data_19163 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 19163 _Entry.PDB_ID 2M6Y 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 19163 _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 11 11 MET HA H 11 4.346 4.346 4.417 -0.071 19163 2 1 1 . 1 1 11 11 MET C C 11 175.801 175.801 175.472 0.329 19163 3 1 1 . 1 1 11 11 MET CA C 11 55.614 55.614 55.456 0.157 19163 4 1 1 . 1 1 11 11 MET CB C 11 32.925 32.925 33.048 -0.123 19163 5 1 1 . 1 1 12 12 VAL N N 12 121.226 121.226 124.428 -3.202 19163 6 1 1 . 1 1 12 12 VAL HA H 12 4.026 4.026 4.281 -0.255 19163 7 1 1 . 1 1 12 12 VAL C C 12 175.701 175.701 174.281 1.420 19163 8 1 1 . 1 1 12 12 VAL CA C 12 62.188 62.188 62.342 -0.154 19163 9 1 1 . 1 1 12 12 VAL CB C 12 32.882 32.882 32.860 0.022 19163 10 1 1 . 1 1 12 12 VAL H H 12 7.988 7.988 8.510 -0.522 19163 11 1 1 . 1 1 13 13 LYS N N 13 125.255 125.255 127.076 -1.821 19163 12 1 1 . 1 1 13 13 LYS HA H 13 4.211 4.211 4.485 -0.274 19163 13 1 1 . 1 1 13 13 LYS C C 13 176.121 176.121 175.455 0.666 19163 14 1 1 . 1 1 13 13 LYS CA C 13 56.355 56.355 56.066 0.289 19163 15 1 1 . 1 1 13 13 LYS CB C 13 33.019 33.019 32.871 0.148 19163 16 1 1 . 1 1 13 13 LYS H H 13 8.281 8.281 8.324 -0.043 19163 17 1 1 . 1 1 14 14 GLU N N 14 123.004 123.004 122.971 0.033 19163 18 1 1 . 1 1 14 14 GLU HA H 14 4.305 4.305 4.016 0.289 19163 19 1 1 . 1 1 14 14 GLU C C 14 176.107 176.107 175.357 0.750 19163 20 1 1 . 1 1 14 14 GLU CA C 14 56.343 56.343 56.434 -0.091 19163 21 1 1 . 1 1 14 14 GLU CB C 14 30.534 30.534 29.588 0.946 19163 22 1 1 . 1 1 14 14 GLU H H 14 8.424 8.424 8.567 -0.143 19163 23 1 1 . 1 1 15 15 THR N N 15 115.895 115.895 117.560 -1.665 19163 24 1 1 . 1 1 15 15 THR HA H 15 4.538 4.538 4.345 0.193 19163 25 1 1 . 1 1 15 15 THR C C 15 175.233 175.233 174.272 0.961 19163 26 1 1 . 1 1 15 15 THR CA C 15 61.981 61.981 61.860 0.121 19163 27 1 1 . 1 1 15 15 THR CB C 15 69.865 69.865 69.347 0.519 19163 28 1 1 . 1 1 15 15 THR H H 15 8.335 8.335 8.130 0.205 19163 29 1 1 . 1 1 16 16 THR N N 16 116.992 116.992 115.947 1.045 19163 30 1 1 . 1 1 16 16 THR HA H 16 4.366 4.366 4.100 0.266 19163 31 1 1 . 1 1 16 16 THR C C 16 176.090 176.090 175.299 0.791 19163 32 1 1 . 1 1 16 16 THR CA C 16 62.172 62.172 60.654 1.518 19163 33 1 1 . 1 1 16 16 THR CB C 16 71.997 71.997 70.742 1.255 19163 34 1 1 . 1 1 16 16 THR H H 16 8.798 8.798 8.250 0.548 19163 35 1 1 . 1 1 17 17 TYR N N 17 117.617 117.617 121.095 -3.478 19163 36 1 1 . 1 1 17 17 TYR HA H 17 4.329 4.329 4.246 0.083 19163 37 1 1 . 1 1 17 17 TYR C C 17 177.105 177.105 177.999 -0.894 19163 38 1 1 . 1 1 17 17 TYR CA C 17 57.577 57.577 62.417 -4.840 19163 39 1 1 . 1 1 17 17 TYR CB C 17 37.113 37.113 37.617 -0.504 19163 40 1 1 . 1 1 17 17 TYR H H 17 8.292 8.292 8.428 -0.136 19163 41 1 1 . 1 1 18 18 TYR N N 18 115.048 115.048 117.466 -2.418 19163 42 1 1 . 1 1 18 18 TYR HA H 18 3.775 3.775 4.303 -0.528 19163 43 1 1 . 1 1 18 18 TYR C C 18 177.771 177.771 177.972 -0.201 19163 44 1 1 . 1 1 18 18 TYR CA C 18 61.430 61.430 58.159 3.271 19163 45 1 1 . 1 1 18 18 TYR CB C 18 36.495 36.495 37.173 -0.679 19163 46 1 1 . 1 1 18 18 TYR H H 18 7.047 7.047 8.056 -1.009 19163 47 1 1 . 1 1 19 19 ASP N N 19 119.520 119.520 120.426 -0.906 19163 48 1 1 . 1 1 19 19 ASP HA H 19 4.406 4.406 4.408 -0.002 19163 49 1 1 . 1 1 19 19 ASP C C 19 180.128 180.128 178.684 1.444 19163 50 1 1 . 1 1 19 19 ASP CA C 19 57.475 57.475 57.426 0.049 19163 51 1 1 . 1 1 19 19 ASP CB C 19 40.659 40.659 41.122 -0.463 19163 52 1 1 . 1 1 19 19 ASP H H 19 7.685 7.685 8.018 -0.333 19163 53 1 1 . 1 1 20 20 VAL N N 20 119.772 119.772 118.665 1.107 19163 54 1 1 . 1 1 20 20 VAL HA H 20 3.608 3.608 3.720 -0.112 19163 55 1 1 . 1 1 20 20 VAL C C 20 177.026 177.026 177.445 -0.419 19163 56 1 1 . 1 1 20 20 VAL CA C 20 65.840 65.840 65.562 0.278 19163 57 1 1 . 1 1 20 20 VAL CB C 20 31.530 31.530 31.570 -0.040 19163 58 1 1 . 1 1 20 20 VAL H H 20 8.004 8.004 8.510 -0.506 19163 59 1 1 . 1 1 21 21 LEU N N 21 115.252 115.252 115.878 -0.626 19163 60 1 1 . 1 1 21 21 LEU HA H 21 4.281 4.281 4.370 -0.089 19163 61 1 1 . 1 1 21 21 LEU C C 21 175.757 175.757 177.379 -1.622 19163 62 1 1 . 1 1 21 21 LEU CA C 21 54.554 54.554 54.616 -0.062 19163 63 1 1 . 1 1 21 21 LEU CB C 21 42.869 42.869 41.876 0.993 19163 64 1 1 . 1 1 21 21 LEU H H 21 6.847 6.847 7.642 -0.795 19163 65 1 1 . 1 1 22 22 GLY N N 22 108.227 108.227 107.461 0.766 19163 66 1 1 . 1 1 22 22 GLY C C 22 175.361 175.361 174.371 0.990 19163 67 1 1 . 1 1 22 22 GLY CA C 22 46.574 46.574 45.746 0.828 19163 68 1 1 . 1 1 22 22 GLY H H 22 7.874 7.874 7.478 0.396 19163 69 1 1 . 1 1 23 23 VAL N N 23 110.675 110.675 119.100 -8.425 19163 70 1 1 . 1 1 23 23 VAL HA H 23 4.767 4.767 4.392 0.375 19163 71 1 1 . 1 1 23 23 VAL C C 23 174.674 174.674 174.705 -0.031 19163 72 1 1 . 1 1 23 23 VAL CA C 23 58.349 58.349 59.726 -1.377 19163 73 1 1 . 1 1 23 23 VAL CB C 23 34.938 34.938 34.900 0.038 19163 74 1 1 . 1 1 23 23 VAL H H 23 7.815 7.815 8.078 -0.263 19163 75 1 1 . 1 1 24 24 LYS N N 24 119.948 119.948 123.193 -3.245 19163 76 1 1 . 1 1 24 24 LYS HA H 24 4.488 4.488 4.715 -0.227 19163 77 1 1 . 1 1 24 24 LYS C C 24 175.442 175.442 176.197 -0.755 19163 78 1 1 . 1 1 24 24 LYS CA C 24 54.001 54.001 54.099 -0.098 19163 79 1 1 . 1 1 24 24 LYS CB C 24 32.197 32.197 31.744 0.453 19163 80 1 1 . 1 1 24 24 LYS H H 24 8.329 8.329 7.991 0.338 19163 81 1 1 . 1 1 25 25 PRO HA H 25 2.421 2.421 4.004 -1.583 19163 82 1 1 . 1 1 25 25 PRO C C 25 175.635 175.635 176.266 -0.631 19163 83 1 1 . 1 1 25 25 PRO CA C 25 63.362 63.362 65.119 -1.757 19163 84 1 1 . 1 1 25 25 PRO CB C 25 31.839 31.839 31.799 0.040 19163 85 1 1 . 1 1 26 26 ASN N N 26 111.739 111.739 114.020 -2.281 19163 86 1 1 . 1 1 26 26 ASN HA H 26 4.518 4.518 4.696 -0.178 19163 87 1 1 . 1 1 26 26 ASN C C 26 175.820 175.820 174.591 1.229 19163 88 1 1 . 1 1 26 26 ASN CA C 26 51.525 51.525 51.111 0.414 19163 89 1 1 . 1 1 26 26 ASN CB C 26 36.829 36.829 37.314 -0.485 19163 90 1 1 . 1 1 26 26 ASN H H 26 7.138 7.138 8.173 -1.035 19163 91 1 1 . 1 1 27 27 ALA N N 27 122.829 122.829 123.795 -0.966 19163 92 1 1 . 1 1 27 27 ALA HA H 27 4.325 4.325 4.193 0.132 19163 93 1 1 . 1 1 27 27 ALA C C 27 178.726 178.726 177.455 1.271 19163 94 1 1 . 1 1 27 27 ALA CA C 27 52.961 52.961 52.437 0.524 19163 95 1 1 . 1 1 27 27 ALA CB C 27 19.159 19.159 19.293 -0.134 19163 96 1 1 . 1 1 27 27 ALA H H 27 7.637 7.637 7.294 0.343 19163 97 1 1 . 1 1 28 28 THR N N 28 113.468 113.468 114.161 -0.693 19163 98 1 1 . 1 1 28 28 THR HA H 28 4.493 4.493 4.298 0.195 19163 99 1 1 . 1 1 28 28 THR C C 28 175.641 175.641 175.717 -0.076 19163 100 1 1 . 1 1 28 28 THR CA C 28 60.592 60.592 61.070 -0.478 19163 101 1 1 . 1 1 28 28 THR CB C 28 71.304 71.304 70.105 1.200 19163 102 1 1 . 1 1 28 28 THR H H 28 8.829 8.829 7.891 0.938 19163 103 1 1 . 1 1 29 29 GLN N N 29 119.445 119.445 122.441 -2.996 19163 104 1 1 . 1 1 29 29 GLN HA H 29 4.035 4.035 3.970 0.065 19163 105 1 1 . 1 1 29 29 GLN C C 29 179.117 179.117 178.473 0.644 19163 106 1 1 . 1 1 29 29 GLN CA C 29 59.435 59.435 60.284 -0.849 19163 107 1 1 . 1 1 29 29 GLN CB C 29 27.851 27.851 28.350 -0.499 19163 108 1 1 . 1 1 29 29 GLN H H 29 9.015 9.015 8.819 0.196 19163 109 1 1 . 1 1 30 30 GLU N N 30 119.343 119.343 118.939 0.404 19163 110 1 1 . 1 1 30 30 GLU HA H 30 4.059 4.059 4.097 -0.038 19163 111 1 1 . 1 1 30 30 GLU C C 30 179.097 179.097 178.483 0.614 19163 112 1 1 . 1 1 30 30 GLU CA C 30 59.847 59.847 59.531 0.316 19163 113 1 1 . 1 1 30 30 GLU CB C 30 29.356 29.356 29.245 0.111 19163 114 1 1 . 1 1 30 30 GLU H H 30 8.549 8.549 8.610 -0.061 19163 115 1 1 . 1 1 31 31 GLU N N 31 120.562 120.562 120.533 0.029 19163 116 1 1 . 1 1 31 31 GLU HA H 31 3.906 3.906 4.091 -0.185 19163 117 1 1 . 1 1 31 31 GLU C C 31 180.405 180.405 179.194 1.211 19163 118 1 1 . 1 1 31 31 GLU CA C 31 59.592 59.592 59.300 0.292 19163 119 1 1 . 1 1 31 31 GLU CB C 31 29.989 29.989 29.543 0.446 19163 120 1 1 . 1 1 31 31 GLU H H 31 7.768 7.768 8.083 -0.315 19163 121 1 1 . 1 1 32 32 LEU N N 32 120.518 120.518 120.182 0.336 19163 122 1 1 . 1 1 32 32 LEU HA H 32 3.963 3.963 4.064 -0.101 19163 123 1 1 . 1 1 32 32 LEU C C 32 177.873 177.873 179.204 -1.331 19163 124 1 1 . 1 1 32 32 LEU CA C 32 58.593 58.593 57.914 0.679 19163 125 1 1 . 1 1 32 32 LEU CB C 32 42.556 42.556 41.196 1.360 19163 126 1 1 . 1 1 32 32 LEU H H 32 8.475 8.475 8.619 -0.144 19163 127 1 1 . 1 1 33 33 LYS N N 33 119.091 119.091 119.495 -0.404 19163 128 1 1 . 1 1 33 33 LYS HA H 33 4.000 4.000 4.205 -0.205 19163 129 1 1 . 1 1 33 33 LYS C C 33 178.701 178.701 179.285 -0.584 19163 130 1 1 . 1 1 33 33 LYS CA C 33 60.274 60.274 60.177 0.097 19163 131 1 1 . 1 1 33 33 LYS CB C 33 32.656 32.656 32.240 0.416 19163 132 1 1 . 1 1 33 33 LYS H H 33 8.077 8.077 7.733 0.344 19163 133 1 1 . 1 1 34 34 LYS N N 34 118.527 118.527 119.516 -0.989 19163 134 1 1 . 1 1 34 34 LYS HA H 34 3.890 3.890 4.073 -0.183 19163 135 1 1 . 1 1 34 34 LYS C C 34 179.172 179.172 178.996 0.176 19163 136 1 1 . 1 1 34 34 LYS CA C 34 59.927 59.927 59.336 0.591 19163 137 1 1 . 1 1 34 34 LYS CB C 34 32.869 32.869 32.336 0.533 19163 138 1 1 . 1 1 34 34 LYS H H 34 7.986 7.986 8.144 -0.158 19163 139 1 1 . 1 1 35 35 ALA N N 35 122.190 122.190 123.126 -0.936 19163 140 1 1 . 1 1 35 35 ALA HA H 35 4.116 4.116 4.059 0.057 19163 141 1 1 . 1 1 35 35 ALA C C 35 179.982 179.982 178.925 1.057 19163 142 1 1 . 1 1 35 35 ALA CA C 35 55.157 55.157 55.335 -0.178 19163 143 1 1 . 1 1 35 35 ALA CB C 35 18.773 18.773 18.306 0.467 19163 144 1 1 . 1 1 35 35 ALA H H 35 7.917 7.917 8.379 -0.462 19163 145 1 1 . 1 1 36 36 TYR N N 36 117.701 117.701 120.380 -2.679 19163 146 1 1 . 1 1 36 36 TYR HA H 36 3.818 3.818 3.998 -0.180 19163 147 1 1 . 1 1 36 36 TYR C C 36 176.344 176.344 177.571 -1.227 19163 148 1 1 . 1 1 36 36 TYR CA C 36 61.468 61.468 61.523 -0.055 19163 149 1 1 . 1 1 36 36 TYR CB C 36 38.890 38.890 38.203 0.687 19163 150 1 1 . 1 1 36 36 TYR H H 36 8.402 8.402 7.823 0.579 19163 151 1 1 . 1 1 37 37 ARG N N 37 117.423 117.423 119.175 -1.752 19163 152 1 1 . 1 1 37 37 ARG HA H 37 3.481 3.481 3.784 -0.303 19163 153 1 1 . 1 1 37 37 ARG C C 37 178.825 178.825 178.295 0.530 19163 154 1 1 . 1 1 37 37 ARG CA C 37 59.397 59.397 59.789 -0.393 19163 155 1 1 . 