU C C 134 175.935 175.935 175.916 0.019 25685 6651 1 9 . 1 1 134 134 GLU CA C 134 56.301 56.301 57.083 -0.782 25685 6652 1 9 . 1 1 134 134 GLU CB C 134 30.129 30.129 30.130 -0.001 25685 6653 1 9 . 1 1 134 134 GLU H H 134 8.054 8.054 8.506 -0.452 25685 6654 1 9 . 1 1 135 135 ASN N N 135 118.890 118.890 119.239 -0.349 25685 6655 1 9 . 1 1 135 135 ASN C C 135 174.272 174.272 173.491 0.781 25685 6656 1 9 . 1 1 135 135 ASN CA C 135 51.390 51.390 51.631 -0.241 25685 6657 1 9 . 1 1 135 135 ASN CB C 135 39.129 39.129 39.500 -0.371 25685 6658 1 9 . 1 1 135 135 ASN H H 135 8.305 8.305 8.326 -0.021 25685 6659 1 9 . 1 1 136 136 PRO C C 136 177.960 177.960 178.520 -0.560 25685 6660 1 9 . 1 1 136 136 PRO CA C 136 64.530 64.530 63.342 1.188 25685 6661 1 9 . 1 1 136 136 PRO CB C 136 31.809 31.809 32.255 -0.446 25685 6662 1 9 . 1 1 137 137 LEU N N 137 117.735 117.735 120.287 -2.552 25685 6663 1 9 . 1 1 137 137 LEU C C 137 179.217 179.217 179.228 -0.011 25685 6664 1 9 . 1 1 137 137 LEU CA C 137 57.039 57.039 58.223 -1.184 25685 6665 1 9 . 1 1 137 137 LEU CB C 137 40.799 40.799 41.084 -0.285 25685 6666 1 9 . 1 1 137 137 LEU H H 137 8.248 8.248 8.358 -0.110 25685 6667 1 9 . 1 1 138 138 VAL N N 138 119.589 119.589 119.956 -0.367 25685 6668 1 9 . 1 1 138 138 VAL C C 138 177.894 177.894 177.800 0.094 25685 6669 1 9 . 1 1 138 138 VAL CA C 138 64.727 64.727 66.683 -1.956 25685 6670 1 9 . 1 1 138 138 VAL CB C 138 31.347 31.347 31.623 -0.276 25685 6671 1 9 . 1 1 138 138 VAL H H 138 7.483 7.483 8.161 -0.678 25685 6672 1 9 . 1 1 139 139 MET N N 139 119.431 119.431 119.126 0.305 25685 6673 1 9 . 1 1 139 139 MET C C 139 177.988 177.988 178.449 -0.461 25685 6674 1 9 . 1 1 139 139 MET CA C 139 57.403 57.403 58.354 -0.951 25685 6675 1 9 . 1 1 139 139 MET CB C 139 31.709 31.709 32.276 -0.567 25685 6676 1 9 . 1 1 139 139 MET H H 139 7.837 7.837 8.109 -0.272 25685 6677 1 9 . 1 1 140 140 LEU N N 140 119.686 119.686 120.387 -0.701 25685 6678 1 9 . 1 1 140 140 LEU C C 140 177.916 177.916 179.014 -1.098 25685 6679 1 9 . 1 1 140 140 LEU CA C 140 56.877 56.877 58.361 -1.484 25685 6680 1 9 . 1 1 140 140 LEU CB C 140 41.491 41.491 40.791 0.700 25685 6681 1 9 . 1 1 140 140 LEU H H 140 7.926 7.926 8.451 -0.525 25685 6682 1 9 . 1 1 141 141 SER N N 141 114.167 114.167 115.059 -0.892 25685 6683 1 9 . 1 1 141 141 SER C C 141 176.030 176.030 176.870 -0.840 25685 6684 1 9 . 1 1 141 141 SER CA C 141 60.425 60.425 61.387 -0.962 25685 6685 1 9 . 1 1 141 141 SER CB C 141 63.956 63.956 63.040 0.916 25685 6686 1 9 . 1 1 141 141 SER H H 141 7.757 7.757 8.863 -1.106 25685 6687 1 9 . 1 1 142 142 TYR N N 142 121.679 121.679 122.739 -1.060 25685 6688 1 9 . 1 1 142 142 TYR C C 142 177.659 177.659 177.721 -0.062 25685 6689 1 9 . 1 1 142 142 TYR CA C 142 59.673 59.673 61.163 -1.490 25685 6690 1 9 . 1 1 142 142 TYR CB C 142 38.079 38.079 38.332 -0.253 25685 6691 1 9 . 1 1 142 142 TYR H H 142 7.965 7.965 8.669 -0.704 25685 6692 1 9 . 1 1 143 143 GLY N N 143 107.396 107.396 107.380 0.016 25685 6693 1 9 . 1 1 143 143 GLY C C 143 174.877 174.877 175.657 -0.780 25685 6694 1 9 . 1 1 143 143 GLY CA C 143 46.343 46.343 47.309 -0.966 25685 6695 1 9 . 1 1 143 143 GLY H H 143 8.177 8.177 8.626 -0.449 25685 6696 1 9 . 1 1 144 144 LEU N N 144 120.477 120.477 122.523 -2.046 25685 6697 1 9 . 1 1 144 144 LEU C C 144 178.504 178.504 178.866 -0.362 25685 6698 1 9 . 1 1 144 144 LEU CA C 144 56.270 56.270 57.379 -1.109 25685 6699 1 9 . 1 1 144 144 LEU CB C 144 41.662 41.662 41.818 -0.156 25685 6700 1 9 . 1 1 144 144 LEU H H 144 8.055 8.055 7.476 0.579 25685 6701 1 9 . 1 1 145 145 GLY N N 145 106.847 106.847 106.330 0.517 25685 6702 1 9 . 1 1 145 145 GLY C C 145 175.375 175.375 175.944 -0.569 25685 6703 1 9 . 1 1 145 145 GLY CA C 145 45.582 45.582 46.664 -1.082 25685 6704 1 9 . 1 1 145 145 GLY H H 145 8.066 8.066 7.515 0.551 25685 6705 1 9 . 1 1 146 146 MET N N 146 120.376 120.376 122.061 -1.685 25685 6706 1 9 . 1 1 146 146 MET C C 146 176.663 176.663 177.613 -0.950 25685 6707 1 9 . 1 1 146 146 MET CA C 146 57.030 57.030 58.631 -1.601 25685 6708 1 9 . 1 1 146 146 MET CB C 146 30.720 30.720 32.930 -2.210 25685 6709 1 9 . 1 1 146 146 MET H H 146 8.157 8.157 8.033 0.124 25685 6710 1 9 . 1 1 147 147 ALA N N 147 123.038 123.038 121.474 1.564 25685 6711 1 9 . 1 1 147 147 ALA C C 147 178.917 178.917 179.580 -0.663 25685 6712 1 9 . 1 1 147 147 ALA CA C 147 54.201 54.201 55.075 -0.874 25685 6713 1 9 . 1 1 147 147 ALA CB C 147 18.810 18.810 17.856 0.954 25685 6714 1 9 . 1 1 147 147 ALA H H 147 8.336 8.336 8.026 0.310 25685 6715 1 9 . 1 1 148 148 VAL N N 148 117.795 117.795 117.099 0.696 25685 6716 1 9 . 1 1 148 148 VAL C C 148 176.891 176.891 177.425 -0.534 25685 6717 1 9 . 1 1 148 148 VAL CA C 148 64.157 64.157 65.196 -1.039 25685 6718 1 9 . 1 1 148 148 VAL CB C 148 31.529 31.529 31.793 -0.264 25685 6719 1 9 . 1 1 148 148 VAL H H 148 7.908 7.908 7.685 0.223 25685 6720 1 9 . 1 1 149 149 THR N N 149 116.069 116.069 115.400 0.669 25685 6721 1 9 . 1 1 149 149 THR C C 149 176.054 176.054 176.528 -0.474 25685 6722 1 9 . 1 1 149 149 THR CA C 149 63.308 63.308 66.027 -2.719 25685 6723 1 9 . 1 1 149 149 THR H H 149 7.414 7.414 7.445 -0.031 25685 6724 1 9 . 1 1 150 150 ILE N N 150 121.971 121.971 121.614 0.357 25685 6725 1 9 . 1 1 150 150 ILE C C 150 177.715 177.715 177.495 0.220 25685 6726 1 9 . 1 1 150 150 ILE CA C 150 64.319 64.319 62.990 1.329 25685 6727 1 9 . 1 1 150 150 ILE CB C 150 36.628 36.628 36.051 0.577 25685 6728 1 9 . 1 1 150 150 ILE H H 150 8.772 8.772 7.939 0.833 25685 6729 1 9 . 1 1 151 151 ALA N N 151 122.272 122.272 122.167 0.105 25685 6730 1 9 . 1 1 151 151 ALA C C 151 180.370 180.370 179.446 0.924 25685 6731 1 9 . 1 1 151 151 ALA CA C 151 55.336 55.336 55.238 0.098 25685 6732 1 9 . 1 1 151 151 ALA CB C 151 18.107 18.107 17.807 0.300 25685 6733 1 9 . 1 1 151 151 ALA H H 151 8.163 8.163 7.956 0.207 25685 6734 1 9 . 1 1 152 152 ALA N N 152 120.648 120.648 121.196 -0.548 25685 6735 1 9 . 1 1 152 152 ALA C C 152 181.019 181.019 180.044 0.975 25685 6736 1 9 . 1 1 152 152 ALA CA C 152 54.944 54.944 54.683 0.261 25685 6737 1 9 . 1 1 152 152 ALA CB C 152 18.963 18.963 18.279 0.684 25685 6738 1 9 . 1 1 152 152 ALA H H 152 7.877 7.877 7.484 0.393 25685 6739 1 9 . 1 1 153 153 VAL N N 153 119.372 119.372 119.018 0.354 25685 6740 1 9 . 1 1 153 153 VAL C C 153 178.197 178.197 178.759 -0.562 25685 6741 1 9 . 1 1 153 153 VAL CA C 153 66.289 66.289 66.319 -0.030 25685 6742 1 9 . 1 1 153 153 VAL CB C 153 30.770 30.770 31.850 -1.080 25685 6743 1 9 . 1 1 153 153 VAL H H 153 8.118 8.118 7.890 0.228 25685 6744 1 9 . 1 1 154 154 PHE N N 154 120.362 120.362 119.373 0.989 25685 6745 1 9 . 1 1 154 154 PHE C C 154 177.733 177.733 177.948 -0.215 25685 6746 1 9 . 1 1 154 154 PHE CA C 154 61.412 61.412 60.595 0.817 25685 6747 1 9 . 1 1 154 154 PHE CB C 154 38.465 38.465 37.789 0.676 25685 6748 1 9 . 1 1 154 154 PHE H H 154 8.508 8.508 9.060 -0.552 25685 6749 1 9 . 1 1 155 155 LYS N N 155 118.894 118.894 119.511 -0.617 25685 6750 1 9 . 1 1 155 155 LYS C C 155 179.940 179.940 178.730 1.210 25685 6751 1 9 . 1 1 155 155 LYS CA C 155 58.969 58.969 59.030 -0.061 25685 6752 1 9 . 1 1 155 155 LYS CB C 155 31.725 31.725 32.151 -0.426 25685 6753 1 9 . 1 1 155 155 LYS H H 155 8.035 8.035 7.703 0.332 25685 6754 1 9 . 1 1 156 156 MET N N 156 118.853 118.853 117.740 1.113 25685 6755 1 9 . 1 1 156 156 MET C C 156 179.245 179.245 177.702 1.543 25685 6756 1 9 . 1 1 156 156 MET CA C 156 58.518 58.518 58.339 0.179 25685 6757 1 9 . 1 1 156 156 MET CB C 156 31.912 31.912 31.215 0.697 25685 6758 1 9 . 1 1 156 156 MET H H 156 8.014 8.014 7.911 0.103 25685 6759 1 9 . 1 1 157 157 GLY N N 157 108.239 108.239 106.823 1.416 25685 6760 1 9 . 1 1 157 157 GLY C C 157 174.637 174.637 174.911 -0.274 25685 6761 1 9 . 1 1 157 157 GLY CA C 157 47.204 47.204 46.250 0.954 25685 6762 1 9 . 1 1 157 157 GLY H H 157 8.614 8.614 7.866 0.748 25685 6763 1 9 . 1 1 158 158 GLU N N 158 122.902 122.902 119.002 3.900 25685 6764 1 9 . 1 1 158 158 GLU C C 158 177.851 177.851 175.253 2.598 25685 6765 1 9 . 1 1 158 158 GLU CA C 158 60.203 60.203 54.710 5.493 25685 6766 1 9 . 1 1 158 158 GLU CB C 158 28.870 28.870 29.298 -0.428 25685 6767 1 9 . 1 1 158 158 GLU H H 158 8.550 8.550 7.632 0.918 25685 6768 1 9 . 1 1 159 159 LYS N N 159 117.932 117.932 117.861 0.071 25685 6769 1 9 . 1 1 159 159 LYS C C 159 179.529 179.529 176.344 3.185 25685 6770 1 9 . 1 1 159 159 LYS CA C 159 59.419 59.419 57.326 2.093 25685 6771 1 9 . 1 1 159 159 LYS CB C 159 31.759 31.759 31.085 0.674 25685 6772 1 9 . 1 1 159 159 LYS H H 159 7.641 7.641 8.030 -0.389 25685 6773 1 9 . 1 1 160 160 PHE N N 160 120.614 120.614 123.011 -2.397 25685 6774 1 9 . 1 1 160 160 PHE C C 160 178.511 178.511 177.924 0.587 25685 6775 1 9 . 1 1 160 160 PHE CA C 160 61.580 61.580 60.842 0.739 25685 6776 1 9 . 1 1 160 160 PHE CB C 160 39.909 39.909 39.217 0.692 25685 6777 1 9 . 1 1 160 160 PHE H H 160 8.026 8.026 8.311 -0.285 25685 6778 1 9 . 1 1 161 161 VAL N N 161 119.870 119.870 115.760 4.110 25685 6779 1 9 . 1 1 161 161 VAL C C 161 177.347 177.347 175.426 1.921 25685 6780 1 9 . 1 1 161 161 VAL CA C 161 66.121 66.121 63.880 2.241 25685 6781 1 9 . 1 1 161 161 VAL CB C 161 30.935 30.935 32.288 -1.353 25685 6782 1 9 . 1 1 161 161 VAL H H 161 8.628 8.628 7.953 0.675 25685 6783 1 9 . 1 1 162 162 LYS N N 162 116.237 116.237 119.923 -3.686 25685 6784 1 9 . 1 1 162 162 LYS C C 162 179.197 179.197 174.367 4.830 25685 6785 1 9 . 1 1 162 162 LYS CA C 162 60.037 60.037 56.971 3.066 25685 6786 1 9 . 1 1 162 162 LYS CB C 162 31.333 31.333 33.533 -2.200 25685 6787 1 9 . 1 1 162 162 LYS H H 162 7.843 7.843 7.994 -0.151 25685 6788 1 9 . 1 1 163 163 ALA N N 163 119.197 119.197 121.675 -2.478 25685 6789 1 9 . 1 1 163 163 ALA C C 163 178.635 178.635 175.272 3.363 25685 6790 1 9 . 1 1 163 163 ALA CA C 163 53.681 53.681 52.015 1.666 25685 6791 1 9 . 1 1 163 163 ALA CB C 163 19.586 19.586 18.795 0.791 25685 6792 1 9 . 1 1 163 163 ALA H H 163 7.630 7.630 8.052 -0.422 25685 6793 1 9 . 1 1 164 164 ASN N N 164 115.956 115.956 118.025 -2.069 25685 6794 1 9 . 1 1 164 164 ASN C C 164 175.556 175.556 176.670 -1.114 25685 6795 1 9 . 1 1 164 164 ASN CA C 164 52.267 52.267 53.455 -1.188 25685 6796 1 9 . 1 1 164 164 ASN CB C 164 39.148 39.148 38.790 0.358 25685 6797 1 9 . 1 1 164 164 ASN H H 164 7.326 7.326 8.060 -0.734 25685 6798 1 9 . 1 1 165 165 PHE N N 165 121.612 121.612 120.184 1.428 25685 6799 1 9 . 1 1 165 165 PHE C C 165 177.069 177.069 177.119 -0.050 25685 6800 1 9 . 1 1 165 165 PHE CA C 165 62.921 62.921 60.823 2.098 25685 6801 1 9 . 1 1 165 165 PHE CB C 165 39.427 39.427 38.720 0.707 25685 6802 1 9 . 1 1 165 165 PHE H H 165 7.408 7.408 8.728 -1.320 25685 6803 1 9 . 1 1 166 166 GLN N N 166 117.147 117.147 118.200 -1.053 25685 6804 1 9 . 1 1 166 166 GLN C C 166 178.922 178.922 178.040 0.882 25685 6805 1 9 . 1 1 166 166 GLN CA C 166 59.262 59.262 58.446 0.816 25685 6806 1 9 . 1 1 166 166 GLN CB C 166 26.811 26.811 27.732 -0.921 25685 6807 1 9 . 1 1 166 166 GLN H H 166 8.605 8.605 7.308 1.297 25685 6808 1 9 . 1 1 167 167 LEU N N 167 121.946 121.946 118.015 3.931 25685 6809 1 9 . 1 1 167 167 LEU C C 167 178.863 178.863 178.762 0.101 25685 6810 1 9 . 1 1 167 167 LEU CA C 167 58.039 58.039 57.719 0.320 25685 6811 1 9 . 1 1 167 167 LEU CB C 167 41.130 41.130 41.557 -0.427 25685 6812 1 9 . 1 1 167 167 LEU H H 167 7.892 7.892 7.488 0.404 25685 6813 1 9 . 1 1 168 168 ILE N N 168 118.751 118.751 115.895 2.856 25685 6814 1 9 . 1 1 168 168 ILE C C 168 179.908 179.908 177.940 1.968 25685 6815 1 9 . 1 1 168 168 ILE CA C 168 63.886 63.886 64.244 -0.358 25685 6816 1 9 . 1 1 168 168 ILE CB C 168 36.170 36.170 37.671 -1.501 25685 6817 1 9 . 1 1 168 168 ILE H H 168 8.065 8.065 7.217 0.848 25685 6818 1 9 . 1 1 169 169 ARG N N 169 125.851 125.851 119.713 6.138 25685 6819 1 9 . 1 1 169 169 ARG C C 169 177.579 177.579 178.303 -0.724 25685 6820 1 9 . 1 1 169 169 ARG CA C 169 60.306 60.306 59.601 0.705 25685 6821 1 9 . 1 1 169 169 ARG CB C 169 29.224 29.224 29.774 -0.550 25685 6822 1 9 . 1 1 169 169 ARG H H 169 8.995 8.995 8.054 0.941 25685 6823 1 9 . 1 1 170 170 LYS N N 170 119.586 119.586 118.691 0.895 25685 6824 1 9 . 1 1 170 170 LYS C C 170 178.584 178.584 178.391 0.193 25685 6825 1 9 . 1 1 170 170 LYS CA C 170 60.293 60.293 59.228 1.065 25685 6826 1 9 . 1 1 170 170 LYS CB C 170 32.530 32.530 31.444 1.086 25685 6827 1 9 . 1 1 170 170 LYS H H 170 7.663 7.663 7.526 0.137 25685 6828 1 9 . 1 1 171 171 VAL N N 171 118.348 118.348 119.273 -0.925 25685 6829 1 9 . 1 1 171 171 VAL C C 171 177.478 177.478 178.069 -0.591 25685 6830 1 9 . 1 1 171 171 VAL CA C 171 66.641 66.641 66.433 0.208 25685 6831 1 9 . 1 1 171 171 VAL CB C 171 31.565 31.565 30.813 0.752 25685 6832 1 9 . 1 1 171 171 VAL H H 171 8.515 8.515 7.657 0.858 25685 6833 1 9 . 1 1 172 172 THR N N 172 115.172 115.172 115.652 -0.480 25685 6834 1 9 . 1 1 172 172 THR C C 172 176.320 176.320 176.282 0.038 25685 6835 1 9 . 1 1 172 172 THR H H 172 8.416 8.416 7.669 0.747 25685 6836 1 9 . 1 1 173 173 GLY N N 173 108.801 108.801 108.114 0.687 25685 6837 1 9 . 1 1 173 173 GLY C C 173 174.138 174.138 175.193 -1.055 25685 6838 1 9 . 1 1 173 173 GLY CA C 173 47.769 47.769 46.930 0.839 25685 6839 1 9 . 1 1 173 173 GLY H H 173 8.505 8.505 7.659 0.846 25685 6840 1 9 . 1 1 174 174 ALA N N 174 123.573 123.573 124.130 -0.557 25685 6841 1 9 . 1 1 174 174 ALA C C 174 178.782 178.782 178.825 -0.043 25685 6842 1 9 . 1 1 174 174 ALA CA C 174 55.604 55.604 54.893 0.711 25685 6843 1 9 . 1 1 174 174 ALA CB C 174 18.778 18.778 18.668 0.110 25685 6844 1 9 . 1 1 174 174 ALA H H 174 8.038 8.038 7.654 0.384 25685 6845 1 9 . 1 1 175 175 ILE N N 175 118.501 118.501 119.290 -0.789 25685 6846 1 9 . 1 1 175 175 ILE C C 175 178.247 178.247 177.890 0.357 25685 6847 1 9 . 1 1 175 175 ILE CA C 175 65.412 65.412 64.245 1.167 25685 6848 1 9 . 1 1 175 175 ILE CB C 175 37.671 37.671 38.127 -0.456 25685 6849 1 9 . 1 1 175 175 ILE H H 175 7.897 7.897 7.545 0.352 25685 6850 1 9 . 1 1 176 176 VAL N N 176 120.104 120.104 119.669 0.435 25685 6851 1 9 . 1 1 176 176 VAL C C 176 177.945 177.945 177.993 -0.048 25685 6852 1 9 . 1 1 176 176 VAL CA C 176 67.761 67.761 66.242 1.519 25685 6853 1 9 . 1 1 176 176 VAL CB C 176 30.662 30.662 31.884 -1.222 25685 6854 1 9 . 1 1 176 176 VAL H H 176 8.321 8.321 7.559 0.762 25685 6855 1 9 . 1 1 177 177 LEU N N 177 118.561 118.561 120.681 -2.120 25685 6856 1 9 . 1 1 177 177 LEU C C 177 178.563 178.563 178.701 -0.138 25685 6857 1 9 . 1 1 177 177 LEU CA C 177 58.094 58.094 57.460 0.634 25685 6858 1 9 . 1 1 177 177 LEU CB C 177 41.061 41.061 40.916 0.145 25685 6859 1 9 . 1 1 177 177 LEU H H 177 8.097 8.097 7.527 0.570 25685 6860 1 9 . 1 1 178 178 LEU N N 178 120.868 120.868 119.610 1.258 25685 6861 1 9 . 1 1 178 178 LEU C C 178 178.524 178.524 178.186 0.338 25685 6862 1 9 . 1 1 178 178 LEU CA C 178 57.767 57.767 58.405 -0.638 25685 6863 1 9 . 1 1 178 178 LEU CB C 178 40.886 40.886 41.390 -0.504 25685 6864 1 9 . 1 1 178 178 LEU H H 178 8.229 8.229 7.352 0.877 25685 6865 1 9 . 1 1 179 179 TYR N N 179 119.355 119.355 118.389 0.966 25685 6866 1 9 . 1 1 179 179 TYR C C 179 180.059 180.059 177.281 2.778 25685 6867 1 9 . 1 1 179 179 TYR CA C 179 63.844 63.844 61.086 2.758 25685 6868 1 9 . 1 1 179 179 TYR CB C 179 39.508 39.508 38.075 1.433 25685 6869 1 9 . 1 1 179 179 TYR H H 179 8.759 8.759 7.853 0.906 25685 6870 1 9 . 1 1 180 180 LEU N N 180 118.984 118.984 119.096 -0.112 25685 6871 1 9 . 1 1 180 180 LEU C C 180 179.079 179.079 179.277 -0.198 25685 6872 1 9 . 1 1 180 180 LEU CA C 180 58.879 58.879 57.566 1.313 25685 6873 1 9 . 1 1 180 180 LEU CB C 180 41.899 41.899 40.623 1.276 25685 6874 1 9 . 1 1 180 180 LEU H H 180 8.315 8.315 7.614 0.701 25685 6875 1 9 . 1 1 181 181 ALA N N 181 121.826 121.826 122.062 -0.236 25685 6876 1 9 . 1 1 181 181 ALA C C 181 180.009 180.009 178.987 1.022 25685 6877 1 9 . 1 1 181 181 ALA CA C 181 55.700 55.700 54.981 0.719 25685 6878 1 9 . 1 1 181 181 ALA CB C 181 17.713 17.713 18.675 -0.962 25685 6879 1 9 . 1 1 181 181 ALA H H 181 8.480 8.480 8.282 0.198 25685 6880 1 9 . 1 1 182 182 TYR N N 182 118.039 118.039 117.756 0.283 25685 6881 1 9 . 1 1 182 182 TYR CA C 182 59.038 59.038 60.525 -1.487 25685 6882 1 9 . 1 1 182 182 TYR H H 182 8.856 8.856 8.292 0.564 25685 6883 1 9 . 1 1 183 183 PHE N N 183 124.769 124.769 117.110 7.659 25685 6884 1 9 . 1 1 183 183 PHE CA C 183 63.566 63.566 59.646 3.920 25685 6885 1 9 . 1 1 183 183 PHE H H 183 9.764 9.764 7.595 2.169 25685 6886 1 10 . 1 1 4 4 ALA N N 4 121.533 121.533 121.478 0.055 25685 6887 1 10 . 1 1 4 4 ALA C C 4 177.632 177.632 178.692 -1.060 25685 6888 1 10 . 1 1 4 4 ALA CA C 4 55.117 55.117 55.309 -0.192 25685 6889 1 10 . 1 1 4 4 ALA CB C 4 18.448 18.448 18.724 -0.276 25685 6890 1 10 . 1 1 4 4 ALA H H 4 7.977 7.977 8.527 -0.550 25685 6891 1 10 . 1 1 5 5 PHE N N 5 119.988 119.988 119.216 0.772 25685 6892 1 10 . 1 1 5 5 PHE CA C 5 60.759 60.759 61.269 -0.510 25685 6893 1 10 . 1 1 5 5 PHE CB C 5 39.221 39.221 38.673 0.548 25685 6894 1 10 . 1 1 5 5 PHE H H 5 8.210 8.210 7.941 0.269 25685 6895 1 10 . 1 1 6 6 ALA C C 6 179.794 179.794 179.412 0.382 25685 6896 1 10 . 1 1 6 6 ALA CA C 6 55.619 55.619 54.847 0.772 25685 6897 1 10 . 1 1 6 6 ALA CB C 6 17.911 17.911 17.719 0.192 25685 6898 1 10 . 1 1 6 6 ALA H H 6 8.417 8.417 8.303 0.114 25685 6899 1 10 . 1 1 7 7 LEU N N 7 115.852 115.852 119.105 -3.253 25685 6900 1 10 . 1 1 7 7 LEU C C 7 180.196 180.196 178.817 1.379 25685 6901 1 10 . 1 1 7 7 LEU CA C 7 57.528 57.528 57.545 -0.017 25685 6902 1 10 . 1 1 7 7 LEU CB C 7 40.060 40.060 41.849 -1.790 25685 6903 1 10 . 1 1 7 7 LEU H H 7 8.741 8.741 7.918 0.823 25685 6904 1 10 . 1 1 8 8 GLY N N 8 110.199 110.199 107.186 3.013 25685 6905 1 10 . 1 1 8 8 GLY C C 8 176.430 176.430 176.362 0.068 25685 6906 1 10 . 1 1 8 8 GLY CA C 8 46.960 46.960 47.500 -0.540 25685 6907 1 10 . 1 1 8 8 GLY H H 8 8.179 8.179 7.910 0.269 25685 6908 1 10 . 1 1 9 9 ILE N N 9 122.346 122.346 121.554 0.792 25685 6909 1 10 . 1 1 9 9 ILE C C 9 178.143 178.143 177.826 0.317 25685 6910 1 10 . 1 1 9 9 ILE CA C 9 65.048 65.048 62.937 2.111 25685 6911 1 10 . 1 1 9 9 ILE CB C 9 36.841 36.841 36.749 0.092 25685 6912 1 10 . 1 1 9 9 ILE H H 9 7.788 7.788 7.368 0.420 25685 6913 1 10 . 1 1 10 10 LEU N N 10 117.560 117.560 118.146 -0.586 25685 6914 1 10 . 1 1 10 10 LEU C C 10 179.501 179.501 178.652 0.849 25685 6915 1 10 . 1 1 10 10 LEU CA C 10 58.068 58.068 57.962 0.106 25685 6916 1 10 . 1 1 10 10 LEU CB C 10 40.776 40.776 40.973 -0.197 25685 6917 1 10 . 1 1 10 10 LEU H H 10 8.044 8.044 7.512 0.532 25685 6918 1 10 . 1 1 11 11 SER N N 11 113.830 113.830 113.308 0.522 25685 6919 1 10 . 1 1 11 11 SER CA C 11 61.769 61.769 61.249 0.520 25685 6920 1 10 . 1 1 11 11 SER CB C 11 63.395 63.395 62.625 0.770 25685 6921 1 10 . 1 1 11 11 SER H H 11 8.140 8.140 7.457 0.683 25685 6922 1 10 . 1 1 12 12 VAL N N 12 121.343 121.343 121.178 0.165 25685 6923 1 10 . 1 1 12 12 VAL C C 12 176.753 176.753 178.454 -1.701 25685 6924 1 10 . 1 1 12 12 VAL CA C 12 64.583 64.583 65.128 -0.545 25685 6925 1 10 . 1 1 12 12 VAL CB C 12 31.067 31.067 31.517 -0.450 25685 6926 1 10 . 1 1 12 12 VAL H H 12 7.587 7.587 7.361 0.226 25685 6927 1 10 . 1 1 13 13 PHE N N 13 115.225 115.225 119.782 -4.557 25685 6928 1 10 . 1 1 13 13 PHE C C 13 177.349 177.349 175.517 1.832 25685 6929 1 10 . 1 1 13 13 PHE CA C 13 58.730 58.730 60.061 -1.331 25685 6930 1 10 . 1 1 13 13 PHE CB C 13 39.785 39.785 39.001 0.784 25685 6931 1 10 . 1 1 13 13 PHE H H 13 7.474 7.474 7.466 0.008 25685 6932 1 10 . 1 1 14 14 SER N N 14 116.075 116.075 114.385 1.690 25685 6933 1 10 . 1 1 14 14 SER H H 14 7.955 7.955 8.007 -0.052 25685 6934 1 10 . 1 1 15 15 PRO C C 15 177.590 177.590 176.752 0.838 25685 6935 1 10 . 1 1 15 15 PRO CA C 15 65.464 65.464 63.333 2.131 25685 6936 1 10 . 1 1 16 16 ALA N N 16 116.288 116.288 119.504 -3.216 25685 6937 1 10 . 1 1 16 16 ALA C C 16 177.563 177.563 178.668 -1.105 25685 6938 1 10 . 1 1 16 16 ALA CA C 16 53.010 53.010 52.910 0.100 25685 6939 1 10 . 1 1 16 16 ALA CB C 16 19.975 19.975 17.978 1.997 25685 6940 1 10 . 1 1 16 16 ALA H H 16 7.455 7.455 7.770 -0.315 25685 6941 1 10 . 1 1 17 17 VAL N N 17 112.072 112.072 120.409 -8.337 25685 6942 1 10 . 1 1 17 17 VAL CA C 17 63.117 63.117 65.402 -2.285 25685 6943 1 10 . 1 1 17 17 VAL CB C 17 33.209 33.209 31.614 1.595 25685 6944 1 10 . 1 1 17 17 VAL H H 17 7.525 7.525 8.658 -1.133 25685 6945 1 10 . 1 1 18 18 LEU N N 18 121.205 121.205 112.864 8.341 25685 6946 1 10 . 1 1 18 18 LEU CA C 18 58.971 58.971 55.856 3.115 25685 6947 1 10 . 1 1 18 18 LEU CB C 18 41.161 41.161 40.749 0.412 25685 6948 1 10 . 1 1 18 18 LEU H H 18 8.191 8.191 7.965 0.226 25685 6949 1 10 . 1 1 19 19 PRO C C 19 177.697 177.697 176.404 1.293 25685 6950 1 10 . 1 1 19 19 PRO CA C 19 65.181 65.181 62.962 2.219 25685 6951 1 10 . 1 1 20 20 VAL N N 20 111.723 111.723 113.566 -1.843 25685 6952 1 10 . 1 1 20 20 VAL C C 20 177.137 177.137 175.443 1.694 25685 6953 1 10 . 1 1 20 20 VAL CA C 20 62.494 62.494 63.201 -0.707 25685 6954 1 10 . 1 1 20 20 VAL CB C 20 31.677 31.677 30.729 0.948 25685 6955 1 10 . 1 1 20 20 VAL H H 20 7.571 7.571 7.713 -0.142 25685 6956 1 10 . 1 1 21 21 VAL N N 21 121.705 121.705 118.750 2.955 25685 6957 1 10 . 1 1 21 21 VAL CA C 21 68.305 68.305 64.713 3.592 25685 6958 1 10 . 1 1 21 21 VAL H H 21 7.732 7.732 8.108 -0.376 25685 6959 1 10 . 1 1 24 24 ILE C C 24 174.359 174.359 175.628 -1.269 25685 6960 1 10 . 1 1 25 25 PHE N N 25 120.132 120.132 124.328 -4.196 25685 6961 1 10 . 1 1 25 25 PHE C C 25 175.945 175.945 176.203 -0.258 25685 6962 1 10 . 1 1 25 25 PHE CA C 25 60.544 60.544 59.250 1.294 25685 6963 1 10 . 1 1 25 25 PHE H H 25 8.082 8.082 8.862 -0.780 25685 6964 1 10 . 1 1 26 26 ALA N N 26 121.341 121.341 120.014 1.327 25685 6965 1 10 . 1 1 26 26 ALA CB C 26 19.784 19.784 19.439 0.345 25685 6966 1 10 . 1 1 26 26 ALA H H 26 7.539 7.539 7.587 -0.048 25685 6967 1 10 . 1 1 27 27 GLY N N 27 107.530 107.530 105.472 2.058 25685 6968 1 10 . 1 1 27 27 GLY C C 27 174.252 174.252 172.370 1.882 25685 6969 1 10 . 1 1 27 27 GLY CA C 27 45.474 45.474 44.319 1.155 25685 6970 1 10 . 1 1 27 27 GLY H H 27 7.997 7.997 8.284 -0.287 25685 6971 1 10 . 1 1 28 28 SER N N 28 116.299 116.299 113.822 2.477 25685 6972 1 10 . 1 1 28 28 SER C C 28 175.759 175.759 173.253 2.506 25685 6973 1 10 . 1 1 28 28 SER CA C 28 58.526 58.526 58.362 0.164 25685 6974 1 10 . 1 1 28 28 SER CB C 28 64.373 64.373 63.778 0.595 25685 6975 1 10 . 1 1 28 28 SER H H 28 8.115 8.115 8.573 -0.458 25685 6976 1 10 . 1 1 34 34 ASP C C 34 177.621 177.621 178.432 -0.811 25685 6977 1 10 . 1 1 34 34 ASP CA C 34 57.082 57.082 57.438 -0.356 25685 6978 1 10 . 1 1 35 35 ALA N N 35 120.662 120.662 121.950 -1.288 25685 6979 1 10 . 1 1 35 35 ALA C C 35 179.168 179.168 179.458 -0.290 25685 6980 1 10 . 1 1 35 35 ALA CA C 35 55.459 55.459 54.467 0.992 25685 6981 1 10 . 1 1 35 35 ALA CB C 35 18.819 18.819 18.161 0.658 25685 6982 1 10 . 1 1 35 35 ALA H H 35 8.090 8.090 7.273 0.817 25685 6983 1 10 . 1 1 36 36 PHE N N 36 117.638 117.638 119.428 -1.790 25685 6984 1 10 . 1 1 36 36 PHE C C 36 177.057 177.057 177.505 -0.448 25685 6985 1 10 . 1 1 36 36 PHE CA C 36 61.472 61.472 61.509 -0.037 25685 6986 1 10 . 1 1 36 36 PHE CB C 36 38.860 38.860 39.130 -0.270 25685 6987 1 10 . 1 1 36 36 PHE H H 36 8.227 8.227 8.061 0.166 25685 6988 1 10 . 1 1 37 37 LEU N N 37 119.312 119.312 119.967 -0.655 25685 6989 1 10 . 1 1 37 37 LEU C C 37 179.798 179.798 178.487 1.311 25685 6990 1 10 . 1 1 37 37 LEU CA C 37 58.181 58.181 58.442 -0.261 25685 6991 1 10 . 1 1 37 37 LEU CB C 37 40.835 40.835 41.845 -1.010 25685 6992 1 10 . 1 1 37 37 LEU H H 37 8.588 8.588 7.771 0.817 25685 6993 1 10 . 1 1 38 38 ILE N N 38 119.057 119.057 118.773 0.284 25685 6994 1 10 . 1 1 38 38 ILE C C 38 177.597 177.597 177.630 -0.033 25685 6995 1 10 . 1 1 38 38 ILE CA C 38 64.827 64.827 64.932 -0.105 25685 6996 1 10 . 1 1 38 38 ILE CB C 38 36.321 36.321 37.554 -1.233 25685 6997 1 10 . 1 1 38 38 ILE H H 38 7.932 7.932 7.283 0.649 25685 6998 1 10 . 1 1 39 39 VAL N N 39 118.758 118.758 115.998 2.760 25685 6999 1 10 . 1 1 39 39 VAL C C 39 179.533 179.533 177.596 1.937 25685 7000 1 10 . 1 1 39 39 VAL CA C 39 66.687 66.687 65.837 0.850 25685 7001 1 10 . 1 1 39 39 VAL CB C 39 30.598 30.598 31.039 -0.441 25685 7002 1 10 . 1 1 39 39 VAL H H 39 7.922 7.922 7.192 0.730 25685 7003 1 10 . 1 1 40 40 ALA N N 40 125.385 125.385 121.947 3.438 25685 7004 1 10 . 1 1 40 40 ALA C C 40 179.200 179.200 179.459 -0.259 25685 7005 1 10 . 1 1 40 40 ALA CA C 40 55.283 55.283 54.792 0.491 25685 7006 1 10 . 1 1 40 40 ALA CB C 40 17.197 17.197 18.702 -1.505 25685 7007 1 10 . 1 1 40 40 ALA H H 40 9.091 9.091 7.371 1.720 25685 7008 1 10 . 1 1 41 41 GLY N N 41 106.978 106.978 106.472 0.506 25685 7009 1 10 . 1 1 41 41 GLY C C 41 176.171 176.171 176.105 0.066 25685 7010 1 10 . 1 1 41 41 GLY CA C 41 47.322 47.322 46.976 0.346 25685 7011 1 10 . 1 1 41 41 GLY H H 41 8.565 8.565 7.967 0.598 25685 7012 1 10 . 1 1 42 42 LEU N N 42 126.914 126.914 120.010 6.904 25685 7013 1 10 . 1 1 42 42 LEU C C 42 178.119 178.119 178.328 -0.209 25685 7014 1 10 . 1 1 42 42 LEU CA C 42 58.523 58.523 57.843 0.680 25685 7015 1 10 . 1 1 42 42 LEU CB C 42 42.125 42.125 41.632 0.493 25685 7016 1 10 . 1 1 42 42 LEU H H 42 8.573 8.573 7.512 1.061 25685 7017 1 10 . 1 1 46 46 MET N N 46 121.710 121.710 121.353 0.357 25685 7018 1 10 . 1 1 46 46 MET C C 46 179.540 179.540 178.511 1.029 25685 7019 1 10 . 1 1 46 46 MET CA C 46 55.968 55.968 56.919 -0.951 25685 7020 1 10 . 1 1 46 46 MET H H 46 8.589 8.589 7.722 0.867 25685 7021 1 10 . 1 1 47 47 LEU N N 47 117.448 117.448 121.241 -3.793 25685 7022 1 10 . 1 1 47 47 LEU HA H 47 3.992 3.992 4.234 -0.242 25685 7023 1 10 . 1 1 47 47 LEU C C 47 179.082 179.082 178.838 0.244 25685 7024 1 10 . 1 1 47 47 LEU CA C 47 58.157 58.157 58.244 -0.087 25685 7025 1 10 . 1 1 47 47 LEU CB C 47 41.858 41.858 41.872 -0.014 25685 7026 1 10 . 1 1 47 47 LEU H H 47 8.769 8.769 8.331 0.438 25685 7027 1 10 . 1 1 48 48 ILE N N 48 117.500 117.500 117.247 0.253 25685 7028 1 10 . 1 1 48 48 ILE C C 48 180.298 180.298 178.138 2.160 25685 7029 1 10 . 1 1 48 48 ILE CA C 48 65.627 65.627 63.513 2.114 25685 7030 1 10 . 1 1 48 48 ILE CB C 48 37.839 37.839 37.192 0.647 25685 7031 1 10 . 1 1 48 48 ILE H H 48 8.093 8.093 7.570 0.523 25685 7032 1 10 . 1 1 49 49 LEU N N 49 123.708 123.708 120.300 3.408 25685 7033 1 10 . 1 1 49 49 LEU C C 49 179.721 179.721 178.300 1.421 25685 7034 1 10 . 1 1 49 49 LEU CA C 49 58.788 58.788 57.706 1.082 25685 7035 1 10 . 1 1 49 49 LEU CB C 49 40.761 40.761 41.176 -0.415 25685 7036 1 10 . 1 1 49 49 LEU H H 49 8.833 8.833 7.731 1.102 25685 7037 1 10 . 1 1 50 50 GLY N N 50 109.284 109.284 107.186 2.098 25685 7038 1 10 . 1 1 50 50 GLY C C 50 176.937 176.937 174.885 2.052 25685 7039 1 10 . 1 1 50 50 GLY CA C 50 47.821 47.821 47.529 0.292 25685 7040 1 10 . 1 1 50 50 GLY H H 50 9.658 9.658 7.973 1.685 25685 7041 1 10 . 1 1 51 51 TYR N N 51 125.640 125.640 117.617 8.023 25685 7042 1 10 . 1 1 51 51 TYR C C 51 177.102 177.102 174.755 2.347 25685 7043 1 10 . 1 1 51 51 TYR CA C 51 61.948 61.948 58.358 3.590 25685 7044 1 10 . 1 1 51 51 TYR CB C 51 38.871 38.871 39.139 -0.269 25685 7045 1 10 . 1 1 51 51 TYR H H 51 8.795 8.795 7.523 1.272 25685 7046 1 10 . 1 1 52 52 THR N N 52 116.273 116.273 116.033 0.240 25685 7047 1 10 . 1 1 52 52 THR C C 52 176.969 176.969 173.992 2.977 25685 7048 1 10 . 1 1 52 52 THR CA C 52 67.972 67.972 63.506 4.466 25685 7049 1 10 . 1 1 52 52 THR H H 52 8.456 8.456 8.244 0.212 25685 7050 1 10 . 1 1 53 53 ALA N N 53 122.122 122.122 127.147 -5.025 25685 7051 1 10 . 1 1 53 53 ALA C C 53 179.907 179.907 177.464 2.443 25685 7052 1 10 . 1 1 53 53 ALA CA C 53 55.722 55.722 52.863 2.859 25685 7053 1 10 . 1 1 53 53 ALA CB C 53 18.786 18.786 19.355 -0.569 25685 7054 1 10 . 1 1 53 53 ALA H H 53 9.058 9.058 8.315 0.743 25685 7055 1 10 . 1 1 54 54 SER N N 54 115.434 115.434 116.134 -0.700 25685 7056 1 10 . 1 1 54 54 SER C C 54 176.433 176.433 174.466 1.967 25685 7057 1 10 . 1 1 54 54 SER CA C 54 55.828 55.828 60.364 -4.536 25685 7058 1 10 . 1 1 54 54 SER H H 54 8.040 8.040 8.455 -0.415 25685 7059 1 10 . 1 1 55 55 LEU N N 55 123.045 123.045 121.277 1.768 25685 7060 1 10 . 1 1 55 55 LEU C C 55 178.789 178.789 175.633 3.156 25685 7061 1 10 . 1 1 55 55 LEU CA C 55 57.633 57.633 54.790 2.843 25685 7062 1 10 . 1 1 55 55 LEU CB C 55 41.293 41.293 42.975 -1.682 25685 7063 1 10 . 1 1 55 55 LEU H H 55 8.255 8.255 8.320 -0.065 25685 7064 1 10 . 1 1 56 56 PHE N N 56 114.426 114.426 120.474 -6.048 25685 7065 1 10 . 1 1 56 56 PHE C C 56 177.507 177.507 175.380 2.127 25685 7066 1 10 . 1 1 56 56 PHE CA C 56 61.068 61.068 57.692 3.376 25685 7067 1 10 . 1 1 56 56 PHE CB C 56 40.107 40.107 39.710 0.397 25685 7068 1 10 . 1 1 56 56 PHE H H 56 7.590 7.590 8.281 -0.691 25685 7069 1 10 . 1 1 57 57 PHE N N 57 114.701 114.701 119.178 -4.477 25685 7070 1 10 . 1 1 57 57 PHE C C 57 176.203 176.203 175.737 0.466 25685 7071 1 10 . 1 1 57 57 PHE CA C 57 58.503 58.503 57.918 0.585 25685 7072 1 10 . 1 1 57 57 PHE CB C 57 41.114 41.114 38.960 2.154 25685 7073 1 10 . 1 1 57 57 PHE H H 57 8.514 8.514 8.094 0.420 25685 7074 1 10 . 1 1 58 58 GLY N N 58 111.041 111.041 108.860 2.181 25685 7075 1 10 . 1 1 58 58 GLY C C 58 174.240 174.240 175.684 -1.444 25685 7076 1 10 . 1 1 58 58 GLY CA C 58 44.827 44.827 46.712 -1.885 25685 7077 1 10 . 1 1 58 58 GLY H H 58 7.998 7.998 8.497 -0.499 25685 7078 1 10 . 1 1 59 59 PHE N N 59 127.950 127.950 121.262 6.688 25685 7079 1 10 . 1 1 59 59 PHE C C 59 176.612 176.612 177.243 -0.631 25685 7080 1 10 . 1 1 59 59 PHE CA C 59 61.598 61.598 59.430 2.168 25685 7081 1 10 . 1 1 59 59 PHE CB C 59 40.870 40.870 38.582 2.288 25685 7082 1 10 . 1 1 59 59 PHE H H 59 9.105 9.105 7.926 1.179 25685 7083 1 10 . 1 1 60 60 PHE N N 60 114.868 114.868 120.042 -5.174 25685 7084 1 10 . 1 1 60 60 PHE C C 60 177.989 177.989 176.935 1.054 25685 7085 1 10 . 1 1 60 60 PHE CA C 60 61.517 61.517 61.907 -0.390 25685 7086 1 10 . 1 1 60 60 PHE CB C 60 38.248 38.248 39.451 -1.203 25685 7087 1 10 . 1 1 60 60 PHE H H 60 8.796 8.796 8.647 0.149 25685 7088 1 10 . 1 1 61 61 ARG N N 61 118.812 118.812 118.456 0.356 25685 7089 1 10 . 1 1 61 61 ARG C C 61 177.813 177.813 178.481 -0.668 25685 7090 1 10 . 1 1 61 61 ARG CA C 61 60.497 60.497 59.367 1.131 25685 7091 1 10 . 1 1 61 61 ARG CB C 61 28.915 28.915 29.901 -0.986 25685 7092 1 10 . 1 1 61 61 ARG H H 61 7.600 7.600 7.821 -0.221 25685 7093 1 10 . 1 1 62 62 VAL N N 62 119.157 119.157 117.529 1.628 25685 7094 1 10 . 1 1 62 62 VAL C C 62 177.670 177.670 177.933 -0.263 25685 7095 1 10 . 1 1 62 62 VAL CA C 62 66.749 66.749 64.806 1.943 25685 7096 1 10 . 1 1 62 62 VAL CB C 62 30.306 30.306 31.435 -1.129 25685 7097 1 10 . 1 1 62 62 VAL H H 62 7.679 7.679 7.541 0.138 25685 7098 1 10 . 1 1 63 63 VAL N N 63 117.999 117.999 120.332 -2.333 25685 7099 1 10 . 1 1 63 63 VAL C C 63 177.639 177.639 178.279 -0.640 25685 7100 1 10 . 1 1 63 63 VAL CA C 63 66.836 66.836 66.280 0.556 25685 7101 1 10 . 1 1 63 63 VAL CB C 63 30.496 30.496 30.720 -0.224 25685 7102 1 10 . 1 1 63 63 VAL H H 63 7.429 7.429 7.847 -0.418 25685 7103 1 10 . 1 1 64 64 ALA N N 64 120.451 120.451 122.310 -1.859 25685 7104 1 10 . 1 1 64 64 ALA C C 64 179.134 179.134 179.324 -0.190 25685 7105 1 10 . 1 1 64 64 ALA CA C 64 55.618 55.618 54.946 0.672 25685 7106 1 10 . 1 1 64 64 ALA CB C 64 17.950 17.950 17.751 0.199 25685 7107 1 10 . 1 1 64 64 ALA H H 64 8.169 8.169 7.520 0.649 25685 7108 1 10 . 1 1 65 65 MET N N 65 116.532 116.532 117.031 -0.499 25685 7109 1 10 . 1 1 65 65 MET C C 65 177.961 177.961 177.736 0.225 25685 7110 1 10 . 1 1 65 65 MET CA C 65 58.161 58.161 58.253 -0.092 25685 7111 1 10 . 1 1 65 65 MET CB C 65 31.208 31.208 32.229 -1.021 25685 7112 1 10 . 1 1 65 65 MET H H 65 7.857 7.857 7.461 0.396 25685 7113 1 10 . 1 1 66 66 LEU C C 66 179.022 179.022 179.311 -0.289 25685 7114 1 10 . 1 1 66 66 LEU CA C 66 58.412 58.412 56.904 1.508 25685 7115 1 10 . 1 1 67 67 PHE N N 67 116.877 116.877 119.218 -2.341 25685 7116 1 10 . 1 1 67 67 PHE C C 67 177.908 177.908 177.455 0.453 25685 7117 1 10 . 1 1 67 67 PHE CA C 67 62.402 62.402 61.198 1.204 25685 7118 1 10 . 1 1 67 67 PHE CB C 67 39.203 39.203 38.891 0.312 25685 7119 1 10 . 1 1 67 67 PHE H H 67 7.923 7.923 7.669 0.254 25685 7120 1 10 . 1 1 68 68 LEU N N 68 118.860 118.860 120.072 -1.212 25685 7121 1 10 . 1 1 68 68 LEU C C 68 179.032 179.032 178.148 0.884 25685 7122 1 10 . 1 1 68 68 LEU CA C 68 58.397 58.397 57.359 1.038 25685 7123 1 10 . 1 1 68 68 LEU CB C 68 40.803 40.803 41.706 -0.903 25685 7124 1 10 . 1 1 68 68 LEU H H 68 8.167 8.167 7.506 0.661 25685 7125 1 10 . 1 1 71 71 PHE N N 71 120.700 120.700 118.058 2.642 25685 7126 1 10 . 1 1 71 71 PHE C C 71 177.670 177.670 177.208 0.462 25685 7127 1 10 . 1 1 71 71 PHE CA C 71 60.528 60.528 60.978 -0.450 25685 7128 1 10 . 1 1 71 71 PHE H H 71 7.847 7.847 7.271 0.576 25685 7129 1 10 . 1 1 72 72 ALA N N 72 120.506 120.506 121.925 -1.419 25685 7130 1 10 . 1 1 72 72 ALA C C 72 178.944 178.944 179.279 -0.335 25685 7131 1 10 . 1 1 72 72 ALA CA C 72 55.461 55.461 54.758 0.703 25685 7132 1 10 . 1 1 72 72 ALA CB C 72 17.829 17.829 18.428 -0.599 25685 7133 1 10 . 1 1 72 72 ALA H H 72 8.533 8.533 7.495 1.038 25685 7134 1 10 . 1 1 73 73 LEU N N 73 115.071 115.071 118.202 -3.131 25685 7135 1 10 . 1 1 73 73 LEU C C 73 180.831 180.831 178.344 2.487 25685 7136 1 10 . 1 1 73 73 LEU CA C 73 58.091 58.091 57.901 0.190 25685 7137 1 10 . 1 1 73 73 LEU CB C 73 41.082 41.082 41.303 -0.221 25685 7138 1 10 . 1 1 73 73 LEU H H 73 8.458 8.458 8.290 0.168 25685 7139 1 10 . 1 1 74 74 ILE N N 74 121.365 121.365 119.485 1.880 25685 7140 1 10 . 1 1 74 74 ILE C C 74 178.287 178.287 177.173 1.114 25685 7141 1 10 . 1 1 74 74 ILE CA C 74 65.335 65.335 64.590 0.745 25685 7142 1 10 . 1 1 74 74 ILE CB C 74 37.453 37.453 37.703 -0.250 25685 7143 1 10 . 1 1 74 74 ILE H H 74 8.220 8.220 7.386 0.834 25685 7144 1 10 . 1 1 75 75 LEU N N 75 119.200 119.200 120.861 -1.661 25685 7145 1 10 . 1 1 75 75 LEU C C 75 177.548 177.548 178.225 -0.677 25685 7146 1 10 . 1 1 75 75 LEU CA C 75 56.938 56.938 57.595 -0.657 25685 7147 1 10 . 1 1 75 75 LEU CB C 75 41.541 41.541 41.621 -0.080 25685 7148 1 10 . 1 1 75 75 LEU H H 75 7.866 7.866 7.543 0.323 25685 7149 1 10 . 1 1 76 76 LEU N N 76 116.338 116.338 118.415 -2.077 25685 7150 1 10 . 1 1 76 76 LEU C C 76 176.889 176.889 178.815 -1.926 25685 7151 1 10 . 1 1 76 76 LEU CA C 76 54.807 54.807 57.602 -2.795 25685 7152 1 10 . 1 1 76 76 LEU CB C 76 41.830 41.830 42.253 -0.423 25685 7153 1 10 . 1 1 76 76 LEU H H 76 7.432 7.432 7.743 -0.311 25685 7154 1 10 . 1 1 77 77 SER N N 77 114.630 114.630 113.396 1.234 25685 7155 1 10 . 1 1 77 77 SER C C 77 174.752 174.752 174.809 -0.057 25685 7156 1 10 . 1 1 77 77 SER CA C 77 58.967 58.967 60.642 -1.675 25685 7157 1 10 . 1 1 77 77 SER CB C 77 64.686 64.686 63.729 0.957 25685 7158 1 10 . 1 1 77 77 SER H H 77 7.423 7.423 8.233 -0.810 25685 7159 1 10 . 1 1 78 78 ASP N N 78 123.054 123.054 118.344 4.710 25685 7160 1 10 . 1 1 78 78 ASP C C 78 176.716 176.716 174.586 2.130 25685 7161 1 10 . 1 1 78 78 ASP CA C 78 54.848 54.848 52.748 2.100 25685 7162 1 10 . 1 1 78 78 ASP CB C 78 40.423 40.423 42.052 -1.629 25685 7163 1 10 . 1 1 78 78 ASP H H 78 8.294 8.294 7.762 0.532 25685 7164 1 10 . 1 1 79 79 GLU N N 79 119.104 119.104 117.546 1.558 25685 7165 1 10 . 1 1 79 79 GLU C C 79 176.391 176.391 175.443 0.948 25685 7166 1 10 . 1 1 79 79 GLU CA C 79 56.258 56.258 56.690 -0.432 25685 7167 1 10 . 1 1 79 79 GLU CB C 79 29.656 29.656 28.985 0.671 25685 7168 1 10 . 1 1 79 79 GLU H H 79 8.384 8.384 8.392 -0.008 25685 7169 1 10 . 1 1 80 80 LEU N N 80 121.254 121.254 124.974 -3.720 25685 7170 1 10 . 1 1 80 80 LEU C C 80 177.164 177.164 176.280 0.884 25685 7171 1 10 . 1 1 80 80 LEU CA C 80 54.670 54.670 56.403 -1.733 25685 7172 1 10 . 1 1 80 80 LEU CB C 80 42.633 42.633 41.996 0.637 25685 7173 1 10 . 1 1 80 80 LEU H H 80 7.637 7.637 8.106 -0.469 25685 7174 1 10 . 1 1 81 81 ASP N N 81 123.410 123.410 113.229 10.181 25685 7175 1 10 . 1 1 81 81 ASP C C 81 177.552 177.552 175.732 1.820 25685 7176 1 10 . 1 1 81 81 ASP CA C 81 55.110 55.110 54.425 0.685 25685 7177 1 10 . 1 1 81 81 ASP CB C 81 42.693 42.693 40.394 2.299 25685 7178 1 10 . 1 1 81 81 ASP H H 81 8.403 8.403 8.243 0.160 25685 7179 1 10 . 1 1 82 82 GLU N N 82 125.047 125.047 120.089 4.958 25685 7180 1 10 . 1 1 82 82 GLU C C 82 178.198 178.198 178.007 0.191 25685 7181 1 10 . 1 1 82 82 GLU CA C 82 59.221 59.221 55.839 3.382 25685 7182 1 10 . 1 1 82 82 GLU CB C 82 29.176 29.176 30.301 -1.125 25685 7183 1 10 . 1 1 82 82 GLU H H 82 8.744 8.744 8.400 0.344 25685 7184 1 10 . 1 1 83 83 LYS N N 83 118.476 118.476 117.146 1.330 25685 7185 1 10 . 1 1 83 83 LYS C C 83 179.356 179.356 178.198 1.158 25685 7186 1 10 . 1 1 83 83 LYS CA C 83 59.170 59.170 58.492 0.678 25685 7187 1 10 . 1 1 83 83 LYS CB C 83 31.509 31.509 30.767 0.742 25685 7188 1 10 . 1 1 83 83 LYS H H 83 8.607 8.607 8.756 -0.149 25685 7189 1 10 . 1 1 84 84 VAL N N 84 118.407 118.407 116.805 1.602 25685 7190 1 10 . 1 1 84 84 VAL C C 84 177.653 177.653 177.129 0.524 25685 7191 1 10 . 1 1 84 84 VAL CA C 84 65.416 65.416 66.676 -1.260 25685 7192 1 10 . 1 1 84 84 VAL CB C 84 31.313 31.313 31.790 -0.477 25685 7193 1 10 . 1 1 84 84 VAL H H 84 7.870 7.870 8.194 -0.324 25685 7194 1 10 . 1 1 85 85 SER N N 85 116.146 116.146 115.529 0.617 25685 7195 1 10 . 1 1 85 85 SER C C 85 177.496 177.496 176.810 0.686 25685 7196 1 10 . 1 1 85 85 SER CA C 85 61.764 61.764 61.435 0.329 25685 7197 1 10 . 1 1 85 85 SER CB C 85 63.654 63.654 63.127 0.527 25685 7198 1 10 . 1 1 85 85 SER H H 85 8.083 8.083 8.200 -0.117 25685 7199 1 10 . 1 1 86 86 ILE N N 86 122.570 122.570 120.591 1.979 25685 7200 1 10 . 1 1 86 86 ILE C C 86 178.698 178.698 178.307 0.391 25685 7201 1 10 . 1 1 86 86 ILE CA C 86 64.526 64.526 62.597 1.929 25685 7202 1 10 . 1 1 86 86 ILE CB C 86 37.393 37.393 36.814 0.579 25685 7203 1 10 . 1 1 86 86 ILE H H 86 8.102 8.102 8.056 0.046 25685 7204 1 10 . 1 1 87 87 PHE N N 87 121.340 121.340 120.786 0.554 25685 7205 1 10 . 1 1 87 87 PHE C C 87 177.671 177.671 176.407 1.264 25685 7206 1 10 . 1 1 87 87 PHE CA C 87 61.098 61.098 61.700 -0.602 25685 7207 1 10 . 1 1 87 87 PHE CB C 87 39.151 39.151 38.623 0.528 25685 7208 1 10 . 1 1 87 87 PHE H H 87 7.719 7.719 8.610 -0.891 25685 7209 1 10 . 1 1 88 88 ALA N N 88 120.921 120.921 120.066 0.855 25685 7210 1 10 . 1 1 88 88 ALA C C 88 180.030 180.030 179.057 0.973 25685 7211 1 10 . 1 1 88 88 ALA CA C 88 55.147 55.147 54.529 0.618 25685 7212 1 10 . 1 1 88 88 ALA CB C 88 19.053 19.053 17.868 1.185 25685 7213 1 10 . 1 1 88 88 ALA H H 88 8.679 8.679 7.633 1.046 25685 7214 1 10 . 1 1 89 89 SER N N 89 114.285 114.285 114.219 0.066 25685 7215 1 10 . 1 1 89 89 SER C C 89 177.040 177.040 176.013 1.027 25685 7216 1 10 . 1 1 89 89 SER CA C 89 61.314 61.314 60.943 0.371 25685 7217 1 10 . 1 1 89 89 SER CB C 89 63.371 63.371 62.713 0.658 25685 7218 1 10 . 1 1 89 89 SER H H 89 8.242 8.242 7.913 0.329 25685 7219 1 10 . 1 1 90 90 ARG N N 90 121.829 121.829 120.847 0.982 25685 7220 1 10 . 1 1 90 90 ARG C C 90 179.247 179.247 177.589 1.658 25685 7221 1 10 . 1 1 90 90 ARG CA C 90 58.444 58.444 58.040 0.404 25685 7222 1 10 . 1 1 90 90 ARG CB C 90 29.532 29.532 29.059 0.473 25685 7223 1 10 . 1 1 90 90 ARG H H 90 7.907 7.907 7.291 0.616 25685 7224 1 10 . 1 1 91 91 MET N N 91 117.124 117.124 117.627 -0.503 25685 7225 1 10 . 1 1 91 91 MET C C 91 177.504 177.504 177.707 -0.203 25685 7226 1 10 . 1 1 91 91 MET CA C 91 57.152 57.152 58.957 -1.805 25685 7227 1 10 . 1 1 91 91 MET CB C 91 32.510 32.510 31.068 1.442 25685 7228 1 10 . 1 1 91 91 MET H H 91 7.930 7.930 7.303 0.627 25685 7229 1 10 . 1 1 92 92 THR N N 92 108.478 108.478 113.775 -5.297 25685 7230 1 10 . 1 1 92 92 THR C C 92 176.367 176.367 175.911 0.456 25685 7231 1 10 . 1 1 92 92 THR CA C 92 63.564 63.564 65.387 -1.823 25685 7232 1 10 . 1 1 92 92 THR H H 92 7.847 7.847 7.541 0.306 25685 7233 1 10 . 1 1 93 93 SER N N 93 117.950 117.950 115.804 2.146 25685 7234 1 10 . 1 1 93 93 SER C C 93 176.552 176.552 176.067 0.485 25685 7235 1 10 . 1 1 93 93 SER CA C 93 60.821 60.821 61.619 -0.798 25685 7236 1 10 . 1 1 93 93 SER CB C 93 63.311 63.311 63.480 -0.169 25685 7237 1 10 . 1 1 93 93 SER H H 93 7.732 7.732 7.482 0.250 25685 7238 1 10 . 1 1 94 94 GLY N N 94 111.265 111.265 107.186 4.079 25685 7239 1 10 . 1 1 94 94 GLY C C 94 175.198 175.198 175.313 -0.115 25685 7240 1 10 . 1 1 94 94 GLY CA C 94 46.021 46.021 44.786 1.235 25685 7241 1 10 . 1 1 94 94 GLY H H 94 8.419 8.419 7.812 0.607 25685 7242 1 10 . 1 1 95 95 LEU N N 95 121.019 121.019 119.041 1.978 25685 7243 1 10 . 1 1 95 95 LEU C C 95 177.810 177.810 175.307 2.503 25685 7244 1 10 . 1 1 95 95 LEU CA C 95 56.012 56.012 55.569 0.443 25685 7245 1 10 . 1 1 95 95 LEU CB C 95 42.122 42.122 41.510 0.612 25685 7246 1 10 . 1 1 95 95 LEU H H 95 7.849 7.849 7.436 0.413 25685 7247 1 10 . 1 1 96 96 SER N N 96 115.465 115.465 117.544 -2.079 25685 7248 1 10 . 1 1 96 96 SER C C 96 175.543 175.543 173.693 1.850 25685 7249 1 10 . 1 1 96 96 SER CA C 96 60.151 60.151 57.149 3.002 25685 7250 1 10 . 1 1 96 96 SER H H 96 8.349 8.349 8.088 0.261 25685 7251 1 10 . 1 1 97 97 TRP N N 97 121.711 121.711 122.026 -0.315 25685 7252 1 10 . 1 1 97 97 TRP C C 97 176.973 176.973 176.134 0.839 25685 7253 1 10 . 1 1 97 97 TRP CA C 97 58.250 58.250 58.648 -0.398 25685 7254 1 10 . 1 1 97 97 TRP CB C 97 28.899 28.899 30.038 -1.139 25685 7255 1 10 . 1 1 97 97 TRP H H 97 7.723 7.723 8.249 -0.526 25685 7256 1 10 . 1 1 98 98 LYS N N 98 119.868 119.868 120.356 -0.488 25685 7257 1 10 . 1 1 98 98 LYS C C 98 178.021 178.021 176.194 1.827 25685 7258 1 10 . 1 1 98 98 LYS CA C 98 56.340 56.340 56.477 -0.137 25685 7259 1 10 . 1 1 98 98 LYS CB C 98 31.933 31.933 33.872 -1.939 25685 7260 1 10 . 1 1 98 98 LYS H H 98 7.855 7.855 8.440 -0.585 25685 7261 1 10 . 1 1 99 99 ILE N N 99 120.044 120.044 119.490 0.554 25685 7262 1 10 . 1 1 99 99 ILE C C 99 176.769 176.769 175.858 0.911 25685 7263 1 10 . 1 1 99 99 ILE CA C 99 62.758 62.758 61.883 0.875 25685 7264 1 10 . 1 1 99 99 ILE CB C 99 37.809 37.809 38.307 -0.498 25685 7265 1 10 . 1 1 99 99 ILE H H 99 8.069 8.069 8.140 -0.071 25685 7266 1 10 . 1 1 100 100 GLN C C 100 176.315 176.315 175.296 1.019 25685 7267 1 10 . 1 1 100 100 GLN CA C 100 57.486 57.486 56.499 0.987 25685 7268 1 10 . 1 1 101 101 THR N N 101 109.873 109.873 113.373 -3.500 25685 7269 1 10 . 1 1 101 101 THR C C 101 174.664 174.664 174.905 -0.241 25685 7270 1 10 . 1 1 101 101 THR CA C 101 61.709 61.709 61.939 -0.230 25685 7271 1 10 . 1 1 101 101 THR CB C 101 69.290 69.290 70.155 -0.865 25685 7272 1 10 . 1 1 101 101 THR H H 101 7.508 7.508 8.061 -0.553 25685 7273 1 10 . 1 1 102 102 LEU N N 102 124.434 124.434 123.559 0.875 25685 7274 1 10 . 1 1 102 102 LEU C C 102 174.681 174.681 176.165 -1.484 25685 7275 1 10 . 1 1 102 102 LEU CA C 102 53.063 53.063 53.753 -0.690 25685 7276 1 10 . 1 1 102 102 LEU CB C 102 41.139 41.139 41.099 0.040 25685 7277 1 10 . 1 1 102 102 LEU H H 102 7.569 7.569 8.082 -0.513 25685 7278 1 10 . 1 1 103 103 PRO C C 103 178.076 178.076 175.813 2.263 25685 7279 1 10 . 1 1 103 103 PRO CA C 103 62.570 62.570 63.380 -0.810 25685 7280 1 10 . 1 1 103 103 PRO CB C 103 31.534 31.534 30.747 0.787 25685 7281 1 10 . 1 1 104 104 SER N N 104 119.929 119.929 119.037 0.892 25685 7282 1 10 . 1 1 104 104 SER C C 104 176.432 176.432 174.466 1.966 25685 7283 1 10 . 1 1 104 104 SER CA C 104 61.976 61.976 57.295 4.681 25685 7284 1 10 . 1 1 104 104 SER CB C 104 63.611 63.611 63.198 0.413 25685 7285 1 10 . 1 1 104 104 SER H H 104 8.784 8.784 7.817 0.967 25685 7286 1 10 . 1 1 105 105 PHE N N 105 119.519 119.519 119.833 -0.314 25685 7287 1 10 . 1 1 105 105 PHE C C 105 176.852 176.852 175.910 0.942 25685 7288 1 10 . 1 1 105 105 PHE CA C 105 60.162 60.162 59.290 0.872 25685 7289 1 10 . 1 1 105 105 PHE CB C 105 38.455 38.455 38.880 -0.425 25685 7290 1 10 . 1 1 105 105 PHE H H 105 8.620 8.620 7.004 1.616 25685 7291 1 10 . 1 1 106 106 PHE N N 106 118.809 118.809 115.023 3.786 25685 7292 1 10 . 1 1 106 106 PHE C C 106 176.741 176.741 175.153 1.588 25685 7293 1 10 . 1 1 106 106 PHE CA C 106 61.421 61.421 57.183 4.238 25685 7294 1 10 . 1 1 106 106 PHE CB C 106 38.788 38.788 38.203 0.584 25685 7295 1 10 . 1 1 106 106 PHE H H 106 7.519 7.519 7.604 -0.085 25685 7296 1 10 . 1 1 107 107 PHE N N 107 117.382 117.382 122.783 -5.401 25685 7297 1 10 . 1 1 107 107 PHE C C 107 177.771 177.771 177.839 -0.068 25685 7298 1 10 . 1 1 107 107 PHE CA C 107 61.099 61.099 62.829 -1.730 25685 7299 1 10 . 1 1 107 107 PHE CB C 107 38.677 38.677 38.942 -0.265 25685 7300 1 10 . 1 1 107 107 PHE H H 107 7.903 7.903 8.004 -0.101 25685 7301 1 10 . 1 1 108 108 GLY N N 108 105.340 105.340 106.201 -0.861 25685 7302 1 10 . 1 1 108 108 GLY C C 108 174.574 174.574 176.085 -1.511 25685 7303 1 10 . 1 1 108 108 GLY CA C 108 47.508 47.508 47.128 0.380 25685 7304 1 10 . 1 1 108 108 GLY H H 108 8.351 8.351 8.797 -0.446 25685 7305 1 10 . 1 1 109 109 MET N N 109 119.831 119.831 121.306 -1.475 25685 7306 1 10 . 1 1 109 109 MET C C 109 177.522 177.522 178.554 -1.032 25685 7307 1 10 . 1 1 109 109 MET CA C 109 58.658 58.658 57.048 1.610 25685 7308 1 10 . 1 1 109 109 MET CB C 109 32.106 32.106 32.071 0.035 25685 7309 1 10 . 1 1 109 109 MET H H 109 7.919 7.919 8.148 -0.229 25685 7310 1 10 . 1 1 110 110 LEU N N 110 119.908 119.908 119.653 0.255 25685 7311 1 10 . 1 1 110 110 LEU C C 110 178.170 178.170 179.518 -1.348 25685 7312 1 10 . 1 1 110 110 LEU CA C 110 57.941 57.941 57.764 0.177 25685 7313 1 10 . 1 1 110 110 LEU CB C 110 41.055 41.055 40.968 0.087 25685 7314 1 10 . 1 1 110 110 LEU H H 110 7.744 7.744 7.819 -0.075 25685 7315 1 10 . 1 1 111 111 LEU N N 111 116.594 116.594 119.660 -3.066 25685 7316 1 10 . 1 1 111 111 LEU C C 111 178.960 178.960 178.054 0.906 25685 7317 1 10 . 1 1 111 111 LEU CA C 111 57.366 57.366 57.747 -0.381 25685 7318 1 10 . 1 1 111 111 LEU CB C 111 40.259 40.259 41.725 -1.466 25685 7319 1 10 . 1 1 111 111 LEU H H 111 7.732 7.732 7.665 0.067 25685 7320 1 10 . 1 1 112 112 ALA N N 112 121.020 121.020 120.591 0.429 25685 7321 1 10 . 1 1 112 112 ALA C C 112 178.700 178.700 179.178 -0.478 25685 7322 1 10 . 1 1 112 112 ALA CA C 112 55.432 55.432 54.736 0.696 25685 7323 1 10 . 1 1 112 112 ALA CB C 112 18.214 18.214 18.035 0.179 25685 7324 1 10 . 1 1 112 112 ALA H H 112 8.121 8.121 7.334 0.787 25685 7325 1 10 . 1 1 113 113 PHE N N 113 118.369 118.369 116.978 1.391 25685 7326 1 10 . 1 1 113 113 PHE C C 113 176.091 176.091 178.047 -1.956 25685 7327 1 10 . 1 1 113 113 PHE CA C 113 61.388 61.388 60.657 0.731 25685 7328 1 10 . 1 1 113 113 PHE CB C 113 39.688 39.688 38.659 1.029 25685 7329 1 10 . 1 1 113 113 PHE H H 113 8.237 8.237 7.454 0.783 25685 7330 1 10 . 1 1 114 114 LEU N N 114 114.214 114.214 116.295 -2.081 25685 7331 1 10 . 1 1 114 114 LEU C C 114 177.038 177.038 178.731 -1.693 25685 7332 1 10 . 1 1 114 114 LEU CA C 114 56.358 56.358 57.501 -1.143 25685 7333 1 10 . 1 1 114 114 LEU CB C 114 42.716 42.716 40.914 1.802 25685 7334 1 10 . 1 1 114 114 LEU H H 114 7.576 7.576 7.803 -0.227 25685 7335 1 10 . 1 1 115 115 TRP N N 115 112.667 112.667 119.037 -6.370 25685 7336 1 10 . 1 1 115 115 TRP C C 115 180.163 180.163 177.334 2.829 25685 7337 1 10 . 1 1 115 115 TRP CA C 115 55.930 55.930 58.074 -2.144 25685 7338 1 10 . 1 1 115 115 TRP H H 115 8.542 8.542 8.097 0.445 25685 7339 1 10 . 1 1 116 116 LEU N N 116 122.144 122.144 120.613 1.531 25685 7340 1 10 . 1 1 116 116 LEU C C 116 175.953 175.953 175.609 0.344 25685 7341 1 10 . 1 1 116 116 LEU CA C 116 59.924 59.924 56.982 2.942 25685 7342 1 10 . 1 1 116 116 LEU CB C 116 39.097 39.097 39.902 -0.805 25685 7343 1 10 . 1 1 116 116 LEU H H 116 8.996 8.996 7.248 1.748 25685 7344 1 10 . 1 1 117 117 PRO C C 117 174.220 174.220 177.651 -3.431 25685 7345 1 10 . 1 1 117 117 PRO CA C 117 66.300 66.300 64.496 1.804 25685 7346 1 10 . 1 1 118 118 ALA N N 118 110.603 110.603 118.933 -8.330 25685 7347 1 10 . 1 1 118 118 ALA C C 118 177.162 177.162 178.501 -1.339 25685 7348 1 10 . 1 1 118 118 ALA CA C 118 52.670 52.670 51.838 0.832 25685 7349 1 10 . 1 1 118 118 ALA CB C 118 18.853 18.853 19.706 -0.853 25685 7350 1 10 . 1 1 118 118 ALA H H 118 6.633 6.633 7.535 -0.902 25685 7351 1 10 . 1 1 119 119 ILE N N 119 113.492 113.492 116.196 -2.704 25685 7352 1 10 . 1 1 119 119 ILE CA C 119 63.703 63.703 63.397 0.306 25685 7353 1 10 . 1 1 119 119 ILE CB C 119 39.605 39.605 37.154 2.451 25685 7354 1 10 . 1 1 119 119 ILE H H 119 7.693 7.693 8.320 -0.627 25685 7355 1 10 . 1 1 121 121 PRO C C 121 178.089 178.089 179.138 -1.049 25685 7356 1 10 . 1 1 121 121 PRO CA C 121 66.004 66.004 65.741 0.263 25685 7357 1 10 . 1 1 122 122 PHE N N 122 113.797 113.797 119.151 -5.354 25685 7358 1 10 . 1 1 122 122 PHE C C 122 177.713 177.713 177.531 0.182 25685 7359 1 10 . 1 1 122 122 PHE CA C 122 61.566 61.566 61.283 0.283 25685 7360 1 10 . 1 1 122 122 PHE CB C 122 38.983 38.983 38.933 0.050 25685 7361 1 10 . 1 1 122 122 PHE H H 122 6.846 6.846 8.188 -1.342 25685 7362 1 10 . 1 1 123 123 ALA N N 123 121.512 121.512 121.154 0.358 25685 7363 1 10 . 1 1 123 123 ALA C C 123 179.318 179.318 179.421 -0.103 25685 7364 1 10 . 1 1 123 123 ALA CA C 123 54.975 54.975 55.109 -0.134 25685 7365 1 10 . 1 1 123 123 ALA CB C 123 17.881 17.881 18.092 -0.211 25685 7366 1 10 . 1 1 123 123 ALA H H 123 8.411 8.411 8.822 -0.411 25685 7367 1 10 . 1 1 124 124 GLY N N 124 104.093 104.093 107.051 -2.958 25685 7368 1 10 . 1 1 124 124 GLY C C 124 175.410 175.410 176.096 -0.686 25685 7369 1 10 . 1 1 124 124 GLY CA C 124 47.370 47.370 46.681 0.688 25685 7370 1 10 . 1 1 124 124 GLY H H 124 8.455 8.455 7.915 0.540 25685 7371 1 10 . 1 1 125 125 ILE N N 125 121.895 121.895 122.992 -1.097 25685 7372 1 10 . 1 1 125 125 ILE C C 125 178.329 178.329 177.029 1.300 25685 7373 1 10 . 1 1 125 125 ILE CA C 125 64.412 64.412 63.951 0.461 25685 7374 1 10 . 1 1 125 125 ILE H H 125 7.954 7.954 8.007 -0.053 25685 7375 1 10 . 1 1 126 126 ALA N N 126 122.768 122.768 121.367 1.401 25685 7376 1 10 . 1 1 126 126 ALA C C 126 180.341 180.341 179.308 1.033 25685 7377 1 10 . 1 1 126 126 ALA CA C 126 55.266 55.266 54.975 0.291 25685 7378 1 10 . 1 1 126 126 ALA CB C 126 18.226 18.226 18.105 0.121 25685 7379 1 10 . 1 1 126 126 ALA H H 126 8.142 8.142 7.458 0.684 25685 7380 1 10 . 1 1 127 127 ILE N N 127 116.752 116.752 114.894 1.858 25685 7381 1 10 . 1 1 127 127 ILE C C 127 177.993 177.993 177.958 0.035 25685 7382 1 10 . 1 1 127 127 ILE CA C 127 63.877 63.877 63.934 -0.057 25685 7383 1 10 . 1 1 127 127 ILE CB C 127 37.657 37.657 37.175 0.482 25685 7384 1 10 . 1 1 127 127 ILE H H 127 8.335 8.335 7.321 1.014 25685 7385 1 10 . 1 1 128 128 SER N N 128 116.351 116.351 115.548 0.803 25685 7386 1 10 . 1 1 128 128 SER C C 128 175.796 175.796 176.598 -0.802 25685 7387 1 10 . 1 1 128 128 SER CA C 128 61.818 61.818 60.959 0.859 25685 7388 1 10 . 1 1 128 128 SER H H 128 7.939 7.939 7.610 0.329 25685 7389 1 10 . 1 1 129 129 GLN N N 129 118.082 118.082 118.440 -0.358 25685 7390 1 10 . 1 1 129 129 GLN C C 129 177.419 177.419 177.319 0.100 25685 7391 1 10 . 1 1 129 129 GLN CA C 129 57.106 57.106 58.212 -1.106 25685 7392 1 10 . 1 1 129 129 GLN CB C 129 28.631 28.631 28.794 -0.163 25685 7393 1 10 . 1 1 129 129 GLN H H 129 7.943 7.943 7.643 0.300 25685 7394 1 10 . 1 1 130 130 THR N N 130 113.484 113.484 113.463 0.021 25685 7395 1 10 . 1 1 130 130 THR C C 130 175.627 175.627 175.490 0.137 25685 7396 1 10 . 1 1 130 130 THR CA C 130 63.758 63.758 64.520 -0.762 25685 7397 1 10 . 1 1 130 130 THR CB C 130 69.182 69.182 69.051 0.131 25685 7398 1 10 . 1 1 130 130 THR H H 130 7.686 7.686 7.537 0.149 25685 7399 1 10 . 1 1 131 131 LEU N N 131 121.347 121.347 119.541 1.806 25685 7400 1 10 . 1 1 131 131 LEU C C 131 177.522 177.522 176.894 0.628 25685 7401 1 10 . 1 1 131 131 LEU CA C 131 56.307 56.307 55.671 0.636 25685 7402 1 10 . 1 1 131 131 LEU CB C 131 41.711 41.711 41.815 -0.104 25685 7403 1 10 . 1 1 131 131 LEU H H 131 8.071 8.071 7.186 0.885 25685 7404 1 10 . 1 1 132 132 LEU N N 132 118.162 118.162 115.051 3.111 25685 7405 1 10 . 1 1 132 132 LEU C C 132 177.461 177.461 176.467 0.994 25685 7406 1 10 . 1 1 132 132 LEU CA C 132 55.264 55.264 54.145 1.119 25685 7407 1 10 . 1 1 132 132 LEU CB C 132 41.613 41.613 42.819 -1.206 25685 7408 1 10 . 1 1 132 132 LEU H H 132 7.810 7.810 7.893 -0.083 25685 7409 1 10 . 1 1 133 133 SER N N 133 114.244 114.244 113.443 0.801 25685 7410 1 10 . 1 1 133 133 SER C C 133 174.363 174.363 172.766 1.597 25685 7411 1 10 . 1 1 133 133 SER CA C 133 59.019 59.019 59.071 -0.052 25685 7412 1 10 . 1 1 133 133 SER CB C 133 64.634 64.634 63.124 1.510 25685 7413 1 10 . 1 1 133 133 SER H H 133 7.829 7.829 8.538 -0.709 25685 7414 1 10 . 1 1 134 134 GLU N N 134 120.151 120.151 121.288 -1.137 25685 7415 1 10 . 1 1 134 134 GLU C C 134 175.935 175.935 174.213 1.722 25685 7416 1 10 . 1 1 134 134 GLU CA C 134 56.301 56.301 55.948 0.353 25685 7417 1 10 . 1 1 134 134 GLU CB C 134 30.129 30.129 31.399 -1.270 25685 7418 1 10 . 1 1 134 134 GLU H H 134 8.054 8.054 8.156 -0.102 25685 7419 1 10 . 1 1 135 135 ASN N N 135 118.890 118.890 118.535 0.355 25685 7420 1 10 . 1 1 135 135 ASN C C 135 174.272 174.272 173.867 0.405 25685 7421 1 10 . 1 1 135 135 ASN CA C 135 51.390 51.390 50.713 0.677 25685 7422 1 10 . 1 1 135 135 ASN CB C 135 39.129 39.129 39.420 -0.291 25685 7423 1 10 . 1 1 135 135 ASN H H 135 8.305 8.305 8.395 -0.090 25685 7424 1 10 . 1 1 136 136 PRO C C 136 177.960 177.960 178.011 -0.051 25685 7425 1 10 . 1 1 136 136 PRO CA C 136 64.530 64.530 64.837 -0.307 25685 7426 1 10 . 1 1 136 136 PRO CB C 136 31.809 31.809 31.987 -0.178 25685 7427 1 10 . 1 1 137 137 LEU N N 137 117.735 117.735 119.669 -1.934 25685 7428 1 10 . 1 1 137 137 LEU C C 137 179.217 179.217 179.528 -0.311 25685 7429 1 10 . 1 1 137 137 LEU CA C 137 57.039 57.039 57.854 -0.815 25685 7430 1 10 . 1 1 137 137 LEU CB C 137 40.799 40.799 40.439 0.360 25685 7431 1 10 . 1 1 137 137 LEU H H 137 8.248 8.248 8.195 0.053 25685 7432 1 10 . 1 1 138 138 VAL N N 138 119.589 119.589 114.633 4.956 25685 7433 1 10 . 1 1 138 138 VAL C C 138 177.894 177.894 178.077 -0.183 25685 7434 1 10 . 1 1 138 138 VAL CA C 138 64.727 64.727 65.684 -0.957 25685 7435 1 10 . 1 1 138 138 VAL CB C 138 31.347 31.347 31.556 -0.209 25685 7436 1 10 . 1 1 138 138 VAL H H 138 7.483 7.483 8.058 -0.575 25685 7437 1 10 . 1 1 139 139 MET N N 139 119.431 119.431 120.460 -1.029 25685 7438 1 10 . 1 1 139 139 MET C C 139 177.988 177.988 178.329 -0.341 25685 7439 1 10 . 1 1 139 139 MET CA C 139 57.403 57.403 57.083 0.320 25685 7440 1 10 . 1 1 139 139 MET CB C 139 31.709 31.709 31.416 0.293 25685 7441 1 10 . 1 1 139 139 MET H H 139 7.837 7.837 7.680 0.157 25685 7442 1 10 . 1 1 140 140 LEU N N 140 119.686 119.686 120.949 -1.263 25685 7443 1 10 . 1 1 140 140 LEU C C 140 177.916 177.916 179.276 -1.360 25685 7444 1 10 . 1 1 140 140 LEU CA C 140 56.877 56.877 58.339 -1.462 25685 7445 1 10 . 1 1 140 140 LEU CB C 140 41.491 41.491 40.524 0.967 25685 7446 1 10 . 1 1 140 140 LEU H H 140 7.926 7.926 8.785 -0.859 25685 7447 1 10 . 1 1 141 141 SER N N 141 114.167 114.167 115.128 -0.961 25685 7448 1 10 . 1 1 141 141 SER C C 141 176.030 176.030 177.209 -1.179 25685 7449 1 10 . 1 1 141 141 SER CA C 141 60.425 60.425 61.879 -1.454 25685 7450 1 10 . 1 1 141 141 SER CB C 141 63.956 63.956 63.087 0.869 25685 7451 1 10 . 1 1 141 141 SER H H 141 7.757 7.757 8.328 -0.571 25685 7452 1 10 . 1 1 142 142 TYR N N 142 121.679 121.679 121.592 0.087 25685 7453 1 10 . 1 1 142 142 TYR C C 142 177.659 177.659 178.184 -0.525 25685 7454 1 10 . 1 1 142 142 TYR CA C 142 59.673 59.673 61.599 -1.926 25685 7455 1 10 . 1 1 142 142 TYR CB C 142 38.079 38.079 38.440 -0.361 25685 7456 1 10 . 1 1 142 142 TYR H H 142 7.965 7.965 8.830 -0.865 25685 7457 1 10 . 1 1 143 143 GLY N N 143 107.396 107.396 107.578 -0.182 25685 7458 1 10 . 1 1 143 143 GLY C C 143 174.877 174.877 175.643 -0.766 25685 7459 1 10 . 1 1 143 143 GLY CA C 143 46.343 46.343 47.147 -0.804 25685 7460 1 10 . 1 1 143 143 GLY H H 143 8.177 8.177 8.840 -0.663 25685 7461 1 10 . 1 1 144 144 LEU N N 144 120.477 120.477 122.532 -2.055 25685 7462 1 10 . 1 1 144 144 LEU C C 144 178.504 178.504 178.813 -0.309 25685 7463 1 10 . 1 1 144 144 LEU CA C 144 56.270 56.270 57.500 -1.230 25685 7464 1 10 . 1 1 144 144 LEU CB C 144 41.662 41.662 41.849 -0.187 25685 7465 1 10 . 1 1 144 144 LEU H H 144 8.055 8.055 7.396 0.659 25685 7466 1 10 . 1 1 145 145 GLY N N 145 106.847 106.847 106.289 0.558 25685 7467 1 10 . 1 1 145 145 GLY C C 145 175.375 175.375 175.917 -0.542 25685 7468 1 10 . 1 1 145 145 GLY CA C 145 45.582 45.582 47.253 -1.671 25685 7469 1 10 . 1 1 145 145 GLY H H 145 8.066 8.066 7.652 0.414 25685 7470 1 10 . 1 1 146 146 MET N N 146 120.376 120.376 121.120 -0.744 25685 7471 1 10 . 1 1 146 146 MET C C 146 176.663 176.663 178.019 -1.356 25685 7472 1 10 . 1 1 146 146 MET CA C 146 57.030 57.030 57.641 -0.611 25685 7473 1 10 . 1 1 146 146 MET CB C 146 30.720 30.720 31.841 -1.121 25685 7474 1 10 . 1 1 146 146 MET H H 146 8.157 8.157 8.510 -0.353 25685 7475 1 10 . 1 1 147 147 ALA N N 147 123.038 123.038 121.999 1.039 25685 7476 1 10 . 1 1 147 147 ALA C C 147 178.917 178.917 179.571 -0.654 25685 7477 1 10 . 1 1 147 147 ALA CA C 147 54.201 54.201 55.156 -0.955 25685 7478 1 10 . 1 1 147 147 ALA CB C 147 18.810 18.810 17.901 0.909 25685 7479 1 10 . 1 1 147 147 ALA H H 147 8.336 8.336 7.930 0.406 25685 7480 1 10 . 1 1 148 148 VAL N N 148 117.795 117.795 114.360 3.435 25685 7481 1 10 . 1 1 148 148 VAL C C 148 176.891 176.891 177.960 -1.069 25685 7482 1 10 . 1 1 148 148 VAL CA C 148 64.157 64.157 66.122 -1.965 25685 7483 1 10 . 1 1 148 148 VAL CB C 148 31.529 31.529 31.420 0.109 25685 7484 1 10 . 1 1 148 148 VAL H H 148 7.908 7.908 7.397 0.511 25685 7485 1 10 . 1 1 149 149 THR N N 149 116.069 116.069 117.160 -1.091 25685 7486 1 10 . 1 1 149 149 THR C C 149 176.054 176.054 176.577 -0.523 25685 7487 1 10 . 1 1 149 149 THR CA C 149 63.308 63.308 67.252 -3.944 25685 7488 1 10 . 1 1 149 149 THR H H 149 7.414 7.414 7.408 0.006 25685 7489 1 10 . 1 1 150 150 ILE N N 150 121.971 121.971 120.531 1.440 25685 7490 1 10 . 1 1 150 150 ILE C C 150 177.715 177.715 177.534 0.181 25685 7491 1 10 . 1 1 150 150 ILE CA C 150 64.319 64.319 62.932 1.387 25685 7492 1 10 . 1 1 150 150 ILE CB C 150 36.628 36.628 36.609 0.019 25685 7493 1 10 . 1 1 150 150 ILE H H 150 8.772 8.772 8.654 0.118 25685 7494 1 10 . 1 1 151 151 ALA N N 151 122.272 122.272 121.927 0.345 25685 7495 1 10 . 1 1 151 151 ALA C C 151 180.370 180.370 179.334 1.036 25685 7496 1 10 . 1 1 151 151 ALA CA C 151 55.336 55.336 55.399 -0.063 25685 7497 1 10 . 1 1 151 151 ALA CB C 151 18.107 18.107 17.804 0.303 25685 7498 1 10 . 1 1 151 151 ALA H H 151 8.163 8.163 7.639 0.524 25685 7499 1 10 . 1 1 152 152 ALA N N 152 120.648 120.648 120.789 -0.141 25685 7500 1 10 . 1 1 152 152 ALA C C 152 181.019 181.019 180.283 0.736 25685 7501 1 10 . 1 1 152 152 ALA CA C 152 54.944 54.944 54.813 0.131 25685 7502 1 10 . 1 1 152 152 ALA CB C 152 18.963 18.963 18.463 0.500 25685 7503 1 10 . 1 1 152 152 ALA H H 152 7.877 7.877 7.836 0.041 25685 7504 1 10 . 1 1 153 153 VAL N N 153 119.372 119.372 119.365 0.007 25685 7505 1 10 . 1 1 153 153 VAL C C 153 178.197 178.197 178.394 -0.197 25685 7506 1 10 . 1 1 153 153 VAL CA C 153 66.289 66.289 65.851 0.438 25685 7507 1 10 . 1 1 153 153 VAL CB C 153 30.770 30.770 31.453 -0.683 25685 7508 1 10 . 1 1 153 153 VAL H H 153 8.118 8.118 7.683 0.435 25685 7509 1 10 . 1 1 154 154 PHE N N 154 120.362 120.362 119.138 1.224 25685 7510 1 10 . 1 1 154 154 PHE C C 154 177.733 177.733 178.002 -0.269 25685 7511 1 10 . 1 1 154 154 PHE CA C 154 61.412 61.412 59.910 1.502 25685 7512 1 10 . 1 1 154 154 PHE CB C 154 38.465 38.465 37.977 0.488 25685 7513 1 10 . 1 1 154 154 PHE H H 154 8.508 8.508 8.424 0.084 25685 7514 1 10 . 1 1 155 155 LYS N N 155 118.894 118.894 119.079 -0.185 25685 7515 1 10 . 1 1 155 155 LYS C C 155 179.940 179.940 177.976 1.964 25685 7516 1 10 . 1 1 155 155 LYS CA C 155 58.969 58.969 58.762 0.207 25685 7517 1 10 . 1 1 155 155 LYS CB C 155 31.725 31.725 32.115 -0.390 25685 7518 1 10 . 1 1 155 155 LYS H H 155 8.035 8.035 7.705 0.330 25685 7519 1 10 . 1 1 156 156 MET N N 156 118.853 118.853 117.016 1.837 25685 7520 1 10 . 1 1 156 156 MET C C 156 179.245 179.245 178.245 1.000 25685 7521 1 10 . 1 1 156 156 MET CA C 156 58.518 58.518 57.551 0.967 25685 7522 1 10 . 1 1 156 156 MET CB C 156 31.912 31.912 30.912 1.000 25685 7523 1 10 . 1 1 156 156 MET H H 156 8.014 8.014 7.306 0.708 25685 7524 1 10 . 1 1 157 157 GLY N N 157 108.239 108.239 108.049 0.190 25685 7525 1 10 . 1 1 157 157 GLY C C 157 174.637 174.637 175.780 -1.143 25685 7526 1 10 . 1 1 157 157 GLY CA C 157 47.204 47.204 47.199 0.005 25685 7527 1 10 . 1 1 157 157 GLY H H 157 8.614 8.614 7.600 1.014 25685 7528 1 10 . 1 1 158 158 GLU N N 158 122.902 122.902 121.676 1.226 25685 7529 1 10 . 1 1 158 158 GLU C C 158 177.851 177.851 176.923 0.928 25685 7530 1 10 . 1 1 158 158 GLU CA C 158 60.203 60.203 57.779 2.424 25685 7531 1 10 . 1 1 158 158 GLU CB C 158 28.870 28.870 30.559 -1.689 25685 7532 1 10 . 1 1 158 158 GLU H H 158 8.550 8.550 7.993 0.557 25685 7533 1 10 . 1 1 159 159 LYS N N 159 117.932 117.932 117.126 0.806 25685 7534 1 10 . 1 1 159 159 LYS C C 159 179.529 179.529 174.743 4.786 25685 7535 1 10 . 1 1 159 159 LYS CA C 159 59.419 59.419 55.164 4.255 25685 7536 1 10 . 1 1 159 159 LYS CB C 159 31.759 31.759 34.218 -2.459 25685 7537 1 10 . 1 1 159 159 LYS H H 159 7.641 7.641 7.869 -0.228 25685 7538 1 10 . 1 1 160 160 PHE N N 160 120.614 120.614 122.677 -2.063 25685 7539 1 10 . 1 1 160 160 PHE C C 160 178.511 178.511 176.806 1.705 25685 7540 1 10 . 1 1 160 160 PHE CA C 160 61.580 61.580 59.070 2.510 25685 7541 1 10 . 1 1 160 160 PHE CB C 160 39.909 39.909 39.861 0.048 25685 7542 1 10 . 1 1 160 160 PHE H H 160 8.026 8.026 8.729 -0.703 25685 7543 1 10 . 1 1 161 161 VAL N N 161 119.870 119.870 122.585 -2.715 25685 7544 1 10 . 1 1 161 161 VAL C C 161 177.347 177.347 176.700 0.647 25685 7545 1 10 . 1 1 161 161 VAL CA C 161 66.121 66.121 61.718 4.402 25685 7546 1 10 . 1 1 161 161 VAL CB C 161 30.935 30.935 34.082 -3.147 25685 7547 1 10 . 1 1 161 161 VAL H H 161 8.628 8.628 8.663 -0.035 25685 7548 1 10 . 1 1 162 162 LYS N N 162 116.237 116.237 124.361 -8.124 25685 7549 1 10 . 1 1 162 162 LYS C C 162 179.197 179.197 175.877 3.320 25685 7550 1 10 . 1 1 162 162 LYS CA C 162 60.037 60.037 58.908 1.129 25685 7551 1 10 . 1 1 162 162 LYS CB C 162 31.333 31.333 32.597 -1.264 25685 7552 1 10 . 1 1 162 162 LYS H H 162 7.843 7.843 8.580 -0.737 25685 7553 1 10 . 1 1 163 163 ALA N N 163 119.197 119.197 116.596 2.601 25685 7554 1 10 . 1 1 163 163 ALA C C 163 178.635 178.635 174.984 3.651 25685 7555 1 10 . 1 1 163 163 ALA CA C 163 53.681 53.681 51.453 2.228 25685 7556 1 10 . 1 1 163 163 ALA CB C 163 19.586 19.586 18.497 1.089 25685 7557 1 10 . 1 1 163 163 ALA H H 163 7.630 7.630 7.883 -0.253 25685 7558 1 10 . 1 1 164 164 ASN N N 164 115.956 115.956 118.047 -2.091 25685 7559 1 10 . 1 1 164 164 ASN C C 164 175.556 175.556 176.435 -0.879 25685 7560 1 10 . 1 1 164 164 ASN CA C 164 52.267 52.267 54.368 -2.101 25685 7561 1 10 . 1 1 164 164 ASN CB C 164 39.148 39.148 39.011 0.137 25685 7562 1 10 . 1 1 164 164 ASN H H 164 7.326 7.326 8.117 -0.791 25685 7563 1 10 . 1 1 165 165 PHE N N 165 121.612 121.612 123.664 -2.052 25685 7564 1 10 . 1 1 165 165 PHE C C 165 177.069 177.069 178.017 -0.948 25685 7565 1 10 . 1 1 165 165 PHE CA C 165 62.921 62.921 61.139 1.782 25685 7566 1 10 . 1 1 165 165 PHE CB C 165 39.427 39.427 39.320 0.107 25685 7567 1 10 . 1 1 165 165 PHE H H 165 7.408 7.408 8.995 -1.587 25685 7568 1 10 . 1 1 166 166 GLN N N 166 117.147 117.147 118.880 -1.733 25685 7569 1 10 . 1 1 166 166 GLN C C 166 178.922 178.922 178.188 0.734 25685 7570 1 10 . 1 1 166 166 GLN CA C 166 59.262 59.262 58.850 0.412 25685 7571 1 10 . 1 1 166 166 GLN CB C 166 26.811 26.811 28.273 -1.462 25685 7572 1 10 . 1 1 166 166 GLN H H 166 8.605 8.605 9.345 -0.740 25685 7573 1 10 . 1 1 167 167 LEU N N 167 121.946 121.946 118.635 3.311 25685 7574 1 10 . 1 1 167 167 LEU C C 167 178.863 178.863 178.607 0.256 25685 7575 1 10 . 1 1 167 167 LEU CA C 167 58.039 58.039 57.825 0.214 25685 7576 1 10 . 1 1 167 167 LEU CB C 167 41.130 41.130 41.590 -0.460 25685 7577 1 10 . 1 1 167 167 LEU H H 167 7.892 7.892 7.606 0.286 25685 7578 1 10 . 1 1 168 168 ILE N N 168 118.751 118.751 115.587 3.164 25685 7579 1 10 . 1 1 168 168 ILE C C 168 179.908 179.908 177.190 2.718 25685 7580 1 10 . 1 1 168 168 ILE CA C 168 63.886 63.886 64.531 -0.645 25685 7581 1 10 . 1 1 168 168 ILE CB C 168 36.170 36.170 37.373 -1.203 25685 7582 1 10 . 1 1 168 168 ILE H H 168 8.065 8.065 7.343 0.722 25685 7583 1 10 . 1 1 169 169 ARG N N 169 125.851 125.851 119.221 6.630 25685 7584 1 10 . 1 1 169 169 ARG C C 169 177.579 177.579 178.699 -1.120 25685 7585 1 10 . 1 1 169 169 ARG CA C 169 60.306 60.306 59.082 1.224 25685 7586 1 10 . 1 1 169 169 ARG CB C 169 29.224 29.224 29.769 -0.545 25685 7587 1 10 . 1 1 169 169 ARG H H 169 8.995 8.995 7.754 1.241 25685 7588 1 10 . 1 1 170 170 LYS N N 170 119.586 119.586 119.145 0.441 25685 7589 1 10 . 1 1 170 170 LYS C C 170 178.584 178.584 178.646 -0.062 25685 7590 1 10 . 1 1 170 170 LYS CA C 170 60.293 60.293 59.365 0.928 25685 7591 1 10 . 1 1 170 170 LYS CB C 170 32.530 32.530 31.790 0.740 25685 7592 1 10 . 1 1 170 170 LYS H H 170 7.663 7.663 7.412 0.251 25685 7593 1 10 . 1 1 171 171 VAL N N 171 118.348 118.348 116.967 1.381 25685 7594 1 10 . 1 1 171 171 VAL C C 171 177.478 177.478 177.697 -0.219 25685 7595 1 10 . 1 1 171 171 VAL CA C 171 66.641 66.641 65.652 0.989 25685 7596 1 10 . 1 1 171 171 VAL CB C 171 31.565 31.565 31.358 0.207 25685 7597 1 10 . 1 1 171 171 VAL H H 171 8.515 8.515 7.524 0.991 25685 7598 1 10 . 1 1 172 172 THR N N 172 115.172 115.172 113.981 1.191 25685 7599 1 10 . 1 1 172 172 THR C C 172 176.320 176.320 176.748 -0.428 25685 7600 1 10 . 1 1 172 172 THR H H 172 8.416 8.416 7.524 0.892 25685 7601 1 10 . 1 1 173 173 GLY N N 173 108.801 108.801 109.290 -0.489 25685 7602 1 10 . 1 1 173 173 GLY C C 173 174.138 174.138 175.169 -1.031 25685 7603 1 10 . 1 1 173 173 GLY CA C 173 47.769 47.769 46.738 1.031 25685 7604 1 10 . 1 1 173 173 GLY H H 173 8.505 8.505 7.645 0.860 25685 7605 1 10 . 1 1 174 174 ALA N N 174 123.573 123.573 124.454 -0.881 25685 7606 1 10 . 1 1 174 174 ALA C C 174 178.782 178.782 178.886 -0.104 25685 7607 1 10 . 1 1 174 174 ALA CA C 174 55.604 55.604 54.828 0.776 25685 7608 1 10 . 1 1 174 174 ALA CB C 174 18.778 18.778 18.612 0.166 25685 7609 1 10 . 1 1 174 174 ALA H H 174 8.038 8.038 7.390 0.648 25685 7610 1 10 . 1 1 175 175 ILE N N 175 118.501 118.501 119.296 -0.795 25685 7611 1 10 . 1 1 175 175 ILE C C 175 178.247 178.247 177.701 0.546 25685 7612 1 10 . 1 1 175 175 ILE CA C 175 65.412 65.412 64.428 0.984 25685 7613 1 10 . 1 1 175 175 ILE CB C 175 37.671 37.671 38.498 -0.827 25685 7614 1 10 . 1 1 175 175 ILE H H 175 7.897 7.897 7.358 0.539 25685 7615 1 10 . 1 1 176 176 VAL N N 176 120.104 120.104 118.877 1.227 25685 7616 1 10 . 1 1 176 176 VAL C C 176 177.945 177.945 178.375 -0.430 25685 7617 1 10 . 1 1 176 176 VAL CA C 176 67.761 67.761 66.217 1.544 25685 7618 1 10 . 1 1 176 176 VAL CB C 176 30.662 30.662 31.295 -0.633 25685 7619 1 10 . 1 1 176 176 VAL H H 176 8.321 8.321 7.583 0.738 25685 7620 1 10 . 1 1 177 177 LEU N N 177 118.561 118.561 121.367 -2.806 25685 7621 1 10 . 1 1 177 177 LEU C C 177 178.563 178.563 178.031 0.532 25685 7622 1 10 . 1 1 177 177 LEU CA C 177 58.094 58.094 57.453 0.641 25685 7623 1 10 . 1 1 177 177 LEU CB C 177 41.061 41.061 41.548 -0.487 25685 7624 1 10 . 1 1 177 177 LEU H H 177 8.097 8.097 7.291 0.806 25685 7625 1 10 . 1 1 178 178 LEU N N 178 120.868 120.868 118.971 1.897 25685 7626 1 10 . 1 1 178 178 LEU C C 178 178.524 178.524 177.842 0.682 25685 7627 1 10 . 1 1 178 178 LEU CA C 178 57.767 57.767 57.904 -0.137 25685 7628 1 10 . 1 1 178 178 LEU CB C 178 40.886 40.886 41.217 -0.331 25685 7629 1 10 . 1 1 178 178 LEU H H 178 8.229 8.229 7.264 0.965 25685 7630 1 10 . 1 1 179 179 TYR N N 179 119.355 119.355 118.758 0.597 25685 7631 1 10 . 1 1 179 179 TYR C C 179 180.059 180.059 177.360 2.699 25685 7632 1 10 . 1 1 179 179 TYR CA C 179 63.844 63.844 60.998 2.846 25685 7633 1 10 . 1 1 179 179 TYR CB C 179 39.508 39.508 38.190 1.318 25685 7634 1 10 . 1 1 179 179 TYR H H 179 8.759 8.759 7.686 1.073 25685 7635 1 10 . 1 1 180 180 LEU N N 180 118.984 118.984 118.964 0.020 25685 7636 1 10 . 1 1 180 180 LEU C C 180 179.079 179.079 178.936 0.143 25685 7637 1 10 . 1 1 180 180 LEU CA C 180 58.879 58.879 57.618 1.261 25685 7638 1 10 . 1 1 180 180 LEU CB C 180 41.899 41.899 41.206 0.693 25685 7639 1 10 . 1 1 180 180 LEU H H 180 8.315 8.315 7.698 0.617 25685 7640 1 10 . 1 1 181 181 ALA N N 181 121.826 121.826 122.151 -0.325 25685 7641 1 10 . 1 1 181 181 ALA C C 181 180.009 180.009 179.334 0.675 25685 7642 1 10 . 1 1 181 181 ALA CA C 181 55.700 55.700 54.961 0.739 25685 7643 1 10 . 1 1 181 181 ALA CB C 181 17.713 17.713 18.314 -0.601 25685 7644 1 10 . 1 1 181 181 ALA H H 181 8.480 8.480 7.828 0.652 25685 7645 1 10 . 1 1 182 182 TYR N N 182 118.039 118.039 117.871 0.168 25685 7646 1 10 . 1 1 182 182 TYR CA C 182 59.038 59.038 61.808 -2.770 25685 7647 1 10 . 1 1 182 182 TYR H H 182 8.856 8.856 7.792 1.064 25685 7648 1 10 . 1 1 183 183 PHE N N 183 124.769 124.769 117.655 7.114 25685 7649 1 10 . 1 1 183 183 PHE CA C 183 63.566 63.566 59.480 4.086 25685 7650 1 10 . 1 1 183 183 PHE H H 183 9.764 9.764 7.572 2.192 25685 7651 1 11 . 1 1 4 4 ALA N N 4 121.533 121.533 122.192 -0.659 25685 7652 1 11 . 1 1 4 4 ALA C C 4 177.632 177.632 178.636 -1.004 25685 7653 1 11 . 1 1 4 4 ALA CA C 4 55.117 55.117 55.042 0.075 25685 7654 1 11 . 1 1 4 4 ALA CB C 4 18.448 18.448 18.939 -0.491 25685 7655 1 11 . 1 1 4 4 ALA H H 4 7.977 7.977 8.058 -0.081 25685 7656 1 11 . 1 1 5 5 PHE N N 5 119.988 119.988 117.296 2.692 25685 7657 1 11 . 1 1 5 5 PHE CA C 5 60.759 60.759 60.682 0.077 25685 7658 1 11 . 1 1 5 5 PHE CB C 5 39.221 39.221 37.456 1.765 25685 7659 1 11 . 1 1 5 5 PHE H H 5 8.210 8.210 8.433 -0.223 25685 7660 1 11 . 1 1 6 6 ALA C C 6 179.794 179.794 179.110 0.684 25685 7661 1 11 . 1 1 6 6 ALA CA C 6 55.619 55.619 54.292 1.327 25685 7662 1 11 . 1 1 6 6 ALA CB C 6 17.911 17.911 17.815 0.096 25685 7663 1 11 . 1 1 6 6 ALA H H 6 8.417 8.417 6.651 1.766 25685 7664 1 11 . 1 1 7 7 LEU N N 7 115.852 115.852 119.679 -3.827 25685 7665 1 11 . 1 1 7 7 LEU C C 7 180.196 180.196 178.937 1.259 25685 7666 1 11 . 1 1 7 7 LEU CA C 7 57.528 57.528 57.053 0.475 25685 7667 1 11 . 1 1 7 7 LEU CB C 7 40.060 40.060 41.600 -1.540 25685 7668 1 11 . 1 1 7 7 LEU H H 7 8.741 8.741 7.130 1.611 25685 7669 1 11 . 1 1 8 8 GLY N N 8 110.199 110.199 105.828 4.371 25685 7670 1 11 . 1 1 8 8 GLY C C 8 176.430 176.430 176.171 0.259 25685 7671 1 11 . 1 1 8 8 GLY CA C 8 46.960 46.960 47.684 -0.724 25685 7672 1 11 . 1 1 8 8 GLY H H 8 8.179 8.179 7.932 0.247 25685 7673 1 11 . 1 1 9 9 ILE N N 9 122.346 122.346 120.061 2.285 25685 7674 1 11 . 1 1 9 9 ILE C C 9 178.143 178.143 177.470 0.673 25685 7675 1 11 . 1 1 9 9 ILE CA C 9 65.048 65.048 64.170 0.878 25685 7676 1 11 . 1 1 9 9 ILE CB C 9 36.841 36.841 37.761 -0.920 25685 7677 1 11 . 1 1 9 9 ILE H H 9 7.788 7.788 7.648 0.140 25685 7678 1 11 . 1 1 10 10 LEU N N 10 117.560 117.560 120.449 -2.889 25685 7679 1 11 . 1 1 10 10 LEU C C 10 179.501 179.501 178.996 0.505 25685 7680 1 11 . 1 1 10 10 LEU CA C 10 58.068 58.068 58.243 -0.175 25685 7681 1 11 . 1 1 10 10 LEU CB C 10 40.776 40.776 40.367 0.409 25685 7682 1 11 . 1 1 10 10 LEU H H 10 8.044 8.044 7.958 0.086 25685 7683 1 11 . 1 1 11 11 SER N N 11 113.830 113.830 114.618 -0.788 25685 7684 1 11 . 1 1 11 11 SER CA C 11 61.769 61.769 61.095 0.674 25685 7685 1 11 . 1 1 11 11 SER CB C 11 63.395 63.395 62.809 0.586 25685 7686 1 11 . 1 1 11 11 SER H H 11 8.140 8.140 7.754 0.386 25685 7687 1 11 . 1 1 12 12 VAL N N 12 121.343 121.343 122.021 -0.678 25685 7688 1 11 . 1 1 12 12 VAL C C 12 176.753 176.753 177.799 -1.046 25685 7689 1 11 . 1 1 12 12 VAL CA C 12 64.583 64.583 65.710 -1.127 25685 7690 1 11 . 1 1 12 12 VAL CB C 12 31.067 31.067 31.348 -0.281 25685 7691 1 11 . 1 1 12 12 VAL H H 12 7.587 7.587 7.594 -0.007 25685 7692 1 11 . 1 1 13 13 PHE N N 13 115.225 115.225 120.190 -4.965 25685 7693 1 11 . 1 1 13 13 PHE C C 13 177.349 177.349 176.706 0.643 25685 7694 1 11 . 1 1 13 13 PHE CA C 13 58.730 58.730 60.919 -2.189 25685 7695 1 11 . 1 1 13 13 PHE CB C 13 39.785 39.785 39.163 0.621 25685 7696 1 11 . 1 1 13 13 PHE H H 13 7.474 7.474 8.386 -0.912 25685 7697 1 11 . 1 1 14 14 SER N N 14 116.075 116.075 114.454 1.621 25685 7698 1 11 . 1 1 14 14 SER H H 14 7.955 7.955 7.952 0.003 25685 7699 1 11 . 1 1 15 15 PRO C C 15 177.590 177.590 175.608 1.982 25685 7700 1 11 . 1 1 15 15 PRO CA C 15 65.464 65.464 62.297 3.167 25685 7701 1 11 . 1 1 16 16 ALA N N 16 116.288 116.288 122.320 -6.032 25685 7702 1 11 . 1 1 16 16 ALA C C 16 177.563 177.563 176.343 1.220 25685 7703 1 11 . 1 1 16 16 ALA CA C 16 53.010 53.010 51.194 1.816 25685 7704 1 11 . 1 1 16 16 ALA CB C 16 19.975 19.975 19.845 0.130 25685 7705 1 11 . 1 1 16 16 ALA H H 16 7.455 7.455 8.437 -0.982 25685 7706 1 11 . 1 1 17 17 VAL N N 17 112.072 112.072 120.232 -8.160 25685 7707 1 11 . 1 1 17 17 VAL CA C 17 63.117 63.117 62.850 0.267 25685 7708 1 11 . 1 1 17 17 VAL CB C 17 33.209 33.209 32.173 1.036 25685 7709 1 11 . 1 1 17 17 VAL H H 17 7.525 7.525 8.671 -1.146 25685 7710 1 11 . 1 1 18 18 LEU N N 18 121.205 121.205 125.640 -4.435 25685 7711 1 11 . 1 1 18 18 LEU CA C 18 58.971 58.971 54.416 4.555 25685 7712 1 11 . 1 1 18 18 LEU CB C 18 41.161 41.161 40.910 0.251 25685 7713 1 11 . 1 1 18 18 LEU H H 18 8.191 8.191 8.412 -0.221 25685 7714 1 11 . 1 1 19 19 PRO C C 19 177.697 177.697 176.348 1.349 25685 7715 1 11 . 1 1 19 19 PRO CA C 19 65.181 65.181 63.568 1.613 25685 7716 1 11 . 1 1 20 20 VAL N N 20 111.723 111.723 121.284 -9.561 25685 7717 1 11 . 1 1 20 20 VAL C C 20 177.137 177.137 176.083 1.054 25685 7718 1 11 . 1 1 20 20 VAL CA C 20 62.494 62.494 62.666 -0.172 25685 7719 1 11 . 1 1 20 20 VAL CB C 20 31.677 31.677 33.339 -1.662 25685 7720 1 11 . 1 1 20 20 VAL H H 20 7.571 7.571 7.614 -0.043 25685 7721 1 11 . 1 1 21 21 VAL N N 21 121.705 121.705 121.963 -0.258 25685 7722 1 11 . 1 1 21 21 VAL CA C 21 68.305 68.305 60.342 7.963 25685 7723 1 11 . 1 1 21 21 VAL H H 21 7.732 7.732 8.157 -0.425 25685 7724 1 11 . 1 1 24 24 ILE C C 24 174.359 174.359 176.222 -1.863 25685 7725 1 11 . 1 1 25 25 PHE N N 25 120.132 120.132 125.285 -5.153 25685 7726 1 11 . 1 1 25 25 PHE C C 25 175.945 175.945 176.314 -0.369 25685 7727 1 11 . 1 1 25 25 PHE CA C 25 60.544 60.544 59.751 0.793 25685 7728 1 11 . 1 1 25 25 PHE H H 25 8.082 8.082 9.067 -0.985 25685 7729 1 11 . 1 1 26 26 ALA N N 26 121.341 121.341 120.138 1.203 25685 7730 1 11 . 1 1 26 26 ALA CB C 26 19.784 19.784 19.438 0.346 25685 7731 1 11 . 1 1 26 26 ALA H H 26 7.539 7.539 7.521 0.018 25685 7732 1 11 . 1 1 27 27 GLY N N 27 107.530 107.530 103.486 4.044 25685 7733 1 11 . 1 1 27 27 GLY C C 27 174.252 174.252 172.354 1.898 25685 7734 1 11 . 1 1 27 27 GLY CA C 27 45.474 45.474 44.430 1.044 25685 7735 1 11 . 1 1 27 27 GLY H H 27 7.997 7.997 7.993 0.004 25685 7736 1 11 . 1 1 28 28 SER N N 28 116.299 116.299 112.029 4.270 25685 7737 1 11 . 1 1 28 28 SER C C 28 175.759 175.759 173.527 2.232 25685 7738 1 11 . 1 1 28 28 SER CA C 28 58.526 58.526 58.013 0.513 25685 7739 1 11 . 1 1 28 28 SER CB C 28 64.373 64.373 64.082 0.291 25685 7740 1 11 . 1 1 28 28 SER H H 28 8.115 8.115 8.348 -0.233 25685 7741 1 11 . 1 1 34 34 ASP C C 34 177.621 177.621 178.365 -0.744 25685 7742 1 11 . 1 1 34 34 ASP CA C 34 57.082 57.082 57.613 -0.531 25685 7743 1 11 . 1 1 35 35 ALA N N 35 120.662 120.662 122.380 -1.718 25685 7744 1 11 . 1 1 35 35 ALA C C 35 179.168 179.168 179.442 -0.274 25685 7745 1 11 . 1 1 35 35 ALA CA C 35 55.459 55.459 54.866 0.593 25685 7746 1 11 . 1 1 35 35 ALA CB C 35 18.819 18.819 18.418 0.401 25685 7747 1 11 . 1 1 35 35 ALA H H 35 8.090 8.090 7.595 0.495 25685 7748 1 11 . 1 1 36 36 PHE N N 36 117.638 117.638 119.543 -1.905 25685 7749 1 11 . 1 1 36 36 PHE C C 36 177.057 177.057 177.471 -0.414 25685 7750 1 11 . 1 1 36 36 PHE CA C 36 61.472 61.472 61.739 -0.267 25685 7751 1 11 . 1 1 36 36 PHE CB C 36 38.860 38.860 39.252 -0.391 25685 7752 1 11 . 1 1 36 36 PHE H H 36 8.227 8.227 8.086 0.141 25685 7753 1 11 . 1 1 37 37 LEU N N 37 119.312 119.312 119.493 -0.181 25685 7754 1 11 . 1 1 37 37 LEU C C 37 179.798 179.798 178.849 0.949 25685 7755 1 11 . 1 1 37 37 LEU CA C 37 58.181 58.181 58.669 -0.488 25685 7756 1 11 . 1 1 37 37 LEU CB C 37 40.835 40.835 41.354 -0.519 25685 7757 1 11 . 1 1 37 37 LEU H H 37 8.588 8.588 7.757 0.831 25685 7758 1 11 . 1 1 38 38 ILE N N 38 119.057 119.057 118.168 0.889 25685 7759 1 11 . 1 1 38 38 ILE C C 38 177.597 177.597 178.377 -0.780 25685 7760 1 11 . 1 1 38 38 ILE CA C 38 64.827 64.827 63.811 1.016 25685 7761 1 11 . 1 1 38 38 ILE CB C 38 36.321 36.321 36.463 -0.142 25685 7762 1 11 . 1 1 38 38 ILE H H 38 7.932 7.932 7.212 0.720 25685 7763 1 11 . 1 1 39 39 VAL N N 39 118.758 118.758 117.122 1.636 25685 7764 1 11 . 1 1 39 39 VAL C C 39 179.533 179.533 177.639 1.894 25685 7765 1 11 . 1 1 39 39 VAL CA C 39 66.687 66.687 66.425 0.262 25685 7766 1 11 . 1 1 39 39 VAL CB C 39 30.598 30.598 31.136 -0.538 25685 7767 1 11 . 1 1 39 39 VAL H H 39 7.922 7.922 7.311 0.611 25685 7768 1 11 . 1 1 40 40 ALA N N 40 125.385 125.385 122.018 3.367 25685 7769 1 11 . 1 1 40 40 ALA C C 40 179.200 179.200 180.004 -0.804 25685 7770 1 11 . 1 1 40 40 ALA CA C 40 55.283 55.283 54.799 0.484 25685 7771 1 11 . 1 1 40 40 ALA CB C 40 17.197 17.197 18.507 -1.310 25685 7772 1 11 . 1 1 40 40 ALA H H 40 9.091 9.091 7.483 1.608 25685 7773 1 11 . 1 1 41 41 GLY N N 41 106.978 106.978 106.681 0.297 25685 7774 1 11 . 1 1 41 41 GLY C C 41 176.171 176.171 175.689 0.482 25685 7775 1 11 . 1 1 41 41 GLY CA C 41 47.322 47.322 47.047 0.275 25685 7776 1 11 . 1 1 41 41 GLY H H 41 8.565 8.565 8.311 0.254 25685 7777 1 11 . 1 1 42 42 LEU N N 42 126.914 126.914 119.820 7.094 25685 7778 1 11 . 1 1 42 42 LEU C C 42 178.119 178.119 178.617 -0.498 25685 7779 1 11 . 1 1 42 42 LEU CA C 42 58.523 58.523 57.731 0.792 25685 7780 1 11 . 1 1 42 42 LEU CB C 42 42.125 42.125 41.230 0.895 25685 7781 1 11 . 1 1 42 42 LEU H H 42 8.573 8.573 7.527 1.046 25685 7782 1 11 . 1 1 46 46 MET N N 46 121.710 121.710 122.144 -0.434 25685 7783 1 11 . 1 1 46 46 MET C C 46 179.540 179.540 177.775 1.765 25685 7784 1 11 . 1 1 46 46 MET CA C 46 55.968 55.968 57.753 -1.785 25685 7785 1 11 . 1 1 46 46 MET H H 46 8.589 8.589 8.130 0.459 25685 7786 1 11 . 1 1 47 47 LEU N N 47 117.448 117.448 120.258 -2.810 25685 7787 1 11 . 1 1 47 47 LEU HA H 47 3.992 3.992 4.096 -0.104 25685 7788 1 11 . 1 1 47 47 LEU C C 47 179.082 179.082 178.872 0.210 25685 7789 1 11 . 1 1 47 47 LEU CA C 47 58.157 58.157 57.741 0.416 25685 7790 1 11 . 1 1 47 47 LEU CB C 47 41.858 41.858 41.493 0.365 25685 7791 1 11 . 1 1 47 47 LEU H H 47 8.769 8.769 7.719 1.050 25685 7792 1 11 . 1 1 48 48 ILE N N 48 117.500 117.500 117.457 0.043 25685 7793 1 11 . 1 1 48 48 ILE C C 48 180.298 180.298 178.360 1.938 25685 7794 1 11 . 1 1 48 48 ILE CA C 48 65.627 65.627 62.589 3.038 25685 7795 1 11 . 1 1 48 48 ILE CB C 48 37.839 37.839 36.082 1.757 25685 7796 1 11 . 1 1 48 48 ILE H H 48 8.093 8.093 7.448 0.645 25685 7797 1 11 . 1 1 49 49 LEU N N 49 123.708 123.708 119.110 4.598 25685 7798 1 11 . 1 1 49 49 LEU C C 49 179.721 179.721 178.187 1.534 25685 7799 1 11 . 1 1 49 49 LEU CA C 49 58.788 58.788 56.895 1.893 25685 7800 1 11 . 1 1 49 49 LEU CB C 49 40.761 40.761 41.539 -0.778 25685 7801 1 11 . 1 1 49 49 LEU H H 49 8.833 8.833 7.526 1.307 25685 7802 1 11 . 1 1 50 50 GLY N N 50 109.284 109.284 105.272 4.012 25685 7803 1 11 . 1 1 50 50 GLY C C 50 176.937 176.937 173.630 3.307 25685 7804 1 11 . 1 1 50 50 GLY CA C 50 47.821 47.821 44.568 3.253 25685 7805 1 11 . 1 1 50 50 GLY H H 50 9.658 9.658 7.593 2.065 25685 7806 1 11 . 1 1 51 51 TYR N N 51 125.640 125.640 118.149 7.491 25685 7807 1 11 . 1 1 51 51 TYR C C 51 177.102 177.102 174.273 2.829 25685 7808 1 11 . 1 1 51 51 TYR CA C 51 61.948 61.948 57.842 4.106 25685 7809 1 11 . 1 1 51 51 TYR CB C 51 38.871 38.871 36.578 2.293 25685 7810 1 11 . 1 1 51 51 TYR H H 51 8.795 8.795 8.204 0.591 25685 7811 1 11 . 1 1 52 52 THR N N 52 116.273 116.273 115.781 0.492 25685 7812 1 11 . 1 1 52 52 THR C C 52 176.969 176.969 174.235 2.734 25685 7813 1 11 . 1 1 52 52 THR CA C 52 67.972 67.972 61.718 6.254 25685 7814 1 11 . 1 1 52 52 THR H H 52 8.456 8.456 8.164 0.292 25685 7815 1 11 . 1 1 53 53 ALA N N 53 122.122 122.122 122.835 -0.713 25685 7816 1 11 . 1 1 53 53 ALA C C 53 179.907 179.907 175.861 4.046 25685 7817 1 11 . 1 1 53 53 ALA CA C 53 55.722 55.722 51.276 4.446 25685 7818 1 11 . 1 1 53 53 ALA CB C 53 18.786 18.786 20.703 -1.917 25685 7819 1 11 . 1 1 53 53 ALA H H 53 9.058 9.058 8.341 0.717 25685 7820 1 11 . 1 1 54 54 SER N N 54 115.434 115.434 116.728 -1.294 25685 7821 1 11 . 1 1 54 54 SER C C 54 176.433 176.433 173.937 2.496 25685 7822 1 11 . 1 1 54 54 SER CA C 54 55.828 55.828 59.569 -3.741 25685 7823 1 11 . 1 1 54 54 SER H H 54 8.040 8.040 8.497 -0.457 25685 7824 1 11 . 1 1 55 55 LEU N N 55 123.045 123.045 122.105 0.940 25685 7825 1 11 . 1 1 55 55 LEU C C 55 178.789 178.789 177.037 1.752 25685 7826 1 11 . 1 1 55 55 LEU CA C 55 57.633 57.633 55.297 2.336 25685 7827 1 11 . 1 1 55 55 LEU CB C 55 41.293 41.293 39.763 1.530 25685 7828 1 11 . 1 1 55 55 LEU H H 55 8.255 8.255 8.707 -0.452 25685 7829 1 11 . 1 1 56 56 PHE N N 56 114.426 114.426 123.814 -9.388 25685 7830 1 11 . 1 1 56 56 PHE C C 56 177.507 177.507 175.228 2.279 25685 7831 1 11 . 1 1 56 56 PHE CA C 56 61.068 61.068 55.462 5.606 25685 7832 1 11 . 1 1 56 56 PHE CB C 56 40.107 40.107 37.587 2.520 25685 7833 1 11 . 1 1 56 56 PHE H H 56 7.590 7.590 8.632 -1.042 25685 7834 1 11 . 1 1 57 57 PHE N N 57 114.701 114.701 120.374 -5.673 25685 7835 1 11 . 1 1 57 57 PHE C C 57 176.203 176.203 176.342 -0.139 25685 7836 1 11 . 1 1 57 57 PHE CA C 57 58.503 58.503 57.392 1.111 25685 7837 1 11 . 1 1 57 57 PHE CB C 57 41.114 41.114 38.302 2.812 25685 7838 1 11 . 1 1 57 57 PHE H H 57 8.514 8.514 8.067 0.447 25685 7839 1 11 . 1 1 58 58 GLY N N 58 111.041 111.041 109.539 1.502 25685 7840 1 11 . 1 1 58 58 GLY C C 58 174.240 174.240 175.427 -1.187 25685 7841 1 11 . 1 1 58 58 GLY CA C 58 44.827 44.827 46.719 -1.892 25685 7842 1 11 . 1 1 58 58 GLY H H 58 7.998 7.998 8.751 -0.753 25685 7843 1 11 . 1 1 59 59 PHE N N 59 127.950 127.950 120.548 7.402 25685 7844 1 11 . 1 1 59 59 PHE C C 59 176.612 176.612 177.124 -0.512 25685 7845 1 11 . 1 1 59 59 PHE CA C 59 61.598 61.598 59.161 2.437 25685 7846 1 11 . 1 1 59 59 PHE CB C 59 40.870 40.870 38.387 2.483 25685 7847 1 11 . 1 1 59 59 PHE H H 59 9.105 9.105 7.702 1.403 25685 7848 1 11 . 1 1 60 60 PHE N N 60 114.868 114.868 119.677 -4.809 25685 7849 1 11 . 1 1 60 60 PHE C C 60 177.989 177.989 176.849 1.140 25685 7850 1 11 . 1 1 60 60 PHE CA C 60 61.517 61.517 61.742 -0.225 25685 7851 1 11 . 1 1 60 60 PHE CB C 60 38.248 38.248 39.215 -0.967 25685 7852 1 11 . 1 1 60 60 PHE H H 60 8.796 8.796 7.644 1.152 25685 7853 1 11 . 1 1 61 61 ARG N N 61 118.812 118.812 118.519 0.293 25685 7854 1 11 . 1 1 61 61 ARG C C 61 177.813 177.813 178.318 -0.505 25685 7855 1 11 . 1 1 61 61 ARG CA C 61 60.497 60.497 58.640 1.857 25685 7856 1 11 . 1 1 61 61 ARG CB C 61 28.915 28.915 29.688 -0.773 25685 7857 1 11 . 1 1 61 61 ARG H H 61 7.600 7.600 7.624 -0.024 25685 7858 1 11 . 1 1 62 62 VAL N N 62 119.157 119.157 119.498 -0.341 25685 7859 1 11 . 1 1 62 62 VAL C C 62 177.670 177.670 178.000 -0.330 25685 7860 1 11 . 1 1 62 62 VAL CA C 62 66.749 66.749 65.109 1.639 25685 7861 1 11 . 1 1 62 62 VAL CB C 62 30.306 30.306 31.024 -0.718 25685 7862 1 11 . 1 1 62 62 VAL H H 62 7.679 7.679 7.363 0.316 25685 7863 1 11 . 1 1 63 63 VAL N N 63 117.999 117.999 119.182 -1.183 25685 7864 1 11 . 1 1 63 63 VAL C C 63 177.639 177.639 177.939 -0.300 25685 7865 1 11 . 1 1 63 63 VAL CA C 63 66.836 66.836 64.942 1.894 25685 7866 1 11 . 1 1 63 63 VAL CB C 63 30.496 30.496 30.265 0.232 25685 7867 1 11 . 1 1 63 63 VAL H H 63 7.429 7.429 8.009 -0.580 25685 7868 1 11 . 1 1 64 64 ALA N N 64 120.451 120.451 121.937 -1.486 25685 7869 1 11 . 1 1 64 64 ALA C C 64 179.134 179.134 179.498 -0.364 25685 7870 1 11 . 1 1 64 64 ALA CA C 64 55.618 55.618 55.106 0.512 25685 7871 1 11 . 1 1 64 64 ALA CB C 64 17.950 17.950 17.795 0.155 25685 7872 1 11 . 1 1 64 64 ALA H H 64 8.169 8.169 7.656 0.513 25685 7873 1 11 . 1 1 65 65 MET N N 65 116.532 116.532 115.206 1.326 25685 7874 1 11 . 1 1 65 65 MET C C 65 177.961 177.961 177.774 0.187 25685 7875 1 11 . 1 1 65 65 MET CA C 65 58.161 58.161 56.611 1.550 25685 7876 1 11 . 1 1 65 65 MET CB C 65 31.208 31.208 30.991 0.218 25685 7877 1 11 . 1 1 65 65 MET H H 65 7.857 7.857 7.327 0.530 25685 7878 1 11 . 1 1 66 66 LEU C C 66 179.022 179.022 179.353 -0.331 25685 7879 1 11 . 1 1 66 66 LEU CA C 66 58.412 58.412 57.111 1.301 25685 7880 1 11 . 1 1 67 67 PHE N N 67 116.877 116.877 120.989 -4.112 25685 7881 1 11 . 1 1 67 67 PHE C C 67 177.908 177.908 177.413 0.495 25685 7882 1 11 . 1 1 67 67 PHE CA C 67 62.402 62.402 61.255 1.147 25685 7883 1 11 . 1 1 67 67 PHE CB C 67 39.203 39.203 38.839 0.364 25685 7884 1 11 . 1 1 67 67 PHE H H 67 7.923 7.923 7.584 0.339 25685 7885 1 11 . 1 1 68 68 LEU N N 68 118.860 118.860 119.639 -0.779 25685 7886 1 11 . 1 1 68 68 LEU C C 68 179.032 179.032 178.363 0.669 25685 7887 1 11 . 1 1 68 68 LEU CA C 68 58.397 58.397 57.150 1.248 25685 7888 1 11 . 1 1 68 68 LEU CB C 68 40.803 40.803 40.211 0.592 25685 7889 1 11 . 1 1 68 68 LEU H H 68 8.167 8.167 7.297 0.870 25685 7890 1 11 . 1 1 71 71 PHE N N 71 120.700 120.700 119.102 1.598 25685 7891 1 11 . 1 1 71 71 PHE C C 71 177.670 177.670 176.947 0.723 25685 7892 1 11 . 1 1 71 71 PHE CA C 71 60.528 60.528 60.965 -0.437 25685 7893 1 11 . 1 1 71 71 PHE H H 71 7.847 7.847 7.574 0.273 25685 7894 1 11 . 1 1 72 72 ALA N N 72 120.506 120.506 122.542 -2.036 25685 7895 1 11 . 1 1 72 72 ALA C C 72 178.944 178.944 179.425 -0.481 25685 7896 1 11 . 1 1 72 72 ALA CA C 72 55.461 55.461 55.027 0.434 25685 7897 1 11 . 1 1 72 72 ALA CB C 72 17.829 17.829 18.300 -0.471 25685 7898 1 11 . 1 1 72 72 ALA H H 72 8.533 8.533 7.788 0.745 25685 7899 1 11 . 1 1 73 73 LEU N N 73 115.071 115.071 119.244 -4.173 25685 7900 1 11 . 1 1 73 73 LEU C C 73 180.831 180.831 178.873 1.958 25685 7901 1 11 . 1 1 73 73 LEU CA C 73 58.091 58.091 58.154 -0.063 25685 7902 1 11 . 1 1 73 73 LEU CB C 73 41.082 41.082 41.591 -0.509 25685 7903 1 11 . 1 1 73 73 LEU H H 73 8.458 8.458 7.999 0.459 25685 7904 1 11 . 1 1 74 74 ILE N N 74 121.365 121.365 114.782 6.583 25685 7905 1 11 . 1 1 74 74 ILE C C 74 178.287 178.287 177.429 0.858 25685 7906 1 11 . 1 1 74 74 ILE CA C 74 65.335 65.335 64.403 0.932 25685 7907 1 11 . 1 1 74 74 ILE CB C 74 37.453 37.453 37.161 0.292 25685 7908 1 11 . 1 1 74 74 ILE H H 74 8.220 8.220 7.187 1.033 25685 7909 1 11 . 1 1 75 75 LEU N N 75 119.200 119.200 120.529 -1.329 25685 7910 1 11 . 1 1 75 75 LEU C C 75 177.548 177.548 178.057 -0.509 25685 7911 1 11 . 1 1 75 75 LEU CA C 75 56.938 56.938 57.091 -0.153 25685 7912 1 11 . 1 1 75 75 LEU CB C 75 41.541 41.541 40.889 0.652 25685 7913 1 11 . 1 1 75 75 LEU H H 75 7.866 7.866 7.193 0.673 25685 7914 1 11 . 1 1 76 76 LEU N N 76 116.338 116.338 116.821 -0.483 25685 7915 1 11 . 1 1 76 76 LEU C C 76 176.889 176.889 178.511 -1.622 25685 7916 1 11 . 1 1 76 76 LEU CA C 76 54.807 54.807 56.992 -2.185 25685 7917 1 11 . 1 1 76 76 LEU CB C 76 41.830 41.830 42.205 -0.374 25685 7918 1 11 . 1 1 76 76 LEU H H 76 7.432 7.432 7.983 -0.551 25685 7919 1 11 . 1 1 77 77 SER N N 77 114.630 114.630 113.262 1.368 25685 7920 1 11 . 1 1 77 77 SER C C 77 174.752 174.752 174.563 0.189 25685 7921 1 11 . 1 1 77 77 SER CA C 77 58.967 58.967 60.211 -1.244 25685 7922 1 11 . 1 1 77 77 SER CB C 77 64.686 64.686 63.848 0.838 25685 7923 1 11 . 1 1 77 77 SER H H 77 7.423 7.423 7.793 -0.370 25685 7924 1 11 . 1 1 78 78 ASP N N 78 123.054 123.054 120.957 2.097 25685 7925 1 11 . 1 1 78 78 ASP C C 78 176.716 176.716 174.810 1.906 25685 7926 1 11 . 1 1 78 78 ASP CA C 78 54.848 54.848 53.862 0.986 25685 7927 1 11 . 1 1 78 78 ASP CB C 78 40.423 40.423 41.521 -1.098 25685 7928 1 11 . 1 1 78 78 ASP H H 78 8.294 8.294 7.798 0.496 25685 7929 1 11 . 1 1 79 79 GLU N N 79 119.104 119.104 116.322 2.782 25685 7930 1 11 . 1 1 79 79 GLU C C 79 176.391 176.391 175.776 0.615 25685 7931 1 11 . 1 1 79 79 GLU CA C 79 56.258 56.258 57.230 -0.972 25685 7932 1 11 . 1 1 79 79 GLU CB C 79 29.656 29.656 29.788 -0.132 25685 7933 1 11 . 1 1 79 79 GLU H H 79 8.384 8.384 8.366 0.018 25685 7934 1 11 . 1 1 80 80 LEU N N 80 121.254 121.254 119.065 2.189 25685 7935 1 11 . 1 1 80 80 LEU C C 80 177.164 177.164 175.671 1.493 25685 7936 1 11 . 1 1 80 80 LEU CA C 80 54.670 54.670 53.980 0.690 25685 7937 1 11 . 1 1 80 80 LEU CB C 80 42.633 42.633 42.397 0.236 25685 7938 1 11 . 1 1 80 80 LEU H H 80 7.637 7.637 8.389 -0.752 25685 7939 1 11 . 1 1 81 81 ASP N N 81 123.410 123.410 124.807 -1.397 25685 7940 1 11 . 1 1 81 81 ASP C C 81 177.552 177.552 175.588 1.964 25685 7941 1 11 . 1 1 81 81 ASP CA C 81 55.110 55.110 52.627 2.483 25685 7942 1 11 . 1 1 81 81 ASP CB C 81 42.693 42.693 43.495 -0.802 25685 7943 1 11 . 1 1 81 81 ASP H H 81 8.403 8.403 8.204 0.199 25685 7944 1 11 . 1 1 82 82 GLU N N 82 125.047 125.047 116.914 8.133 25685 7945 1 11 . 1 1 82 82 GLU C C 82 178.198 178.198 178.529 -0.331 25685 7946 1 11 . 1 1 82 82 GLU CA C 82 59.221 59.221 58.085 1.136 25685 7947 1 11 . 1 1 82 82 GLU CB C 82 29.176 29.176 29.968 -0.792 25685 7948 1 11 . 1 1 82 82 GLU H H 82 8.744 8.744 8.398 0.346 25685 7949 1 11 . 1 1 83 83 LYS N N 83 118.476 118.476 120.744 -2.268 25685 7950 1 11 . 1 1 83 83 LYS C C 83 179.356 179.356 178.984 0.372 25685 7951 1 11 . 1 1 83 83 LYS CA C 83 59.170 59.170 58.775 0.395 25685 7952 1 11 . 1 1 83 83 LYS CB C 83 31.509 31.509 31.769 -0.260 25685 7953 1 11 . 1 1 83 83 LYS H H 83 8.607 8.607 7.949 0.658 25685 7954 1 11 . 1 1 84 84 VAL N N 84 118.407 118.407 115.577 2.830 25685 7955 1 11 . 1 1 84 84 VAL C C 84 177.653 177.653 177.723 -0.070 25685 7956 1 11 . 1 1 84 84 VAL CA C 84 65.416 65.416 66.403 -0.987 25685 7957 1 11 . 1 1 84 84 VAL CB C 84 31.313 31.313 30.795 0.518 25685 7958 1 11 . 1 1 84 84 VAL H H 84 7.870 7.870 8.064 -0.194 25685 7959 1 11 . 1 1 85 85 SER N N 85 116.146 116.146 117.132 -0.986 25685 7960 1 11 . 1 1 85 85 SER C C 85 177.496 177.496 177.061 0.435 25685 7961 1 11 . 1 1 85 85 SER CA C 85 61.764 61.764 61.148 0.616 25685 7962 1 11 . 1 1 85 85 SER CB C 85 63.654 63.654 62.977 0.677 25685 7963 1 11 . 1 1 85 85 SER H H 85 8.083 8.083 7.538 0.545 25685 7964 1 11 . 1 1 86 86 ILE N N 86 122.570 122.570 122.251 0.319 25685 7965 1 11 . 1 1 86 86 ILE C C 86 178.698 178.698 177.566 1.132 25685 7966 1 11 . 1 1 86 86 ILE CA C 86 64.526 64.526 62.665 1.861 25685 7967 1 11 . 1 1 86 86 ILE CB C 86 37.393 37.393 36.778 0.615 25685 7968 1 11 . 1 1 86 86 ILE H H 86 8.102 8.102 7.522 0.580 25685 7969 1 11 . 1 1 87 87 PHE N N 87 121.340 121.340 121.557 -0.217 25685 7970 1 11 . 1 1 87 87 PHE C C 87 177.671 177.671 176.688 0.983 25685 7971 1 11 . 1 1 87 87 PHE CA C 87 61.098 61.098 61.913 -0.815 25685 7972 1 11 . 1 1 87 87 PHE CB C 87 39.151 39.151 38.387 0.764 25685 7973 1 11 . 1 1 87 87 PHE H H 87 7.719 7.719 8.740 -1.021 25685 7974 1 11 . 1 1 88 88 ALA N N 88 120.921 120.921 120.518 0.403 25685 7975 1 11 . 1 1 88 88 ALA C C 88 180.030 180.030 179.389 0.641 25685 7976 1 11 . 1 1 88 88 ALA CA C 88 55.147 55.147 54.552 0.595 25685 7977 1 11 . 1 1 88 88 ALA CB C 88 19.053 19.053 17.874 1.179 25685 7978 1 11 . 1 1 88 88 ALA H H 88 8.679 8.679 7.855 0.824 25685 7979 1 11 . 1 1 89 89 SER N N 89 114.285 114.285 114.284 0.001 25685 7980 1 11 . 1 1 89 89 SER C C 89 177.040 177.040 176.468 0.572 25685 7981 1 11 . 1 1 89 89 SER CA C 89 61.314 61.314 61.111 0.203 25685 7982 1 11 . 1 1 89 89 SER CB C 89 63.371 63.371 62.976 0.395 25685 7983 1 11 . 1 1 89 89 SER H H 89 8.242 8.242 7.711 0.531 25685 7984 1 11 . 1 1 90 90 ARG N N 90 121.829 121.829 120.492 1.337 25685 7985 1 11 . 1 1 90 90 ARG C C 90 179.247 179.247 177.836 1.411 25685 7986 1 11 . 1 1 90 90 ARG CA C 90 58.444 58.444 58.312 0.132 25685 7987 1 11 . 1 1 90 90 ARG CB C 90 29.532 29.532 29.129 0.403 25685 7988 1 11 . 1 1 90 90 ARG H H 90 7.907 7.907 7.913 -0.006 25685 7989 1 11 . 1 1 91 91 MET N N 91 117.124 117.124 116.566 0.558 25685 7990 1 11 . 1 1 91 91 MET C C 91 177.504 177.504 177.717 -0.213 25685 7991 1 11 . 1 1 91 91 MET CA C 91 57.152 57.152 59.618 -2.466 25685 7992 1 11 . 1 1 91 91 MET CB C 91 32.510 32.510 31.825 0.685 25685 7993 1 11 . 1 1 91 91 MET H H 91 7.930 7.930 7.521 0.409 25685 7994 1 11 . 1 1 92 92 THR N N 92 108.478 108.478 112.570 -4.092 25685 7995 1 11 . 1 1 92 92 THR C C 92 176.367 176.367 176.326 0.041 25685 7996 1 11 . 1 1 92 92 THR CA C 92 63.564 63.564 65.260 -1.696 25685 7997 1 11 . 1 1 92 92 THR H H 92 7.847 7.847 7.653 0.194 25685 7998 1 11 . 1 1 93 93 SER N N 93 117.950 117.950 117.506 0.444 25685 7999 1 11 . 1 1 93 93 SER C C 93 176.552 176.552 176.295 0.257 25685 8000 1 11 . 1 1 93 93 SER CA C 93 60.821 60.821 61.559 -0.738 25685 8001 1 11 . 1 1 93 93 SER CB C 93 63.311 63.311 63.386 -0.075 25685 8002 1 11 . 1 1 93 93 SER H H 93 7.732 7.732 7.537 0.195 25685 8003 1 11 . 1 1 94 94 GLY N N 94 111.265 111.265 107.119 4.146 25685 8004 1 11 . 1 1 94 94 GLY C C 94 175.198 175.198 174.710 0.488 25685 8005 1 11 . 1 1 94 94 GLY CA C 94 46.021 46.021 44.997 1.024 25685 8006 1 11 . 1 1 94 94 GLY H H 94 8.419 8.419 7.921 0.498 25685 8007 1 11 . 1 1 95 95 LEU N N 95 121.019 121.019 119.432 1.587 25685 8008 1 11 . 1 1 95 95 LEU C C 95 177.810 177.810 175.822 1.988 25685 8009 1 11 . 1 1 95 95 LEU CA C 95 56.012 56.012 56.392 -0.380 25685 8010 1 11 . 1 1 95 95 LEU CB C 95 42.122 42.122 41.437 0.685 25685 8011 1 11 . 1 1 95 95 LEU H H 95 7.849 7.849 7.500 0.349 25685 8012 1 11 . 1 1 96 96 SER N N 96 115.465 115.465 119.128 -3.663 25685 8013 1 11 . 1 1 96 96 SER C C 96 175.543 175.543 174.023 1.520 25685 8014 1 11 . 1 1 96 96 SER CA C 96 60.151 60.151 57.508 2.643 25685 8015 1 11 . 1 1 96 96 SER H H 96 8.349 8.349 8.099 0.250 25685 8016 1 11 . 1 1 97 97 TRP N N 97 121.711 121.711 122.728 -1.017 25685 8017 1 11 . 1 1 97 97 TRP C C 97 176.973 176.973 176.999 -0.026 25685 8018 1 11 . 1 1 97 97 TRP CA C 97 58.250 58.250 57.031 1.219 25685 8019 1 11 . 1 1 97 97 TRP CB C 97 28.899 28.899 30.459 -1.560 25685 8020 1 11 . 1 1 97 97 TRP H H 97 7.723 7.723 8.082 -0.359 25685 8021 1 11 . 1 1 98 98 LYS N N 98 119.868 119.868 117.915 1.953 25685 8022 1 11 . 1 1 98 98 LYS C C 98 178.021 178.021 176.650 1.371 25685 8023 1 11 . 1 1 98 98 LYS CA C 98 56.340 56.340 57.459 -1.119 25685 8024 1 11 . 1 1 98 98 LYS CB C 98 31.933 31.933 34.503 -2.570 25685 8025 1 11 . 1 1 98 98 LYS H H 98 7.855 7.855 8.893 -1.038 25685 8026 1 11 . 1 1 99 99 ILE N N 99 120.044 120.044 117.825 2.219 25685 8027 1 11 . 1 1 99 99 ILE C C 99 176.769 176.769 176.400 0.369 25685 8028 1 11 . 1 1 99 99 ILE CA C 99 62.758 62.758 61.673 1.085 25685 8029 1 11 . 1 1 99 99 ILE CB C 99 37.809 37.809 39.715 -1.906 25685 8030 1 11 . 1 1 99 99 ILE H H 99 8.069 8.069 8.120 -0.051 25685 8031 1 11 . 1 1 100 100 GLN C C 100 176.315 176.315 175.099 1.216 25685 8032 1 11 . 1 1 100 100 GLN CA C 100 57.486 57.486 56.528 0.958 25685 8033 1 11 . 1 1 101 101 THR N N 101 109.873 109.873 114.680 -4.807 25685 8034 1 11 . 1 1 101 101 THR C C 101 174.664 174.664 173.341 1.323 25685 8035 1 11 . 1 1 101 101 THR CA C 101 61.709 61.709 61.972 -0.263 25685 8036 1 11 . 1 1 101 101 THR CB C 101 69.290 69.290 70.111 -0.821 25685 8037 1 11 . 1 1 101 101 THR H H 101 7.508 7.508 7.907 -0.399 25685 8038 1 11 . 1 1 102 102 LEU N N 102 124.434 124.434 122.852 1.582 25685 8039 1 11 . 1 1 102 102 LEU C C 102 174.681 174.681 173.843 0.838 25685 8040 1 11 . 1 1 102 102 LEU CA C 102 53.063 53.063 53.760 -0.696 25685 8041 1 11 . 1 1 102 102 LEU CB C 102 41.139 41.139 42.353 -1.214 25685 8042 1 11 . 1 1 102 102 LEU H H 102 7.569 7.569 7.817 -0.248 25685 8043 1 11 . 1 1 103 103 PRO C C 103 178.076 178.076 175.873 2.203 25685 8044 1 11 . 1 1 103 103 PRO CA C 103 62.570 62.570 63.245 -0.675 25685 8045 1 11 . 1 1 103 103 PRO CB C 103 31.534 31.534 32.503 -0.969 25685 8046 1 11 . 1 1 104 104 SER N N 104 119.929 119.929 114.482 5.447 25685 8047 1 11 . 1 1 104 104 SER C C 104 176.432 176.432 173.918 2.514 25685 8048 1 11 . 1 1 104 104 SER CA C 104 61.976 61.976 58.118 3.858 25685 8049 1 11 . 1 1 104 104 SER CB C 104 63.611 63.611 63.716 -0.105 25685 8050 1 11 . 1 1 104 104 SER H H 104 8.784 8.784 8.129 0.655 25685 8051 1 11 . 1 1 105 105 PHE N N 105 119.519 119.519 121.666 -2.147 25685 8052 1 11 . 1 1 105 105 PHE C C 105 176.852 176.852 174.839 2.013 25685 8053 1 11 . 1 1 105 105 PHE CA C 105 60.162 60.162 55.644 4.518 25685 8054 1 11 . 1 1 105 105 PHE CB C 105 38.455 38.455 36.636 1.819 25685 8055 1 11 . 1 1 105 105 PHE H H 105 8.620 8.620 7.995 0.625 25685 8056 1 11 . 1 1 106 106 PHE N N 106 118.809 118.809 118.901 -0.092 25685 8057 1 11 . 1 1 106 106 PHE C C 106 176.741 176.741 175.555 1.186 25685 8058 1 11 . 1 1 106 106 PHE CA C 106 61.421 61.421 58.469 2.952 25685 8059 1 11 . 1 1 106 106 PHE CB C 106 38.788 38.788 36.206 2.582 25685 8060 1 11 . 1 1 106 106 PHE H H 106 7.519 7.519 8.647 -1.128 25685 8061 1 11 . 1 1 107 107 PHE N N 107 117.382 117.382 122.205 -4.823 25685 8062 1 11 . 1 1 107 107 PHE C C 107 177.771 177.771 177.166 0.605 25685 8063 1 11 . 1 1 107 107 PHE CA C 107 61.099 61.099 62.383 -1.284 25685 8064 1 11 . 1 1 107 107 PHE CB C 107 38.677 38.677 39.368 -0.691 25685 8065 1 11 . 1 1 107 107 PHE H H 107 7.903 7.903 8.532 -0.629 25685 8066 1 11 . 1 1 108 108 GLY N N 108 105.340 105.340 105.988 -0.648 25685 8067 1 11 . 1 1 108 108 GLY C C 108 174.574 174.574 175.898 -1.324 25685 8068 1 11 . 1 1 108 108 GLY CA C 108 47.508 47.508 47.376 0.132 25685 8069 1 11 . 1 1 108 108 GLY H H 108 8.351 8.351 8.970 -0.619 25685 8070 1 11 . 