1 1 37 37 ARG CB C 37 29.710 29.710 30.110 -0.400 19163 156 1 1 . 1 1 37 37 ARG H H 37 8.264 8.264 8.234 0.030 19163 157 1 1 . 1 1 38 38 LYS N N 38 117.247 117.247 120.036 -2.789 19163 158 1 1 . 1 1 38 38 LYS HA H 38 3.905 3.905 4.042 -0.137 19163 159 1 1 . 1 1 38 38 LYS C C 38 179.444 179.444 179.168 0.276 19163 160 1 1 . 1 1 38 38 LYS CA C 38 59.450 59.450 59.533 -0.083 19163 161 1 1 . 1 1 38 38 LYS CB C 38 32.609 32.609 32.347 0.262 19163 162 1 1 . 1 1 38 38 LYS H H 38 7.444 7.444 8.026 -0.582 19163 163 1 1 . 1 1 39 39 LEU N N 39 119.901 119.901 119.467 0.434 19163 164 1 1 . 1 1 39 39 LEU HA H 39 4.020 4.020 4.054 -0.034 19163 165 1 1 . 1 1 39 39 LEU C C 39 178.801 178.801 178.743 0.058 19163 166 1 1 . 1 1 39 39 LEU CA C 39 57.409 57.409 57.983 -0.574 19163 167 1 1 . 1 1 39 39 LEU CB C 39 42.388 42.388 41.659 0.729 19163 168 1 1 . 1 1 39 39 LEU H H 39 7.707 7.707 8.207 -0.500 19163 169 1 1 . 1 1 40 40 ALA N N 40 122.772 122.772 122.363 0.409 19163 170 1 1 . 1 1 40 40 ALA HA H 40 3.849 3.849 4.048 -0.199 19163 171 1 1 . 1 1 40 40 ALA C C 40 179.446 179.446 179.681 -0.235 19163 172 1 1 . 1 1 40 40 ALA CA C 40 55.109 55.109 55.164 -0.055 19163 173 1 1 . 1 1 40 40 ALA CB C 40 17.116 17.116 18.059 -0.944 19163 174 1 1 . 1 1 40 40 ALA H H 40 8.931 8.931 8.181 0.750 19163 175 1 1 . 1 1 41 41 LEU N N 41 115.299 115.299 116.801 -1.502 19163 176 1 1 . 1 1 41 41 LEU HA H 41 3.977 3.977 3.945 0.032 19163 177 1 1 . 1 1 41 41 LEU C C 41 178.216 178.216 178.113 0.103 19163 178 1 1 . 1 1 41 41 LEU CA C 41 57.088 57.088 57.128 -0.040 19163 179 1 1 . 1 1 41 41 LEU CB C 41 42.162 42.162 41.839 0.323 19163 180 1 1 . 1 1 41 41 LEU H H 41 7.133 7.133 7.628 -0.495 19163 181 1 1 . 1 1 42 42 LYS N N 42 116.812 116.812 116.192 0.620 19163 182 1 1 . 1 1 42 42 LYS HA H 42 3.925 3.925 4.017 -0.092 19163 183 1 1 . 1 1 42 42 LYS C C 42 177.560 177.560 177.910 -0.350 19163 184 1 1 . 1 1 42 42 LYS CA C 42 57.885 57.885 57.658 0.227 19163 185 1 1 . 1 1 42 42 LYS CB C 42 33.427 33.427 32.727 0.700 19163 186 1 1 . 1 1 42 42 LYS H H 42 7.038 7.038 7.381 -0.343 19163 187 1 1 . 1 1 43 43 TYR N N 43 114.022 114.022 115.671 -1.649 19163 188 1 1 . 1 1 43 43 TYR HA H 43 4.665 4.665 4.625 0.040 19163 189 1 1 . 1 1 43 43 TYR C C 43 173.741 173.741 174.347 -0.606 19163 190 1 1 . 1 1 43 43 TYR CA C 43 56.928 56.928 56.323 0.605 19163 191 1 1 . 1 1 43 43 TYR CB C 43 39.579 39.579 37.497 2.082 19163 192 1 1 . 1 1 43 43 TYR H H 43 7.683 7.683 8.253 -0.570 19163 193 1 1 . 1 1 44 44 HIS N N 44 120.947 120.947 122.941 -1.994 19163 194 1 1 . 1 1 44 44 HIS HA H 44 3.697 3.697 4.104 -0.407 19163 195 1 1 . 1 1 44 44 HIS C C 44 174.925 174.925 174.670 0.255 19163 196 1 1 . 1 1 44 44 HIS CA C 44 56.229 56.229 55.847 0.382 19163 197 1 1 . 1 1 44 44 HIS CB C 44 30.852 30.852 31.160 -0.308 19163 198 1 1 . 1 1 44 44 HIS H H 44 7.814 7.814 7.767 0.047 19163 199 1 1 . 1 1 45 45 PRO HA H 45 4.131 4.131 4.288 -0.157 19163 200 1 1 . 1 1 45 45 PRO C C 45 177.269 177.269 177.516 -0.247 19163 201 1 1 . 1 1 45 45 PRO CA C 45 64.723 64.723 64.984 -0.261 19163 202 1 1 . 1 1 45 45 PRO CB C 45 32.070 32.070 31.883 0.187 19163 203 1 1 . 1 1 46 46 ASP N N 46 119.127 119.127 116.840 2.287 19163 204 1 1 . 1 1 46 46 ASP HA H 46 4.375 4.375 4.498 -0.123 19163 205 1 1 . 1 1 46 46 ASP C C 46 177.284 177.284 177.230 0.054 19163 206 1 1 . 1 1 46 46 ASP CA C 46 56.020 56.020 56.359 -0.340 19163 207 1 1 . 1 1 46 46 ASP CB C 46 40.221 40.221 40.598 -0.377 19163 208 1 1 . 1 1 46 46 ASP H H 46 10.040 10.040 8.156 1.884 19163 209 1 1 . 1 1 47 47 LYS N N 47 117.416 117.416 118.748 -1.332 19163 210 1 1 . 1 1 47 47 LYS HA H 47 4.315 4.315 4.351 -0.036 19163 211 1 1 . 1 1 47 47 LYS C C 47 176.355 176.355 176.287 0.068 19163 212 1 1 . 1 1 47 47 LYS CA C 47 55.880 55.880 57.283 -1.403 19163 213 1 1 . 1 1 47 47 LYS CB C 47 33.778 33.778 34.794 -1.016 19163 214 1 1 . 1 1 47 47 LYS H H 47 7.826 7.826 7.830 -0.004 19163 215 1 1 . 1 1 48 48 ASN N N 48 116.573 116.573 118.468 -1.895 19163 216 1 1 . 1 1 48 48 ASN HA H 48 5.021 5.021 5.167 -0.146 19163 217 1 1 . 1 1 48 48 ASN C C 48 172.992 172.992 173.740 -0.748 19163 218 1 1 . 1 1 48 48 ASN CA C 48 50.467 50.467 50.817 -0.350 19163 219 1 1 . 1 1 48 48 ASN CB C 48 39.284 39.284 39.409 -0.125 19163 220 1 1 . 1 1 48 48 ASN H H 48 7.956 7.956 8.333 -0.377 19163 221 1 1 . 1 1 49 49 PRO HA H 49 4.448 4.448 4.355 0.093 19163 222 1 1 . 1 1 49 49 PRO C C 49 178.030 178.030 177.510 0.520 19163 223 1 1 . 1 1 49 49 PRO CA C 49 64.468 64.468 64.615 -0.147 19163 224 1 1 . 1 1 49 49 PRO CB C 49 32.173 32.173 31.937 0.236 19163 225 1 1 . 1 1 50 50 ASN N N 50 115.567 115.567 115.559 0.008 19163 226 1 1 . 1 1 50 50 ASN HA H 50 4.748 4.748 4.500 0.248 19163 227 1 1 . 1 1 50 50 ASN C C 50 176.443 176.443 176.473 -0.030 19163 228 1 1 . 1 1 50 50 ASN CA C 50 54.677 54.677 55.643 -0.966 19163 229 1 1 . 1 1 50 50 ASN CB C 50 39.014 39.014 38.217 0.797 19163 230 1 1 . 1 1 50 50 ASN H H 50 8.398 8.398 8.566 -0.168 19163 231 1 1 . 1 1 51 51 GLU N N 51 119.270 119.270 118.726 0.544 19163 232 1 1 . 1 1 51 51 GLU HA H 51 4.797 4.797 4.512 0.285 19163 233 1 1 . 1 1 51 51 GLU C C 51 176.922 176.922 177.990 -1.068 19163 234 1 1 . 1 1 51 51 GLU CA C 51 55.916 55.916 56.375 -0.459 19163 235 1 1 . 1 1 51 51 GLU CB C 51 29.200 29.200 29.479 -0.279 19163 236 1 1 . 1 1 51 51 GLU H H 51 7.485 7.485 7.740 -0.255 19163 237 1 1 . 1 1 52 52 GLY N N 52 107.541 107.541 108.452 -0.911 19163 238 1 1 . 1 1 52 52 GLY C C 52 176.755 176.755 175.680 1.075 19163 239 1 1 . 1 1 52 52 GLY CA C 52 47.914 47.914 46.791 1.123 19163 240 1 1 . 1 1 52 52 GLY H H 52 8.092 8.092 7.624 0.468 19163 241 1 1 . 1 1 53 53 GLU N N 53 121.603 121.603 120.717 0.886 19163 242 1 1 . 1 1 53 53 GLU HA H 53 4.065 4.065 4.030 0.035 19163 243 1 1 . 1 1 53 53 GLU C C 53 179.052 179.052 178.899 0.153 19163 244 1 1 . 1 1 53 53 GLU CA C 53 59.280 59.280 59.169 0.111 19163 245 1 1 . 1 1 53 53 GLU CB C 53 28.968 28.968 29.388 -0.420 19163 246 1 1 . 1 1 53 53 GLU H H 53 8.496 8.496 7.921 0.575 19163 247 1 1 . 1 1 54 54 LYS N N 54 120.837 120.837 119.448 1.389 19163 248 1 1 . 1 1 54 54 LYS HA H 54 3.923 3.923 4.072 -0.149 19163 249 1 1 . 1 1 54 54 LYS C C 54 179.058 179.058 178.817 0.241 19163 250 1 1 . 1 1 54 54 LYS CA C 54 58.800 58.800 58.827 -0.027 19163 251 1 1 . 1 1 54 54 LYS CB C 54 31.551 31.551 32.324 -0.773 19163 252 1 1 . 1 1 54 54 LYS H H 54 7.857 7.857 7.501 0.356 19163 253 1 1 . 1 1 55 55 PHE N N 55 118.608 118.608 120.600 -1.992 19163 254 1 1 . 1 1 55 55 PHE HA H 55 4.021 4.021 4.182 -0.161 19163 255 1 1 . 1 1 55 55 PHE C C 55 178.001 178.001 176.938 1.063 19163 256 1 1 . 1 1 55 55 PHE CA C 55 61.911 61.911 61.015 0.896 19163 257 1 1 . 1 1 55 55 PHE CB C 55 38.553 38.553 38.963 -0.410 19163 258 1 1 . 1 1 55 55 PHE H H 55 8.382 8.382 8.098 0.284 19163 259 1 1 . 1 1 56 56 LYS N N 56 120.898 120.898 119.262 1.636 19163 260 1 1 . 1 1 56 56 LYS HA H 56 3.828 3.828 3.918 -0.090 19163 261 1 1 . 1 1 56 56 LYS C C 56 178.817 178.817 178.906 -0.089 19163 262 1 1 . 1 1 56 56 LYS CA C 56 59.877 59.877 60.229 -0.352 19163 263 1 1 . 1 1 56 56 LYS CB C 56 32.133 32.133 31.920 0.213 19163 264 1 1 . 1 1 56 56 LYS H H 56 8.111 8.111 7.826 0.285 19163 265 1 1 . 1 1 57 57 GLN N N 57 118.600 118.600 118.595 0.005 19163 266 1 1 . 1 1 57 57 GLN HA H 57 4.009 4.009 4.066 -0.057 19163 267 1 1 . 1 1 57 57 GLN C C 57 179.333 179.333 178.420 0.913 19163 268 1 1 . 1 1 57 57 GLN CA C 57 59.109 59.109 58.705 0.404 19163 269 1 1 . 1 1 57 57 GLN CB C 57 28.595 28.595 28.655 -0.060 19163 270 1 1 . 1 1 57 57 GLN H H 57 7.613 7.613 7.692 -0.079 19163 271 1 1 . 1 1 58 58 ILE N N 58 118.709 118.709 120.688 -1.979 19163 272 1 1 . 1 1 58 58 ILE HA H 58 3.559 3.559 3.558 0.001 19163 273 1 1 . 1 1 58 58 ILE C C 58 177.152 177.152 178.101 -0.949 19163 274 1 1 . 1 1 58 58 ILE CA C 58 65.068 65.068 65.393 -0.325 19163 275 1 1 . 1 1 58 58 ILE CB C 58 38.381 38.381 37.466 0.915 19163 276 1 1 . 1 1 58 58 ILE H H 58 8.011 8.011 7.434 0.577 19163 277 1 1 . 1 1 59 59 SER N N 59 116.112 116.112 115.559 0.553 19163 278 1 1 . 1 1 59 59 SER HA H 59 3.948 3.948 4.094 -0.146 19163 279 1 1 . 1 1 59 59 SER C C 59 175.949 175.949 176.859 -0.910 19163 280 1 1 . 1 1 59 59 SER CA C 59 62.315 62.315 62.284 0.031 19163 281 1 1 . 1 1 59 59 SER H H 59 8.030 8.030 8.329 -0.299 19163 282 1 1 . 1 1 60 60 GLN N N 60 122.099 122.099 121.234 0.865 19163 283 1 1 . 1 1 60 60 GLN HA H 60 3.801 3.801 3.996 -0.195 19163 284 1 1 . 1 1 60 60 GLN C C 60 176.942 176.942 178.319 -1.377 19163 285 1 1 . 1 1 60 60 GLN CA C 60 58.762 58.762 58.884 -0.122 19163 286 1 1 . 1 1 60 60 GLN CB C 60 28.498 28.498 28.764 -0.266 19163 287 1 1 . 1 1 60 60 GLN H H 60 7.933 7.933 7.679 0.254 19163 288 1 1 . 1 1 61 61 ALA N N 61 119.367 119.367 122.212 -2.845 19163 289 1 1 . 1 1 61 61 ALA HA H 61 2.636 2.636 4.040 -1.404 19163 290 1 1 . 1 1 61 61 ALA C C 61 178.507 178.507 179.450 -0.943 19163 291 1 1 . 1 1 61 61 ALA CA C 61 54.126 54.126 54.970 -0.844 19163 292 1 1 . 1 1 61 61 ALA CB C 61 18.462 18.462 18.449 0.013 19163 293 1 1 . 1 1 61 61 ALA H H 61 7.354 7.354 8.152 -0.798 19163 294 1 1 . 1 1 62 62 TYR N N 62 115.613 115.613 120.228 -4.615 19163 295 1 1 . 1 1 62 62 TYR HA H 62 3.633 3.633 4.055 -0.422 19163 296 1 1 . 1 1 62 62 TYR C C 62 177.421 177.421 177.371 0.050 19163 297 1 1 . 1 1 62 62 TYR CA C 62 61.676 61.676 61.380 0.296 19163 298 1 1 . 1 1 62 62 TYR CB C 62 39.162 39.162 38.377 0.785 19163 299 1 1 . 1 1 62 62 TYR H H 62 7.994 7.994 8.702 -0.708 19163 300 1 1 . 1 1 63 63 GLU N N 63 121.396 121.396 120.390 1.006 19163 301 1 1 . 1 1 63 63 GLU HA H 63 3.347 3.347 3.795 -0.448 19163 302 1 1 . 1 1 63 63 GLU C C 63 177.687 177.687 179.084 -1.397 19163 303 1 1 . 1 1 63 63 GLU CA C 63 59.562 59.562 58.851 0.711 19163 304 1 1 . 1 1 63 63 GLU CB C 63 29.115 29.115 28.870 0.245 19163 305 1 1 . 1 1 63 63 GLU H H 63 8.151 8.151 8.033 0.118 19163 306 1 1 . 1 1 64 64 VAL N N 64 115.850 115.850 119.903 -4.053 19163 307 1 1 . 1 1 64 64 VAL HA H 64 3.377 3.377 3.768 -0.391 19163 308 1 1 . 1 1 64 64 VAL C C 64 175.925 175.925 177.532 -1.607 19163 309 1 1 . 1 1 64 64 VAL CA C 64 65.806 65.806 65.178 0.628 19163 310 1 1 . 1 1 64 64 VAL CB C 64 31.786 31.786 31.312 0.474 19163 311 1 1 . 1 1 64 64 VAL H H 64 6.814 6.814 7.392 -0.578 19163 312 1 1 . 1 1 65 65 LEU N N 65 111.438 111.438 120.915 -9.477 19163 313 1 1 . 1 1 65 65 LEU HA H 65 3.569 3.569 4.031 -0.462 19163 314 1 1 . 1 1 65 65 LEU C C 65 177.124 177.124 178.216 -1.092 19163 315 1 1 . 1 1 65 65 LEU CA C 65 56.645 56.645 57.427 -0.782 19163 316 1 1 . 1 1 65 65 LEU CB C 65 42.589 42.589 41.220 1.369 19163 317 1 1 . 1 1 65 65 LEU H H 65 7.398 7.398 8.424 -1.026 19163 318 1 1 . 1 1 66 66 SER N N 66 108.642 108.642 109.684 -1.042 19163 319 1 1 . 1 1 66 66 SER HA H 66 4.028 4.028 4.036 -0.008 19163 320 1 1 . 1 1 66 66 SER C C 66 173.286 173.286 174.189 -0.903 19163 321 1 1 . 1 1 66 66 SER CA C 66 59.232 59.232 59.805 -0.573 19163 322 1 1 . 1 1 66 66 SER CB C 66 63.066 63.066 63.089 -0.023 19163 323 1 1 . 1 1 66 66 SER H H 66 7.700 7.700 7.733 -0.033 19163 324 1 1 . 1 1 67 67 ASP N N 67 124.276 124.276 121.553 2.723 19163 325 1 1 . 1 1 67 67 ASP HA H 67 4.668 4.668 4.730 -0.062 19163 326 1 1 . 1 1 67 67 ASP C C 67 174.913 174.913 175.338 -0.425 19163 327 1 1 . 1 1 67 67 ASP CA C 67 52.487 52.487 53.213 -0.726 19163 328 1 1 . 1 1 67 67 ASP CB C 67 43.218 43.218 42.949 0.269 19163 329 1 1 . 1 1 67 67 ASP H H 67 6.879 6.879 7.292 -0.413 19163 330 1 1 . 1 1 68 68 ALA N N 68 127.326 127.326 130.246 -2.920 19163 331 1 1 . 1 1 68 68 ALA HA H 68 3.853 3.853 3.891 -0.038 19163 332 1 1 . 1 1 68 68 ALA C C 68 180.336 180.336 179.049 1.287 19163 333 1 1 . 1 1 68 68 ALA CA C 68 55.912 55.912 55.483 0.429 19163 334 1 1 . 1 1 68 68 ALA CB C 68 18.645 18.645 18.517 0.128 19163 335 1 1 . 1 1 68 68 ALA H H 68 8.693 8.693 8.788 -0.095 19163 336 1 1 . 1 1 69 69 LYS N N 69 116.929 116.929 117.984 -1.055 19163 337 1 1 . 1 1 69 69 LYS HA H 69 4.162 4.162 3.973 0.189 19163 338 1 1 . 1 1 69 69 LYS C C 69 179.515 179.515 178.696 0.819 19163 339 1 1 . 1 1 69 69 LYS CA C 69 58.562 58.562 59.567 -1.005 19163 340 1 1 . 1 1 69 69 LYS CB C 69 31.840 31.840 32.129 -0.289 19163 341 1 1 . 1 1 69 69 LYS H H 69 7.950 7.950 8.455 -0.505 19163 342 1 1 . 1 1 70 70 LYS N N 70 121.286 121.286 118.931 2.355 19163 343 1 1 . 1 1 70 70 LYS HA H 70 3.960 3.960 3.941 0.019 19163 344 1 1 . 1 1 70 70 LYS C C 70 179.938 179.938 179.022 0.916 19163 345 1 1 . 1 1 70 70 LYS CA C 70 60.066 60.066 59.613 0.453 19163 346 1 1 . 1 1 70 70 LYS CB C 70 32.695 32.695 32.238 0.457 19163 347 1 1 . 1 1 70 70 LYS H H 70 8.184 8.184 8.198 -0.014 19163 348 1 1 . 1 1 71 71 ARG N N 71 122.794 122.794 119.758 3.036 19163 349 1 1 . 1 1 71 71 ARG HA H 71 3.668 3.668 3.941 -0.273 19163 350 1 1 . 1 1 71 71 ARG C C 71 177.356 177.356 178.364 -1.008 19163 351 1 1 . 1 1 71 71 ARG CA C 71 60.127 60.127 59.980 0.147 19163 352 1 1 . 1 1 71 71 ARG CB C 71 29.668 29.668 30.163 -0.495 19163 353 1 1 . 1 1 71 71 ARG H H 71 9.290 9.290 8.167 1.123 19163 354 1 1 . 1 1 72 72 GLU N N 72 118.390 118.390 119.682 -1.292 19163 355 1 1 . 1 1 72 72 GLU HA H 72 4.096 4.096 4.156 -0.060 19163 356 1 1 . 1 1 72 72 GLU C C 72 179.073 179.073 179.009 0.064 19163 357 1 1 . 1 1 72 72 GLU CA C 72 59.456 59.456 59.102 0.354 19163 358 1 1 . 1 1 72 72 GLU CB C 72 29.615 29.615 29.745 -0.130 19163 359 1 1 . 1 1 72 72 GLU H H 72 7.607 7.607 7.866 -0.259 19163 360 1 1 . 1 1 73 73 LEU N N 73 117.921 117.921 120.159 -2.238 19163 361 1 1 . 1 1 73 73 LEU HA H 73 4.032 4.032 3.978 0.054 19163 362 1 1 . 1 1 73 73 LEU C C 73 179.696 179.696 179.114 0.582 19163 363 1 1 . 1 1 73 73 LEU CA C 73 57.597 57.597 57.893 -0.296 19163 364 1 1 . 1 1 73 73 LEU CB C 73 41.815 41.815 41.572 0.243 19163 365 1 1 . 1 1 73 73 LEU H H 73 7.398 7.398 8.381 -0.983 19163 366 1 1 . 1 1 74 74 TYR N N 74 122.662 122.662 120.027 2.635 19163 367 1 1 . 1 1 74 74 TYR HA H 74 4.092 4.092 3.953 0.139 19163 368 1 1 . 1 1 74 74 TYR C C 74 178.166 178.166 177.689 0.477 19163 369 1 1 . 1 1 74 74 TYR CA C 74 61.458 61.458 61.027 0.431 19163 370 1 1 . 1 1 74 74 TYR CB C 74 38.778 38.778 38.215 0.563 19163 371 1 1 . 1 1 74 74 TYR H H 74 8.316 8.316 8.600 -0.284 19163 372 1 1 . 1 1 75 75 ASP N N 75 118.842 118.842 117.933 0.909 19163 373 1 1 . 1 1 75 75 ASP HA H 75 4.423 4.423 4.328 0.095 19163 374 1 1 . 1 1 75 75 ASP C C 75 177.726 177.726 177.853 -0.127 19163 375 1 1 . 1 1 75 75 ASP CA C 75 56.177 56.177 56.801 -0.624 19163 376 1 1 . 1 1 75 75 ASP CB C 75 40.800 40.800 41.033 -0.233 19163 377 1 1 . 1 1 75 75 ASP H H 75 8.770 8.770 7.807 0.963 19163 378 1 1 . 1 1 76 76 LYS N N 76 118.955 118.955 119.817 -0.862 19163 379 1 1 . 1 1 76 76 LYS HA H 76 4.130 4.130 4.142 -0.012 19163 380 1 1 . 1 1 76 76 LYS C C 76 177.006 177.006 177.204 -0.198 19163 381 1 1 . 1 1 76 76 LYS CA C 76 57.537 57.537 57.683 -0.146 19163 382 1 1 . 1 1 76 76 LYS CB C 76 33.136 33.136 33.590 -0.454 19163 383 1 1 . 1 1 76 76 LYS H H 76 7.610 7.610 7.777 -0.168 19163 384 1 2 . 1 1 11 11 MET HA H 11 4.346 4.346 4.535 -0.189 19163 385 1 2 . 1 1 11 11 MET C C 11 175.801 175.801 175.579 0.222 19163 386 1 2 . 1 1 11 11 MET CA C 11 55.614 55.614 54.892 0.722 19163 387 1 2 . 1 1 11 11 MET CB C 11 32.925 32.925 33.932 -1.007 19163 388 1 2 . 1 1 12 12 VAL N N 12 121.226 121.226 122.988 -1.762 19163 389 1 2 . 1 1 12 12 VAL HA H 12 4.026 4.026 4.011 0.015 19163 390 1 2 . 1 1 12 12 VAL C C 12 175.701 175.701 175.664 0.037 19163 391 1 2 . 1 1 12 12 VAL CA C 12 62.188 62.188 62.611 -0.423 19163 392 1 2 . 1 1 12 12 VAL CB C 12 32.882 32.882 31.276 1.606 19163 393 1 2 . 1 1 12 12 VAL H H 12 7.988 7.988 8.380 -0.392 19163 394 1 2 . 1 1 13 13 LYS N N 13 125.255 125.255 128.341 -3.086 19163 395 1 2 . 1 1 13 13 LYS HA H 13 4.211 4.211 4.455 -0.244 19163 396 1 2 . 1 1 13 13 LYS C C 13 176.121 176.121 175.345 0.776 19163 397 1 2 . 1 1 13 13 LYS CA C 13 56.355 56.355 55.656 0.699 19163 398 1 2 . 1 1 13 13 LYS CB C 13 33.019 33.019 33.184 -0.165 19163 399 1 2 . 1 1 13 13 LYS H H 13 8.281 8.281 8.379 -0.098 19163 400 1 2 . 1 1 14 14 GLU N N 14 123.004 123.004 121.241 1.763 19163 401 1 2 . 1 1 14 14 GLU HA H 14 4.305 4.305 4.047 0.258 19163 402 1 2 . 1 1 14 14 GLU C C 14 176.107 176.107 175.298 0.809 19163 403 1 2 . 1 1 14 14 GLU CA C 14 56.343 56.343 56.702 -0.359 19163 404 1 2 . 1 1 14 14 GLU CB C 14 30.534 30.534 28.960 1.573 19163 405 1 2 . 1 1 14 14 GLU H H 14 8.424 8.424 8.710 -0.286 19163 406 1 2 . 1 1 15 15 THR N N 15 115.895 115.895 114.962 0.933 19163 407 1 2 . 1 1 15 15 THR HA H 15 4.538 4.538 4.523 0.015 19163 408 1 2 . 1 1 15 15 THR C C 15 175.233 175.233 174.547 0.686 19163 409 1 2 . 1 1 15 15 THR CA C 15 61.981 61.981 62.627 -0.646 19163 410 1 2 . 1 1 15 15 THR CB C 15 69.865 69.865 68.952 0.913 19163 411 1 2 . 1 1 15 15 THR H H 15 8.335 8.335 8.178 0.157 19163 412 1 2 . 1 1 16 16 THR N N 16 116.992 116.992 120.210 -3.218 19163 413 1 2 . 1 1 16 16 THR HA H 16 4.366 4.366 4.365 0.001 19163 414 1 2 . 1 1 16 16 THR C C 16 176.090 176.090 175.416 0.674 19163 415 1 2 . 1 1 16 16 THR CA C 16 62.172 62.172 59.270 2.902 19163 416 1 2 . 1 1 16 16 THR CB C 16 71.997 71.997 70.177 1.820 19163 417 1 2 . 1 1 16 16 THR H H 16 8.798 8.798 7.996 0.802 19163 418 1 2 . 1 1 17 17 TYR N N 17 117.617 117.617 119.071 -1.454 19163 419 1 2 . 1 1 17 17 TYR HA H 17 4.329 4.329 4.260 0.069 19163 420 1 2 . 1 1 17 17 TYR C C 17 177.105 177.105 177.853 -0.748 19163 421 1 2 . 1 1 17 17 TYR CA C 17 57.577 57.577 62.047 -4.470 19163 422 1 2 . 1 1 17 17 TYR CB C 17 37.113 37.113 38.038 -0.925 19163 423 1 2 . 1 1 17 17 TYR H H 17 8.292 8.292 8.916 -0.624 19163 424 1 2 . 1 1 18 18 TYR N N 18 115.048 115.048 117.269 -2.221 19163 425 1 2 . 1 1 18 18 TYR HA H 18 3.775 3.775 4.246 -0.471 19163 426 1 2 . 1 1 18 18 TYR C C 18 177.771 177.771 177.859 -0.088 19163 427 1 2 . 1 1 18 18 TYR CA C 18 61.430 61.430 62.599 -1.169 19163 428 1 2 . 1 1 18 18 TYR CB C 18 36.495 36.495 37.781 -1.286 19163 429 1 2 . 1 1 18 18 TYR H H 18 7.047 7.047 8.304 -1.257 19163 430 1 2 . 1 1 19 19 ASP N N 19 119.520 119.520 119.075 0.445 19163 431 1 2 . 1 1 19 19 ASP HA H 19 4.406 4.406 4.441 -0.035 19163 432 1 2 . 1 1 19 19 ASP C C 19 180.128 180.128 178.304 1.824 19163 433 1 2 . 1 1 19 19 ASP CA C 19 57.475 57.475 57.016 0.459 19163 434 1 2 . 1 1 19 19 ASP CB C 19 40.659 40.659 40.515 0.144 19163 435 1 2 . 1 1 19 19 ASP H H 19 7.685 7.685 8.244 -0.559 19163 436 1 2 . 1 1 20 20 VAL N N 20 119.772 119.772 118.762 1.010 19163 437 1 2 . 1 1 20 20 VAL HA H 20 3.608 3.608 3.742 -0.134 19163 438 1 2 . 1 1 20 20 VAL C C 20 177.026 177.026 177.338 -0.312 19163 439 1 2 . 1 1 20 20 VAL CA C 20 65.840 65.840 65.820 0.020 19163 440 1 2 . 1 1 20 20 VAL CB C 20 31.530 31.530 31.917 -0.387 19163 441 1 2 . 1 1 20 20 VAL H H 20 8.004 8.004 8.329 -0.325 19163 442 1 2 . 1 1 21 21 LEU N N 21 115.252 115.252 116.599 -1.347 19163 443 1 2 . 1 1 21 21 LEU HA H 21 4.281 4.281 4.293 -0.012 19163 444 1 2 . 1 1 21 21 LEU C C 21 175.757 175.757 177.483 -1.726 19163 445 1 2 . 1 1 21 21 LEU CA C 21 54.554 54.554 54.801 -0.247 19163 446 1 2 . 1 1 21 21 LEU CB C 21 42.869 42.869 42.007 0.862 19163 447 1 2 . 1 1 21 21 LEU H H 21 6.847 6.847 7.761 -0.914 19163 448 1 2 . 1 1 22 22 GLY N N 22 108.227 108.227 107.223 1.004 19163 449 1 2 . 1 1 22 22 GLY C C 22 175.361 175.361 174.240 1.121 19163 450 1 2 . 1 1 22 22 GLY CA C 22 46.574 46.574 46.018 0.556 19163 451 1 2 . 1 1 22 22 GLY H H 22 7.874 7.874 7.599 0.275 19163 452 1 2 . 1 1 23 23 VAL N N 23 110.675 110.675 118.473 -7.798 19163 453 1 2 . 1 1 23 23 VAL HA H 23 4.767 4.767 4.349 0.418 19163 454 1 2 . 1 1 23 23 VAL C C 23 174.674 174.674 174.399 0.275 19163 455 1 2 . 1 1 23 23 VAL CA C 23 58.349 58.349 60.505 -2.156 19163 456 1 2 . 1 1 23 23 VAL CB C 23 34.938 34.938 35.013 -0.075 19163 457 1 2 . 1 1 23 23 VAL H H 23 7.815 7.815 8.229 -0.414 19163 458 1 2 . 1 1 24 24 LYS N N 24 119.948 119.948 122.371 -2.423 19163 459 1 2 . 1 1 24 24 LYS HA H 24 4.488 4.488 4.635 -0.147 19163 460 1 2 . 1 1 24 24 LYS C C 24 175.442 175.442 176.108 -0.666 19163 461 1 2 . 1 1 24 24 LYS CA C 24 54.001 54.001 54.396 -0.395 19163 462 1 2 . 1 1 24 24 LYS CB C 24 32.197 32.197 32.097 0.100 19163 463 1 2 . 1 1 24 24 LYS H H 24 8.329 8.329 8.317 0.012 19163 464 1 2 . 