1 1 109 109 MET N N 109 119.831 119.831 120.945 -1.114 25685 8071 1 11 . 1 1 109 109 MET C C 109 177.522 177.522 178.576 -1.054 25685 8072 1 11 . 1 1 109 109 MET CA C 109 58.658 58.658 55.975 2.683 25685 8073 1 11 . 1 1 109 109 MET CB C 109 32.106 32.106 31.194 0.912 25685 8074 1 11 . 1 1 109 109 MET H H 109 7.919 7.919 8.101 -0.182 25685 8075 1 11 . 1 1 110 110 LEU N N 110 119.908 119.908 117.817 2.091 25685 8076 1 11 . 1 1 110 110 LEU C C 110 178.170 178.170 178.196 -0.026 25685 8077 1 11 . 1 1 110 110 LEU CA C 110 57.941 57.941 58.299 -0.358 25685 8078 1 11 . 1 1 110 110 LEU CB C 110 41.055 41.055 40.883 0.172 25685 8079 1 11 . 1 1 110 110 LEU H H 110 7.744 7.744 7.573 0.171 25685 8080 1 11 . 1 1 111 111 LEU N N 111 116.594 116.594 116.494 0.100 25685 8081 1 11 . 1 1 111 111 LEU C C 111 178.960 178.960 178.365 0.595 25685 8082 1 11 . 1 1 111 111 LEU CA C 111 57.366 57.366 57.606 -0.240 25685 8083 1 11 . 1 1 111 111 LEU CB C 111 40.259 40.259 40.486 -0.227 25685 8084 1 11 . 1 1 111 111 LEU H H 111 7.732 7.732 7.401 0.331 25685 8085 1 11 . 1 1 112 112 ALA N N 112 121.020 121.020 120.932 0.088 25685 8086 1 11 . 1 1 112 112 ALA C C 112 178.700 178.700 178.736 -0.036 25685 8087 1 11 . 1 1 112 112 ALA CA C 112 55.432 55.432 54.518 0.914 25685 8088 1 11 . 1 1 112 112 ALA CB C 112 18.214 18.214 18.053 0.161 25685 8089 1 11 . 1 1 112 112 ALA H H 112 8.121 8.121 7.251 0.870 25685 8090 1 11 . 1 1 113 113 PHE N N 113 118.369 118.369 118.246 0.123 25685 8091 1 11 . 1 1 113 113 PHE C C 113 176.091 176.091 177.200 -1.109 25685 8092 1 11 . 1 1 113 113 PHE CA C 113 61.388 61.388 60.515 0.873 25685 8093 1 11 . 1 1 113 113 PHE CB C 113 39.688 39.688 38.988 0.700 25685 8094 1 11 . 1 1 113 113 PHE H H 113 8.237 8.237 7.269 0.968 25685 8095 1 11 . 1 1 114 114 LEU N N 114 114.214 114.214 119.876 -5.662 25685 8096 1 11 . 1 1 114 114 LEU C C 114 177.038 177.038 178.041 -1.003 25685 8097 1 11 . 1 1 114 114 LEU CA C 114 56.358 56.358 58.091 -1.733 25685 8098 1 11 . 1 1 114 114 LEU CB C 114 42.716 42.716 42.109 0.606 25685 8099 1 11 . 1 1 114 114 LEU H H 114 7.576 7.576 7.479 0.097 25685 8100 1 11 . 1 1 115 115 TRP N N 115 112.667 112.667 116.123 -3.456 25685 8101 1 11 . 1 1 115 115 TRP C C 115 180.163 180.163 177.471 2.692 25685 8102 1 11 . 1 1 115 115 TRP CA C 115 55.930 55.930 59.078 -3.148 25685 8103 1 11 . 1 1 115 115 TRP H H 115 8.542 8.542 7.075 1.467 25685 8104 1 11 . 1 1 116 116 LEU N N 116 122.144 122.144 121.031 1.113 25685 8105 1 11 . 1 1 116 116 LEU C C 116 175.953 175.953 175.923 0.030 25685 8106 1 11 . 1 1 116 116 LEU CA C 116 59.924 59.924 58.540 1.384 25685 8107 1 11 . 1 1 116 116 LEU CB C 116 39.097 39.097 40.246 -1.149 25685 8108 1 11 . 1 1 116 116 LEU H H 116 8.996 8.996 6.783 2.213 25685 8109 1 11 . 1 1 117 117 PRO C C 117 174.220 174.220 177.722 -3.502 25685 8110 1 11 . 1 1 117 117 PRO CA C 117 66.300 66.300 64.303 1.997 25685 8111 1 11 . 1 1 118 118 ALA N N 118 110.603 110.603 120.411 -9.808 25685 8112 1 11 . 1 1 118 118 ALA C C 118 177.162 177.162 178.761 -1.599 25685 8113 1 11 . 1 1 118 118 ALA CA C 118 52.670 52.670 52.818 -0.148 25685 8114 1 11 . 1 1 118 118 ALA CB C 118 18.853 18.853 19.526 -0.673 25685 8115 1 11 . 1 1 118 118 ALA H H 118 6.633 6.633 7.495 -0.862 25685 8116 1 11 . 1 1 119 119 ILE N N 119 113.492 113.492 115.680 -2.188 25685 8117 1 11 . 1 1 119 119 ILE CA C 119 63.703 63.703 63.844 -0.141 25685 8118 1 11 . 1 1 119 119 ILE CB C 119 39.605 39.605 36.909 2.696 25685 8119 1 11 . 1 1 119 119 ILE H H 119 7.693 7.693 8.374 -0.681 25685 8120 1 11 . 1 1 121 121 PRO C C 121 178.089 178.089 179.238 -1.149 25685 8121 1 11 . 1 1 121 121 PRO CA C 121 66.004 66.004 65.675 0.329 25685 8122 1 11 . 1 1 122 122 PHE N N 122 113.797 113.797 119.781 -5.984 25685 8123 1 11 . 1 1 122 122 PHE C C 122 177.713 177.713 177.284 0.429 25685 8124 1 11 . 1 1 122 122 PHE CA C 122 61.566 61.566 60.498 1.069 25685 8125 1 11 . 1 1 122 122 PHE CB C 122 38.983 38.983 38.798 0.185 25685 8126 1 11 . 1 1 122 122 PHE H H 122 6.846 6.846 8.188 -1.342 25685 8127 1 11 . 1 1 123 123 ALA N N 123 121.512 121.512 121.797 -0.285 25685 8128 1 11 . 1 1 123 123 ALA C C 123 179.318 179.318 179.945 -0.627 25685 8129 1 11 . 1 1 123 123 ALA CA C 123 54.975 54.975 54.959 0.016 25685 8130 1 11 . 1 1 123 123 ALA CB C 123 17.881 17.881 18.300 -0.419 25685 8131 1 11 . 1 1 123 123 ALA H H 123 8.411 8.411 8.613 -0.202 25685 8132 1 11 . 1 1 124 124 GLY N N 124 104.093 104.093 106.993 -2.900 25685 8133 1 11 . 1 1 124 124 GLY C C 124 175.410 175.410 176.153 -0.743 25685 8134 1 11 . 1 1 124 124 GLY CA C 124 47.370 47.370 46.716 0.654 25685 8135 1 11 . 1 1 124 124 GLY H H 124 8.455 8.455 7.754 0.701 25685 8136 1 11 . 1 1 125 125 ILE N N 125 121.895 121.895 122.393 -0.498 25685 8137 1 11 . 1 1 125 125 ILE C C 125 178.329 178.329 177.064 1.265 25685 8138 1 11 . 1 1 125 125 ILE CA C 125 64.412 64.412 63.755 0.657 25685 8139 1 11 . 1 1 125 125 ILE H H 125 7.954 7.954 7.883 0.071 25685 8140 1 11 . 1 1 126 126 ALA N N 126 122.768 122.768 121.423 1.345 25685 8141 1 11 . 1 1 126 126 ALA C C 126 180.341 180.341 178.997 1.344 25685 8142 1 11 . 1 1 126 126 ALA CA C 126 55.266 55.266 55.247 0.019 25685 8143 1 11 . 1 1 126 126 ALA CB C 126 18.226 18.226 17.707 0.519 25685 8144 1 11 . 1 1 126 126 ALA H H 126 8.142 8.142 7.439 0.703 25685 8145 1 11 . 1 1 127 127 ILE N N 127 116.752 116.752 114.952 1.800 25685 8146 1 11 . 1 1 127 127 ILE C C 127 177.993 177.993 177.932 0.061 25685 8147 1 11 . 1 1 127 127 ILE CA C 127 63.877 63.877 63.954 -0.077 25685 8148 1 11 . 1 1 127 127 ILE CB C 127 37.657 37.657 37.162 0.495 25685 8149 1 11 . 1 1 127 127 ILE H H 127 8.335 8.335 7.299 1.036 25685 8150 1 11 . 1 1 128 128 SER N N 128 116.351 116.351 115.345 1.006 25685 8151 1 11 . 1 1 128 128 SER C C 128 175.796 175.796 176.478 -0.682 25685 8152 1 11 . 1 1 128 128 SER CA C 128 61.818 61.818 61.142 0.676 25685 8153 1 11 . 1 1 128 128 SER H H 128 7.939 7.939 7.682 0.257 25685 8154 1 11 . 1 1 129 129 GLN N N 129 118.082 118.082 119.501 -1.419 25685 8155 1 11 . 1 1 129 129 GLN C C 129 177.419 177.419 177.838 -0.419 25685 8156 1 11 . 1 1 129 129 GLN CA C 129 57.106 57.106 58.450 -1.344 25685 8157 1 11 . 1 1 129 129 GLN CB C 129 28.631 28.631 28.381 0.250 25685 8158 1 11 . 1 1 129 129 GLN H H 129 7.943 7.943 7.578 0.365 25685 8159 1 11 . 1 1 130 130 THR N N 130 113.484 113.484 114.700 -1.216 25685 8160 1 11 . 1 1 130 130 THR C C 130 175.627 175.627 174.967 0.660 25685 8161 1 11 . 1 1 130 130 THR CA C 130 63.758 63.758 65.374 -1.616 25685 8162 1 11 . 1 1 130 130 THR CB C 130 69.182 69.182 68.904 0.278 25685 8163 1 11 . 1 1 130 130 THR H H 130 7.686 7.686 7.561 0.125 25685 8164 1 11 . 1 1 131 131 LEU N N 131 121.347 121.347 118.675 2.672 25685 8165 1 11 . 1 1 131 131 LEU C C 131 177.522 177.522 175.600 1.922 25685 8166 1 11 . 1 1 131 131 LEU CA C 131 56.307 56.307 54.383 1.923 25685 8167 1 11 . 1 1 131 131 LEU CB C 131 41.711 41.711 42.880 -1.169 25685 8168 1 11 . 1 1 131 131 LEU H H 131 8.071 8.071 7.131 0.940 25685 8169 1 11 . 1 1 132 132 LEU N N 132 118.162 118.162 119.187 -1.025 25685 8170 1 11 . 1 1 132 132 LEU C C 132 177.461 177.461 176.367 1.094 25685 8171 1 11 . 1 1 132 132 LEU CA C 132 55.264 55.264 54.266 0.999 25685 8172 1 11 . 1 1 132 132 LEU CB C 132 41.613 41.613 41.302 0.311 25685 8173 1 11 . 1 1 132 132 LEU H H 132 7.810 7.810 8.358 -0.548 25685 8174 1 11 . 1 1 133 133 SER N N 133 114.244 114.244 116.764 -2.520 25685 8175 1 11 . 1 1 133 133 SER C C 133 174.363 174.363 174.700 -0.337 25685 8176 1 11 . 1 1 133 133 SER CA C 133 59.019 59.019 58.930 0.089 25685 8177 1 11 . 1 1 133 133 SER CB C 133 64.634 64.634 63.985 0.649 25685 8178 1 11 . 1 1 133 133 SER H H 133 7.829 7.829 8.162 -0.333 25685 8179 1 11 . 1 1 134 134 GLU N N 134 120.151 120.151 123.722 -3.571 25685 8180 1 11 . 1 1 134 134 GLU C C 134 175.935 175.935 174.769 1.166 25685 8181 1 11 . 1 1 134 134 GLU CA C 134 56.301 56.301 55.834 0.467 25685 8182 1 11 . 1 1 134 134 GLU CB C 134 30.129 30.129 29.387 0.743 25685 8183 1 11 . 1 1 134 134 GLU H H 134 8.054 8.054 8.596 -0.542 25685 8184 1 11 . 1 1 135 135 ASN N N 135 118.890 118.890 118.858 0.032 25685 8185 1 11 . 1 1 135 135 ASN C C 135 174.272 174.272 174.302 -0.030 25685 8186 1 11 . 1 1 135 135 ASN CA C 135 51.390 51.390 53.380 -1.990 25685 8187 1 11 . 1 1 135 135 ASN CB C 135 39.129 39.129 37.686 1.443 25685 8188 1 11 . 1 1 135 135 ASN H H 135 8.305 8.305 8.273 0.032 25685 8189 1 11 . 1 1 136 136 PRO C C 136 177.960 177.960 177.921 0.039 25685 8190 1 11 . 1 1 136 136 PRO CA C 136 64.530 64.530 64.260 0.270 25685 8191 1 11 . 1 1 136 136 PRO CB C 136 31.809 31.809 31.973 -0.164 25685 8192 1 11 . 1 1 137 137 LEU N N 137 117.735 117.735 120.163 -2.428 25685 8193 1 11 . 1 1 137 137 LEU C C 137 179.217 179.217 179.063 0.154 25685 8194 1 11 . 1 1 137 137 LEU CA C 137 57.039 57.039 58.101 -1.062 25685 8195 1 11 . 1 1 137 137 LEU CB C 137 40.799 40.799 40.752 0.047 25685 8196 1 11 . 1 1 137 137 LEU H H 137 8.248 8.248 7.888 0.360 25685 8197 1 11 . 1 1 138 138 VAL N N 138 119.589 119.589 120.467 -0.878 25685 8198 1 11 . 1 1 138 138 VAL C C 138 177.894 177.894 177.696 0.198 25685 8199 1 11 . 1 1 138 138 VAL CA C 138 64.727 64.727 66.197 -1.470 25685 8200 1 11 . 1 1 138 138 VAL CB C 138 31.347 31.347 31.436 -0.089 25685 8201 1 11 . 1 1 138 138 VAL H H 138 7.483 7.483 9.329 -1.846 25685 8202 1 11 . 1 1 139 139 MET N N 139 119.431 119.431 119.691 -0.260 25685 8203 1 11 . 1 1 139 139 MET C C 139 177.988 177.988 178.410 -0.422 25685 8204 1 11 . 1 1 139 139 MET CA C 139 57.403 57.403 59.510 -2.107 25685 8205 1 11 . 1 1 139 139 MET CB C 139 31.709 31.709 32.274 -0.565 25685 8206 1 11 . 1 1 139 139 MET H H 139 7.837 7.837 7.578 0.259 25685 8207 1 11 . 1 1 140 140 LEU N N 140 119.686 119.686 120.581 -0.895 25685 8208 1 11 . 1 1 140 140 LEU C C 140 177.916 177.916 178.535 -0.619 25685 8209 1 11 . 1 1 140 140 LEU CA C 140 56.877 56.877 58.303 -1.426 25685 8210 1 11 . 1 1 140 140 LEU CB C 140 41.491 41.491 41.838 -0.347 25685 8211 1 11 . 1 1 140 140 LEU H H 140 7.926 7.926 8.665 -0.739 25685 8212 1 11 . 1 1 141 141 SER N N 141 114.167 114.167 115.213 -1.046 25685 8213 1 11 . 1 1 141 141 SER C C 141 176.030 176.030 176.922 -0.892 25685 8214 1 11 . 1 1 141 141 SER CA C 141 60.425 60.425 61.857 -1.432 25685 8215 1 11 . 1 1 141 141 SER CB C 141 63.956 63.956 63.345 0.611 25685 8216 1 11 . 1 1 141 141 SER H H 141 7.757 7.757 8.223 -0.466 25685 8217 1 11 . 1 1 142 142 TYR N N 142 121.679 121.679 123.181 -1.502 25685 8218 1 11 . 1 1 142 142 TYR C C 142 177.659 177.659 177.773 -0.114 25685 8219 1 11 . 1 1 142 142 TYR CA C 142 59.673 59.673 61.008 -1.335 25685 8220 1 11 . 1 1 142 142 TYR CB C 142 38.079 38.079 38.397 -0.318 25685 8221 1 11 . 1 1 142 142 TYR H H 142 7.965 7.965 8.938 -0.973 25685 8222 1 11 . 1 1 143 143 GLY N N 143 107.396 107.396 107.657 -0.261 25685 8223 1 11 . 1 1 143 143 GLY C C 143 174.877 174.877 175.512 -0.635 25685 8224 1 11 . 1 1 143 143 GLY CA C 143 46.343 46.343 47.353 -1.010 25685 8225 1 11 . 1 1 143 143 GLY H H 143 8.177 8.177 8.766 -0.589 25685 8226 1 11 . 1 1 144 144 LEU N N 144 120.477 120.477 122.678 -2.201 25685 8227 1 11 . 1 1 144 144 LEU C C 144 178.504 178.504 178.890 -0.386 25685 8228 1 11 . 1 1 144 144 LEU CA C 144 56.270 56.270 57.634 -1.364 25685 8229 1 11 . 1 1 144 144 LEU CB C 144 41.662 41.662 41.702 -0.040 25685 8230 1 11 . 1 1 144 144 LEU H H 144 8.055 8.055 7.391 0.664 25685 8231 1 11 . 1 1 145 145 GLY N N 145 106.847 106.847 106.041 0.806 25685 8232 1 11 . 1 1 145 145 GLY C C 145 175.375 175.375 175.672 -0.297 25685 8233 1 11 . 1 1 145 145 GLY CA C 145 45.582 45.582 46.820 -1.238 25685 8234 1 11 . 1 1 145 145 GLY H H 145 8.066 8.066 7.554 0.512 25685 8235 1 11 . 1 1 146 146 MET N N 146 120.376 120.376 122.330 -1.954 25685 8236 1 11 . 1 1 146 146 MET C C 146 176.663 176.663 177.359 -0.696 25685 8237 1 11 . 1 1 146 146 MET CA C 146 57.030 57.030 58.844 -1.815 25685 8238 1 11 . 1 1 146 146 MET CB C 146 30.720 30.720 32.656 -1.936 25685 8239 1 11 . 1 1 146 146 MET H H 146 8.157 8.157 8.124 0.033 25685 8240 1 11 . 1 1 147 147 ALA N N 147 123.038 123.038 122.052 0.986 25685 8241 1 11 . 1 1 147 147 ALA C C 147 178.917 178.917 179.695 -0.778 25685 8242 1 11 . 1 1 147 147 ALA CA C 147 54.201 54.201 55.313 -1.112 25685 8243 1 11 . 1 1 147 147 ALA CB C 147 18.810 18.810 17.996 0.814 25685 8244 1 11 . 1 1 147 147 ALA H H 147 8.336 8.336 8.100 0.236 25685 8245 1 11 . 1 1 148 148 VAL N N 148 117.795 117.795 117.149 0.646 25685 8246 1 11 . 1 1 148 148 VAL C C 148 176.891 176.891 178.371 -1.480 25685 8247 1 11 . 1 1 148 148 VAL CA C 148 64.157 64.157 66.297 -2.140 25685 8248 1 11 . 1 1 148 148 VAL CB C 148 31.529 31.529 30.961 0.568 25685 8249 1 11 . 1 1 148 148 VAL H H 148 7.908 7.908 7.563 0.345 25685 8250 1 11 . 1 1 149 149 THR N N 149 116.069 116.069 116.890 -0.821 25685 8251 1 11 . 1 1 149 149 THR C C 149 176.054 176.054 176.865 -0.811 25685 8252 1 11 . 1 1 149 149 THR CA C 149 63.308 63.308 66.888 -3.580 25685 8253 1 11 . 1 1 149 149 THR H H 149 7.414 7.414 7.560 -0.146 25685 8254 1 11 . 1 1 150 150 ILE N N 150 121.971 121.971 120.753 1.218 25685 8255 1 11 . 1 1 150 150 ILE C C 150 177.715 177.715 177.542 0.173 25685 8256 1 11 . 1 1 150 150 ILE CA C 150 64.319 64.319 65.064 -0.745 25685 8257 1 11 . 1 1 150 150 ILE CB C 150 36.628 36.628 37.430 -0.802 25685 8258 1 11 . 1 1 150 150 ILE H H 150 8.772 8.772 8.560 0.212 25685 8259 1 11 . 1 1 151 151 ALA N N 151 122.272 122.272 121.847 0.425 25685 8260 1 11 . 1 1 151 151 ALA C C 151 180.370 180.370 179.369 1.001 25685 8261 1 11 . 1 1 151 151 ALA CA C 151 55.336 55.336 55.075 0.261 25685 8262 1 11 . 1 1 151 151 ALA CB C 151 18.107 18.107 18.025 0.082 25685 8263 1 11 . 1 1 151 151 ALA H H 151 8.163 8.163 7.510 0.653 25685 8264 1 11 . 1 1 152 152 ALA N N 152 120.648 120.648 121.089 -0.441 25685 8265 1 11 . 1 1 152 152 ALA C C 152 181.019 181.019 180.016 1.003 25685 8266 1 11 . 1 1 152 152 ALA CA C 152 54.944 54.944 54.830 0.114 25685 8267 1 11 . 1 1 152 152 ALA CB C 152 18.963 18.963 18.427 0.536 25685 8268 1 11 . 1 1 152 152 ALA H H 152 7.877 7.877 7.440 0.437 25685 8269 1 11 . 1 1 153 153 VAL N N 153 119.372 119.372 119.246 0.126 25685 8270 1 11 . 1 1 153 153 VAL C C 153 178.197 178.197 177.743 0.454 25685 8271 1 11 . 1 1 153 153 VAL CA C 153 66.289 66.289 65.259 1.030 25685 8272 1 11 . 1 1 153 153 VAL CB C 153 30.770 30.770 31.174 -0.404 25685 8273 1 11 . 1 1 153 153 VAL H H 153 8.118 8.118 7.653 0.465 25685 8274 1 11 . 1 1 154 154 PHE N N 154 120.362 120.362 120.126 0.236 25685 8275 1 11 . 1 1 154 154 PHE C C 154 177.733 177.733 177.185 0.548 25685 8276 1 11 . 1 1 154 154 PHE CA C 154 61.412 61.412 61.412 0.000 25685 8277 1 11 . 1 1 154 154 PHE CB C 154 38.465 38.465 38.773 -0.308 25685 8278 1 11 . 1 1 154 154 PHE H H 154 8.508 8.508 8.013 0.495 25685 8279 1 11 . 1 1 155 155 LYS N N 155 118.894 118.894 119.038 -0.144 25685 8280 1 11 . 1 1 155 155 LYS C C 155 179.940 179.940 178.314 1.626 25685 8281 1 11 . 1 1 155 155 LYS CA C 155 58.969 58.969 59.246 -0.277 25685 8282 1 11 . 1 1 155 155 LYS CB C 155 31.725 31.725 32.172 -0.447 25685 8283 1 11 . 1 1 155 155 LYS H H 155 8.035 8.035 7.654 0.381 25685 8284 1 11 . 1 1 156 156 MET N N 156 118.853 118.853 117.144 1.709 25685 8285 1 11 . 1 1 156 156 MET C C 156 179.245 179.245 177.961 1.284 25685 8286 1 11 . 1 1 156 156 MET CA C 156 58.518 58.518 57.517 1.001 25685 8287 1 11 . 1 1 156 156 MET CB C 156 31.912 31.912 30.566 1.346 25685 8288 1 11 . 1 1 156 156 MET H H 156 8.014 8.014 7.471 0.543 25685 8289 1 11 . 1 1 157 157 GLY N N 157 108.239 108.239 106.129 2.110 25685 8290 1 11 . 1 1 157 157 GLY C C 157 174.637 174.637 175.357 -0.720 25685 8291 1 11 . 1 1 157 157 GLY CA C 157 47.204 47.204 46.684 0.520 25685 8292 1 11 . 1 1 157 157 GLY H H 157 8.614 8.614 7.613 1.001 25685 8293 1 11 . 1 1 158 158 GLU N N 158 122.902 122.902 118.856 4.046 25685 8294 1 11 . 1 1 158 158 GLU C C 158 177.851 177.851 175.746 2.105 25685 8295 1 11 . 1 1 158 158 GLU CA C 158 60.203 60.203 56.871 3.332 25685 8296 1 11 . 1 1 158 158 GLU CB C 158 28.870 28.870 32.658 -3.788 25685 8297 1 11 . 1 1 158 158 GLU H H 158 8.550 8.550 7.706 0.844 25685 8298 1 11 . 1 1 159 159 LYS N N 159 117.932 117.932 117.254 0.678 25685 8299 1 11 . 1 1 159 159 LYS C C 159 179.529 179.529 175.553 3.976 25685 8300 1 11 . 1 1 159 159 LYS CA C 159 59.419 59.419 55.653 3.766 25685 8301 1 11 . 1 1 159 159 LYS CB C 159 31.759 31.759 33.318 -1.559 25685 8302 1 11 . 1 1 159 159 LYS H H 159 7.641 7.641 7.918 -0.277 25685 8303 1 11 . 1 1 160 160 PHE N N 160 120.614 120.614 123.655 -3.041 25685 8304 1 11 . 1 1 160 160 PHE C C 160 178.511 178.511 176.111 2.400 25685 8305 1 11 . 1 1 160 160 PHE CA C 160 61.580 61.580 59.198 2.382 25685 8306 1 11 . 1 1 160 160 PHE CB C 160 39.909 39.909 39.696 0.213 25685 8307 1 11 . 1 1 160 160 PHE H H 160 8.026 8.026 8.057 -0.031 25685 8308 1 11 . 1 1 161 161 VAL N N 161 119.870 119.870 116.706 3.164 25685 8309 1 11 . 1 1 161 161 VAL C C 161 177.347 177.347 175.890 1.457 25685 8310 1 11 . 1 1 161 161 VAL CA C 161 66.121 66.121 60.999 5.122 25685 8311 1 11 . 1 1 161 161 VAL CB C 161 30.935 30.935 33.074 -2.139 25685 8312 1 11 . 1 1 161 161 VAL H H 161 8.628 8.628 8.460 0.168 25685 8313 1 11 . 1 1 162 162 LYS N N 162 116.237 116.237 123.341 -7.104 25685 8314 1 11 . 1 1 162 162 LYS C C 162 179.197 179.197 176.616 2.581 25685 8315 1 11 . 1 1 162 162 LYS CA C 162 60.037 60.037 58.607 1.430 25685 8316 1 11 . 1 1 162 162 LYS CB C 162 31.333 31.333 32.606 -1.273 25685 8317 1 11 . 1 1 162 162 LYS H H 162 7.843 7.843 8.678 -0.835 25685 8318 1 11 . 1 1 163 163 ALA N N 163 119.197 119.197 118.412 0.785 25685 8319 1 11 . 1 1 163 163 ALA C C 163 178.635 178.635 175.359 3.276 25685 8320 1 11 . 1 1 163 163 ALA CA C 163 53.681 53.681 51.542 2.139 25685 8321 1 11 . 1 1 163 163 ALA CB C 163 19.586 19.586 18.449 1.137 25685 8322 1 11 . 1 1 163 163 ALA H H 163 7.630 7.630 7.677 -0.047 25685 8323 1 11 . 1 1 164 164 ASN N N 164 115.956 115.956 119.143 -3.187 25685 8324 1 11 . 1 1 164 164 ASN C C 164 175.556 175.556 176.617 -1.061 25685 8325 1 11 . 1 1 164 164 ASN CA C 164 52.267 52.267 52.401 -0.134 25685 8326 1 11 . 1 1 164 164 ASN CB C 164 39.148 39.148 38.406 0.742 25685 8327 1 11 . 1 1 164 164 ASN H H 164 7.326 7.326 8.153 -0.827 25685 8328 1 11 . 1 1 165 165 PHE N N 165 121.612 121.612 126.756 -5.144 25685 8329 1 11 . 1 1 165 165 PHE C C 165 177.069 177.069 176.679 0.390 25685 8330 1 11 . 1 1 165 165 PHE CA C 165 62.921 62.921 60.162 2.759 25685 8331 1 11 . 1 1 165 165 PHE CB C 165 39.427 39.427 39.407 0.020 25685 8332 1 11 . 1 1 165 165 PHE H H 165 7.408 7.408 8.909 -1.501 25685 8333 1 11 . 1 1 166 166 GLN N N 166 117.147 117.147 117.127 0.020 25685 8334 1 11 . 1 1 166 166 GLN C C 166 178.922 178.922 178.409 0.513 25685 8335 1 11 . 1 1 166 166 GLN CA C 166 59.262 59.262 57.988 1.274 25685 8336 1 11 . 1 1 166 166 GLN CB C 166 26.811 26.811 27.814 -1.004 25685 8337 1 11 . 1 1 166 166 GLN H H 166 8.605 8.605 9.091 -0.486 25685 8338 1 11 . 1 1 167 167 LEU N N 167 121.946 121.946 119.508 2.438 25685 8339 1 11 . 1 1 167 167 LEU C C 167 178.863 178.863 178.646 0.217 25685 8340 1 11 . 1 1 167 167 LEU CA C 167 58.039 58.039 57.386 0.653 25685 8341 1 11 . 1 1 167 167 LEU CB C 167 41.130 41.130 42.021 -0.891 25685 8342 1 11 . 1 1 167 167 LEU H H 167 7.892 7.892 7.637 0.255 25685 8343 1 11 . 1 1 168 168 ILE N N 168 118.751 118.751 115.349 3.402 25685 8344 1 11 . 1 1 168 168 ILE C C 168 179.908 179.908 177.187 2.721 25685 8345 1 11 . 1 1 168 168 ILE CA C 168 63.886 63.886 64.158 -0.272 25685 8346 1 11 . 1 1 168 168 ILE CB C 168 36.170 36.170 37.950 -1.780 25685 8347 1 11 . 1 1 168 168 ILE H H 168 8.065 8.065 7.361 0.704 25685 8348 1 11 . 1 1 169 169 ARG N N 169 125.851 125.851 119.066 6.785 25685 8349 1 11 . 1 1 169 169 ARG C C 169 177.579 177.579 177.958 -0.379 25685 8350 1 11 . 1 1 169 169 ARG CA C 169 60.306 60.306 58.745 1.561 25685 8351 1 11 . 1 1 169 169 ARG CB C 169 29.224 29.224 29.196 0.028 25685 8352 1 11 . 1 1 169 169 ARG H H 169 8.995 8.995 7.536 1.459 25685 8353 1 11 . 1 1 170 170 LYS N N 170 119.586 119.586 119.522 0.064 25685 8354 1 11 . 1 1 170 170 LYS C C 170 178.584 178.584 178.227 0.357 25685 8355 1 11 . 1 1 170 170 LYS CA C 170 60.293 60.293 59.179 1.114 25685 8356 1 11 . 1 1 170 170 LYS CB C 170 32.530 32.530 31.609 0.921 25685 8357 1 11 . 1 1 170 170 LYS H H 170 7.663 7.663 7.533 0.130 25685 8358 1 11 . 1 1 171 171 VAL N N 171 118.348 118.348 119.004 -0.656 25685 8359 1 11 . 1 1 171 171 VAL C C 171 177.478 177.478 177.567 -0.089 25685 8360 1 11 . 1 1 171 171 VAL CA C 171 66.641 66.641 66.112 0.529 25685 8361 1 11 . 1 1 171 171 VAL CB C 171 31.565 31.565 31.075 0.490 25685 8362 1 11 . 1 1 171 171 VAL H H 171 8.515 8.515 7.609 0.906 25685 8363 1 11 . 1 1 172 172 THR N N 172 115.172 115.172 112.748 2.424 25685 8364 1 11 . 1 1 172 172 THR C C 172 176.320 176.320 176.650 -0.330 25685 8365 1 11 . 1 1 172 172 THR H H 172 8.416 8.416 7.440 0.976 25685 8366 1 11 . 1 1 173 173 GLY N N 173 108.801 108.801 109.073 -0.272 25685 8367 1 11 . 1 1 173 173 GLY C C 173 174.138 174.138 175.218 -1.080 25685 8368 1 11 . 1 1 173 173 GLY CA C 173 47.769 47.769 46.585 1.184 25685 8369 1 11 . 1 1 173 173 GLY H H 173 8.505 8.505 7.577 0.928 25685 8370 1 11 . 1 1 174 174 ALA N N 174 123.573 123.573 124.354 -0.781 25685 8371 1 11 . 1 1 174 174 ALA C C 174 178.782 178.782 179.046 -0.264 25685 8372 1 11 . 1 1 174 174 ALA CA C 174 55.604 55.604 54.733 0.871 25685 8373 1 11 . 1 1 174 174 ALA CB C 174 18.778 18.778 18.514 0.264 25685 8374 1 11 . 1 1 174 174 ALA H H 174 8.038 8.038 7.447 0.591 25685 8375 1 11 . 1 1 175 175 ILE N N 175 118.501 118.501 119.269 -0.768 25685 8376 1 11 . 1 1 175 175 ILE C C 175 178.247 178.247 177.573 0.674 25685 8377 1 11 . 1 1 175 175 ILE CA C 175 65.412 65.412 64.822 0.590 25685 8378 1 11 . 1 1 175 175 ILE CB C 175 37.671 37.671 38.291 -0.620 25685 8379 1 11 . 1 1 175 175 ILE H H 175 7.897 7.897 7.448 0.449 25685 8380 1 11 . 1 1 176 176 VAL N N 176 120.104 120.104 119.792 0.312 25685 8381 1 11 . 1 1 176 176 VAL C C 176 177.945 177.945 177.631 0.314 25685 8382 1 11 . 1 1 176 176 VAL CA C 176 67.761 67.761 65.992 1.769 25685 8383 1 11 . 1 1 176 176 VAL CB C 176 30.662 30.662 31.924 -1.262 25685 8384 1 11 . 1 1 176 176 VAL H H 176 8.321 8.321 7.603 0.718 25685 8385 1 11 . 1 1 177 177 LEU N N 177 118.561 118.561 119.423 -0.862 25685 8386 1 11 . 1 1 177 177 LEU C C 177 178.563 178.563 178.257 0.306 25685 8387 1 11 . 1 1 177 177 LEU CA C 177 58.094 58.094 57.994 0.100 25685 8388 1 11 . 1 1 177 177 LEU CB C 177 41.061 41.061 40.257 0.804 25685 8389 1 11 . 1 1 177 177 LEU H H 177 8.097 8.097 7.310 0.787 25685 8390 1 11 . 1 1 178 178 LEU N N 178 120.868 120.868 120.853 0.015 25685 8391 1 11 . 1 1 178 178 LEU C C 178 178.524 178.524 178.121 0.403 25685 8392 1 11 . 1 1 178 178 LEU CA C 178 57.767 57.767 57.973 -0.206 25685 8393 1 11 . 1 1 178 178 LEU CB C 178 40.886 40.886 40.969 -0.083 25685 8394 1 11 . 1 1 178 178 LEU H H 178 8.229 8.229 7.280 0.949 25685 8395 1 11 . 1 1 179 179 TYR N N 179 119.355 119.355 119.063 0.292 25685 8396 1 11 . 1 1 179 179 TYR C C 179 180.059 180.059 177.480 2.579 25685 8397 1 11 . 1 1 179 179 TYR CA C 179 63.844 63.844 61.680 2.164 25685 8398 1 11 . 1 1 179 179 TYR CB C 179 39.508 39.508 38.417 1.091 25685 8399 1 11 . 1 1 179 179 TYR H H 179 8.759 8.759 7.446 1.313 25685 8400 1 11 . 1 1 180 180 LEU N N 180 118.984 118.984 119.052 -0.068 25685 8401 1 11 . 1 1 180 180 LEU C C 180 179.079 179.079 179.264 -0.185 25685 8402 1 11 . 1 1 180 180 LEU CA C 180 58.879 58.879 57.704 1.175 25685 8403 1 11 . 1 1 180 180 LEU CB C 180 41.899 41.899 40.914 0.985 25685 8404 1 11 . 1 1 180 180 LEU H H 180 8.315 8.315 7.561 0.754 25685 8405 1 11 . 1 1 181 181 ALA N N 181 121.826 121.826 121.893 -0.067 25685 8406 1 11 . 1 1 181 181 ALA C C 181 180.009 180.009 179.633 0.376 25685 8407 1 11 . 1 1 181 181 ALA CA C 181 55.700 55.700 54.730 0.970 25685 8408 1 11 . 1 1 181 181 ALA CB C 181 17.713 17.713 18.535 -0.822 25685 8409 1 11 . 1 1 181 181 ALA H H 181 8.480 8.480 8.282 0.198 25685 8410 1 11 . 1 1 182 182 TYR N N 182 118.039 118.039 118.089 -0.050 25685 8411 1 11 . 1 1 182 182 TYR CA C 182 59.038 59.038 61.759 -2.721 25685 8412 1 11 . 1 1 182 182 TYR H H 182 8.856 8.856 7.799 1.057 25685 8413 1 11 . 1 1 183 183 PHE N N 183 124.769 124.769 117.733 7.036 25685 8414 1 11 . 1 1 183 183 PHE CA C 183 63.566 63.566 59.988 3.578 25685 8415 1 11 . 1 1 183 183 PHE H H 183 9.764 9.764 7.500 2.264 25685 8416 1 12 . 1 1 4 4 ALA N N 4 121.533 121.533 123.934 -2.401 25685 8417 1 12 . 1 1 4 4 ALA C C 4 177.632 177.632 178.492 -0.860 25685 8418 1 12 . 1 1 4 4 ALA CA C 4 55.117 55.117 55.529 -0.412 25685 8419 1 12 . 1 1 4 4 ALA CB C 4 18.448 18.448 18.489 -0.041 25685 8420 1 12 . 1 1 4 4 ALA H H 4 7.977 7.977 7.683 0.294 25685 8421 1 12 . 1 1 5 5 PHE N N 5 119.988 119.988 116.251 3.737 25685 8422 1 12 . 1 1 5 5 PHE CA C 5 60.759 60.759 59.645 1.114 25685 8423 1 12 . 1 1 5 5 PHE CB C 5 39.221 39.221 37.502 1.718 25685 8424 1 12 . 1 1 5 5 PHE H H 5 8.210 8.210 8.258 -0.048 25685 8425 1 12 . 1 1 6 6 ALA C C 6 179.794 179.794 179.299 0.495 25685 8426 1 12 . 1 1 6 6 ALA CA C 6 55.619 55.619 54.462 1.157 25685 8427 1 12 . 1 1 6 6 ALA CB C 6 17.911 17.911 17.327 0.584 25685 8428 1 12 . 1 1 6 6 ALA H H 6 8.417 8.417 6.444 1.973 25685 8429 1 12 . 1 1 7 7 LEU N N 7 115.852 115.852 117.168 -1.316 25685 8430 1 12 . 1 1 7 7 LEU C C 7 180.196 180.196 179.125 1.071 25685 8431 1 12 . 1 1 7 7 LEU CA C 7 57.528 57.528 57.095 0.433 25685 8432 1 12 . 1 1 7 7 LEU CB C 7 40.060 40.060 41.191 -1.131 25685 8433 1 12 . 1 1 7 7 LEU H H 7 8.741 8.741 7.176 1.565 25685 8434 1 12 . 1 1 8 8 GLY N N 8 110.199 110.199 107.171 3.028 25685 8435 1 12 . 1 1 8 8 GLY C C 8 176.430 176.430 176.471 -0.041 25685 8436 1 12 . 1 1 8 8 GLY CA C 8 46.960 46.960 47.273 -0.313 25685 8437 1 12 . 1 1 8 8 GLY H H 8 8.179 8.179 7.728 0.451 25685 8438 1 12 . 1 1 9 9 ILE N N 9 122.346 122.346 120.091 2.255 25685 8439 1 12 . 1 1 9 9 ILE C C 9 178.143 178.143 177.488 0.655 25685 8440 1 12 . 1 1 9 9 ILE CA C 9 65.048 65.048 64.324 0.724 25685 8441 1 12 . 1 1 9 9 ILE CB C 9 36.841 36.841 37.359 -0.518 25685 8442 1 12 . 1 1 9 9 ILE H H 9 7.788 7.788 7.445 0.343 25685 8443 1 12 . 1 1 10 10 LEU N N 10 117.560 117.560 119.520 -1.960 25685 8444 1 12 . 1 1 10 10 LEU C C 10 179.501 179.501 178.969 0.532 25685 8445 1 12 . 1 1 10 10 LEU CA C 10 58.068 58.068 58.057 0.011 25685 8446 1 12 . 1 1 10 10 LEU CB C 10 40.776 40.776 41.114 -0.338 25685 8447 1 12 . 1 1 10 10 LEU H H 10 8.044 8.044 7.697 0.347 25685 8448 1 12 . 1 1 11 11 SER N N 11 113.830 113.830 114.652 -0.822 25685 8449 1 12 . 1 1 11 11 SER CA C 11 61.769 61.769 61.526 0.243 25685 8450 1 12 . 1 1 11 11 SER CB C 11 63.395 63.395 62.815 0.580 25685 8451 1 12 . 1 1 11 11 SER H H 11 8.140 8.140 7.634 0.506 25685 8452 1 12 . 1 1 12 12 VAL N N 12 121.343 121.343 122.573 -1.230 25685 8453 1 12 . 1 1 12 12 VAL C C 12 176.753 176.753 178.421 -1.668 25685 8454 1 12 . 1 1 12 12 VAL CA C 12 64.583 64.583 64.967 -0.384 25685 8455 1 12 . 1 1 12 12 VAL CB C 12 31.067 31.067 31.089 -0.022 25685 8456 1 12 . 1 1 12 12 VAL H H 12 7.587 7.587 6.820 0.767 25685 8457 1 12 . 1 1 13 13 PHE N N 13 115.225 115.225 119.973 -4.748 25685 8458 1 12 . 1 1 13 13 PHE C C 13 177.349 177.349 175.477 1.872 25685 8459 1 12 . 1 1 13 13 PHE CA C 13 58.730 58.730 60.797 -2.067 25685 8460 1 12 . 1 1 13 13 PHE CB C 13 39.785 39.785 39.075 0.710 25685 8461 1 12 . 1 1 13 13 PHE H H 13 7.474 7.474 7.642 -0.168 25685 8462 1 12 . 1 1 14 14 SER N N 14 116.075 116.075 114.409 1.666 25685 8463 1 12 . 1 1 14 14 SER H H 14 7.955 7.955 8.151 -0.196 25685 8464 1 12 . 1 1 15 15 PRO C C 15 177.590 177.590 175.699 1.891 25685 8465 1 12 . 1 1 15 15 PRO CA C 15 65.464 65.464 62.070 3.394 25685 8466 1 12 . 1 1 16 16 ALA N N 16 116.288 116.288 121.205 -4.917 25685 8467 1 12 . 1 1 16 16 ALA C C 16 177.563 177.563 176.801 0.762 25685 8468 1 12 . 1 1 16 16 ALA CA C 16 53.010 53.010 51.485 1.525 25685 8469 1 12 . 1 1 16 16 ALA CB C 16 19.975 19.975 19.775 0.200 25685 8470 1 12 . 1 1 16 16 ALA H H 16 7.455 7.455 7.941 -0.486 25685 8471 1 12 . 1 1 17 17 VAL N N 17 112.072 112.072 118.916 -6.844 25685 8472 1 12 . 1 1 17 17 VAL CA C 17 63.117 63.117 63.085 0.032 25685 8473 1 12 . 1 1 17 17 VAL CB C 17 33.209 33.209 32.393 0.816 25685 8474 1 12 . 1 1 17 17 VAL H H 17 7.525 7.525 8.361 -0.836 25685 8475 1 12 . 1 1 18 18 LEU N N 18 121.205 121.205 120.472 0.733 25685 8476 1 12 . 1 1 18 18 LEU CA C 18 58.971 58.971 57.489 1.482 25685 8477 1 12 . 1 1 18 18 LEU CB C 18 41.161 41.161 40.416 0.745 25685 8478 1 12 . 1 1 18 18 LEU H H 18 8.191 8.191 8.302 -0.111 25685 8479 1 12 . 1 1 19 19 PRO C C 19 177.697 177.697 176.918 0.779 25685 8480 1 12 . 1 1 19 19 PRO CA C 19 65.181 65.181 64.096 1.085 25685 8481 1 12 . 1 1 20 20 VAL N N 20 111.723 111.723 108.916 2.807 25685 8482 1 12 . 1 1 20 20 VAL C C 20 177.137 177.137 174.462 2.675 25685 8483 1 12 . 1 1 20 20 VAL CA C 20 62.494 62.494 63.033 -0.539 25685 8484 1 12 . 1 1 20 20 VAL CB C 20 31.677 31.677 29.796 1.881 25685 8485 1 12 . 1 1 20 20 VAL H H 20 7.571 7.571 8.128 -0.557 25685 8486 1 12 . 1 1 21 21 VAL N N 21 121.705 121.705 118.065 3.640 25685 8487 1 12 . 1 1 21 21 VAL CA C 21 68.305 68.305 64.310 3.995 25685 8488 1 12 . 1 1 21 21 VAL H H 21 7.732 7.732 7.940 -0.208 25685 8489 1 12 . 1 1 24 24 ILE C C 24 174.359 174.359 175.340 -0.981 25685 8490 1 12 . 1 1 25 25 PHE N N 25 120.132 120.132 118.088 2.044 25685 8491 1 12 . 1 1 25 25 PHE C C 25 175.945 175.945 174.110 1.835 25685 8492 1 12 . 1 1 25 25 PHE CA C 25 60.544 60.544 58.730 1.814 25685 8493 1 12 . 1 1 25 25 PHE H H 25 8.082 8.082 8.082 0.000 25685 8494 1 12 . 1 1 26 26 ALA N N 26 121.341 121.341 119.536 1.805 25685 8495 1 12 . 1 1 26 26 ALA CB C 26 19.784 19.784 20.725 -0.941 25685 8496 1 12 . 1 1 26 26 ALA H H 26 7.539 7.539 7.332 0.207 25685 8497 1 12 . 1 1 27 27 GLY N N 27 107.530 107.530 104.052 3.478 25685 8498 1 12 . 1 1 27 27 GLY C C 27 174.252 174.252 172.308 1.944 25685 8499 1 12 . 1 1 27 27 GLY CA C 27 45.474 45.474 45.054 0.420 25685 8500 1 12 . 1 1 27 27 GLY H H 27 7.997 7.997 8.357 -0.360 25685 8501 1 12 . 1 1 28 28 SER N N 28 116.299 116.299 116.932 -0.633 25685 8502 1 12 . 1 1 28 28 SER C C 28 175.759 175.759 172.979 2.780 25685 8503 1 12 . 1 1 28 28 SER CA C 28 58.526 58.526 58.113 0.413 25685 8504 1 12 . 1 1 28 28 SER CB C 28 64.373 64.373 64.274 0.099 25685 8505 1 12 . 1 1 28 28 SER H H 28 8.115 8.115 8.594 -0.479 25685 8506 1 12 . 1 1 34 34 ASP C C 34 177.621 177.621 178.184 -0.563 25685 8507 1 12 . 1 1 34 34 ASP CA C 34 57.082 57.082 57.309 -0.227 25685 8508 1 12 . 1 1 35 35 ALA N N 35 120.662 120.662 121.518 -0.856 25685 8509 1 12 . 1 1 35 35 ALA C C 35 179.168 179.168 179.437 -0.269 25685 8510 1 12 . 1 1 35 35 ALA CA C 35 55.459 55.459 54.585 0.874 25685 8511 1 12 . 1 1 35 35 ALA CB C 35 18.819 18.819 18.178 0.641 25685 8512 1 12 . 1 1 35 35 ALA H H 35 8.090 8.090 7.380 0.710 25685 8513 1 12 . 1 1 36 36 PHE N N 36 117.638 117.638 117.486 0.152 25685 8514 1 12 . 1 1 36 36 PHE C C 36 177.057 177.057 177.564 -0.507 25685 8515 1 12 . 1 1 36 36 PHE CA C 36 61.472 61.472 61.902 -0.430 25685 8516 1 12 . 1 1 36 36 PHE CB C 36 38.860 38.860 38.928 -0.069 25685 8517 1 12 . 1 1 36 36 PHE H H 36 8.227 8.227 7.460 0.767 25685 8518 1 12 . 1 1 37 37 LEU N N 37 119.312 119.312 119.293 0.019 25685 8519 1 12 . 1 1 37 37 LEU C C 37 179.798 179.798 179.259 0.539 25685 8520 1 12 . 1 1 37 37 LEU CA C 37 58.181 58.181 58.333 -0.152 25685 8521 1 12 . 1 1 37 37 LEU CB C 37 40.835 40.835 40.946 -0.111 25685 8522 1 12 . 1 1 37 37 LEU H H 37 8.588 8.588 7.503 1.085 25685 8523 1 12 . 1 1 38 38 ILE N N 38 119.057 119.057 118.322 0.735 25685 8524 1 12 . 1 1 38 38 ILE C C 38 177.597 177.597 178.124 -0.527 25685 8525 1 12 . 1 1 38 38 ILE CA C 38 64.827 64.827 65.035 -0.208 25685 8526 1 12 . 1 1 38 38 ILE CB C 38 36.321 36.321 37.384 -1.063 25685 8527 1 12 . 1 1 38 38 ILE H H 38 7.932 7.932 7.180 0.752 25685 8528 1 12 . 1 1 39 39 VAL N N 39 118.758 118.758 116.732 2.026 25685 8529 1 12 . 1 1 39 39 VAL C C 39 179.533 179.533 177.606 1.927 25685 8530 1 12 . 1 1 39 39 VAL CA C 39 66.687 66.687 65.688 0.999 25685 8531 1 12 . 1 1 39 39 VAL CB C 39 30.598 30.598 31.146 -0.548 25685 8532 1 12 . 1 1 39 39 VAL H H 39 7.922 7.922 7.230 0.692 25685 8533 1 12 . 1 1 40 40 ALA N N 40 125.385 125.385 122.272 3.113 25685 8534 1 12 . 1 1 40 40 ALA C C 40 179.200 179.200 179.750 -0.550 25685 8535 1 12 . 1 1 40 40 ALA CA C 40 55.283 55.283 54.897 0.386 25685 8536 1 12 . 1 1 40 40 ALA CB C 40 17.197 17.197 18.616 -1.419 25685 8537 1 12 . 1 1 40 40 ALA H H 40 9.091 9.091 7.641 1.450 25685 8538 1 12 . 1 1 41 41 GLY N N 41 106.978 106.978 107.066 -0.088 25685 8539 1 12 . 1 1 41 41 GLY C C 41 176.171 176.171 175.916 0.255 25685 8540 1 12 . 1 1 41 41 GLY CA C 41 47.322 47.322 46.973 0.349 25685 8541 1 12 . 1 1 41 41 GLY H H 41 8.565 8.565 8.151 0.414 25685 8542 1 12 . 1 1 42 42 LEU N N 42 126.914 126.914 120.609 6.305 25685 8543 1 12 . 1 1 42 42 LEU C C 42 178.119 178.119 178.457 -0.338 25685 8544 1 12 . 1 1 42 42 LEU CA C 42 58.523 58.523 58.017 0.506 25685 8545 1 12 . 1 1 42 42 LEU CB C 42 42.125 42.125 41.625 0.500 25685 8546 1 12 . 1 1 42 42 LEU H H 42 8.573 8.573 7.557 1.016 25685 8547 1 12 . 1 1 46 46 MET N N 46 121.710 121.710 122.440 -0.730 25685 8548 1 12 . 1 1 46 46 MET C C 46 179.540 179.540 177.881 1.659 25685 8549 1 12 . 1 1 46 46 MET CA C 46 55.968 55.968 58.106 -2.138 25685 8550 1 12 . 1 1 46 46 MET H H 46 8.589 8.589 8.165 0.424 25685 8551 1 12 . 1 1 47 47 LEU N N 47 117.448 117.448 119.013 -1.565 25685 8552 1 12 . 1 1 47 47 LEU HA H 47 3.992 3.992 4.072 -0.080 25685 8553 1 12 . 1 1 47 47 LEU C C 47 179.082 179.082 179.051 0.031 25685 8554 1 12 . 1 1 47 47 LEU CA C 47 58.157 58.157 57.603 0.554 25685 8555 1 12 . 1 1 47 47 LEU CB C 47 41.858 41.858 41.711 0.147 25685 8556 1 12 . 1 1 47 47 LEU H H 47 8.769 8.769 7.800 0.969 25685 8557 1 12 . 1 1 48 48 ILE N N 48 117.500 117.500 117.066 0.434 25685 8558 1 12 . 1 1 48 48 ILE C C 48 180.298 180.298 177.923 2.375 25685 8559 1 12 . 1 1 48 48 ILE CA C 48 65.627 65.627 63.271 2.356 25685 8560 1 12 . 1 1 48 48 ILE CB C 48 37.839 37.839 36.994 0.845 25685 8561 1 12 . 1 1 48 48 ILE H H 48 8.093 8.093 7.673 0.420 25685 8562 1 12 . 1 1 49 49 LEU N N 49 123.708 123.708 120.911 2.797 25685 8563 1 12 . 1 1 49 49 LEU C C 49 179.721 179.721 179.345 0.376 25685 8564 1 12 . 1 1 49 49 LEU CA C 49 58.788 58.788 57.602 1.186 25685 8565 1 12 . 1 1 49 49 LEU CB C 49 40.761 40.761 41.035 -0.274 25685 8566 1 12 . 1 1 49 49 LEU H H 49 8.833 8.833 7.778 1.055 25685 8567 1 12 . 1 1 50 50 GLY N N 50 109.284 109.284 105.112 4.172 25685 8568 1 12 . 1 1 50 50 GLY C C 50 176.937 176.937 173.624 3.313 25685 8569 1 12 . 1 1 50 50 GLY CA C 50 47.821 47.821 45.767 2.054 25685 8570 1 12 . 1 1 50 50 GLY H H 50 9.658 9.658 7.892 1.766 25685 8571 1 12 . 1 1 51 51 TYR N N 51 125.640 125.640 120.299 5.341 25685 8572 1 12 . 1 1 51 51 TYR C C 51 177.102 177.102 174.712 2.390 25685 8573 1 12 . 1 1 51 51 TYR CA C 51 61.948 61.948 57.291 4.657 25685 8574 1 12 . 1 1 51 51 TYR CB C 51 38.871 38.871 38.665 0.206 25685 8575 1 12 . 1 1 51 51 TYR H H 51 8.795 8.795 7.654 1.141 25685 8576 1 12 . 1 1 52 52 THR N N 52 116.273 116.273 116.611 -0.338 25685 8577 1 12 . 1 1 52 52 THR C C 52 176.969 176.969 174.230 2.739 25685 8578 1 12 . 1 1 52 52 THR CA C 52 67.972 67.972 65.470 2.502 25685 8579 1 12 . 1 1 52 52 THR H H 52 8.456 8.456 8.121 0.335 25685 8580 1 12 . 1 1 53 53 ALA N N 53 122.122 122.122 122.417 -0.295 25685 8581 1 12 . 1 1 53 53 ALA C C 53 179.907 179.907 176.027 3.880 25685 8582 1 12 . 1 1 53 53 ALA CA C 53 55.722 55.722 52.185 3.537 25685 8583 1 12 . 1 1 53 53 ALA CB C 53 18.786 18.786 18.840 -0.054 25685 8584 1 12 . 1 1 53 53 ALA H H 53 9.058 9.058 8.169 0.889 25685 8585 1 12 . 1 1 54 54 SER N N 54 115.434 115.434 117.223 -1.789 25685 8586 1 12 . 1 1 54 54 SER C C 54 176.433 176.433 175.249 1.184 25685 8587 1 12 . 1 1 54 54 SER CA C 54 55.828 55.828 59.351 -3.523 25685 8588 1 12 . 1 1 54 54 SER H H 54 8.040 8.040 8.411 -0.371 25685 8589 1 12 . 1 1 55 55 LEU N N 55 123.045 123.045 124.581 -1.536 25685 8590 1 12 . 1 1 55 55 LEU C C 55 178.789 178.789 174.719 4.070 25685 8591 1 12 . 1 1 55 55 LEU CA C 55 57.633 57.633 55.772 1.861 25685 8592 1 12 . 1 1 55 55 LEU CB C 55 41.293 41.293 40.879 0.414 25685 8593 1 12 . 1 1 55 55 LEU H H 55 8.255 8.255 8.668 -0.413 25685 8594 1 12 . 1 1 56 56 PHE N N 56 114.426 114.426 118.665 -4.239 25685 8595 1 12 . 1 1 56 56 PHE C C 56 177.507 177.507 175.117 2.390 25685 8596 1 12 . 1 1 56 56 PHE CA C 56 61.068 61.068 57.218 3.849 25685 8597 1 12 . 1 1 56 56 PHE CB C 56 40.107 40.107 39.627 0.480 25685 8598 1 12 . 1 1 56 56 PHE H H 56 7.590 7.590 7.366 0.224 25685 8599 1 12 . 1 1 57 57 PHE N N 57 114.701 114.701 115.813 -1.112 25685 8600 1 12 . 1 1 57 57 PHE C C 57 176.203 176.203 176.960 -0.757 25685 8601 1 12 . 1 1 57 57 PHE CA C 57 58.503 58.503 57.808 0.695 25685 8602 1 12 . 1 1 57 57 PHE CB C 57 41.114 41.114 36.738 4.376 25685 8603 1 12 . 1 1 57 57 PHE H H 57 8.514 8.514 7.644 0.871 25685 8604 1 12 . 1 1 58 58 GLY N N 58 111.041 111.041 107.985 3.056 25685 8605 1 12 . 1 1 58 58 GLY C C 58 174.240 174.240 176.088 -1.848 25685 8606 1 12 . 1 1 58 58 GLY CA C 58 44.827 44.827 47.056 -2.229 25685 8607 1 12 . 1 1 58 58 GLY H H 58 7.998 7.998 8.784 -0.786 25685 8608 1 12 . 1 1 59 59 PHE N N 59 127.950 127.950 121.294 6.656 25685 8609 1 12 . 1 1 59 59 PHE C C 59 176.612 176.612 176.962 -0.350 25685 8610 1 12 . 1 1 59 59 PHE CA C 59 61.598 61.598 59.434 2.164 25685 8611 1 12 . 1 1 59 59 PHE CB C 59 40.870 40.870 38.746 2.124 25685 8612 1 12 . 1 1 59 59 PHE H H 59 9.105 9.105 7.715 1.390 25685 8613 1 12 . 1 1 60 60 PHE N N 60 114.868 114.868 119.567 -4.699 25685 8614 1 12 . 1 1 60 60 PHE C C 60 177.989 177.989 177.302 0.687 25685 8615 1 12 . 1 1 60 60 PHE CA C 60 61.517 61.517 61.380 0.137 25685 8616 1 12 . 1 1 60 60 PHE CB C 60 38.248 38.248 39.244 -0.996 25685 8617 1 12 . 1 1 60 60 PHE H H 60 8.796 8.796 8.403 0.393 25685 8618 1 12 . 1 1 61 61 ARG N N 61 118.812 118.812 117.866 0.946 25685 8619 1 12 . 1 1 61 61 ARG C C 61 177.813 177.813 178.441 -0.628 25685 8620 1 12 . 1 1 61 61 ARG CA C 61 60.497 60.497 59.383 1.114 25685 8621 1 12 . 1 1 61 61 ARG CB C 61 28.915 28.915 30.160 -1.245 25685 8622 1 12 . 1 1 61 61 ARG H H 61 7.600 7.600 7.924 -0.324 25685 8623 1 12 . 1 1 62 62 VAL N N 62 119.157 119.157 115.892 3.265 25685 8624 1 12 . 1 1 62 62 VAL C C 62 177.670 177.670 177.793 -0.123 25685 8625 1 12 . 1 1 62 62 VAL CA C 62 66.749 66.749 65.129 1.620 25685 8626 1 12 . 1 1 62 62 VAL CB C 62 30.306 30.306 31.177 -0.871 25685 8627 1 12 . 1 1 62 62 VAL H H 62 7.679 7.679 7.390 0.289 25685 8628 1 12 . 1 1 63 63 VAL N N 63 117.999 117.999 119.426 -1.427 25685 8629 1 12 . 1 1 63 63 VAL C C 63 177.639 177.639 178.333 -0.694 25685 8630 1 12 . 1 1 63 63 VAL CA C 63 66.836 66.836 65.840 0.996 25685 8631 1 12 . 1 1 63 63 VAL CB C 63 30.496 30.496 30.739 -0.243 25685 8632 1 12 . 1 1 63 63 VAL H H 63 7.429 7.429 7.450 -0.021 25685 8633 1 12 . 1 1 64 64 ALA N N 64 120.451 120.451 122.061 -1.610 25685 8634 1 12 . 1 1 64 64 ALA C C 64 179.134 179.134 179.134 0.000 25685 8635 1 12 . 1 1 64 64 ALA CA C 64 55.618 55.618 54.985 0.633 25685 8636 1 12 . 1 1 64 64 ALA CB C 64 17.950 17.950 17.775 0.175 25685 8637 1 12 . 1 1 64 64 ALA H H 64 8.169 8.169 7.553 0.616 25685 8638 1 12 . 1 1 65 65 MET N N 65 116.532 116.532 116.495 0.037 25685 8639 1 12 . 1 1 65 65 MET C C 65 177.961 177.961 178.090 -0.129 25685 8640 1 12 . 1 1 65 65 MET CA C 65 58.161 58.161 58.340 -0.179 25685 8641 1 12 . 1 1 65 65 MET CB C 65 31.208 31.208 32.206 -0.998 25685 8642 1 12 . 1 1 65 65 MET H H 65 7.857 7.857 7.531 0.326 25685 8643 1 12 . 1 1 66 66 LEU C C 66 179.022 179.022 178.670 0.352 25685 8644 1 12 . 1 1 66 66 LEU CA C 66 58.412 58.412 58.102 0.310 25685 8645 1 12 . 1 1 67 67 PHE N N 67 116.877 116.877 118.258 -1.381 25685 8646 1 12 . 1 1 67 67 PHE C C 67 177.908 177.908 177.815 0.093 25685 8647 1 12 . 1 1 67 67 PHE CA C 67 62.402 62.402 60.886 1.516 25685 8648 1 12 . 1 1 67 67 PHE CB C 67 39.203 39.203 38.920 0.283 25685 8649 1 12 . 1 1 67 67 PHE H H 67 7.923 7.923 7.688 0.235 25685 8650 1 12 . 1 1 68 68 LEU N N 68 118.860 118.860 120.409 -1.549 25685 8651 1 12 . 1 1 68 68 LEU C C 68 179.032 179.032 177.733 1.299 25685 8652 1 12 . 1 1 68 68 LEU CA C 68 58.397 58.397 57.497 0.900 25685 8653 1 12 . 1 1 68 68 LEU CB C 68 40.803 40.803 41.424 -0.621 25685 8654 1 12 . 1 1 68 68 LEU H H 68 8.167 8.167 7.457 0.710 25685 8655 1 12 . 1 1 71 71 PHE N N 71 120.700 120.700 117.385 3.315 25685 8656 1 12 . 1 1 71 71 PHE C C 71 177.670 177.670 177.886 -0.216 25685 8657 1 12 . 1 1 71 71 PHE CA C 71 60.528 60.528 60.760 -0.232 25685 8658 1 12 . 1 1 71 71 PHE H H 71 7.847 7.847 6.989 0.858 25685 8659 1 12 . 1 1 72 72 ALA N N 72 120.506 120.506 123.058 -2.552 25685 8660 1 12 . 1 1 72 72 ALA C C 72 178.944 178.944 179.160 -0.216 25685 8661 1 12 . 1 1 72 72 ALA CA C 72 55.461 55.461 54.853 0.608 25685 8662 1 12 . 1 1 72 72 ALA CB C 72 17.829 17.829 17.711 0.118 25685 8663 1 12 . 1 1 72 72 ALA H H 72 8.533 8.533 7.382 1.151 25685 8664 1 12 . 1 1 73 73 LEU N N 73 115.071 115.071 118.154 -3.083 25685 8665 1 12 . 1 1 73 73 LEU C C 73 180.831 180.831 178.968 1.863 25685 8666 1 12 . 1 1 73 73 LEU CA C 73 58.091 58.091 57.570 0.521 25685 8667 1 12 . 1 1 73 73 LEU CB C 73 41.082 41.082 41.394 -0.312 25685 8668 1 12 . 1 1 73 73 LEU H H 73 8.458 8.458 7.566 0.892 25685 8669 1 12 . 1 1 74 74 ILE N N 74 121.365 121.365 117.983 3.382 25685 8670 1 12 . 1 1 74 74 ILE C C 74 178.287 178.287 177.988 0.299 25685 8671 1 12 . 1 1 74 74 ILE CA C 74 65.335 65.335 64.800 0.535 25685 8672 1 12 . 1 1 74 74 ILE CB C 74 37.453 37.453 37.467 -0.014 25685 8673 1 12 . 1 1 74 74 ILE H H 74 8.220 8.220 7.439 0.781 25685 8674 1 12 . 1 1 75 75 LEU N N 75 119.200 119.200 120.365 -1.165 25685 8675 1 12 . 1 1 75 75 LEU C C 75 177.548 177.548 177.719 -0.171 25685 8676 1 12 . 1 1 75 75 LEU CA C 75 56.938 56.938 57.434 -0.496 25685 8677 1 12 . 1 1 75 75 LEU CB C 75 41.541 41.541 41.723 -0.182 25685 8678 1 12 . 1 1 75 75 LEU H H 75 7.866 7.866 7.439 0.427 25685 8679 1 12 . 1 1 76 76 LEU N N 76 116.338 116.338 115.895 0.443 25685 8680 1 12 . 1 1 76 76 LEU C C 76 176.889 176.889 178.739 -1.850 25685 8681 1 12 . 1 1 76 76 LEU CA C 76 54.807 54.807 57.536 -2.729 25685 8682 1 12 . 1 1 76 76 LEU CB C 76 41.830 41.830 41.825 0.005 25685 8683 1 12 . 1 1 76 76 LEU H H 76 7.432 7.432 7.693 -0.261 25685 8684 1 12 . 1 1 77 77 SER N N 77 114.630 114.630 112.011 2.619 25685 8685 1 12 . 1 1 77 77 SER C C 77 174.752 174.752 175.044 -0.292 25685 8686 1 12 . 1 1 77 77 SER CA C 77 58.967 58.967 60.911 -1.944 25685 8687 1 12 . 1 1 77 77 SER CB C 77 64.686 64.686 63.522 1.165 25685 8688 1 12 . 1 1 77 77 SER H H 77 7.423 7.423 7.812 -0.389 25685 8689 1 12 . 1 1 78 78 ASP N N 78 123.054 123.054 120.070 2.984 25685 8690 1 12 . 1 1 78 78 ASP C C 78 176.716 176.716 176.251 0.465 25685 8691 1 12 . 1 1 78 78 ASP CA C 78 54.848 54.848 56.416 -1.568 25685 8692 1 12 . 1 1 78 78 ASP CB C 78 40.423 40.423 40.880 -0.457 25685 8693 1 12 . 1 1 78 78 ASP H H 78 8.294 8.294 7.577 0.717 25685 8694 1 12 . 1 1 79 79 GLU N N 79 119.104 119.104 120.582 -1.478 25685 8695 1 12 . 1 1 79 79 GLU C C 79 176.391 176.391 175.681 0.710 25685 8696 1 12 . 1 1 79 79 GLU CA C 79 56.258 56.258 55.961 0.297 25685 8697 1 12 . 1 1 79 79 GLU CB C 79 29.656 29.656 29.725 -0.069 25685 8698 1 12 . 1 1 79 79 GLU H H 79 8.384 8.384 8.519 -0.135 25685 8699 1 12 . 1 1 80 80 LEU N N 80 121.254 121.254 120.165 1.089 25685 8700 1 12 . 1 1 80 80 LEU C C 80 177.164 177.164 174.833 2.331 25685 8701 1 12 . 1 1 80 80 LEU CA C 80 54.670 54.670 55.677 -1.007 25685 8702 1 12 . 1 1 80 80 LEU CB C 80 42.633 42.633 40.403 2.230 25685 8703 1 12 . 1 1 80 80 LEU H H 80 7.637 7.637 8.334 -0.697 25685 8704 1 12 . 1 1 81 81 ASP N N 81 123.410 123.410 123.790 -0.380 25685 8705 1 12 . 1 1 81 81 ASP C C 81 177.552 177.552 175.048 2.504 25685 8706 1 12 . 1 1 81 81 ASP CA C 81 55.110 55.110 52.909 2.201 25685 8707 1 12 . 1 1 81 81 ASP CB C 81 42.693 42.693 43.248 -0.555 25685 8708 1 12 . 1 1 81 81 ASP H H 81 8.403 8.403 8.297 0.106 25685 8709 1 12 . 1 1 82 82 GLU N N 82 125.047 125.047 119.042 6.005 25685 8710 1 12 . 1 1 82 82 GLU C C 82 178.198 178.198 176.690 1.508 25685 8711 1 12 . 1 1 82 82 GLU CA C 82 59.221 59.221 55.835 3.386 25685 8712 1 12 . 1 1 82 82 GLU CB C 82 29.176 29.176 30.809 -1.633 25685 8713 1 12 . 1 1 82 82 GLU H H 82 8.744 8.744 8.343 0.401 25685 8714 1 12 . 1 1 83 83 LYS N N 83 118.476 118.476 120.910 -2.434 25685 8715 1 12 . 1 1 83 83 LYS C C 83 179.356 179.356 176.940 2.416 25685 8716 1 12 . 1 1 83 83 LYS CA C 83 59.170 59.170 58.278 0.892 25685 8717 1 12 . 1 1 83 83 LYS CB C 83 31.509 31.509 31.202 0.307 25685 8718 1 12 . 1 1 83 83 LYS H H 83 8.607 8.607 8.796 -0.189 25685 8719 1 12 . 1 1 84 84 VAL N N 84 118.407 118.407 115.004 3.403 25685 8720 1 12 . 1 1 84 84 VAL C C 84 177.653 177.653 177.244 0.409 25685 8721 1 12 . 1 1 84 84 VAL CA C 84 65.416 65.416 66.524 -1.108 25685 8722 1 12 . 1 1 84 84 VAL CB C 84 31.313 31.313 31.137 0.176 25685 8723 1 12 . 1 1 84 84 VAL H H 84 7.870 7.870 7.394 0.476 25685 8724 1 12 . 1 1 85 85 SER N N 85 116.146 116.146 116.315 -0.169 25685 8725 1 12 . 1 1 85 85 SER C C 85 177.496 177.496 176.704 0.792 25685 8726 1 12 . 1 1 85 85 SER CA C 85 61.764 61.764 61.699 0.065 25685 8727 1 12 . 1 1 85 85 SER CB C 85 63.654 63.654 63.115 0.539 25685 8728 1 12 . 1 1 85 85 SER H H 85 8.083 8.083 8.524 -0.441 25685 8729 1 12 . 1 1 86 86 ILE N N 86 122.570 122.570 117.643 4.927 25685 8730 1 12 . 1 1 86 86 ILE C C 86 178.698 178.698 177.200 1.498 25685 8731 1 12 . 1 1 86 86 ILE CA C 86 64.526 64.526 63.838 0.688 25685 8732 1 12 . 1 1 86 86 ILE CB C 86 37.393 37.393 37.267 0.127 25685 8733 1 12 . 1 1 86 86 ILE H H 86 8.102 8.102 7.807 0.295 25685 8734 1 12 . 1 1 87 87 PHE N N 87 121.340 121.340 121.605 -0.265 25685 8735 1 12 . 1 1 87 87 PHE C C 87 177.671 177.671 177.341 0.330 25685 8736 1 12 . 1 1 87 87 PHE CA C 87 61.098 61.098 61.251 -0.153 25685 8737 1 12 . 1 1 87 87 PHE CB C 87 39.151 39.151 38.853 0.298 25685 8738 1 12 . 1 1 87 87 PHE H H 87 7.719 7.719 8.011 -0.292 25685 8739 1 12 . 1 1 88 88 ALA N N 88 120.921 120.921 121.356 -0.435 25685 8740 1 12 . 1 1 88 88 ALA C C 88 180.030 180.030 179.738 0.292 25685 8741 1 12 . 1 1 88 88 ALA CA C 88 55.147 55.147 54.940 0.207 25685 8742 1 12 . 1 1 88 88 ALA CB C 88 19.053 19.053 17.937 1.116 25685 8743 1 12 . 1 1 88 88 ALA H H 88 8.679 8.679 8.020 0.659 25685 8744 1 12 . 1 1 89 89 SER N N 89 114.285 114.285 115.017 -0.732 25685 8745 1 12 . 1 1 89 89 SER C C 89 177.040 177.040 176.416 0.624 25685 8746 1 12 . 1 1 89 89 SER CA C 89 61.314 61.314 61.164 0.149 25685 8747 1 12 . 1 1 89 89 SER CB C 89 63.371 63.371 62.805 0.566 25685 8748 1 12 . 1 1 89 89 SER H H 89 8.242 8.242 7.597 0.645 25685 8749 1 12 . 1 1 90 90 ARG N N 90 121.829 121.829 120.592 1.237 25685 8750 1 12 . 1 1 90 90 ARG C C 90 179.247 179.247 177.786 1.461 25685 8751 1 12 . 1 1 90 90 ARG CA C 90 58.444 58.444 58.030 0.414 25685 8752 1 12 . 1 1 90 90 ARG CB C 90 29.532 29.532 28.410 1.121 25685 8753 1 12 . 1 1 90 90 ARG H H 90 7.907 7.907 7.306 0.601 25685 8754 1 12 . 1 1 91 91 MET N N 91 117.124 117.124 117.995 -0.871 25685 8755 1 12 . 1 1 91 91 MET C C 91 177.504 177.504 177.572 -0.068 25685 8756 1 12 . 1 1 91 91 MET CA C 91 57.152 57.152 60.224 -3.072 25685 8757 1 12 . 1 1 91 91 MET CB C 91 32.510 32.510 32.401 0.109 25685 8758 1 12 . 1 1 91 91 MET H H 91 7.930 7.930 8.065 -0.135 25685 8759 1 12 . 1 1 92 92 THR N N 92 108.478 108.478 111.090 -2.612 25685 8760 1 12 . 1 1 92 92 THR C C 92 176.367 176.367 176.238 0.129 25685 8761 1 12 . 1 1 92 92 THR CA C 92 63.564 63.564 64.951 -1.387 25685 8762 1 12 . 1 1 92 92 THR H H 92 7.847 7.847 7.674 0.173 25685 8763 1 12 . 1 1 93 93 SER N N 93 117.950 117.950 118.052 -0.102 25685 8764 1 12 . 1 1 93 93 SER C C 93 176.552 176.552 176.494 0.058 25685 8765 1 12 . 1 1 93 93 SER CA C 93 60.821 60.821 61.440 -0.619 25685 8766 1 12 . 1 1 93 93 SER CB C 93 63.311 63.311 63.203 0.108 25685 8767 1 12 . 1 1 93 93 SER H H 93 7.732 7.732 7.659 0.073 25685 8768 1 12 . 1 1 94 94 GLY N N 94 111.265 111.265 108.229 3.036 25685 8769 1 12 . 1 1 94 94 GLY C C 94 175.198 175.198 174.311 0.887 25685 8770 1 12 . 1 1 94 94 GLY CA C 94 46.021 46.021 45.489 0.532 25685 8771 1 12 . 1 1 94 94 GLY H H 94 8.419 8.419 7.963 0.456 25685 8772 1 12 . 1 1 95 95 LEU N N 95 121.019 121.019 117.811 3.208 25685 8773 1 12 . 1 1 95 95 LEU C C 95 177.810 177.810 175.652 2.158 25685 8774 1 12 . 1 1 95 95 LEU CA C 95 56.012 56.012 56.168 -0.156 25685 8775 1 12 . 1 1 95 95 LEU CB C 95 42.122 42.122 42.461 -0.339 25685 8776 1 12 . 1 1 95 95 LEU H H 95 7.849 7.849 7.269 0.580 25685 8777 1 12 . 1 1 96 96 SER N N 96 115.465 115.465 115.417 0.048 25685 8778 1 12 . 1 1 96 96 SER C C 96 175.543 175.543 174.231 1.312 25685 8779 1 12 . 1 1 96 96 SER CA C 96 60.151 60.151 58.246 1.905 25685 8780 1 12 . 1 1 96 96 SER H H 96 8.349 8.349 8.209 0.140 25685 8781 1 12 . 1 1 97 97 TRP N N 97 121.711 121.711 123.374 -1.663 25685 8782 1 12 . 1 1 97 97 TRP C C 97 176.973 176.973 176.151 0.822 25685 8783 1 12 . 1 1 97 97 TRP CA C 97 58.250 58.250 57.258 0.992 25685 8784 1 12 . 1 1 97 97 TRP CB C 97 28.899 28.899 29.705 -0.806 25685 8785 1 12 . 1 1 97 97 TRP H H 97 7.723 7.723 8.377 -0.654 25685 8786 1 12 . 1 1 98 98 LYS N N 98 119.868 119.868 122.516 -2.648 25685 8787 1 12 . 1 1 98 98 LYS C C 98 178.021 178.021 176.914 1.107 25685 8788 1 12 . 1 1 98 98 LYS CA C 98 56.340 56.340 56.024 0.316 25685 8789 1 12 . 1 1 98 98 LYS CB C 98 31.933 31.933 34.234 -2.301 25685 8790 1 12 . 1 1 98 98 LYS H H 98 7.855 7.855 8.469 -0.614 25685 8791 1 12 . 1 1 99 99 ILE N N 99 120.044 120.044 120.149 -0.105 25685 8792 1 12 . 1 1 99 99 ILE C C 99 176.769 176.769 177.640 -0.871 25685 8793 1 12 . 1 1 99 99 ILE CA C 99 62.758 62.758 63.426 -0.668 25685 8794 1 12 . 1 1 99 99 ILE CB C 99 37.809 37.809 36.117 1.692 25685 8795 1 12 . 1 1 99 99 ILE H H 99 8.069 8.069 8.123 -0.054 25685 8796 1 12 . 1 1 100 100 GLN C C 100 176.315 176.315 175.995 0.320 25685 8797 1 12 . 1 1 100 100 GLN CA C 100 57.486 57.486 56.099 1.387 25685 8798 1 12 . 1 1 101 101 THR N N 101 109.873 109.873 113.585 -3.712 25685 8799 1 12 . 1 1 101 101 THR C C 101 174.664 174.664 173.106 1.558 25685 8800 1 12 . 1 1 101 101 THR CA C 101 61.709 61.709 63.016 -1.307 25685 8801 1 12 . 1 1 101 101 THR CB C 101 69.290 69.290 69.319 -0.029 25685 8802 1 12 . 1 1 101 101 THR H H 101 7.508 7.508 7.892 -0.384 25685 8803 1 12 . 1 1 102 102 LEU N N 102 124.434 124.434 125.694 -1.260 25685 8804 1 12 . 1 1 102 102 LEU C C 102 174.681 174.681 175.366 -0.685 25685 8805 1 12 . 1 1 102 102 LEU CA C 102 53.063 53.063 52.733 0.329 25685 8806 1 12 . 1 1 102 102 LEU CB C 102 41.139 41.139 41.843 -0.704 25685 8807 1 12 . 1 1 102 102 LEU H H 102 7.569 7.569 8.198 -0.629 25685 8808 1 12 . 1 1 103 103 PRO C C 103 178.076 178.076 175.809 2.267 25685 8809 1 12 . 1 1 103 103 PRO CA C 103 62.570 62.570 64.224 -1.653 25685 8810 1 12 . 1 1 103 103 PRO CB C 103 31.534 31.534 32.368 -0.834 25685 8811 1 12 . 1 1 104 104 SER N N 104 119.929 119.929 118.092 1.837 25685 8812 1 12 . 1 1 104 104 SER C C 104 176.432 176.432 174.231 2.201 25685 8813 1 12 . 1 1 104 104 SER CA C 104 61.976 61.976 58.128 3.848 25685 8814 1 12 . 1 1 104 104 SER CB C 104 63.611 63.611 63.809 -0.198 25685 8815 1 12 . 1 1 104 104 SER H H 104 8.784 8.784 8.075 0.709 25685 8816 1 12 . 1 1 105 105 PHE N N 105 119.519 119.519 125.202 -5.683 25685 8817 1 12 . 1 1 105 105 PHE C C 105 176.852 176.852 175.348 1.504 25685 8818 1 12 . 1 1 105 105 PHE CA C 105 60.162 60.162 56.459 3.703 25685 8819 1 12 . 1 1 105 105 PHE CB C 105 38.455 38.455 37.255 1.200 25685 8820 1 12 . 1 1 105 105 PHE H H 105 8.620 8.620 8.738 -0.118 25685 8821 1 12 . 1 1 106 106 PHE N N 106 118.809 118.809 120.559 -1.750 25685 8822 1 12 . 1 1 106 106 PHE C C 106 176.741 176.741 176.523 0.218 25685 8823 1 12 . 1 1 106 106 PHE CA C 106 61.421 61.421 61.328 0.093 25685 8824 1 12 . 1 1 106 106 PHE CB C 106 38.788 38.788 37.071 1.717 25685 8825 1 12 . 1 1 106 106 PHE H H 106 7.519 7.519 8.479 -0.960 25685 8826 1 12 . 1 1 107 107 PHE N N 107 117.382 117.382 118.323 -0.941 25685 8827 1 12 . 1 1 107 107 PHE C C 107 177.771 177.771 176.372 1.399 25685 8828 1 12 . 1 1 107 107 PHE CA C 107 61.099 61.099 61.315 -0.216 25685 8829 1 12 . 1 1 107 107 PHE CB C 107 38.677 38.677 37.799 0.878 25685 8830 1 12 . 1 1 107 107 PHE H H 107 7.903 7.903 8.892 -0.989 25685 8831 1 12 . 1 1 108 108 GLY N N 108 105.340 105.340 106.435 -1.095 25685 8832 1 12 . 1 1 108 108 GLY C C 108 174.574 174.574 175.702 -1.128 25685 8833 1 12 . 1 1 108 108 GLY CA C 108 47.508 47.508 47.099 0.409 25685 8834 1 12 . 1 1 108 108 GLY H H 108 8.351 8.351 8.857 -0.506 25685 8835 1 12 . 1 1 109 109 MET N N 109 119.831 119.831 120.655 -0.824 25685 8836 1 12 . 1 1 109 109 MET C C 109 177.522 177.522 177.064 0.458 25685 8837 1 12 . 1 1 109 109 MET CA C 109 58.658 58.658 58.109 0.549 25685 8838 1 12 . 1 1 109 109 MET CB C 109 32.106 32.106 31.957 0.149 25685 8839 1 12 . 1 1 109 109 MET H H 109 7.919 7.919 7.973 -0.054 25685 8840 1 12 . 1 1 110 110 LEU N N 110 119.908 119.908 118.114 1.794 25685 8841 1 12 . 1 1 110 110 LEU C C 110 178.170 178.170 178.958 -0.788 25685 8842 1 12 . 1 1 110 110 LEU CA C 110 57.941 57.941 57.828 0.114 25685 8843 1 12 . 1 1 110 110 LEU CB C 110 41.055 41.055 40.767 0.288 25685 8844 1 12 . 1 1 110 110 LEU H H 110 7.744 7.744 8.064 -0.320 25685 8845 1 12 . 1 1 111 111 LEU N N 111 116.594 116.594 117.326 -0.732 25685 8846 1 12 . 1 1 111 111 LEU C C 111 178.960 178.960 179.184 -0.224 25685 8847 1 12 . 1 1 111 111 LEU CA C 111 57.366 57.366 57.887 -0.521 25685 8848 1 12 . 1 1 111 111 LEU CB C 111 40.259 40.259 41.154 -0.895 25685 8849 1 12 . 1 1 111 111 LEU H H 111 7.732 7.732 7.306 0.426 25685 8850 1 12 . 1 1 112 112 ALA N N 112 121.020 121.020 121.294 -0.274 25685 8851 1 12 . 1 1 112 112 ALA C C 112 178.700 178.700 179.606 -0.906 25685 8852 1 12 . 1 1 112 112 ALA CA C 112 55.432 55.432 54.910 0.521 25685 8853 1 12 . 1 1 112 112 ALA CB C 112 18.214 18.214 18.497 -0.283 25685 8854 1 12 . 1 1 112 112 ALA H H 112 8.121 8.121 7.522 0.599 25685 8855 1 12 . 1 1 113 113 PHE N N 113 118.369 118.369 116.769 1.600 25685 8856 1 12 . 1 1 113 113 PHE C C 113 176.091 176.091 177.925 -1.834 25685 8857 1 12 . 1 1 113 113 PHE CA C 113 61.388 61.388 58.773 2.615 25685 8858 1 12 . 1 1 113 113 PHE CB C 113 39.688 39.688 37.703 1.985 25685 8859 1 12 . 1 1 113 113 PHE H H 113 8.237 8.237 7.353 0.884 25685 8860 1 12 . 1 1 114 114 LEU N N 114 114.214 114.214 119.873 -5.659 25685 8861 1 12 . 1 1 114 114 LEU C C 114 177.038 177.038 178.199 -1.161 25685 8862 1 12 . 1 1 114 114 LEU CA C 114 56.358 56.358 58.694 -2.336 25685 8863 1 12 . 1 1 114 114 LEU CB C 114 42.716 42.716 42.107 0.609 25685 8864 1 12 . 1 1 114 114 LEU H H 114 7.576 7.576 7.642 -0.066 25685 8865 1 12 . 1 1 115 115 TRP N N 115 112.667 112.667 116.782 -4.115 25685 8866 1 12 . 1 1 115 115 TRP C C 115 180.163 180.163 177.203 2.960 25685 8867 1 12 . 1 1 115 115 TRP CA C 115 55.930 55.930 58.827 -2.897 25685 8868 1 12 . 1 1 115 115 TRP H H 115 8.542 8.542 7.370 1.172 25685 8869 1 12 . 1 1 116 116 LEU N N 116 122.144 122.144 119.960 2.184 25685 8870 1 12 . 1 1 116 116 LEU C C 116 175.953 175.953 176.990 -1.037 25685 8871 1 12 . 1 1 116 116 LEU CA C 116 59.924 59.924 58.197 1.727 25685 8872 1 12 . 1 1 116 116 LEU CB C 116 39.097 39.097 39.153 -0.056 25685 8873 1 12 . 1 1 116 116 LEU H H 116 8.996 8.996 6.977 2.019 25685 8874 1 12 . 1 1 117 117 PRO C C 117 174.220 174.220 177.302 -3.082 25685 8875 1 12 . 1 1 117 117 PRO CA C 117 66.300 66.300 64.097 2.203 25685 8876 1 12 . 1 1 118 118 ALA N N 118 110.603 110.603 120.924 -10.321 25685 8877 1 12 . 1 1 118 118 ALA C C 118 177.162 177.162 178.584 -1.422 25685 8878 1 12 . 1 1 118 118 ALA CA C 118 52.670 52.670 53.578 -0.908 25685 8879 1 12 . 1 1 118 118 ALA CB C 118 18.853 18.853 19.564 -0.712 25685 8880 1 12 . 1 1 118 118 ALA H H 118 6.633 6.633 7.502 -0.869 25685 8881 1 12 . 1 1 119 119 ILE N N 119 113.492 113.492 115.531 -2.039 25685 8882 1 12 . 1 1 119 119 ILE CA C 119 63.703 63.703 63.801 -0.098 25685 8883 1 12 . 1 1 119 119 ILE CB C 119 39.605 39.605 37.310 2.295 25685 8884 1 12 . 1 1 119 119 ILE H H 119 7.693 7.693 8.441 -0.748 25685 8885 1 12 . 1 1 121 121 PRO C C 121 178.089 178.089 178.784 -0.695 25685 8886 1 12 . 1 1 121 121 PRO CA C 121 66.004 66.004 65.911 0.093 25685 8887 1 12 . 1 1 122 122 PHE N N 122 113.797 113.797 119.234 -5.437 25685 8888 1 12 . 1 1 122 122 PHE C C 122 177.713 177.713 176.553 1.160 25685 8889 1 12 . 1 1 122 122 PHE CA C 122 61.566 61.566 60.466 1.100 25685 8890 1 12 . 1 1 122 122 PHE CB C 122 38.983 38.983 38.761 0.222 25685 8891 1 12 . 1 1 122 122 PHE H H 122 6.846 6.846 7.951 -1.105 25685 8892 1 12 . 1 1 123 123 ALA N N 123 121.512 121.512 121.258 0.254 25685 8893 1 12 . 1 1 123 123 ALA C C 123 179.318 179.318 179.678 -0.360 25685 8894 1 12 . 1 1 123 123 ALA CA C 123 54.975 54.975 55.217 -0.242 25685 8895 1 12 . 1 1 123 123 ALA CB C 123 17.881 17.881 17.992 -0.111 25685 8896 1 12 . 1 1 123 123 ALA H H 123 8.411 8.411 8.828 -0.417 25685 8897 1 12 . 1 1 124 124 GLY N N 124 104.093 104.093 107.172 -3.079 25685 8898 1 12 . 1 1 124 124 GLY C C 124 175.410 175.410 176.068 -0.658 25685 8899 1 12 . 1 1 124 124 GLY CA C 124 47.370 47.370 46.830 0.541 25685 8900 1 12 . 1 1 124 124 GLY H H 124 8.455 8.455 7.910 0.545 25685 8901 1 12 . 1 1 125 125 ILE N N 125 121.895 121.895 122.944 -1.049 25685 8902 1 12 . 1 1 125 125 ILE C C 125 178.329 178.329 177.141 1.188 25685 8903 1 12 . 1 1 125 125 ILE CA C 125 64.412 64.412 63.389 1.023 25685 8904 1 12 . 1 1 125 125 ILE H H 125 7.954 7.954 7.514 0.440 25685 8905 1 12 . 1 1 126 126 ALA N N 126 122.768 122.768 123.059 -0.291 25685 8906 1 12 . 1 1 126 126 ALA C C 126 180.341 180.341 179.604 0.737 25685 8907 1 12 . 1 1 126 126 ALA CA C 126 55.266 55.266 55.187 0.079 25685 8908 1 12 . 1 1 126 126 ALA CB C 126 18.226 18.226 17.951 0.275 25685 8909 1 12 . 1 1 126 126 ALA H H 126 8.142 8.142 7.448 0.694 25685 8910 1 12 . 1 1 127 127 ILE N N 127 116.752 116.752 118.778 -2.026 25685 8911 1 12 . 1 1 127 127 ILE C C 127 177.993 177.993 177.577 0.416 25685 8912 1 12 . 1 1 127 127 ILE CA C 127 63.877 63.877 62.833 1.044 25685 8913 1 12 . 1 1 127 127 ILE CB C 127 37.657 37.657 37.076 0.581 25685 8914 1 12 . 1 1 127 127 ILE H H 127 8.335 8.335 7.563 0.772 25685 8915 1 12 . 1 1 128 128 SER N N 128 116.351 116.351 114.999 1.352 25685 8916 1 12 . 1 1 128 128 SER C C 128 175.796 175.796 176.805 -1.009 25685 8917 1 12 . 1 1 128 128 SER CA C 128 61.818 61.818 61.955 -0.137 25685 8918 1 12 . 1 1 128 128 SER H H 128 7.939 7.939 7.573 0.366 25685 8919 1 12 . 1 1 129 129 GLN N N 129 118.082 118.082 120.949 -2.867 25685 8920 1 12 . 1 1 129 129 GLN C C 129 177.419 177.419 177.692 -0.273 25685 8921 1 12 . 1 1 129 129 GLN CA C 129 57.106 57.106 58.642 -1.536 25685 8922 1 12 . 1 1 129 129 GLN CB C 129 28.631 28.631 28.265 0.366 25685 8923 1 12 . 1 1 129 129 GLN H H 129 7.943 7.943 7.608 0.335 25685 8924 1 12 . 1 1 130 130 THR N N 130 113.484 113.484 114.840 -1.356 25685 8925 1 12 . 1 1 130 130 THR C C 130 175.627 175.627 175.803 -0.176 25685 8926 1 12 . 1 1 130 130 THR CA C 130 63.758 63.758 64.711 -0.953 25685 8927 1 12 . 1 1 130 130 THR CB C 130 69.182 69.182 69.041 0.141 25685 8928 1 12 . 1 1 130 130 THR H H 130 7.686 7.686 7.617 0.069 25685 8929 1 12 . 1 1 131 131 LEU N N 131 121.347 121.347 120.601 0.746 25685 8930 1 12 . 1 1 131 131 LEU C C 131 177.522 177.522 176.840 0.682 25685 8931 1 12 . 1 1 131 131 LEU CA C 131 56.307 56.307 56.278 0.029 25685 8932 1 12 . 1 1 131 131 LEU CB C 131 41.711 41.711 42.285 -0.574 25685 8933 1 12 . 1 1 131 131 LEU H H 131 8.071 8.071 7.364 0.707 25685 8934 1 12 . 1 1 132 132 LEU N N 132 118.162 118.162 117.410 0.752 25685 8935 1 12 . 1 1 132 132 LEU C C 132 177.461 177.461 176.817 0.644 25685 8936 1 12 . 1 1 132 132 LEU CA C 132 55.264 55.264 54.259 1.005 25685 8937 1 12 . 1 1 132 132 LEU CB C 132 41.613 41.613 41.870 -0.257 25685 8938 1 12 . 1 1 132 132 LEU H H 132 7.810 7.810 7.727 0.083 25685 8939 1 12 . 1 1 133 133 SER N N 133 114.244 114.244 115.054 -0.810 25685 8940 1 12 . 1 1 133 133 SER C C 133 174.363 174.363 173.849 0.514 25685 8941 1 12 . 1 1 133 133 SER CA C 133 59.019 59.019 59.266 -0.247 25685 8942 1 12 . 1 1 133 133 SER CB C 133 64.634 64.634 63.629 1.005 25685 8943 1 12 . 1 1 133 133 SER H H 133 7.829 7.829 8.108 -0.279 25685 8944 1 12 . 1 1 134 134 GLU N N 134 120.151 120.151 119.841 0.310 25685 8945 1 12 . 1 1 134 134 GLU C C 134 175.935 175.935 175.502 0.433 25685 8946 1 12 . 1 1 134 134 GLU CA C 134 56.301 56.301 56.322 -0.021 25685 8947 1 12 . 1 1 134 134 GLU CB C 134 30.129 30.129 30.665 -0.536 25685 8948 1 12 . 1 1 134 134 GLU H H 134 8.054 8.054 8.386 -0.332 25685 8949 1 12 . 1 1 135 135 ASN N N 135 118.890 118.890 121.027 -2.137 25685 8950 1 12 . 1 1 135 135 ASN C C 135 174.272 174.272 173.809 0.463 25685 8951 1 12 . 1 1 135 135 ASN CA C 135 51.390 51.390 51.898 -0.508 25685 8952 1 12 . 1 1 135 135 ASN CB C 135 39.129 39.129 38.433 0.696 25685 8953 1 12 . 1 1 135 135 ASN H H 135 8.305 8.305 8.420 -0.115 25685 8954 1 12 . 1 1 136 136 PRO C C 136 177.960 177.960 178.117 -0.157 25685 8955 1 12 . 1 1 136 136 PRO CA C 136 64.530 64.530 65.547 -1.017 25685 8956 1 12 . 1 1 136 136 PRO CB C 136 31.809 31.809 31.845 -0.035 25685 8957 1 12 . 1 1 137 137 LEU N N 137 117.735 117.735 118.035 -0.300 25685 8958 1 12 . 1 1 137 137 LEU C C 137 179.217 179.217 179.415 -0.198 25685 8959 1 12 . 1 1 137 137 LEU CA C 137 57.039 57.039 58.072 -1.033 25685 8960 1 12 . 1 1 137 137 LEU CB C 137 40.799 40.799 41.367 -0.568 25685 8961 1 12 . 1 1 137 137 LEU H H 137 8.248 8.248 8.037 0.211 25685 8962 1 12 . 1 1 138 138 VAL N N 138 119.589 119.589 118.884 0.705 25685 8963 1 12 . 1 1 138 138 VAL C C 138 177.894 177.894 177.665 0.229 25685 8964 1 12 . 1 1 138 138 VAL CA C 138 64.727 64.727 65.665 -0.938 25685 8965 1 12 . 1 1 138 138 VAL CB C 138 31.347 31.347 31.339 0.008 25685 8966 1 12 . 1 1 138 138 VAL H H 138 7.483 7.483 7.662 -0.179 25685 8967 1 12 . 1 1 139 139 MET N N 139 119.431 119.431 120.601 -1.170 25685 8968 1 12 . 1 1 139 139 MET C C 139 177.988 177.988 178.295 -0.307 25685 8969 1 12 . 1 1 139 139 MET CA C 139 57.403 57.403 57.245 0.158 25685 8970 1 12 . 1 1 139 139 MET CB C 139 31.709 31.709 32.073 -0.364 25685 8971 1 12 . 1 1 139 139 MET H H 139 7.837 7.837 8.450 -0.613 25685 8972 1 12 . 1 1 140 140 LEU N N 140 119.686 119.686 120.553 -0.867 25685 8973 1 12 . 1 1 140 140 LEU C C 140 177.916 177.916 178.662 -0.746 25685 8974 1 12 . 1 1 140 140 LEU CA C 140 56.877 56.877 58.710 -1.833 25685 8975 1 12 . 1 1 140 140 LEU CB C 140 41.491 41.491 41.578 -0.087 25685 8976 1 12 . 1 1 140 140 LEU H H 140 7.926 7.926 8.895 -0.969 25685 8977 1 12 . 1 1 141 141 SER N N 141 114.167 114.167 115.045 -0.878 25685 8978 1 12 . 1 1 141 141 SER C C 141 176.030 176.030 177.342 -1.312 25685 8979 1 12 . 1 1 141 141 SER CA C 141 60.425 60.425 62.020 -1.595 25685 8980 1 12 . 1 1 141 141 SER CB C 141 63.956 63.956 63.279 0.677 25685 8981 1 12 . 1 1 141 141 SER H H 141 7.757 7.757 8.363 -0.606 25685 8982 1 12 . 1 1 142 142 TYR N N 142 121.679 121.679 121.256 0.423 25685 8983 1 12 . 1 1 142 142 TYR C C 142 177.659 177.659 178.595 -0.936 25685 8984 1 12 . 1 1 142 142 TYR CA C 142 59.673 59.673 58.927 0.746 25685 8985 1 12 . 1 1 142 142 TYR CB C 142 38.079 38.079 37.648 0.431 25685 8986 1 12 . 1 1 142 142 TYR H H 142 7.965 7.965 8.843 -0.878 25685 8987 1 12 . 1 1 143 143 GLY N N 143 107.396 107.396 108.260 -0.864 25685 8988 1 12 . 1 1 143 143 GLY C C 143 174.877 174.877 176.077 -1.200 25685 8989 1 12 . 1 1 143 143 GLY CA C 143 46.343 46.343 47.290 -0.947 25685 8990 1 12 . 1 1 143 143 GLY H H 143 8.177 8.177 8.971 -0.794 25685 8991 1 12 . 1 1 144 144 LEU N N 144 120.477 120.477 122.810 -2.333 25685 8992 1 12 . 1 1 144 144 LEU C C 144 178.504 178.504 178.903 -0.399 25685 8993 1 12 . 1 1 144 144 LEU CA C 144 56.270 56.270 57.313 -1.044 25685 8994 1 12 . 1 1 144 144 LEU CB C 144 41.662 41.662 41.762 -0.100 25685 8995 1 12 . 1 1 144 144 LEU H H 144 8.055 8.055 7.569 0.486 25685 8996 1 12 . 1 1 145 145 GLY N N 145 106.847 106.847 106.631 0.216 25685 8997 1 12 . 1 1 145 145 GLY C C 145 175.375 175.375 176.151 -0.776 25685 8998 1 12 . 1 1 145 145 GLY CA C 145 45.582 45.582 46.913 -1.331 25685 8999 1 12 . 1 1 145 145 GLY H H 145 8.066 8.066 7.683 0.383 25685 9000 1 12 . 1 1 146 146 MET N N 146 120.376 120.376 122.081 -1.705 25685 9001 1 12 . 1 1 146 146 MET C C 146 176.663 176.663 178.089 -1.426 25685 9002 1 12 . 1 1 146 146 MET CA C 146 57.030 57.030 57.830 -0.800 25685 9003 1 12 . 1 1 146 146 MET CB C 146 30.720 30.720 32.335 -1.615 25685 9004 1 12 . 1 1 146 146 MET H H 146 8.157 8.157 8.732 -0.575 25685 9005 1 12 . 1 1 147 147 ALA N N 147 123.038 123.038 121.945 1.093 25685 9006 1 12 . 1 1 147 147 ALA C C 147 178.917 178.917 179.755 -0.838 25685 9007 1 12 . 1 1 147 147 ALA CA C 147 54.201 54.201 55.311 -1.110 25685 9008 1 12 . 1 1 147 147 ALA CB C 147 18.810 18.810 18.067 0.743 25685 9009 1 12 . 1 1 147 147 ALA H H 147 8.336 8.336 8.717 -0.381 25685 9010 1 12 . 1 1 148 148 VAL N N 148 117.795 117.795 117.454 0.341 25685 9011 1 12 . 1 1 148 148 VAL C C 148 176.891 176.891 178.204 -1.313 25685 9012 1 12 . 1 1 148 148 VAL CA C 148 64.157 64.157 66.628 -2.471 25685 9013 1 12 . 1 1 148 148 VAL CB C 148 31.529 31.529 31.824 -0.295 25685 9014 1 12 . 1 1 148 148 VAL H H 148 7.908 7.908 7.520 0.388 25685 9015 1 12 . 1 1 149 149 THR N N 149 116.069 116.069 116.655 -0.586 25685 9016 1 12 . 1 1 149 149 THR C C 149 176.054 176.054 176.363 -0.309 25685 9017 1 12 . 1 1 149 149 THR CA C 149 63.308 63.308 67.443 -4.135 25685 9018 1 12 . 1 1 149 149 THR H H 149 7.414 7.414 7.568 -0.154 25685 9019 1 12 . 1 1 150 150 ILE N N 150 121.971 121.971 121.324 0.647 25685 9020 1 12 . 1 1 150 150 ILE C C 150 177.715 177.715 176.769 0.946 25685 9021 1 12 . 1 1 150 150 ILE CA C 150 64.319 64.319 63.454 0.865 25685 9022 1 12 . 1 1 150 150 ILE CB C 150 36.628 36.628 37.812 -1.184 25685 9023 1 12 . 1 1 150 150 ILE H H 150 8.772 8.772 8.633 0.139 25685 9024 1 12 . 1 1 151 151 ALA N N 151 122.272 122.272 121.506 0.766 25685 9025 1 12 . 1 1 151 151 ALA C C 151 180.370 180.370 179.573 0.797 25685 9026 1 12 . 1 1 151 151 ALA CA C 151 55.336 55.336 55.244 0.092 25685 9027 1 12 . 1 1 151 151 ALA CB C 151 18.107 18.107 18.026 0.081 25685 9028 1 12 . 1 1 151 151 ALA H H 151 8.163 8.163 7.605 0.558 25685 9029 1 12 . 1 1 152 152 ALA N N 152 120.648 120.648 121.006 -0.358 25685 9030 1 12 . 1 1 152 152 ALA C C 152 181.019 181.019 179.457 1.562 25685 9031 1 12 . 1 1 152 152 ALA CA C 152 54.944 54.944 54.945 -0.001 25685 9032 1 12 . 1 1 152 152 ALA CB C 152 18.963 18.963 18.631 0.332 25685 9033 1 12 . 1 1 152 152 ALA H H 152 7.877 7.877 7.424 0.453 25685 9034 1 12 . 1 1 153 153 VAL N N 153 119.372 119.372 119.068 0.304 25685 9035 1 12 . 1 1 153 153 VAL C C 153 178.197 178.197 177.766 0.431 25685 9036 1 12 . 1 1 153 153 VAL CA C 153 66.289 66.289 65.521 0.768 25685 9037 1 12 . 1 1 153 153 VAL CB C 153 30.770 30.770 32.014 -1.244 25685 9038 1 12 . 1 1 153 153 VAL H H 153 8.118 8.118 7.684 0.434 25685 9039 1 12 . 1 1 154 154 PHE N N 154 120.362 120.362 119.994 0.368 25685 9040 1 12 . 1 1 154 154 PHE C C 154 177.733 177.733 176.972 0.761 25685 9041 1 12 . 1 1 154 154 PHE CA C 154 61.412 61.412 61.505 -0.093 25685 9042 1 12 . 1 1 154 154 PHE CB C 154 38.465 38.465 38.833 -0.367 25685 9043 1 12 . 1 1 154 154 PHE H H 154 8.508 8.508 8.168 0.340 25685 9044 1 12 . 1 1 155 155 LYS N N 155 118.894 118.894 118.300 0.594 25685 9045 1 12 . 1 1 155 155 LYS C C 155 179.940 179.940 178.496 1.444 25685 9046 1 12 . 1 1 155 155 LYS CA C 155 58.969 58.969 59.248 -0.279 25685 9047 1 12 . 1 1 155 155 LYS CB C 155 31.725 31.725 32.093 -0.368 25685 9048 1 12 . 1 1 155 155 LYS H H 155 8.035 8.035 7.614 0.421 25685 9049 1 12 . 1 1 156 156 MET N N 156 118.853 118.853 117.895 0.958 25685 9050 1 12 . 1 1 156 156 MET C C 156 179.245 179.245 177.581 1.664 25685 9051 1 12 . 1 1 156 156 MET CA C 156 58.518 58.518 57.687 0.831 25685 9052 1 12 . 1 1 156 156 MET CB C 156 31.912 31.912 30.782 1.130 25685 9053 1 12 . 1 1 156 156 MET H H 156 8.014 8.014 7.851 0.163 25685 9054 1 12 . 1 1 157 157 GLY N N 157 108.239 108.239 107.920 0.319 25685 9055 1 12 . 1 1 157 157 GLY C C 157 174.637 174.637 174.979 -0.342 25685 9056 1 12 . 1 1 157 157 GLY CA C 157 47.204 47.204 46.478 0.725 25685 9057 1 12 . 1 1 157 157 GLY H H 157 8.614 8.614 7.639 0.975 25685 9058 1 12 . 1 1 158 158 GLU N N 158 122.902 122.902 118.310 4.592 25685 9059 1 12 . 1 1 158 158 GLU C C 158 177.851 177.851 176.774 1.077 25685 9060 1 12 . 1 1 158 158 GLU CA C 158 60.203 60.203 57.502 2.701 25685 9061 1 12 . 1 1 158 158 GLU CB C 158 28.870 28.870 30.416 -1.546 25685 9062 1 12 . 1 1 158 158 GLU H H 158 8.550 8.550 7.526 1.024 25685 9063 1 12 . 1 1 159 159 LYS N N 159 117.932 117.932 117.329 0.603 25685 9064 1 12 . 1 1 159 159 LYS C C 159 179.529 179.529 175.349 4.180 25685 9065 1 12 . 1 1 159 159 LYS CA C 159 59.419 59.419 55.915 3.504 25685 9066 1 12 . 1 1 159 159 LYS CB C 159 31.759 31.759 34.667 -2.908 25685 9067 1 12 . 1 1 159 159 LYS H H 159 7.641 7.641 7.449 0.192 25685 9068 1 12 . 1 1 160 160 PHE N N 160 120.614 120.614 116.096 4.518 25685 9069 1 12 . 1 1 160 160 PHE C C 160 178.511 178.511 174.217 4.294 25685 9070 1 12 . 1 1 160 160 PHE CA C 160 61.580 61.580 57.223 4.357 25685 9071 1 12 . 1 1 160 160 PHE CB C 160 39.909 39.909 40.153 -0.243 25685 9072 1 12 . 1 1 160 160 PHE H H 160 8.026 8.026 8.171 -0.145 25685 9073 1 12 . 1 1 161 161 VAL N N 161 119.870 119.870 118.517 1.353 25685 9074 1 12 . 1 1 161 161 VAL C C 161 177.347 177.347 176.579 0.768 25685 9075 1 12 . 1 1 161 161 VAL CA C 161 66.121 66.121 62.922 3.199 25685 9076 1 12 . 1 1 161 161 VAL CB C 161 30.935 30.935 33.166 -2.231 25685 9077 1 12 . 1 1 161 161 VAL H H 161 8.628 8.628 7.673 0.955 25685 9078 1 12 . 1 1 162 162 LYS N N 162 116.237 116.237 123.583 -7.346 25685 9079 1 12 . 1 1 162 162 LYS C C 162 179.197 179.197 176.771 2.426 25685 9080 1 12 . 1 1 162 162 LYS CA C 162 60.037 60.037 59.168 0.869 25685 9081 1 12 . 1 1 162 162 LYS CB C 162 31.333 31.333 32.472 -1.139 25685 9082 1 12 . 1 1 162 162 LYS H H 162 7.843 7.843 8.721 -0.878 25685 9083 1 12 . 1 1 163 163 ALA N N 163 119.197 119.197 116.235 2.962 25685 9084 1 12 . 1 1 163 163 ALA C C 163 178.635 178.635 175.389 3.246 25685 9085 1 12 . 1 1 163 163 ALA CA C 163 53.681 53.681 51.899 1.782 25685 9086 1 12 . 1 1 163 163 ALA CB C 163 19.586 19.586 19.608 -0.022 25685 9087 1 12 . 1 1 163 163 ALA H H 163 7.630 7.630 7.713 -0.083 25685 9088 1 12 . 1 1 164 164 ASN N N 164 115.956 115.956 116.751 -0.795 25685 9089 1 12 . 1 1 164 164 ASN C C 164 175.556 175.556 175.586 -0.030 25685 9090 1 12 . 1 1 164 164 ASN CA C 164 52.267 52.267 52.970 -0.703 25685 9091 1 12 . 1 1 164 164 ASN CB C 164 39.148 39.148 38.704 0.444 25685 9092 1 12 . 1 1 164 164 ASN H H 164 7.326 7.326 8.100 -0.774 25685 9093 1 12 . 1 1 165 165 PHE N N 165 121.612 121.612 124.834 -3.222 25685 9094 1 12 . 1 1 165 165 PHE C C 165 177.069 177.069 176.339 0.730 25685 9095 1 12 . 1 1 165 165 PHE CA C 165 62.921 62.921 60.845 2.076 25685 9096 1 12 . 1 1 165 165 PHE CB C 165 39.427 39.427 38.948 0.479 25685 9097 1 12 . 1 1 165 165 PHE H H 165 7.408 7.408 8.702 -1.294 25685 9098 1 12 . 1 1 166 166 GLN N N 166 117.147 117.147 117.686 -0.539 25685 9099 1 12 . 1 1 166 166 GLN C C 166 178.922 178.922 177.793 1.129 25685 9100 1 12 . 1 1 166 166 GLN CA C 166 59.262 59.262 58.376 0.886 25685 9101 1 12 . 1 1 166 166 GLN CB C 166 26.811 26.811 27.544 -0.733 25685 9102 1 12 . 1 1 166 166 GLN H H 166 8.605 8.605 8.552 0.053 25685 9103 1 12 . 1 1 167 167 LEU N N 167 121.946 121.946 120.607 1.339 25685 9104 1 12 . 1 1 167 167 LEU C C 167 178.863 178.863 178.147 0.716 25685 9105 1 12 . 1 1 167 167 LEU CA C 167 58.039 58.039 57.576 0.463 25685 9106 1 12 . 1 1 167 167 LEU CB C 167 41.130 41.130 42.076 -0.946 25685 9107 1 12 . 1 1 167 167 LEU H H 167 7.892 7.892 7.520 0.372 25685 9108 1 12 . 1 1 168 168 ILE N N 168 118.751 118.751 114.624 4.127 25685 9109 1 12 . 1 1 168 168 ILE C C 168 179.908 179.908 177.193 2.715 25685 9110 1 12 . 1 1 168 168 ILE CA C 168 63.886 63.886 63.879 0.007 25685 9111 1 12 . 1 1 168 168 ILE CB C 168 36.170 36.170 37.516 -1.346 25685 9112 1 12 . 1 1 168 168 ILE H H 168 8.065 8.065 7.311 0.754 25685 9113 1 12 . 1 1 169 169 ARG N N 169 125.851 125.851 119.296 6.555 25685 9114 1 12 . 1 1 169 169 ARG C C 169 177.579 177.579 177.758 -0.179 25685 9115 1 12 . 1 1 169 169 ARG CA C 169 60.306 60.306 59.111 1.195 25685 9116 1 12 . 1 1 169 169 ARG CB C 169 29.224 29.224 29.631 -0.407 25685 9117 1 12 . 1 1 169 169 ARG H H 169 8.995 8.995 7.521 1.474 25685 9118 1 12 . 1 1 170 170 LYS N N 170 119.586 119.586 119.407 0.179 25685 9119 1 12 . 1 1 170 170 LYS C C 170 178.584 178.584 178.674 -0.090 25685 9120 1 12 . 1 1 170 170 LYS CA C 170 60.293 60.293 59.094 1.199 25685 9121 1 12 . 1 1 170 170 LYS CB C 170 32.530 32.530 31.292 1.238 25685 9122 1 12 . 1 1 170 170 LYS H H 170 7.663 7.663 7.497 0.166 25685 9123 1 12 . 1 1 171 171 VAL N N 171 118.348 118.348 118.968 -0.620 25685 9124 1 12 . 1 1 171 171 VAL C C 171 177.478 177.478 177.763 -0.285 25685 9125 1 12 . 1 1 171 171 VAL CA C 171 66.641 66.641 66.265 0.376 25685 9126 1 12 . 1 1 171 171 VAL CB C 171 31.565 31.565 30.766 0.799 25685 9127 1 12 . 1 1 171 171 VAL H H 171 8.515 8.515 7.609 0.906 25685 9128 1 12 . 1 1 172 172 THR N N 172 115.172 115.172 115.860 -0.688 25685 9129 1 12 . 1 1 172 172 THR C C 172 176.320 176.320 176.538 -0.218 25685 9130 1 12 . 1 1 172 172 THR H H 172 8.416 8.416 7.497 0.919 25685 9131 1 12 . 1 1 173 173 GLY N N 173 108.801 108.801 108.646 0.155 25685 9132 1 12 . 1 1 173 173 GLY C C 173 174.138 174.138 175.048 -0.910 25685 9133 1 12 . 1 1 173 173 GLY CA C 173 47.769 47.769 46.851 0.918 25685 9134 1 12 . 1 1 173 173 GLY H H 173 8.505 8.505 7.600 0.905 25685 9135 1 12 . 1 1 174 174 ALA N N 174 123.573 123.573 124.446 -0.873 25685 9136 1 12 . 1 1 174 174 ALA C C 174 178.782 178.782 179.100 -0.318 25685 9137 1 12 . 1 1 174 174 ALA CA C 174 55.604 55.604 54.793 0.811 25685 9138 1 12 . 1 1 174 174 ALA CB C 174 18.778 18.778 18.602 0.176 25685 9139 1 12 . 1 1 174 174 ALA H H 174 8.038 8.038 7.437 0.601 25685 9140 1 12 . 1 1 175 175 ILE N N 175 118.501 118.501 119.147 -0.646 25685 9141 1 12 . 1 1 175 175 ILE C C 175 178.247 178.247 177.626 0.621 25685 9142 1 12 . 1 1 175 175 ILE CA C 175 65.412 65.412 65.004 0.408 25685 9143 1 12 . 1 1 175 175 ILE CB C 175 37.671 37.671 38.292 -0.621 25685 9144 1 12 . 1 1 175 175 ILE H H 175 7.897 7.897 7.340 0.557 25685 9145 1 12 . 1 1 176 176 VAL N N 176 120.104 120.104 119.623 0.481 25685 9146 1 12 . 1 1 176 176 VAL C C 176 177.945 177.945 178.075 -0.130 25685 9147 1 12 . 1 1 176 176 VAL CA C 176 67.761 67.761 65.857 1.904 25685 9148 1 12 . 1 1 176 176 VAL CB C 176 30.662 30.662 31.575 -0.913 25685 9149 1 12 . 1 1 176 176 VAL H H 176 8.321 8.321 7.571 0.750 25685 9150 1 12 . 1 1 177 177 LEU N N 177 118.561 118.561 118.292 0.269 25685 9151 1 12 . 1 1 177 177 LEU C C 177 178.563 178.563 178.776 -0.213 25685 9152 1 12 . 1 1 177 177 LEU CA C 177 58.094 58.094 58.386 -0.292 25685 9153 1 12 . 1 1 177 177 LEU CB C 177 41.061 41.061 40.545 0.516 25685 9154 1 12 . 1 1 177 177 LEU H H 177 8.097 8.097 7.307 0.790 25685 9155 1 12 . 1 1 178 178 LEU N N 178 120.868 120.868 120.089 0.779 25685 9156 1 12 . 1 1 178 178 LEU C C 178 178.524 178.524 178.050 0.474 25685 9157 1 12 . 1 1 178 178 LEU CA C 178 57.767 57.767 57.687 0.080 25685 9158 1 12 . 1 1 178 178 LEU CB C 178 40.886 40.886 40.857 0.029 25685 9159 1 12 . 1 1 178 178 LEU H H 178 8.229 8.229 7.120 1.109 25685 9160 1 12 . 1 1 179 179 TYR N N 179 119.355 119.355 119.560 -0.205 25685 9161 1 12 . 1 1 179 179 TYR C C 179 180.059 180.059 177.696 2.363 25685 9162 1 12 . 1 1 179 179 TYR CA C 179 63.844 63.844 62.010 1.834 25685 9163 1 12 . 1 1 179 179 TYR CB C 179 39.508 39.508 38.653 0.855 25685 9164 1 12 . 1 1 179 179 TYR H H 179 8.759 8.759 7.422 1.337 25685 9165 1 12 . 1 1 180 180 LEU N N 180 118.984 118.984 119.022 -0.038 25685 9166 1 12 . 1 1 180 180 LEU C C 180 179.079 179.079 179.398 -0.319 25685 9167 1 12 . 1 1 180 180 LEU CA C 180 58.879 58.879 57.759 1.120 25685 9168 1 12 . 1 1 180 180 LEU CB C 180 41.899 41.899 40.809 1.089 25685 9169 1 12 . 1 1 180 180 LEU H H 180 8.315 8.315 7.656 0.659 25685 9170 1 12 . 1 1 181 181 ALA N N 181 121.826 121.826 122.325 -0.499 25685 9171 1 12 . 1 1 181 181 ALA C C 181 180.009 180.009 179.872 0.137 25685 9172 1 12 . 1 1 181 181 ALA CA C 181 55.700 55.700 55.193 0.507 25685 9173 1 12 . 1 1 181 181 ALA CB C 181 17.713 17.713 18.478 -0.765 25685 9174 1 12 . 1 1 181 181 ALA H H 181 8.480 8.480 8.055 0.425 25685 9175 1 12 . 1 1 182 182 TYR N N 182 118.039 118.039 118.474 -0.435 25685 9176 1 12 . 1 1 182 182 TYR CA C 182 59.038 59.038 61.821 -2.783 25685 9177 1 12 . 1 1 182 182 TYR H H 182 8.856 8.856 7.826 1.030 25685 9178 1 12 . 1 1 183 183 PHE N N 183 124.769 124.769 120.031 4.738 25685 9179 1 12 . 1 1 183 183 PHE CA C 183 63.566 63.566 60.192 3.374 25685 9180 1 12 . 1 1 183 183 PHE H H 183 9.764 9.764 7.717 2.047 25685 9181 1 13 . 1 1 4 4 ALA N N 4 121.533 121.533 123.947 -2.414 25685 9182 1 13 . 1 1 4 4 ALA C C 4 177.632 177.632 178.356 -0.724 25685 9183 1 13 . 1 1 4 4 ALA CA C 4 55.117 55.117 54.882 0.235 25685 9184 1 13 . 1 1 4 4 ALA CB C 4 18.448 18.448 17.956 0.492 25685 9185 1 13 . 1 1 4 4 ALA H H 4 7.977 7.977 7.857 0.120 25685 9186 1 13 . 1 1 5 5 PHE N N 5 119.988 119.988 117.037 2.951 25685 9187 1 13 . 1 1 5 5 PHE CA C 5 60.759 60.759 59.764 0.995 25685 9188 1 13 . 1 1 5 5 PHE CB C 5 39.221 39.221 37.616 1.605 25685 9189 1 13 . 1 1 5 5 PHE H H 5 8.210 8.210 6.505 1.705 25685 9190 1 13 . 1 1 6 6 ALA C C 6 179.794 179.794 179.518 0.276 25685 9191 1 13 . 1 1 6 6 ALA CA C 6 55.619 55.619 54.823 0.796 25685 9192 1 13 . 1 1 6 6 ALA CB C 6 17.911 17.911 17.923 -0.012 25685 9193 1 13 . 1 1 6 6 ALA H H 6 8.417 8.417 7.995 0.422 25685 9194 1 13 . 1 1 7 7 LEU N N 7 115.852 115.852 119.532 -3.680 25685 9195 1 13 . 1 1 7 7 LEU C C 7 180.196 180.196 178.987 1.209 25685 9196 1 13 . 1 1 7 7 LEU CA C 7 57.528 57.528 57.388 0.140 25685 9197 1 13 . 1 1 7 7 LEU CB C 7 40.060 40.060 41.647 -1.587 25685 9198 1 13 . 1 1 7 7 LEU H H 7 8.741 8.741 7.911 0.830 25685 9199 1 13 . 1 1 8 8 GLY N N 8 110.199 110.199 106.300 3.899 25685 9200 1 13 . 1 1 8 8 GLY C C 8 176.430 176.430 176.362 0.068 25685 9201 1 13 . 1 1 8 8 GLY CA C 8 46.960 46.960 47.837 -0.877 25685 9202 1 13 . 1 1 8 8 GLY H H 8 8.179 8.179 7.804 0.375 25685 9203 1 13 . 1 1 9 9 ILE N N 9 122.346 122.346 119.481 2.865 25685 9204 1 13 . 1 1 9 9 ILE C C 9 178.143 178.143 177.292 0.851 25685 9205 1 13 . 1 1 9 9 ILE CA C 9 65.048 65.048 63.800 1.248 25685 9206 1 13 . 1 1 9 9 ILE CB C 9 36.841 36.841 37.902 -1.061 25685 9207 1 13 . 1 1 9 9 ILE H H 9 7.788 7.788 7.557 0.231 25685 9208 1 13 . 1 1 10 10 LEU N N 10 117.560 117.560 119.733 -2.173 25685 9209 1 13 . 1 1 10 10 LEU C C 10 179.501 179.501 178.427 1.074 25685 9210 1 13 . 1 1 10 10 LEU CA C 10 58.068 58.068 58.025 0.043 25685 9211 1 13 . 1 1 10 10 LEU CB C 10 40.776 40.776 41.345 -0.569 25685 9212 1 13 . 1 1 10 10 LEU H H 10 8.044 8.044 7.719 0.325 25685 9213 1 13 . 1 1 11 11 SER N N 11 113.830 113.830 114.161 -0.331 25685 9214 1 13 . 1 1 11 11 SER CA C 11 61.769 61.769 61.500 0.269 25685 9215 1 13 . 1 1 11 11 SER CB C 11 63.395 63.395 63.294 0.101 25685 9216 1 13 . 1 1 11 11 SER H H 11 8.140 8.140 7.683 0.457 25685 9217 1 13 . 1 1 12 12 VAL N N 12 121.343 121.343 121.012 0.331 25685 9218 1 13 . 1 1 12 12 VAL C C 12 176.753 176.753 177.278 -0.525 25685 9219 1 13 . 1 1 12 12 VAL CA C 12 64.583 64.583 65.797 -1.214 25685 9220 1 13 . 1 1 12 12 VAL CB C 12 31.067 31.067 31.264 -0.197 25685 9221 1 13 . 1 1 12 12 VAL H H 12 7.587 7.587 7.274 0.313 25685 9222 1 13 . 1 1 13 13 PHE N N 13 115.225 115.225 119.214 -3.989 25685 9223 1 13 . 1 1 13 13 PHE C C 13 177.349 177.349 175.560 1.789 25685 9224 1 13 . 1 1 13 13 PHE CA C 13 58.730 58.730 60.594 -1.864 25685 9225 1 13 . 1 1 13 13 PHE CB C 13 39.785 39.785 39.082 0.703 25685 9226 1 13 . 1 1 13 13 PHE H H 13 7.474 7.474 7.938 -0.464 25685 9227 1 13 . 1 1 14 14 SER N N 14 116.075 116.075 114.660 1.415 25685 9228 1 13 . 1 1 14 14 SER H H 14 7.955 7.955 7.880 0.075 25685 9229 1 13 . 1 1 15 15 PRO C C 15 177.590 177.590 176.756 0.834 25685 9230 1 13 . 1 1 15 15 PRO CA C 15 65.464 65.464 64.587 0.877 25685 9231 1 13 . 1 1 16 16 ALA N N 16 116.288 116.288 116.244 0.044 25685 9232 1 13 . 1 1 16 16 ALA C C 16 177.563 177.563 176.541 1.022 25685 9233 1 13 . 1 1 16 16 ALA CA C 16 53.010 53.010 51.702 1.308 25685 9234 1 13 . 1 1 16 16 ALA CB C 16 19.975 19.975 18.781 1.194 25685 9235 1 13 . 1 1 16 16 ALA H H 16 7.455 7.455 7.602 -0.147 25685 9236 1 13 . 1 1 17 17 VAL N N 17 112.072 112.072 118.482 -6.410 25685 9237 1 13 . 1 1 17 17 VAL CA C 17 63.117 63.117 63.737 -0.620 25685 9238 1 13 . 1 1 17 17 VAL CB C 17 33.209 33.209 32.481 0.728 25685 9239 1 13 . 1 1 17 17 VAL H H 17 7.525 7.525 8.416 -0.891 25685 9240 1 13 . 1 1 18 18 LEU N N 18 121.205 121.205 120.885 0.320 25685 9241 1 13 . 1 1 18 18 LEU CA C 18 58.971 58.971 57.494 1.477 25685 9242 1 13 . 1 1 18 18 LEU CB C 18 41.161 41.161 40.326 0.835 25685 9243 1 13 . 1 1 18 18 LEU H H 18 8.191 8.191 8.193 -0.002 25685 9244 1 13 . 1 1 19 19 PRO C C 19 177.697 177.697 178.731 -1.034 25685 9245 1 13 . 1 1 19 19 PRO CA C 19 65.181 65.181 64.822 0.359 25685 9246 1 13 . 1 1 20 20 VAL N N 20 111.723 111.723 111.409 0.314 25685 9247 1 13 . 1 1 20 20 VAL C C 20 177.137 177.137 175.858 1.279 25685 9248 1 13 . 1 1 20 20 VAL CA C 20 62.494 62.494 64.377 -1.883 25685 9249 1 13 . 1 1 20 20 VAL CB C 20 31.677 31.677 29.782 1.895 25685 9250 1 13 . 1 1 20 20 VAL H H 20 7.571 7.571 8.194 -0.623 25685 9251 1 13 . 1 1 21 21 VAL N N 21 121.705 121.705 119.176 2.529 25685 9252 1 13 . 1 1 21 21 VAL CA C 21 68.305 68.305 65.428 2.877 25685 9253 1 13 . 1 1 21 21 VAL H H 21 7.732 7.732 7.930 -0.198 25685 9254 1 13 . 1 1 24 24 ILE C C 24 174.359 174.359 176.106 -1.747 25685 9255 1 13 . 1 1 25 25 PHE N N 25 120.132 120.132 122.022 -1.890 25685 9256 1 13 . 1 1 25 25 PHE C C 25 175.945 175.945 176.386 -0.441 25685 9257 1 13 . 1 1 25 25 PHE CA C 25 60.544 60.544 59.314 1.230 25685 9258 1 13 . 1 1 25 25 PHE H H 25 8.082 8.082 8.799 -0.717 25685 9259 1 13 . 1 1 26 26 ALA N N 26 121.341 121.341 120.938 0.403 25685 9260 1 13 . 1 1 26 26 ALA CB C 26 19.784 19.784 20.277 -0.493 25685 9261 1 13 . 1 1 26 26 ALA H H 26 7.539 7.539 7.224 0.315 25685 9262 1 13 . 1 1 27 27 GLY N N 27 107.530 107.530 107.234 0.296 25685 9263 1 13 . 1 1 27 27 GLY C C 27 174.252 174.252 174.288 -0.036 25685 9264 1 13 . 1 1 27 27 GLY CA C 27 45.474 45.474 45.291 0.183 25685 9265 1 13 . 1 1 27 27 GLY H H 27 7.997 7.997 8.014 -0.017 25685 9266 1 13 . 1 1 28 28 SER N N 28 116.299 116.299 118.032 -1.733 25685 9267 1 13 . 1 1 28 28 SER C C 28 175.759 175.759 174.082 1.677 25685 9268 1 13 . 1 1 28 28 SER CA C 28 58.526 58.526 58.359 0.167 25685 9269 1 13 . 1 1 28 28 SER CB C 28 64.373 64.373 64.964 -0.591 25685 9270 1 13 . 1 1 28 28 SER H H 28 8.115 8.115 8.438 -0.323 25685 9271 1 13 . 1 1 34 34 ASP C C 34 177.621 177.621 178.343 -0.722 25685 9272 1 13 . 1 1 34 34 ASP CA C 34 57.082 57.082 57.395 -0.313 25685 9273 1 13 . 1 1 35 35 ALA N N 35 120.662 120.662 121.745 -1.083 25685 9274 1 13 . 1 1 35 35 ALA C C 35 179.168 179.168 179.324 -0.156 25685 9275 1 13 . 1 1 35 35 ALA CA C 35 55.459 55.459 54.458 1.001 25685 9276 1 13 . 1 1 35 35 ALA CB C 35 18.819 18.819 17.668 1.151 25685 9277 1 13 . 1 1 35 35 ALA H H 35 8.090 8.090 7.284 0.806 25685 9278 1 13 . 1 1 36 36 PHE N N 36 117.638 117.638 119.576 -1.938 25685 9279 1 13 . 1 1 36 36 PHE C C 36 177.057 177.057 177.089 -0.032 25685 9280 1 13 . 1 1 36 36 PHE CA C 36 61.472 61.472 60.523 0.949 25685 9281 1 13 . 1 1 36 36 PHE CB C 36 38.860 38.860 38.868 -0.008 25685 9282 1 13 . 1 1 36 36 PHE H H 36 8.227 8.227 7.488 0.739 25685 9283 1 13 . 1 1 37 37 LEU N N 37 119.312 119.312 119.725 -0.413 25685 9284 1 13 . 1 1 37 37 LEU C C 37 179.798 179.798 178.583 1.215 25685 9285 1 13 . 1 1 37 37 LEU CA C 37 58.181 58.181 57.257 0.924 25685 9286 1 13 . 1 1 37 37 LEU CB C 37 40.835 40.835 41.939 -1.104 25685 9287 1 13 . 1 1 37 37 LEU H H 37 8.588 8.588 7.975 0.613 25685 9288 1 13 . 1 1 38 38 ILE N N 38 119.057 119.057 119.092 -0.035 25685 9289 1 13 . 1 1 38 38 ILE C C 38 177.597 177.597 177.351 0.246 25685 9290 1 13 . 1 1 38 38 ILE CA C 38 64.827 64.827 64.630 0.197 25685 9291 1 13 . 1 1 38 38 ILE CB C 38 36.321 36.321 38.172 -1.851 25685 9292 1 13 . 1 1 38 38 ILE H H 38 7.932 7.932 7.542 0.390 25685 9293 1 13 . 1 1 39 39 VAL N N 39 118.758 118.758 116.993 1.765 25685 9294 1 13 . 1 1 39 39 VAL C C 39 179.533 179.533 177.183 2.350 25685 9295 1 13 . 1 1 39 39 VAL CA C 39 66.687 66.687 65.865 0.822 25685 9296 1 13 . 1 1 39 39 VAL CB C 39 30.598 30.598 31.195 -0.597 25685 9297 1 13 . 1 1 39 39 VAL H H 39 7.922 7.922 7.456 0.466 25685 9298 1 13 . 1 1 40 40 ALA N N 40 125.385 125.385 122.445 2.940 25685 9299 1 13 . 1 1 40 40 ALA C C 40 179.200 179.200 179.573 -0.373 25685 9300 1 13 . 1 1 40 40 ALA CA C 40 55.283 55.283 54.914 0.369 25685 9301 1 13 . 1 1 40 40 ALA CB C 40 17.197 17.197 18.163 -0.966 25685 9302 1 13 . 1 1 40 40 ALA H H 40 9.091 9.091 7.474 1.617 25685 9303 1 13 . 1 1 41 41 GLY N N 41 106.978 106.978 107.543 -0.565 25685 9304 1 13 . 1 1 41 41 GLY C C 41 176.171 176.171 175.912 0.259 25685 9305 1 13 . 1 1 41 41 GLY CA C 41 47.322 47.322 47.077 0.245 25685 9306 1 13 . 1 1 41 41 GLY H H 41 8.565 8.565 7.838 0.727 25685 9307 1 13 . 1 1 42 42 LEU N N 42 126.914 126.914 120.457 6.457 25685 9308 1 13 . 1 1 42 42 LEU C C 42 178.119 178.119 178.702 -0.583 25685 9309 1 13 . 1 1 42 42 LEU CA C 42 58.523 58.523 57.714 0.809 25685 9310 1 13 . 1 1 42 42 LEU CB C 42 42.125 42.125 41.130 0.995 25685 9311 1 13 . 1 1 42 42 LEU H H 42 8.573 8.573 8.102 0.471 25685 9312 1 13 . 1 1 46 46 MET N N 46 121.710 121.710 121.866 -0.156 25685 9313 1 13 . 1 1 46 46 MET C C 46 179.540 179.540 178.446 1.094 25685 9314 1 13 . 1 1 46 46 MET CA C 46 55.968 55.968 57.791 -1.823 25685 9315 1 13 . 1 1 46 46 MET H H 46 8.589 8.589 7.843 0.746 25685 9316 1 13 . 1 1 47 47 LEU N N 47 117.448 117.448 121.210 -3.762 25685 9317 1 13 . 1 1 47 47 LEU HA H 47 3.992 3.992 4.252 -0.260 25685 9318 1 13 . 1 1 47 47 LEU C C 47 179.082 179.082 178.537 0.545 25685 9319 1 13 . 1 1 47 47 LEU CA C 47 58.157 58.157 58.096 0.061 25685 9320 1 13 . 1 1 47 47 LEU CB C 47 41.858 41.858 41.773 0.085 25685 9321 1 13 . 1 1 47 47 LEU H H 47 8.769 8.769 7.936 0.833 25685 9322 1 13 . 1 1 48 48 ILE N N 48 117.500 117.500 116.709 0.791 25685 9323 1 13 . 1 1 48 48 ILE C C 48 180.298 180.298 178.482 1.816 25685 9324 1 13 . 1 1 48 48 ILE CA C 48 65.627 65.627 64.215 1.412 25685 9325 1 13 . 1 1 48 48 ILE CB C 48 37.839 37.839 37.233 0.606 25685 9326 1 13 . 1 1 48 48 ILE H H 48 8.093 8.093 7.487 0.606 25685 9327 1 13 . 1 1 49 49 LEU N N 49 123.708 123.708 120.106 3.602 25685 9328 1 13 . 1 1 49 49 LEU C C 49 179.721 179.721 178.419 1.302 25685 9329 1 13 . 1 1 49 49 LEU CA C 49 58.788 58.788 57.127 1.661 25685 9330 1 13 . 1 1 49 49 LEU CB C 49 40.761 40.761 41.819 -1.058 25685 9331 1 13 . 1 1 49 49 LEU H H 49 8.833 8.833 7.791 1.042 25685 9332 1 13 . 1 1 50 50 GLY N N 50 109.284 109.284 106.222 3.062 25685 9333 1 13 . 1 1 50 50 GLY C C 50 176.937 176.937 174.464 2.473 25685 9334 1 13 . 1 1 50 50 GLY CA C 50 47.821 47.821 47.055 0.766 25685 9335 1 13 . 1 1 50 50 GLY H H 50 9.658 9.658 8.180 1.478 25685 9336 1 13 . 1 1 51 51 TYR N N 51 125.640 125.640 121.229 4.411 25685 9337 1 13 . 1 1 51 51 TYR C C 51 177.102 177.102 174.476 2.626 25685 9338 1 13 . 1 1 51 51 TYR CA C 51 61.948 61.948 56.780 5.168 25685 9339 1 13 . 1 1 51 51 TYR CB C 51 38.871 38.871 40.726 -1.855 25685 9340 1 13 . 1 1 51 51 TYR H H 51 8.795 8.795 7.561 1.234 25685 9341 1 13 . 1 1 52 52 THR N N 52 116.273 116.273 122.372 -6.099 25685 9342 1 13 . 1 1 52 52 THR C C 52 176.969 176.969 174.300 2.669 25685 9343 1 13 . 1 1 52 52 THR CA C 52 67.972 67.972 63.503 4.469 25685 9344 1 13 . 1 1 52 52 THR H H 52 8.456 8.456 7.711 0.745 25685 9345 1 13 . 1 1 53 53 ALA N N 53 122.122 122.122 126.388 -4.266 25685 9346 1 13 . 1 1 53 53 ALA C C 53 179.907 179.907 176.071 3.836 25685 9347 1 13 . 1 1 53 53 ALA CA C 53 55.722 55.722 51.498 4.224 25685 9348 1 13 . 1 1 53 53 ALA CB C 53 18.786 18.786 19.556 -0.770 25685 9349 1 13 . 1 1 53 53 ALA H H 53 9.058 9.058 8.388 0.670 25685 9350 1 13 . 1 1 54 54 SER N N 54 115.434 115.434 112.492 2.942 25685 9351 1 13 . 1 1 54 54 SER C C 54 176.433 176.433 174.380 2.053 25685 9352 1 13 . 1 1 54 54 SER CA C 54 55.828 55.828 58.535 -2.707 25685 9353 1 13 . 1 1 54 54 SER H H 54 8.040 8.040 8.069 -0.029 25685 9354 1 13 . 1 1 55 55 LEU N N 55 123.045 123.045 121.502 1.543 25685 9355 1 13 . 1 1 55 55 LEU C C 55 178.789 178.789 175.809 2.980 25685 9356 1 13 . 1 1 55 55 LEU CA C 55 57.633 57.633 56.195 1.438 25685 9357 1 13 . 1 1 55 55 LEU CB C 55 41.293 41.293 40.325 0.968 25685 9358 1 13 . 1 1 55 55 LEU H H 55 8.255 8.255 8.516 -0.261 25685 9359 1 13 . 1 1 56 56 PHE N N 56 114.426 114.426 124.592 -10.166 25685 9360 1 13 . 1 1 56 56 PHE C C 56 177.507 177.507 175.690 1.817 25685 9361 1 13 . 1 1 56 56 PHE CA C 56 61.068 61.068 58.748 2.321 25685 9362 1 13 . 1 1 56 56 PHE CB C 56 40.107 40.107 40.676 -0.569 25685 9363 1 13 . 1 1 56 56 PHE H H 56 7.590 7.590 8.667 -1.077 25685 9364 1 13 . 1 1 57 57 PHE N N 57 114.701 114.701 116.974 -2.273 25685 9365 1 13 . 1 1 57 57 PHE C C 57 176.203 176.203 176.513 -0.310 25685 9366 1 13 . 1 1 57 57 PHE CA C 57 58.503 58.503 57.844 0.659 25685 9367 1 13 . 1 1 57 57 PHE CB C 57 41.114 41.114 39.038 2.076 25685 9368 1 13 . 1 1 57 57 PHE H H 57 8.514 8.514 8.454 0.060 25685 9369 1 13 . 1 1 58 58 GLY N N 58 111.041 111.041 109.966 1.075 25685 9370 1 13 . 1 1 58 58 GLY C C 58 174.240 174.240 175.569 -1.329 25685 9371 1 13 . 1 1 58 58 GLY CA C 58 44.827 44.827 46.912 -2.085 25685 9372 1 13 . 1 1 58 58 GLY H H 58 7.998 7.998 8.655 -0.657 25685 9373 1 13 . 1 1 59 59 PHE N N 59 127.950 127.950 121.242 6.708 25685 9374 1 13 . 1 1 59 59 PHE C C 59 176.612 176.612 176.072 0.540 25685 9375 1 13 . 1 1 59 59 PHE CA C 59 61.598 61.598 58.488 3.110 25685 9376 1 13 . 1 1 59 59 PHE CB C 59 40.870 40.870 39.139 1.731 25685 9377 1 13 . 1 1 59 59 PHE H H 59 9.105 9.105 7.968 1.137 25685 9378 1 13 . 1 1 60 60 PHE N N 60 114.868 114.868 120.732 -5.864 25685 9379 1 13 . 1 1 60 60 PHE C C 60 177.989 177.989 176.958 1.031 25685 9380 1 13 . 1 1 60 60 PHE CA C 60 61.517 61.517 61.384 0.133 25685 9381 1 13 . 1 1 60 60 PHE CB C 60 38.248 38.248 39.102 -0.854 25685 9382 1 13 . 1 1 60 60 PHE H H 60 8.796 8.796 8.290 0.506 25685 9383 1 13 . 1 1 61 61 ARG N N 61 118.812 118.812 118.398 0.414 25685 9384 1 13 . 1 1 61 61 ARG C C 61 177.813 177.813 178.109 -0.296 25685 9385 1 13 . 1 1 61 61 ARG CA C 61 60.497 60.497 59.047 1.450 25685 9386 1 13 . 1 1 61 61 ARG CB C 61 28.915 28.915 29.398 -0.483 25685 9387 1 13 . 1 1 61 61 ARG H H 61 7.600 7.600 7.525 0.075 25685 9388 1 13 . 1 1 62 62 VAL N N 62 119.157 119.157 120.352 -1.195 25685 9389 1 13 . 1 1 62 62 VAL C C 62 177.670 177.670 177.821 -0.151 25685 9390 1 13 . 1 1 62 62 VAL CA C 62 66.749 66.749 64.633 2.116 25685 9391 1 13 . 1 1 62 62 VAL CB C 62 30.306 30.306 31.404 -1.098 25685 9392 1 13 . 1 1 62 62 VAL H H 62 7.679 7.679 7.266 0.413 25685 9393 1 13 . 1 1 63 63 VAL N N 63 117.999 117.999 119.549 -1.550 25685 9394 1 13 . 1 1 63 63 VAL C C 63 177.639 177.639 177.601 0.038 25685 9395 1 13 . 1 1 63 63 VAL CA C 63 66.836 66.836 65.846 0.990 25685 9396 1 13 . 1 1 63 63 VAL CB C 63 30.496 30.496 30.397 0.099 25685 9397 1 13 . 1 1 63 63 VAL H H 63 7.429 7.429 7.155 0.274 25685 9398 1 13 . 1 1 64 64 ALA N N 64 120.451 120.451 121.728 -1.277 25685 9399 1 13 . 1 1 64 64 ALA C C 64 179.134 179.134 178.708 0.426 25685 9400 1 13 . 1 1 64 64 ALA CA C 64 55.618 55.618 54.208 1.410 25685 9401 1 13 . 1 1 64 64 ALA CB C 64 17.950 17.950 17.385 0.565 25685 9402 1 13 . 1 1 64 64 ALA H H 64 8.169 8.169 7.387 0.782 25685 9403 1 13 . 1 1 65 65 MET N N 65 116.532 116.532 117.189 -0.657 25685 9404 1 13 . 1 1 65 65 MET C C 65 177.961 177.961 177.938 0.023 25685 9405 1 13 . 1 1 65 65 MET CA C 65 58.161 58.161 58.566 -0.405 25685 9406 1 13 . 1 1 65 65 MET CB C 65 31.208 31.208 32.016 -0.808 25685 9407 1 13 . 1 1 65 65 MET H H 65 7.857 7.857 7.246 0.611 25685 9408 1 13 . 1 1 66 66 LEU C C 66 179.022 179.022 179.132 -0.110 25685 9409 1 13 . 1 1 66 66 LEU CA C 66 58.412 58.412 57.719 0.693 25685 9410 1 13 . 1 1 67 67 PHE N N 67 116.877 116.877 117.643 -0.766 25685 9411 1 13 . 1 1 67 67 PHE C C 67 177.908 177.908 178.097 -0.189 25685 9412 1 13 . 1 1 67 67 PHE CA C 67 62.402 62.402 59.825 2.577 25685 9413 1 13 . 1 1 67 67 PHE CB C 67 39.203 39.203 36.853 2.350 25685 9414 1 13 . 1 1 67 67 PHE H H 67 7.923 7.923 7.020 0.903 25685 9415 1 13 . 1 1 68 68 LEU N N 68 118.860 118.860 118.790 0.070 25685 9416 1 13 . 1 1 68 68 LEU C C 68 179.032 179.032 178.500 0.532 25685 9417 1 13 . 1 1 68 68 LEU CA C 68 58.397 58.397 57.445 0.952 25685 9418 1 13 . 1 1 68 68 LEU CB C 68 40.803 40.803 41.023 -0.220 25685 9419 1 13 . 1 1 68 68 LEU H H 68 8.167 8.167 7.543 0.624 25685 9420 1 13 . 1 1 71 71 PHE N N 71 120.700 120.700 119.393 1.307 25685 9421 1 13 . 1 1 71 71 PHE C C 71 177.670 177.670 178.333 -0.663 25685 9422 1 13 . 1 1 71 71 PHE CA C 71 60.528 60.528 60.265 0.263 25685 9423 1 13 . 1 1 71 71 PHE H H 71 7.847 7.847 6.956 0.891 25685 9424 1 13 . 1 1 72 72 ALA N N 72 120.506 120.506 123.109 -2.603 25685 9425 1 13 . 1 1 72 72 ALA C C 72 178.944 178.944 179.387 -0.443 25685 9426 1 13 . 1 1 72 72 ALA CA C 72 55.461 55.461 55.009 0.452 25685 9427 1 13 . 1 1 72 72 ALA CB C 72 17.829 17.829 18.290 -0.461 25685 9428 1 13 . 1 1 72 72 ALA H H 72 8.533 8.533 8.828 -0.295 25685 9429 1 13 . 1 1 73 73 LEU N N 73 115.071 115.071 119.370 -4.299 25685 9430 1 13 . 1 1 73 73 LEU C C 73 180.831 180.831 179.050 1.781 25685 9431 1 13 . 1 1 73 73 LEU CA C 73 58.091 58.091 57.773 0.319 25685 9432 1 13 . 1 1 73 73 LEU CB C 73 41.082 41.082 40.924 0.158 25685 9433 1 13 . 1 1 73 73 LEU H H 73 8.458 8.458 8.041 0.417 25685 9434 1 13 . 1 1 74 74 ILE N N 74 121.365 121.365 119.652 1.713 25685 9435 1 13 . 1 1 74 74 ILE C C 74 178.287 178.287 178.210 0.077 25685 9436 1 13 . 1 1 74 74 ILE CA C 74 65.335 65.335 63.905 1.430 25685 9437 1 13 . 1 1 74 74 ILE CB C 74 37.453 37.453 36.946 0.507 25685 9438 1 13 . 1 1 74 74 ILE H H 74 8.220 8.220 7.491 0.729 25685 9439 1 13 . 1 1 75 75 LEU N N 75 119.200 119.200 120.928 -1.728 25685 9440 1 13 . 1 1 75 75 LEU C C 75 177.548 177.548 178.901 -1.353 25685 9441 1 13 . 1 1 75 75 LEU CA C 75 56.938 56.938 57.732 -0.794 25685 9442 1 13 . 1 1 75 75 LEU CB C 75 41.541 41.541 41.448 0.093 25685 9443 1 13 . 1 1 75 75 LEU H H 75 7.866 7.866 7.282 0.584 25685 9444 1 13 . 1 1 76 76 LEU N N 76 116.338 116.338 118.439 -2.101 25685 9445 1 13 . 1 1 76 76 LEU C C 76 176.889 176.889 178.674 -1.785 25685 9446 1 13 . 1 1 76 76 LEU CA C 76 54.807 54.807 57.292 -2.485 25685 9447 1 13 . 1 1 76 76 LEU CB C 76 41.830 41.830 41.243 0.587 25685 9448 1 13 . 1 1 76 76 LEU H H 76 7.432 7.432 7.754 -0.322 25685 9449 1 13 . 1 1 77 77 SER N N 77 114.630 114.630 112.737 1.893 25685 9450 1 13 . 1 1 77 77 SER C C 77 174.752 174.752 174.637 0.115 25685 9451 1 13 . 1 1 77 77 SER CA C 77 58.967 58.967 59.947 -0.980 25685 9452 1 13 . 1 1 77 77 SER CB C 77 64.686 64.686 63.288 1.398 25685 9453 1 13 . 1 1 77 77 SER H H 77 7.423 7.423 7.716 -0.293 25685 9454 1 13 . 1 1 78 78 ASP N N 78 123.054 123.054 121.388 1.666 25685 9455 1 13 . 1 1 78 78 ASP C C 78 176.716 176.716 176.348 0.368 25685 9456 1 13 . 1 1 78 78 ASP CA C 78 54.848 54.848 55.502 -0.654 25685 9457 1 13 . 1 1 78 78 ASP CB C 78 40.423 40.423 41.206 -0.783 25685 9458 1 13 . 1 1 78 78 ASP H H 78 8.294 8.294 7.443 0.851 25685 9459 1 13 . 1 1 79 79 GLU N N 79 119.104 119.104 123.217 -4.113 25685 9460 1 13 . 1 1 79 79 GLU C C 79 176.391 176.391 176.033 0.358 25685 9461 1 13 . 1 1 79 79 GLU CA C 79 56.258 56.258 56.219 0.039 25685 9462 1 13 . 1 1 79 79 GLU CB C 79 29.656 29.656 29.046 0.611 25685 9463 1 13 . 1 1 79 79 GLU H H 79 8.384 8.384 8.515 -0.131 25685 9464 1 13 . 1 1 80 80 LEU N N 80 121.254 121.254 123.231 -1.977 25685 9465 1 13 . 1 1 80 80 LEU C C 80 177.164 177.164 175.562 1.602 25685 9466 1 13 . 1 1 80 80 LEU CA C 80 54.670 54.670 56.296 -1.626 25685 9467 1 13 . 1 1 80 80 LEU CB C 80 42.633 42.633 41.485 1.148 25685 9468 1 13 . 1 1 80 80 LEU H H 80 7.637 7.637 8.121 -0.484 25685 9469 1 13 . 1 1 81 81 ASP N N 81 123.410 123.410 118.691 4.719 25685 9470 1 13 . 1 1 81 81 ASP C C 81 177.552 177.552 174.589 2.963 25685 9471 1 13 . 1 1 81 81 ASP CA C 81 55.110 55.110 53.634 1.476 25685 9472 1 13 . 1 1 81 81 ASP CB C 81 42.693 42.693 42.339 0.354 25685 9473 1 13 . 1 1 81 81 ASP H H 81 8.403 8.403 8.270 0.133 25685 9474 1 13 . 1 1 82 82 GLU N N 82 125.047 125.047 118.931 6.116 25685 9475 1 13 . 1 1 82 82 GLU C C 82 178.198 178.198 176.216 1.982 25685 9476 1 13 . 1 1 82 82 GLU CA C 82 59.221 59.221 56.560 2.661 25685 9477 1 13 . 1 1 82 82 GLU CB C 82 29.176 29.176 30.518 -1.342 25685 9478 1 13 . 1 1 82 82 GLU H H 82 8.744 8.744 8.537 0.207 25685 9479 1 13 . 1 1 83 83 LYS N N 83 118.476 118.476 118.846 -0.370 25685 9480 1 13 . 1 1 83 83 LYS C C 83 179.356 179.356 177.807 1.549 25685 9481 1 13 . 1 1 83 83 LYS CA C 83 59.170 59.170 57.508 1.662 25685 9482 1 13 . 1 1 83 83 LYS CB C 83 31.509 31.509 34.087 -2.578 25685 9483 1 13 . 1 1 83 83 LYS H H 83 8.607 8.607 7.778 0.829 25685 9484 1 13 . 