1 1 25 25 PRO HA H 25 2.421 2.421 4.435 -2.014 19163 465 1 2 . 1 1 25 25 PRO C C 25 175.635 175.635 176.864 -1.229 19163 466 1 2 . 1 1 25 25 PRO CA C 25 63.362 63.362 64.935 -1.573 19163 467 1 2 . 1 1 25 25 PRO CB C 25 31.839 31.839 31.951 -0.112 19163 468 1 2 . 1 1 26 26 ASN N N 26 111.739 111.739 114.594 -2.855 19163 469 1 2 . 1 1 26 26 ASN HA H 26 4.518 4.518 4.834 -0.316 19163 470 1 2 . 1 1 26 26 ASN C C 26 175.820 175.820 174.270 1.550 19163 471 1 2 . 1 1 26 26 ASN CA C 26 51.525 51.525 51.330 0.195 19163 472 1 2 . 1 1 26 26 ASN CB C 26 36.829 36.829 38.326 -1.497 19163 473 1 2 . 1 1 26 26 ASN H H 26 7.138 7.138 8.241 -1.103 19163 474 1 2 . 1 1 27 27 ALA N N 27 122.829 122.829 123.199 -0.370 19163 475 1 2 . 1 1 27 27 ALA HA H 27 4.325 4.325 4.420 -0.095 19163 476 1 2 . 1 1 27 27 ALA C C 27 178.726 178.726 176.411 2.315 19163 477 1 2 . 1 1 27 27 ALA CA C 27 52.961 52.961 52.006 0.955 19163 478 1 2 . 1 1 27 27 ALA CB C 27 19.159 19.159 19.862 -0.703 19163 479 1 2 . 1 1 27 27 ALA H H 27 7.637 7.637 7.541 0.096 19163 480 1 2 . 1 1 28 28 THR N N 28 113.468 113.468 114.175 -0.707 19163 481 1 2 . 1 1 28 28 THR HA H 28 4.493 4.493 4.392 0.101 19163 482 1 2 . 1 1 28 28 THR C C 28 175.641 175.641 175.841 -0.200 19163 483 1 2 . 1 1 28 28 THR CA C 28 60.592 60.592 60.265 0.327 19163 484 1 2 . 1 1 28 28 THR CB C 28 71.304 71.304 70.385 0.919 19163 485 1 2 . 1 1 28 28 THR H H 28 8.829 8.829 7.980 0.849 19163 486 1 2 . 1 1 29 29 GLN N N 29 119.445 119.445 121.896 -2.451 19163 487 1 2 . 1 1 29 29 GLN HA H 29 4.035 4.035 3.903 0.132 19163 488 1 2 . 1 1 29 29 GLN C C 29 179.117 179.117 178.446 0.671 19163 489 1 2 . 1 1 29 29 GLN CA C 29 59.435 59.435 59.951 -0.516 19163 490 1 2 . 1 1 29 29 GLN CB C 29 27.851 27.851 28.583 -0.732 19163 491 1 2 . 1 1 29 29 GLN H H 29 9.015 9.015 8.845 0.170 19163 492 1 2 . 1 1 30 30 GLU N N 30 119.343 119.343 118.943 0.400 19163 493 1 2 . 1 1 30 30 GLU HA H 30 4.059 4.059 4.042 0.017 19163 494 1 2 . 1 1 30 30 GLU C C 30 179.097 179.097 178.630 0.467 19163 495 1 2 . 1 1 30 30 GLU CA C 30 59.847 59.847 59.629 0.218 19163 496 1 2 . 1 1 30 30 GLU CB C 30 29.356 29.356 29.387 -0.031 19163 497 1 2 . 1 1 30 30 GLU H H 30 8.549 8.549 8.691 -0.142 19163 498 1 2 . 1 1 31 31 GLU N N 31 120.562 120.562 120.777 -0.215 19163 499 1 2 . 1 1 31 31 GLU HA H 31 3.906 3.906 4.110 -0.204 19163 500 1 2 . 1 1 31 31 GLU C C 31 180.405 180.405 179.110 1.295 19163 501 1 2 . 1 1 31 31 GLU CA C 31 59.592 59.592 59.065 0.527 19163 502 1 2 . 1 1 31 31 GLU CB C 31 29.989 29.989 29.237 0.752 19163 503 1 2 . 1 1 31 31 GLU H H 31 7.768 7.768 8.168 -0.400 19163 504 1 2 . 1 1 32 32 LEU N N 32 120.518 120.518 120.093 0.425 19163 505 1 2 . 1 1 32 32 LEU HA H 32 3.963 3.963 4.019 -0.056 19163 506 1 2 . 1 1 32 32 LEU C C 32 177.873 177.873 179.311 -1.438 19163 507 1 2 . 1 1 32 32 LEU CA C 32 58.593 58.593 57.992 0.601 19163 508 1 2 . 1 1 32 32 LEU CB C 32 42.556 42.556 41.291 1.265 19163 509 1 2 . 1 1 32 32 LEU H H 32 8.475 8.475 8.661 -0.186 19163 510 1 2 . 1 1 33 33 LYS N N 33 119.091 119.091 119.149 -0.058 19163 511 1 2 . 1 1 33 33 LYS HA H 33 4.000 4.000 4.174 -0.174 19163 512 1 2 . 1 1 33 33 LYS C C 33 178.701 178.701 178.915 -0.214 19163 513 1 2 . 1 1 33 33 LYS CA C 33 60.274 60.274 60.153 0.121 19163 514 1 2 . 1 1 33 33 LYS CB C 33 32.656 32.656 32.235 0.421 19163 515 1 2 . 1 1 33 33 LYS H H 33 8.077 8.077 7.854 0.223 19163 516 1 2 . 1 1 34 34 LYS N N 34 118.527 118.527 119.923 -1.396 19163 517 1 2 . 1 1 34 34 LYS HA H 34 3.890 3.890 4.018 -0.128 19163 518 1 2 . 1 1 34 34 LYS C C 34 179.172 179.172 178.750 0.422 19163 519 1 2 . 1 1 34 34 LYS CA C 34 59.927 59.927 59.446 0.481 19163 520 1 2 . 1 1 34 34 LYS CB C 34 32.869 32.869 32.485 0.384 19163 521 1 2 . 1 1 34 34 LYS H H 34 7.986 7.986 8.102 -0.116 19163 522 1 2 . 1 1 35 35 ALA N N 35 122.190 122.190 121.769 0.421 19163 523 1 2 . 1 1 35 35 ALA HA H 35 4.116 4.116 4.044 0.072 19163 524 1 2 . 1 1 35 35 ALA C C 35 179.982 179.982 179.031 0.951 19163 525 1 2 . 1 1 35 35 ALA CA C 35 55.157 55.157 55.191 -0.034 19163 526 1 2 . 1 1 35 35 ALA CB C 35 18.773 18.773 18.302 0.471 19163 527 1 2 . 1 1 35 35 ALA H H 35 7.917 7.917 8.107 -0.190 19163 528 1 2 . 1 1 36 36 TYR N N 36 117.701 117.701 119.904 -2.203 19163 529 1 2 . 1 1 36 36 TYR HA H 36 3.818 3.818 3.970 -0.152 19163 530 1 2 . 1 1 36 36 TYR C C 36 176.344 176.344 177.782 -1.438 19163 531 1 2 . 1 1 36 36 TYR CA C 36 61.468 61.468 61.414 0.054 19163 532 1 2 . 1 1 36 36 TYR CB C 36 38.890 38.890 38.004 0.886 19163 533 1 2 . 1 1 36 36 TYR H H 36 8.402 8.402 7.931 0.471 19163 534 1 2 . 1 1 37 37 ARG N N 37 117.423 117.423 118.308 -0.885 19163 535 1 2 . 1 1 37 37 ARG HA H 37 3.481 3.481 3.717 -0.236 19163 536 1 2 . 1 1 37 37 ARG C C 37 178.825 178.825 178.373 0.452 19163 537 1 2 . 1 1 37 37 ARG CA C 37 59.397 59.397 59.798 -0.401 19163 538 1 2 . 1 1 37 37 ARG CB C 37 29.710 29.710 29.951 -0.241 19163 539 1 2 . 1 1 37 37 ARG H H 37 8.264 8.264 8.325 -0.061 19163 540 1 2 . 1 1 38 38 LYS N N 38 117.247 117.247 120.569 -3.322 19163 541 1 2 . 1 1 38 38 LYS HA H 38 3.905 3.905 4.048 -0.143 19163 542 1 2 . 1 1 38 38 LYS C C 38 179.444 179.444 179.108 0.336 19163 543 1 2 . 1 1 38 38 LYS CA C 38 59.450 59.450 59.439 0.011 19163 544 1 2 . 1 1 38 38 LYS CB C 38 32.609 32.609 32.396 0.213 19163 545 1 2 . 1 1 38 38 LYS H H 38 7.444 7.444 7.622 -0.178 19163 546 1 2 . 1 1 39 39 LEU N N 39 119.901 119.901 119.373 0.528 19163 547 1 2 . 1 1 39 39 LEU HA H 39 4.020 4.020 4.242 -0.222 19163 548 1 2 . 1 1 39 39 LEU C C 39 178.801 178.801 178.869 -0.068 19163 549 1 2 . 1 1 39 39 LEU CA C 39 57.409 57.409 57.666 -0.257 19163 550 1 2 . 1 1 39 39 LEU CB C 39 42.388 42.388 41.590 0.798 19163 551 1 2 . 1 1 39 39 LEU H H 39 7.707 7.707 8.043 -0.336 19163 552 1 2 . 1 1 40 40 ALA N N 40 122.772 122.772 121.445 1.327 19163 553 1 2 . 1 1 40 40 ALA HA H 40 3.849 3.849 4.043 -0.194 19163 554 1 2 . 1 1 40 40 ALA C C 40 179.446 179.446 179.034 0.412 19163 555 1 2 . 1 1 40 40 ALA CA C 40 55.109 55.109 55.084 0.025 19163 556 1 2 . 1 1 40 40 ALA CB C 40 17.116 17.116 18.344 -1.228 19163 557 1 2 . 1 1 40 40 ALA H H 40 8.931 8.931 8.147 0.784 19163 558 1 2 . 1 1 41 41 LEU N N 41 115.299 115.299 116.667 -1.368 19163 559 1 2 . 1 1 41 41 LEU HA H 41 3.977 3.977 3.872 0.105 19163 560 1 2 . 1 1 41 41 LEU C C 41 178.216 178.216 178.768 -0.552 19163 561 1 2 . 1 1 41 41 LEU CA C 41 57.088 57.088 57.227 -0.139 19163 562 1 2 . 1 1 41 41 LEU CB C 41 42.162 42.162 41.834 0.328 19163 563 1 2 . 1 1 41 41 LEU H H 41 7.133 7.133 7.435 -0.302 19163 564 1 2 . 1 1 42 42 LYS N N 42 116.812 116.812 117.405 -0.593 19163 565 1 2 . 1 1 42 42 LYS HA H 42 3.925 3.925 4.025 -0.100 19163 566 1 2 . 1 1 42 42 LYS C C 42 177.560 177.560 178.463 -0.903 19163 567 1 2 . 1 1 42 42 LYS CA C 42 57.885 57.885 58.219 -0.334 19163 568 1 2 . 1 1 42 42 LYS CB C 42 33.427 33.427 32.673 0.754 19163 569 1 2 . 1 1 42 42 LYS H H 42 7.038 7.038 7.377 -0.339 19163 570 1 2 . 1 1 43 43 TYR N N 43 114.022 114.022 115.155 -1.133 19163 571 1 2 . 1 1 43 43 TYR HA H 43 4.665 4.665 4.557 0.108 19163 572 1 2 . 1 1 43 43 TYR C C 43 173.741 173.741 174.049 -0.308 19163 573 1 2 . 1 1 43 43 TYR CA C 43 56.928 56.928 56.435 0.493 19163 574 1 2 . 1 1 43 43 TYR CB C 43 39.579 39.579 37.677 1.902 19163 575 1 2 . 1 1 43 43 TYR H H 43 7.683 7.683 8.389 -0.706 19163 576 1 2 . 1 1 44 44 HIS N N 44 120.947 120.947 122.920 -1.973 19163 577 1 2 . 1 1 44 44 HIS HA H 44 3.697 3.697 4.068 -0.371 19163 578 1 2 . 1 1 44 44 HIS C C 44 174.925 174.925 174.818 0.107 19163 579 1 2 . 1 1 44 44 HIS CA C 44 56.229 56.229 56.463 -0.234 19163 580 1 2 . 1 1 44 44 HIS CB C 44 30.852 30.852 30.926 -0.074 19163 581 1 2 . 1 1 44 44 HIS H H 44 7.814 7.814 7.571 0.243 19163 582 1 2 . 1 1 45 45 PRO HA H 45 4.131 4.131 4.417 -0.286 19163 583 1 2 . 1 1 45 45 PRO C C 45 177.269 177.269 177.368 -0.099 19163 584 1 2 . 1 1 45 45 PRO CA C 45 64.723 64.723 65.175 -0.452 19163 585 1 2 . 1 1 45 45 PRO CB C 45 32.070 32.070 31.959 0.111 19163 586 1 2 . 1 1 46 46 ASP N N 46 119.127 119.127 117.034 2.093 19163 587 1 2 . 1 1 46 46 ASP HA H 46 4.375 4.375 4.560 -0.185 19163 588 1 2 . 1 1 46 46 ASP C C 46 177.284 177.284 177.293 -0.009 19163 589 1 2 . 1 1 46 46 ASP CA C 46 56.020 56.020 56.046 -0.026 19163 590 1 2 . 1 1 46 46 ASP CB C 46 40.221 40.221 40.567 -0.346 19163 591 1 2 . 1 1 46 46 ASP H H 46 10.040 10.040 7.584 2.456 19163 592 1 2 . 1 1 47 47 LYS N N 47 117.416 117.416 118.625 -1.209 19163 593 1 2 . 1 1 47 47 LYS HA H 47 4.315 4.315 4.387 -0.072 19163 594 1 2 . 1 1 47 47 LYS C C 47 176.355 176.355 176.337 0.018 19163 595 1 2 . 1 1 47 47 LYS CA C 47 55.880 55.880 57.264 -1.384 19163 596 1 2 . 1 1 47 47 LYS CB C 47 33.778 33.778 34.641 -0.862 19163 597 1 2 . 1 1 47 47 LYS H H 47 7.826 7.826 7.683 0.143 19163 598 1 2 . 1 1 48 48 ASN N N 48 116.573 116.573 118.863 -2.290 19163 599 1 2 . 1 1 48 48 ASN HA H 48 5.021 5.021 5.147 -0.126 19163 600 1 2 . 1 1 48 48 ASN C C 48 172.992 172.992 173.714 -0.722 19163 601 1 2 . 1 1 48 48 ASN CA C 48 50.467 50.467 50.973 -0.506 19163 602 1 2 . 1 1 48 48 ASN CB C 48 39.284 39.284 39.911 -0.627 19163 603 1 2 . 1 1 48 48 ASN H H 48 7.956 7.956 8.358 -0.402 19163 604 1 2 . 1 1 49 49 PRO HA H 49 4.448 4.448 4.531 -0.083 19163 605 1 2 . 1 1 49 49 PRO C C 49 178.030 178.030 177.856 0.174 19163 606 1 2 . 1 1 49 49 PRO CA C 49 64.468 64.468 65.078 -0.610 19163 607 1 2 . 1 1 49 49 PRO CB C 49 32.173 32.173 32.119 0.054 19163 608 1 2 . 1 1 50 50 ASN N N 50 115.567 115.567 116.305 -0.738 19163 609 1 2 . 1 1 50 50 ASN HA H 50 4.748 4.748 4.649 0.099 19163 610 1 2 . 1 1 50 50 ASN C C 50 176.443 176.443 176.477 -0.034 19163 611 1 2 . 1 1 50 50 ASN CA C 50 54.677 54.677 54.860 -0.183 19163 612 1 2 . 1 1 50 50 ASN CB C 50 39.014 39.014 37.604 1.410 19163 613 1 2 . 1 1 50 50 ASN H H 50 8.398 8.398 8.665 -0.267 19163 614 1 2 . 1 1 51 51 GLU N N 51 119.270 119.270 118.193 1.077 19163 615 1 2 . 1 1 51 51 GLU HA H 51 4.797 4.797 4.607 0.190 19163 616 1 2 . 1 1 51 51 GLU C C 51 176.922 176.922 178.069 -1.147 19163 617 1 2 . 1 1 51 51 GLU CA C 51 55.916 55.916 56.013 -0.097 19163 618 1 2 . 1 1 51 51 GLU CB C 51 29.200 29.200 29.346 -0.145 19163 619 1 2 . 1 1 51 51 GLU H H 51 7.485 7.485 7.824 -0.339 19163 620 1 2 . 1 1 52 52 GLY N N 52 107.541 107.541 108.824 -1.283 19163 621 1 2 . 1 1 52 52 GLY C C 52 176.755 176.755 175.888 0.867 19163 622 1 2 . 1 1 52 52 GLY CA C 52 47.914 47.914 47.148 0.766 19163 623 1 2 . 1 1 52 52 GLY H H 52 8.092 8.092 7.638 0.454 19163 624 1 2 . 1 1 53 53 GLU N N 53 121.603 121.603 120.918 0.685 19163 625 1 2 . 1 1 53 53 GLU HA H 53 4.065 4.065 4.131 -0.066 19163 626 1 2 . 1 1 53 53 GLU C C 53 179.052 179.052 178.956 0.096 19163 627 1 2 . 1 1 53 53 GLU CA C 53 59.280 59.280 59.552 -0.272 19163 628 1 2 . 1 1 53 53 GLU CB C 53 28.968 28.968 29.069 -0.101 19163 629 1 2 . 1 1 53 53 GLU H H 53 8.496 8.496 8.610 -0.114 19163 630 1 2 . 1 1 54 54 LYS N N 54 120.837 120.837 119.597 1.240 19163 631 1 2 . 1 1 54 54 LYS HA H 54 3.923 3.923 4.085 -0.162 19163 632 1 2 . 1 1 54 54 LYS C C 54 179.058 179.058 179.010 0.048 19163 633 1 2 . 1 1 54 54 LYS CA C 54 58.800 58.800 58.888 -0.088 19163 634 1 2 . 1 1 54 54 LYS CB C 54 31.551 31.551 32.390 -0.839 19163 635 1 2 . 1 1 54 54 LYS H H 54 7.857 7.857 7.528 0.329 19163 636 1 2 . 1 1 55 55 PHE N N 55 118.608 118.608 121.203 -2.595 19163 637 1 2 . 1 1 55 55 PHE HA H 55 4.021 4.021 4.098 -0.077 19163 638 1 2 . 1 1 55 55 PHE C C 55 178.001 178.001 176.868 1.133 19163 639 1 2 . 1 1 55 55 PHE CA C 55 61.911 61.911 60.657 1.254 19163 640 1 2 . 1 1 55 55 PHE CB C 55 38.553 38.553 39.038 -0.485 19163 641 1 2 . 1 1 55 55 PHE H H 55 8.382 8.382 7.944 0.438 19163 642 1 2 . 1 1 56 56 LYS N N 56 120.898 120.898 119.780 1.118 19163 643 1 2 . 1 1 56 56 LYS HA H 56 3.828 3.828 3.778 0.050 19163 644 1 2 . 1 1 56 56 LYS C C 56 178.817 178.817 178.611 0.206 19163 645 1 2 . 1 1 56 56 LYS CA C 56 59.877 59.877 60.151 -0.274 19163 646 1 2 . 1 1 56 56 LYS CB C 56 32.133 32.133 32.109 0.024 19163 647 1 2 . 1 1 56 56 LYS H H 56 8.111 8.111 8.173 -0.062 19163 648 1 2 . 1 1 57 57 GLN N N 57 118.600 118.600 117.933 0.667 19163 649 1 2 . 1 1 57 57 GLN HA H 57 4.009 4.009 4.011 -0.002 19163 650 1 2 . 1 1 57 57 GLN C C 57 179.333 179.333 178.686 0.647 19163 651 1 2 . 1 1 57 57 GLN CA C 57 59.109 59.109 58.852 0.257 19163 652 1 2 . 1 1 57 57 GLN CB C 57 28.595 28.595 28.656 -0.061 19163 653 1 2 . 1 1 57 57 GLN H H 57 7.613 7.613 7.492 0.121 19163 654 1 2 . 1 1 58 58 ILE N N 58 118.709 118.709 120.761 -2.052 19163 655 1 2 . 1 1 58 58 ILE HA H 58 3.559 3.559 3.573 -0.014 19163 656 1 2 . 1 1 58 58 ILE C C 58 177.152 177.152 178.151 -0.999 19163 657 1 2 . 1 1 58 58 ILE CA C 58 65.068 65.068 65.542 -0.474 19163 658 1 2 . 1 1 58 58 ILE CB C 58 38.381 38.381 37.622 0.759 19163 659 1 2 . 1 1 58 58 ILE H H 58 8.011 8.011 7.514 0.497 19163 660 1 2 . 1 1 59 59 SER N N 59 116.112 116.112 115.467 0.645 19163 661 1 2 . 1 1 59 59 SER HA H 59 3.948 3.948 4.032 -0.084 19163 662 1 2 . 1 1 59 59 SER C C 59 175.949 175.949 177.108 -1.159 19163 663 1 2 . 1 1 59 59 SER CA C 59 62.315 62.315 61.664 0.651 19163 664 1 2 . 1 1 59 59 SER H H 59 8.030 8.030 8.317 -0.287 19163 665 1 2 . 1 1 60 60 GLN N N 60 122.099 122.099 120.930 1.169 19163 666 1 2 . 1 1 60 60 GLN HA H 60 3.801 3.801 3.991 -0.190 19163 667 1 2 . 1 1 60 60 GLN C C 60 176.942 176.942 178.153 -1.211 19163 668 1 2 . 1 1 60 60 GLN CA C 60 58.762 58.762 58.776 -0.014 19163 669 1 2 . 1 1 60 60 GLN CB C 60 28.498 28.498 28.741 -0.243 19163 670 1 2 . 1 1 60 60 GLN H H 60 7.933 7.933 7.781 0.152 19163 671 1 2 . 1 1 61 61 ALA N N 61 119.367 119.367 122.426 -3.059 19163 672 1 2 . 1 1 61 61 ALA HA H 61 2.636 2.636 3.890 -1.254 19163 673 1 2 . 1 1 61 61 ALA C C 61 178.507 178.507 179.323 -0.816 19163 674 1 2 . 1 1 61 61 ALA CA C 61 54.126 54.126 54.890 -0.764 19163 675 1 2 . 1 1 61 61 ALA CB C 61 18.462 18.462 18.375 0.087 19163 676 1 2 . 1 1 61 61 ALA H H 61 7.354 7.354 7.990 -0.636 19163 677 1 2 . 1 1 62 62 TYR N N 62 115.613 115.613 119.868 -4.255 19163 678 1 2 . 1 1 62 62 TYR HA H 62 3.633 3.633 3.940 -0.307 19163 679 1 2 . 1 1 62 62 TYR C C 62 177.421 177.421 177.262 0.159 19163 680 1 2 . 1 1 62 62 TYR CA C 62 61.676 61.676 60.813 0.863 19163 681 1 2 . 1 1 62 62 TYR CB C 62 39.162 39.162 38.147 1.015 19163 682 1 2 . 1 1 62 62 TYR H H 62 7.994 7.994 8.709 -0.715 19163 683 1 2 . 1 1 63 63 GLU N N 63 121.396 121.396 119.865 1.531 19163 684 1 2 . 1 1 63 63 GLU HA H 63 3.347 3.347 3.675 -0.328 19163 685 1 2 . 1 1 63 63 GLU C C 63 177.687 177.687 178.475 -0.788 19163 686 1 2 . 1 1 63 63 GLU CA C 63 59.562 59.562 59.156 0.407 19163 687 1 2 . 1 1 63 63 GLU CB C 63 29.115 29.115 28.718 0.397 19163 688 1 2 . 1 1 63 63 GLU H H 63 8.151 8.151 7.771 0.380 19163 689 1 2 . 1 1 64 64 VAL N N 64 115.850 115.850 118.601 -2.751 19163 690 1 2 . 1 1 64 64 VAL HA H 64 3.377 3.377 3.686 -0.309 19163 691 1 2 . 1 1 64 64 VAL C C 64 175.925 175.925 177.473 -1.548 19163 692 1 2 . 1 1 64 64 VAL CA C 64 65.806 65.806 65.550 0.256 19163 693 1 2 . 1 1 64 64 VAL CB C 64 31.786 31.786 31.571 0.215 19163 694 1 2 . 1 1 64 64 VAL H H 64 6.814 6.814 7.137 -0.323 19163 695 1 2 . 1 1 65 65 LEU N N 65 111.438 111.438 119.608 -8.170 19163 696 1 2 . 1 1 65 65 LEU HA H 65 3.569 3.569 3.977 -0.408 19163 697 1 2 . 1 1 65 65 LEU C C 65 177.124 177.124 177.641 -0.517 19163 698 1 2 . 1 1 65 65 LEU CA C 65 56.645 56.645 56.344 0.301 19163 699 1 2 . 1 1 65 65 LEU CB C 65 42.589 42.589 40.765 1.824 19163 700 1 2 . 1 1 65 65 LEU H H 65 7.398 7.398 8.335 -0.937 19163 701 1 2 . 1 1 66 66 SER N N 66 108.642 108.642 110.690 -2.048 19163 702 1 2 . 1 1 66 66 SER HA H 66 4.028 4.028 3.837 0.191 19163 703 1 2 . 1 1 66 66 SER C C 66 173.286 173.286 174.007 -0.721 19163 704 1 2 . 1 1 66 66 SER CA C 66 59.232 59.232 59.842 -0.610 19163 705 1 2 . 1 1 66 66 SER CB C 66 63.066 63.066 62.896 0.170 19163 706 1 2 . 1 1 66 66 SER H H 66 7.700 7.700 7.375 0.325 19163 707 1 2 . 1 1 67 67 ASP N N 67 124.276 124.276 120.841 3.435 19163 708 1 2 . 1 1 67 67 ASP HA H 67 4.668 4.668 4.810 -0.142 19163 709 1 2 . 1 1 67 67 ASP C C 67 174.913 174.913 175.158 -0.245 19163 710 1 2 . 1 1 67 67 ASP CA C 67 52.487 52.487 53.644 -1.157 19163 711 1 2 . 1 1 67 67 ASP CB C 67 43.218 43.218 43.944 -0.726 19163 712 1 2 . 1 1 67 67 ASP H H 67 6.879 6.879 7.334 -0.455 19163 713 1 2 . 1 1 68 68 ALA N N 68 127.326 127.326 129.646 -2.320 19163 714 1 2 . 1 1 68 68 ALA HA H 68 3.853 3.853 3.888 -0.035 19163 715 1 2 . 1 1 68 68 ALA C C 68 180.336 180.336 178.705 1.631 19163 716 1 2 . 1 1 68 68 ALA CA C 68 55.912 55.912 55.513 0.399 19163 717 1 2 . 1 1 68 68 ALA CB C 68 18.645 18.645 18.892 -0.247 19163 718 1 2 . 1 1 68 68 ALA H H 68 8.693 8.693 9.057 -0.364 19163 719 1 2 . 1 1 69 69 LYS N N 69 116.929 116.929 117.859 -0.930 19163 720 1 2 . 1 1 69 69 LYS HA H 69 4.162 4.162 4.012 0.150 19163 721 1 2 . 1 1 69 69 LYS C C 69 179.515 179.515 178.569 0.946 19163 722 1 2 . 1 1 69 69 LYS CA C 69 58.562 58.562 59.614 -1.052 19163 723 1 2 . 1 1 69 69 LYS CB C 69 31.840 31.840 32.306 -0.466 19163 724 1 2 . 1 1 69 69 LYS H H 69 7.950 7.950 8.514 -0.564 19163 725 1 2 . 1 1 70 70 LYS N N 70 121.286 121.286 119.047 2.239 19163 726 1 2 . 1 1 70 70 LYS HA H 70 3.960 3.960 3.951 0.009 19163 727 1 2 . 1 1 70 70 LYS C C 70 179.938 179.938 178.964 0.974 19163 728 1 2 . 1 1 70 70 LYS CA C 70 60.066 60.066 59.455 0.612 19163 729 1 2 . 1 1 70 70 LYS CB C 70 32.695 32.695 32.158 0.537 19163 730 1 2 . 1 1 70 70 LYS H H 70 8.184 8.184 7.625 0.559 19163 731 1 2 . 1 1 71 71 ARG N N 71 122.794 122.794 119.817 2.977 19163 732 1 2 . 1 1 71 71 ARG HA H 71 3.668 3.668 3.834 -0.166 19163 733 1 2 . 1 1 71 71 ARG C C 71 177.356 177.356 178.191 -0.835 19163 734 1 2 . 1 1 71 71 ARG CA C 71 60.127 60.127 60.077 0.050 19163 735 1 2 . 1 1 71 71 ARG CB C 71 29.668 29.668 30.110 -0.443 19163 736 1 2 . 1 1 71 71 ARG H H 71 9.290 9.290 8.139 1.151 19163 737 1 2 . 1 1 72 72 GLU N N 72 118.390 118.390 119.687 -1.297 19163 738 1 2 . 1 1 72 72 GLU HA H 72 4.096 4.096 4.126 -0.030 19163 739 1 2 . 1 1 72 72 GLU C C 72 179.073 179.073 179.021 0.052 19163 740 1 2 . 1 1 72 72 GLU CA C 72 59.456 59.456 59.129 0.327 19163 741 1 2 . 1 1 72 72 GLU CB C 72 29.615 29.615 29.209 0.406 19163 742 1 2 . 1 1 72 72 GLU H H 72 7.607 7.607 7.811 -0.204 19163 743 1 2 . 1 1 73 73 LEU N N 73 117.921 117.921 120.155 -2.234 19163 744 1 2 . 1 1 73 73 LEU HA H 73 4.032 4.032 3.995 0.037 19163 745 1 2 . 1 1 73 73 LEU C C 73 179.696 179.696 178.823 0.873 19163 746 1 2 . 1 1 73 73 LEU CA C 73 57.597 57.597 57.777 -0.180 19163 747 1 2 . 1 1 73 73 LEU CB C 73 41.815 41.815 41.729 0.086 19163 748 1 2 . 1 1 73 73 LEU H H 73 7.398 7.398 7.866 -0.468 19163 749 1 2 . 1 1 74 74 TYR N N 74 122.662 122.662 119.275 3.387 19163 750 1 2 . 1 1 74 74 TYR HA H 74 4.092 4.092 4.026 0.066 19163 751 1 2 . 1 1 74 74 TYR C C 74 178.166 178.166 178.587 -0.421 19163 752 1 2 . 1 1 74 74 TYR CA C 74 61.458 61.458 61.448 0.010 19163 753 1 2 . 1 1 74 74 TYR CB C 74 38.778 38.778 38.611 0.167 19163 754 1 2 . 1 1 74 74 TYR H H 74 8.316 8.316 8.282 0.034 19163 755 1 2 . 1 1 75 75 ASP N N 75 118.842 118.842 119.446 -0.604 19163 756 1 2 . 1 1 75 75 ASP HA H 75 4.423 4.423 4.469 -0.046 19163 757 1 2 . 1 1 75 75 ASP C C 75 177.726 177.726 177.683 0.043 19163 758 1 2 . 1 1 75 75 ASP CA C 75 56.177 56.177 56.794 -0.617 19163 759 1 2 . 1 1 75 75 ASP CB C 75 40.800 40.800 40.911 -0.111 19163 760 1 2 . 1 1 75 75 ASP H H 75 8.770 8.770 8.485 0.285 19163 761 1 2 . 1 1 76 76 LYS N N 76 118.955 118.955 118.392 0.563 19163 762 1 2 . 1 1 76 76 LYS HA H 76 4.130 4.130 4.267 -0.137 19163 763 1 2 . 1 1 76 76 LYS C C 76 177.006 177.006 177.339 -0.333 19163 764 1 2 . 1 1 76 76 LYS CA C 76 57.537 57.537 56.291 1.246 19163 765 1 2 . 1 1 76 76 LYS CB C 76 33.136 33.136 32.843 0.293 19163 766 1 2 . 1 1 76 76 LYS H H 76 7.610 7.610 7.704 -0.094 19163 767 1 3 . 1 1 11 11 MET HA H 11 4.346 4.346 4.448 -0.102 19163 768 1 3 . 1 1 11 11 MET C C 11 175.801 175.801 175.211 0.590 19163 769 1 3 . 1 1 11 11 MET CA C 11 55.614 55.614 53.595 2.019 19163 770 1 3 . 1 1 11 11 MET CB C 11 32.925 32.925 32.289 0.636 19163 771 1 3 . 1 1 12 12 VAL N N 12 121.226 121.226 125.540 -4.314 19163 772 1 3 . 1 1 12 12 VAL HA H 12 4.026 4.026 4.057 -0.031 19163 773 1 3 . 1 1 12 12 VAL C C 12 175.701 175.701 175.836 -0.135 19163 774 1 3 . 