1 1 84 84 VAL N N 84 118.407 118.407 118.301 0.106 25685 9485 1 13 . 1 1 84 84 VAL C C 84 177.653 177.653 177.401 0.252 25685 9486 1 13 . 1 1 84 84 VAL CA C 84 65.416 65.416 66.292 -0.876 25685 9487 1 13 . 1 1 84 84 VAL CB C 84 31.313 31.313 30.922 0.390 25685 9488 1 13 . 1 1 84 84 VAL H H 84 7.870 7.870 8.182 -0.312 25685 9489 1 13 . 1 1 85 85 SER N N 85 116.146 116.146 116.588 -0.442 25685 9490 1 13 . 1 1 85 85 SER C C 85 177.496 177.496 176.779 0.717 25685 9491 1 13 . 1 1 85 85 SER CA C 85 61.764 61.764 61.321 0.443 25685 9492 1 13 . 1 1 85 85 SER CB C 85 63.654 63.654 63.002 0.652 25685 9493 1 13 . 1 1 85 85 SER H H 85 8.083 8.083 8.365 -0.282 25685 9494 1 13 . 1 1 86 86 ILE N N 86 122.570 122.570 122.392 0.178 25685 9495 1 13 . 1 1 86 86 ILE C C 86 178.698 178.698 177.717 0.981 25685 9496 1 13 . 1 1 86 86 ILE CA C 86 64.526 64.526 64.168 0.358 25685 9497 1 13 . 1 1 86 86 ILE CB C 86 37.393 37.393 37.733 -0.340 25685 9498 1 13 . 1 1 86 86 ILE H H 86 8.102 8.102 7.907 0.195 25685 9499 1 13 . 1 1 87 87 PHE N N 87 121.340 121.340 121.169 0.171 25685 9500 1 13 . 1 1 87 87 PHE C C 87 177.671 177.671 176.795 0.876 25685 9501 1 13 . 1 1 87 87 PHE CA C 87 61.098 61.098 61.457 -0.359 25685 9502 1 13 . 1 1 87 87 PHE CB C 87 39.151 39.151 39.099 0.052 25685 9503 1 13 . 1 1 87 87 PHE H H 87 7.719 7.719 8.713 -0.994 25685 9504 1 13 . 1 1 88 88 ALA N N 88 120.921 120.921 120.546 0.375 25685 9505 1 13 . 1 1 88 88 ALA C C 88 180.030 180.030 179.558 0.472 25685 9506 1 13 . 1 1 88 88 ALA CA C 88 55.147 55.147 54.624 0.523 25685 9507 1 13 . 1 1 88 88 ALA CB C 88 19.053 19.053 18.265 0.788 25685 9508 1 13 . 1 1 88 88 ALA H H 88 8.679 8.679 8.235 0.444 25685 9509 1 13 . 1 1 89 89 SER N N 89 114.285 114.285 114.831 -0.546 25685 9510 1 13 . 1 1 89 89 SER C C 89 177.040 177.040 176.378 0.662 25685 9511 1 13 . 1 1 89 89 SER CA C 89 61.314 61.314 61.607 -0.293 25685 9512 1 13 . 1 1 89 89 SER CB C 89 63.371 63.371 62.882 0.489 25685 9513 1 13 . 1 1 89 89 SER H H 89 8.242 8.242 7.781 0.461 25685 9514 1 13 . 1 1 90 90 ARG N N 90 121.829 121.829 120.599 1.230 25685 9515 1 13 . 1 1 90 90 ARG C C 90 179.247 179.247 178.387 0.860 25685 9516 1 13 . 1 1 90 90 ARG CA C 90 58.444 58.444 58.587 -0.143 25685 9517 1 13 . 1 1 90 90 ARG CB C 90 29.532 29.532 29.139 0.393 25685 9518 1 13 . 1 1 90 90 ARG H H 90 7.907 7.907 7.389 0.518 25685 9519 1 13 . 1 1 91 91 MET N N 91 117.124 117.124 117.484 -0.360 25685 9520 1 13 . 1 1 91 91 MET C C 91 177.504 177.504 177.971 -0.467 25685 9521 1 13 . 1 1 91 91 MET CA C 91 57.152 57.152 60.070 -2.918 25685 9522 1 13 . 1 1 91 91 MET CB C 91 32.510 32.510 31.777 0.732 25685 9523 1 13 . 1 1 91 91 MET H H 91 7.930 7.930 7.798 0.132 25685 9524 1 13 . 1 1 92 92 THR N N 92 108.478 108.478 114.492 -6.014 25685 9525 1 13 . 1 1 92 92 THR C C 92 176.367 176.367 176.097 0.270 25685 9526 1 13 . 1 1 92 92 THR CA C 92 63.564 63.564 65.310 -1.746 25685 9527 1 13 . 1 1 92 92 THR H H 92 7.847 7.847 7.551 0.296 25685 9528 1 13 . 1 1 93 93 SER N N 93 117.950 117.950 117.196 0.754 25685 9529 1 13 . 1 1 93 93 SER C C 93 176.552 176.552 176.444 0.108 25685 9530 1 13 . 1 1 93 93 SER CA C 93 60.821 60.821 61.499 -0.679 25685 9531 1 13 . 1 1 93 93 SER CB C 93 63.311 63.311 63.366 -0.055 25685 9532 1 13 . 1 1 93 93 SER H H 93 7.732 7.732 7.713 0.019 25685 9533 1 13 . 1 1 94 94 GLY N N 94 111.265 111.265 107.984 3.281 25685 9534 1 13 . 1 1 94 94 GLY C C 94 175.198 175.198 174.101 1.097 25685 9535 1 13 . 1 1 94 94 GLY CA C 94 46.021 46.021 45.212 0.809 25685 9536 1 13 . 1 1 94 94 GLY H H 94 8.419 8.419 8.165 0.254 25685 9537 1 13 . 1 1 95 95 LEU N N 95 121.019 121.019 119.368 1.651 25685 9538 1 13 . 1 1 95 95 LEU C C 95 177.810 177.810 175.632 2.178 25685 9539 1 13 . 1 1 95 95 LEU CA C 95 56.012 56.012 56.095 -0.083 25685 9540 1 13 . 1 1 95 95 LEU CB C 95 42.122 42.122 42.265 -0.143 25685 9541 1 13 . 1 1 95 95 LEU H H 95 7.849 7.849 7.500 0.349 25685 9542 1 13 . 1 1 96 96 SER N N 96 115.465 115.465 116.746 -1.281 25685 9543 1 13 . 1 1 96 96 SER C C 96 175.543 175.543 173.880 1.663 25685 9544 1 13 . 1 1 96 96 SER CA C 96 60.151 60.151 57.432 2.719 25685 9545 1 13 . 1 1 96 96 SER H H 96 8.349 8.349 8.308 0.041 25685 9546 1 13 . 1 1 97 97 TRP N N 97 121.711 121.711 120.451 1.260 25685 9547 1 13 . 1 1 97 97 TRP C C 97 176.973 176.973 176.200 0.773 25685 9548 1 13 . 1 1 97 97 TRP CA C 97 58.250 58.250 58.987 -0.737 25685 9549 1 13 . 1 1 97 97 TRP CB C 97 28.899 28.899 28.752 0.147 25685 9550 1 13 . 1 1 97 97 TRP H H 97 7.723 7.723 7.772 -0.049 25685 9551 1 13 . 1 1 98 98 LYS N N 98 119.868 119.868 119.125 0.743 25685 9552 1 13 . 1 1 98 98 LYS C C 98 178.021 178.021 175.532 2.489 25685 9553 1 13 . 1 1 98 98 LYS CA C 98 56.340 56.340 57.616 -1.276 25685 9554 1 13 . 1 1 98 98 LYS CB C 98 31.933 31.933 30.290 1.643 25685 9555 1 13 . 1 1 98 98 LYS H H 98 7.855 7.855 8.417 -0.562 25685 9556 1 13 . 1 1 99 99 ILE N N 99 120.044 120.044 112.911 7.133 25685 9557 1 13 . 1 1 99 99 ILE C C 99 176.769 176.769 176.133 0.636 25685 9558 1 13 . 1 1 99 99 ILE CA C 99 62.758 62.758 62.083 0.675 25685 9559 1 13 . 1 1 99 99 ILE CB C 99 37.809 37.809 39.815 -2.006 25685 9560 1 13 . 1 1 99 99 ILE H H 99 8.069 8.069 7.821 0.248 25685 9561 1 13 . 1 1 100 100 GLN C C 100 176.315 176.315 175.210 1.105 25685 9562 1 13 . 1 1 100 100 GLN CA C 100 57.486 57.486 55.968 1.518 25685 9563 1 13 . 1 1 101 101 THR N N 101 109.873 109.873 115.971 -6.098 25685 9564 1 13 . 1 1 101 101 THR C C 101 174.664 174.664 173.389 1.275 25685 9565 1 13 . 1 1 101 101 THR CA C 101 61.709 61.709 62.420 -0.712 25685 9566 1 13 . 1 1 101 101 THR CB C 101 69.290 69.290 69.474 -0.184 25685 9567 1 13 . 1 1 101 101 THR H H 101 7.508 7.508 8.091 -0.583 25685 9568 1 13 . 1 1 102 102 LEU N N 102 124.434 124.434 122.545 1.889 25685 9569 1 13 . 1 1 102 102 LEU C C 102 174.681 174.681 174.308 0.373 25685 9570 1 13 . 1 1 102 102 LEU CA C 102 53.063 53.063 53.272 -0.208 25685 9571 1 13 . 1 1 102 102 LEU CB C 102 41.139 41.139 41.890 -0.751 25685 9572 1 13 . 1 1 102 102 LEU H H 102 7.569 7.569 8.156 -0.587 25685 9573 1 13 . 1 1 103 103 PRO C C 103 178.076 178.076 175.880 2.196 25685 9574 1 13 . 1 1 103 103 PRO CA C 103 62.570 62.570 63.349 -0.779 25685 9575 1 13 . 1 1 103 103 PRO CB C 103 31.534 31.534 32.458 -0.924 25685 9576 1 13 . 1 1 104 104 SER N N 104 119.929 119.929 114.711 5.218 25685 9577 1 13 . 1 1 104 104 SER C C 104 176.432 176.432 173.977 2.455 25685 9578 1 13 . 1 1 104 104 SER CA C 104 61.976 61.976 58.486 3.490 25685 9579 1 13 . 1 1 104 104 SER CB C 104 63.611 63.611 62.983 0.628 25685 9580 1 13 . 1 1 104 104 SER H H 104 8.784 8.784 8.566 0.218 25685 9581 1 13 . 1 1 105 105 PHE N N 105 119.519 119.519 125.393 -5.874 25685 9582 1 13 . 1 1 105 105 PHE C C 105 176.852 176.852 173.989 2.863 25685 9583 1 13 . 1 1 105 105 PHE CA C 105 60.162 60.162 55.516 4.646 25685 9584 1 13 . 1 1 105 105 PHE CB C 105 38.455 38.455 37.900 0.555 25685 9585 1 13 . 1 1 105 105 PHE H H 105 8.620 8.620 8.360 0.260 25685 9586 1 13 . 1 1 106 106 PHE N N 106 118.809 118.809 116.709 2.100 25685 9587 1 13 . 1 1 106 106 PHE C C 106 176.741 176.741 175.619 1.122 25685 9588 1 13 . 1 1 106 106 PHE CA C 106 61.421 61.421 57.428 3.993 25685 9589 1 13 . 1 1 106 106 PHE CB C 106 38.788 38.788 35.304 3.484 25685 9590 1 13 . 1 1 106 106 PHE H H 106 7.519 7.519 7.538 -0.019 25685 9591 1 13 . 1 1 107 107 PHE N N 107 117.382 117.382 121.607 -4.225 25685 9592 1 13 . 1 1 107 107 PHE C C 107 177.771 177.771 177.252 0.519 25685 9593 1 13 . 1 1 107 107 PHE CA C 107 61.099 61.099 62.133 -1.034 25685 9594 1 13 . 1 1 107 107 PHE CB C 107 38.677 38.677 38.751 -0.074 25685 9595 1 13 . 1 1 107 107 PHE H H 107 7.903 7.903 8.337 -0.434 25685 9596 1 13 . 1 1 108 108 GLY N N 108 105.340 105.340 104.698 0.642 25685 9597 1 13 . 1 1 108 108 GLY C C 108 174.574 174.574 176.062 -1.488 25685 9598 1 13 . 1 1 108 108 GLY CA C 108 47.508 47.508 47.121 0.387 25685 9599 1 13 . 1 1 108 108 GLY H H 108 8.351 8.351 8.656 -0.305 25685 9600 1 13 . 1 1 109 109 MET N N 109 119.831 119.831 121.169 -1.338 25685 9601 1 13 . 1 1 109 109 MET C C 109 177.522 177.522 178.482 -0.960 25685 9602 1 13 . 1 1 109 109 MET CA C 109 58.658 58.658 58.779 -0.121 25685 9603 1 13 . 1 1 109 109 MET CB C 109 32.106 32.106 32.533 -0.428 25685 9604 1 13 . 1 1 109 109 MET H H 109 7.919 7.919 7.893 0.026 25685 9605 1 13 . 1 1 110 110 LEU N N 110 119.908 119.908 117.807 2.101 25685 9606 1 13 . 1 1 110 110 LEU C C 110 178.170 178.170 178.707 -0.537 25685 9607 1 13 . 1 1 110 110 LEU CA C 110 57.941 57.941 57.403 0.538 25685 9608 1 13 . 1 1 110 110 LEU CB C 110 41.055 41.055 40.666 0.389 25685 9609 1 13 . 1 1 110 110 LEU H H 110 7.744 7.744 7.780 -0.036 25685 9610 1 13 . 1 1 111 111 LEU N N 111 116.594 116.594 116.826 -0.232 25685 9611 1 13 . 1 1 111 111 LEU C C 111 178.960 178.960 178.348 0.612 25685 9612 1 13 . 1 1 111 111 LEU CA C 111 57.366 57.366 57.804 -0.438 25685 9613 1 13 . 1 1 111 111 LEU CB C 111 40.259 40.259 40.812 -0.553 25685 9614 1 13 . 1 1 111 111 LEU H H 111 7.732 7.732 7.384 0.348 25685 9615 1 13 . 1 1 112 112 ALA N N 112 121.020 121.020 121.289 -0.269 25685 9616 1 13 . 1 1 112 112 ALA C C 112 178.700 178.700 178.803 -0.103 25685 9617 1 13 . 1 1 112 112 ALA CA C 112 55.432 55.432 54.428 1.004 25685 9618 1 13 . 1 1 112 112 ALA CB C 112 18.214 18.214 17.946 0.268 25685 9619 1 13 . 1 1 112 112 ALA H H 112 8.121 8.121 7.283 0.838 25685 9620 1 13 . 1 1 113 113 PHE N N 113 118.369 118.369 116.933 1.436 25685 9621 1 13 . 1 1 113 113 PHE C C 113 176.091 176.091 177.549 -1.458 25685 9622 1 13 . 1 1 113 113 PHE CA C 113 61.388 61.388 60.812 0.576 25685 9623 1 13 . 1 1 113 113 PHE CB C 113 39.688 39.688 38.445 1.243 25685 9624 1 13 . 1 1 113 113 PHE H H 113 8.237 8.237 7.065 1.172 25685 9625 1 13 . 1 1 114 114 LEU N N 114 114.214 114.214 119.451 -5.237 25685 9626 1 13 . 1 1 114 114 LEU C C 114 177.038 177.038 178.175 -1.137 25685 9627 1 13 . 1 1 114 114 LEU CA C 114 56.358 56.358 57.304 -0.946 25685 9628 1 13 . 1 1 114 114 LEU CB C 114 42.716 42.716 42.081 0.634 25685 9629 1 13 . 1 1 114 114 LEU H H 114 7.576 7.576 7.378 0.198 25685 9630 1 13 . 1 1 115 115 TRP N N 115 112.667 112.667 116.189 -3.522 25685 9631 1 13 . 1 1 115 115 TRP C C 115 180.163 180.163 177.757 2.406 25685 9632 1 13 . 1 1 115 115 TRP CA C 115 55.930 55.930 58.959 -3.029 25685 9633 1 13 . 1 1 115 115 TRP H H 115 8.542 8.542 7.161 1.381 25685 9634 1 13 . 1 1 116 116 LEU N N 116 122.144 122.144 121.663 0.481 25685 9635 1 13 . 1 1 116 116 LEU C C 116 175.953 175.953 176.664 -0.711 25685 9636 1 13 . 1 1 116 116 LEU CA C 116 59.924 59.924 58.127 1.798 25685 9637 1 13 . 1 1 116 116 LEU CB C 116 39.097 39.097 40.130 -1.033 25685 9638 1 13 . 1 1 116 116 LEU H H 116 8.996 8.996 7.230 1.766 25685 9639 1 13 . 1 1 117 117 PRO C C 117 174.220 174.220 177.197 -2.977 25685 9640 1 13 . 1 1 117 117 PRO CA C 117 66.300 66.300 63.950 2.350 25685 9641 1 13 . 1 1 118 118 ALA N N 118 110.603 110.603 119.499 -8.896 25685 9642 1 13 . 1 1 118 118 ALA C C 118 177.162 177.162 178.554 -1.392 25685 9643 1 13 . 1 1 118 118 ALA CA C 118 52.670 52.670 53.688 -1.018 25685 9644 1 13 . 1 1 118 118 ALA CB C 118 18.853 18.853 19.497 -0.644 25685 9645 1 13 . 1 1 118 118 ALA H H 118 6.633 6.633 7.667 -1.034 25685 9646 1 13 . 1 1 119 119 ILE N N 119 113.492 113.492 114.874 -1.382 25685 9647 1 13 . 1 1 119 119 ILE CA C 119 63.703 63.703 64.238 -0.535 25685 9648 1 13 . 1 1 119 119 ILE CB C 119 39.605 39.605 37.397 2.208 25685 9649 1 13 . 1 1 119 119 ILE H H 119 7.693 7.693 8.532 -0.839 25685 9650 1 13 . 1 1 121 121 PRO C C 121 178.089 178.089 178.775 -0.686 25685 9651 1 13 . 1 1 121 121 PRO CA C 121 66.004 66.004 66.252 -0.249 25685 9652 1 13 . 1 1 122 122 PHE N N 122 113.797 113.797 117.908 -4.111 25685 9653 1 13 . 1 1 122 122 PHE C C 122 177.713 177.713 177.100 0.613 25685 9654 1 13 . 1 1 122 122 PHE CA C 122 61.566 61.566 59.511 2.055 25685 9655 1 13 . 1 1 122 122 PHE CB C 122 38.983 38.983 38.588 0.395 25685 9656 1 13 . 1 1 122 122 PHE H H 122 6.846 6.846 8.100 -1.254 25685 9657 1 13 . 1 1 123 123 ALA N N 123 121.512 121.512 121.184 0.328 25685 9658 1 13 . 1 1 123 123 ALA C C 123 179.318 179.318 179.801 -0.483 25685 9659 1 13 . 1 1 123 123 ALA CA C 123 54.975 54.975 55.248 -0.274 25685 9660 1 13 . 1 1 123 123 ALA CB C 123 17.881 17.881 18.081 -0.200 25685 9661 1 13 . 1 1 123 123 ALA H H 123 8.411 8.411 8.586 -0.175 25685 9662 1 13 . 1 1 124 124 GLY N N 124 104.093 104.093 107.054 -2.961 25685 9663 1 13 . 1 1 124 124 GLY C C 124 175.410 175.410 176.083 -0.673 25685 9664 1 13 . 1 1 124 124 GLY CA C 124 47.370 47.370 46.783 0.587 25685 9665 1 13 . 1 1 124 124 GLY H H 124 8.455 8.455 7.960 0.495 25685 9666 1 13 . 1 1 125 125 ILE N N 125 121.895 121.895 121.086 0.809 25685 9667 1 13 . 1 1 125 125 ILE C C 125 178.329 178.329 177.378 0.951 25685 9668 1 13 . 1 1 125 125 ILE CA C 125 64.412 64.412 64.177 0.235 25685 9669 1 13 . 1 1 125 125 ILE H H 125 7.954 7.954 7.836 0.118 25685 9670 1 13 . 1 1 126 126 ALA N N 126 122.768 122.768 123.023 -0.255 25685 9671 1 13 . 1 1 126 126 ALA C C 126 180.341 180.341 179.414 0.927 25685 9672 1 13 . 1 1 126 126 ALA CA C 126 55.266 55.266 55.509 -0.243 25685 9673 1 13 . 1 1 126 126 ALA CB C 126 18.226 18.226 18.011 0.215 25685 9674 1 13 . 1 1 126 126 ALA H H 126 8.142 8.142 7.781 0.361 25685 9675 1 13 . 1 1 127 127 ILE N N 127 116.752 116.752 118.261 -1.509 25685 9676 1 13 . 1 1 127 127 ILE C C 127 177.993 177.993 177.895 0.098 25685 9677 1 13 . 1 1 127 127 ILE CA C 127 63.877 63.877 64.151 -0.274 25685 9678 1 13 . 1 1 127 127 ILE CB C 127 37.657 37.657 37.468 0.189 25685 9679 1 13 . 1 1 127 127 ILE H H 127 8.335 8.335 7.689 0.646 25685 9680 1 13 . 1 1 128 128 SER N N 128 116.351 116.351 114.253 2.098 25685 9681 1 13 . 1 1 128 128 SER C C 128 175.796 175.796 176.368 -0.572 25685 9682 1 13 . 1 1 128 128 SER CA C 128 61.818 61.818 61.544 0.275 25685 9683 1 13 . 1 1 128 128 SER H H 128 7.939 7.939 7.811 0.128 25685 9684 1 13 . 1 1 129 129 GLN N N 129 118.082 118.082 120.125 -2.043 25685 9685 1 13 . 1 1 129 129 GLN C C 129 177.419 177.419 178.122 -0.703 25685 9686 1 13 . 1 1 129 129 GLN CA C 129 57.106 57.106 58.411 -1.305 25685 9687 1 13 . 1 1 129 129 GLN CB C 129 28.631 28.631 28.836 -0.205 25685 9688 1 13 . 1 1 129 129 GLN H H 129 7.943 7.943 7.629 0.314 25685 9689 1 13 . 1 1 130 130 THR N N 130 113.484 113.484 112.702 0.782 25685 9690 1 13 . 1 1 130 130 THR C C 130 175.627 175.627 175.566 0.061 25685 9691 1 13 . 1 1 130 130 THR CA C 130 63.758 63.758 65.538 -1.780 25685 9692 1 13 . 1 1 130 130 THR CB C 130 69.182 69.182 68.980 0.202 25685 9693 1 13 . 1 1 130 130 THR H H 130 7.686 7.686 7.543 0.143 25685 9694 1 13 . 1 1 131 131 LEU N N 131 121.347 121.347 120.787 0.560 25685 9695 1 13 . 1 1 131 131 LEU C C 131 177.522 177.522 177.973 -0.451 25685 9696 1 13 . 1 1 131 131 LEU CA C 131 56.307 56.307 56.035 0.272 25685 9697 1 13 . 1 1 131 131 LEU CB C 131 41.711 41.711 41.287 0.424 25685 9698 1 13 . 1 1 131 131 LEU H H 131 8.071 8.071 7.494 0.577 25685 9699 1 13 . 1 1 132 132 LEU N N 132 118.162 118.162 121.153 -2.991 25685 9700 1 13 . 1 1 132 132 LEU C C 132 177.461 177.461 177.775 -0.314 25685 9701 1 13 . 1 1 132 132 LEU CA C 132 55.264 55.264 56.742 -1.478 25685 9702 1 13 . 1 1 132 132 LEU CB C 132 41.613 41.613 41.666 -0.054 25685 9703 1 13 . 1 1 132 132 LEU H H 132 7.810 7.810 7.731 0.079 25685 9704 1 13 . 1 1 133 133 SER N N 133 114.244 114.244 113.190 1.054 25685 9705 1 13 . 1 1 133 133 SER C C 133 174.363 174.363 173.484 0.879 25685 9706 1 13 . 1 1 133 133 SER CA C 133 59.019 59.019 58.824 0.195 25685 9707 1 13 . 1 1 133 133 SER CB C 133 64.634 64.634 63.791 0.843 25685 9708 1 13 . 1 1 133 133 SER H H 133 7.829 7.829 8.223 -0.394 25685 9709 1 13 . 1 1 134 134 GLU N N 134 120.151 120.151 121.661 -1.510 25685 9710 1 13 . 1 1 134 134 GLU C C 134 175.935 175.935 174.853 1.082 25685 9711 1 13 . 1 1 134 134 GLU CA C 134 56.301 56.301 55.550 0.751 25685 9712 1 13 . 1 1 134 134 GLU CB C 134 30.129 30.129 31.628 -1.499 25685 9713 1 13 . 1 1 134 134 GLU H H 134 8.054 8.054 8.482 -0.428 25685 9714 1 13 . 1 1 135 135 ASN N N 135 118.890 118.890 123.564 -4.674 25685 9715 1 13 . 1 1 135 135 ASN C C 135 174.272 174.272 173.712 0.560 25685 9716 1 13 . 1 1 135 135 ASN CA C 135 51.390 51.390 51.864 -0.474 25685 9717 1 13 . 1 1 135 135 ASN CB C 135 39.129 39.129 39.252 -0.123 25685 9718 1 13 . 1 1 135 135 ASN H H 135 8.305 8.305 8.071 0.234 25685 9719 1 13 . 1 1 136 136 PRO C C 136 177.960 177.960 178.257 -0.297 25685 9720 1 13 . 1 1 136 136 PRO CA C 136 64.530 64.530 65.273 -0.743 25685 9721 1 13 . 1 1 136 136 PRO CB C 136 31.809 31.809 32.157 -0.348 25685 9722 1 13 . 1 1 137 137 LEU N N 137 117.735 117.735 117.601 0.134 25685 9723 1 13 . 1 1 137 137 LEU C C 137 179.217 179.217 178.462 0.755 25685 9724 1 13 . 1 1 137 137 LEU CA C 137 57.039 57.039 58.207 -1.168 25685 9725 1 13 . 1 1 137 137 LEU CB C 137 40.799 40.799 41.328 -0.529 25685 9726 1 13 . 1 1 137 137 LEU H H 137 8.248 8.248 8.041 0.207 25685 9727 1 13 . 1 1 138 138 VAL N N 138 119.589 119.589 116.532 3.057 25685 9728 1 13 . 1 1 138 138 VAL C C 138 177.894 177.894 176.932 0.962 25685 9729 1 13 . 1 1 138 138 VAL CA C 138 64.727 64.727 65.347 -0.620 25685 9730 1 13 . 1 1 138 138 VAL CB C 138 31.347 31.347 31.010 0.337 25685 9731 1 13 . 1 1 138 138 VAL H H 138 7.483 7.483 7.272 0.211 25685 9732 1 13 . 1 1 139 139 MET N N 139 119.431 119.431 119.605 -0.174 25685 9733 1 13 . 1 1 139 139 MET C C 139 177.988 177.988 179.014 -1.026 25685 9734 1 13 . 1 1 139 139 MET CA C 139 57.403 57.403 59.418 -2.015 25685 9735 1 13 . 1 1 139 139 MET CB C 139 31.709 31.709 32.403 -0.694 25685 9736 1 13 . 1 1 139 139 MET H H 139 7.837 7.837 7.525 0.312 25685 9737 1 13 . 1 1 140 140 LEU N N 140 119.686 119.686 119.953 -0.267 25685 9738 1 13 . 1 1 140 140 LEU C C 140 177.916 177.916 178.804 -0.888 25685 9739 1 13 . 1 1 140 140 LEU CA C 140 56.877 56.877 58.371 -1.494 25685 9740 1 13 . 1 1 140 140 LEU CB C 140 41.491 41.491 41.344 0.147 25685 9741 1 13 . 1 1 140 140 LEU H H 140 7.926 7.926 8.370 -0.444 25685 9742 1 13 . 1 1 141 141 SER N N 141 114.167 114.167 115.285 -1.118 25685 9743 1 13 . 1 1 141 141 SER C C 141 176.030 176.030 177.225 -1.195 25685 9744 1 13 . 1 1 141 141 SER CA C 141 60.425 60.425 61.489 -1.064 25685 9745 1 13 . 1 1 141 141 SER CB C 141 63.956 63.956 63.369 0.587 25685 9746 1 13 . 1 1 141 141 SER H H 141 7.757 7.757 8.091 -0.334 25685 9747 1 13 . 1 1 142 142 TYR N N 142 121.679 121.679 121.109 0.570 25685 9748 1 13 . 1 1 142 142 TYR C C 142 177.659 177.659 178.286 -0.627 25685 9749 1 13 . 1 1 142 142 TYR CA C 142 59.673 59.673 58.325 1.348 25685 9750 1 13 . 1 1 142 142 TYR CB C 142 38.079 38.079 37.472 0.607 25685 9751 1 13 . 1 1 142 142 TYR H H 142 7.965 7.965 8.970 -1.005 25685 9752 1 13 . 1 1 143 143 GLY N N 143 107.396 107.396 107.271 0.125 25685 9753 1 13 . 1 1 143 143 GLY C C 143 174.877 174.877 175.814 -0.937 25685 9754 1 13 . 1 1 143 143 GLY CA C 143 46.343 46.343 47.801 -1.458 25685 9755 1 13 . 1 1 143 143 GLY H H 143 8.177 8.177 8.507 -0.330 25685 9756 1 13 . 1 1 144 144 LEU N N 144 120.477 120.477 121.169 -0.692 25685 9757 1 13 . 1 1 144 144 LEU C C 144 178.504 178.504 178.634 -0.130 25685 9758 1 13 . 1 1 144 144 LEU CA C 144 56.270 56.270 57.495 -1.225 25685 9759 1 13 . 1 1 144 144 LEU CB C 144 41.662 41.662 40.960 0.702 25685 9760 1 13 . 1 1 144 144 LEU H H 144 8.055 8.055 7.403 0.652 25685 9761 1 13 . 1 1 145 145 GLY N N 145 106.847 106.847 107.087 -0.240 25685 9762 1 13 . 1 1 145 145 GLY C C 145 175.375 175.375 175.816 -0.441 25685 9763 1 13 . 1 1 145 145 GLY CA C 145 45.582 45.582 46.820 -1.238 25685 9764 1 13 . 1 1 145 145 GLY H H 145 8.066 8.066 7.624 0.442 25685 9765 1 13 . 1 1 146 146 MET N N 146 120.376 120.376 122.075 -1.699 25685 9766 1 13 . 1 1 146 146 MET C C 146 176.663 176.663 178.140 -1.477 25685 9767 1 13 . 1 1 146 146 MET CA C 146 57.030 57.030 58.013 -0.983 25685 9768 1 13 . 1 1 146 146 MET CB C 146 30.720 30.720 32.168 -1.448 25685 9769 1 13 . 1 1 146 146 MET H H 146 8.157 8.157 8.691 -0.534 25685 9770 1 13 . 1 1 147 147 ALA N N 147 123.038 123.038 120.987 2.051 25685 9771 1 13 . 1 1 147 147 ALA C C 147 178.917 178.917 179.391 -0.474 25685 9772 1 13 . 1 1 147 147 ALA CA C 147 54.201 54.201 55.240 -1.039 25685 9773 1 13 . 1 1 147 147 ALA CB C 147 18.810 18.810 18.191 0.619 25685 9774 1 13 . 1 1 147 147 ALA H H 147 8.336 8.336 8.212 0.124 25685 9775 1 13 . 1 1 148 148 VAL N N 148 117.795 117.795 115.337 2.458 25685 9776 1 13 . 1 1 148 148 VAL C C 148 176.891 176.891 177.825 -0.934 25685 9777 1 13 . 1 1 148 148 VAL CA C 148 64.157 64.157 65.799 -1.642 25685 9778 1 13 . 1 1 148 148 VAL CB C 148 31.529 31.529 31.171 0.358 25685 9779 1 13 . 1 1 148 148 VAL H H 148 7.908 7.908 7.375 0.533 25685 9780 1 13 . 1 1 149 149 THR N N 149 116.069 116.069 117.214 -1.145 25685 9781 1 13 . 1 1 149 149 THR C C 149 176.054 176.054 176.472 -0.418 25685 9782 1 13 . 1 1 149 149 THR CA C 149 63.308 63.308 67.706 -4.398 25685 9783 1 13 . 1 1 149 149 THR H H 149 7.414 7.414 7.449 -0.035 25685 9784 1 13 . 1 1 150 150 ILE N N 150 121.971 121.971 120.570 1.401 25685 9785 1 13 . 1 1 150 150 ILE C C 150 177.715 177.715 177.267 0.448 25685 9786 1 13 . 1 1 150 150 ILE CA C 150 64.319 64.319 64.818 -0.499 25685 9787 1 13 . 1 1 150 150 ILE CB C 150 36.628 36.628 37.714 -1.086 25685 9788 1 13 . 1 1 150 150 ILE H H 150 8.772 8.772 8.028 0.744 25685 9789 1 13 . 1 1 151 151 ALA N N 151 122.272 122.272 121.191 1.081 25685 9790 1 13 . 1 1 151 151 ALA C C 151 180.370 180.370 179.161 1.209 25685 9791 1 13 . 1 1 151 151 ALA CA C 151 55.336 55.336 55.169 0.167 25685 9792 1 13 . 1 1 151 151 ALA CB C 151 18.107 18.107 17.945 0.162 25685 9793 1 13 . 1 1 151 151 ALA H H 151 8.163 8.163 7.601 0.562 25685 9794 1 13 . 1 1 152 152 ALA N N 152 120.648 120.648 121.111 -0.463 25685 9795 1 13 . 1 1 152 152 ALA C C 152 181.019 181.019 179.831 1.188 25685 9796 1 13 . 1 1 152 152 ALA CA C 152 54.944 54.944 54.611 0.333 25685 9797 1 13 . 1 1 152 152 ALA CB C 152 18.963 18.963 18.455 0.508 25685 9798 1 13 . 1 1 152 152 ALA H H 152 7.877 7.877 7.514 0.363 25685 9799 1 13 . 1 1 153 153 VAL N N 153 119.372 119.372 119.511 -0.139 25685 9800 1 13 . 1 1 153 153 VAL C C 153 178.197 178.197 177.569 0.628 25685 9801 1 13 . 1 1 153 153 VAL CA C 153 66.289 66.289 65.017 1.272 25685 9802 1 13 . 1 1 153 153 VAL CB C 153 30.770 30.770 31.656 -0.886 25685 9803 1 13 . 1 1 153 153 VAL H H 153 8.118 8.118 7.521 0.597 25685 9804 1 13 . 1 1 154 154 PHE N N 154 120.362 120.362 119.849 0.513 25685 9805 1 13 . 1 1 154 154 PHE C C 154 177.733 177.733 177.046 0.687 25685 9806 1 13 . 1 1 154 154 PHE CA C 154 61.412 61.412 61.447 -0.035 25685 9807 1 13 . 1 1 154 154 PHE CB C 154 38.465 38.465 38.786 -0.321 25685 9808 1 13 . 1 1 154 154 PHE H H 154 8.508 8.508 7.977 0.531 25685 9809 1 13 . 1 1 155 155 LYS N N 155 118.894 118.894 118.939 -0.045 25685 9810 1 13 . 1 1 155 155 LYS C C 155 179.940 179.940 178.552 1.388 25685 9811 1 13 . 1 1 155 155 LYS CA C 155 58.969 58.969 59.202 -0.233 25685 9812 1 13 . 1 1 155 155 LYS CB C 155 31.725 31.725 32.166 -0.441 25685 9813 1 13 . 1 1 155 155 LYS H H 155 8.035 8.035 7.684 0.351 25685 9814 1 13 . 1 1 156 156 MET N N 156 118.853 118.853 117.024 1.829 25685 9815 1 13 . 1 1 156 156 MET C C 156 179.245 179.245 177.635 1.610 25685 9816 1 13 . 1 1 156 156 MET CA C 156 58.518 58.518 57.157 1.361 25685 9817 1 13 . 1 1 156 156 MET CB C 156 31.912 31.912 30.839 1.073 25685 9818 1 13 . 1 1 156 156 MET H H 156 8.014 8.014 7.437 0.577 25685 9819 1 13 . 1 1 157 157 GLY N N 157 108.239 108.239 106.633 1.606 25685 9820 1 13 . 1 1 157 157 GLY C C 157 174.637 174.637 175.134 -0.497 25685 9821 1 13 . 1 1 157 157 GLY CA C 157 47.204 47.204 46.670 0.534 25685 9822 1 13 . 1 1 157 157 GLY H H 157 8.614 8.614 7.675 0.939 25685 9823 1 13 . 1 1 158 158 GLU N N 158 122.902 122.902 120.230 2.672 25685 9824 1 13 . 1 1 158 158 GLU C C 158 177.851 177.851 176.203 1.648 25685 9825 1 13 . 1 1 158 158 GLU CA C 158 60.203 60.203 55.733 4.470 25685 9826 1 13 . 1 1 158 158 GLU CB C 158 28.870 28.870 31.344 -2.474 25685 9827 1 13 . 1 1 158 158 GLU H H 158 8.550 8.550 7.692 0.858 25685 9828 1 13 . 1 1 159 159 LYS N N 159 117.932 117.932 121.453 -3.521 25685 9829 1 13 . 1 1 159 159 LYS C C 159 179.529 179.529 176.928 2.601 25685 9830 1 13 . 1 1 159 159 LYS CA C 159 59.419 59.419 55.779 3.640 25685 9831 1 13 . 1 1 159 159 LYS CB C 159 31.759 31.759 32.312 -0.553 25685 9832 1 13 . 1 1 159 159 LYS H H 159 7.641 7.641 8.413 -0.772 25685 9833 1 13 . 1 1 160 160 PHE N N 160 120.614 120.614 128.746 -8.132 25685 9834 1 13 . 1 1 160 160 PHE C C 160 178.511 178.511 175.014 3.497 25685 9835 1 13 . 1 1 160 160 PHE CA C 160 61.580 61.580 56.302 5.278 25685 9836 1 13 . 1 1 160 160 PHE CB C 160 39.909 39.909 37.450 2.459 25685 9837 1 13 . 1 1 160 160 PHE H H 160 8.026 8.026 9.052 -1.026 25685 9838 1 13 . 1 1 161 161 VAL N N 161 119.870 119.870 118.575 1.295 25685 9839 1 13 . 1 1 161 161 VAL C C 161 177.347 177.347 175.129 2.218 25685 9840 1 13 . 1 1 161 161 VAL CA C 161 66.121 66.121 63.589 2.532 25685 9841 1 13 . 1 1 161 161 VAL CB C 161 30.935 30.935 31.751 -0.816 25685 9842 1 13 . 1 1 161 161 VAL H H 161 8.628 8.628 8.133 0.495 25685 9843 1 13 . 1 1 162 162 LYS N N 162 116.237 116.237 121.840 -5.603 25685 9844 1 13 . 1 1 162 162 LYS C C 162 179.197 179.197 176.247 2.950 25685 9845 1 13 . 1 1 162 162 LYS CA C 162 60.037 60.037 58.214 1.823 25685 9846 1 13 . 1 1 162 162 LYS CB C 162 31.333 31.333 32.691 -1.359 25685 9847 1 13 . 1 1 162 162 LYS H H 162 7.843 7.843 8.570 -0.727 25685 9848 1 13 . 1 1 163 163 ALA N N 163 119.197 119.197 116.875 2.322 25685 9849 1 13 . 1 1 163 163 ALA C C 163 178.635 178.635 175.166 3.469 25685 9850 1 13 . 1 1 163 163 ALA CA C 163 53.681 53.681 51.550 2.131 25685 9851 1 13 . 1 1 163 163 ALA CB C 163 19.586 19.586 18.762 0.824 25685 9852 1 13 . 1 1 163 163 ALA H H 163 7.630 7.630 7.673 -0.043 25685 9853 1 13 . 1 1 164 164 ASN N N 164 115.956 115.956 117.073 -1.117 25685 9854 1 13 . 1 1 164 164 ASN C C 164 175.556 175.556 175.632 -0.076 25685 9855 1 13 . 1 1 164 164 ASN CA C 164 52.267 52.267 53.565 -1.298 25685 9856 1 13 . 1 1 164 164 ASN CB C 164 39.148 39.148 38.448 0.700 25685 9857 1 13 . 1 1 164 164 ASN H H 164 7.326 7.326 8.315 -0.989 25685 9858 1 13 . 1 1 165 165 PHE N N 165 121.612 121.612 123.386 -1.774 25685 9859 1 13 . 1 1 165 165 PHE C C 165 177.069 177.069 176.266 0.803 25685 9860 1 13 . 1 1 165 165 PHE CA C 165 62.921 62.921 61.439 1.482 25685 9861 1 13 . 1 1 165 165 PHE CB C 165 39.427 39.427 38.995 0.432 25685 9862 1 13 . 1 1 165 165 PHE H H 165 7.408 7.408 8.897 -1.489 25685 9863 1 13 . 1 1 166 166 GLN N N 166 117.147 117.147 117.537 -0.390 25685 9864 1 13 . 1 1 166 166 GLN C C 166 178.922 178.922 178.209 0.713 25685 9865 1 13 . 1 1 166 166 GLN CA C 166 59.262 59.262 58.369 0.893 25685 9866 1 13 . 1 1 166 166 GLN CB C 166 26.811 26.811 27.406 -0.595 25685 9867 1 13 . 1 1 166 166 GLN H H 166 8.605 8.605 8.449 0.156 25685 9868 1 13 . 1 1 167 167 LEU N N 167 121.946 121.946 119.929 2.017 25685 9869 1 13 . 1 1 167 167 LEU C C 167 178.863 178.863 178.206 0.657 25685 9870 1 13 . 1 1 167 167 LEU CA C 167 58.039 58.039 57.440 0.599 25685 9871 1 13 . 1 1 167 167 LEU CB C 167 41.130 41.130 41.910 -0.780 25685 9872 1 13 . 1 1 167 167 LEU H H 167 7.892 7.892 7.314 0.578 25685 9873 1 13 . 1 1 168 168 ILE N N 168 118.751 118.751 117.300 1.451 25685 9874 1 13 . 1 1 168 168 ILE C C 168 179.908 179.908 177.620 2.288 25685 9875 1 13 . 1 1 168 168 ILE CA C 168 63.886 63.886 64.710 -0.824 25685 9876 1 13 . 1 1 168 168 ILE CB C 168 36.170 36.170 37.882 -1.712 25685 9877 1 13 . 1 1 168 168 ILE H H 168 8.065 8.065 7.277 0.788 25685 9878 1 13 . 1 1 169 169 ARG N N 169 125.851 125.851 118.429 7.422 25685 9879 1 13 . 1 1 169 169 ARG C C 169 177.579 177.579 177.700 -0.121 25685 9880 1 13 . 1 1 169 169 ARG CA C 169 60.306 60.306 59.582 0.724 25685 9881 1 13 . 1 1 169 169 ARG CB C 169 29.224 29.224 30.036 -0.812 25685 9882 1 13 . 1 1 169 169 ARG H H 169 8.995 8.995 7.746 1.249 25685 9883 1 13 . 1 1 170 170 LYS N N 170 119.586 119.586 118.111 1.475 25685 9884 1 13 . 1 1 170 170 LYS C C 170 178.584 178.584 178.330 0.254 25685 9885 1 13 . 1 1 170 170 LYS CA C 170 60.293 60.293 58.991 1.302 25685 9886 1 13 . 1 1 170 170 LYS CB C 170 32.530 32.530 31.249 1.281 25685 9887 1 13 . 1 1 170 170 LYS H H 170 7.663 7.663 7.552 0.111 25685 9888 1 13 . 1 1 171 171 VAL N N 171 118.348 118.348 119.291 -0.943 25685 9889 1 13 . 1 1 171 171 VAL C C 171 177.478 177.478 177.465 0.013 25685 9890 1 13 . 1 1 171 171 VAL CA C 171 66.641 66.641 66.280 0.361 25685 9891 1 13 . 1 1 171 171 VAL CB C 171 31.565 31.565 31.337 0.228 25685 9892 1 13 . 1 1 171 171 VAL H H 171 8.515 8.515 7.486 1.029 25685 9893 1 13 . 1 1 172 172 THR N N 172 115.172 115.172 115.176 -0.004 25685 9894 1 13 . 1 1 172 172 THR C C 172 176.320 176.320 176.110 0.210 25685 9895 1 13 . 1 1 172 172 THR H H 172 8.416 8.416 7.600 0.816 25685 9896 1 13 . 1 1 173 173 GLY N N 173 108.801 108.801 108.109 0.692 25685 9897 1 13 . 1 1 173 173 GLY C C 173 174.138 174.138 175.091 -0.953 25685 9898 1 13 . 1 1 173 173 GLY CA C 173 47.769 47.769 46.883 0.886 25685 9899 1 13 . 1 1 173 173 GLY H H 173 8.505 8.505 7.560 0.945 25685 9900 1 13 . 1 1 174 174 ALA N N 174 123.573 123.573 124.355 -0.782 25685 9901 1 13 . 1 1 174 174 ALA C C 174 178.782 178.782 179.610 -0.828 25685 9902 1 13 . 1 1 174 174 ALA CA C 174 55.604 55.604 54.777 0.827 25685 9903 1 13 . 1 1 174 174 ALA CB C 174 18.778 18.778 18.265 0.513 25685 9904 1 13 . 1 1 174 174 ALA H H 174 8.038 8.038 7.402 0.636 25685 9905 1 13 . 1 1 175 175 ILE N N 175 118.501 118.501 118.706 -0.205 25685 9906 1 13 . 1 1 175 175 ILE C C 175 178.247 178.247 178.186 0.061 25685 9907 1 13 . 1 1 175 175 ILE CA C 175 65.412 65.412 63.418 1.994 25685 9908 1 13 . 1 1 175 175 ILE CB C 175 37.671 37.671 36.641 1.030 25685 9909 1 13 . 1 1 175 175 ILE H H 175 7.897 7.897 7.674 0.223 25685 9910 1 13 . 1 1 176 176 VAL N N 176 120.104 120.104 120.313 -0.209 25685 9911 1 13 . 1 1 176 176 VAL C C 176 177.945 177.945 178.102 -0.157 25685 9912 1 13 . 1 1 176 176 VAL CA C 176 67.761 67.761 65.944 1.817 25685 9913 1 13 . 1 1 176 176 VAL CB C 176 30.662 30.662 31.440 -0.778 25685 9914 1 13 . 1 1 176 176 VAL H H 176 8.321 8.321 7.675 0.646 25685 9915 1 13 . 1 1 177 177 LEU N N 177 118.561 118.561 120.346 -1.785 25685 9916 1 13 . 1 1 177 177 LEU C C 177 178.563 178.563 179.349 -0.786 25685 9917 1 13 . 1 1 177 177 LEU CA C 177 58.094 58.094 57.623 0.471 25685 9918 1 13 . 1 1 177 177 LEU CB C 177 41.061 41.061 40.845 0.216 25685 9919 1 13 . 1 1 177 177 LEU H H 177 8.097 8.097 7.410 0.687 25685 9920 1 13 . 1 1 178 178 LEU N N 178 120.868 120.868 120.208 0.660 25685 9921 1 13 . 1 1 178 178 LEU C C 178 178.524 178.524 178.148 0.376 25685 9922 1 13 . 1 1 178 178 LEU CA C 178 57.767 57.767 58.455 -0.688 25685 9923 1 13 . 1 1 178 178 LEU CB C 178 40.886 40.886 41.840 -0.954 25685 9924 1 13 . 1 1 178 178 LEU H H 178 8.229 8.229 7.910 0.319 25685 9925 1 13 . 1 1 179 179 TYR N N 179 119.355 119.355 118.338 1.017 25685 9926 1 13 . 1 1 179 179 TYR C C 179 180.059 180.059 177.706 2.353 25685 9927 1 13 . 1 1 179 179 TYR CA C 179 63.844 63.844 61.868 1.976 25685 9928 1 13 . 1 1 179 179 TYR CB C 179 39.508 39.508 38.515 0.993 25685 9929 1 13 . 1 1 179 179 TYR H H 179 8.759 8.759 7.870 0.889 25685 9930 1 13 . 1 1 180 180 LEU N N 180 118.984 118.984 118.695 0.289 25685 9931 1 13 . 1 1 180 180 LEU C C 180 179.079 179.079 179.104 -0.025 25685 9932 1 13 . 1 1 180 180 LEU CA C 180 58.879 58.879 57.736 1.143 25685 9933 1 13 . 1 1 180 180 LEU CB C 180 41.899 41.899 41.372 0.527 25685 9934 1 13 . 1 1 180 180 LEU H H 180 8.315 8.315 7.859 0.456 25685 9935 1 13 . 1 1 181 181 ALA N N 181 121.826 121.826 122.056 -0.230 25685 9936 1 13 . 1 1 181 181 ALA C C 181 180.009 180.009 178.837 1.172 25685 9937 1 13 . 1 1 181 181 ALA CA C 181 55.700 55.700 54.952 0.748 25685 9938 1 13 . 1 1 181 181 ALA CB C 181 17.713 17.713 18.530 -0.817 25685 9939 1 13 . 1 1 181 181 ALA H H 181 8.480 8.480 8.104 0.376 25685 9940 1 13 . 1 1 182 182 TYR N N 182 118.039 118.039 117.250 0.789 25685 9941 1 13 . 1 1 182 182 TYR CA C 182 59.038 59.038 61.456 -2.418 25685 9942 1 13 . 1 1 182 182 TYR H H 182 8.856 8.856 7.701 1.155 25685 9943 1 13 . 1 1 183 183 PHE N N 183 124.769 124.769 116.303 8.466 25685 9944 1 13 . 1 1 183 183 PHE CA C 183 63.566 63.566 60.092 3.474 25685 9945 1 13 . 1 1 183 183 PHE H H 183 9.764 9.764 7.562 2.202 25685 9946 1 14 . 1 1 4 4 ALA N N 4 121.533 121.533 123.902 -2.369 25685 9947 1 14 . 1 1 4 4 ALA C C 4 177.632 177.632 178.647 -1.015 25685 9948 1 14 . 1 1 4 4 ALA CA C 4 55.117 55.117 55.073 0.044 25685 9949 1 14 . 1 1 4 4 ALA CB C 4 18.448 18.448 18.183 0.265 25685 9950 1 14 . 1 1 4 4 ALA H H 4 7.977 7.977 8.405 -0.428 25685 9951 1 14 . 1 1 5 5 PHE N N 5 119.988 119.988 119.732 0.256 25685 9952 1 14 . 1 1 5 5 PHE CA C 5 60.759 60.759 60.607 0.152 25685 9953 1 14 . 1 1 5 5 PHE CB C 5 39.221 39.221 38.806 0.415 25685 9954 1 14 . 1 1 5 5 PHE H H 5 8.210 8.210 8.304 -0.094 25685 9955 1 14 . 1 1 6 6 ALA C C 6 179.794 179.794 179.505 0.289 25685 9956 1 14 . 1 1 6 6 ALA CA C 6 55.619 55.619 54.783 0.836 25685 9957 1 14 . 1 1 6 6 ALA CB C 6 17.911 17.911 17.914 -0.003 25685 9958 1 14 . 1 1 6 6 ALA H H 6 8.417 8.417 8.332 0.085 25685 9959 1 14 . 1 1 7 7 LEU N N 7 115.852 115.852 117.433 -1.581 25685 9960 1 14 . 1 1 7 7 LEU C C 7 180.196 180.196 179.336 0.860 25685 9961 1 14 . 1 1 7 7 LEU CA C 7 57.528 57.528 57.313 0.215 25685 9962 1 14 . 1 1 7 7 LEU CB C 7 40.060 40.060 41.136 -1.076 25685 9963 1 14 . 1 1 7 7 LEU H H 7 8.741 8.741 7.724 1.017 25685 9964 1 14 . 1 1 8 8 GLY N N 8 110.199 110.199 107.619 2.580 25685 9965 1 14 . 1 1 8 8 GLY C C 8 176.430 176.430 176.136 0.294 25685 9966 1 14 . 1 1 8 8 GLY CA C 8 46.960 46.960 47.172 -0.212 25685 9967 1 14 . 1 1 8 8 GLY H H 8 8.179 8.179 7.608 0.571 25685 9968 1 14 . 1 1 9 9 ILE N N 9 122.346 122.346 123.212 -0.866 25685 9969 1 14 . 1 1 9 9 ILE C C 9 178.143 178.143 177.184 0.959 25685 9970 1 14 . 1 1 9 9 ILE CA C 9 65.048 65.048 62.356 2.692 25685 9971 1 14 . 1 1 9 9 ILE CB C 9 36.841 36.841 37.021 -0.180 25685 9972 1 14 . 1 1 9 9 ILE H H 9 7.788 7.788 7.350 0.438 25685 9973 1 14 . 1 1 10 10 LEU N N 10 117.560 117.560 119.816 -2.256 25685 9974 1 14 . 1 1 10 10 LEU C C 10 179.501 179.501 178.110 1.391 25685 9975 1 14 . 1 1 10 10 LEU CA C 10 58.068 58.068 57.958 0.110 25685 9976 1 14 . 1 1 10 10 LEU CB C 10 40.776 40.776 41.855 -1.079 25685 9977 1 14 . 1 1 10 10 LEU H H 10 8.044 8.044 7.575 0.469 25685 9978 1 14 . 1 1 11 11 SER N N 11 113.830 113.830 113.975 -0.145 25685 9979 1 14 . 1 1 11 11 SER CA C 11 61.769 61.769 61.036 0.733 25685 9980 1 14 . 1 1 11 11 SER CB C 11 63.395 63.395 63.666 -0.272 25685 9981 1 14 . 1 1 11 11 SER H H 11 8.140 8.140 7.466 0.674 25685 9982 1 14 . 1 1 12 12 VAL N N 12 121.343 121.343 119.745 1.598 25685 9983 1 14 . 1 1 12 12 VAL C C 12 176.753 176.753 177.495 -0.742 25685 9984 1 14 . 1 1 12 12 VAL CA C 12 64.583 64.583 64.437 0.146 25685 9985 1 14 . 1 1 12 12 VAL CB C 12 31.067 31.067 30.028 1.039 25685 9986 1 14 . 1 1 12 12 VAL H H 12 7.587 7.587 7.393 0.194 25685 9987 1 14 . 1 1 13 13 PHE N N 13 115.225 115.225 121.480 -6.255 25685 9988 1 14 . 1 1 13 13 PHE C C 13 177.349 177.349 175.837 1.512 25685 9989 1 14 . 1 1 13 13 PHE CA C 13 58.730 58.730 60.353 -1.623 25685 9990 1 14 . 1 1 13 13 PHE CB C 13 39.785 39.785 39.185 0.600 25685 9991 1 14 . 1 1 13 13 PHE H H 13 7.474 7.474 7.507 -0.033 25685 9992 1 14 . 1 1 14 14 SER N N 14 116.075 116.075 114.144 1.931 25685 9993 1 14 . 1 1 14 14 SER H H 14 7.955 7.955 7.730 0.225 25685 9994 1 14 . 1 1 15 15 PRO C C 15 177.590 177.590 175.882 1.708 25685 9995 1 14 . 1 1 15 15 PRO CA C 15 65.464 65.464 62.482 2.982 25685 9996 1 14 . 1 1 16 16 ALA N N 16 116.288 116.288 118.565 -2.277 25685 9997 1 14 . 1 1 16 16 ALA C C 16 177.563 177.563 176.485 1.078 25685 9998 1 14 . 1 1 16 16 ALA CA C 16 53.010 53.010 51.759 1.251 25685 9999 1 14 . 1 1 16 16 ALA CB C 16 19.975 19.975 19.483 0.492 25685 10000 1 14 . 1 1 16 16 ALA H H 16 7.455 7.455 7.941 -0.486 25685 10001 1 14 . 1 1 17 17 VAL N N 17 112.072 112.072 121.790 -9.718 25685 10002 1 14 . 1 1 17 17 VAL CA C 17 63.117 63.117 63.983 -0.866 25685 10003 1 14 . 1 1 17 17 VAL CB C 17 33.209 33.209 30.417 2.792 25685 10004 1 14 . 1 1 17 17 VAL H H 17 7.525 7.525 8.554 -1.029 25685 10005 1 14 . 1 1 18 18 LEU N N 18 121.205 121.205 130.374 -9.169 25685 10006 1 14 . 1 1 18 18 LEU CA C 18 58.971 58.971 59.767 -0.796 25685 10007 1 14 . 1 1 18 18 LEU CB C 18 41.161 41.161 38.613 2.548 25685 10008 1 14 . 1 1 18 18 LEU H H 18 8.191 8.191 8.399 -0.208 25685 10009 1 14 . 1 1 19 19 PRO C C 19 177.697 177.697 177.202 0.495 25685 10010 1 14 . 1 1 19 19 PRO CA C 19 65.181 65.181 64.075 1.106 25685 10011 1 14 . 1 1 20 20 VAL N N 20 111.723 111.723 115.455 -3.732 25685 10012 1 14 . 1 1 20 20 VAL C C 20 177.137 177.137 176.045 1.092 25685 10013 1 14 . 1 1 20 20 VAL CA C 20 62.494 62.494 63.658 -1.164 25685 10014 1 14 . 1 1 20 20 VAL CB C 20 31.677 31.677 30.891 0.786 25685 10015 1 14 . 1 1 20 20 VAL H H 20 7.571 7.571 8.076 -0.505 25685 10016 1 14 . 1 1 21 21 VAL N N 21 121.705 121.705 123.715 -2.010 25685 10017 1 14 . 1 1 21 21 VAL CA C 21 68.305 68.305 63.196 5.109 25685 10018 1 14 . 1 1 21 21 VAL H H 21 7.732 7.732 7.951 -0.219 25685 10019 1 14 . 1 1 24 24 ILE C C 24 174.359 174.359 174.678 -0.319 25685 10020 1 14 . 1 1 25 25 PHE N N 25 120.132 120.132 125.797 -5.665 25685 10021 1 14 . 1 1 25 25 PHE C C 25 175.945 175.945 175.216 0.729 25685 10022 1 14 . 1 1 25 25 PHE CA C 25 60.544 60.544 59.144 1.400 25685 10023 1 14 . 1 1 25 25 PHE H H 25 8.082 8.082 8.618 -0.536 25685 10024 1 14 . 1 1 26 26 ALA N N 26 121.341 121.341 124.290 -2.949 25685 10025 1 14 . 1 1 26 26 ALA CB C 26 19.784 19.784 21.600 -1.816 25685 10026 1 14 . 1 1 26 26 ALA H H 26 7.539 7.539 7.846 -0.307 25685 10027 1 14 . 1 1 27 27 GLY N N 27 107.530 107.530 108.238 -0.708 25685 10028 1 14 . 1 1 27 27 GLY C C 27 174.252 174.252 173.189 1.063 25685 10029 1 14 . 1 1 27 27 GLY CA C 27 45.474 45.474 44.938 0.536 25685 10030 1 14 . 1 1 27 27 GLY H H 27 7.997 7.997 8.536 -0.539 25685 10031 1 14 . 1 1 28 28 SER N N 28 116.299 116.299 116.042 0.257 25685 10032 1 14 . 1 1 28 28 SER C C 28 175.759 175.759 172.426 3.333 25685 10033 1 14 . 1 1 28 28 SER CA C 28 58.526 58.526 57.425 1.101 25685 10034 1 14 . 1 1 28 28 SER CB C 28 64.373 64.373 65.360 -0.987 25685 10035 1 14 . 1 1 28 28 SER H H 28 8.115 8.115 8.445 -0.330 25685 10036 1 14 . 1 1 34 34 ASP C C 34 177.621 177.621 178.130 -0.509 25685 10037 1 14 . 1 1 34 34 ASP CA C 34 57.082 57.082 57.454 -0.372 25685 10038 1 14 . 1 1 35 35 ALA N N 35 120.662 120.662 121.836 -1.174 25685 10039 1 14 . 1 1 35 35 ALA C C 35 179.168 179.168 179.775 -0.607 25685 10040 1 14 . 1 1 35 35 ALA CA C 35 55.459 55.459 54.895 0.564 25685 10041 1 14 . 1 1 35 35 ALA CB C 35 18.819 18.819 18.521 0.298 25685 10042 1 14 . 1 1 35 35 ALA H H 35 8.090 8.090 7.364 0.726 25685 10043 1 14 . 1 1 36 36 PHE N N 36 117.638 117.638 119.331 -1.693 25685 10044 1 14 . 1 1 36 36 PHE C C 36 177.057 177.057 177.479 -0.422 25685 10045 1 14 . 1 1 36 36 PHE CA C 36 61.472 61.472 61.384 0.088 25685 10046 1 14 . 1 1 36 36 PHE CB C 36 38.860 38.860 39.648 -0.788 25685 10047 1 14 . 1 1 36 36 PHE H H 36 8.227 8.227 7.876 0.351 25685 10048 1 14 . 1 1 37 37 LEU N N 37 119.312 119.312 119.853 -0.541 25685 10049 1 14 . 1 1 37 37 LEU C C 37 179.798 179.798 178.594 1.204 25685 10050 1 14 . 1 1 37 37 LEU CA C 37 58.181 58.181 58.121 0.060 25685 10051 1 14 . 1 1 37 37 LEU CB C 37 40.835 40.835 41.270 -0.435 25685 10052 1 14 . 1 1 37 37 LEU H H 37 8.588 8.588 8.107 0.481 25685 10053 1 14 . 1 1 38 38 ILE N N 38 119.057 119.057 119.616 -0.559 25685 10054 1 14 . 1 1 38 38 ILE C C 38 177.597 177.597 177.332 0.265 25685 10055 1 14 . 1 1 38 38 ILE CA C 38 64.827 64.827 64.132 0.695 25685 10056 1 14 . 1 1 38 38 ILE CB C 38 36.321 36.321 37.629 -1.308 25685 10057 1 14 . 1 1 38 38 ILE H H 38 7.932 7.932 7.686 0.246 25685 10058 1 14 . 1 1 39 39 VAL N N 39 118.758 118.758 118.694 0.064 25685 10059 1 14 . 1 1 39 39 VAL C C 39 179.533 179.533 177.294 2.239 25685 10060 1 14 . 1 1 39 39 VAL CA C 39 66.687 66.687 65.794 0.892 25685 10061 1 14 . 1 1 39 39 VAL CB C 39 30.598 30.598 30.342 0.256 25685 10062 1 14 . 1 1 39 39 VAL H H 39 7.922 7.922 7.354 0.568 25685 10063 1 14 . 1 1 40 40 ALA N N 40 125.385 125.385 122.211 3.174 25685 10064 1 14 . 1 1 40 40 ALA C C 40 179.200 179.200 179.841 -0.641 25685 10065 1 14 . 1 1 40 40 ALA CA C 40 55.283 55.283 54.914 0.369 25685 10066 1 14 . 1 1 40 40 ALA CB C 40 17.197 17.197 18.378 -1.181 25685 10067 1 14 . 1 1 40 40 ALA H H 40 9.091 9.091 7.353 1.738 25685 10068 1 14 . 1 1 41 41 GLY N N 41 106.978 106.978 107.021 -0.043 25685 10069 1 14 . 1 1 41 41 GLY C C 41 176.171 176.171 175.993 0.178 25685 10070 1 14 . 1 1 41 41 GLY CA C 41 47.322 47.322 46.981 0.341 25685 10071 1 14 . 1 1 41 41 GLY H H 41 8.565 8.565 8.001 0.564 25685 10072 1 14 . 1 1 42 42 LEU N N 42 126.914 126.914 120.206 6.708 25685 10073 1 14 . 1 1 42 42 LEU C C 42 178.119 178.119 178.581 -0.462 25685 10074 1 14 . 1 1 42 42 LEU CA C 42 58.523 58.523 57.748 0.775 25685 10075 1 14 . 1 1 42 42 LEU CB C 42 42.125 42.125 41.240 0.885 25685 10076 1 14 . 1 1 42 42 LEU H H 42 8.573 8.573 7.643 0.930 25685 10077 1 14 . 1 1 46 46 MET N N 46 121.710 121.710 122.540 -0.830 25685 10078 1 14 . 1 1 46 46 MET C C 46 179.540 179.540 177.583 1.957 25685 10079 1 14 . 1 1 46 46 MET CA C 46 55.968 55.968 57.435 -1.467 25685 10080 1 14 . 1 1 46 46 MET H H 46 8.589 8.589 7.807 0.782 25685 10081 1 14 . 1 1 47 47 LEU N N 47 117.448 117.448 120.351 -2.903 25685 10082 1 14 . 1 1 47 47 LEU HA H 47 3.992 3.992 4.176 -0.184 25685 10083 1 14 . 1 1 47 47 LEU C C 47 179.082 179.082 179.864 -0.782 25685 10084 1 14 . 1 1 47 47 LEU CA C 47 58.157 58.157 57.640 0.517 25685 10085 1 14 . 1 1 47 47 LEU CB C 47 41.858 41.858 41.881 -0.023 25685 10086 1 14 . 1 1 47 47 LEU H H 47 8.769 8.769 7.971 0.798 25685 10087 1 14 . 1 1 48 48 ILE N N 48 117.500 117.500 118.411 -0.911 25685 10088 1 14 . 1 1 48 48 ILE C C 48 180.298 180.298 178.227 2.071 25685 10089 1 14 . 1 1 48 48 ILE CA C 48 65.627 65.627 64.617 1.010 25685 10090 1 14 . 1 1 48 48 ILE CB C 48 37.839 37.839 37.842 -0.003 25685 10091 1 14 . 1 1 48 48 ILE H H 48 8.093 8.093 7.521 0.572 25685 10092 1 14 . 1 1 49 49 LEU N N 49 123.708 123.708 120.786 2.922 25685 10093 1 14 . 1 1 49 49 LEU C C 49 179.721 179.721 178.381 1.340 25685 10094 1 14 . 1 1 49 49 LEU CA C 49 58.788 58.788 57.620 1.169 25685 10095 1 14 . 1 1 49 49 LEU CB C 49 40.761 40.761 41.806 -1.045 25685 10096 1 14 . 1 1 49 49 LEU H H 49 8.833 8.833 7.691 1.142 25685 10097 1 14 . 1 1 50 50 GLY N N 50 109.284 109.284 106.917 2.367 25685 10098 1 14 . 1 1 50 50 GLY C C 50 176.937 176.937 174.610 2.327 25685 10099 1 14 . 1 1 50 50 GLY CA C 50 47.821 47.821 46.752 1.069 25685 10100 1 14 . 1 1 50 50 GLY H H 50 9.658 9.658 8.646 1.012 25685 10101 1 14 . 1 1 51 51 TYR N N 51 125.640 125.640 118.810 6.830 25685 10102 1 14 . 1 1 51 51 TYR C C 51 177.102 177.102 176.146 0.956 25685 10103 1 14 . 1 1 51 51 TYR CA C 51 61.948 61.948 56.588 5.360 25685 10104 1 14 . 1 1 51 51 TYR CB C 51 38.871 38.871 40.074 -1.203 25685 10105 1 14 . 1 1 51 51 TYR H H 51 8.795 8.795 7.599 1.196 25685 10106 1 14 . 1 1 52 52 THR N N 52 116.273 116.273 115.205 1.068 25685 10107 1 14 . 1 1 52 52 THR C C 52 176.969 176.969 174.378 2.591 25685 10108 1 14 . 1 1 52 52 THR CA C 52 67.972 67.972 63.381 4.591 25685 10109 1 14 . 1 1 52 52 THR H H 52 8.456 8.456 8.630 -0.174 25685 10110 1 14 . 1 1 53 53 ALA N N 53 122.122 122.122 124.200 -2.078 25685 10111 1 14 . 1 1 53 53 ALA C C 53 179.907 179.907 177.230 2.677 25685 10112 1 14 . 1 1 53 53 ALA CA C 53 55.722 55.722 52.817 2.905 25685 10113 1 14 . 1 1 53 53 ALA CB C 53 18.786 18.786 18.245 0.541 25685 10114 1 14 . 1 1 53 53 ALA H H 53 9.058 9.058 8.116 0.942 25685 10115 1 14 . 1 1 54 54 SER N N 54 115.434 115.434 116.462 -1.028 25685 10116 1 14 . 1 1 54 54 SER C C 54 176.433 176.433 174.519 1.914 25685 10117 1 14 . 1 1 54 54 SER CA C 54 55.828 55.828 59.451 -3.623 25685 10118 1 14 . 1 1 54 54 SER H H 54 8.040 8.040 8.768 -0.728 25685 10119 1 14 . 1 1 55 55 LEU N N 55 123.045 123.045 115.038 8.007 25685 10120 1 14 . 1 1 55 55 LEU C C 55 178.789 178.789 175.544 3.245 25685 10121 1 14 . 1 1 55 55 LEU CA C 55 57.633 57.633 54.859 2.774 25685 10122 1 14 . 1 1 55 55 LEU CB C 55 41.293 41.293 42.092 -0.799 25685 10123 1 14 . 1 1 55 55 LEU H H 55 8.255 8.255 7.559 0.696 25685 10124 1 14 . 1 1 56 56 PHE N N 56 114.426 114.426 120.038 -5.612 25685 10125 1 14 . 1 1 56 56 PHE C C 56 177.507 177.507 174.683 2.824 25685 10126 1 14 . 1 1 56 56 PHE CA C 56 61.068 61.068 57.290 3.778 25685 10127 1 14 . 1 1 56 56 PHE CB C 56 40.107 40.107 38.620 1.487 25685 10128 1 14 . 1 1 56 56 PHE H H 56 7.590 7.590 7.808 -0.218 25685 10129 1 14 . 1 1 57 57 PHE N N 57 114.701 114.701 116.370 -1.669 25685 10130 1 14 . 1 1 57 57 PHE C C 57 176.203 176.203 176.333 -0.130 25685 10131 1 14 . 1 1 57 57 PHE CA C 57 58.503 58.503 58.003 0.500 25685 10132 1 14 . 1 1 57 57 PHE CB C 57 41.114 41.114 37.096 4.018 25685 10133 1 14 . 1 1 57 57 PHE H H 57 8.514 8.514 7.517 0.997 25685 10134 1 14 . 1 1 58 58 GLY N N 58 111.041 111.041 108.274 2.767 25685 10135 1 14 . 1 1 58 58 GLY C C 58 174.240 174.240 175.803 -1.563 25685 10136 1 14 . 1 1 58 58 GLY CA C 58 44.827 44.827 46.849 -2.022 25685 10137 1 14 . 1 1 58 58 GLY H H 58 7.998 7.998 8.671 -0.673 25685 10138 1 14 . 1 1 59 59 PHE N N 59 127.950 127.950 123.077 4.873 25685 10139 1 14 . 1 1 59 59 PHE C C 59 176.612 176.612 176.345 0.267 25685 10140 1 14 . 1 1 59 59 PHE CA C 59 61.598 61.598 59.220 2.378 25685 10141 1 14 . 1 1 59 59 PHE CB C 59 40.870 40.870 39.010 1.860 25685 10142 1 14 . 1 1 59 59 PHE H H 59 9.105 9.105 8.332 0.773 25685 10143 1 14 . 1 1 60 60 PHE N N 60 114.868 114.868 120.301 -5.433 25685 10144 1 14 . 1 1 60 60 PHE C C 60 177.989 177.989 176.858 1.131 25685 10145 1 14 . 1 1 60 60 PHE CA C 60 61.517 61.517 61.781 -0.264 25685 10146 1 14 . 1 1 60 60 PHE CB C 60 38.248 38.248 39.460 -1.212 25685 10147 1 14 . 1 1 60 60 PHE H H 60 8.796 8.796 8.328 0.468 25685 10148 1 14 . 1 1 61 61 ARG N N 61 118.812 118.812 118.991 -0.179 25685 10149 1 14 . 1 1 61 61 ARG C C 61 177.813 177.813 178.155 -0.342 25685 10150 1 14 . 1 1 61 61 ARG CA C 61 60.497 60.497 59.191 1.306 25685 10151 1 14 . 1 1 61 61 ARG CB C 61 28.915 28.915 29.542 -0.627 25685 10152 1 14 . 1 1 61 61 ARG H H 61 7.600 7.600 7.823 -0.223 25685 10153 1 14 . 1 1 62 62 VAL N N 62 119.157 119.157 119.275 -0.118 25685 10154 1 14 . 1 1 62 62 VAL C C 62 177.670 177.670 177.383 0.287 25685 10155 1 14 . 1 1 62 62 VAL CA C 62 66.749 66.749 65.023 1.726 25685 10156 1 14 . 1 1 62 62 VAL CB C 62 30.306 30.306 31.275 -0.969 25685 10157 1 14 . 1 1 62 62 VAL H H 62 7.679 7.679 7.201 0.478 25685 10158 1 14 . 1 1 63 63 VAL N N 63 117.999 117.999 119.581 -1.582 25685 10159 1 14 . 1 1 63 63 VAL C C 63 177.639 177.639 178.304 -0.665 25685 10160 1 14 . 1 1 63 63 VAL CA C 63 66.836 66.836 65.736 1.100 25685 10161 1 14 . 1 1 63 63 VAL CB C 63 30.496 30.496 30.702 -0.206 25685 10162 1 14 . 1 1 63 63 VAL H H 63 7.429 7.429 7.109 0.320 25685 10163 1 14 . 1 1 64 64 ALA N N 64 120.451 120.451 122.368 -1.917 25685 10164 1 14 . 1 1 64 64 ALA C C 64 179.134 179.134 179.576 -0.442 25685 10165 1 14 . 1 1 64 64 ALA CA C 64 55.618 55.618 54.712 0.906 25685 10166 1 14 . 1 1 64 64 ALA CB C 64 17.950 17.950 17.697 0.253 25685 10167 1 14 . 1 1 64 64 ALA H H 64 8.169 8.169 7.437 0.732 25685 10168 1 14 . 1 1 65 65 MET N N 65 116.532 116.532 118.310 -1.778 25685 10169 1 14 . 1 1 65 65 MET C C 65 177.961 177.961 178.334 -0.373 25685 10170 1 14 . 1 1 65 65 MET CA C 65 58.161 58.161 58.138 0.023 25685 10171 1 14 . 1 1 65 65 MET CB C 65 31.208 31.208 32.406 -1.198 25685 10172 1 14 . 1 1 65 65 MET H H 65 7.857 7.857 7.574 0.283 25685 10173 1 14 . 1 1 66 66 LEU C C 66 179.022 179.022 178.800 0.222 25685 10174 1 14 . 1 1 66 66 LEU CA C 66 58.412 58.412 58.183 0.229 25685 10175 1 14 . 1 1 67 67 PHE N N 67 116.877 116.877 119.895 -3.018 25685 10176 1 14 . 1 1 67 67 PHE C C 67 177.908 177.908 177.010 0.898 25685 10177 1 14 . 1 1 67 67 PHE CA C 67 62.402 62.402 60.068 2.334 25685 10178 1 14 . 1 1 67 67 PHE CB C 67 39.203 39.203 38.430 0.773 25685 10179 1 14 . 1 1 67 67 PHE H H 67 7.923 7.923 7.817 0.106 25685 10180 1 14 . 1 1 68 68 LEU N N 68 118.860 118.860 118.551 0.309 25685 10181 1 14 . 1 1 68 68 LEU C C 68 179.032 179.032 178.345 0.687 25685 10182 1 14 . 1 1 68 68 LEU CA C 68 58.397 58.397 57.029 1.368 25685 10183 1 14 . 1 1 68 68 LEU CB C 68 40.803 40.803 40.803 -0.000 25685 10184 1 14 . 1 1 68 68 LEU H H 68 8.167 8.167 7.405 0.762 25685 10185 1 14 . 1 1 71 71 PHE N N 71 120.700 120.700 119.602 1.098 25685 10186 1 14 . 1 1 71 71 PHE C C 71 177.670 177.670 176.852 0.818 25685 10187 1 14 . 1 1 71 71 PHE CA C 71 60.528 60.528 61.008 -0.480 25685 10188 1 14 . 1 1 71 71 PHE H H 71 7.847 7.847 7.415 0.432 25685 10189 1 14 . 1 1 72 72 ALA N N 72 120.506 120.506 122.114 -1.608 25685 10190 1 14 . 1 1 72 72 ALA C C 72 178.944 178.944 179.261 -0.317 25685 10191 1 14 . 1 1 72 72 ALA CA C 72 55.461 55.461 54.854 0.607 25685 10192 1 14 . 1 1 72 72 ALA CB C 72 17.829 17.829 18.261 -0.432 25685 10193 1 14 . 1 1 72 72 ALA H H 72 8.533 8.533 7.567 0.966 25685 10194 1 14 . 1 1 73 73 LEU N N 73 115.071 115.071 118.986 -3.915 25685 10195 1 14 . 1 1 73 73 LEU C C 73 180.831 180.831 178.499 2.332 25685 10196 1 14 . 1 1 73 73 LEU CA C 73 58.091 58.091 57.894 0.197 25685 10197 1 14 . 1 1 73 73 LEU CB C 73 41.082 41.082 42.057 -0.975 25685 10198 1 14 . 1 1 73 73 LEU H H 73 8.458 8.458 8.343 0.115 25685 10199 1 14 . 1 1 74 74 ILE N N 74 121.365 121.365 117.390 3.975 25685 10200 1 14 . 1 1 74 74 ILE C C 74 178.287 178.287 177.957 0.330 25685 10201 1 14 . 1 1 74 74 ILE CA C 74 65.335 65.335 64.574 0.761 25685 10202 1 14 . 1 1 74 74 ILE CB C 74 37.453 37.453 37.456 -0.003 25685 10203 1 14 . 1 1 74 74 ILE H H 74 8.220 8.220 7.397 0.823 25685 10204 1 14 . 1 1 75 75 LEU N N 75 119.200 119.200 121.151 -1.951 25685 10205 1 14 . 1 1 75 75 LEU C C 75 177.548 177.548 179.020 -1.472 25685 10206 1 14 . 1 1 75 75 LEU CA C 75 56.938 56.938 57.740 -0.802 25685 10207 1 14 . 1 1 75 75 LEU CB C 75 41.541 41.541 41.647 -0.105 25685 10208 1 14 . 1 1 75 75 LEU H H 75 7.866 7.866 7.481 0.385 25685 10209 1 14 . 1 1 76 76 LEU N N 76 116.338 116.338 118.484 -2.146 25685 10210 1 14 . 1 1 76 76 LEU C C 76 176.889 176.889 179.255 -2.366 25685 10211 1 14 . 1 1 76 76 LEU CA C 76 54.807 54.807 56.994 -2.187 25685 10212 1 14 . 1 1 76 76 LEU CB C 76 41.830 41.830 40.568 1.262 25685 10213 1 14 . 1 1 76 76 LEU H H 76 7.432 7.432 7.647 -0.215 25685 10214 1 14 . 1 1 77 77 SER N N 77 114.630 114.630 113.471 1.159 25685 10215 1 14 . 1 1 77 77 SER C C 77 174.752 174.752 174.308 0.444 25685 10216 1 14 . 1 1 77 77 SER CA C 77 58.967 58.967 60.823 -1.856 25685 10217 1 14 . 1 1 77 77 SER CB C 77 64.686 64.686 63.505 1.181 25685 10218 1 14 . 1 1 77 77 SER H H 77 7.423 7.423 7.861 -0.438 25685 10219 1 14 . 1 1 78 78 ASP N N 78 123.054 123.054 117.192 5.862 25685 10220 1 14 . 1 1 78 78 ASP C C 78 176.716 176.716 174.426 2.290 25685 10221 1 14 . 1 1 78 78 ASP CA C 78 54.848 54.848 53.238 1.610 25685 10222 1 14 . 1 1 78 78 ASP CB C 78 40.423 40.423 41.300 -0.877 25685 10223 1 14 . 1 1 78 78 ASP H H 78 8.294 8.294 7.593 0.701 25685 10224 1 14 . 1 1 79 79 GLU N N 79 119.104 119.104 117.929 1.175 25685 10225 1 14 . 1 1 79 79 GLU C C 79 176.391 176.391 175.006 1.385 25685 10226 1 14 . 1 1 79 79 GLU CA C 79 56.258 56.258 57.203 -0.945 25685 10227 1 14 . 1 1 79 79 GLU CB C 79 29.656 29.656 28.593 1.063 25685 10228 1 14 . 1 1 79 79 GLU H H 79 8.384 8.384 8.441 -0.057 25685 10229 1 14 . 1 1 80 80 LEU N N 80 121.254 121.254 122.369 -1.115 25685 10230 1 14 . 1 1 80 80 LEU C C 80 177.164 177.164 176.210 0.954 25685 10231 1 14 . 1 1 80 80 LEU CA C 80 54.670 54.670 54.586 0.084 25685 10232 1 14 . 1 1 80 80 LEU CB C 80 42.633 42.633 42.760 -0.127 25685 10233 1 14 . 1 1 80 80 LEU H H 80 7.637 7.637 8.290 -0.653 25685 10234 1 14 . 1 1 81 81 ASP N N 81 123.410 123.410 121.835 1.575 25685 10235 1 14 . 1 1 81 81 ASP C C 81 177.552 177.552 175.693 1.859 25685 10236 1 14 . 1 1 81 81 ASP CA C 81 55.110 55.110 53.029 2.082 25685 10237 1 14 . 1 1 81 81 ASP CB C 81 42.693 42.693 43.433 -0.740 25685 10238 1 14 . 1 1 81 81 ASP H H 81 8.403 8.403 8.197 0.206 25685 10239 1 14 . 1 1 82 82 GLU N N 82 125.047 125.047 121.238 3.809 25685 10240 1 14 . 1 1 82 82 GLU C C 82 178.198 178.198 178.530 -0.332 25685 10241 1 14 . 1 1 82 82 GLU CA C 82 59.221 59.221 59.217 0.004 25685 10242 1 14 . 1 1 82 82 GLU CB C 82 29.176 29.176 29.709 -0.533 25685 10243 1 14 . 1 1 82 82 GLU H H 82 8.744 8.744 8.659 0.085 25685 10244 1 14 . 1 1 83 83 LYS N N 83 118.476 118.476 119.502 -1.026 25685 10245 1 14 . 1 1 83 83 LYS C C 83 179.356 179.356 179.063 0.293 25685 10246 1 14 . 1 1 83 83 LYS CA C 83 59.170 59.170 59.193 -0.023 25685 10247 1 14 . 1 1 83 83 LYS CB C 83 31.509 31.509 31.355 0.154 25685 10248 1 14 . 1 1 83 83 LYS H H 83 8.607 8.607 8.479 0.128 25685 10249 1 14 . 1 1 84 84 VAL N N 84 118.407 118.407 119.550 -1.143 25685 10250 1 14 . 1 1 84 84 VAL C C 84 177.653 177.653 177.898 -0.245 25685 10251 1 14 . 1 1 84 84 VAL CA C 84 65.416 65.416 66.110 -0.694 25685 10252 1 14 . 1 1 84 84 VAL CB C 84 31.313 31.313 31.675 -0.362 25685 10253 1 14 . 1 1 84 84 VAL H H 84 7.870 7.870 7.715 0.155 25685 10254 1 14 . 1 1 85 85 SER N N 85 116.146 116.146 115.388 0.758 25685 10255 1 14 . 1 1 85 85 SER C C 85 177.496 177.496 177.006 0.490 25685 10256 1 14 . 1 1 85 85 SER CA C 85 61.764 61.764 62.038 -0.273 25685 10257 1 14 . 1 1 85 85 SER CB C 85 63.654 63.654 63.099 0.555 25685 10258 1 14 . 1 1 85 85 SER H H 85 8.083 8.083 8.585 -0.502 25685 10259 1 14 . 1 1 86 86 ILE N N 86 122.570 122.570 122.613 -0.043 25685 10260 1 14 . 1 1 86 86 ILE C C 86 178.698 178.698 177.929 0.769 25685 10261 1 14 . 1 1 86 86 ILE CA C 86 64.526 64.526 62.490 2.036 25685 10262 1 14 . 1 1 86 86 ILE CB C 86 37.393 37.393 36.431 0.963 25685 10263 1 14 . 1 1 86 86 ILE H H 86 8.102 8.102 7.469 0.633 25685 10264 1 14 . 1 1 87 87 PHE N N 87 121.340 121.340 122.047 -0.707 25685 10265 1 14 . 1 1 87 87 PHE C C 87 177.671 177.671 176.780 0.891 25685 10266 1 14 . 1 1 87 87 PHE CA C 87 61.098 61.098 61.701 -0.603 25685 10267 1 14 . 1 1 87 87 PHE CB C 87 39.151 39.151 38.663 0.487 25685 10268 1 14 . 1 1 87 87 PHE H H 87 7.719 7.719 8.721 -1.002 25685 10269 1 14 . 1 1 88 88 ALA N N 88 120.921 120.921 120.525 0.396 25685 10270 1 14 . 1 1 88 88 ALA C C 88 180.030 180.030 179.815 0.215 25685 10271 1 14 . 1 1 88 88 ALA CA C 88 55.147 55.147 55.055 0.092 25685 10272 1 14 . 1 1 88 88 ALA CB C 88 19.053 19.053 18.346 0.707 25685 10273 1 14 . 1 1 88 88 ALA H H 88 8.679 8.679 7.953 0.726 25685 10274 1 14 . 1 1 89 89 SER N N 89 114.285 114.285 114.979 -0.694 25685 10275 1 14 . 1 1 89 89 SER C C 89 177.040 177.040 176.705 0.335 25685 10276 1 14 . 1 1 89 89 SER CA C 89 61.314 61.314 61.715 -0.401 25685 10277 1 14 . 1 1 89 89 SER CB C 89 63.371 63.371 62.631 0.740 25685 10278 1 14 . 1 1 89 89 SER H H 89 8.242 8.242 7.702 0.540 25685 10279 1 14 . 1 1 90 90 ARG N N 90 121.829 121.829 121.007 0.822 25685 10280 1 14 . 1 1 90 90 ARG C C 90 179.247 179.247 178.012 1.235 25685 10281 1 14 . 1 1 90 90 ARG CA C 90 58.444 58.444 58.231 0.213 25685 10282 1 14 . 1 1 90 90 ARG CB C 90 29.532 29.532 28.684 0.848 25685 10283 1 14 . 1 1 90 90 ARG H H 90 7.907 7.907 8.013 -0.106 25685 10284 1 14 . 1 1 91 91 MET N N 91 117.124 117.124 117.907 -0.783 25685 10285 1 14 . 1 1 91 91 MET C C 91 177.504 177.504 177.803 -0.299 25685 10286 1 14 . 1 1 91 91 MET CA C 91 57.152 57.152 59.889 -2.737 25685 10287 1 14 . 1 1 91 91 MET CB C 91 32.510 32.510 32.218 0.292 25685 10288 1 14 . 1 1 91 91 MET H H 91 7.930 7.930 7.634 0.296 25685 10289 1 14 . 1 1 92 92 THR N N 92 108.478 108.478 112.908 -4.430 25685 10290 1 14 . 1 1 92 92 THR C C 92 176.367 176.367 175.961 0.406 25685 10291 1 14 . 1 1 92 92 THR CA C 92 63.564 63.564 64.956 -1.392 25685 10292 1 14 . 1 1 92 92 THR H H 92 7.847 7.847 7.733 0.114 25685 10293 1 14 . 1 1 93 93 SER N N 93 117.950 117.950 114.783 3.167 25685 10294 1 14 . 1 1 93 93 SER C C 93 176.552 176.552 175.839 0.713 25685 10295 1 14 . 1 1 93 93 SER CA C 93 60.821 60.821 60.890 -0.069 25685 10296 1 14 . 1 1 93 93 SER CB C 93 63.311 63.311 63.508 -0.197 25685 10297 1 14 . 1 1 93 93 SER H H 93 7.732 7.732 7.452 0.280 25685 10298 1 14 . 1 1 94 94 GLY N N 94 111.265 111.265 108.034 3.231 25685 10299 1 14 . 1 1 94 94 GLY C C 94 175.198 175.198 174.241 0.957 25685 10300 1 14 . 1 1 94 94 GLY CA C 94 46.021 46.021 45.103 0.918 25685 10301 1 14 . 1 1 94 94 GLY H H 94 8.419 8.419 7.424 0.995 25685 10302 1 14 . 1 1 95 95 LEU N N 95 121.019 121.019 119.270 1.749 25685 10303 1 14 . 1 1 95 95 LEU C C 95 177.810 177.810 177.548 0.262 25685 10304 1 14 . 1 1 95 95 LEU CA C 95 56.012 56.012 54.568 1.444 25685 10305 1 14 . 1 1 95 95 LEU CB C 95 42.122 42.122 41.473 0.649 25685 10306 1 14 . 1 1 95 95 LEU H H 95 7.849 7.849 7.362 0.487 25685 10307 1 14 . 1 1 96 96 SER N N 96 115.465 115.465 118.944 -3.479 25685 10308 1 14 . 1 1 96 96 SER C C 96 175.543 175.543 175.022 0.521 25685 10309 1 14 . 1 1 96 96 SER CA C 96 60.151 60.151 59.062 1.089 25685 10310 1 14 . 1 1 96 96 SER H H 96 8.349 8.349 8.219 0.130 25685 10311 1 14 . 1 1 97 97 TRP N N 97 121.711 121.711 123.585 -1.874 25685 10312 1 14 . 1 1 97 97 TRP C C 97 176.973 176.973 175.900 1.073 25685 10313 1 14 . 1 1 97 97 TRP CA C 97 58.250 58.250 57.406 0.844 25685 10314 1 14 . 1 1 97 97 TRP CB C 97 28.899 28.899 30.360 -1.461 25685 10315 1 14 . 1 1 97 97 TRP H H 97 7.723 7.723 8.197 -0.474 25685 10316 1 14 . 1 1 98 98 LYS N N 98 119.868 119.868 119.666 0.202 25685 10317 1 14 . 1 1 98 98 LYS C C 98 178.021 178.021 176.193 1.828 25685 10318 1 14 . 1 1 98 98 LYS CA C 98 56.340 56.340 55.093 1.247 25685 10319 1 14 . 1 1 98 98 LYS CB C 98 31.933 31.933 35.084 -3.151 25685 10320 1 14 . 1 1 98 98 LYS H H 98 7.855 7.855 7.607 0.248 25685 10321 1 14 . 1 1 99 99 ILE N N 99 120.044 120.044 117.548 2.496 25685 10322 1 14 . 1 1 99 99 ILE C C 99 176.769 176.769 176.849 -0.080 25685 10323 1 14 . 1 1 99 99 ILE CA C 99 62.758 62.758 63.705 -0.947 25685 10324 1 14 . 1 1 99 99 ILE CB C 99 37.809 37.809 37.390 0.419 25685 10325 1 14 . 1 1 99 99 ILE H H 99 8.069 8.069 8.494 -0.425 25685 10326 1 14 . 1 1 100 100 GLN C C 100 176.315 176.315 176.449 -0.134 25685 10327 1 14 . 1 1 100 100 GLN CA C 100 57.486 57.486 57.299 0.187 25685 10328 1 14 . 1 1 101 101 THR N N 101 109.873 109.873 112.441 -2.568 25685 10329 1 14 . 1 1 101 101 THR C C 101 174.664 174.664 173.385 1.279 25685 10330 1 14 . 1 1 101 101 THR CA C 101 61.709 61.709 63.177 -1.468 25685 10331 1 14 . 1 1 101 101 THR CB C 101 69.290 69.290 69.153 0.137 25685 10332 1 14 . 1 1 101 101 THR H H 101 7.508 7.508 8.512 -1.004 25685 10333 1 14 . 1 1 102 102 LEU N N 102 124.434 124.434 124.814 -0.380 25685 10334 1 14 . 1 1 102 102 LEU C C 102 174.681 174.681 175.308 -0.627 25685 10335 1 14 . 1 1 102 102 LEU CA C 102 53.063 53.063 51.976 1.087 25685 10336 1 14 . 1 1 102 102 LEU CB C 102 41.139 41.139 42.399 -1.260 25685 10337 1 14 . 1 1 102 102 LEU H H 102 7.569 7.569 8.359 -0.790 25685 10338 1 14 . 1 1 103 103 PRO C C 103 178.076 178.076 176.157 1.919 25685 10339 1 14 . 1 1 103 103 PRO CA C 103 62.570 62.570 63.612 -1.042 25685 10340 1 14 . 1 1 103 103 PRO CB C 103 31.534 31.534 31.914 -0.380 25685 10341 1 14 . 1 1 104 104 SER N N 104 119.929 119.929 111.007 8.922 25685 10342 1 14 . 1 1 104 104 SER C C 104 176.432 176.432 175.237 1.195 25685 10343 1 14 . 1 1 104 104 SER CA C 104 61.976 61.976 57.864 4.112 25685 10344 1 14 . 1 1 104 104 SER CB C 104 63.611 63.611 63.838 -0.227 25685 10345 1 14 . 1 1 104 104 SER H H 104 8.784 8.784 7.906 0.878 25685 10346 1 14 . 1 1 105 105 PHE N N 105 119.519 119.519 126.287 -6.768 25685 10347 1 14 . 1 1 105 105 PHE C C 105 176.852 176.852 174.437 2.415 25685 10348 1 14 . 1 1 105 105 PHE CA C 105 60.162 60.162 60.372 -0.210 25685 10349 1 14 . 1 1 105 105 PHE CB C 105 38.455 38.455 39.297 -0.842 25685 10350 1 14 . 1 1 105 105 PHE H H 105 8.620 8.620 8.697 -0.077 25685 10351 1 14 . 1 1 106 106 PHE N N 106 118.809 118.809 114.412 4.397 25685 10352 1 14 . 1 1 106 106 PHE C C 106 176.741 176.741 174.294 2.447 25685 10353 1 14 . 1 1 106 106 PHE CA C 106 61.421 61.421 57.353 4.068 25685 10354 1 14 . 1 1 106 106 PHE CB C 106 38.788 38.788 38.571 0.217 25685 10355 1 14 . 1 1 106 106 PHE H H 106 7.519 7.519 7.718 -0.199 25685 10356 1 14 . 1 1 107 107 PHE N N 107 117.382 117.382 123.554 -6.172 25685 10357 1 14 . 1 1 107 107 PHE C C 107 177.771 177.771 176.916 0.855 25685 10358 1 14 . 1 1 107 107 PHE CA C 107 61.099 61.099 60.751 0.348 25685 10359 1 14 . 1 1 107 107 PHE CB C 107 38.677 38.677 40.280 -1.603 25685 10360 1 14 . 1 1 107 107 PHE H H 107 7.903 7.903 8.150 -0.247 25685 10361 1 14 . 1 1 108 108 GLY N N 108 105.340 105.340 106.576 -1.236 25685 10362 1 14 . 1 1 108 108 GLY C C 108 174.574 174.574 176.055 -1.481 25685 10363 1 14 . 1 1 108 108 GLY CA C 108 47.508 47.508 47.027 0.481 25685 10364 1 14 . 1 1 108 108 GLY H H 108 8.351 8.351 8.818 -0.467 25685 10365 1 14 . 1 1 109 109 MET N N 109 119.831 119.831 119.558 0.273 25685 10366 1 14 . 1 1 109 109 MET C C 109 177.522 177.522 176.685 0.837 25685 10367 1 14 . 1 1 109 109 MET CA C 109 58.658 58.658 58.252 0.406 25685 10368 1 14 . 1 1 109 109 MET CB C 109 32.106 32.106 32.491 -0.385 25685 10369 1 14 . 1 1 109 109 MET H H 109 7.919 7.919 7.919 -0.000 25685 10370 1 14 . 1 1 110 110 LEU N N 110 119.908 119.908 118.875 1.033 25685 10371 1 14 . 1 1 110 110 LEU C C 110 178.170 178.170 178.261 -0.091 25685 10372 1 14 . 1 1 110 110 LEU CA C 110 57.941 57.941 57.347 0.594 25685 10373 1 14 . 1 1 110 110 LEU CB C 110 41.055 41.055 41.072 -0.017 25685 10374 1 14 . 1 1 110 110 LEU H H 110 7.744 7.744 7.296 0.448 25685 10375 1 14 . 1 1 111 111 LEU N N 111 116.594 116.594 118.851 -2.257 25685 10376 1 14 . 1 1 111 111 LEU C C 111 178.960 178.960 178.364 0.596 25685 10377 1 14 . 1 1 111 111 LEU CA C 111 57.366 57.366 57.656 -0.290 25685 10378 1 14 . 1 1 111 111 LEU CB C 111 40.259 40.259 40.600 -0.341 25685 10379 1 14 . 1 1 111 111 LEU H H 111 7.732 7.732 7.174 0.558 25685 10380 1 14 . 1 1 112 112 ALA N N 112 121.020 121.020 120.270 0.750 25685 10381 1 14 . 1 1 112 112 ALA C C 112 178.700 178.700 179.617 -0.917 25685 10382 1 14 . 1 1 112 112 ALA CA C 112 55.432 55.432 54.749 0.683 25685 10383 1 14 . 1 1 112 112 ALA CB C 112 18.214 18.214 18.365 -0.151 25685 10384 1 14 . 1 1 112 112 ALA H H 112 8.121 8.121 7.133 0.988 25685 10385 1 14 . 1 1 113 113 PHE N N 113 118.369 118.369 116.078 2.291 25685 10386 1 14 . 1 1 113 113 PHE C C 113 176.091 176.091 177.562 -1.471 25685 10387 1 14 . 1 1 113 113 PHE CA C 113 61.388 61.388 58.237 3.151 25685 10388 1 14 . 1 1 113 113 PHE CB C 113 39.688 39.688 37.610 2.078 25685 10389 1 14 . 1 1 113 113 PHE H H 113 8.237 8.237 7.012 1.225 25685 10390 1 14 . 1 1 114 114 LEU N N 114 114.214 114.214 118.264 -4.050 25685 10391 1 14 . 1 1 114 114 LEU C C 114 177.038 177.038 177.928 -0.890 25685 10392 1 14 . 1 1 114 114 LEU CA C 114 56.358 56.358 57.795 -1.437 25685 10393 1 14 . 1 1 114 114 LEU CB C 114 42.716 42.716 41.334 1.382 25685 10394 1 14 . 1 1 114 114 LEU H H 114 7.576 7.576 7.298 0.278 25685 10395 1 14 . 1 1 115 115 TRP N N 115 112.667 112.667 117.420 -4.753 25685 10396 1 14 . 1 1 115 115 TRP C C 115 180.163 180.163 177.530 2.633 25685 10397 1 14 . 1 1 115 115 TRP CA C 115 55.930 55.930 58.644 -2.714 25685 10398 1 14 . 1 1 115 115 TRP H H 115 8.542 8.542 7.118 1.424 25685 10399 1 14 . 1 1 116 116 LEU N N 116 122.144 122.144 121.139 1.005 25685 10400 1 14 . 1 1 116 116 LEU C C 116 175.953 175.953 176.037 -0.084 25685 10401 1 14 . 1 1 116 116 LEU CA C 116 59.924 59.924 58.187 1.737 25685 10402 1 14 . 1 1 116 116 LEU CB C 116 39.097 39.097 40.008 -0.911 25685 10403 1 14 . 1 1 116 116 LEU H H 116 8.996 8.996 7.043 1.953 25685 10404 1 14 . 1 1 117 117 PRO C C 117 174.220 174.220 176.887 -2.667 25685 10405 1 14 . 1 1 117 117 PRO CA C 117 66.300 66.300 63.748 2.552 25685 10406 1 14 . 1 1 118 118 ALA N N 118 110.603 110.603 119.568 -8.965 25685 10407 1 14 . 1 1 118 118 ALA C C 118 177.162 177.162 178.633 -1.471 25685 10408 1 14 . 1 1 118 118 ALA CA C 118 52.670 52.670 53.446 -0.776 25685 10409 1 14 . 1 1 118 118 ALA CB C 118 18.853 18.853 19.403 -0.550 25685 10410 1 14 . 1 1 118 118 ALA H H 118 6.633 6.633 7.475 -0.842 25685 10411 1 14 . 1 1 119 119 ILE N N 119 113.492 113.492 114.269 -0.777 25685 10412 1 14 . 1 1 119 119 ILE CA C 119 63.703 63.703 64.218 -0.515 25685 10413 1 14 . 1 1 119 119 ILE CB C 119 39.605 39.605 36.818 2.787 25685 10414 1 14 . 1 1 119 119 ILE H H 119 7.693 7.693 8.437 -0.744 25685 10415 1 14 . 1 1 121 121 PRO C C 121 178.089 178.089 179.219 -1.130 25685 10416 1 14 . 1 1 121 121 PRO CA C 121 66.004 66.004 65.692 0.312 25685 10417 1 14 . 1 1 122 122 PHE N N 122 113.797 113.797 119.459 -5.662 25685 10418 1 14 . 1 1 122 122 PHE C C 122 177.713 177.713 177.109 0.604 25685 10419 1 14 . 1 1 122 122 PHE CA C 122 61.566 61.566 60.752 0.815 25685 10420 1 14 . 1 1 122 122 PHE CB C 122 38.983 38.983 38.650 0.333 25685 10421 1 14 . 1 1 122 122 PHE H H 122 6.846 6.846 8.051 -1.205 25685 10422 1 14 . 1 1 123 123 ALA N N 123 121.512 121.512 120.844 0.668 25685 10423 1 14 . 1 1 123 123 ALA C C 123 179.318 179.318 179.739 -0.421 25685 10424 1 14 . 1 1 123 123 ALA CA C 123 54.975 54.975 55.186 -0.211 25685 10425 1 14 . 1 1 123 123 ALA CB C 123 17.881 17.881 17.948 -0.067 25685 10426 1 14 . 1 1 123 123 ALA H H 123 8.411 8.411 8.190 0.221 25685 10427 1 14 . 1 1 124 124 GLY N N 124 104.093 104.093 107.118 -3.025 25685 10428 1 14 . 1 1 124 124 GLY C C 124 175.410 175.410 176.072 -0.662 25685 10429 1 14 . 1 1 124 124 GLY CA C 124 47.370 47.370 46.709 0.661 25685 10430 1 14 . 1 1 124 124 GLY H H 124 8.455 8.455 7.679 0.776 25685 10431 1 14 . 1 1 125 125 ILE N N 125 121.895 121.895 122.572 -0.677 25685 10432 1 14 . 1 1 125 125 ILE C C 125 178.329 178.329 177.151 1.178 25685 10433 1 14 . 1 1 125 125 ILE CA C 125 64.412 64.412 63.900 0.512 25685 10434 1 14 . 1 1 125 125 ILE H H 125 7.954 7.954 8.022 -0.068 25685 10435 1 14 . 1 1 126 126 ALA N N 126 122.768 122.768 122.218 0.550 25685 10436 1 14 . 1 1 126 126 ALA C C 126 180.341 180.341 179.517 0.824 25685 10437 1 14 . 1 1 126 126 ALA CA C 126 55.266 55.266 55.467 -0.201 25685 10438 1 14 . 1 1 126 126 ALA CB C 126 18.226 18.226 17.942 0.284 25685 10439 1 14 . 1 1 126 126 ALA H H 126 8.142 8.142 7.518 0.624 25685 10440 1 14 . 1 1 127 127 ILE N N 127 116.752 116.752 118.050 -1.298 25685 10441 1 14 . 1 1 127 127 ILE C C 127 177.993 177.993 178.132 -0.139 25685 10442 1 14 . 1 1 127 127 ILE CA C 127 63.877 63.877 64.489 -0.612 25685 10443 1 14 . 1 1 127 127 ILE CB C 127 37.657 37.657 37.586 0.071 25685 10444 1 14 . 1 1 127 127 ILE H H 127 8.335 8.335 7.435 0.900 25685 10445 1 14 . 1 1 128 128 SER N N 128 116.351 116.351 114.955 1.396 25685 10446 1 14 . 1 1 128 128 SER C C 128 175.796 175.796 176.509 -0.713 25685 10447 1 14 . 1 1 128 128 SER CA C 128 61.818 61.818 61.439 0.379 25685 10448 1 14 . 1 1 128 128 SER H H 128 7.939 7.939 7.576 0.363 25685 10449 1 14 . 1 1 129 129 GLN N N 129 118.082 118.082 120.696 -2.614 25685 10450 1 14 . 1 1 129 129 GLN C C 129 177.419 177.419 179.036 -1.617 25685 10451 1 14 . 1 1 129 129 GLN CA C 129 57.106 57.106 58.803 -1.697 25685 10452 1 14 . 1 1 129 129 GLN CB C 129 28.631 28.631 28.799 -0.168 25685 10453 1 14 . 1 1 129 129 GLN H H 129 7.943 7.943 7.683 0.260 25685 10454 1 14 . 1 1 130 130 THR N N 130 113.484 113.484 113.474 0.010 25685 10455 1 14 . 1 1 130 130 THR C C 130 175.627 175.627 176.103 -0.476 25685 10456 1 14 . 1 1 130 130 THR CA C 130 63.758 63.758 65.019 -1.261 25685 10457 1 14 . 1 1 130 130 THR CB C 130 69.182 69.182 68.870 0.312 25685 10458 1 14 . 1 1 130 130 THR H H 130 7.686 7.686 7.650 0.036 25685 10459 1 14 . 1 1 131 131 LEU N N 131 121.347 121.347 120.662 0.685 25685 10460 1 14 . 1 1 131 131 LEU C C 131 177.522 177.522 176.102 1.420 25685 10461 1 14 . 1 1 131 131 LEU CA C 131 56.307 56.307 56.794 -0.487 25685 10462 1 14 . 1 1 131 131 LEU CB C 131 41.711 41.711 42.610 -0.899 25685 10463 1 14 . 1 1 131 131 LEU H H 131 8.071 8.071 7.541 0.530 25685 10464 1 14 . 1 1 132 132 LEU N N 132 118.162 118.162 115.946 2.216 25685 10465 1 14 . 1 1 132 132 LEU C C 132 177.461 177.461 175.430 2.031 25685 10466 1 14 . 1 1 132 132 LEU CA C 132 55.264 55.264 52.923 2.341 25685 10467 1 14 . 1 1 132 132 LEU CB C 132 41.613 41.613 44.721 -3.108 25685 10468 1 14 . 1 1 132 132 LEU H H 132 7.810 7.810 7.290 0.520 25685 10469 1 14 . 1 1 133 133 SER N N 133 114.244 114.244 115.063 -0.819 25685 10470 1 14 . 1 1 133 133 SER C C 133 174.363 174.363 173.418 0.945 25685 10471 1 14 . 1 1 133 133 SER CA C 133 59.019 59.019 59.707 -0.688 25685 10472 1 14 . 1 1 133 133 SER CB C 133 64.634 64.634 63.718 0.916 25685 10473 1 14 . 1 1 133 133 SER H H 133 7.829 7.829 8.263 -0.434 25685 10474 1 14 . 1 1 134 134 GLU N N 134 120.151 120.151 117.142 3.009 25685 10475 1 14 . 1 1 134 134 GLU C C 134 175.935 175.935 174.627 1.308 25685 10476 1 14 . 1 1 134 134 GLU CA C 134 56.301 56.301 55.549 0.752 25685 10477 1 14 . 1 1 134 134 GLU CB C 134 30.129 30.129 31.172 -1.043 25685 10478 1 14 . 1 1 134 134 GLU H H 134 8.054 8.054 8.251 -0.197 25685 10479 1 14 . 1 1 135 135 ASN N N 135 118.890 118.890 117.397 1.493 25685 10480 1 14 . 1 1 135 135 ASN C C 135 174.272 174.272 173.623 0.649 25685 10481 1 14 . 1 1 135 135 ASN CA C 135 51.390 51.390 51.009 0.381 25685 10482 1 14 . 1 1 135 135 ASN CB C 135 39.129 39.129 40.121 -0.992 25685 10483 1 14 . 1 1 135 135 ASN H H 135 8.305 8.305 8.322 -0.017 25685 10484 1 14 . 1 1 136 136 PRO C C 136 177.960 177.960 177.717 0.243 25685 10485 1 14 . 1 1 136 136 PRO CA C 136 64.530 64.530 65.848 -1.318 25685 10486 1 14 . 1 1 136 136 PRO CB C 136 31.809 31.809 31.988 -0.180 25685 10487 1 14 . 1 1 137 137 LEU N N 137 117.735 117.735 116.308 1.427 25685 10488 1 14 . 1 1 137 137 LEU C C 137 179.217 179.217 179.029 0.188 25685 10489 1 14 . 1 1 137 137 LEU CA C 137 57.039 57.039 57.938 -0.899 25685 10490 1 14 . 1 1 137 137 LEU CB C 137 40.799 40.799 40.833 -0.034 25685 10491 1 14 . 1 1 137 137 LEU H H 137 8.248 8.248 8.032 0.216 25685 10492 1 14 . 1 1 138 138 VAL N N 138 119.589 119.589 117.653 1.936 25685 10493 1 14 . 1 1 138 138 VAL C C 138 177.894 177.894 177.380 0.514 25685 10494 1 14 . 1 1 138 138 VAL CA C 138 64.727 64.727 65.464 -0.737 25685 10495 1 14 . 1 1 138 138 VAL CB C 138 31.347 31.347 30.847 0.500 25685 10496 1 14 . 1 1 138 138 VAL H H 138 7.483 7.483 7.215 0.268 25685 10497 1 14 . 1 1 139 139 MET N N 139 119.431 119.431 119.572 -0.141 25685 10498 1 14 . 1 1 139 139 MET C C 139 177.988 177.988 178.586 -0.598 25685 10499 1 14 . 1 1 139 139 MET CA C 139 57.403 57.403 59.403 -2.000 25685 10500 1 14 . 1 1 139 139 MET CB C 139 31.709 31.709 32.444 -0.736 25685 10501 1 14 . 1 1 139 139 MET H H 139 7.837 7.837 8.005 -0.168 25685 10502 1 14 . 1 1 140 140 LEU N N 140 119.686 119.686 120.659 -0.973 25685 10503 1 14 . 1 1 140 140 LEU C C 140 177.916 177.916 178.753 -0.837 25685 10504 1 14 . 1 1 140 140 LEU CA C 140 56.877 56.877 58.240 -1.363 25685 10505 1 14 . 1 1 140 140 LEU CB C 140 41.491 41.491 41.473 0.018 25685 10506 1 14 . 1 1 140 140 LEU H H 140 7.926 7.926 8.451 -0.525 25685 10507 1 14 . 1 1 141 141 SER N N 141 114.167 114.167 115.125 -0.958 25685 10508 1 14 . 1 1 141 141 SER C C 141 176.030 176.030 177.269 -1.239 25685 10509 1 14 . 1 1 141 141 SER CA C 141 60.425 60.425 61.518 -1.093 25685 10510 1 14 . 1 1 141 141 SER CB C 141 63.956 63.956 63.036 0.920 25685 10511 1 14 . 1 1 141 141 SER H H 141 7.757 7.757 8.444 -0.687 25685 10512 1 14 . 1 1 142 142 TYR N N 142 121.679 121.679 120.662 1.017 25685 10513 1 14 . 1 1 142 142 TYR C C 142 177.659 177.659 178.426 -0.767 25685 10514 1 14 . 1 1 142 142 TYR CA C 142 59.673 59.673 58.696 0.977 25685 10515 1 14 . 1 1 142 142 TYR CB C 142 38.079 38.079 37.710 0.369 25685 10516 1 14 . 1 1 142 142 TYR H H 142 7.965 7.965 8.955 -0.990 25685 10517 1 14 . 1 1 143 143 GLY N N 143 107.396 107.396 108.122 -0.726 25685 10518 1 14 . 1 1 143 143 GLY C C 143 174.877 174.877 176.006 -1.129 25685 10519 1 14 . 1 1 143 143 GLY CA C 143 46.343 46.343 47.314 -0.971 25685 10520 1 14 . 1 1 143 143 GLY H H 143 8.177 8.177 8.904 -0.727 25685 10521 1 14 . 1 1 144 144 LEU N N 144 120.477 120.477 123.267 -2.790 25685 10522 1 14 . 1 1 144 144 LEU C C 144 178.504 178.504 178.452 0.052 25685 10523 1 14 . 1 1 144 144 LEU CA C 144 56.270 56.270 57.515 -1.245 25685 10524 1 14 . 1 1 144 144 LEU CB C 144 41.662 41.662 41.795 -0.133 25685 10525 1 14 . 1 1 144 144 LEU H H 144 8.055 8.055 7.571 0.484 25685 10526 1 14 . 1 1 145 145 GLY N N 145 106.847 106.847 106.446 0.401 25685 10527 1 14 . 1 1 145 145 GLY C C 145 175.375 175.375 176.152 -0.777 25685 10528 1 14 . 1 1 145 145 GLY CA C 145 45.582 45.582 47.040 -1.458 25685 10529 1 14 . 1 1 145 145 GLY H H 145 8.066 8.066 7.666 0.400 25685 10530 1 14 . 1 1 146 146 MET N N 146 120.376 120.376 121.949 -1.573 25685 10531 1 14 . 1 1 146 146 MET C C 146 176.663 176.663 178.206 -1.543 25685 10532 1 14 . 1 1 146 146 MET CA C 146 57.030 57.030 57.728 -0.698 25685 10533 1 14 . 1 1 146 146 MET CB C 146 30.720 30.720 32.296 -1.576 25685 10534 1 14 . 1 1 146 146 MET H H 146 8.157 8.157 8.634 -0.477 25685 10535 1 14 . 1 1 147 147 ALA N N 147 123.038 123.038 121.962 1.076 25685 10536 1 14 . 1 1 147 147 ALA C C 147 178.917 178.917 179.693 -0.776 25685 10537 1 14 . 1 1 147 147 ALA CA C 147 54.201 54.201 55.093 -0.892 25685 10538 1 14 . 1 1 147 147 ALA CB C 147 18.810 18.810 18.009 0.801 25685 10539 1 14 . 1 1 147 147 ALA H H 147 8.336 8.336 8.672 -0.336 25685 10540 1 14 . 1 1 148 148 VAL N N 148 117.795 117.795 117.825 -0.030 25685 10541 1 14 . 1 1 148 148 VAL C C 148 176.891 176.891 177.577 -0.686 25685 10542 1 14 . 1 1 148 148 VAL CA C 148 64.157 64.157 65.693 -1.536 25685 10543 1 14 . 1 1 148 148 VAL CB C 148 31.529 31.529 31.726 -0.197 25685 10544 1 14 . 1 1 148 148 VAL H H 148 7.908 7.908 7.431 0.477 25685 10545 1 14 . 1 1 149 149 THR N N 149 116.069 116.069 115.628 0.441 25685 10546 1 14 . 1 1 149 149 THR C C 149 176.054 176.054 176.391 -0.337 25685 10547 1 14 . 1 1 149 149 THR CA C 149 63.308 63.308 66.558 -3.250 25685 10548 1 14 . 1 1 149 149 THR H H 149 7.414 7.414 7.432 -0.018 25685 10549 1 14 . 1 1 150 150 ILE N N 150 121.971 121.971 121.419 0.552 25685 10550 1 14 . 1 1 150 150 ILE C C 150 177.715 177.715 176.728 0.987 25685 10551 1 14 . 1 1 150 150 ILE CA C 150 64.319 64.319 63.970 0.349 25685 10552 1 14 . 1 1 150 150 ILE CB C 150 36.628 36.628 37.890 -1.262 25685 10553 1 14 . 1 1 150 150 ILE H H 150 8.772 8.772 8.272 0.500 25685 10554 1 14 . 1 1 151 151 ALA N N 151 122.272 122.272 121.374 0.898 25685 10555 1 14 . 1 1 151 151 ALA C C 151 180.370 180.370 179.377 0.993 25685 10556 1 14 . 1 1 151 151 ALA CA C 151 55.336 55.336 55.359 -0.023 25685 10557 1 14 . 1 1 151 151 ALA CB C 151 18.107 18.107 17.753 0.354 25685 10558 1 14 . 1 1 151 151 ALA H H 151 8.163 8.163 7.651 0.512 25685 10559 1 14 . 1 1 152 152 ALA N N 152 120.648 120.648 121.279 -0.631 25685 10560 1 14 . 1 1 152 152 ALA C C 152 181.019 181.019 180.081 0.938 25685 10561 1 14 . 1 1 152 152 ALA CA C 152 54.944 54.944 54.691 0.253 25685 10562 1 14 . 1 1 152 152 ALA CB C 152 18.963 18.963 18.224 0.739 25685 10563 1 14 . 1 1 152 152 ALA H H 152 7.877 7.877 7.663 0.214 25685 10564 1 14 . 1 1 153 153 VAL N N 153 119.372 119.372 119.021 0.351 25685 10565 1 14 . 1 1 153 153 VAL C C 153 178.197 178.197 177.790 0.407 25685 10566 1 14 . 1 1 153 153 VAL CA C 153 66.289 66.289 65.425 0.864 25685 10567 1 14 . 1 1 153 153 VAL CB C 153 30.770 30.770 31.929 -1.159 25685 10568 1 14 . 1 1 153 153 VAL H H 153 8.118 8.118 7.680 0.438 25685 10569 1 14 . 1 1 154 154 PHE N N 154 120.362 120.362 119.973 0.389 25685 10570 1 14 . 1 1 154 154 PHE C C 154 177.733 177.733 177.426 0.307 25685 10571 1 14 . 1 1 154 154 PHE CA C 154 61.412 61.412 61.470 -0.058 25685 10572 1 14 . 1 1 154 154 PHE CB C 154 38.465 38.465 38.726 -0.261 25685 10573 1 14 . 1 1 154 154 PHE H H 154 8.508 8.508 8.336 0.172 25685 10574 1 14 . 1 1 155 155 LYS N N 155 118.894 118.894 120.152 -1.258 25685 10575 1 14 . 1 1 155 155 LYS C C 155 179.940 179.940 178.262 1.678 25685 10576 1 14 . 1 1 155 155 LYS CA C 155 58.969 58.969 59.151 -0.182 25685 10577 1 14 . 1 1 155 155 LYS CB C 155 31.725 31.725 32.084 -0.359 25685 10578 1 14 . 1 1 155 155 LYS H H 155 8.035 8.035 7.710 0.325 25685 10579 1 14 . 1 1 156 156 MET N N 156 118.853 118.853 116.274 2.579 25685 10580 1 14 . 1 1 156 156 MET C C 156 179.245 179.245 177.718 1.527 25685 10581 1 14 . 1 1 156 156 MET CA C 156 58.518 58.518 57.852 0.666 25685 10582 1 14 . 1 1 156 156 MET CB C 156 31.912 31.912 30.773 1.139 25685 10583 1 14 . 1 1 156 156 MET H H 156 8.014 8.014 7.523 0.491 25685 10584 1 14 . 1 1 157 157 GLY N N 157 108.239 108.239 106.100 2.139 25685 10585 1 14 . 1 1 157 157 GLY C C 157 174.637 174.637 175.341 -0.704 25685 10586 1 14 . 1 1 157 157 GLY CA C 157 47.204 47.204 46.498 0.706 25685 10587 1 14 . 1 1 157 157 GLY H H 157 8.614 8.614 7.611 1.003 25685 10588 1 14 . 1 1 158 158 GLU N N 158 122.902 122.902 117.793 5.109 25685 10589 1 14 . 1 1 158 158 GLU C C 158 177.851 177.851 175.466 2.385 25685 10590 1 14 . 1 1 158 158 GLU CA C 158 60.203 60.203 56.474 3.729 25685 10591 1 14 . 1 1 158 158 GLU CB C 158 28.870 28.870 33.347 -4.477 25685 10592 1 14 . 1 1 158 158 GLU H H 158 8.550 8.550 7.748 0.802 25685 10593 1 14 . 1 1 159 159 LYS N N 159 117.932 117.932 119.379 -1.447 25685 10594 1 14 . 1 1 159 159 LYS C C 159 179.529 179.529 174.615 4.914 25685 10595 1 14 . 1 1 159 159 LYS CA C 159 59.419 59.419 55.944 3.475 25685 10596 1 14 . 1 1 159 159 LYS CB C 159 31.759 31.759 33.896 -2.137 25685 10597 1 14 . 1 1 159 159 LYS H H 159 7.641 7.641 8.018 -0.377 25685 10598 1 14 . 1 1 160 160 PHE N N 160 120.614 120.614 124.361 -3.747 25685 10599 1 14 . 1 1 160 160 PHE C C 160 178.511 178.511 175.738 2.773 25685 10600 1 14 . 1 1 160 160 PHE CA C 160 61.580 61.580 58.468 3.112 25685 10601 1 14 . 1 1 160 160 PHE CB C 160 39.909 39.909 40.208 -0.299 25685 10602 1 14 . 1 1 160 160 PHE H H 160 8.026 8.026 8.602 -0.576 25685 10603 1 14 . 1 1 161 161 VAL N N 161 119.870 119.870 117.765 2.105 25685 10604 1 14 . 1 1 161 161 VAL C C 161 177.347 177.347 176.217 1.130 25685 10605 1 14 . 1 1 161 161 VAL CA C 161 66.121 66.121 61.455 4.666 25685 10606 1 14 . 1 1 161 161 VAL CB C 161 30.935 30.935 33.244 -2.309 25685 10607 1 14 . 1 1 161 161 VAL H H 161 8.628 8.628 8.457 0.171 25685 10608 1 14 . 1 1 162 162 LYS N N 162 116.237 116.237 127.548 -11.311 25685 10609 1 14 . 1 1 162 162 LYS C C 162 179.197 179.197 176.053 3.144 25685 10610 1 14 . 1 1 162 162 LYS CA C 162 60.037 60.037 58.202 1.835 25685 10611 1 14 . 1 1 162 162 LYS CB C 162 31.333 31.333 32.653 -1.320 25685 10612 1 14 . 1 1 162 162 LYS H H 162 7.843 7.843 8.769 -0.926 25685 10613 1 14 . 1 1 163 163 ALA N N 163 119.197 119.197 118.403 0.794 25685 10614 1 14 . 1 1 163 163 ALA C C 163 178.635 178.635 174.976 3.659 25685 10615 1 14 . 1 1 163 163 ALA CA C 163 53.681 53.681 51.645 2.036 25685 10616 1 14 . 1 1 163 163 ALA CB C 163 19.586 19.586 18.468 1.118 25685 10617 1 14 . 1 1 163 163 ALA H H 163 7.630 7.630 7.670 -0.040 25685 10618 1 14 . 1 1 164 164 ASN N N 164 115.956 115.956 119.591 -3.635 25685 10619 1 14 . 1 1 164 164 ASN C C 164 175.556 175.556 175.706 -0.150 25685 10620 1 14 . 1 1 164 164 ASN CA C 164 52.267 52.267 52.992 -0.725 25685 10621 1 14 . 1 1 164 164 ASN CB C 164 39.148 39.148 38.313 0.835 25685 10622 1 14 . 1 1 164 164 ASN H H 164 7.326 7.326 8.440 -1.114 25685 10623 1 14 . 1 1 165 165 PHE N N 165 121.612 121.612 126.603 -4.991 25685 10624 1 14 . 1 1 165 165 PHE C C 165 177.069 177.069 176.273 0.796 25685 10625 1 14 . 1 1 165 165 PHE CA C 165 62.921 62.921 61.567 1.354 25685 10626 1 14 . 1 1 165 165 PHE CB C 165 39.427 39.427 39.132 0.295 25685 10627 1 14 . 1 1 165 165 PHE H H 165 7.408 7.408 8.348 -0.940 25685 10628 1 14 . 1 1 166 166 GLN N N 166 117.147 117.147 117.034 0.113 25685 10629 1 14 . 1 1 166 166 GLN C C 166 178.922 178.922 177.851 1.071 25685 10630 1 14 . 1 1 166 166 GLN CA C 166 59.262 59.262 58.278 0.984 25685 10631 1 14 . 1 1 166 166 GLN CB C 166 26.811 26.811 27.479 -0.668 25685 10632 1 14 . 1 1 166 166 GLN H H 166 8.605 8.605 8.622 -0.017 25685 10633 1 14 . 1 1 167 167 LEU N N 167 121.946 121.946 120.689 1.257 25685 10634 1 14 . 1 1 167 167 LEU C C 167 178.863 178.863 178.201 0.662 25685 10635 1 14 . 1 1 167 167 LEU CA C 167 58.039 58.039 57.312 0.727 25685 10636 1 14 . 1 1 167 167 LEU CB C 167 41.130 41.130 41.342 -0.212 25685 10637 1 14 . 1 1 167 167 LEU H H 167 7.892 7.892 7.544 0.348 25685 10638 1 14 . 1 1 168 168 ILE N N 168 118.751 118.751 115.210 3.541 25685 10639 1 14 . 1 1 168 168 ILE C C 168 179.908 179.908 177.858 2.050 25685 10640 1 14 . 1 1 168 168 ILE CA C 168 63.886 63.886 63.738 0.148 25685 10641 1 14 . 1 1 168 168 ILE CB C 168 36.170 36.170 37.390 -1.220 25685 10642 1 14 . 1 1 168 168 ILE H H 168 8.065 8.065 7.425 0.640 25685 10643 1 14 . 1 1 169 169 ARG N N 169 125.851 125.851 120.286 5.565 25685 10644 1 14 . 1 1 169 169 ARG C C 169 177.579 177.579 177.899 -0.320 25685 10645 1 14 . 1 1 169 169 ARG CA C 169 60.306 60.306 59.111 1.194 25685 10646 1 14 . 1 1 169 169 ARG CB C 169 29.224 29.224 29.327 -0.103 25685 10647 1 14 . 1 1 169 169 ARG H H 169 8.995 8.995 7.623 1.372 25685 10648 1 14 . 1 1 170 170 LYS N N 170 119.586 119.586 118.280 1.306 25685 10649 1 14 . 1 1 170 170 LYS C C 170 178.584 178.584 178.887 -0.303 25685 10650 1 14 . 1 1 170 170 LYS CA C 170 60.293 60.293 59.023 1.270 25685 10651 1 14 . 1 1 170 170 LYS CB C 170 32.530 32.530 32.094 0.436 25685 10652 1 14 . 1 1 170 170 LYS H H 170 7.663 7.663 7.603 0.060 25685 10653 1 14 . 1 1 171 171 VAL N N 171 118.348 118.348 114.970 3.378 25685 10654 1 14 . 1 1 171 171 VAL C C 171 177.478 177.478 177.615 -0.137 25685 10655 1 14 . 1 1 171 171 VAL CA C 171 66.641 66.641 65.746 0.895 25685 10656 1 14 . 1 1 171 171 VAL CB C 171 31.565 31.565 31.464 0.101 25685 10657 1 14 . 1 1 171 171 VAL H H 171 8.515 8.515 7.594 0.921 25685 10658 1 14 . 1 1 172 172 THR N N 172 115.172 115.172 115.373 -0.201 25685 10659 1 14 . 1 1 172 172 THR C C 172 176.320 176.320 176.282 0.038 25685 10660 1 14 . 1 1 172 172 THR H H 172 8.416 8.416 7.744 0.672 25685 10661 1 14 . 1 1 173 173 GLY N N 173 108.801 108.801 107.633 1.168 25685 10662 1 14 . 1 1 173 173 GLY C C 173 174.138 174.138 175.121 -0.983 25685 10663 1 14 . 1 1 173 173 GLY CA C 173 47.769 47.769 47.051 0.718 25685 10664 1 14 . 1 1 173 173 GLY H H 173 8.505 8.505 7.845 0.660 25685 10665 1 14 . 1 1 174 174 ALA N N 174 123.573 123.573 124.189 -0.616 25685 10666 1 14 . 1 1 174 174 ALA C C 174 178.782 178.782 179.116 -0.334 25685 10667 1 14 . 1 1 174 174 ALA CA C 174 55.604 55.604 54.750 0.854 25685 10668 1 14 . 1 1 174 174 ALA CB C 174 18.778 18.778 18.537 0.241 25685 10669 1 14 . 1 1 174 174 ALA H H 174 8.038 8.038 7.375 0.663 25685 10670 1 14 . 1 1 175 175 ILE N N 175 118.501 118.501 118.656 -0.155 25685 10671 1 14 . 1 1 175 175 ILE C C 175 178.247 178.247 178.104 0.143 25685 10672 1 14 . 1 1 175 175 ILE CA C 175 65.412 65.412 63.340 2.072 25685 10673 1 14 . 1 1 175 175 ILE CB C 175 37.671 37.671 36.449 1.222 25685 10674 1 14 . 1 1 175 175 ILE H H 175 7.897 7.897 7.539 0.358 25685 10675 1 14 . 1 1 176 176 VAL N N 176 120.104 120.104 120.497 -0.393 25685 10676 1 14 . 1 1 176 176 VAL C C 176 177.945 177.945 177.950 -0.005 25685 10677 1 14 . 1 1 176 176 VAL CA C 176 67.761 67.761 66.061 1.700 25685 10678 1 14 . 1 1 176 176 VAL CB C 176 30.662 30.662 31.447 -0.785 25685 10679 1 14 . 1 1 176 176 VAL H H 176 8.321 8.321 7.766 0.555 25685 10680 1 14 . 1 1 177 177 LEU N N 177 118.561 118.561 121.107 -2.546 25685 10681 1 14 . 1 1 177 177 LEU C C 177 178.563 178.563 178.566 -0.003 25685 10682 1 14 . 1 1 177 177 LEU CA C 177 58.094 58.094 57.592 0.502 25685 10683 1 14 . 1 1 177 177 LEU CB C 177 41.061 41.061 40.729 0.332 25685 10684 1 14 . 1 1 177 177 LEU H H 177 8.097 8.097 7.410 0.687 25685 10685 1 14 . 1 1 178 178 LEU N N 178 120.868 120.868 118.970 1.898 25685 10686 1 14 . 1 1 178 178 LEU C C 178 178.524 178.524 178.387 0.137 25685 10687 1 14 . 1 1 178 178 LEU CA C 178 57.767 57.767 58.053 -0.286 25685 10688 1 14 . 1 1 178 178 LEU CB C 178 40.886 40.886 41.225 -0.339 25685 10689 1 14 . 1 1 178 178 LEU H H 178 8.229 8.229 7.460 0.769 25685 10690 1 14 . 1 1 179 179 TYR N N 179 119.355 119.355 118.509 0.846 25685 10691 1 14 . 1 1 179 179 TYR C C 179 180.059 180.059 177.326 2.733 25685 10692 1 14 . 1 1 179 179 TYR CA C 179 63.844 63.844 60.220 3.624 25685 10693 1 14 . 1 1 179 179 TYR CB C 179 39.508 39.508 37.869 1.639 25685 10694 1 14 . 1 1 179 179 TYR H H 179 8.759 8.759 7.712 1.047 25685 10695 1 14 . 1 1 180 180 LEU N N 180 118.984 118.984 119.255 -0.271 25685 10696 1 14 . 1 1 180 180 LEU C C 180 179.079 179.079 179.201 -0.122 25685 10697 1 14 . 1 1 180 180 LEU CA C 180 58.879 58.879 57.456 1.423 25685 10698 1 14 . 1 1 180 180 LEU CB C 180 41.899 41.899 40.617 1.282 25685 10699 1 14 . 1 1 180 180 LEU H H 180 8.315 8.315 7.386 0.929 25685 10700 1 14 . 1 1 181 181 ALA N N 181 121.826 121.826 121.673 0.153 25685 10701 1 14 . 1 1 181 181 ALA C C 181 180.009 180.009 179.706 0.303 25685 10702 1 14 . 1 1 181 181 ALA CA C 181 55.700 55.700 54.892 0.808 25685 10703 1 14 . 1 1 181 181 ALA CB C 181 17.713 17.713 18.651 -0.938 25685 10704 1 14 . 1 1 181 181 ALA H H 181 8.480 8.480 8.005 0.475 25685 10705 1 14 . 1 1 182 182 TYR N N 182 118.039 118.039 118.415 -0.376 25685 10706 1 14 . 1 1 182 182 TYR CA C 182 59.038 59.038 61.817 -2.779 25685 10707 1 14 . 1 1 182 182 TYR H H 182 8.856 8.856 7.721 1.135 25685 10708 1 14 . 1 1 183 183 PHE N N 183 124.769 124.769 117.816 6.953 25685 10709 1 14 . 1 1 183 183 PHE CA C 183 63.566 63.566 59.325 4.241 25685 10710 1 14 . 1 1 183 183 PHE H H 183 9.764 9.764 7.588 2.176 25685 10711 1 15 . 1 1 4 4 ALA N N 4 121.533 121.533 122.512 -0.979 25685 10712 1 15 . 1 1 4 4 ALA C C 4 177.632 177.632 179.157 -1.525 25685 10713 1 15 . 1 1 4 4 ALA CA C 4 55.117 55.117 55.075 0.042 25685 10714 1 15 . 1 1 4 4 ALA CB C 4 18.448 18.448 18.419 0.029 25685 10715 1 15 . 1 1 4 4 ALA H H 4 7.977 7.977 8.591 -0.614 25685 10716 1 15 . 1 1 5 5 PHE N N 5 119.988 119.988 119.481 0.507 25685 10717 1 15 . 1 1 5 5 PHE CA C 5 60.759 60.759 60.279 0.480 25685 10718 1 15 . 1 1 5 5 PHE CB C 5 39.221 39.221 38.532 0.688 25685 10719 1 15 . 1 1 5 5 PHE H H 5 8.210 8.210 8.215 -0.005 25685 10720 1 15 . 1 1 6 6 ALA C C 6 179.794 179.794 179.602 0.192 25685 10721 1 15 . 1 1 6 6 ALA CA C 6 55.619 55.619 55.038 0.580 25685 10722 1 15 . 1 1 6 6 ALA CB C 6 17.911 17.911 17.853 0.058 25685 10723 1 15 . 1 1 6 6 ALA H H 6 8.417 8.417 7.626 0.791 25685 10724 1 15 . 1 1 7 7 LEU N N 7 115.852 115.852 119.097 -3.245 25685 10725 1 15 . 1 1 7 7 LEU C C 7 180.196 180.196 179.551 0.645 25685 10726 1 15 . 1 1 7 7 LEU CA C 7 57.528 57.528 57.174 0.354 25685 10727 1 15 . 1 1 7 7 LEU CB C 7 40.060 40.060 40.941 -0.881 25685 10728 1 15 . 1 1 7 7 LEU H H 7 8.741 8.741 7.372 1.369 25685 10729 1 15 . 1 1 8 8 GLY N N 8 110.199 110.199 107.249 2.950 25685 10730 1 15 . 1 1 8 8 GLY C C 8 176.430 176.430 176.368 0.062 25685 10731 1 15 . 1 1 8 8 GLY CA C 8 46.960 46.960 47.485 -0.525 25685 10732 1 15 . 1 1 8 8 GLY H H 8 8.179 8.179 7.758 0.421 25685 10733 1 15 . 1 1 9 9 ILE N N 9 122.346 122.346 119.466 2.880 25685 10734 1 15 . 1 1 9 9 ILE C C 9 178.143 178.143 177.500 0.643 25685 10735 1 15 . 1 1 9 9 ILE CA C 9 65.048 65.048 64.312 0.736 25685 10736 1 15 . 1 1 9 9 ILE CB C 9 36.841 36.841 37.362 -0.521 25685 10737 1 15 . 1 1 9 9 ILE H H 9 7.788 7.788 7.277 0.511 25685 10738 1 15 . 1 1 10 10 LEU N N 10 117.560 117.560 120.400 -2.840 25685 10739 1 15 . 1 1 10 10 LEU C C 10 179.501 179.501 179.016 0.485 25685 10740 1 15 . 1 1 10 10 LEU CA C 10 58.068 58.068 58.023 0.045 25685 10741 1 15 . 1 1 10 10 LEU CB C 10 40.776 40.776 41.184 -0.408 25685 10742 1 15 . 1 1 10 10 LEU H H 10 8.044 8.044 7.518 0.526 25685 10743 1 15 . 1 1 11 11 SER N N 11 113.830 113.830 114.482 -0.652 25685 10744 1 15 . 1 1 11 11 SER CA C 11 61.769 61.769 60.974 0.795 25685 10745 1 15 . 1 1 11 11 SER CB C 11 63.395 63.395 63.455 -0.060 25685 10746 1 15 . 1 1 11 11 SER H H 11 8.140 8.140 7.433 0.707 25685 10747 1 15 . 1 1 12 12 VAL N N 12 121.343 121.343 121.084 0.259 25685 10748 1 15 . 1 1 12 12 VAL C C 12 176.753 176.753 177.355 -0.602 25685 10749 1 15 . 1 1 12 12 VAL CA C 12 64.583 64.583 65.445 -0.862 25685 10750 1 15 . 1 1 12 12 VAL CB C 12 31.067 31.067 31.614 -0.547 25685 10751 1 15 . 1 1 12 12 VAL H H 12 7.587 7.587 7.271 0.316 25685 10752 1 15 . 1 1 13 13 PHE N N 13 115.225 115.225 119.723 -4.498 25685 10753 1 15 . 1 1 13 13 PHE C C 13 177.349 177.349 175.514 1.835 25685 10754 1 15 . 1 1 13 13 PHE CA C 13 58.730 58.730 60.954 -2.224 25685 10755 1 15 . 1 1 13 13 PHE CB C 13 39.785 39.785 39.305 0.480 25685 10756 1 15 . 1 1 13 13 PHE H H 13 7.474 7.474 7.495 -0.021 25685 10757 1 15 . 1 1 14 14 SER N N 14 116.075 116.075 115.739 0.336 25685 10758 1 15 . 1 1 14 14 SER H H 14 7.955 7.955 7.970 -0.015 25685 10759 1 15 . 1 1 15 15 PRO C C 15 177.590 177.590 175.685 1.905 25685 10760 1 15 . 1 1 15 15 PRO CA C 15 65.464 65.464 62.124 3.340 25685 10761 1 15 . 1 1 16 16 ALA N N 16 116.288 116.288 120.903 -4.615 25685 10762 1 15 . 1 1 16 16 ALA C C 16 177.563 177.563 176.756 0.807 25685 10763 1 15 . 1 1 16 16 ALA CA C 16 53.010 53.010 51.048 1.962 25685 10764 1 15 . 1 1 16 16 ALA CB C 16 19.975 19.975 21.149 -1.175 25685 10765 1 15 . 1 1 16 16 ALA H H 16 7.455 7.455 8.012 -0.557 25685 10766 1 15 . 1 1 17 17 VAL N N 17 112.072 112.072 118.890 -6.818 25685 10767 1 15 . 1 1 17 17 VAL CA C 17 63.117 63.117 62.999 0.118 25685 10768 1 15 . 1 1 17 17 VAL CB C 17 33.209 33.209 32.294 0.915 25685 10769 1 15 . 1 1 17 17 VAL H H 17 7.525 7.525 8.557 -1.032 25685 10770 1 15 . 1 1 18 18 LEU N N 18 121.205 121.205 124.105 -2.900 25685 10771 1 15 . 1 1 18 18 LEU CA C 18 58.971 58.971 58.582 0.389 25685 10772 1 15 . 1 1 18 18 LEU CB C 18 41.161 41.161 39.748 1.413 25685 10773 1 15 . 1 1 18 18 LEU H H 18 8.191 8.191 8.415 -0.224 25685 10774 1 15 . 1 1 19 19 PRO C C 19 177.697 177.697 177.031 0.666 25685 10775 1 15 . 1 1 19 19 PRO CA C 19 65.181 65.181 65.721 -0.540 25685 10776 1 15 . 1 1 20 20 VAL N N 20 111.723 111.723 110.312 1.411 25685 10777 1 15 . 1 1 20 20 VAL C C 20 177.137 177.137 176.862 0.275 25685 10778 1 15 . 1 1 20 20 VAL CA C 20 62.494 62.494 62.694 -0.200 25685 10779 1 15 . 1 1 20 20 VAL CB C 20 31.677 31.677 30.880 0.797 25685 10780 1 15 . 1 1 20 20 VAL H H 20 7.571 7.571 7.483 0.088 25685 10781 1 15 . 1 1 21 21 VAL N N 21 121.705 121.705 122.598 -0.893 25685 10782 1 15 . 1 1 21 21 VAL CA C 21 68.305 68.305 67.792 0.513 25685 10783 1 15 . 1 1 21 21 VAL H H 21 7.732 7.732 8.503 -0.771 25685 10784 1 15 . 1 1 24 24 ILE C C 24 174.359 174.359 175.879 -1.520 25685 10785 1 15 . 1 1 25 25 PHE N N 25 120.132 120.132 116.671 3.461 25685 10786 1 15 . 1 1 25 25 PHE C C 25 175.945 175.945 174.560 1.385 25685 10787 1 15 . 1 1 25 25 PHE CA C 25 60.544 60.544 58.836 1.708 25685 10788 1 15 . 1 1 25 25 PHE H H 25 8.082 8.082 7.954 0.128 25685 10789 1 15 . 1 1 26 26 ALA N N 26 121.341 121.341 119.797 1.544 25685 10790 1 15 . 1 1 26 26 ALA CB C 26 19.784 19.784 21.168 -1.384 25685 10791 1 15 . 1 1 26 26 ALA H H 26 7.539 7.539 7.626 -0.087 25685 10792 1 15 . 1 1 27 27 GLY N N 27 107.530 107.530 107.350 0.180 25685 10793 1 15 . 1 1 27 27 GLY C C 27 174.252 174.252 173.409 0.843 25685 10794 1 15 . 1 1 27 27 GLY CA C 27 45.474 45.474 44.738 0.736 25685 10795 1 15 . 1 1 27 27 GLY H H 27 7.997 7.997 8.520 -0.523 25685 10796 1 15 . 1 1 28 28 SER N N 28 116.299 116.299 116.710 -0.411 25685 10797 1 15 . 1 1 28 28 SER C C 28 175.759 175.759 173.336 2.423 25685 10798 1 15 . 1 1 28 28 SER CA C 28 58.526 58.526 58.054 0.472 25685 10799 1 15 . 1 1 28 28 SER CB C 28 64.373 64.373 64.488 -0.115 25685 10800 1 15 . 1 1 28 28 SER H H 28 8.115 8.115 8.376 -0.261 25685 10801 1 15 . 1 1 34 34 ASP C C 34 177.621 177.621 178.245 -0.624 25685 10802 1 15 . 1 1 34 34 ASP CA C 34 57.082 57.082 57.000 0.082 25685 10803 1 15 . 1 1 35 35 ALA N N 35 120.662 120.662 121.894 -1.232 25685 10804 1 15 . 1 1 35 35 ALA C C 35 179.168 179.168 179.548 -0.380 25685 10805 1 15 . 1 1 35 35 ALA CA C 35 55.459 55.459 54.552 0.907 25685 10806 1 15 . 1 1 35 35 ALA CB C 35 18.819 18.819 18.160 0.659 25685 10807 1 15 . 1 1 35 35 ALA H H 35 8.090 8.090 7.334 0.756 25685 10808 1 15 . 1 1 36 36 PHE N N 36 117.638 117.638 119.997 -2.359 25685 10809 1 15 . 1 1 36 36 PHE C C 36 177.057 177.057 177.540 -0.483 25685 10810 1 15 . 1 1 36 36 PHE CA C 36 61.472 61.472 61.967 -0.494 25685 10811 1 15 . 1 1 36 36 PHE CB C 36 38.860 38.860 39.483 -0.623 25685 10812 1 15 . 1 1 36 36 PHE H H 36 8.227 8.227 8.360 -0.133 25685 10813 1 15 . 1 1 37 37 LEU N N 37 119.312 119.312 120.632 -1.320 25685 10814 1 15 . 1 1 37 37 LEU C C 37 179.798 179.798 178.772 1.026 25685 10815 1 15 . 1 1 37 37 LEU CA C 37 58.181 58.181 58.269 -0.088 25685 10816 1 15 . 1 1 37 37 LEU CB C 37 40.835 40.835 42.153 -1.317 25685 10817 1 15 . 1 1 37 37 LEU H H 37 8.588 8.588 8.394 0.194 25685 10818 1 15 . 1 1 38 38 ILE N N 38 119.057 119.057 119.229 -0.172 25685 10819 1 15 . 1 1 38 38 ILE C C 38 177.597 177.597 178.226 -0.629 25685 10820 1 15 . 1 1 38 38 ILE CA C 38 64.827 64.827 64.334 0.493 25685 10821 1 15 . 1 1 38 38 ILE CB C 38 36.321 36.321 36.751 -0.430 25685 10822 1 15 . 1 1 38 38 ILE H H 38 7.932 7.932 7.600 0.332 25685 10823 1 15 . 1 1 39 39 VAL N N 39 118.758 118.758 119.426 -0.668 25685 10824 1 15 . 1 1 39 39 VAL C C 39 179.533 179.533 177.741 1.792 25685 10825 1 15 . 1 1 39 39 VAL CA C 39 66.687 66.687 66.380 0.307 25685 10826 1 15 . 1 1 39 39 VAL CB C 39 30.598 30.598 30.786 -0.188 25685 10827 1 15 . 1 1 39 39 VAL H H 39 7.922 7.922 7.483 0.439 25685 10828 1 15 . 1 1 40 40 ALA N N 40 125.385 125.385 120.996 4.389 25685 10829 1 15 . 1 1 40 40 ALA C C 40 179.200 179.200 179.679 -0.479 25685 10830 1 15 . 1 1 40 40 ALA CA C 40 55.283 55.283 54.910 0.373 25685 10831 1 15 . 1 1 40 40 ALA CB C 40 17.197 17.197 18.538 -1.341 25685 10832 1 15 . 1 1 40 40 ALA H H 40 9.091 9.091 7.351 1.740 25685 10833 1 15 . 1 1 41 41 GLY N N 41 106.978 106.978 106.986 -0.008 25685 10834 1 15 . 1 1 41 41 GLY C C 41 176.171 176.171 175.935 0.236 25685 10835 1 15 . 1 1 41 41 GLY CA C 41 47.322 47.322 47.084 0.238 25685 10836 1 15 . 1 1 41 41 GLY H H 41 8.565 8.565 7.891 0.674 25685 10837 1 15 . 1 1 42 42 LEU N N 42 126.914 126.914 119.456 7.458 25685 10838 1 15 . 1 1 42 42 LEU C C 42 178.119 178.119 178.625 -0.506 25685 10839 1 15 . 1 1 42 42 LEU CA C 42 58.523 58.523 58.206 0.317 25685 10840 1 15 . 1 1 42 42 LEU CB C 42 42.125 42.125 41.033 1.092 25685 10841 1 15 . 1 1 42 42 LEU H H 42 8.573 8.573 7.663 0.910 25685 10842 1 15 . 1 1 46 46 MET N N 46 121.710 121.710 121.003 0.707 25685 10843 1 15 . 1 1 46 46 MET C C 46 179.540 179.540 179.055 0.485 25685 10844 1 15 . 1 1 46 46 MET CA C 46 55.968 55.968 57.428 -1.460 25685 10845 1 15 . 1 1 46 46 MET H H 46 8.589 8.589 7.644 0.945 25685 10846 1 15 . 1 1 47 47 LEU N N 47 117.448 117.448 120.674 -3.226 25685 10847 1 15 . 1 1 47 47 LEU HA H 47 3.992 3.992 4.207 -0.215 25685 10848 1 15 . 1 1 47 47 LEU C C 47 179.082 179.082 179.144 -0.062 25685 10849 1 15 . 1 1 47 47 LEU CA C 47 58.157 58.157 57.738 0.419 25685 10850 1 15 . 1 1 47 47 LEU CB C 47 41.858 41.858 40.717 1.141 25685 10851 1 15 . 1 1 47 47 LEU H H 47 8.769 8.769 8.160 0.609 25685 10852 1 15 . 1 1 48 48 ILE N N 48 117.500 117.500 118.885 -1.385 25685 10853 1 15 . 1 1 48 48 ILE C C 48 180.298 180.298 177.221 3.077 25685 10854 1 15 . 1 1 48 48 ILE CA C 48 65.627 65.627 63.817 1.810 25685 10855 1 15 . 1 1 48 48 ILE CB C 48 37.839 37.839 37.888 -0.049 25685 10856 1 15 . 1 1 48 48 ILE H H 48 8.093 8.093 7.500 0.593 25685 10857 1 15 . 1 1 49 49 LEU N N 49 123.708 123.708 120.466 3.242 25685 10858 1 15 . 1 1 49 49 LEU C C 49 179.721 179.721 177.080 2.641 25685 10859 1 15 . 1 1 49 49 LEU CA C 49 58.788 58.788 56.722 2.066 25685 10860 1 15 . 1 1 49 49 LEU CB C 49 40.761 40.761 42.297 -1.536 25685 10861 1 15 . 1 1 49 49 LEU H H 49 8.833 8.833 7.574 1.259 25685 10862 1 15 . 1 1 50 50 GLY N N 50 109.284 109.284 105.909 3.375 25685 10863 1 15 . 1 1 50 50 GLY C C 50 176.937 176.937 174.170 2.767 25685 10864 1 15 . 1 1 50 50 GLY CA C 50 47.821 47.821 45.420 2.401 25685 10865 1 15 . 1 1 50 50 GLY H H 50 9.658 9.658 7.496 2.162 25685 10866 1 15 . 1 1 51 51 TYR N N 51 125.640 125.640 120.699 4.941 25685 10867 1 15 . 1 1 51 51 TYR C C 51 177.102 177.102 175.532 1.570 25685 10868 1 15 . 1 1 51 51 TYR CA C 51 61.948 61.948 59.730 2.218 25685 10869 1 15 . 1 1 51 51 TYR CB C 51 38.871 38.871 37.715 1.157 25685 10870 1 15 . 1 1 51 51 TYR H H 51 8.795 8.795 8.296 0.499 25685 10871 1 15 . 1 1 52 52 THR N N 52 116.273 116.273 114.820 1.453 25685 10872 1 15 . 1 1 52 52 THR C C 52 176.969 176.969 172.805 4.164 25685 10873 1 15 . 1 1 52 52 THR CA C 52 67.972 67.972 63.472 4.500 25685 10874 1 15 . 1 1 52 52 THR H H 52 8.456 8.456 8.606 -0.150 25685 10875 1 15 . 1 1 53 53 ALA N N 53 122.122 122.122 128.277 -6.155 25685 10876 1 15 . 1 1 53 53 ALA C C 53 179.907 179.907 175.866 4.041 25685 10877 1 15 . 1 1 53 53 ALA CA C 53 55.722 55.722 51.860 3.862 25685 10878 1 15 . 1 1 53 53 ALA CB C 53 18.786 18.786 19.292 -0.506 25685 10879 1 15 . 1 1 53 53 ALA H H 53 9.058 9.058 7.694 1.364 25685 10880 1 15 . 1 1 54 54 SER N N 54 115.434 115.434 116.518 -1.084 25685 10881 1 15 . 1 1 54 54 SER C C 54 176.433 176.433 174.191 2.242 25685 10882 1 15 . 1 1 54 54 SER CA C 54 55.828 55.828 59.385 -3.557 25685 10883 1 15 . 