1 1 12 12 VAL CA C 12 62.188 62.188 62.328 -0.140 19163 775 1 3 . 1 1 12 12 VAL CB C 12 32.882 32.882 30.997 1.885 19163 776 1 3 . 1 1 12 12 VAL H H 12 7.988 7.988 8.558 -0.570 19163 777 1 3 . 1 1 13 13 LYS N N 13 125.255 125.255 128.419 -3.164 19163 778 1 3 . 1 1 13 13 LYS HA H 13 4.211 4.211 4.441 -0.230 19163 779 1 3 . 1 1 13 13 LYS C C 13 176.121 176.121 175.589 0.532 19163 780 1 3 . 1 1 13 13 LYS CA C 13 56.355 56.355 55.356 0.999 19163 781 1 3 . 1 1 13 13 LYS CB C 13 33.019 33.019 32.892 0.127 19163 782 1 3 . 1 1 13 13 LYS H H 13 8.281 8.281 8.385 -0.104 19163 783 1 3 . 1 1 14 14 GLU N N 14 123.004 123.004 123.299 -0.295 19163 784 1 3 . 1 1 14 14 GLU HA H 14 4.305 4.305 4.003 0.302 19163 785 1 3 . 1 1 14 14 GLU C C 14 176.107 176.107 175.263 0.844 19163 786 1 3 . 1 1 14 14 GLU CA C 14 56.343 56.343 56.288 0.055 19163 787 1 3 . 1 1 14 14 GLU CB C 14 30.534 30.534 29.572 0.963 19163 788 1 3 . 1 1 14 14 GLU H H 14 8.424 8.424 8.687 -0.263 19163 789 1 3 . 1 1 15 15 THR N N 15 115.895 115.895 116.747 -0.852 19163 790 1 3 . 1 1 15 15 THR HA H 15 4.538 4.538 4.582 -0.044 19163 791 1 3 . 1 1 15 15 THR C C 15 175.233 175.233 174.718 0.515 19163 792 1 3 . 1 1 15 15 THR CA C 15 61.981 61.981 62.278 -0.297 19163 793 1 3 . 1 1 15 15 THR CB C 15 69.865 69.865 69.422 0.443 19163 794 1 3 . 1 1 15 15 THR H H 15 8.335 8.335 8.227 0.108 19163 795 1 3 . 1 1 16 16 THR N N 16 116.992 116.992 117.242 -0.250 19163 796 1 3 . 1 1 16 16 THR HA H 16 4.366 4.366 4.306 0.060 19163 797 1 3 . 1 1 16 16 THR C C 16 176.090 176.090 175.598 0.492 19163 798 1 3 . 1 1 16 16 THR CA C 16 62.172 62.172 60.258 1.914 19163 799 1 3 . 1 1 16 16 THR CB C 16 71.997 71.997 70.711 1.286 19163 800 1 3 . 1 1 16 16 THR H H 16 8.798 8.798 8.298 0.500 19163 801 1 3 . 1 1 17 17 TYR N N 17 117.617 117.617 120.629 -3.012 19163 802 1 3 . 1 1 17 17 TYR HA H 17 4.329 4.329 4.187 0.142 19163 803 1 3 . 1 1 17 17 TYR C C 17 177.105 177.105 178.281 -1.176 19163 804 1 3 . 1 1 17 17 TYR CA C 17 57.577 57.577 62.111 -4.534 19163 805 1 3 . 1 1 17 17 TYR CB C 17 37.113 37.113 37.362 -0.249 19163 806 1 3 . 1 1 17 17 TYR H H 17 8.292 8.292 8.713 -0.421 19163 807 1 3 . 1 1 18 18 TYR N N 18 115.048 115.048 117.099 -2.051 19163 808 1 3 . 1 1 18 18 TYR HA H 18 3.775 3.775 4.241 -0.466 19163 809 1 3 . 1 1 18 18 TYR C C 18 177.771 177.771 177.919 -0.148 19163 810 1 3 . 1 1 18 18 TYR CA C 18 61.430 61.430 60.781 0.649 19163 811 1 3 . 1 1 18 18 TYR CB C 18 36.495 36.495 37.566 -1.071 19163 812 1 3 . 1 1 18 18 TYR H H 18 7.047 7.047 8.482 -1.435 19163 813 1 3 . 1 1 19 19 ASP N N 19 119.520 119.520 120.037 -0.517 19163 814 1 3 . 1 1 19 19 ASP HA H 19 4.406 4.406 4.452 -0.046 19163 815 1 3 . 1 1 19 19 ASP C C 19 180.128 180.128 178.705 1.423 19163 816 1 3 . 1 1 19 19 ASP CA C 19 57.475 57.475 57.115 0.360 19163 817 1 3 . 1 1 19 19 ASP CB C 19 40.659 40.659 40.847 -0.188 19163 818 1 3 . 1 1 19 19 ASP H H 19 7.685 7.685 8.103 -0.418 19163 819 1 3 . 1 1 20 20 VAL N N 20 119.772 119.772 119.201 0.571 19163 820 1 3 . 1 1 20 20 VAL HA H 20 3.608 3.608 3.748 -0.140 19163 821 1 3 . 1 1 20 20 VAL C C 20 177.026 177.026 177.601 -0.575 19163 822 1 3 . 1 1 20 20 VAL CA C 20 65.840 65.840 65.897 -0.057 19163 823 1 3 . 1 1 20 20 VAL CB C 20 31.530 31.530 31.532 -0.002 19163 824 1 3 . 1 1 20 20 VAL H H 20 8.004 8.004 8.394 -0.390 19163 825 1 3 . 1 1 21 21 LEU N N 21 115.252 115.252 115.287 -0.035 19163 826 1 3 . 1 1 21 21 LEU HA H 21 4.281 4.281 4.452 -0.171 19163 827 1 3 . 1 1 21 21 LEU C C 21 175.757 175.757 176.883 -1.126 19163 828 1 3 . 1 1 21 21 LEU CA C 21 54.554 54.554 54.511 0.043 19163 829 1 3 . 1 1 21 21 LEU CB C 21 42.869 42.869 41.381 1.488 19163 830 1 3 . 1 1 21 21 LEU H H 21 6.847 6.847 7.479 -0.632 19163 831 1 3 . 1 1 22 22 GLY N N 22 108.227 108.227 107.386 0.841 19163 832 1 3 . 1 1 22 22 GLY C C 22 175.361 175.361 174.259 1.102 19163 833 1 3 . 1 1 22 22 GLY CA C 22 46.574 46.574 45.732 0.842 19163 834 1 3 . 1 1 22 22 GLY H H 22 7.874 7.874 7.329 0.545 19163 835 1 3 . 1 1 23 23 VAL N N 23 110.675 110.675 118.664 -7.989 19163 836 1 3 . 1 1 23 23 VAL HA H 23 4.767 4.767 4.456 0.311 19163 837 1 3 . 1 1 23 23 VAL C C 23 174.674 174.674 174.425 0.249 19163 838 1 3 . 1 1 23 23 VAL CA C 23 58.349 58.349 59.837 -1.488 19163 839 1 3 . 1 1 23 23 VAL CB C 23 34.938 34.938 35.200 -0.262 19163 840 1 3 . 1 1 23 23 VAL H H 23 7.815 7.815 8.003 -0.188 19163 841 1 3 . 1 1 24 24 LYS N N 24 119.948 119.948 124.388 -4.440 19163 842 1 3 . 1 1 24 24 LYS HA H 24 4.488 4.488 4.756 -0.268 19163 843 1 3 . 1 1 24 24 LYS C C 24 175.442 175.442 176.165 -0.723 19163 844 1 3 . 1 1 24 24 LYS CA C 24 54.001 54.001 54.281 -0.280 19163 845 1 3 . 1 1 24 24 LYS CB C 24 32.197 32.197 31.835 0.362 19163 846 1 3 . 1 1 24 24 LYS H H 24 8.329 8.329 8.560 -0.231 19163 847 1 3 . 1 1 25 25 PRO HA H 25 2.421 2.421 4.168 -1.747 19163 848 1 3 . 1 1 25 25 PRO C C 25 175.635 175.635 176.246 -0.611 19163 849 1 3 . 1 1 25 25 PRO CA C 25 63.362 63.362 64.834 -1.472 19163 850 1 3 . 1 1 25 25 PRO CB C 25 31.839 31.839 31.632 0.207 19163 851 1 3 . 1 1 26 26 ASN N N 26 111.739 111.739 113.290 -1.551 19163 852 1 3 . 1 1 26 26 ASN HA H 26 4.518 4.518 4.712 -0.194 19163 853 1 3 . 1 1 26 26 ASN C C 26 175.820 175.820 174.518 1.302 19163 854 1 3 . 1 1 26 26 ASN CA C 26 51.525 51.525 51.724 -0.199 19163 855 1 3 . 1 1 26 26 ASN CB C 26 36.829 36.829 37.300 -0.471 19163 856 1 3 . 1 1 26 26 ASN H H 26 7.138 7.138 8.257 -1.119 19163 857 1 3 . 1 1 27 27 ALA N N 27 122.829 122.829 124.850 -2.021 19163 858 1 3 . 1 1 27 27 ALA HA H 27 4.325 4.325 4.477 -0.152 19163 859 1 3 . 1 1 27 27 ALA C C 27 178.726 178.726 177.733 0.993 19163 860 1 3 . 1 1 27 27 ALA CA C 27 52.961 52.961 52.346 0.615 19163 861 1 3 . 1 1 27 27 ALA CB C 27 19.159 19.159 19.883 -0.724 19163 862 1 3 . 1 1 27 27 ALA H H 27 7.637 7.637 7.659 -0.022 19163 863 1 3 . 1 1 28 28 THR N N 28 113.468 113.468 114.373 -0.905 19163 864 1 3 . 1 1 28 28 THR HA H 28 4.493 4.493 4.382 0.111 19163 865 1 3 . 1 1 28 28 THR C C 28 175.641 175.641 175.876 -0.235 19163 866 1 3 . 1 1 28 28 THR CA C 28 60.592 60.592 61.680 -1.088 19163 867 1 3 . 1 1 28 28 THR CB C 28 71.304 71.304 70.788 0.516 19163 868 1 3 . 1 1 28 28 THR H H 28 8.829 8.829 8.153 0.676 19163 869 1 3 . 1 1 29 29 GLN N N 29 119.445 119.445 122.099 -2.654 19163 870 1 3 . 1 1 29 29 GLN HA H 29 4.035 4.035 3.946 0.089 19163 871 1 3 . 1 1 29 29 GLN C C 29 179.117 179.117 178.525 0.592 19163 872 1 3 . 1 1 29 29 GLN CA C 29 59.435 59.435 59.944 -0.508 19163 873 1 3 . 1 1 29 29 GLN CB C 29 27.851 27.851 28.613 -0.762 19163 874 1 3 . 1 1 29 29 GLN H H 29 9.015 9.015 8.806 0.209 19163 875 1 3 . 1 1 30 30 GLU N N 30 119.343 119.343 119.206 0.137 19163 876 1 3 . 1 1 30 30 GLU HA H 30 4.059 4.059 4.043 0.016 19163 877 1 3 . 1 1 30 30 GLU C C 30 179.097 179.097 178.550 0.547 19163 878 1 3 . 1 1 30 30 GLU CA C 30 59.847 59.847 59.623 0.224 19163 879 1 3 . 1 1 30 30 GLU CB C 30 29.356 29.356 29.372 -0.016 19163 880 1 3 . 1 1 30 30 GLU H H 30 8.549 8.549 8.692 -0.143 19163 881 1 3 . 1 1 31 31 GLU N N 31 120.562 120.562 120.645 -0.083 19163 882 1 3 . 1 1 31 31 GLU HA H 31 3.906 3.906 4.092 -0.186 19163 883 1 3 . 1 1 31 31 GLU C C 31 180.405 180.405 179.168 1.237 19163 884 1 3 . 1 1 31 31 GLU CA C 31 59.592 59.592 59.406 0.186 19163 885 1 3 . 1 1 31 31 GLU CB C 31 29.989 29.989 29.547 0.442 19163 886 1 3 . 1 1 31 31 GLU H H 31 7.768 7.768 8.167 -0.399 19163 887 1 3 . 1 1 32 32 LEU N N 32 120.518 120.518 120.206 0.312 19163 888 1 3 . 1 1 32 32 LEU HA H 32 3.963 3.963 4.005 -0.042 19163 889 1 3 . 1 1 32 32 LEU C C 32 177.873 177.873 178.966 -1.093 19163 890 1 3 . 1 1 32 32 LEU CA C 32 58.593 58.593 57.755 0.838 19163 891 1 3 . 1 1 32 32 LEU CB C 32 42.556 42.556 41.114 1.442 19163 892 1 3 . 1 1 32 32 LEU H H 32 8.475 8.475 8.618 -0.143 19163 893 1 3 . 1 1 33 33 LYS N N 33 119.091 119.091 119.715 -0.624 19163 894 1 3 . 1 1 33 33 LYS HA H 33 4.000 4.000 4.233 -0.233 19163 895 1 3 . 1 1 33 33 LYS C C 33 178.701 178.701 178.986 -0.285 19163 896 1 3 . 1 1 33 33 LYS CA C 33 60.274 60.274 59.960 0.314 19163 897 1 3 . 1 1 33 33 LYS CB C 33 32.656 32.656 32.406 0.251 19163 898 1 3 . 1 1 33 33 LYS H H 33 8.077 8.077 7.779 0.298 19163 899 1 3 . 1 1 34 34 LYS N N 34 118.527 118.527 119.115 -0.588 19163 900 1 3 . 1 1 34 34 LYS HA H 34 3.890 3.890 4.042 -0.152 19163 901 1 3 . 1 1 34 34 LYS C C 34 179.172 179.172 178.971 0.201 19163 902 1 3 . 1 1 34 34 LYS CA C 34 59.927 59.927 59.289 0.638 19163 903 1 3 . 1 1 34 34 LYS CB C 34 32.869 32.869 32.361 0.508 19163 904 1 3 . 1 1 34 34 LYS H H 34 7.986 7.986 8.139 -0.153 19163 905 1 3 . 1 1 35 35 ALA N N 35 122.190 122.190 122.810 -0.620 19163 906 1 3 . 1 1 35 35 ALA HA H 35 4.116 4.116 4.034 0.083 19163 907 1 3 . 1 1 35 35 ALA C C 35 179.982 179.982 178.915 1.067 19163 908 1 3 . 1 1 35 35 ALA CA C 35 55.157 55.157 55.243 -0.086 19163 909 1 3 . 1 1 35 35 ALA CB C 35 18.773 18.773 18.337 0.436 19163 910 1 3 . 1 1 35 35 ALA H H 35 7.917 7.917 8.381 -0.464 19163 911 1 3 . 1 1 36 36 TYR N N 36 117.701 117.701 120.445 -2.744 19163 912 1 3 . 1 1 36 36 TYR HA H 36 3.818 3.818 4.004 -0.186 19163 913 1 3 . 1 1 36 36 TYR C C 36 176.344 176.344 177.371 -1.027 19163 914 1 3 . 1 1 36 36 TYR CA C 36 61.468 61.468 61.218 0.250 19163 915 1 3 . 1 1 36 36 TYR CB C 36 38.890 38.890 38.227 0.663 19163 916 1 3 . 1 1 36 36 TYR H H 36 8.402 8.402 7.816 0.586 19163 917 1 3 . 1 1 37 37 ARG N N 37 117.423 117.423 119.090 -1.667 19163 918 1 3 . 1 1 37 37 ARG HA H 37 3.481 3.481 3.631 -0.150 19163 919 1 3 . 1 1 37 37 ARG C C 37 178.825 178.825 178.267 0.558 19163 920 1 3 . 1 1 37 37 ARG CA C 37 59.397 59.397 59.732 -0.335 19163 921 1 3 . 1 1 37 37 ARG CB C 37 29.710 29.710 30.004 -0.294 19163 922 1 3 . 1 1 37 37 ARG H H 37 8.264 8.264 8.227 0.036 19163 923 1 3 . 1 1 38 38 LYS N N 38 117.247 117.247 119.739 -2.492 19163 924 1 3 . 1 1 38 38 LYS HA H 38 3.905 3.905 4.006 -0.101 19163 925 1 3 . 1 1 38 38 LYS C C 38 179.444 179.444 179.143 0.301 19163 926 1 3 . 1 1 38 38 LYS CA C 38 59.450 59.450 59.412 0.038 19163 927 1 3 . 1 1 38 38 LYS CB C 38 32.609 32.609 32.334 0.275 19163 928 1 3 . 1 1 38 38 LYS H H 38 7.444 7.444 7.724 -0.280 19163 929 1 3 . 1 1 39 39 LEU N N 39 119.901 119.901 119.311 0.590 19163 930 1 3 . 1 1 39 39 LEU HA H 39 4.020 4.020 4.063 -0.043 19163 931 1 3 . 1 1 39 39 LEU C C 39 178.801 178.801 178.748 0.053 19163 932 1 3 . 1 1 39 39 LEU CA C 39 57.409 57.409 57.554 -0.145 19163 933 1 3 . 1 1 39 39 LEU CB C 39 42.388 42.388 41.606 0.782 19163 934 1 3 . 1 1 39 39 LEU H H 39 7.707 7.707 7.965 -0.258 19163 935 1 3 . 1 1 40 40 ALA N N 40 122.772 122.772 122.213 0.559 19163 936 1 3 . 1 1 40 40 ALA HA H 40 3.849 3.849 4.069 -0.220 19163 937 1 3 . 1 1 40 40 ALA C C 40 179.446 179.446 179.116 0.330 19163 938 1 3 . 1 1 40 40 ALA CA C 40 55.109 55.109 55.141 -0.032 19163 939 1 3 . 1 1 40 40 ALA CB C 40 17.116 17.116 17.896 -0.780 19163 940 1 3 . 1 1 40 40 ALA H H 40 8.931 8.931 8.188 0.743 19163 941 1 3 . 1 1 41 41 LEU N N 41 115.299 115.299 116.644 -1.345 19163 942 1 3 . 1 1 41 41 LEU HA H 41 3.977 3.977 3.963 0.014 19163 943 1 3 . 1 1 41 41 LEU C C 41 178.216 178.216 178.943 -0.727 19163 944 1 3 . 1 1 41 41 LEU CA C 41 57.088 57.088 57.032 0.056 19163 945 1 3 . 1 1 41 41 LEU CB C 41 42.162 42.162 41.669 0.493 19163 946 1 3 . 1 1 41 41 LEU H H 41 7.133 7.133 7.343 -0.210 19163 947 1 3 . 1 1 42 42 LYS N N 42 116.812 116.812 118.151 -1.339 19163 948 1 3 . 1 1 42 42 LYS HA H 42 3.925 3.925 3.821 0.104 19163 949 1 3 . 1 1 42 42 LYS C C 42 177.560 177.560 177.747 -0.187 19163 950 1 3 . 1 1 42 42 LYS CA C 42 57.885 57.885 58.028 -0.143 19163 951 1 3 . 1 1 42 42 LYS CB C 42 33.427 33.427 32.682 0.745 19163 952 1 3 . 1 1 42 42 LYS H H 42 7.038 7.038 7.396 -0.358 19163 953 1 3 . 1 1 43 43 TYR N N 43 114.022 114.022 115.676 -1.654 19163 954 1 3 . 1 1 43 43 TYR HA H 43 4.665 4.665 4.485 0.180 19163 955 1 3 . 1 1 43 43 TYR C C 43 173.741 173.741 174.320 -0.579 19163 956 1 3 . 1 1 43 43 TYR CA C 43 56.928 56.928 56.719 0.209 19163 957 1 3 . 1 1 43 43 TYR CB C 43 39.579 39.579 37.928 1.651 19163 958 1 3 . 1 1 43 43 TYR H H 43 7.683 7.683 8.072 -0.389 19163 959 1 3 . 1 1 44 44 HIS N N 44 120.947 120.947 117.511 3.436 19163 960 1 3 . 1 1 44 44 HIS HA H 44 3.697 3.697 4.362 -0.665 19163 961 1 3 . 1 1 44 44 HIS C C 44 174.925 174.925 174.446 0.479 19163 962 1 3 . 1 1 44 44 HIS CA C 44 56.229 56.229 53.809 2.420 19163 963 1 3 . 1 1 44 44 HIS CB C 44 30.852 30.852 29.405 1.447 19163 964 1 3 . 1 1 44 44 HIS H H 44 7.814 7.814 7.118 0.696 19163 965 1 3 . 1 1 45 45 PRO HA H 45 4.131 4.131 4.489 -0.358 19163 966 1 3 . 1 1 45 45 PRO C C 45 177.269 177.269 177.842 -0.573 19163 967 1 3 . 1 1 45 45 PRO CA C 45 64.723 64.723 64.636 0.087 19163 968 1 3 . 1 1 45 45 PRO CB C 45 32.070 32.070 31.586 0.484 19163 969 1 3 . 1 1 46 46 ASP N N 46 119.127 119.127 117.139 1.988 19163 970 1 3 . 1 1 46 46 ASP HA H 46 4.375 4.375 4.346 0.029 19163 971 1 3 . 1 1 46 46 ASP C C 46 177.284 177.284 177.224 0.060 19163 972 1 3 . 1 1 46 46 ASP CA C 46 56.020 56.020 56.486 -0.466 19163 973 1 3 . 1 1 46 46 ASP CB C 46 40.221 40.221 40.688 -0.467 19163 974 1 3 . 1 1 46 46 ASP H H 46 10.040 10.040 8.172 1.868 19163 975 1 3 . 1 1 47 47 LYS N N 47 117.416 117.416 116.674 0.742 19163 976 1 3 . 1 1 47 47 LYS HA H 47 4.315 4.315 4.252 0.063 19163 977 1 3 . 1 1 47 47 LYS C C 47 176.355 176.355 176.742 -0.387 19163 978 1 3 . 1 1 47 47 LYS CA C 47 55.880 55.880 56.733 -0.853 19163 979 1 3 . 1 1 47 47 LYS CB C 47 33.778 33.778 33.852 -0.074 19163 980 1 3 . 1 1 47 47 LYS H H 47 7.826 7.826 7.354 0.472 19163 981 1 3 . 1 1 48 48 ASN N N 48 116.573 116.573 118.232 -1.659 19163 982 1 3 . 1 1 48 48 ASN HA H 48 5.021 5.021 5.212 -0.191 19163 983 1 3 . 1 1 48 48 ASN C C 48 172.992 172.992 173.975 -0.983 19163 984 1 3 . 1 1 48 48 ASN CA C 48 50.467 50.467 51.083 -0.616 19163 985 1 3 . 1 1 48 48 ASN CB C 48 39.284 39.284 39.295 -0.011 19163 986 1 3 . 1 1 48 48 ASN H H 48 7.956 7.956 8.122 -0.166 19163 987 1 3 . 1 1 49 49 PRO HA H 49 4.448 4.448 4.441 0.007 19163 988 1 3 . 1 1 49 49 PRO C C 49 178.030 178.030 177.779 0.251 19163 989 1 3 . 1 1 49 49 PRO CA C 49 64.468 64.468 64.904 -0.436 19163 990 1 3 . 1 1 49 49 PRO CB C 49 32.173 32.173 32.029 0.144 19163 991 1 3 . 1 1 50 50 ASN N N 50 115.567 115.567 116.364 -0.797 19163 992 1 3 . 1 1 50 50 ASN HA H 50 4.748 4.748 4.573 0.175 19163 993 1 3 . 1 1 50 50 ASN C C 50 176.443 176.443 176.720 -0.277 19163 994 1 3 . 1 1 50 50 ASN CA C 50 54.677 54.677 55.604 -0.927 19163 995 1 3 . 1 1 50 50 ASN CB C 50 39.014 39.014 37.586 1.428 19163 996 1 3 . 1 1 50 50 ASN H H 50 8.398 8.398 8.794 -0.396 19163 997 1 3 . 1 1 51 51 GLU N N 51 119.270 119.270 119.006 0.264 19163 998 1 3 . 1 1 51 51 GLU HA H 51 4.797 4.797 4.521 0.276 19163 999 1 3 . 1 1 51 51 GLU C C 51 176.922 176.922 178.065 -1.143 19163 1000 1 3 . 1 1 51 51 GLU CA C 51 55.916 55.916 56.292 -0.376 19163 1001 1 3 . 1 1 51 51 GLU CB C 51 29.200 29.200 28.978 0.222 19163 1002 1 3 . 1 1 51 51 GLU H H 51 7.485 7.485 7.727 -0.242 19163 1003 1 3 . 1 1 52 52 GLY N N 52 107.541 107.541 108.560 -1.019 19163 1004 1 3 . 1 1 52 52 GLY C C 52 176.755 176.755 175.464 1.291 19163 1005 1 3 . 1 1 52 52 GLY CA C 52 47.914 47.914 46.830 1.084 19163 1006 1 3 . 1 1 52 52 GLY H H 52 8.092 8.092 7.932 0.160 19163 1007 1 3 . 1 1 53 53 GLU N N 53 121.603 121.603 121.246 0.357 19163 1008 1 3 . 1 1 53 53 GLU HA H 53 4.065 4.065 4.061 0.004 19163 1009 1 3 . 1 1 53 53 GLU C C 53 179.052 179.052 178.673 0.379 19163 1010 1 3 . 1 1 53 53 GLU CA C 53 59.280 59.280 59.604 -0.324 19163 1011 1 3 . 1 1 53 53 GLU CB C 53 28.968 28.968 29.431 -0.463 19163 1012 1 3 . 1 1 53 53 GLU H H 53 8.496 8.496 7.785 0.711 19163 1013 1 3 . 1 1 54 54 LYS N N 54 120.837 120.837 118.374 2.463 19163 1014 1 3 . 1 1 54 54 LYS HA H 54 3.923 3.923 4.039 -0.116 19163 1015 1 3 . 1 1 54 54 LYS C C 54 179.058 179.058 179.006 0.052 19163 1016 1 3 . 1 1 54 54 LYS CA C 54 58.800 58.800 58.777 0.023 19163 1017 1 3 . 1 1 54 54 LYS CB C 54 31.551 31.551 32.169 -0.618 19163 1018 1 3 . 1 1 54 54 LYS H H 54 7.857 7.857 7.521 0.336 19163 1019 1 3 . 1 1 55 55 PHE N N 55 118.608 118.608 121.166 -2.558 19163 1020 1 3 . 1 1 55 55 PHE HA H 55 4.021 4.021 4.198 -0.177 19163 1021 1 3 . 1 1 55 55 PHE C C 55 178.001 178.001 176.813 1.188 19163 1022 1 3 . 1 1 55 55 PHE CA C 55 61.911 61.911 61.323 0.588 19163 1023 1 3 . 1 1 55 55 PHE CB C 55 38.553 38.553 39.223 -0.670 19163 1024 1 3 . 1 1 55 55 PHE H H 55 8.382 8.382 8.162 0.220 19163 1025 1 3 . 1 1 56 56 LYS N N 56 120.898 120.898 119.069 1.829 19163 1026 1 3 . 1 1 56 56 LYS HA H 56 3.828 3.828 3.979 -0.151 19163 1027 1 3 . 1 1 56 56 LYS C C 56 178.817 178.817 179.033 -0.216 19163 1028 1 3 . 1 1 56 56 LYS CA C 56 59.877 59.877 59.655 0.222 19163 1029 1 3 . 1 1 56 56 LYS CB C 56 32.133 32.133 31.425 0.708 19163 1030 1 3 . 1 1 56 56 LYS H H 56 8.111 8.111 7.994 0.117 19163 1031 1 3 . 1 1 57 57 GLN N N 57 118.600 118.600 118.536 0.064 19163 1032 1 3 . 1 1 57 57 GLN HA H 57 4.009 4.009 4.074 -0.065 19163 1033 1 3 . 1 1 57 57 GLN C C 57 179.333 179.333 178.802 0.531 19163 1034 1 3 . 1 1 57 57 GLN CA C 57 59.109 59.109 59.082 0.027 19163 1035 1 3 . 1 1 57 57 GLN CB C 57 28.595 28.595 28.524 0.070 19163 1036 1 3 . 1 1 57 57 GLN H H 57 7.613 7.613 7.611 0.002 19163 1037 1 3 . 1 1 58 58 ILE N N 58 118.709 118.709 120.258 -1.549 19163 1038 1 3 . 1 1 58 58 ILE HA H 58 3.559 3.559 3.596 -0.037 19163 1039 1 3 . 1 1 58 58 ILE C C 58 177.152 177.152 178.121 -0.969 19163 1040 1 3 . 1 1 58 58 ILE CA C 58 65.068 65.068 65.373 -0.305 19163 1041 1 3 . 1 1 58 58 ILE CB C 58 38.381 38.381 37.659 0.722 19163 1042 1 3 . 1 1 58 58 ILE H H 58 8.011 8.011 7.669 0.342 19163 1043 1 3 . 1 1 59 59 SER N N 59 116.112 116.112 114.751 1.361 19163 1044 1 3 . 1 1 59 59 SER HA H 59 3.948 3.948 3.897 0.051 19163 1045 1 3 . 1 1 59 59 SER C C 59 175.949 175.949 176.782 -0.833 19163 1046 1 3 . 1 1 59 59 SER CA C 59 62.315 62.315 61.860 0.455 19163 1047 1 3 . 1 1 59 59 SER H H 59 8.030 8.030 8.157 -0.127 19163 1048 1 3 . 1 1 60 60 GLN N N 60 122.099 122.099 120.669 1.430 19163 1049 1 3 . 1 1 60 60 GLN HA H 60 3.801 3.801 3.916 -0.115 19163 1050 1 3 . 1 1 60 60 GLN C C 60 176.942 176.942 178.256 -1.314 19163 1051 1 3 . 1 1 60 60 GLN CA C 60 58.762 58.762 58.765 -0.003 19163 1052 1 3 . 1 1 60 60 GLN CB C 60 28.498 28.498 28.803 -0.305 19163 1053 1 3 . 1 1 60 60 GLN H H 60 7.933 7.933 7.702 0.231 19163 1054 1 3 . 1 1 61 61 ALA N N 61 119.367 119.367 122.243 -2.876 19163 1055 1 3 . 1 1 61 61 ALA HA H 61 2.636 2.636 3.763 -1.127 19163 1056 1 3 . 1 1 61 61 ALA C C 61 178.507 178.507 179.228 -0.721 19163 1057 1 3 . 1 1 61 61 ALA CA C 61 54.126 54.126 54.814 -0.688 19163 1058 1 3 . 1 1 61 61 ALA CB C 61 18.462 18.462 18.284 0.178 19163 1059 1 3 . 1 1 61 61 ALA H H 61 7.354 7.354 7.823 -0.469 19163 1060 1 3 . 1 1 62 62 TYR N N 62 115.613 115.613 119.907 -4.294 19163 1061 1 3 . 1 1 62 62 TYR HA H 62 3.633 3.633 3.886 -0.253 19163 1062 1 3 . 1 1 62 62 TYR C C 62 177.421 177.421 177.273 0.148 19163 1063 1 3 . 1 1 62 62 TYR CA C 62 61.676 61.676 61.232 0.444 19163 1064 1 3 . 1 1 62 62 TYR CB C 62 39.162 39.162 37.917 1.245 19163 1065 1 3 . 1 1 62 62 TYR H H 62 7.994 7.994 8.615 -0.621 19163 1066 1 3 . 1 1 63 63 GLU N N 63 121.396 121.396 119.122 2.274 19163 1067 1 3 . 1 1 63 63 GLU HA H 63 3.347 3.347 3.623 -0.276 19163 1068 1 3 . 1 1 63 63 GLU C C 63 177.687 177.687 178.960 -1.273 19163 1069 1 3 . 1 1 63 63 GLU CA C 63 59.562 59.562 58.992 0.570 19163 1070 1 3 . 1 1 63 63 GLU CB C 63 29.115 29.115 28.845 0.270 19163 1071 1 3 . 1 1 63 63 GLU H H 63 8.151 8.151 7.852 0.299 19163 1072 1 3 . 1 1 64 64 VAL N N 64 115.850 115.850 118.677 -2.827 19163 1073 1 3 . 1 1 64 64 VAL HA H 64 3.377 3.377 3.641 -0.264 19163 1074 1 3 . 1 1 64 64 VAL C C 64 175.925 175.925 177.050 -1.125 19163 1075 1 3 . 1 1 64 64 VAL CA C 64 65.806 65.806 64.644 1.163 19163 1076 1 3 . 1 1 64 64 VAL CB C 64 31.786 31.786 31.408 0.378 19163 1077 1 3 . 1 1 64 64 VAL H H 64 6.814 6.814 7.195 -0.381 19163 1078 1 3 . 1 1 65 65 LEU N N 65 111.438 111.438 120.054 -8.616 19163 1079 1 3 . 1 1 65 65 LEU HA H 65 3.569 3.569 3.811 -0.242 19163 1080 1 3 . 1 1 65 65 LEU C C 65 177.124 177.124 179.117 -1.993 19163 1081 1 3 . 1 1 65 65 LEU CA C 65 56.645 56.645 57.630 -0.985 19163 1082 1 3 . 1 1 65 65 LEU CB C 65 42.589 42.589 40.832 1.757 19163 1083 1 3 . 