1 1 54 54 SER H H 54 8.040 8.040 8.788 -0.748 25685 10884 1 15 . 1 1 55 55 LEU N N 55 123.045 123.045 120.404 2.641 25685 10885 1 15 . 1 1 55 55 LEU C C 55 178.789 178.789 175.835 2.954 25685 10886 1 15 . 1 1 55 55 LEU CA C 55 57.633 57.633 54.242 3.390 25685 10887 1 15 . 1 1 55 55 LEU CB C 55 41.293 41.293 42.136 -0.843 25685 10888 1 15 . 1 1 55 55 LEU H H 55 8.255 8.255 8.131 0.124 25685 10889 1 15 . 1 1 56 56 PHE N N 56 114.426 114.426 117.480 -3.054 25685 10890 1 15 . 1 1 56 56 PHE C C 56 177.507 177.507 175.505 2.002 25685 10891 1 15 . 1 1 56 56 PHE CA C 56 61.068 61.068 58.347 2.721 25685 10892 1 15 . 1 1 56 56 PHE CB C 56 40.107 40.107 39.546 0.561 25685 10893 1 15 . 1 1 56 56 PHE H H 56 7.590 7.590 7.972 -0.382 25685 10894 1 15 . 1 1 57 57 PHE N N 57 114.701 114.701 117.974 -3.273 25685 10895 1 15 . 1 1 57 57 PHE C C 57 176.203 176.203 175.438 0.765 25685 10896 1 15 . 1 1 57 57 PHE CA C 57 58.503 58.503 56.958 1.545 25685 10897 1 15 . 1 1 57 57 PHE CB C 57 41.114 41.114 39.232 1.882 25685 10898 1 15 . 1 1 57 57 PHE H H 57 8.514 8.514 5.862 2.652 25685 10899 1 15 . 1 1 58 58 GLY N N 58 111.041 111.041 109.161 1.880 25685 10900 1 15 . 1 1 58 58 GLY C C 58 174.240 174.240 175.617 -1.377 25685 10901 1 15 . 1 1 58 58 GLY CA C 58 44.827 44.827 46.976 -2.149 25685 10902 1 15 . 1 1 58 58 GLY H H 58 7.998 7.998 7.378 0.620 25685 10903 1 15 . 1 1 59 59 PHE N N 59 127.950 127.950 120.298 7.652 25685 10904 1 15 . 1 1 59 59 PHE C C 59 176.612 176.612 177.399 -0.787 25685 10905 1 15 . 1 1 59 59 PHE CA C 59 61.598 61.598 59.485 2.113 25685 10906 1 15 . 1 1 59 59 PHE CB C 59 40.870 40.870 38.691 2.179 25685 10907 1 15 . 1 1 59 59 PHE H H 59 9.105 9.105 7.979 1.126 25685 10908 1 15 . 1 1 60 60 PHE N N 60 114.868 114.868 120.715 -5.847 25685 10909 1 15 . 1 1 60 60 PHE C C 60 177.989 177.989 177.263 0.726 25685 10910 1 15 . 1 1 60 60 PHE CA C 60 61.517 61.517 61.684 -0.167 25685 10911 1 15 . 1 1 60 60 PHE CB C 60 38.248 38.248 39.264 -1.016 25685 10912 1 15 . 1 1 60 60 PHE H H 60 8.796 8.796 7.940 0.856 25685 10913 1 15 . 1 1 61 61 ARG N N 61 118.812 118.812 119.369 -0.557 25685 10914 1 15 . 1 1 61 61 ARG C C 61 177.813 177.813 178.329 -0.516 25685 10915 1 15 . 1 1 61 61 ARG CA C 61 60.497 60.497 58.726 1.771 25685 10916 1 15 . 1 1 61 61 ARG CB C 61 28.915 28.915 29.590 -0.674 25685 10917 1 15 . 1 1 61 61 ARG H H 61 7.600 7.600 7.787 -0.187 25685 10918 1 15 . 1 1 62 62 VAL N N 62 119.157 119.157 119.178 -0.021 25685 10919 1 15 . 1 1 62 62 VAL C C 62 177.670 177.670 177.652 0.018 25685 10920 1 15 . 1 1 62 62 VAL CA C 62 66.749 66.749 65.161 1.588 25685 10921 1 15 . 1 1 62 62 VAL CB C 62 30.306 30.306 31.660 -1.355 25685 10922 1 15 . 1 1 62 62 VAL H H 62 7.679 7.679 7.504 0.175 25685 10923 1 15 . 1 1 63 63 VAL N N 63 117.999 117.999 119.124 -1.125 25685 10924 1 15 . 1 1 63 63 VAL C C 63 177.639 177.639 178.030 -0.391 25685 10925 1 15 . 1 1 63 63 VAL CA C 63 66.836 66.836 65.109 1.727 25685 10926 1 15 . 1 1 63 63 VAL CB C 63 30.496 30.496 30.077 0.419 25685 10927 1 15 . 1 1 63 63 VAL H H 63 7.429 7.429 7.769 -0.340 25685 10928 1 15 . 1 1 64 64 ALA N N 64 120.451 120.451 122.263 -1.812 25685 10929 1 15 . 1 1 64 64 ALA C C 64 179.134 179.134 179.196 -0.062 25685 10930 1 15 . 1 1 64 64 ALA CA C 64 55.618 55.618 54.299 1.319 25685 10931 1 15 . 1 1 64 64 ALA CB C 64 17.950 17.950 17.619 0.331 25685 10932 1 15 . 1 1 64 64 ALA H H 64 8.169 8.169 7.455 0.714 25685 10933 1 15 . 1 1 65 65 MET N N 65 116.532 116.532 117.232 -0.700 25685 10934 1 15 . 1 1 65 65 MET C C 65 177.961 177.961 178.233 -0.272 25685 10935 1 15 . 1 1 65 65 MET CA C 65 58.161 58.161 57.359 0.802 25685 10936 1 15 . 1 1 65 65 MET CB C 65 31.208 31.208 31.435 -0.227 25685 10937 1 15 . 1 1 65 65 MET H H 65 7.857 7.857 7.411 0.446 25685 10938 1 15 . 1 1 66 66 LEU C C 66 179.022 179.022 179.098 -0.076 25685 10939 1 15 . 1 1 66 66 LEU CA C 66 58.412 58.412 58.051 0.361 25685 10940 1 15 . 1 1 67 67 PHE N N 67 116.877 116.877 116.588 0.289 25685 10941 1 15 . 1 1 67 67 PHE C C 67 177.908 177.908 178.611 -0.703 25685 10942 1 15 . 1 1 67 67 PHE CA C 67 62.402 62.402 59.408 2.994 25685 10943 1 15 . 1 1 67 67 PHE CB C 67 39.203 39.203 36.989 2.215 25685 10944 1 15 . 1 1 67 67 PHE H H 67 7.923 7.923 7.236 0.687 25685 10945 1 15 . 1 1 68 68 LEU N N 68 118.860 118.860 118.863 -0.003 25685 10946 1 15 . 1 1 68 68 LEU C C 68 179.032 179.032 178.777 0.255 25685 10947 1 15 . 1 1 68 68 LEU CA C 68 58.397 58.397 57.386 1.011 25685 10948 1 15 . 1 1 68 68 LEU CB C 68 40.803 40.803 40.553 0.250 25685 10949 1 15 . 1 1 68 68 LEU H H 68 8.167 8.167 7.674 0.493 25685 10950 1 15 . 1 1 71 71 PHE N N 71 120.700 120.700 117.878 2.822 25685 10951 1 15 . 1 1 71 71 PHE C C 71 177.670 177.670 177.467 0.203 25685 10952 1 15 . 1 1 71 71 PHE CA C 71 60.528 60.528 60.196 0.332 25685 10953 1 15 . 1 1 71 71 PHE H H 71 7.847 7.847 6.954 0.893 25685 10954 1 15 . 1 1 72 72 ALA N N 72 120.506 120.506 122.878 -2.372 25685 10955 1 15 . 1 1 72 72 ALA C C 72 178.944 178.944 179.441 -0.497 25685 10956 1 15 . 1 1 72 72 ALA CA C 72 55.461 55.461 55.169 0.292 25685 10957 1 15 . 1 1 72 72 ALA CB C 72 17.829 17.829 17.823 0.006 25685 10958 1 15 . 1 1 72 72 ALA H H 72 8.533 8.533 8.529 0.004 25685 10959 1 15 . 1 1 73 73 LEU N N 73 115.071 115.071 118.446 -3.375 25685 10960 1 15 . 1 1 73 73 LEU C C 73 180.831 180.831 179.175 1.656 25685 10961 1 15 . 1 1 73 73 LEU CA C 73 58.091 58.091 57.856 0.235 25685 10962 1 15 . 1 1 73 73 LEU CB C 73 41.082 41.082 41.554 -0.472 25685 10963 1 15 . 1 1 73 73 LEU H H 73 8.458 8.458 7.688 0.770 25685 10964 1 15 . 1 1 74 74 ILE N N 74 121.365 121.365 118.115 3.250 25685 10965 1 15 . 1 1 74 74 ILE C C 74 178.287 178.287 178.572 -0.285 25685 10966 1 15 . 1 1 74 74 ILE CA C 74 65.335 65.335 64.419 0.915 25685 10967 1 15 . 1 1 74 74 ILE CB C 74 37.453 37.453 37.673 -0.220 25685 10968 1 15 . 1 1 74 74 ILE H H 74 8.220 8.220 7.276 0.944 25685 10969 1 15 . 1 1 75 75 LEU N N 75 119.200 119.200 121.149 -1.949 25685 10970 1 15 . 1 1 75 75 LEU C C 75 177.548 177.548 178.039 -0.491 25685 10971 1 15 . 1 1 75 75 LEU CA C 75 56.938 56.938 57.987 -1.049 25685 10972 1 15 . 1 1 75 75 LEU CB C 75 41.541 41.541 41.788 -0.247 25685 10973 1 15 . 1 1 75 75 LEU H H 75 7.866 7.866 7.514 0.352 25685 10974 1 15 . 1 1 76 76 LEU N N 76 116.338 116.338 115.860 0.478 25685 10975 1 15 . 1 1 76 76 LEU C C 76 176.889 176.889 178.573 -1.684 25685 10976 1 15 . 1 1 76 76 LEU CA C 76 54.807 54.807 56.943 -2.136 25685 10977 1 15 . 1 1 76 76 LEU CB C 76 41.830 41.830 41.350 0.480 25685 10978 1 15 . 1 1 76 76 LEU H H 76 7.432 7.432 8.097 -0.665 25685 10979 1 15 . 1 1 77 77 SER N N 77 114.630 114.630 113.018 1.612 25685 10980 1 15 . 1 1 77 77 SER C C 77 174.752 174.752 175.195 -0.443 25685 10981 1 15 . 1 1 77 77 SER CA C 77 58.967 58.967 60.778 -1.811 25685 10982 1 15 . 1 1 77 77 SER CB C 77 64.686 64.686 63.654 1.032 25685 10983 1 15 . 1 1 77 77 SER H H 77 7.423 7.423 7.903 -0.480 25685 10984 1 15 . 1 1 78 78 ASP N N 78 123.054 123.054 121.257 1.797 25685 10985 1 15 . 1 1 78 78 ASP C C 78 176.716 176.716 175.402 1.314 25685 10986 1 15 . 1 1 78 78 ASP CA C 78 54.848 54.848 55.715 -0.867 25685 10987 1 15 . 1 1 78 78 ASP CB C 78 40.423 40.423 40.091 0.332 25685 10988 1 15 . 1 1 78 78 ASP H H 78 8.294 8.294 7.713 0.581 25685 10989 1 15 . 1 1 79 79 GLU N N 79 119.104 119.104 120.399 -1.295 25685 10990 1 15 . 1 1 79 79 GLU C C 79 176.391 176.391 175.515 0.876 25685 10991 1 15 . 1 1 79 79 GLU CA C 79 56.258 56.258 55.135 1.123 25685 10992 1 15 . 1 1 79 79 GLU CB C 79 29.656 29.656 29.136 0.520 25685 10993 1 15 . 1 1 79 79 GLU H H 79 8.384 8.384 8.358 0.026 25685 10994 1 15 . 1 1 80 80 LEU N N 80 121.254 121.254 120.713 0.541 25685 10995 1 15 . 1 1 80 80 LEU C C 80 177.164 177.164 175.416 1.748 25685 10996 1 15 . 1 1 80 80 LEU CA C 80 54.670 54.670 55.636 -0.966 25685 10997 1 15 . 1 1 80 80 LEU CB C 80 42.633 42.633 40.201 2.432 25685 10998 1 15 . 1 1 80 80 LEU H H 80 7.637 7.637 8.703 -1.066 25685 10999 1 15 . 1 1 81 81 ASP N N 81 123.410 123.410 120.254 3.156 25685 11000 1 15 . 1 1 81 81 ASP C C 81 177.552 177.552 175.729 1.823 25685 11001 1 15 . 1 1 81 81 ASP CA C 81 55.110 55.110 52.724 2.386 25685 11002 1 15 . 1 1 81 81 ASP CB C 81 42.693 42.693 43.545 -0.852 25685 11003 1 15 . 1 1 81 81 ASP H H 81 8.403 8.403 7.955 0.448 25685 11004 1 15 . 1 1 82 82 GLU N N 82 125.047 125.047 119.568 5.479 25685 11005 1 15 . 1 1 82 82 GLU C C 82 178.198 178.198 177.258 0.940 25685 11006 1 15 . 1 1 82 82 GLU CA C 82 59.221 59.221 57.530 1.691 25685 11007 1 15 . 1 1 82 82 GLU CB C 82 29.176 29.176 29.869 -0.693 25685 11008 1 15 . 1 1 82 82 GLU H H 82 8.744 8.744 8.735 0.009 25685 11009 1 15 . 1 1 83 83 LYS N N 83 118.476 118.476 119.664 -1.188 25685 11010 1 15 . 1 1 83 83 LYS C C 83 179.356 179.356 177.558 1.798 25685 11011 1 15 . 1 1 83 83 LYS CA C 83 59.170 59.170 57.682 1.488 25685 11012 1 15 . 1 1 83 83 LYS CB C 83 31.509 31.509 32.431 -0.922 25685 11013 1 15 . 1 1 83 83 LYS H H 83 8.607 8.607 7.634 0.973 25685 11014 1 15 . 1 1 84 84 VAL N N 84 118.407 118.407 114.443 3.964 25685 11015 1 15 . 1 1 84 84 VAL C C 84 177.653 177.653 177.263 0.390 25685 11016 1 15 . 1 1 84 84 VAL CA C 84 65.416 65.416 65.171 0.245 25685 11017 1 15 . 1 1 84 84 VAL CB C 84 31.313 31.313 31.375 -0.062 25685 11018 1 15 . 1 1 84 84 VAL H H 84 7.870 7.870 7.484 0.386 25685 11019 1 15 . 1 1 85 85 SER N N 85 116.146 116.146 115.906 0.240 25685 11020 1 15 . 1 1 85 85 SER C C 85 177.496 177.496 176.560 0.936 25685 11021 1 15 . 1 1 85 85 SER CA C 85 61.764 61.764 61.762 0.002 25685 11022 1 15 . 1 1 85 85 SER CB C 85 63.654 63.654 62.838 0.816 25685 11023 1 15 . 1 1 85 85 SER H H 85 8.083 8.083 7.879 0.204 25685 11024 1 15 . 1 1 86 86 ILE N N 86 122.570 122.570 117.260 5.310 25685 11025 1 15 . 1 1 86 86 ILE C C 86 178.698 178.698 177.673 1.025 25685 11026 1 15 . 1 1 86 86 ILE CA C 86 64.526 64.526 63.986 0.540 25685 11027 1 15 . 1 1 86 86 ILE CB C 86 37.393 37.393 37.197 0.196 25685 11028 1 15 . 1 1 86 86 ILE H H 86 8.102 8.102 7.163 0.939 25685 11029 1 15 . 1 1 87 87 PHE N N 87 121.340 121.340 119.320 2.020 25685 11030 1 15 . 1 1 87 87 PHE C C 87 177.671 177.671 177.908 -0.237 25685 11031 1 15 . 1 1 87 87 PHE CA C 87 61.098 61.098 59.759 1.339 25685 11032 1 15 . 1 1 87 87 PHE CB C 87 39.151 39.151 36.877 2.274 25685 11033 1 15 . 1 1 87 87 PHE H H 87 7.719 7.719 7.311 0.408 25685 11034 1 15 . 1 1 88 88 ALA N N 88 120.921 120.921 121.107 -0.186 25685 11035 1 15 . 1 1 88 88 ALA C C 88 180.030 180.030 179.451 0.579 25685 11036 1 15 . 1 1 88 88 ALA CA C 88 55.147 55.147 55.015 0.132 25685 11037 1 15 . 1 1 88 88 ALA CB C 88 19.053 19.053 18.095 0.958 25685 11038 1 15 . 1 1 88 88 ALA H H 88 8.679 8.679 7.689 0.990 25685 11039 1 15 . 1 1 89 89 SER N N 89 114.285 114.285 114.855 -0.570 25685 11040 1 15 . 1 1 89 89 SER C C 89 177.040 177.040 176.524 0.516 25685 11041 1 15 . 1 1 89 89 SER CA C 89 61.314 61.314 61.908 -0.595 25685 11042 1 15 . 1 1 89 89 SER CB C 89 63.371 63.371 62.860 0.511 25685 11043 1 15 . 1 1 89 89 SER H H 89 8.242 8.242 7.749 0.493 25685 11044 1 15 . 1 1 90 90 ARG N N 90 121.829 121.829 121.810 0.019 25685 11045 1 15 . 1 1 90 90 ARG C C 90 179.247 179.247 178.365 0.882 25685 11046 1 15 . 1 1 90 90 ARG CA C 90 58.444 58.444 58.333 0.112 25685 11047 1 15 . 1 1 90 90 ARG CB C 90 29.532 29.532 29.172 0.360 25685 11048 1 15 . 1 1 90 90 ARG H H 90 7.907 7.907 8.366 -0.459 25685 11049 1 15 . 1 1 91 91 MET N N 91 117.124 117.124 119.211 -2.087 25685 11050 1 15 . 1 1 91 91 MET C C 91 177.504 177.504 177.930 -0.426 25685 11051 1 15 . 1 1 91 91 MET CA C 91 57.152 57.152 60.348 -3.196 25685 11052 1 15 . 1 1 91 91 MET CB C 91 32.510 32.510 32.598 -0.088 25685 11053 1 15 . 1 1 91 91 MET H H 91 7.930 7.930 7.827 0.103 25685 11054 1 15 . 1 1 92 92 THR N N 92 108.478 108.478 112.890 -4.412 25685 11055 1 15 . 1 1 92 92 THR C C 92 176.367 176.367 176.657 -0.290 25685 11056 1 15 . 1 1 92 92 THR CA C 92 63.564 63.564 65.487 -1.923 25685 11057 1 15 . 1 1 92 92 THR H H 92 7.847 7.847 7.840 0.007 25685 11058 1 15 . 1 1 93 93 SER N N 93 117.950 117.950 117.536 0.414 25685 11059 1 15 . 1 1 93 93 SER C C 93 176.552 176.552 176.608 -0.056 25685 11060 1 15 . 1 1 93 93 SER CA C 93 60.821 60.821 61.178 -0.357 25685 11061 1 15 . 1 1 93 93 SER CB C 93 63.311 63.311 63.291 0.020 25685 11062 1 15 . 1 1 93 93 SER H H 93 7.732 7.732 7.816 -0.084 25685 11063 1 15 . 1 1 94 94 GLY N N 94 111.265 111.265 107.874 3.391 25685 11064 1 15 . 1 1 94 94 GLY C C 94 175.198 175.198 173.848 1.350 25685 11065 1 15 . 1 1 94 94 GLY CA C 94 46.021 46.021 44.900 1.121 25685 11066 1 15 . 1 1 94 94 GLY H H 94 8.419 8.419 8.134 0.285 25685 11067 1 15 . 1 1 95 95 LEU N N 95 121.019 121.019 118.542 2.477 25685 11068 1 15 . 1 1 95 95 LEU C C 95 177.810 177.810 176.258 1.552 25685 11069 1 15 . 1 1 95 95 LEU CA C 95 56.012 56.012 56.147 -0.135 25685 11070 1 15 . 1 1 95 95 LEU CB C 95 42.122 42.122 42.380 -0.258 25685 11071 1 15 . 1 1 95 95 LEU H H 95 7.849 7.849 7.720 0.129 25685 11072 1 15 . 1 1 96 96 SER N N 96 115.465 115.465 118.887 -3.422 25685 11073 1 15 . 1 1 96 96 SER C C 96 175.543 175.543 174.964 0.579 25685 11074 1 15 . 1 1 96 96 SER CA C 96 60.151 60.151 57.687 2.464 25685 11075 1 15 . 1 1 96 96 SER H H 96 8.349 8.349 8.219 0.130 25685 11076 1 15 . 1 1 97 97 TRP N N 97 121.711 121.711 121.598 0.113 25685 11077 1 15 . 1 1 97 97 TRP C C 97 176.973 176.973 176.435 0.538 25685 11078 1 15 . 1 1 97 97 TRP CA C 97 58.250 58.250 57.448 0.802 25685 11079 1 15 . 1 1 97 97 TRP CB C 97 28.899 28.899 30.020 -1.121 25685 11080 1 15 . 1 1 97 97 TRP H H 97 7.723 7.723 8.418 -0.695 25685 11081 1 15 . 1 1 98 98 LYS N N 98 119.868 119.868 119.987 -0.119 25685 11082 1 15 . 1 1 98 98 LYS C C 98 178.021 178.021 177.684 0.337 25685 11083 1 15 . 1 1 98 98 LYS CA C 98 56.340 56.340 56.693 -0.353 25685 11084 1 15 . 1 1 98 98 LYS CB C 98 31.933 31.933 33.332 -1.399 25685 11085 1 15 . 1 1 98 98 LYS H H 98 7.855 7.855 8.406 -0.551 25685 11086 1 15 . 1 1 99 99 ILE N N 99 120.044 120.044 122.663 -2.619 25685 11087 1 15 . 1 1 99 99 ILE C C 99 176.769 176.769 177.646 -0.877 25685 11088 1 15 . 1 1 99 99 ILE CA C 99 62.758 62.758 63.137 -0.379 25685 11089 1 15 . 1 1 99 99 ILE CB C 99 37.809 37.809 36.789 1.020 25685 11090 1 15 . 1 1 99 99 ILE H H 99 8.069 8.069 8.278 -0.209 25685 11091 1 15 . 1 1 100 100 GLN C C 100 176.315 176.315 175.429 0.886 25685 11092 1 15 . 1 1 100 100 GLN CA C 100 57.486 57.486 55.494 1.992 25685 11093 1 15 . 1 1 101 101 THR N N 101 109.873 109.873 114.738 -4.865 25685 11094 1 15 . 1 1 101 101 THR C C 101 174.664 174.664 174.564 0.100 25685 11095 1 15 . 1 1 101 101 THR CA C 101 61.709 61.709 62.785 -1.075 25685 11096 1 15 . 1 1 101 101 THR CB C 101 69.290 69.290 69.889 -0.599 25685 11097 1 15 . 1 1 101 101 THR H H 101 7.508 7.508 7.234 0.274 25685 11098 1 15 . 1 1 102 102 LEU N N 102 124.434 124.434 125.921 -1.487 25685 11099 1 15 . 1 1 102 102 LEU C C 102 174.681 174.681 175.821 -1.140 25685 11100 1 15 . 1 1 102 102 LEU CA C 102 53.063 53.063 52.708 0.355 25685 11101 1 15 . 1 1 102 102 LEU CB C 102 41.139 41.139 42.077 -0.938 25685 11102 1 15 . 1 1 102 102 LEU H H 102 7.569 7.569 8.765 -1.196 25685 11103 1 15 . 1 1 103 103 PRO C C 103 178.076 178.076 175.675 2.401 25685 11104 1 15 . 1 1 103 103 PRO CA C 103 62.570 62.570 62.719 -0.149 25685 11105 1 15 . 1 1 103 103 PRO CB C 103 31.534 31.534 30.570 0.964 25685 11106 1 15 . 1 1 104 104 SER N N 104 119.929 119.929 117.281 2.648 25685 11107 1 15 . 1 1 104 104 SER C C 104 176.432 176.432 174.332 2.100 25685 11108 1 15 . 1 1 104 104 SER CA C 104 61.976 61.976 57.338 4.638 25685 11109 1 15 . 1 1 104 104 SER CB C 104 63.611 63.611 63.655 -0.044 25685 11110 1 15 . 1 1 104 104 SER H H 104 8.784 8.784 8.003 0.781 25685 11111 1 15 . 1 1 105 105 PHE N N 105 119.519 119.519 121.191 -1.672 25685 11112 1 15 . 1 1 105 105 PHE C C 105 176.852 176.852 173.983 2.869 25685 11113 1 15 . 1 1 105 105 PHE CA C 105 60.162 60.162 58.010 2.152 25685 11114 1 15 . 1 1 105 105 PHE CB C 105 38.455 38.455 38.470 -0.015 25685 11115 1 15 . 1 1 105 105 PHE H H 105 8.620 8.620 7.765 0.855 25685 11116 1 15 . 1 1 106 106 PHE N N 106 118.809 118.809 114.860 3.949 25685 11117 1 15 . 1 1 106 106 PHE C C 106 176.741 176.741 175.052 1.689 25685 11118 1 15 . 1 1 106 106 PHE CA C 106 61.421 61.421 58.056 3.365 25685 11119 1 15 . 1 1 106 106 PHE CB C 106 38.788 38.788 36.232 2.556 25685 11120 1 15 . 1 1 106 106 PHE H H 106 7.519 7.519 7.121 0.398 25685 11121 1 15 . 1 1 107 107 PHE N N 107 117.382 117.382 122.014 -4.632 25685 11122 1 15 . 1 1 107 107 PHE C C 107 177.771 177.771 177.526 0.245 25685 11123 1 15 . 1 1 107 107 PHE CA C 107 61.099 61.099 61.500 -0.401 25685 11124 1 15 . 1 1 107 107 PHE CB C 107 38.677 38.677 38.683 -0.006 25685 11125 1 15 . 1 1 107 107 PHE H H 107 7.903 7.903 8.569 -0.666 25685 11126 1 15 . 1 1 108 108 GLY N N 108 105.340 105.340 106.029 -0.689 25685 11127 1 15 . 1 1 108 108 GLY C C 108 174.574 174.574 175.874 -1.300 25685 11128 1 15 . 1 1 108 108 GLY CA C 108 47.508 47.508 47.120 0.388 25685 11129 1 15 . 1 1 108 108 GLY H H 108 8.351 8.351 8.878 -0.527 25685 11130 1 15 . 1 1 109 109 MET N N 109 119.831 119.831 119.615 0.216 25685 11131 1 15 . 1 1 109 109 MET C C 109 177.522 177.522 177.327 0.195 25685 11132 1 15 . 1 1 109 109 MET CA C 109 58.658 58.658 58.247 0.411 25685 11133 1 15 . 1 1 109 109 MET CB C 109 32.106 32.106 32.037 0.069 25685 11134 1 15 . 1 1 109 109 MET H H 109 7.919 7.919 7.648 0.271 25685 11135 1 15 . 1 1 110 110 LEU N N 110 119.908 119.908 119.729 0.179 25685 11136 1 15 . 1 1 110 110 LEU C C 110 178.170 178.170 178.277 -0.107 25685 11137 1 15 . 1 1 110 110 LEU CA C 110 57.941 57.941 57.403 0.538 25685 11138 1 15 . 1 1 110 110 LEU CB C 110 41.055 41.055 41.330 -0.275 25685 11139 1 15 . 1 1 110 110 LEU H H 110 7.744 7.744 7.189 0.555 25685 11140 1 15 . 1 1 111 111 LEU N N 111 116.594 116.594 118.811 -2.217 25685 11141 1 15 . 1 1 111 111 LEU C C 111 178.960 178.960 177.882 1.078 25685 11142 1 15 . 1 1 111 111 LEU CA C 111 57.366 57.366 57.370 -0.004 25685 11143 1 15 . 1 1 111 111 LEU CB C 111 40.259 40.259 40.688 -0.429 25685 11144 1 15 . 1 1 111 111 LEU H H 111 7.732 7.732 7.493 0.239 25685 11145 1 15 . 1 1 112 112 ALA N N 112 121.020 121.020 120.037 0.983 25685 11146 1 15 . 1 1 112 112 ALA C C 112 178.700 178.700 178.864 -0.164 25685 11147 1 15 . 1 1 112 112 ALA CA C 112 55.432 55.432 54.970 0.462 25685 11148 1 15 . 1 1 112 112 ALA CB C 112 18.214 18.214 18.111 0.103 25685 11149 1 15 . 1 1 112 112 ALA H H 112 8.121 8.121 7.249 0.872 25685 11150 1 15 . 1 1 113 113 PHE N N 113 118.369 118.369 115.403 2.966 25685 11151 1 15 . 1 1 113 113 PHE C C 113 176.091 176.091 177.225 -1.134 25685 11152 1 15 . 1 1 113 113 PHE CA C 113 61.388 61.388 58.500 2.888 25685 11153 1 15 . 1 1 113 113 PHE CB C 113 39.688 39.688 37.526 2.162 25685 11154 1 15 . 1 1 113 113 PHE H H 113 8.237 8.237 6.919 1.318 25685 11155 1 15 . 1 1 114 114 LEU N N 114 114.214 114.214 119.001 -4.787 25685 11156 1 15 . 1 1 114 114 LEU C C 114 177.038 177.038 178.344 -1.306 25685 11157 1 15 . 1 1 114 114 LEU CA C 114 56.358 56.358 57.590 -1.232 25685 11158 1 15 . 1 1 114 114 LEU CB C 114 42.716 42.716 42.061 0.655 25685 11159 1 15 . 1 1 114 114 LEU H H 114 7.576 7.576 7.307 0.269 25685 11160 1 15 . 1 1 115 115 TRP N N 115 112.667 112.667 116.343 -3.676 25685 11161 1 15 . 1 1 115 115 TRP C C 115 180.163 180.163 178.007 2.156 25685 11162 1 15 . 1 1 115 115 TRP CA C 115 55.930 55.930 59.079 -3.149 25685 11163 1 15 . 1 1 115 115 TRP H H 115 8.542 8.542 7.025 1.517 25685 11164 1 15 . 1 1 116 116 LEU N N 116 122.144 122.144 122.744 -0.600 25685 11165 1 15 . 1 1 116 116 LEU C C 116 175.953 175.953 176.501 -0.548 25685 11166 1 15 . 1 1 116 116 LEU CA C 116 59.924 59.924 57.929 1.995 25685 11167 1 15 . 1 1 116 116 LEU CB C 116 39.097 39.097 39.231 -0.134 25685 11168 1 15 . 1 1 116 116 LEU H H 116 8.996 8.996 7.593 1.403 25685 11169 1 15 . 1 1 117 117 PRO C C 117 174.220 174.220 176.589 -2.369 25685 11170 1 15 . 1 1 117 117 PRO CA C 117 66.300 66.300 64.203 2.097 25685 11171 1 15 . 1 1 118 118 ALA N N 118 110.603 110.603 118.454 -7.851 25685 11172 1 15 . 1 1 118 118 ALA C C 118 177.162 177.162 176.431 0.731 25685 11173 1 15 . 1 1 118 118 ALA CA C 118 52.670 52.670 51.999 0.671 25685 11174 1 15 . 1 1 118 118 ALA CB C 118 18.853 18.853 20.610 -1.757 25685 11175 1 15 . 1 1 118 118 ALA H H 118 6.633 6.633 7.562 -0.929 25685 11176 1 15 . 1 1 119 119 ILE N N 119 113.492 113.492 115.065 -1.573 25685 11177 1 15 . 1 1 119 119 ILE CA C 119 63.703 63.703 62.653 1.050 25685 11178 1 15 . 1 1 119 119 ILE CB C 119 39.605 39.605 38.025 1.580 25685 11179 1 15 . 1 1 119 119 ILE H H 119 7.693 7.693 7.924 -0.231 25685 11180 1 15 . 1 1 121 121 PRO C C 121 178.089 178.089 178.945 -0.856 25685 11181 1 15 . 1 1 121 121 PRO CA C 121 66.004 66.004 66.020 -0.016 25685 11182 1 15 . 1 1 122 122 PHE N N 122 113.797 113.797 118.232 -4.435 25685 11183 1 15 . 1 1 122 122 PHE C C 122 177.713 177.713 176.894 0.819 25685 11184 1 15 . 1 1 122 122 PHE CA C 122 61.566 61.566 61.058 0.508 25685 11185 1 15 . 1 1 122 122 PHE CB C 122 38.983 38.983 38.806 0.177 25685 11186 1 15 . 1 1 122 122 PHE H H 122 6.846 6.846 8.028 -1.182 25685 11187 1 15 . 1 1 123 123 ALA N N 123 121.512 121.512 121.381 0.131 25685 11188 1 15 . 1 1 123 123 ALA C C 123 179.318 179.318 179.568 -0.250 25685 11189 1 15 . 1 1 123 123 ALA CA C 123 54.975 54.975 55.136 -0.161 25685 11190 1 15 . 1 1 123 123 ALA CB C 123 17.881 17.881 18.134 -0.253 25685 11191 1 15 . 1 1 123 123 ALA H H 123 8.411 8.411 8.288 0.123 25685 11192 1 15 . 1 1 124 124 GLY N N 124 104.093 104.093 107.152 -3.059 25685 11193 1 15 . 1 1 124 124 GLY C C 124 175.410 175.410 176.160 -0.750 25685 11194 1 15 . 1 1 124 124 GLY CA C 124 47.370 47.370 46.777 0.593 25685 11195 1 15 . 1 1 124 124 GLY H H 124 8.455 8.455 7.997 0.458 25685 11196 1 15 . 1 1 125 125 ILE N N 125 121.895 121.895 119.671 2.224 25685 11197 1 15 . 1 1 125 125 ILE C C 125 178.329 178.329 177.409 0.920 25685 11198 1 15 . 1 1 125 125 ILE CA C 125 64.412 64.412 64.386 0.026 25685 11199 1 15 . 1 1 125 125 ILE H H 125 7.954 7.954 8.311 -0.357 25685 11200 1 15 . 1 1 126 126 ALA N N 126 122.768 122.768 122.384 0.384 25685 11201 1 15 . 1 1 126 126 ALA C C 126 180.341 180.341 179.508 0.833 25685 11202 1 15 . 1 1 126 126 ALA CA C 126 55.266 55.266 55.409 -0.143 25685 11203 1 15 . 1 1 126 126 ALA CB C 126 18.226 18.226 18.219 0.007 25685 11204 1 15 . 1 1 126 126 ALA H H 126 8.142 8.142 7.667 0.475 25685 11205 1 15 . 1 1 127 127 ILE N N 127 116.752 116.752 115.576 1.176 25685 11206 1 15 . 1 1 127 127 ILE C C 127 177.993 177.993 177.533 0.460 25685 11207 1 15 . 1 1 127 127 ILE CA C 127 63.877 63.877 63.913 -0.036 25685 11208 1 15 . 1 1 127 127 ILE CB C 127 37.657 37.657 37.540 0.117 25685 11209 1 15 . 1 1 127 127 ILE H H 127 8.335 8.335 7.405 0.930 25685 11210 1 15 . 1 1 128 128 SER N N 128 116.351 116.351 116.484 -0.133 25685 11211 1 15 . 1 1 128 128 SER C C 128 175.796 175.796 176.335 -0.539 25685 11212 1 15 . 1 1 128 128 SER CA C 128 61.818 61.818 60.828 0.990 25685 11213 1 15 . 1 1 128 128 SER H H 128 7.939 7.939 7.560 0.379 25685 11214 1 15 . 1 1 129 129 GLN N N 129 118.082 118.082 120.235 -2.153 25685 11215 1 15 . 1 1 129 129 GLN C C 129 177.419 177.419 178.342 -0.923 25685 11216 1 15 . 1 1 129 129 GLN CA C 129 57.106 57.106 58.248 -1.142 25685 11217 1 15 . 1 1 129 129 GLN CB C 129 28.631 28.631 28.845 -0.214 25685 11218 1 15 . 1 1 129 129 GLN H H 129 7.943 7.943 7.750 0.193 25685 11219 1 15 . 1 1 130 130 THR N N 130 113.484 113.484 114.439 -0.955 25685 11220 1 15 . 1 1 130 130 THR C C 130 175.627 175.627 174.743 0.884 25685 11221 1 15 . 1 1 130 130 THR CA C 130 63.758 63.758 65.276 -1.518 25685 11222 1 15 . 1 1 130 130 THR CB C 130 69.182 69.182 69.163 0.019 25685 11223 1 15 . 1 1 130 130 THR H H 130 7.686 7.686 7.527 0.159 25685 11224 1 15 . 1 1 131 131 LEU N N 131 121.347 121.347 121.174 0.173 25685 11225 1 15 . 1 1 131 131 LEU C C 131 177.522 177.522 174.993 2.529 25685 11226 1 15 . 1 1 131 131 LEU CA C 131 56.307 56.307 54.800 1.508 25685 11227 1 15 . 1 1 131 131 LEU CB C 131 41.711 41.711 42.330 -0.619 25685 11228 1 15 . 1 1 131 131 LEU H H 131 8.071 8.071 7.311 0.760 25685 11229 1 15 . 1 1 132 132 LEU N N 132 118.162 118.162 126.297 -8.135 25685 11230 1 15 . 1 1 132 132 LEU C C 132 177.461 177.461 175.414 2.047 25685 11231 1 15 . 1 1 132 132 LEU CA C 132 55.264 55.264 56.525 -1.261 25685 11232 1 15 . 1 1 132 132 LEU CB C 132 41.613 41.613 42.826 -1.213 25685 11233 1 15 . 1 1 132 132 LEU H H 132 7.810 7.810 8.435 -0.625 25685 11234 1 15 . 1 1 133 133 SER N N 133 114.244 114.244 114.095 0.149 25685 11235 1 15 . 1 1 133 133 SER C C 133 174.363 174.363 174.267 0.096 25685 11236 1 15 . 1 1 133 133 SER CA C 133 59.019 59.019 57.653 1.366 25685 11237 1 15 . 1 1 133 133 SER CB C 133 64.634 64.634 63.896 0.738 25685 11238 1 15 . 1 1 133 133 SER H H 133 7.829 7.829 7.961 -0.132 25685 11239 1 15 . 1 1 134 134 GLU N N 134 120.151 120.151 123.180 -3.029 25685 11240 1 15 . 1 1 134 134 GLU C C 134 175.935 175.935 175.814 0.121 25685 11241 1 15 . 1 1 134 134 GLU CA C 134 56.301 56.301 58.525 -2.224 25685 11242 1 15 . 1 1 134 134 GLU CB C 134 30.129 30.129 29.716 0.413 25685 11243 1 15 . 1 1 134 134 GLU H H 134 8.054 8.054 8.604 -0.550 25685 11244 1 15 . 1 1 135 135 ASN N N 135 118.890 118.890 117.956 0.934 25685 11245 1 15 . 1 1 135 135 ASN C C 135 174.272 174.272 174.332 -0.060 25685 11246 1 15 . 1 1 135 135 ASN CA C 135 51.390 51.390 53.021 -1.631 25685 11247 1 15 . 1 1 135 135 ASN CB C 135 39.129 39.129 38.102 1.027 25685 11248 1 15 . 1 1 135 135 ASN H H 135 8.305 8.305 8.422 -0.117 25685 11249 1 15 . 1 1 136 136 PRO C C 136 177.960 177.960 178.293 -0.333 25685 11250 1 15 . 1 1 136 136 PRO CA C 136 64.530 64.530 64.750 -0.220 25685 11251 1 15 . 1 1 136 136 PRO CB C 136 31.809 31.809 32.516 -0.707 25685 11252 1 15 . 1 1 137 137 LEU N N 137 117.735 117.735 120.165 -2.430 25685 11253 1 15 . 1 1 137 137 LEU C C 137 179.217 179.217 179.339 -0.122 25685 11254 1 15 . 1 1 137 137 LEU CA C 137 57.039 57.039 58.373 -1.334 25685 11255 1 15 . 1 1 137 137 LEU CB C 137 40.799 40.799 41.109 -0.310 25685 11256 1 15 . 1 1 137 137 LEU H H 137 8.248 8.248 7.901 0.347 25685 11257 1 15 . 1 1 138 138 VAL N N 138 119.589 119.589 119.239 0.350 25685 11258 1 15 . 1 1 138 138 VAL C C 138 177.894 177.894 176.922 0.972 25685 11259 1 15 . 1 1 138 138 VAL CA C 138 64.727 64.727 66.432 -1.705 25685 11260 1 15 . 1 1 138 138 VAL CB C 138 31.347 31.347 31.525 -0.178 25685 11261 1 15 . 1 1 138 138 VAL H H 138 7.483 7.483 7.686 -0.203 25685 11262 1 15 . 1 1 139 139 MET N N 139 119.431 119.431 119.106 0.325 25685 11263 1 15 . 1 1 139 139 MET C C 139 177.988 177.988 178.105 -0.117 25685 11264 1 15 . 1 1 139 139 MET CA C 139 57.403 57.403 59.105 -1.702 25685 11265 1 15 . 1 1 139 139 MET CB C 139 31.709 31.709 32.450 -0.741 25685 11266 1 15 . 1 1 139 139 MET H H 139 7.837 7.837 7.330 0.507 25685 11267 1 15 . 1 1 140 140 LEU N N 140 119.686 119.686 120.342 -0.656 25685 11268 1 15 . 1 1 140 140 LEU C C 140 177.916 177.916 178.525 -0.609 25685 11269 1 15 . 1 1 140 140 LEU CA C 140 56.877 56.877 58.286 -1.409 25685 11270 1 15 . 1 1 140 140 LEU CB C 140 41.491 41.491 41.976 -0.485 25685 11271 1 15 . 1 1 140 140 LEU H H 140 7.926 7.926 8.710 -0.784 25685 11272 1 15 . 1 1 141 141 SER N N 141 114.167 114.167 115.035 -0.868 25685 11273 1 15 . 1 1 141 141 SER C C 141 176.030 176.030 177.223 -1.193 25685 11274 1 15 . 1 1 141 141 SER CA C 141 60.425 60.425 61.864 -1.439 25685 11275 1 15 . 1 1 141 141 SER CB C 141 63.956 63.956 63.353 0.603 25685 11276 1 15 . 1 1 141 141 SER H H 141 7.757 7.757 8.121 -0.364 25685 11277 1 15 . 1 1 142 142 TYR N N 142 121.679 121.679 121.543 0.136 25685 11278 1 15 . 1 1 142 142 TYR C C 142 177.659 177.659 178.441 -0.782 25685 11279 1 15 . 1 1 142 142 TYR CA C 142 59.673 59.673 58.944 0.729 25685 11280 1 15 . 1 1 142 142 TYR CB C 142 38.079 38.079 37.568 0.511 25685 11281 1 15 . 1 1 142 142 TYR H H 142 7.965 7.965 8.733 -0.768 25685 11282 1 15 . 1 1 143 143 GLY N N 143 107.396 107.396 107.435 -0.039 25685 11283 1 15 . 1 1 143 143 GLY C C 143 174.877 174.877 176.034 -1.157 25685 11284 1 15 . 1 1 143 143 GLY CA C 143 46.343 46.343 47.789 -1.446 25685 11285 1 15 . 1 1 143 143 GLY H H 143 8.177 8.177 8.638 -0.461 25685 11286 1 15 . 1 1 144 144 LEU N N 144 120.477 120.477 122.449 -1.972 25685 11287 1 15 . 1 1 144 144 LEU C C 144 178.504 178.504 179.350 -0.846 25685 11288 1 15 . 1 1 144 144 LEU CA C 144 56.270 56.270 57.767 -1.497 25685 11289 1 15 . 1 1 144 144 LEU CB C 144 41.662 41.662 41.569 0.093 25685 11290 1 15 . 1 1 144 144 LEU H H 144 8.055 8.055 7.518 0.537 25685 11291 1 15 . 1 1 145 145 GLY N N 145 106.847 106.847 106.709 0.138 25685 11292 1 15 . 1 1 145 145 GLY C C 145 175.375 175.375 175.928 -0.553 25685 11293 1 15 . 1 1 145 145 GLY CA C 145 45.582 45.582 47.012 -1.430 25685 11294 1 15 . 1 1 145 145 GLY H H 145 8.066 8.066 7.717 0.349 25685 11295 1 15 . 1 1 146 146 MET N N 146 120.376 120.376 121.419 -1.043 25685 11296 1 15 . 1 1 146 146 MET C C 146 176.663 176.663 178.433 -1.770 25685 11297 1 15 . 1 1 146 146 MET CA C 146 57.030 57.030 57.727 -0.697 25685 11298 1 15 . 1 1 146 146 MET CB C 146 30.720 30.720 31.869 -1.149 25685 11299 1 15 . 1 1 146 146 MET H H 146 8.157 8.157 8.468 -0.311 25685 11300 1 15 . 1 1 147 147 ALA N N 147 123.038 123.038 121.839 1.199 25685 11301 1 15 . 1 1 147 147 ALA C C 147 178.917 178.917 179.535 -0.618 25685 11302 1 15 . 1 1 147 147 ALA CA C 147 54.201 54.201 54.867 -0.666 25685 11303 1 15 . 1 1 147 147 ALA CB C 147 18.810 18.810 18.082 0.728 25685 11304 1 15 . 1 1 147 147 ALA H H 147 8.336 8.336 7.829 0.507 25685 11305 1 15 . 1 1 148 148 VAL N N 148 117.795 117.795 117.554 0.241 25685 11306 1 15 . 1 1 148 148 VAL C C 148 176.891 176.891 177.391 -0.500 25685 11307 1 15 . 1 1 148 148 VAL CA C 148 64.157 64.157 65.782 -1.625 25685 11308 1 15 . 1 1 148 148 VAL CB C 148 31.529 31.529 31.988 -0.459 25685 11309 1 15 . 1 1 148 148 VAL H H 148 7.908 7.908 7.419 0.489 25685 11310 1 15 . 1 1 149 149 THR N N 149 116.069 116.069 114.196 1.873 25685 11311 1 15 . 1 1 149 149 THR C C 149 176.054 176.054 176.915 -0.861 25685 11312 1 15 . 1 1 149 149 THR CA C 149 63.308 63.308 66.365 -3.057 25685 11313 1 15 . 1 1 149 149 THR H H 149 7.414 7.414 7.533 -0.119 25685 11314 1 15 . 1 1 150 150 ILE N N 150 121.971 121.971 118.627 3.344 25685 11315 1 15 . 1 1 150 150 ILE C C 150 177.715 177.715 177.292 0.423 25685 11316 1 15 . 1 1 150 150 ILE CA C 150 64.319 64.319 64.382 -0.063 25685 11317 1 15 . 1 1 150 150 ILE CB C 150 36.628 36.628 36.859 -0.231 25685 11318 1 15 . 1 1 150 150 ILE H H 150 8.772 8.772 7.658 1.114 25685 11319 1 15 . 1 1 151 151 ALA N N 151 122.272 122.272 122.652 -0.380 25685 11320 1 15 . 1 1 151 151 ALA C C 151 180.370 180.370 179.355 1.015 25685 11321 1 15 . 1 1 151 151 ALA CA C 151 55.336 55.336 55.450 -0.114 25685 11322 1 15 . 1 1 151 151 ALA CB C 151 18.107 18.107 17.702 0.405 25685 11323 1 15 . 1 1 151 151 ALA H H 151 8.163 8.163 7.770 0.393 25685 11324 1 15 . 1 1 152 152 ALA N N 152 120.648 120.648 120.450 0.198 25685 11325 1 15 . 1 1 152 152 ALA C C 152 181.019 181.019 179.570 1.449 25685 11326 1 15 . 1 1 152 152 ALA CA C 152 54.944 54.944 54.742 0.202 25685 11327 1 15 . 1 1 152 152 ALA CB C 152 18.963 18.963 18.340 0.623 25685 11328 1 15 . 1 1 152 152 ALA H H 152 7.877 7.877 7.621 0.256 25685 11329 1 15 . 1 1 153 153 VAL N N 153 119.372 119.372 119.302 0.070 25685 11330 1 15 . 1 1 153 153 VAL C C 153 178.197 178.197 178.371 -0.174 25685 11331 1 15 . 1 1 153 153 VAL CA C 153 66.289 66.289 65.089 1.200 25685 11332 1 15 . 1 1 153 153 VAL CB C 153 30.770 30.770 31.292 -0.522 25685 11333 1 15 . 1 1 153 153 VAL H H 153 8.118 8.118 7.714 0.404 25685 11334 1 15 . 1 1 154 154 PHE N N 154 120.362 120.362 119.707 0.655 25685 11335 1 15 . 1 1 154 154 PHE C C 154 177.733 177.733 177.804 -0.071 25685 11336 1 15 . 1 1 154 154 PHE CA C 154 61.412 61.412 61.611 -0.200 25685 11337 1 15 . 1 1 154 154 PHE CB C 154 38.465 38.465 38.536 -0.071 25685 11338 1 15 . 1 1 154 154 PHE H H 154 8.508 8.508 9.120 -0.612 25685 11339 1 15 . 1 1 155 155 LYS N N 155 118.894 118.894 119.743 -0.849 25685 11340 1 15 . 1 1 155 155 LYS C C 155 179.940 179.940 178.466 1.474 25685 11341 1 15 . 1 1 155 155 LYS CA C 155 58.969 58.969 59.437 -0.468 25685 11342 1 15 . 1 1 155 155 LYS CB C 155 31.725 31.725 32.275 -0.550 25685 11343 1 15 . 1 1 155 155 LYS H H 155 8.035 8.035 7.936 0.099 25685 11344 1 15 . 1 1 156 156 MET N N 156 118.853 118.853 116.760 2.093 25685 11345 1 15 . 1 1 156 156 MET C C 156 179.245 179.245 177.524 1.721 25685 11346 1 15 . 1 1 156 156 MET CA C 156 58.518 58.518 57.838 0.680 25685 11347 1 15 . 1 1 156 156 MET CB C 156 31.912 31.912 31.200 0.712 25685 11348 1 15 . 1 1 156 156 MET H H 156 8.014 8.014 7.700 0.314 25685 11349 1 15 . 1 1 157 157 GLY N N 157 108.239 108.239 106.494 1.745 25685 11350 1 15 . 1 1 157 157 GLY C C 157 174.637 174.637 175.174 -0.537 25685 11351 1 15 . 1 1 157 157 GLY CA C 157 47.204 47.204 46.882 0.322 25685 11352 1 15 . 1 1 157 157 GLY H H 157 8.614 8.614 7.630 0.984 25685 11353 1 15 . 1 1 158 158 GLU N N 158 122.902 122.902 119.524 3.378 25685 11354 1 15 . 1 1 158 158 GLU C C 158 177.851 177.851 176.242 1.609 25685 11355 1 15 . 1 1 158 158 GLU CA C 158 60.203 60.203 56.986 3.217 25685 11356 1 15 . 1 1 158 158 GLU CB C 158 28.870 28.870 31.783 -2.913 25685 11357 1 15 . 1 1 158 158 GLU H H 158 8.550 8.550 7.564 0.986 25685 11358 1 15 . 1 1 159 159 LYS N N 159 117.932 117.932 117.912 0.020 25685 11359 1 15 . 1 1 159 159 LYS C C 159 179.529 179.529 175.770 3.759 25685 11360 1 15 . 1 1 159 159 LYS CA C 159 59.419 59.419 55.713 3.706 25685 11361 1 15 . 1 1 159 159 LYS CB C 159 31.759 31.759 34.566 -2.807 25685 11362 1 15 . 1 1 159 159 LYS H H 159 7.641 7.641 7.369 0.272 25685 11363 1 15 . 1 1 160 160 PHE N N 160 120.614 120.614 123.104 -2.490 25685 11364 1 15 . 1 1 160 160 PHE C C 160 178.511 178.511 177.448 1.063 25685 11365 1 15 . 1 1 160 160 PHE CA C 160 61.580 61.580 59.191 2.389 25685 11366 1 15 . 1 1 160 160 PHE CB C 160 39.909 39.909 39.557 0.352 25685 11367 1 15 . 1 1 160 160 PHE H H 160 8.026 8.026 8.553 -0.527 25685 11368 1 15 . 1 1 161 161 VAL N N 161 119.870 119.870 118.476 1.394 25685 11369 1 15 . 1 1 161 161 VAL C C 161 177.347 177.347 175.549 1.798 25685 11370 1 15 . 1 1 161 161 VAL CA C 161 66.121 66.121 63.043 3.078 25685 11371 1 15 . 1 1 161 161 VAL CB C 161 30.935 30.935 32.769 -1.834 25685 11372 1 15 . 1 1 161 161 VAL H H 161 8.628 8.628 8.345 0.283 25685 11373 1 15 . 1 1 162 162 LYS N N 162 116.237 116.237 118.064 -1.827 25685 11374 1 15 . 1 1 162 162 LYS C C 162 179.197 179.197 174.852 4.345 25685 11375 1 15 . 1 1 162 162 LYS CA C 162 60.037 60.037 56.974 3.063 25685 11376 1 15 . 1 1 162 162 LYS CB C 162 31.333 31.333 31.867 -0.534 25685 11377 1 15 . 1 1 162 162 LYS H H 162 7.843 7.843 7.735 0.108 25685 11378 1 15 . 1 1 163 163 ALA N N 163 119.197 119.197 119.311 -0.114 25685 11379 1 15 . 1 1 163 163 ALA C C 163 178.635 178.635 175.960 2.675 25685 11380 1 15 . 1 1 163 163 ALA CA C 163 53.681 53.681 52.331 1.350 25685 11381 1 15 . 1 1 163 163 ALA CB C 163 19.586 19.586 19.897 -0.311 25685 11382 1 15 . 1 1 163 163 ALA H H 163 7.630 7.630 7.942 -0.312 25685 11383 1 15 . 1 1 164 164 ASN N N 164 115.956 115.956 116.853 -0.897 25685 11384 1 15 . 1 1 164 164 ASN C C 164 175.556 175.556 175.617 -0.061 25685 11385 1 15 . 1 1 164 164 ASN CA C 164 52.267 52.267 52.936 -0.669 25685 11386 1 15 . 1 1 164 164 ASN CB C 164 39.148 39.148 38.962 0.185 25685 11387 1 15 . 1 1 164 164 ASN H H 164 7.326 7.326 8.299 -0.973 25685 11388 1 15 . 1 1 165 165 PHE N N 165 121.612 121.612 122.683 -1.071 25685 11389 1 15 . 1 1 165 165 PHE C C 165 177.069 177.069 177.324 -0.255 25685 11390 1 15 . 1 1 165 165 PHE CA C 165 62.921 62.921 61.199 1.722 25685 11391 1 15 . 1 1 165 165 PHE CB C 165 39.427 39.427 39.023 0.404 25685 11392 1 15 . 1 1 165 165 PHE H H 165 7.408 7.408 8.747 -1.339 25685 11393 1 15 . 1 1 166 166 GLN N N 166 117.147 117.147 118.317 -1.170 25685 11394 1 15 . 1 1 166 166 GLN C C 166 178.922 178.922 178.478 0.444 25685 11395 1 15 . 1 1 166 166 GLN CA C 166 59.262 59.262 58.897 0.365 25685 11396 1 15 . 1 1 166 166 GLN CB C 166 26.811 26.811 27.864 -1.053 25685 11397 1 15 . 1 1 166 166 GLN H H 166 8.605 8.605 8.822 -0.217 25685 11398 1 15 . 1 1 167 167 LEU N N 167 121.946 121.946 118.170 3.776 25685 11399 1 15 . 1 1 167 167 LEU C C 167 178.863 178.863 178.768 0.095 25685 11400 1 15 . 1 1 167 167 LEU CA C 167 58.039 58.039 57.822 0.217 25685 11401 1 15 . 1 1 167 167 LEU CB C 167 41.130 41.130 41.499 -0.369 25685 11402 1 15 . 1 1 167 167 LEU H H 167 7.892 7.892 7.667 0.225 25685 11403 1 15 . 1 1 168 168 ILE N N 168 118.751 118.751 115.372 3.379 25685 11404 1 15 . 1 1 168 168 ILE C C 168 179.908 179.908 177.383 2.525 25685 11405 1 15 . 1 1 168 168 ILE CA C 168 63.886 63.886 64.108 -0.221 25685 11406 1 15 . 1 1 168 168 ILE CB C 168 36.170 36.170 37.379 -1.209 25685 11407 1 15 . 1 1 168 168 ILE H H 168 8.065 8.065 7.384 0.681 25685 11408 1 15 . 1 1 169 169 ARG N N 169 125.851 125.851 119.187 6.664 25685 11409 1 15 . 1 1 169 169 ARG C C 169 177.579 177.579 178.376 -0.797 25685 11410 1 15 . 1 1 169 169 ARG CA C 169 60.306 60.306 59.309 0.997 25685 11411 1 15 . 1 1 169 169 ARG CB C 169 29.224 29.224 29.851 -0.627 25685 11412 1 15 . 1 1 169 169 ARG H H 169 8.995 8.995 7.886 1.109 25685 11413 1 15 . 1 1 170 170 LYS N N 170 119.586 119.586 118.743 0.843 25685 11414 1 15 . 1 1 170 170 LYS C C 170 178.584 178.584 178.338 0.246 25685 11415 1 15 . 1 1 170 170 LYS CA C 170 60.293 60.293 59.277 1.016 25685 11416 1 15 . 1 1 170 170 LYS CB C 170 32.530 32.530 31.752 0.778 25685 11417 1 15 . 1 1 170 170 LYS H H 170 7.663 7.663 7.695 -0.032 25685 11418 1 15 . 1 1 171 171 VAL N N 171 118.348 118.348 119.163 -0.815 25685 11419 1 15 . 1 1 171 171 VAL C C 171 177.478 177.478 177.180 0.298 25685 11420 1 15 . 1 1 171 171 VAL CA C 171 66.641 66.641 66.091 0.550 25685 11421 1 15 . 1 1 171 171 VAL CB C 171 31.565 31.565 31.933 -0.368 25685 11422 1 15 . 1 1 171 171 VAL H H 171 8.515 8.515 7.781 0.734 25685 11423 1 15 . 1 1 172 172 THR N N 172 115.172 115.172 114.128 1.044 25685 11424 1 15 . 1 1 172 172 THR C C 172 176.320 176.320 176.264 0.056 25685 11425 1 15 . 1 1 172 172 THR H H 172 8.416 8.416 7.713 0.703 25685 11426 1 15 . 1 1 173 173 GLY N N 173 108.801 108.801 109.160 -0.359 25685 11427 1 15 . 1 1 173 173 GLY C C 173 174.138 174.138 175.018 -0.880 25685 11428 1 15 . 1 1 173 173 GLY CA C 173 47.769 47.769 46.470 1.299 25685 11429 1 15 . 1 1 173 173 GLY H H 173 8.505 8.505 7.715 0.790 25685 11430 1 15 . 1 1 174 174 ALA N N 174 123.573 123.573 123.523 0.050 25685 11431 1 15 . 1 1 174 174 ALA C C 174 178.782 178.782 178.489 0.293 25685 11432 1 15 . 1 1 174 174 ALA CA C 174 55.604 55.604 54.269 1.335 25685 11433 1 15 . 1 1 174 174 ALA CB C 174 18.778 18.778 18.125 0.653 25685 11434 1 15 . 1 1 174 174 ALA H H 174 8.038 8.038 7.140 0.898 25685 11435 1 15 . 1 1 175 175 ILE N N 175 118.501 118.501 118.989 -0.488 25685 11436 1 15 . 1 1 175 175 ILE C C 175 178.247 178.247 177.816 0.431 25685 11437 1 15 . 1 1 175 175 ILE CA C 175 65.412 65.412 64.477 0.935 25685 11438 1 15 . 1 1 175 175 ILE CB C 175 37.671 37.671 38.291 -0.620 25685 11439 1 15 . 1 1 175 175 ILE H H 175 7.897 7.897 7.180 0.717 25685 11440 1 15 . 1 1 176 176 VAL N N 176 120.104 120.104 120.041 0.063 25685 11441 1 15 . 1 1 176 176 VAL C C 176 177.945 177.945 177.748 0.197 25685 11442 1 15 . 1 1 176 176 VAL CA C 176 67.761 67.761 66.620 1.141 25685 11443 1 15 . 1 1 176 176 VAL CB C 176 30.662 30.662 31.958 -1.296 25685 11444 1 15 . 1 1 176 176 VAL H H 176 8.321 8.321 7.307 1.014 25685 11445 1 15 . 1 1 177 177 LEU N N 177 118.561 118.561 120.609 -2.048 25685 11446 1 15 . 1 1 177 177 LEU C C 177 178.563 178.563 178.836 -0.273 25685 11447 1 15 . 1 1 177 177 LEU CA C 177 58.094 58.094 58.330 -0.236 25685 11448 1 15 . 1 1 177 177 LEU CB C 177 41.061 41.061 41.453 -0.392 25685 11449 1 15 . 1 1 177 177 LEU H H 177 8.097 8.097 7.372 0.725 25685 11450 1 15 . 1 1 178 178 LEU N N 178 120.868 120.868 120.140 0.728 25685 11451 1 15 . 1 1 178 178 LEU C C 178 178.524 178.524 178.144 0.380 25685 11452 1 15 . 1 1 178 178 LEU CA C 178 57.767 57.767 58.645 -0.878 25685 11453 1 15 . 1 1 178 178 LEU CB C 178 40.886 40.886 42.137 -1.251 25685 11454 1 15 . 1 1 178 178 LEU H H 178 8.229 8.229 7.675 0.554 25685 11455 1 15 . 1 1 179 179 TYR N N 179 119.355 119.355 118.665 0.690 25685 11456 1 15 . 1 1 179 179 TYR C C 179 180.059 180.059 177.471 2.588 25685 11457 1 15 . 1 1 179 179 TYR CA C 179 63.844 63.844 60.643 3.201 25685 11458 1 15 . 1 1 179 179 TYR CB C 179 39.508 39.508 38.195 1.313 25685 11459 1 15 . 1 1 179 179 TYR H H 179 8.759 8.759 7.803 0.956 25685 11460 1 15 . 1 1 180 180 LEU N N 180 118.984 118.984 119.026 -0.042 25685 11461 1 15 . 1 1 180 180 LEU C C 180 179.079 179.079 178.938 0.141 25685 11462 1 15 . 1 1 180 180 LEU CA C 180 58.879 58.879 57.120 1.760 25685 11463 1 15 . 1 1 180 180 LEU CB C 180 41.899 41.899 40.616 1.283 25685 11464 1 15 . 1 1 180 180 LEU H H 180 8.315 8.315 7.782 0.533 25685 11465 1 15 . 1 1 181 181 ALA N N 181 121.826 121.826 122.309 -0.483 25685 11466 1 15 . 1 1 181 181 ALA C C 181 180.009 180.009 179.149 0.860 25685 11467 1 15 . 1 1 181 181 ALA CA C 181 55.700 55.700 54.919 0.781 25685 11468 1 15 . 1 1 181 181 ALA CB C 181 17.713 17.713 18.535 -0.822 25685 11469 1 15 . 1 1 181 181 ALA H H 181 8.480 8.480 8.051 0.429 25685 11470 1 15 . 1 1 182 182 TYR N N 182 118.039 118.039 117.370 0.669 25685 11471 1 15 . 1 1 182 182 TYR CA C 182 59.038 59.038 61.456 -2.418 25685 11472 1 15 . 1 1 182 182 TYR H H 182 8.856 8.856 7.767 1.089 25685 11473 1 15 . 1 1 183 183 PHE N N 183 124.769 124.769 116.215 8.554 25685 11474 1 15 . 1 1 183 183 PHE CA C 183 63.566 63.566 60.017 3.549 25685 11475 1 15 . 1 1 183 183 PHE H H 183 9.764 9.764 7.482 2.282 25685 stop_ loop_ _SPARTA_output.Data_ID _SPARTA_output.Entity_delta_chem_shifts_ID _SPARTA_output.Conformer_ID _SPARTA_output.Data_type _SPARTA_output.Data_atom _SPARTA_output.Data_num_shifts _SPARTA_output.Data_value _SPARTA_output.Data_low_range _SPARTA_output.Data_high_range _SPARTA_output.Entry_ID 1 1 1 "Average Difference" N 156 2.963 0.389 2.946 25685 2 1 1 "Average Difference" HA 1 0.206 0.206 0.000 25685 3 1 1 "Average Difference" C 157 1.360 -0.487 1.274 25685 4 1 1 "Average Difference" CA 163 1.684 -0.456 1.626 25685 5 1 1 "Average Difference" CB 131 1.033 0.004 1.037 25685 6 1 1 "Average Difference" HN 157 0.679 -0.252 0.632 25685 7 1 2 "Average Difference" N 156 3.003 0.050 3.012 25685 8 1 2 "Average Difference" HA 1 0.203 0.203 0.000 25685 9 1 2 "Average Difference" C 157 1.283 -0.438 1.210 25685 10 1 2 "Average Difference" CA 163 1.624 -0.419 1.574 25685 11 1 2 "Average Difference" CB 131 1.040 0.057 1.042 25685 12 1 2 "Average Difference" HN 157 0.669 -0.195 0.642 25685 13 1 3 "Average Difference" N 156 2.914 0.010 2.923 25685 14 1 3 "Average Difference" HA 1 0.179 0.179 0.000 25685 15 1 3 "Average Difference" C 157 1.403 -0.539 1.299 25685 16 1 3 "Average Difference" CA 163 1.718 -0.493 1.651 25685 17 1 3 "Average Difference" CB 131 1.046 -0.011 1.050 25685 18 1 3 "Average Difference" HN 157 0.679 -0.287 0.618 25685 19 1 4 "Average Difference" N 156 3.232 0.240 3.234 25685 20 1 4 "Average Difference" HA 1 0.087 0.087 0.000 25685 21 1 4 "Average Difference" C 157 1.404 -0.492 1.320 25685 22 1 4 "Average Difference" CA 163 1.709 -0.443 1.656 25685 23 1 4 "Average Difference" CB 131 1.079 0.043 1.082 25685 24 1 4 "Average Difference" HN 157 0.668 -0.228 0.630 25685 25 1 5 "Average Difference" N 156 2.909 0.173 2.913 25685 26 1 5 "Average Difference" HA 1 0.205 0.205 0.000 25685 27 1 5 "Average Difference" C 157 1.332 -0.499 1.239 25685 28 1 5 "Average Difference" CA 163 1.646 -0.489 1.576 25685 29 1 5 "Average Difference" CB 131 1.107 0.067 1.109 25685 30 1 5 "Average Difference" HN 157 0.722 -0.259 0.676 25685 31 1 6 "Average Difference" N 156 2.999 0.215 3.000 25685 32 1 6 "Average Difference" HA 1 0.129 0.129 0.000 25685 33 1 6 "Average Difference" C 157 1.326 -0.453 1.250 25685 34 1 6 "Average Difference" CA 163 1.654 -0.495 1.583 25685 35 1 6 "Average Difference" CB 131 1.044 -0.018 1.048 25685 36 1 6 "Average Difference" HN 157 0.658 -0.220 0.622 25685 37 1 7 "Average Difference" N 156 2.953 0.073 2.961 25685 38 1 7 "Average Difference" HA 1 0.287 0.287 0.000 25685 39 1 7 "Average Difference" C 157 1.297 -0.412 1.234 25685 40 1 7 "Average Difference" CA 163 1.636 -0.422 1.586 25685 41 1 7 "Average Difference" CB 131 1.045 0.023 1.049 25685 42 1 7 "Average Difference" HN 157 0.699 -0.243 0.658 25685 43 1 8 "Average Difference" N 156 2.941 0.154 2.946 25685 44 1 8 "Average Difference" HA 1 0.195 0.195 0.000 25685 45 1 8 "Average Difference" C 157 1.365 -0.484 1.281 25685 46 1 8 "Average Difference" CA 163 1.739 -0.475 1.678 25685 47 1 8 "Average Difference" CB 131 1.060 -0.014 1.064 25685 48 1 8 "Average Difference" HN 157 0.686 -0.264 0.636 25685 49 1 9 "Average Difference" N 156 2.883 0.005 2.892 25685 50 1 9 "Average Difference" HA 1 0.013 0.013 0.000 25685 51 1 9 "Average Difference" C 157 1.376 -0.523 1.277 25685 52 1 9 "Average Difference" CA 163 1.677 -0.515 1.601 25685 53 1 9 "Average Difference" CB 131 0.969 0.004 0.973 25685 54 1 9 "Average Difference" HN 157 0.715 -0.279 0.660 25685 55 1 10 "Average Difference" N 156 2.993 -0.083 3.002 25685 56 1 10 "Average Difference" HA 1 0.242 0.242 0.000 25685 57 1 10 "Average Difference" C 157 1.354 -0.438 1.285 25685 58 1 10 "Average Difference" CA 163 1.640 -0.457 1.580 25685 59 1 10 "Average Difference" CB 131 0.958 0.027 0.961 25685 60 1 10 "Average Difference" HN 157 0.680 -0.216 0.647 25685 61 1 11 "Average Difference" N 156 3.189 0.227 3.192 25685 62 1 11 "Average Difference" HA 1 0.104 0.104 0.000 25685 63 1 11 "Average Difference" C 157 1.324 -0.512 1.225 25685 64 1 11 "Average Difference" CA 163 1.896 -0.578 1.811 25685 65 1 11 "Average Difference" CB 131 1.070 -0.028 1.073 25685 66 1 11 "Average Difference" HN 157 0.757 -0.231 0.724 25685 67 1 12 "Average Difference" N 156 2.658 0.007 2.666 25685 68 1 12 "Average Difference" HA 1 0.080 0.080 0.000 25685 69 1 12 "Average Difference" C 157 1.403 -0.508 1.312 25685 70 1 12 "Average Difference" CA 163 1.589 -0.390 1.545 25685 71 1 12 "Average Difference" CB 131 0.972 -0.040 0.975 25685 72 1 12 "Average Difference" HN 157 0.714 -0.262 0.666 25685 73 1 13 "Average Difference" N 156 2.966 0.179 2.970 25685 74 1 13 "Average Difference" HA 1 0.260 0.260 0.000 25685 75 1 13 "Average Difference" C 157 1.314 -0.501 1.219 25685 76 1 13 "Average Difference" CA 163 1.666 -0.404 1.622 25685 77 1 13 "Average Difference" CB 131 0.999 -0.044 1.002 25685 78 1 13 "Average Difference" HN 157 0.672 -0.251 0.625 25685 79 1 14 "Average Difference" N 156 3.158 0.290 3.155 25685 80 1 14 "Average Difference" HA 1 0.184 0.184 0.000 25685 81 1 14 "Average Difference" C 157 1.345 -0.513 1.247 25685 82 1 14 "Average Difference" CA 163 1.677 -0.492 1.608 25685 83 1 14 "Average Difference" CB 131 1.138 0.073 1.140 25685 84 1 14 "Average Difference" HN 157 0.669 -0.235 0.628 25685 85 1 15 "Average Difference" N 156 2.754 0.084 2.762 25685 86 1 15 "Average Difference" HA 1 0.215 0.215 0.000 25685 87 1 15 "Average Difference" C 157 1.335 -0.482 1.249 25685 88 1 15 "Average Difference" CA 163 1.603 -0.441 1.545 25685 89 1 15 "Average Difference" CB 131 0.962 0.026 0.965 25685 90 1 15 "Average Difference" HN 157 0.731 -0.281 0.677 25685 stop_ save_ save_delta_chem_shifts_average _Entity_delta_chem_shifts.Sf_category delta_chem_shifts _Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_average _Entity_delta_chem_shifts.Model_type average _Entity_delta_chem_shifts.Entry_ID 25685 _Entity_delta_chem_shifts.ID 2 _Entity_delta_chem_shifts.Details ; This saveframe contains the averaged SPARTA chemical shift over all the models used. ; loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 . 1 1 4 4 ALA N N 4 121.533 121.533 123.233 -1.700 25685 2 1 . 1 1 4 4 ALA C C 4 177.632 177.632 178.749 -1.117 25685 3 1 . 1 1 4 4 ALA CA C 4 55.117 55.117 55.166 -0.049 25685 4 1 . 1 1 4 4 ALA CB C 4 18.448 18.448 18.273 0.175 25685 5 1 . 1 1 4 4 ALA H H 4 7.977 7.977 8.206 -0.229 25685 6 1 . 1 1 5 5 PHE N N 5 119.988 119.988 118.496 1.492 25685 7 1 . 1 1 5 5 PHE CA C 5 60.759 60.759 60.404 0.355 25685 8 1 . 1 1 5 5 PHE CB C 5 39.221 39.221 38.371 0.850 25685 9 1 . 1 1 5 5 PHE H H 5 8.210 8.210 8.108 0.102 25685 10 1 . 1 1 6 6 ALA C C 6 179.794 179.794 179.364 0.430 25685 11 1 . 1 1 6 6 ALA CA C 6 55.619 55.619 54.703 0.916 25685 12 1 . 1 1 6 6 ALA CB C 6 17.911 17.911 17.827 0.084 25685 13 1 . 1 1 6 6 ALA H H 6 8.417 8.417 7.681 0.736 25685 14 1 . 1 1 7 7 LEU N N 7 115.852 115.852 118.851 -2.999 25685 15 1 . 1 1 7 7 LEU C C 7 180.196 180.196 179.024 1.172 25685 16 1 . 1 1 7 7 LEU CA C 7 57.528 57.528 57.423 0.105 25685 17 1 . 1 1 7 7 LEU CB C 7 40.060 40.060 41.483 -1.423 25685 18 1 . 1 1 7 7 LEU H H 7 8.741 8.741 7.602 1.139 25685 19 1 . 1 1 8 8 GLY N N 8 110.199 110.199 106.918 3.281 25685 20 1 . 1 1 8 8 GLY C C 8 176.430 176.430 176.173 0.257 25685 21 1 . 1 1 8 8 GLY CA C 8 46.960 46.960 47.374 -0.414 25685 22 1 . 1 1 8 8 GLY H H 8 8.179 8.179 7.771 0.408 25685 23 1 . 1 1 9 9 ILE N N 9 122.346 122.346 121.466 0.880 25685 24 1 . 1 1 9 9 ILE C C 9 178.143 178.143 177.379 0.764 25685 25 1 . 1 1 9 9 ILE CA C 9 65.048 65.048 63.546 1.501 25685 26 1 . 1 1 9 9 ILE CB C 9 36.841 36.841 37.498 -0.657 25685 27 1 . 1 1 9 9 ILE H H 9 7.788 7.788 7.323 0.465 25685 28 1 . 1 1 10 10 LEU N N 10 117.560 117.560 119.688 -2.128 25685 29 1 . 1 1 10 10 LEU C C 10 179.501 179.501 178.707 0.794 25685 30 1 . 1 1 10 10 LEU CA C 10 58.068 58.068 58.175 -0.107 25685 31 1 . 1 1 10 10 LEU CB C 10 40.776 40.776 41.072 -0.296 25685 32 1 . 1 1 10 10 LEU H H 10 8.044 8.044 7.586 0.458 25685 33 1 . 1 1 11 11 SER N N 11 113.830 113.830 114.020 -0.190 25685 34 1 . 1 1 11 11 SER CA C 11 61.769 61.769 61.252 0.517 25685 35 1 . 1 1 11 11 SER CB C 11 63.395 63.395 63.159 0.236 25685 36 1 . 1 1 11 11 SER H H 11 8.140 8.140 7.575 0.565 25685 37 1 . 1 1 12 12 VAL N N 12 121.343 121.343 120.769 0.574 25685 38 1 . 1 1 12 12 VAL C C 12 176.753 176.753 177.597 -0.844 25685 39 1 . 1 1 12 12 VAL CA C 12 64.583 64.583 65.207 -0.624 25685 40 1 . 1 1 12 12 VAL CB C 12 31.067 31.067 31.233 -0.166 25685 41 1 . 1 1 12 12 VAL H H 12 7.587 7.587 7.334 0.253 25685 42 1 . 1 1 13 13 PHE N N 13 115.225 115.225 119.815 -4.590 25685 43 1 . 1 1 13 13 PHE C C 13 177.349 177.349 175.952 1.397 25685 44 1 . 1 1 13 13 PHE CA C 13 58.730 58.730 60.587 -1.857 25685 45 1 . 1 1 13 13 PHE CB C 13 39.785 39.785 39.168 0.617 25685 46 1 . 1 1 13 13 PHE H H 13 7.474 7.474 7.709 -0.235 25685 47 1 . 1 1 14 14 SER N N 14 116.075 116.075 114.896 1.179 25685 48 1 . 1 1 14 14 SER H H 14 7.955 7.955 7.934 0.021 25685 49 1 . 1 1 15 15 PRO C C 15 177.590 177.590 176.103 1.487 25685 50 1 . 1 1 15 15 PRO CA C 15 65.464 65.464 62.808 2.656 25685 51 1 . 1 1 16 16 ALA N N 16 116.288 116.288 120.045 -3.757 25685 52 1 . 1 1 16 16 ALA C C 16 177.563 177.563 176.724 0.839 25685 53 1 . 1 1 16 16 ALA CA C 16 53.010 53.010 51.673 1.337 25685 54 1 . 1 1 16 16 ALA CB C 16 19.975 19.975 19.630 0.345 25685 55 1 . 1 1 16 16 ALA H H 16 7.455 7.455 7.912 -0.457 25685 56 1 . 1 1 17 17 VAL N N 17 112.072 112.072 119.629 -7.557 25685 57 1 . 1 1 17 17 VAL CA C 17 63.117 63.117 62.996 0.121 25685 58 1 . 1 1 17 17 VAL CB C 17 33.209 33.209 32.227 0.982 25685 59 1 . 1 1 17 17 VAL H H 17 7.525 7.525 8.394 -0.869 25685 60 1 . 1 1 18 18 LEU N N 18 121.205 121.205 123.679 -2.474 25685 61 1 . 1 1 18 18 LEU CA C 18 58.971 58.971 57.729 1.242 25685 62 1 . 1 1 18 18 LEU CB C 18 41.161 41.161 39.935 1.226 25685 63 1 . 1 1 18 18 LEU H H 18 8.191 8.191 8.394 -0.203 25685 64 1 . 1 1 19 19 PRO C C 19 177.697 177.697 177.050 0.647 25685 65 1 . 1 1 19 19 PRO CA C 19 65.181 65.181 64.030 1.151 25685 66 1 . 1 1 20 20 VAL N N 20 111.723 111.723 114.231 -2.508 25685 67 1 . 1 1 20 20 VAL C C 20 177.137 177.137 175.563 1.574 25685 68 1 . 1 1 20 20 VAL CA C 20 62.494 62.494 63.259 -0.765 25685 69 1 . 1 1 20 20 VAL CB C 20 31.677 31.677 31.047 0.630 25685 70 1 . 1 1 20 20 VAL H H 20 7.571 7.571 7.872 -0.301 25685 71 1 . 1 1 21 21 VAL N N 21 121.705 121.705 118.588 3.117 25685 72 1 . 1 1 21 21 VAL CA C 21 68.305 68.305 63.906 4.399 25685 73 1 . 1 1 21 21 VAL H H 21 7.732 7.732 8.090 -0.358 25685 74 1 . 1 1 24 24 ILE C C 24 174.359 174.359 175.646 -1.287 25685 75 1 . 1 1 25 25 PHE N N 25 120.132 120.132 121.839 -1.707 25685 76 1 . 1 1 25 25 PHE C C 25 175.945 175.945 175.127 0.818 25685 77 1 . 1 1 25 25 PHE CA C 25 60.544 60.544 58.678 1.866 25685 78 1 . 1 1 25 25 PHE H H 25 8.082 8.082 8.504 -0.422 25685 79 1 . 1 1 26 26 ALA N N 26 121.341 121.341 121.937 -0.596 25685 80 1 . 1 1 26 26 ALA CB C 26 19.784 19.784 20.740 -0.956 25685 81 1 . 1 1 26 26 ALA H H 26 7.539 7.539 7.766 -0.227 25685 82 1 . 1 1 27 27 GLY N N 27 107.530 107.530 106.113 1.417 25685 83 1 . 1 1 27 27 GLY C C 27 174.252 174.252 172.985 1.267 25685 84 1 . 1 1 27 27 GLY CA C 27 45.474 45.474 44.885 0.589 25685 85 1 . 1 1 27 27 GLY H H 27 7.997 7.997 8.437 -0.440 25685 86 1 . 1 1 28 28 SER N N 28 116.299 116.299 115.590 0.709 25685 87 1 . 1 1 28 28 SER C C 28 175.759 175.759 173.523 2.236 25685 88 1 . 1 1 28 28 SER CA C 28 58.526 58.526 57.844 0.682 25685 89 1 . 1 1 28 28 SER CB C 28 64.373 64.373 64.286 0.087 25685 90 1 . 1 1 28 28 SER H H 28 8.115 8.115 8.401 -0.286 25685 91 1 . 1 1 34 34 ASP C C 34 177.621 177.621 178.275 -0.654 25685 92 1 . 1 1 34 34 ASP CA C 34 57.082 57.082 57.373 -0.291 25685 93 1 . 1 1 35 35 ALA N N 35 120.662 120.662 121.832 -1.170 25685 94 1 . 1 1 35 35 ALA C C 35 179.168 179.168 179.541 -0.373 25685 95 1 . 1 1 35 35 ALA CA C 35 55.459 55.459 54.692 0.767 25685 96 1 . 1 1 35 35 ALA CB C 35 18.819 18.819 18.210 0.609 25685 97 1 . 1 1 35 35 ALA H H 35 8.090 8.090 7.425 0.665 25685 98 1 . 1 1 36 36 PHE N N 36 117.638 117.638 118.715 -1.077 25685 99 1 . 1 1 36 36 PHE C C 36 177.057 177.057 177.461 -0.404 25685 100 1 . 1 1 36 36 PHE CA C 36 61.472 61.472 61.371 0.101 25685 101 1 . 1 1 36 36 PHE CB C 36 38.860 38.860 39.022 -0.162 25685 102 1 . 1 1 36 36 PHE H H 36 8.227 8.227 7.859 0.368 25685 103 1 . 1 1 37 37 LEU N N 37 119.312 119.312 119.649 -0.337 25685 104 1 . 1 1 37 37 LEU C C 37 179.798 179.798 178.718 1.080 25685 105 1 . 1 1 37 37 LEU CA C 37 58.181 58.181 57.987 0.194 25685 106 1 . 1 1 37 37 LEU CB C 37 40.835 40.835 41.606 -0.771 25685 107 1 . 1 1 37 37 LEU H H 37 8.588 8.588 7.780 0.808 25685 108 1 . 1 1 38 38 ILE N N 38 119.057 119.057 118.692 0.365 25685 109 1 . 1 1 38 38 ILE C C 38 177.597 177.597 177.718 -0.121 25685 110 1 . 1 1 38 38 ILE CA C 38 64.827 64.827 64.512 0.315 25685 111 1 . 1 1 38 38 ILE CB C 38 36.321 36.321 37.392 -1.071 25685 112 1 . 1 1 38 38 ILE H H 38 7.932 7.932 7.474 0.458 25685 113 1 . 1 1 39 39 VAL N N 39 118.758 118.758 117.545 1.213 25685 114 1 . 1 1 39 39 VAL C C 39 179.533 179.533 177.504 2.029 25685 115 1 . 1 1 39 39 VAL CA C 39 66.687 66.687 66.034 0.653 25685 116 1 . 1 1 39 39 VAL CB C 39 30.598 30.598 31.058 -0.460 25685 117 1 . 1 1 39 39 VAL H H 39 7.922 7.922 7.373 0.549 25685 118 1 . 1 1 40 40 ALA N N 40 125.385 125.385 122.094 3.291 25685 119 1 . 1 1 40 40 ALA C C 40 179.200 179.200 179.664 -0.464 25685 120 1 . 1 1 40 40 ALA CA C 40 55.283 55.283 54.873 0.410 25685 121 1 . 1 1 40 40 ALA CB C 40 17.197 17.197 18.371 -1.174 25685 122 1 . 1 1 40 40 ALA H H 40 9.091 9.091 7.432 1.659 25685 123 1 . 1 1 41 41 GLY N N 41 106.978 106.978 106.776 0.202 25685 124 1 . 1 1 41 41 GLY C C 41 176.171 176.171 175.919 0.252 25685 125 1 . 1 1 41 41 GLY CA C 41 47.322 47.322 47.041 0.281 25685 126 1 . 1 1 41 41 GLY H H 41 8.565 8.565 7.921 0.644 25685 127 1 . 1 1 42 42 LEU N N 42 126.914 126.914 119.905 7.009 25685 128 1 . 1 1 42 42 LEU C C 42 178.119 178.119 178.587 -0.468 25685 129 1 . 1 1 42 42 LEU CA C 42 58.523 58.523 57.803 0.720 25685 130 1 . 1 1 42 42 LEU CB C 42 42.125 42.125 41.337 0.789 25685 131 1 . 1 1 42 42 LEU H H 42 8.573 8.573 7.611 0.962 25685 132 1 . 1 1 46 46 MET N N 46 121.710 121.710 121.949 -0.239 25685 133 1 . 1 1 46 46 MET C C 46 179.540 179.540 178.388 1.152 25685 134 1 . 1 1 46 46 MET CA C 46 55.968 55.968 57.959 -1.991 25685 135 1 . 1 1 46 46 MET H H 46 8.589 8.589 7.857 0.732 25685 136 1 . 1 1 47 47 LEU N N 47 117.448 117.448 120.444 -2.996 25685 137 1 . 1 1 47 47 LEU HA H 47 3.992 3.992 4.165 -0.173 25685 138 1 . 1 1 47 47 LEU C C 47 179.082 179.082 178.966 0.116 25685 139 1 . 1 1 47 47 LEU CA C 47 58.157 58.157 57.898 0.259 25685 140 1 . 1 1 47 47 LEU CB C 47 41.858 41.858 41.603 0.255 25685 141 1 . 1 1 47 47 LEU H H 47 8.769 8.769 8.068 0.701 25685 142 1 . 1 1 48 48 ILE N N 48 117.500 117.500 117.525 -0.025 25685 143 1 . 1 1 48 48 ILE C C 48 180.298 180.298 178.198 2.100 25685 144 1 . 1 1 48 48 ILE CA C 48 65.627 65.627 63.953 1.674 25685 145 1 . 1 1 48 48 ILE CB C 48 37.839 37.839 37.362 0.477 25685 146 1 . 1 1 48 48 ILE H H 48 8.093 8.093 7.495 0.598 25685 147 1 . 1 1 49 49 LEU N N 49 123.708 123.708 120.361 3.347 25685 148 1 . 1 1 49 49 LEU C C 49 179.721 179.721 178.479 1.242 25685 149 1 . 1 1 49 49 LEU CA C 49 58.788 58.788 57.380 1.408 25685 150 1 . 1 1 49 49 LEU CB C 49 40.761 40.761 41.566 -0.805 25685 151 1 . 1 1 49 49 LEU H H 49 8.833 8.833 7.730 1.103 25685 152 1 . 1 1 50 50 GLY N N 50 109.284 109.284 105.987 3.297 25685 153 1 . 1 1 50 50 GLY C C 50 176.937 176.937 174.434 2.503 25685 154 1 . 1 1 50 50 GLY CA C 50 47.821 47.821 46.593 1.228 25685 155 1 . 1 1 50 50 GLY H H 50 9.658 9.658 8.019 1.639 25685 156 1 . 1 1 51 51 TYR N N 51 125.640 125.640 119.816 5.824 25685 157 1 . 1 1 51 51 TYR C C 51 177.102 177.102 174.855 2.247 25685 158 1 . 1 1 51 51 TYR CA C 51 61.948 61.948 57.334 4.614 25685 159 1 . 1 1 51 51 TYR CB C 51 38.871 38.871 39.147 -0.276 25685 160 1 . 1 1 51 51 TYR H H 51 8.795 8.795 7.778 1.017 25685 161 1 . 1 1 52 52 THR N N 52 116.273 116.273 115.594 0.679 25685 162 1 . 1 1 52 52 THR C C 52 176.969 176.969 174.139 2.830 25685 163 1 . 1 1 52 52 THR CA C 52 67.972 67.972 63.273 4.699 25685 164 1 . 1 1 52 52 THR H H 52 8.456 8.456 7.966 0.490 25685 165 1 . 1 1 53 53 ALA N N 53 122.122 122.122 126.169 -4.047 25685 166 1 . 1 1 53 53 ALA C C 53 179.907 179.907 177.013 2.894 25685 167 1 . 1 1 53 53 ALA CA C 53 55.722 55.722 52.104 3.618 25685 168 1 . 1 1 53 53 ALA CB C 53 18.786 18.786 19.532 -0.746 25685 169 1 . 1 1 53 53 ALA H H 53 9.058 9.058 8.192 0.866 25685 170 1 . 1 1 54 54 SER N N 54 115.434 115.434 115.297 0.137 25685 171 1 . 1 1 54 54 SER C C 54 176.433 176.433 174.303 2.130 25685 172 1 . 1 1 54 54 SER CA C 54 55.828 55.828 59.395 -3.567 25685 173 1 . 1 1 54 54 SER H H 54 8.040 8.040 8.431 -0.391 25685 174 1 . 1 1 55 55 LEU N N 55 123.045 123.045 120.673 2.372 25685 175 1 . 1 1 55 55 LEU C C 55 178.789 178.789 175.654 3.135 25685 176 1 . 1 1 55 55 LEU CA C 55 57.633 57.633 55.185 2.448 25685 177 1 . 1 1 55 55 LEU CB C 55 41.293 41.293 41.674 -0.381 25685 178 1 . 1 1 55 55 LEU H H 55 8.255 8.255 8.092 0.163 25685 179 1 . 1 1 56 56 PHE N N 56 114.426 114.426 120.871 -6.445 25685 180 1 . 1 1 56 56 PHE C C 56 177.507 177.507 175.181 2.326 25685 181 1 . 1 1 56 56 PHE CA C 56 61.068 61.068 57.659 3.409 25685 182 1 . 1 1 56 56 PHE CB C 56 40.107 40.107 39.520 0.587 25685 183 1 . 1 1 56 56 PHE H H 56 7.590 7.590 7.989 -0.399 25685 184 1 . 1 1 57 57 PHE N N 57 114.701 114.701 117.440 -2.739 25685 185 1 . 1 1 57 57 PHE C C 57 176.203 176.203 176.512 -0.309 25685 186 1 . 1 1 57 57 PHE CA C 57 58.503 58.503 57.722 0.781 25685 187 1 . 1 1 57 57 PHE CB C 57 41.114 41.114 38.021 3.093 25685 188 1 . 1 1 57 57 PHE H H 57 8.514 8.514 7.803 0.711 25685 189 1 . 1 1 58 58 GLY N N 58 111.041 111.041 109.370 1.671 25685 190 1 . 1 1 58 58 GLY C C 58 174.240 174.240 175.962 -1.722 25685 191 1 . 1 1 58 58 GLY CA C 58 44.827 44.827 46.901 -2.074 25685 192 1 . 1 1 58 58 GLY H H 58 7.998 7.998 8.599 -0.601 25685 193 1 . 1 1 59 59 PHE N N 59 127.950 127.950 121.354 6.596 25685 194 1 . 1 1 59 59 PHE C C 59 176.612 176.612 176.905 -0.293 25685 195 1 . 1 1 59 59 PHE CA C 59 61.598 61.598 59.177 2.421 25685 196 1 . 1 1 59 59 PHE CB C 59 40.870 40.870 38.748 2.122 25685 197 1 . 1 1 59 59 PHE H H 59 9.105 9.105 8.000 1.105 25685 198 1 . 1 1 60 60 PHE N N 60 114.868 114.868 119.963 -5.095 25685 199 1 . 1 1 60 60 PHE C C 60 177.989 177.989 177.001 0.988 25685 200 1 . 1 1 60 60 PHE CA C 60 61.517 61.517 61.591 -0.074 25685 201 1 . 1 1 60 60 PHE CB C 60 38.248 38.248 39.227 -0.979 25685 202 1 . 1 1 60 60 PHE H H 60 8.796 8.796 8.140 0.656 25685 203 1 . 1 1 61 61 ARG N N 61 118.812 118.812 118.360 0.452 25685 204 1 . 1 1 61 61 ARG C C 61 177.813 177.813 178.386 -0.573 25685 205 1 . 1 1 61 61 ARG CA C 61 60.497 60.497 59.054 1.443 25685 206 1 . 1 1 61 61 ARG CB C 61 28.915 28.915 29.674 -0.759 25685 207 1 . 1 1 61 61 ARG H H 61 7.600 7.600 7.788 -0.188 25685 208 1 . 1 1 62 62 VAL N N 62 119.157 119.157 118.625 0.532 25685 209 1 . 1 1 62 62 VAL C C 62 177.670 177.670 177.768 -0.098 25685 210 1 . 1 1 62 62 VAL CA C 62 66.749 66.749 65.176 1.573 25685 211 1 . 1 1 62 62 VAL CB C 62 30.306 30.306 31.479 -1.174 25685 212 1 . 1 1 62 62 VAL H H 62 7.679 7.679 7.397 0.282 25685 213 1 . 1 1 63 63 VAL N N 63 117.999 117.999 119.462 -1.463 25685 214 1 . 1 1 63 63 VAL C C 63 177.639 177.639 178.168 -0.529 25685 215 1 . 1 1 63 63 VAL CA C 63 66.836 66.836 65.458 1.378 25685 216 1 . 1 1 63 63 VAL CB C 63 30.496 30.496 30.506 -0.010 25685 217 1 . 1 1 63 63 VAL H H 63 7.429 7.429 7.596 -0.167 25685 218 1 . 1 1 64 64 ALA N N 64 120.451 120.451 122.267 -1.816 25685 219 1 . 1 1 64 64 ALA C C 64 179.134 179.134 179.292 -0.158 25685 220 1 . 1 1 64 64 ALA CA C 64 55.618 55.618 54.809 0.809 25685 221 1 . 1 1 64 64 ALA CB C 64 17.950 17.950 17.737 0.213 25685 222 1 . 1 1 64 64 ALA H H 64 8.169 8.169 7.572 0.597 25685 223 1 . 1 1 65 65 MET N N 65 116.532 116.532 117.016 -0.484 25685 224 1 . 1 1 65 65 MET C C 65 177.961 177.961 178.112 -0.151 25685 225 1 . 1 1 65 65 MET CA C 65 58.161 58.161 58.065 0.096 25685 226 1 . 1 1 65 65 MET CB C 65 31.208 31.208 32.032 -0.824 25685 227 1 . 1 1 65 65 MET H H 65 7.857 7.857 7.434 0.423 25685 228 1 . 1 1 66 66 LEU C C 66 179.022 179.022 178.928 0.094 25685 229 1 . 1 1 66 66 LEU CA C 66 58.412 58.412 57.817 0.595 25685 230 1 . 1 1 67 67 PHE N N 67 116.877 116.877 118.866 -1.989 25685 231 1 . 1 1 67 67 PHE C C 67 177.908 177.908 177.561 0.347 25685 232 1 . 1 1 67 67 PHE CA C 67 62.402 62.402 60.679 1.723 25685 233 1 . 1 1 67 67 PHE CB C 67 39.203 39.203 38.420 0.783 25685 234 1 . 1 1 67 67 PHE H H 67 7.923 7.923 7.530 0.393 25685 235 1 . 1 1 68 68 LEU N N 68 118.860 118.860 119.291 -0.431 25685 236 1 . 1 1 68 68 LEU C C 68 179.032 179.032 178.366 0.666 25685 237 1 . 1 1 68 68 LEU CA C 68 58.397 58.397 57.366 1.031 25685 238 1 . 1 1 68 68 LEU CB C 68 40.803 40.803 41.139 -0.336 25685 239 1 . 1 1 68 68 LEU H H 68 8.167 8.167 7.449 0.718 25685 240 1 . 1 1 71 71 PHE N N 71 120.700 120.700 118.653 2.047 25685 241 1 . 1 1 71 71 PHE C C 71 177.670 177.670 177.343 0.327 25685 242 1 . 1 1 71 71 PHE CA C 71 60.528 60.528 60.790 -0.262 25685 243 1 . 1 1 71 71 PHE H H 71 7.847 7.847 7.298 0.549 25685 244 1 . 1 1 72 72 ALA N N 72 120.506 120.506 122.424 -1.918 25685 245 1 . 1 1 72 72 ALA C C 72 178.944 178.944 179.292 -0.348 25685 246 1 . 1 1 72 72 ALA CA C 72 55.461 55.461 54.837 0.624 25685 247 1 . 1 1 72 72 ALA CB C 72 17.829 17.829 18.136 -0.307 25685 248 1 . 1 1 72 72 ALA H H 72 8.533 8.533 7.809 0.724 25685 249 1 . 1 1 73 73 LEU N N 73 115.071 115.071 118.983 -3.912 25685 250 1 . 1 1 73 73 LEU C C 73 180.831 180.831 178.660 2.171 25685 251 1 . 1 1 73 73 LEU CA C 73 58.091 58.091 57.800 0.291 25685 252 1 . 1 1 73 73 LEU CB C 73 41.082 41.082 41.499 -0.417 25685 253 1 . 1 1 73 73 LEU H H 73 8.458 8.458 8.005 0.453 25685 254 1 . 1 1 74 74 ILE N N 74 121.365 121.365 117.876 3.489 25685 255 1 . 1 1 74 74 ILE C C 74 178.287 178.287 177.705 0.582 25685 256 1 . 1 1 74 74 ILE CA C 74 65.335 65.335 64.185 1.150 25685 257 1 . 1 1 74 74 ILE CB C 74 37.453 37.453 37.377 0.076 25685 258 1 . 1 1 74 74 ILE H H 74 8.220 8.220 7.326 0.894 25685 259 1 . 1 1 75 75 LEU N N 75 119.200 119.200 120.743 -1.543 25685 260 1 . 1 1 75 75 LEU C C 75 177.548 177.548 178.272 -0.724 25685 261 1 . 1 1 75 75 LEU CA C 75 56.938 56.938 57.532 -0.594 25685 262 1 . 1 1 75 75 LEU CB C 75 41.541 41.541 41.367 0.174 25685 263 1 . 1 1 75 75 LEU H H 75 7.866 7.866 7.354 0.512 25685 264 1 . 1 1 76 76 LEU N N 76 116.338 116.338 117.179 -0.841 25685 265 1 . 1 1 76 76 LEU C C 76 176.889 176.889 178.502 -1.613 25685 266 1 . 1 1 76 76 LEU CA C 76 54.807 54.807 57.181 -2.374 25685 267 1 . 1 1 76 76 LEU CB C 76 41.830 41.830 41.695 0.136 25685 268 1 . 1 1 76 76 LEU H H 76 7.432 7.432 7.639 -0.207 25685 269 1 . 1 1 77 77 SER N N 77 114.630 114.630 112.584 2.046 25685 270 1 . 1 1 77 77 SER C C 77 174.752 174.752 174.931 -0.179 25685 271 1 . 1 1 77 77 SER CA C 77 58.967 58.967 60.260 -1.293 25685 272 1 . 1 1 77 77 SER CB C 77 64.686 64.686 63.502 1.184 25685 273 1 . 1 1 77 77 SER H H 77 7.423 7.423 7.787 -0.364 25685 274 1 . 1 1 78 78 ASP N N 78 123.054 123.054 120.983 2.071 25685 275 1 . 1 1 78 78 ASP C C 78 176.716 176.716 175.746 0.970 25685 276 1 . 1 1 78 78 ASP CA C 78 54.848 54.848 54.965 -0.117 25685 277 1 . 1 1 78 78 ASP CB C 78 40.423 40.423 41.090 -0.667 25685 278 1 . 1 1 78 78 ASP H H 78 8.294 8.294 7.661 0.633 25685 279 1 . 1 1 79 79 GLU N N 79 119.104 119.104 119.595 -0.491 25685 280 1 . 1 1 79 79 GLU C C 79 176.391 176.391 175.633 0.758 25685 281 1 . 1 1 79 79 GLU CA C 79 56.258 56.258 56.402 -0.144 25685 282 1 . 1 1 79 79 GLU CB C 79 29.656 29.656 29.665 -0.009 25685 283 1 . 1 1 79 79 GLU H H 79 8.384 8.384 8.433 -0.049 25685 284 1 . 1 1 80 80 LEU N N 80 121.254 121.254 122.062 -0.808 25685 285 1 . 1 1 80 80 LEU C C 80 177.164 177.164 175.800 1.364 25685 286 1 . 1 1 80 80 LEU CA C 80 54.670 54.670 55.451 -0.781 25685 287 1 . 1 1 80 80 LEU CB C 80 42.633 42.633 41.852 0.781 25685 288 1 . 1 1 80 80 LEU H H 80 7.637 7.637 8.307 -0.670 25685 289 1 . 1 1 81 81 ASP N N 81 123.410 123.410 121.514 1.896 25685 290 1 . 1 1 81 81 ASP C C 81 177.552 177.552 175.540 2.012 25685 291 1 . 1 1 81 81 ASP CA C 81 55.110 55.110 53.246 1.864 25685 292 1 . 1 1 81 81 ASP CB C 81 42.693 42.693 42.685 0.008 25685 293 1 . 1 1 81 81 ASP H H 81 8.403 8.403 8.202 0.201 25685 294 1 . 1 1 82 82 GLU N N 82 125.047 125.047 119.680 5.367 25685 295 1 . 1 1 82 82 GLU C C 82 178.198 178.198 177.633 0.565 25685 296 1 . 1 1 82 82 GLU CA C 82 59.221 59.221 57.537 1.684 25685 297 1 . 1 1 82 82 GLU CB C 82 29.176 29.176 30.055 -0.879 25685 298 1 . 1 1 82 82 GLU H H 82 8.744 8.744 8.462 0.282 25685 299 1 . 1 1 83 83 LYS N N 83 118.476 118.476 119.418 -0.942 25685 300 1 . 1 1 83 83 LYS C C 83 179.356 179.356 178.196 1.160 25685 301 1 . 1 1 83 83 LYS CA C 83 59.170 59.170 58.613 0.557 25685 302 1 . 1 1 83 83 LYS CB C 83 31.509 31.509 31.765 -0.255 25685 303 1 . 1 1 83 83 LYS H H 83 8.607 8.607 8.396 0.211 25685 304 1 . 1 1 84 84 VAL N N 84 118.407 118.407 116.450 1.957 25685 305 1 . 1 1 84 84 VAL C C 84 177.653 177.653 177.490 0.163 25685 306 1 . 1 1 84 84 VAL CA C 84 65.416 65.416 66.084 -0.668 25685 307 1 . 1 1 84 84 VAL CB C 84 31.313 31.313 31.305 0.008 25685 308 1 . 1 1 84 84 VAL H H 84 7.870 7.870 7.955 -0.084 25685 309 1 . 1 1 85 85 SER N N 85 116.146 116.146 116.243 -0.097 25685 310 1 . 1 1 85 85 SER C C 85 177.496 177.496 176.804 0.692 25685 311 1 . 1 1 85 85 SER CA C 85 61.764 61.764 61.537 0.227 25685 312 1 . 1 1 85 85 SER CB C 85 63.654 63.654 62.895 0.759 25685 313 1 . 1 1 85 85 SER H H 85 8.083 8.083 8.204 -0.121 25685 314 1 . 1 1 86 86 ILE N N 86 122.570 122.570 120.680 1.890 25685 315 1 . 1 1 86 86 ILE C C 86 178.698 178.698 177.577 1.121 25685 316 1 . 1 1 86 86 ILE CA C 86 64.526 64.526 63.557 0.969 25685 317 1 . 1 1 86 86 ILE CB C 86 37.393 37.393 37.275 0.119 25685 318 1 . 1 1 86 86 ILE H H 86 8.102 8.102 7.546 0.556 25685 319 1 . 1 1 87 87 PHE N N 87 121.340 121.340 121.232 0.108 25685 320 1 . 1 1 87 87 PHE C C 87 177.671 177.671 176.834 0.837 25685 321 1 . 1 1 87 87 PHE CA C 87 61.098 61.098 61.249 -0.151 25685 322 1 . 1 1 87 87 PHE CB C 87 39.151 39.151 38.512 0.639 25685 323 1 . 1 1 87 87 PHE H H 87 7.719 7.719 8.237 -0.518 25685 324 1 . 1 1 88 88 ALA N N 88 120.921 120.921 120.872 0.049 25685 325 1 . 1 1 88 88 ALA C C 88 180.030 180.030 179.528 0.502 25685 326 1 . 1 1 88 88 ALA CA C 88 55.147 55.147 54.672 0.475 25685 327 1 . 1 1 88 88 ALA CB C 88 19.053 19.053 18.004 1.049 25685 328 1 . 1 1 88 88 ALA H H 88 8.679 8.679 7.877 0.802 25685 329 1 . 1 1 89 89 SER N N 89 114.285 114.285 114.759 -0.474 25685 330 1 . 1 1 89 89 SER C C 89 177.040 177.040 176.376 0.664 25685 331 1 . 1 1 89 89 SER CA C 89 61.314 61.314 61.345 -0.031 25685 332 1 . 1 1 89 89 SER CB C 89 63.371 63.371 62.785 0.586 25685 333 1 . 1 1 89 89 SER H H 89 8.242 8.242 7.645 0.597 25685 334 1 . 1 1 90 90 ARG N N 90 121.829 121.829 120.996 0.833 25685 335 1 . 1 1 90 90 ARG C C 90 179.247 179.247 178.086 1.161 25685 336 1 . 1 1 90 90 ARG CA C 90 58.444 58.444 58.452 -0.008 25685 337 1 . 1 1 90 90 ARG CB C 90 29.532 29.532 28.995 0.537 25685 338 1 . 1 1 90 90 ARG H H 90 7.907 7.907 7.631 0.276 25685 339 1 . 1 1 91 91 MET N N 91 117.124 117.124 117.142 -0.018 25685 340 1 . 1 1 91 91 MET C C 91 177.504 177.504 177.964 -0.460 25685 341 1 . 1 1 91 91 MET CA C 91 57.152 57.152 59.790 -2.638 25685 342 1 . 1 1 91 91 MET CB C 91 32.510 32.510 31.890 0.620 25685 343 1 . 1 1 91 91 MET H H 91 7.930 7.930 7.761 0.169 25685 344 1 . 1 1 92 92 THR N N 92 108.478 108.478 113.595 -5.117 25685 345 1 . 1 1 92 92 THR C C 92 176.367 176.367 176.196 0.171 25685 346 1 . 1 1 92 92 THR CA C 92 63.564 63.564 65.470 -1.906 25685 347 1 . 1 1 92 92 THR H H 92 7.847 7.847 7.687 0.160 25685 348 1 . 1 1 93 93 SER N N 93 117.950 117.950 116.598 1.352 25685 349 1 . 1 1 93 93 SER C C 93 176.552 176.552 176.411 0.141 25685 350 1 . 1 1 93 93 SER CA C 93 60.821 60.821 61.095 -0.274 25685 351 1 . 1 1 93 93 SER CB C 93 63.311 63.311 63.327 -0.016 25685 352 1 . 1 1 93 93 SER H H 93 7.732 7.732 7.650 0.082 25685 353 1 . 1 1 94 94 GLY N N 94 111.265 111.265 108.524 2.741 25685 354 1 . 1 1 94 94 GLY C C 94 175.198 175.198 174.702 0.496 25685 355 1 . 1 1 94 94 GLY CA C 94 46.021 46.021 45.231 0.790 25685 356 1 . 1 1 94 94 GLY H H 94 8.419 8.419 7.971 0.448 25685 357 1 . 1 1 95 95 LEU N N 95 121.019 121.019 118.950 2.069 25685 358 1 . 1 1 95 95 LEU C C 95 177.810 177.810 176.030 1.780 25685 359 1 . 1 1 95 95 LEU CA C 95 56.012 56.012 55.917 0.095 25685 360 1 . 1 1 95 95 LEU CB C 95 42.122 42.122 41.952 0.170 25685 361 1 . 1 1 95 95 LEU H H 95 7.849 7.849 7.609 0.240 25685 362 1 . 1 1 96 96 SER N N 96 115.465 115.465 116.540 -1.075 25685 363 1 . 1 1 96 96 SER C C 96 175.543 175.543 174.053 1.490 25685 364 1 . 1 1 96 96 SER CA C 96 60.151 60.151 57.865 2.286 25685 365 1 . 1 1 96 96 SER H H 96 8.349 8.349 8.065 0.284 25685 366 1 . 1 1 97 97 TRP N N 97 121.711 121.711 122.473 -0.762 25685 367 1 . 1 1 97 97 TRP C C 97 176.973 176.973 176.345 0.628 25685 368 1 . 1 1 97 97 TRP CA C 97 58.250 58.250 58.030 0.220 25685 369 1 . 1 1 97 97 TRP CB C 97 28.899 28.899 29.288 -0.389 25685 370 1 . 1 1 97 97 TRP H H 97 7.723 7.723 8.128 -0.405 25685 371 1 . 1 1 98 98 LYS N N 98 119.868 119.868 120.891 -1.023 25685 372 1 . 1 1 98 98 LYS C C 98 178.021 178.021 176.719 1.302 25685 373 1 . 1 1 98 98 LYS CA C 98 56.340 56.340 56.908 -0.568 25685 374 1 . 1 1 98 98 LYS CB C 98 31.933 31.933 33.223 -1.290 25685 375 1 . 1 1 98 98 LYS H H 98 7.855 7.855 8.421 -0.566 25685 376 1 . 1 1 99 99 ILE N N 99 120.044 120.044 118.874 1.170 25685 377 1 . 1 1 99 99 ILE C C 99 176.769 176.769 176.533 0.236 25685 378 1 . 1 1 99 99 ILE CA C 99 62.758 62.758 62.341 0.417 25685 379 1 . 1 1 99 99 ILE CB C 99 37.809 37.809 38.091 -0.283 25685 380 1 . 1 1 99 99 ILE H H 99 8.069 8.069 8.123 -0.054 25685 381 1 . 1 1 100 100 GLN C C 100 176.315 176.315 175.433 0.882 25685 382 1 . 1 1 100 100 GLN CA C 100 57.486 57.486 56.330 1.156 25685 383 1 . 1 1 101 101 THR N N 101 109.873 109.873 114.736 -4.863 25685 384 1 . 1 1 101 101 THR C C 101 174.664 174.664 173.760 0.904 25685 385 1 . 1 1 101 101 THR CA C 101 61.709 61.709 62.647 -0.938 25685 386 1 . 1 1 101 101 THR CB C 101 69.290 69.290 69.569 -0.279 25685 387 1 . 1 1 101 101 THR H H 101 7.508 7.508 8.057 -0.549 25685 388 1 . 1 1 102 102 LEU N N 102 124.434 124.434 124.627 -0.193 25685 389 1 . 1 1 102 102 LEU C C 102 174.681 174.681 175.128 -0.447 25685 390 1 . 1 1 102 102 LEU CA C 102 53.063 53.063 52.879 0.184 25685 391 1 . 1 1 102 102 LEU CB C 102 41.139 41.139 41.797 -0.658 25685 392 1 . 1 1 102 102 LEU H H 102 7.569 7.569 8.210 -0.641 25685 393 1 . 1 1 103 103 PRO C C 103 178.076 178.076 176.224 1.852 25685 394 1 . 1 1 103 103 PRO CA C 103 62.570 62.570 63.542 -0.972 25685 395 1 . 1 1 103 103 PRO CB C 103 31.534 31.534 31.985 -0.451 25685 396 1 . 1 1 104 104 SER N N 104 119.929 119.929 116.073 3.856 25685 397 1 . 1 1 104 104 SER C C 104 176.432 176.432 174.370 2.062 25685 398 1 . 1 1 104 104 SER CA C 104 61.976 61.976 58.255 3.721 25685 399 1 . 1 1 104 104 SER CB C 104 63.611 63.611 63.655 -0.044 25685 400 1 . 1 1 104 104 SER H H 104 8.784 8.784 8.086 0.698 25685 401 1 . 1 1 105 105 PHE N N 105 119.519 119.519 122.567 -3.048 25685 402 1 . 1 1 105 105 PHE C C 105 176.852 176.852 174.467 2.385 25685 403 1 . 1 1 105 105 PHE CA C 105 60.162 60.162 57.604 2.558 25685 404 1 . 1 1 105 105 PHE CB C 105 38.455 38.455 38.124 0.331 25685 405 1 . 1 1 105 105 PHE H H 105 8.620 8.620 8.183 0.437 25685 406 1 . 1 1 106 106 PHE N N 106 118.809 118.809 116.705 2.104 25685 407 1 . 1 1 106 106 PHE C C 106 176.741 176.741 175.395 1.346 25685 408 1 . 1 1 106 106 PHE CA C 106 61.421 61.421 58.205 3.216 25685 409 1 . 1 1 106 106 PHE CB C 106 38.788 38.788 37.034 1.754 25685 410 1 . 1 1 106 106 PHE H H 106 7.519 7.519 7.691 -0.172 25685 411 1 . 1 1 107 107 PHE N N 107 117.382 117.382 121.502 -4.120 25685 412 1 . 1 1 107 107 PHE C C 107 177.771 177.771 177.025 0.746 25685 413 1 . 1 1 107 107 PHE CA C 107 61.099 61.099 61.401 -0.302 25685 414 1 . 1 1 107 107 PHE CB C 107 38.677 38.677 38.998 -0.321 25685 415 1 . 1 1 107 107 PHE H H 107 7.903 7.903 8.362 -0.459 25685 416 1 . 1 1 108 108 GLY N N 108 105.340 105.340 106.495 -1.155 25685 417 1 . 1 1 108 108 GLY C C 108 174.574 174.574 175.920 -1.346 25685 418 1 . 1 1 108 108 GLY CA C 108 47.508 47.508 47.202 0.306 25685 419 1 . 1 1 108 108 GLY H H 108 8.351 8.351 8.670 -0.319 25685 420 1 . 1 1 109 109 MET N N 109 119.831 119.831 120.303 -0.472 25685 421 1 . 1 1 109 109 MET C C 109 177.522 177.522 177.678 -0.156 25685 422 1 . 1 1 109 109 MET CA C 109 58.658 58.658 57.631 1.027 25685 423 1 . 1 1 109 109 MET CB C 109 32.106 32.106 31.944 0.162 25685 424 1 . 1 1 109 109 MET H H 109 7.919 7.919 7.816 0.103 25685 425 1 . 1 1 110 110 LEU N N 110 119.908 119.908 118.563 1.345 25685 426 1 . 1 1 110 110 LEU C C 110 178.170 178.170 178.655 -0.485 25685 427 1 . 1 1 110 110 LEU CA C 110 57.941 57.941 57.467 0.474 25685 428 1 . 1 1 110 110 LEU CB C 110 41.055 41.055 40.879 0.177 25685 429 1 . 1 1 110 110 LEU H H 110 7.744 7.744 7.610 0.134 25685 430 1 . 1 1 111 111 LEU N N 111 116.594 116.594 118.715 -2.121 25685 431 1 . 1 1 111 111 LEU C C 111 178.960 178.960 178.122 0.838 25685 432 1 . 1 1 111 111 LEU CA C 111 57.366 57.366 57.672 -0.306 25685 433 1 . 1 1 111 111 LEU CB C 111 40.259 40.259 41.074 -0.815 25685 434 1 . 1 1 111 111 LEU H H 111 7.732 7.732 7.340 0.392 25685 435 1 . 1 1 112 112 ALA N N 112 121.020 121.020 120.648 0.372 25685 436 1 . 1 1 112 112 ALA C C 112 178.700 178.700 179.231 -0.531 25685 437 1 . 1 1 112 112 ALA CA C 112 55.432 55.432 54.799 0.633 25685 438 1 . 1 1 112 112 ALA CB C 112 18.214 18.214 18.055 0.159 25685 439 1 . 1 1 112 112 ALA H H 112 8.121 8.121 7.246 0.875 25685 440 1 . 1 1 113 113 PHE N N 113 118.369 118.369 116.135 2.234 25685 441 1 . 1 1 113 113 PHE C C 113 176.091 176.091 177.524 -1.433 25685 442 1 . 1 1 113 113 PHE CA C 113 61.388 61.388 58.881 2.507 25685 443 1 . 1 1 113 113 PHE CB C 113 39.688 39.688 37.857 1.831 25685 444 1 . 1 1 113 113 PHE H H 113 8.237 8.237 7.140 1.097 25685 445 1 . 1 1 114 114 LEU N N 114 114.214 114.214 118.797 -4.583 25685 446 1 . 1 1 114 114 LEU C C 114 177.038 177.038 178.255 -1.217 25685 447 1 . 1 1 114 114 LEU CA C 114 56.358 56.358 57.701 -1.343 25685 448 1 . 1 1 114 114 LEU CB C 114 42.716 42.716 41.719 0.997 25685 449 1 . 1 1 114 114 LEU H H 114 7.576 7.576 7.486 0.090 25685 450 1 . 1 1 115 115 TRP N N 115 112.667 112.667 117.347 -4.680 25685 451 1 . 1 1 115 115 TRP C C 115 180.163 180.163 177.593 2.570 25685 452 1 . 1 1 115 115 TRP CA C 115 55.930 55.930 58.819 -2.889 25685 453 1 . 1 1 115 115 TRP H H 115 8.542 8.542 7.346 1.196 25685 454 1 . 1 1 116 116 LEU N N 116 122.144 122.144 120.914 1.230 25685 455 1 . 1 1 116 116 LEU C C 116 175.953 175.953 176.296 -0.343 25685 456 1 . 1 1 116 116 LEU CA C 116 59.924 59.924 58.037 1.887 25685 457 1 . 1 1 116 116 LEU CB C 116 39.097 39.097 39.818 -0.721 25685 458 1 . 1 1 116 116 LEU H H 116 8.996 8.996 7.282 1.714 25685 459 1 . 1 1 117 117 PRO C C 117 174.220 174.220 177.399 -3.179 25685 460 1 . 1 1 117 117 PRO CA C 117 66.300 66.300 64.258 2.042 25685 461 1 . 1 1 118 118 ALA N N 118 110.603 110.603 119.829 -9.226 25685 462 1 . 1 1 118 118 ALA C C 118 177.162 177.162 178.310 -1.148 25685 463 1 . 1 1 118 118 ALA CA C 118 52.670 52.670 52.801 -0.131 25685 464 1 . 1 1 118 118 ALA CB C 118 18.853 18.853 19.652 -0.799 25685 465 1 . 1 1 118 118 ALA H H 118 6.633 6.633 7.540 -0.907 25685 466 1 . 1 1 119 119 ILE N N 119 113.492 113.492 115.088 -1.596 25685 467 1 . 1 1 119 119 ILE CA C 119 63.703 63.703 63.742 -0.039 25685 468 1 . 1 1 119 119 ILE CB C 119 39.605 39.605 37.127 2.478 25685 469 1 . 1 1 119 119 ILE H H 119 7.693 7.693 8.361 -0.668 25685 470 1 . 1 1 121 121 PRO C C 121 178.089 178.089 179.039 -0.950 25685 471 1 . 1 1 121 121 PRO CA C 121 66.004 66.004 65.854 0.150 25685 472 1 . 1 1 122 122 PHE N N 122 113.797 113.797 119.116 -5.319 25685 473 1 . 1 1 122 122 PHE C C 122 177.713 177.713 177.088 0.625 25685 474 1 . 1 1 122 122 PHE CA C 122 61.566 61.566 60.770 0.797 25685 475 1 . 1 1 122 122 PHE CB C 122 38.983 38.983 38.802 0.181 25685 476 1 . 1 1 122 122 PHE H H 122 6.846 6.846 8.106 -1.260 25685 477 1 . 1 1 123 123 ALA N N 123 121.512 121.512 121.250 0.262 25685 478 1 . 1 1 123 123 ALA C C 123 179.318 179.318 179.656 -0.338 25685 479 1 . 1 1 123 123 ALA CA C 123 54.975 54.975 55.080 -0.105 25685 480 1 . 1 1 123 123 ALA CB C 123 17.881 17.881 18.091 -0.209 25685 481 1 . 1 1 123 123 ALA H H 123 8.411 8.411 8.550 -0.139 25685 482 1 . 1 1 124 124 GLY N N 124 104.093 104.093 107.083 -2.990 25685 483 1 . 1 1 124 124 GLY C C 124 175.410 175.410 176.111 -0.701 25685 484 1 . 1 1 124 124 GLY CA C 124 47.370 47.370 46.779 0.591 25685 485 1 . 1 1 124 124 GLY H H 124 8.455 8.455 7.958 0.497 25685 486 1 . 1 1 125 125 ILE N N 125 121.895 121.895 121.733 0.162 25685 487 1 . 1 1 125 125 ILE C C 125 178.329 178.329 177.212 1.117 25685 488 1 . 1 1 125 125 ILE CA C 125 64.412 64.412 63.869 0.543 25685 489 1 . 1 1 125 125 ILE H H 125 7.954 7.954 7.946 0.008 25685 490 1 . 1 1 126 126 ALA N N 126 122.768 122.768 122.297 0.471 25685 491 1 . 1 1 126 126 ALA C C 126 180.341 180.341 179.376 0.965 25685 492 1 . 1 1 126 126 ALA CA C 126 55.266 55.266 55.331 -0.065 25685 493 1 . 1 1 126 126 ALA CB C 126 18.226 18.226 17.972 0.254 25685 494 1 . 1 1 126 126 ALA H H 126 8.142 8.142 7.523 0.619 25685 495 1 . 1 1 127 127 ILE N N 127 116.752 116.752 116.878 -0.126 25685 496 1 . 1 1 127 127 ILE C C 127 177.993 177.993 177.742 0.251 25685 497 1 . 1 1 127 127 ILE CA C 127 63.877 63.877 63.941 -0.064 25685 498 1 . 1 1 127 127 ILE CB C 127 37.657 37.657 37.233 0.424 25685 499 1 . 1 1 127 127 ILE H H 127 8.335 8.335 7.440 0.895 25685 500 1 . 1 1 128 128 SER N N 128 116.351 116.351 115.646 0.705 25685 501 1 . 1 1 128 128 SER C C 128 175.796 175.796 176.591 -0.795 25685 502 1 . 1 1 128 128 SER CA C 128 61.818 61.818 61.336 0.482 25685 503 1 . 1 1 128 128 SER H H 128 7.939 7.939 7.625 0.314 25685 504 1 . 1 1 129 129 GLN N N 129 118.082 118.082 120.396 -2.314 25685 505 1 . 1 1 129 129 GLN C C 129 177.419 177.419 178.060 -0.641 25685 506 1 . 1 1 129 129 GLN CA C 129 57.106 57.106 58.528 -1.422 25685 507 1 . 1 1 129 129 GLN CB C 129 28.631 28.631 28.660 -0.029 25685 508 1 . 1 1 129 129 GLN H H 129 7.943 7.943 7.687 0.256 25685 509 1 . 1 1 130 130 THR N N 130 113.484 113.484 113.771 -0.287 25685 510 1 . 1 1 130 130 THR C C 130 175.627 175.627 175.507 0.120 25685 511 1 . 1 1 130 130 THR CA C 130 63.758 63.758 65.276 -1.518 25685 512 1 . 1 1 130 130 THR CB C 130 69.182 69.182 68.949 0.233 25685 513 1 . 1 1 130 130 THR H H 130 7.686 7.686 7.593 0.093 25685 514 1 . 1 1 131 131 LEU N N 131 121.347 121.347 120.089 1.258 25685 515 1 . 1 1 131 131 LEU C C 131 177.522 177.522 176.525 0.997 25685 516 1 . 1 1 131 131 LEU CA C 131 56.307 56.307 55.382 0.925 25685 517 1 . 1 1 131 131 LEU CB C 131 41.711 41.711 42.014 -0.303 25685 518 1 . 1 1 131 131 LEU H H 131 8.071 8.071 7.393 0.678 25685 519 1 . 1 1 132 132 LEU N N 132 118.162 118.162 119.396 -1.234 25685 520 1 . 1 1 132 132 LEU C C 132 177.461 177.461 176.206 1.255 25685 521 1 . 1 1 132 132 LEU CA C 132 55.264 55.264 55.264 0.000 25685 522 1 . 1 1 132 132 LEU CB C 132 41.613 41.613 42.575 -0.962 25685 523 1 . 1 1 132 132 LEU H H 132 7.810 7.810 7.921 -0.111 25685 524 1 . 1 1 133 133 SER N N 133 114.244 114.244 115.438 -1.194 25685 525 1 . 1 1 133 133 SER C C 133 174.363 174.363 173.466 0.897 25685 526 1 . 1 1 133 133 SER CA C 133 59.019 59.019 58.831 0.188 25685 527 1 . 1 1 133 133 SER CB C 133 64.634 64.634 63.910 0.724 25685 528 1 . 1 1 133 133 SER H H 133 7.829 7.829 8.242 -0.413 25685 529 1 . 1 1 134 134 GLU N N 134 120.151 120.151 120.589 -0.438 25685 530 1 . 1 1 134 134 GLU C C 134 175.935 175.935 174.920 1.015 25685 531 1 . 1 1 134 134 GLU CA C 134 56.301 56.301 56.295 0.006 25685 532 1 . 1 1 134 134 GLU CB C 134 30.129 30.129 30.894 -0.765 25685 533 1 . 1 1 134 134 GLU H H 134 8.054 8.054 8.423 -0.369 25685 534 1 . 1 1 135 135 ASN N N 135 118.890 118.890 119.720 -0.830 25685 535 1 . 1 1 135 135 ASN C C 135 174.272 174.272 173.912 0.360 25685 536 1 . 1 1 135 135 ASN CA C 135 51.390 51.390 51.795 -0.405 25685 537 1 . 1 1 135 135 ASN CB C 135 39.129 39.129 38.754 0.375 25685 538 1 . 1 1 135 135 ASN H H 135 8.305 8.305 8.347 -0.042 25685 539 1 . 1 1 136 136 PRO C C 136 177.960 177.960 178.175 -0.215 25685 540 1 . 1 1 136 136 PRO CA C 136 64.530 64.530 64.927 -0.397 25685 541 1 . 1 1 136 136 PRO CB C 136 31.809 31.809 32.052 -0.243 25685 542 1 . 1 1 137 137 LEU N N 137 117.735 117.735 118.371 -0.636 25685 543 1 . 1 1 137 137 LEU C C 137 179.217 179.217 179.003 0.214 25685 544 1 . 1 1 137 137 LEU CA C 137 57.039 57.039 58.090 -1.051 25685 545 1 . 1 1 137 137 LEU CB C 137 40.799 40.799 41.116 -0.317 25685 546 1 . 1 1 137 137 LEU H H 137 8.248 8.248 8.039 0.209 25685 547 1 . 1 1 138 138 VAL N N 138 119.589 119.589 118.031 1.558 25685 548 1 . 1 1 138 138 VAL C C 138 177.894 177.894 177.485 0.409 25685 549 1 . 1 1 138 138 VAL CA C 138 64.727 64.727 65.974 -1.247 25685 550 1 . 1 1 138 138 VAL CB C 138 31.347 31.347 31.291 0.056 25685 551 1 . 1 1 138 138 VAL H H 138 7.483 7.483 7.883 -0.400 25685 552 1 . 1 1 139 139 MET N N 139 119.431 119.431 119.699 -0.268 25685 553 1 . 1 1 139 139 MET C C 139 177.988 177.988 178.434 -0.446 25685 554 1 . 1 1 139 139 MET CA C 139 57.403 57.403 58.696 -1.293 25685 555 1 . 1 1 139 139 MET CB C 139 31.709 31.709 32.300 -0.591 25685 556 1 . 1 1 139 139 MET H H 139 7.837 7.837 7.713 0.124 25685 557 1 . 1 1 140 140 LEU N N 140 119.686 119.686 120.445 -0.759 25685 558 1 . 1 1 140 140 LEU C C 140 177.916 177.916 178.878 -0.962 25685 559 1 . 1 1 140 140 LEU CA C 140 56.877 56.877 58.276 -1.399 25685 560 1 . 1 1 140 140 LEU CB C 140 41.491 41.491 41.180 0.311 25685 561 1 . 1 1 140 140 LEU H H 140 7.926 7.926 8.671 -0.745 25685 562 1 . 1 1 141 141 SER N N 141 114.167 114.167 115.210 -1.043 25685 563 1 . 1 1 141 141 SER C C 141 176.030 176.030 177.178 -1.148 25685 564 1 . 1 1 141 141 SER CA C 141 60.425 60.425 61.744 -1.319 25685 565 1 . 1 1 141 141 SER CB C 141 63.956 63.956 63.210 0.746 25685 566 1 . 1 1 141 141 SER H H 141 7.757 7.757 8.348 -0.591 25685 567 1 . 1 1 142 142 TYR N N 142 121.679 121.679 121.774 -0.095 25685 568 1 . 1 1 142 142 TYR C C 142 177.659 177.659 178.295 -0.636 25685 569 1 . 1 1 142 142 TYR CA C 142 59.673 59.673 59.618 0.055 25685 570 1 . 1 1 142 142 TYR CB C 142 38.079 38.079 37.897 0.182 25685 571 1 . 1 1 142 142 TYR H H 142 7.965 7.965 8.829 -0.864 25685 572 1 . 1 1 143 143 GLY N N 143 107.396 107.396 107.788 -0.392 25685 573 1 . 1 1 143 143 GLY C C 143 174.877 174.877 175.898 -1.021 25685 574 1 . 1 1 143 143 GLY CA C 143 46.343 46.343 47.367 -1.024 25685 575 1 . 1 1 143 143 GLY H H 143 8.177 8.177 8.754 -0.577 25685 576 1 . 1 1 144 144 LEU N N 144 120.477 120.477 122.535 -2.058 25685 577 1 . 1 1 144 144 LEU C C 144 178.504 178.504 178.889 -0.385 25685 578 1 . 1 1 144 144 LEU CA C 144 56.270 56.270 57.493 -1.223 25685 579 1 . 1 1 144 144 LEU CB C 144 41.662 41.662 41.623 0.039 25685 580 1 . 1 1 144 144 LEU H H 144 8.055 8.055 7.471 0.584 25685 581 1 . 1 1 145 145 GLY N N 145 106.847 106.847 106.618 0.229 25685 582 1 . 1 1 145 145 GLY C C 145 175.375 175.375 175.992 -0.617 25685 583 1 . 1 1 145 145 GLY CA C 145 45.582 45.582 46.921 -1.339 25685 584 1 . 1 1 145 145 GLY H H 145 8.066 8.066 7.654 0.412 25685 585 1 . 1 1 146 146 MET N N 146 120.376 120.376 121.848 -1.472 25685 586 1 . 1 1 146 146 MET C C 146 176.663 176.663 178.111 -1.448 25685 587 1 . 1 1 146 146 MET CA C 146 57.030 57.030 57.910 -0.880 25685 588 1 . 1 1 146 146 MET CB C 146 30.720 30.720 32.246 -1.526 25685 589 1 . 1 1 146 146 MET H H 146 8.157 8.157 8.433 -0.276 25685 590 1 . 1 1 147 147 ALA N N 147 123.038 123.038 121.646 1.392 25685 591 1 . 1 1 147 147 ALA C C 147 178.917 178.917 179.612 -0.695 25685 592 1 . 1 1 147 147 ALA CA C 147 54.201 54.201 55.238 -1.037 25685 593 1 . 1 1 147 147 ALA CB C 147 18.810 18.810 18.085 0.725 25685 594 1 . 1 1 147 147 ALA H H 147 8.336 8.336 8.322 0.014 25685 595 1 . 1 1 148 148 VAL N N 148 117.795 117.795 116.539 1.256 25685 596 1 . 1 1 148 148 VAL C C 148 176.891 176.891 177.964 -1.073 25685 597 1 . 1 1 148 148 VAL CA C 148 64.157 64.157 66.047 -1.890 25685 598 1 . 1 1 148 148 VAL CB C 148 31.529 31.529 31.378 0.151 25685 599 1 . 1 1 148 148 VAL H H 148 7.908 7.908 7.479 0.429 25685 600 1 . 1 1 149 149 THR N N 149 116.069 116.069 115.951 0.118 25685 601 1 . 1 1 149 149 THR C C 149 176.054 176.054 176.522 -0.468 25685 602 1 . 1 1 149 149 THR CA C 149 63.308 63.308 66.697 -3.389 25685 603 1 . 1 1 149 149 THR H H 149 7.414 7.414 7.465 -0.051 25685 604 1 . 1 1 150 150 ILE N N 150 121.971 121.971 120.978 0.993 25685 605 1 . 1 1 150 150 ILE C C 150 177.715 177.715 177.043 0.672 25685 606 1 . 1 1 150 150 ILE CA C 150 64.319 64.319 63.781 0.538 25685 607 1 . 1 1 150 150 ILE CB C 150 36.628 36.628 37.286 -0.658 25685 608 1 . 1 1 150 150 ILE H H 150 8.772 8.772 8.204 0.568 25685 609 1 . 1 1 151 151 ALA N N 151 122.272 122.272 121.695 0.577 25685 610 1 . 1 1 151 151 ALA C C 151 180.370 180.370 179.413 0.957 25685 611 1 . 1 1 151 151 ALA CA C 151 55.336 55.336 55.273 0.063 25685 612 1 . 1 1 151 151 ALA CB C 151 18.107 18.107 17.874 0.233 25685 613 1 . 1 1 151 151 ALA H H 151 8.163 8.163 7.674 0.489 25685 614 1 . 1 1 152 152 ALA N N 152 120.648 120.648 120.984 -0.336 25685 615 1 . 1 1 152 152 ALA C C 152 181.019 181.019 179.941 1.078 25685 616 1 . 1 1 152 152 ALA CA C 152 54.944 54.944 54.788 0.156 25685 617 1 . 1 1 152 152 ALA CB C 152 18.963 18.963 18.445 0.517 25685 618 1 . 1 1 152 152 ALA H H 152 7.877 7.877 7.548 0.329 25685 619 1 . 1 1 153 153 VAL N N 153 119.372 119.372 119.249 0.123 25685 620 1 . 1 1 153 153 VAL C C 153 178.197 178.197 178.023 0.174 25685 621 1 . 1 1 153 153 VAL CA C 153 66.289 66.289 65.567 0.722 25685 622 1 . 1 1 153 153 VAL CB C 153 30.770 30.770 31.570 -0.800 25685 623 1 . 1 1 153 153 VAL H H 153 8.118 8.118 7.755 0.363 25685 624 1 . 1 1 154 154 PHE N N 154 120.362 120.362 119.707 0.655 25685 625 1 . 1 1 154 154 PHE C C 154 177.733 177.733 177.433 0.300 25685 626 1 . 1 1 154 154 PHE CA C 154 61.412 61.412 61.185 0.227 25685 627 1 . 1 1 154 154 PHE CB C 154 38.465 38.465 38.449 0.016 25685 628 1 . 1 1 154 154 PHE H H 154 8.508 8.508 8.461 0.047 25685 629 1 . 1 1 155 155 LYS N N 155 118.894 118.894 119.171 -0.277 25685 630 1 . 1 1 155 155 LYS C C 155 179.940 179.940 178.499 1.441 25685 631 1 . 1 1 155 155 LYS CA C 155 58.969 58.969 59.082 -0.113 25685 632 1 . 1 1 155 155 LYS CB C 155 31.725 31.725 32.092 -0.367 25685 633 1 . 1 1 155 155 LYS H H 155 8.035 8.035 7.707 0.328 25685 634 1 . 1 1 156 156 MET N N 156 118.853 118.853 117.319 1.534 25685 635 1 . 1 1 156 156 MET C C 156 179.245 179.245 177.772 1.473 25685 636 1 . 1 1 156 156 MET CA C 156 58.518 58.518 57.855 0.663 25685 637 1 . 1 1 156 156 MET CB C 156 31.912 31.912 31.034 0.878 25685 638 1 . 1 1 156 156 MET H H 156 8.014 8.014 7.604 0.410 25685 639 1 . 1 1 157 157 GLY N N 157 108.239 108.239 106.370 1.869 25685 640 1 . 1 1 157 157 GLY C C 157 174.637 174.637 175.251 -0.614 25685 641 1 . 1 1 157 157 GLY CA C 157 47.204 47.204 46.616 0.588 25685 642 1 . 1 1 157 157 GLY H H 157 8.614 8.614 7.658 0.956 25685 643 1 . 1 1 158 158 GLU N N 158 122.902 122.902 119.490 3.412 25685 644 1 . 1 1 158 158 GLU C C 158 177.851 177.851 176.033 1.818 25685 645 1 . 1 1 158 158 GLU CA C 158 60.203 60.203 56.430 3.773 25685 646 1 . 1 1 158 158 GLU CB C 158 28.870 28.870 31.308 -2.438 25685 647 1 . 1 1 158 158 GLU H H 158 8.550 8.550 7.682 0.868 25685 648 1 . 1 1 159 159 LYS N N 159 117.932 117.932 118.086 -0.154 25685 649 1 . 1 1 159 159 LYS C C 159 179.529 179.529 175.471 4.058 25685 650 1 . 1 1 159 159 LYS CA C 159 59.419 59.419 56.123 3.296 25685 651 1 . 1 1 159 159 LYS CB C 159 31.759 31.759 33.364 -1.605 25685 652 1 . 1 1 159 159 LYS H H 159 7.641 7.641 7.960 -0.319 25685 653 1 . 1 1 160 160 PHE N N 160 120.614 120.614 122.756 -2.142 25685 654 1 . 1 1 160 160 PHE C C 160 178.511 178.511 176.022 2.489 25685 655 1 . 1 1 160 160 PHE CA C 160 61.580 61.580 59.057 2.523 25685 656 1 . 1 1 160 160 PHE CB C 160 39.909 39.909 39.336 0.574 25685 657 1 . 1 1 160 160 PHE H H 160 8.026 8.026 8.358 -0.332 25685 658 1 . 1 1 161 161 VAL N N 161 119.870 119.870 118.049 1.821 25685 659 1 . 1 1 161 161 VAL C C 161 177.347 177.347 175.942 1.405 25685 660 1 . 1 1 161 161 VAL CA C 161 66.121 66.121 62.046 4.075 25685 661 1 . 1 1 161 161 VAL CB C 161 30.935 30.935 33.567 -2.632 25685 662 1 . 1 1 161 161 VAL H H 161 8.628 8.628 8.215 0.413 25685 663 1 . 1 1 162 162 LYS N N 162 116.237 116.237 121.717 -5.480 25685 664 1 . 1 1 162 162 LYS C C 162 179.197 179.197 175.765 3.432 25685 665 1 . 1 1 162 162 LYS CA C 162 60.037 60.037 58.249 1.788 25685 666 1 . 1 1 162 162 LYS CB C 162 31.333 31.333 32.723 -1.390 25685 667 1 . 1 1 162 162 LYS H H 162 7.843 7.843 8.432 -0.589 25685 668 1 . 1 1 163 163 ALA N N 163 119.197 119.197 118.334 0.863 25685 669 1 . 1 1 163 163 ALA C C 163 178.635 178.635 175.230 3.405 25685 670 1 . 1 1 163 163 ALA CA C 163 53.681 53.681 51.784 1.897 25685 671 1 . 1 1 163 163 ALA CB C 163 19.586 19.586 18.981 0.605 25685 672 1 . 1 1 163 163 ALA H H 163 7.630 7.630 7.789 -0.159 25685 673 1 . 1 1 164 164 ASN N N 164 115.956 115.956 117.796 -1.840 25685 674 1 . 1 1 164 164 ASN C C 164 175.556 175.556 175.962 -0.406 25685 675 1 . 1 1 164 164 ASN CA C 164 52.267 52.267 53.095 -0.829 25685 676 1 . 1 1 164 164 ASN CB C 164 39.148 39.148 38.592 0.556 25685 677 1 . 1 1 164 164 ASN H H 164 7.326 7.326 8.202 -0.876 25685 678 1 . 1 1 165 165 PHE N N 165 121.612 121.612 123.663 -2.051 25685 679 1 . 1 1 165 165 PHE C C 165 177.069 177.069 176.852 0.217 25685 680 1 . 1 1 165 165 PHE CA C 165 62.921 62.921 61.004 1.917 25685 681 1 . 1 1 165 165 PHE CB C 165 39.427 39.427 39.096 0.331 25685 682 1 . 1 1 165 165 PHE H H 165 7.408 7.408 8.733 -1.325 25685 683 1 . 1 1 166 166 GLN N N 166 117.147 117.147 117.915 -0.768 25685 684 1 . 1 1 166 166 GLN C C 166 178.922 178.922 178.183 0.739 25685 685 1 . 1 1 166 166 GLN CA C 166 59.262 59.262 58.520 0.742 25685 686 1 . 1 1 166 166 GLN CB C 166 26.811 26.811 27.858 -1.047 25685 687 1 . 1 1 166 166 GLN H H 166 8.605 8.605 8.524 0.081 25685 688 1 . 1 1 167 167 LEU N N 167 121.946 121.946 119.228 2.718 25685 689 1 . 1 1 167 167 LEU C C 167 178.863 178.863 178.636 0.227 25685 690 1 . 1 1 167 167 LEU CA C 167 58.039 58.039 57.474 0.565 25685 691 1 . 1 1 167 167 LEU CB C 167 41.130 41.130 41.583 -0.453 25685 692 1 . 1 1 167 167 LEU H H 167 7.892 7.892 7.605 0.287 25685 693 1 . 1 1 168 168 ILE N N 168 118.751 118.751 116.755 1.996 25685 694 1 . 1 1 168 168 ILE C C 168 179.908 179.908 177.600 2.308 25685 695 1 . 1 1 168 168 ILE CA C 168 63.886 63.886 64.019 -0.133 25685 696 1 . 1 1 168 168 ILE CB C 168 36.170 36.170 37.521 -1.351 25685 697 1 . 1 1 168 168 ILE H H 168 8.065 8.065 7.353 0.712 25685 698 1 . 1 1 169 169 ARG N N 169 125.851 125.851 119.128 6.723 25685 699 1 . 1 1 169 169 ARG C C 169 177.579 177.579 178.071 -0.492 25685 700 1 . 1 1 169 169 ARG CA C 169 60.306 60.306 59.241 1.065 25685 701 1 . 1 1 169 169 ARG CB C 169 29.224 29.224 29.716 -0.492 25685 702 1 . 1 1 169 169 ARG H H 169 8.995 8.995 7.682 1.313 25685 703 1 . 1 1 170 170 LYS N N 170 119.586 119.586 118.818 0.768 25685 704 1 . 1 1 170 170 LYS C C 170 178.584 178.584 178.469 0.115 25685 705 1 . 1 1 170 170 LYS CA C 170 60.293 60.293 59.203 1.090 25685 706 1 . 1 1 170 170 LYS CB C 170 32.530 32.530 31.572 0.958 25685 707 1 . 1 1 170 170 LYS H H 170 7.663 7.663 7.556 0.107 25685 708 1 . 1 1 171 171 VAL N N 171 118.348 118.348 118.457 -0.109 25685 709 1 . 1 1 171 171 VAL C C 171 177.478 177.478 177.571 -0.093 25685 710 1 . 1 1 171 171 VAL CA C 171 66.641 66.641 66.062 0.579 25685 711 1 . 1 1 171 171 VAL CB C 171 31.565 31.565 31.210 0.355 25685 712 1 . 1 1 171 171 VAL H H 171 8.515 8.515 7.623 0.892 25685 713 1 . 1 1 172 172 THR N N 172 115.172 115.172 114.725 0.447 25685 714 1 . 1 1 172 172 THR C C 172 176.320 176.320 176.477 -0.157 25685 715 1 . 1 1 172 172 THR H H 172 8.416 8.416 7.581 0.835 25685 716 1 . 1 1 173 173 GLY N N 173 108.801 108.801 108.709 0.092 25685 717 1 . 1 1 173 173 GLY C C 173 174.138 174.138 175.170 -1.032 25685 718 1 . 1 1 173 173 GLY CA C 173 47.769 47.769 46.729 1.040 25685 719 1 . 1 1 173 173 GLY H H 173 8.505 8.505 7.666 0.839 25685 720 1 . 1 1 174 174 ALA N N 174 123.573 123.573 124.265 -0.692 25685 721 1 . 1 1 174 174 ALA C C 174 178.782 178.782 179.051 -0.269 25685 722 1 . 1 1 174 174 ALA CA C 174 55.604 55.604 54.740 0.864 25685 723 1 . 1 1 174 174 ALA CB C 174 18.778 18.778 18.500 0.278 25685 724 1 . 1 1 174 174 ALA H H 174 8.038 8.038 7.449 0.589 25685 725 1 . 1 1 175 175 ILE N N 175 118.501 118.501 118.943 -0.442 25685 726 1 . 1 1 175 175 ILE C C 175 178.247 178.247 177.880 0.367 25685 727 1 . 1 1 175 175 ILE CA C 175 65.412 65.412 64.113 1.299 25685 728 1 . 1 1 175 175 ILE CB C 175 37.671 37.671 37.716 -0.045 25685 729 1 . 1 1 175 175 ILE H H 175 7.897 7.897 7.446 0.451 25685 730 1 . 1 1 176 176 VAL N N 176 120.104 120.104 119.100 1.004 25685 731 1 . 1 1 176 176 VAL C C 176 177.945 177.945 177.992 -0.047 25685 732 1 . 1 1 176 176 VAL CA C 176 67.761 67.761 66.167 1.594 25685 733 1 . 1 1 176 176 VAL CB C 176 30.662 30.662 31.473 -0.811 25685 734 1 . 1 1 176 176 VAL H H 176 8.321 8.321 7.670 0.651 25685 735 1 . 1 1 177 177 LEU N N 177 118.561 118.561 119.893 -1.332 25685 736 1 . 1 1 177 177 LEU C C 177 178.563 178.563 178.632 -0.069 25685 737 1 . 1 1 177 177 LEU CA C 177 58.094 58.094 57.807 0.287 25685 738 1 . 1 1 177 177 LEU CB C 177 41.061 41.061 41.038 0.023 25685 739 1 . 1 1 177 177 LEU H H 177 8.097 8.097 7.346 0.751 25685 740 1 . 1 1 178 178 LEU N N 178 120.868 120.868 119.752 1.116 25685 741 1 . 1 1 178 178 LEU C C 178 178.524 178.524 178.189 0.335 25685 742 1 . 1 1 178 178 LEU CA C 178 57.767 57.767 58.061 -0.294 25685 743 1 . 1 1 178 178 LEU CB C 178 40.886 40.886 41.448 -0.562 25685 744 1 . 1 1 178 178 LEU H H 178 8.229 8.229 7.432 0.797 25685 745 1 . 1 1 179 179 TYR N N 179 119.355 119.355 118.757 0.598 25685 746 1 . 1 1 179 179 TYR C C 179 180.059 180.059 177.443 2.616 25685 747 1 . 1 1 179 179 TYR CA C 179 63.844 63.844 61.027 2.817 25685 748 1 . 1 1 179 179 TYR CB C 179 39.508 39.508 38.223 1.285 25685 749 1 . 1 1 179 179 TYR H H 179 8.759 8.759 7.691 1.068 25685 750 1 . 1 1 180 180 LEU N N 180 118.984 118.984 119.005 -0.021 25685 751 1 . 1 1 180 180 LEU C C 180 179.079 179.079 179.172 -0.093 25685 752 1 . 1 1 180 180 LEU CA C 180 58.879 58.879 57.520 1.359 25685 753 1 . 1 1 180 180 LEU CB C 180 41.899 41.899 40.818 1.081 25685 754 1 . 1 1 180 180 LEU H H 180 8.315 8.315 7.616 0.699 25685 755 1 . 1 1 181 181 ALA N N 181 121.826 121.826 122.105 -0.279 25685 756 1 . 1 1 181 181 ALA C C 181 180.009 180.009 179.358 0.651 25685 757 1 . 1 1 181 181 ALA CA C 181 55.700 55.700 54.969 0.731 25685 758 1 . 1 1 181 181 ALA CB C 181 17.713 17.713 18.548 -0.835 25685 759 1 . 1 1 181 181 ALA H H 181 8.480 8.480 8.145 0.335 25685 760 1 . 1 1 182 182 TYR N N 182 118.039 118.039 117.930 0.109 25685 761 1 . 1 1 182 182 TYR CA C 182 59.038 59.038 61.582 -2.544 25685 762 1 . 1 1 182 182 TYR H H 182 8.856 8.856 7.878 0.978 25685 763 1 . 1 1 183 183 PHE N N 183 124.769 124.769 117.370 7.399 25685 764 1 . 1 1 183 183 PHE CA C 183 63.566 63.566 59.750 3.816 25685 765 1 . 1 1 183 183 PHE H H 183 9.764 9.764 7.593 2.171 25685 stop_ save_