1 1 65 65 LEU H H 65 7.398 7.398 8.296 -0.898 19163 1084 1 3 . 1 1 66 66 SER N N 66 108.642 108.642 111.311 -2.669 19163 1085 1 3 . 1 1 66 66 SER HA H 66 4.028 4.028 4.134 -0.106 19163 1086 1 3 . 1 1 66 66 SER C C 66 173.286 173.286 173.932 -0.646 19163 1087 1 3 . 1 1 66 66 SER CA C 66 59.232 59.232 59.676 -0.444 19163 1088 1 3 . 1 1 66 66 SER CB C 66 63.066 63.066 62.941 0.125 19163 1089 1 3 . 1 1 66 66 SER H H 66 7.700 7.700 7.646 0.054 19163 1090 1 3 . 1 1 67 67 ASP N N 67 124.276 124.276 121.594 2.682 19163 1091 1 3 . 1 1 67 67 ASP HA H 67 4.668 4.668 4.664 0.004 19163 1092 1 3 . 1 1 67 67 ASP C C 67 174.913 174.913 175.520 -0.607 19163 1093 1 3 . 1 1 67 67 ASP CA C 67 52.487 52.487 52.870 -0.383 19163 1094 1 3 . 1 1 67 67 ASP CB C 67 43.218 43.218 42.190 1.028 19163 1095 1 3 . 1 1 67 67 ASP H H 67 6.879 6.879 7.182 -0.303 19163 1096 1 3 . 1 1 68 68 ALA N N 68 127.326 127.326 130.480 -3.154 19163 1097 1 3 . 1 1 68 68 ALA HA H 68 3.853 3.853 3.904 -0.051 19163 1098 1 3 . 1 1 68 68 ALA C C 68 180.336 180.336 178.769 1.567 19163 1099 1 3 . 1 1 68 68 ALA CA C 68 55.912 55.912 55.384 0.528 19163 1100 1 3 . 1 1 68 68 ALA CB C 68 18.645 18.645 18.783 -0.138 19163 1101 1 3 . 1 1 68 68 ALA H H 68 8.693 8.693 8.842 -0.149 19163 1102 1 3 . 1 1 69 69 LYS N N 69 116.929 116.929 118.573 -1.644 19163 1103 1 3 . 1 1 69 69 LYS HA H 69 4.162 4.162 4.013 0.149 19163 1104 1 3 . 1 1 69 69 LYS C C 69 179.515 179.515 178.842 0.673 19163 1105 1 3 . 1 1 69 69 LYS CA C 69 58.562 58.562 59.464 -0.902 19163 1106 1 3 . 1 1 69 69 LYS CB C 69 31.840 31.840 32.284 -0.444 19163 1107 1 3 . 1 1 69 69 LYS H H 69 7.950 7.950 7.836 0.114 19163 1108 1 3 . 1 1 70 70 LYS N N 70 121.286 121.286 118.917 2.369 19163 1109 1 3 . 1 1 70 70 LYS HA H 70 3.960 3.960 4.065 -0.105 19163 1110 1 3 . 1 1 70 70 LYS C C 70 179.938 179.938 179.007 0.931 19163 1111 1 3 . 1 1 70 70 LYS CA C 70 60.066 60.066 59.570 0.496 19163 1112 1 3 . 1 1 70 70 LYS CB C 70 32.695 32.695 32.384 0.311 19163 1113 1 3 . 1 1 70 70 LYS H H 70 8.184 8.184 8.197 -0.013 19163 1114 1 3 . 1 1 71 71 ARG N N 71 122.794 122.794 119.826 2.968 19163 1115 1 3 . 1 1 71 71 ARG HA H 71 3.668 3.668 3.873 -0.205 19163 1116 1 3 . 1 1 71 71 ARG C C 71 177.356 177.356 178.208 -0.852 19163 1117 1 3 . 1 1 71 71 ARG CA C 71 60.127 60.127 60.137 -0.010 19163 1118 1 3 . 1 1 71 71 ARG CB C 71 29.668 29.668 30.171 -0.503 19163 1119 1 3 . 1 1 71 71 ARG H H 71 9.290 9.290 8.684 0.606 19163 1120 1 3 . 1 1 72 72 GLU N N 72 118.390 118.390 119.481 -1.091 19163 1121 1 3 . 1 1 72 72 GLU HA H 72 4.096 4.096 4.162 -0.066 19163 1122 1 3 . 1 1 72 72 GLU C C 72 179.073 179.073 179.093 -0.020 19163 1123 1 3 . 1 1 72 72 GLU CA C 72 59.456 59.456 59.121 0.335 19163 1124 1 3 . 1 1 72 72 GLU CB C 72 29.615 29.615 29.090 0.525 19163 1125 1 3 . 1 1 72 72 GLU H H 72 7.607 7.607 7.800 -0.193 19163 1126 1 3 . 1 1 73 73 LEU N N 73 117.921 117.921 120.074 -2.153 19163 1127 1 3 . 1 1 73 73 LEU HA H 73 4.032 4.032 3.960 0.072 19163 1128 1 3 . 1 1 73 73 LEU C C 73 179.696 179.696 179.276 0.420 19163 1129 1 3 . 1 1 73 73 LEU CA C 73 57.597 57.597 57.963 -0.366 19163 1130 1 3 . 1 1 73 73 LEU CB C 73 41.815 41.815 41.658 0.157 19163 1131 1 3 . 1 1 73 73 LEU H H 73 7.398 7.398 7.537 -0.139 19163 1132 1 3 . 1 1 74 74 TYR N N 74 122.662 122.662 118.381 4.281 19163 1133 1 3 . 1 1 74 74 TYR HA H 74 4.092 4.092 4.270 -0.178 19163 1134 1 3 . 1 1 74 74 TYR C C 74 178.166 178.166 178.577 -0.411 19163 1135 1 3 . 1 1 74 74 TYR CA C 74 61.458 61.458 61.015 0.443 19163 1136 1 3 . 1 1 74 74 TYR CB C 74 38.778 38.778 38.192 0.586 19163 1137 1 3 . 1 1 74 74 TYR H H 74 8.316 8.316 8.449 -0.133 19163 1138 1 3 . 1 1 75 75 ASP N N 75 118.842 118.842 119.423 -0.581 19163 1139 1 3 . 1 1 75 75 ASP HA H 75 4.423 4.423 4.563 -0.140 19163 1140 1 3 . 1 1 75 75 ASP C C 75 177.726 177.726 177.536 0.190 19163 1141 1 3 . 1 1 75 75 ASP CA C 75 56.177 56.177 56.784 -0.607 19163 1142 1 3 . 1 1 75 75 ASP CB C 75 40.800 40.800 40.937 -0.137 19163 1143 1 3 . 1 1 75 75 ASP H H 75 8.770 8.770 8.452 0.318 19163 1144 1 3 . 1 1 76 76 LYS N N 76 118.955 118.955 117.507 1.448 19163 1145 1 3 . 1 1 76 76 LYS HA H 76 4.130 4.130 4.440 -0.310 19163 1146 1 3 . 1 1 76 76 LYS C C 76 177.006 177.006 177.611 -0.605 19163 1147 1 3 . 1 1 76 76 LYS CA C 76 57.537 57.537 56.676 0.861 19163 1148 1 3 . 1 1 76 76 LYS CB C 76 33.136 33.136 33.509 -0.373 19163 1149 1 3 . 1 1 76 76 LYS H H 76 7.610 7.610 7.707 -0.097 19163 1150 1 4 . 1 1 11 11 MET HA H 11 4.346 4.346 4.738 -0.392 19163 1151 1 4 . 1 1 11 11 MET C C 11 175.801 175.801 175.220 0.581 19163 1152 1 4 . 1 1 11 11 MET CA C 11 55.614 55.614 54.948 0.666 19163 1153 1 4 . 1 1 11 11 MET CB C 11 32.925 32.925 33.960 -1.035 19163 1154 1 4 . 1 1 12 12 VAL N N 12 121.226 121.226 122.942 -1.716 19163 1155 1 4 . 1 1 12 12 VAL HA H 12 4.026 4.026 4.301 -0.275 19163 1156 1 4 . 1 1 12 12 VAL C C 12 175.701 175.701 174.393 1.308 19163 1157 1 4 . 1 1 12 12 VAL CA C 12 62.188 62.188 62.437 -0.249 19163 1158 1 4 . 1 1 12 12 VAL CB C 12 32.882 32.882 32.205 0.677 19163 1159 1 4 . 1 1 12 12 VAL H H 12 7.988 7.988 8.486 -0.498 19163 1160 1 4 . 1 1 13 13 LYS N N 13 125.255 125.255 127.463 -2.208 19163 1161 1 4 . 1 1 13 13 LYS HA H 13 4.211 4.211 4.487 -0.276 19163 1162 1 4 . 1 1 13 13 LYS C C 13 176.121 176.121 175.454 0.667 19163 1163 1 4 . 1 1 13 13 LYS CA C 13 56.355 56.355 56.232 0.123 19163 1164 1 4 . 1 1 13 13 LYS CB C 13 33.019 33.019 32.663 0.356 19163 1165 1 4 . 1 1 13 13 LYS H H 13 8.281 8.281 8.597 -0.316 19163 1166 1 4 . 1 1 14 14 GLU N N 14 123.004 123.004 123.318 -0.314 19163 1167 1 4 . 1 1 14 14 GLU HA H 14 4.305 4.305 4.034 0.272 19163 1168 1 4 . 1 1 14 14 GLU C C 14 176.107 176.107 175.470 0.637 19163 1169 1 4 . 1 1 14 14 GLU CA C 14 56.343 56.343 56.322 0.021 19163 1170 1 4 . 1 1 14 14 GLU CB C 14 30.534 30.534 29.828 0.706 19163 1171 1 4 . 1 1 14 14 GLU H H 14 8.424 8.424 8.623 -0.199 19163 1172 1 4 . 1 1 15 15 THR N N 15 115.895 115.895 117.271 -1.376 19163 1173 1 4 . 1 1 15 15 THR HA H 15 4.538 4.538 4.404 0.134 19163 1174 1 4 . 1 1 15 15 THR C C 15 175.233 175.233 174.409 0.824 19163 1175 1 4 . 1 1 15 15 THR CA C 15 61.981 61.981 62.561 -0.580 19163 1176 1 4 . 1 1 15 15 THR CB C 15 69.865 69.865 68.918 0.947 19163 1177 1 4 . 1 1 15 15 THR H H 15 8.335 8.335 8.324 0.011 19163 1178 1 4 . 1 1 16 16 THR N N 16 116.992 116.992 119.645 -2.653 19163 1179 1 4 . 1 1 16 16 THR HA H 16 4.366 4.366 4.363 0.003 19163 1180 1 4 . 1 1 16 16 THR C C 16 176.090 176.090 175.669 0.421 19163 1181 1 4 . 1 1 16 16 THR CA C 16 62.172 62.172 59.548 2.624 19163 1182 1 4 . 1 1 16 16 THR CB C 16 71.997 71.997 70.941 1.056 19163 1183 1 4 . 1 1 16 16 THR H H 16 8.798 8.798 8.077 0.721 19163 1184 1 4 . 1 1 17 17 TYR N N 17 117.617 117.617 120.216 -2.599 19163 1185 1 4 . 1 1 17 17 TYR HA H 17 4.329 4.329 4.279 0.050 19163 1186 1 4 . 1 1 17 17 TYR C C 17 177.105 177.105 177.783 -0.678 19163 1187 1 4 . 1 1 17 17 TYR CA C 17 57.577 57.577 61.910 -4.333 19163 1188 1 4 . 1 1 17 17 TYR CB C 17 37.113 37.113 38.065 -0.952 19163 1189 1 4 . 1 1 17 17 TYR H H 17 8.292 8.292 8.681 -0.389 19163 1190 1 4 . 1 1 18 18 TYR N N 18 115.048 115.048 117.758 -2.710 19163 1191 1 4 . 1 1 18 18 TYR HA H 18 3.775 3.775 4.321 -0.546 19163 1192 1 4 . 1 1 18 18 TYR C C 18 177.771 177.771 177.663 0.108 19163 1193 1 4 . 1 1 18 18 TYR CA C 18 61.430 61.430 61.404 0.026 19163 1194 1 4 . 1 1 18 18 TYR CB C 18 36.495 36.495 37.520 -1.025 19163 1195 1 4 . 1 1 18 18 TYR H H 18 7.047 7.047 8.004 -0.957 19163 1196 1 4 . 1 1 19 19 ASP N N 19 119.520 119.520 119.012 0.508 19163 1197 1 4 . 1 1 19 19 ASP HA H 19 4.406 4.406 4.449 -0.043 19163 1198 1 4 . 1 1 19 19 ASP C C 19 180.128 180.128 178.420 1.708 19163 1199 1 4 . 1 1 19 19 ASP CA C 19 57.475 57.475 57.530 -0.055 19163 1200 1 4 . 1 1 19 19 ASP CB C 19 40.659 40.659 40.587 0.072 19163 1201 1 4 . 1 1 19 19 ASP H H 19 7.685 7.685 8.487 -0.802 19163 1202 1 4 . 1 1 20 20 VAL N N 20 119.772 119.772 119.065 0.707 19163 1203 1 4 . 1 1 20 20 VAL HA H 20 3.608 3.608 3.687 -0.079 19163 1204 1 4 . 1 1 20 20 VAL C C 20 177.026 177.026 177.214 -0.188 19163 1205 1 4 . 1 1 20 20 VAL CA C 20 65.840 65.840 65.734 0.106 19163 1206 1 4 . 1 1 20 20 VAL CB C 20 31.530 31.530 31.933 -0.404 19163 1207 1 4 . 1 1 20 20 VAL H H 20 8.004 8.004 8.218 -0.214 19163 1208 1 4 . 1 1 21 21 LEU N N 21 115.252 115.252 115.275 -0.023 19163 1209 1 4 . 1 1 21 21 LEU HA H 21 4.281 4.281 4.389 -0.108 19163 1210 1 4 . 1 1 21 21 LEU C C 21 175.757 175.757 177.500 -1.743 19163 1211 1 4 . 1 1 21 21 LEU CA C 21 54.554 54.554 54.590 -0.035 19163 1212 1 4 . 1 1 21 21 LEU CB C 21 42.869 42.869 41.766 1.103 19163 1213 1 4 . 1 1 21 21 LEU H H 21 6.847 6.847 7.590 -0.743 19163 1214 1 4 . 1 1 22 22 GLY N N 22 108.227 108.227 107.179 1.048 19163 1215 1 4 . 1 1 22 22 GLY C C 22 175.361 175.361 174.287 1.074 19163 1216 1 4 . 1 1 22 22 GLY CA C 22 46.574 46.574 45.724 0.850 19163 1217 1 4 . 1 1 22 22 GLY H H 22 7.874 7.874 7.683 0.191 19163 1218 1 4 . 1 1 23 23 VAL N N 23 110.675 110.675 119.630 -8.955 19163 1219 1 4 . 1 1 23 23 VAL HA H 23 4.767 4.767 4.344 0.423 19163 1220 1 4 . 1 1 23 23 VAL C C 23 174.674 174.674 174.753 -0.079 19163 1221 1 4 . 1 1 23 23 VAL CA C 23 58.349 58.349 60.329 -1.980 19163 1222 1 4 . 1 1 23 23 VAL CB C 23 34.938 34.938 35.293 -0.355 19163 1223 1 4 . 1 1 23 23 VAL H H 23 7.815 7.815 8.199 -0.384 19163 1224 1 4 . 1 1 24 24 LYS N N 24 119.948 119.948 122.906 -2.958 19163 1225 1 4 . 1 1 24 24 LYS HA H 24 4.488 4.488 4.781 -0.293 19163 1226 1 4 . 1 1 24 24 LYS C C 24 175.442 175.442 176.368 -0.926 19163 1227 1 4 . 1 1 24 24 LYS CA C 24 54.001 54.001 54.366 -0.365 19163 1228 1 4 . 1 1 24 24 LYS CB C 24 32.197 32.197 31.625 0.572 19163 1229 1 4 . 1 1 24 24 LYS H H 24 8.329 8.329 7.992 0.337 19163 1230 1 4 . 1 1 25 25 PRO HA H 25 2.421 2.421 4.391 -1.970 19163 1231 1 4 . 1 1 25 25 PRO C C 25 175.635 175.635 176.715 -1.080 19163 1232 1 4 . 1 1 25 25 PRO CA C 25 63.362 63.362 65.221 -1.859 19163 1233 1 4 . 1 1 25 25 PRO CB C 25 31.839 31.839 31.820 0.019 19163 1234 1 4 . 1 1 26 26 ASN N N 26 111.739 111.739 113.756 -2.017 19163 1235 1 4 . 1 1 26 26 ASN HA H 26 4.518 4.518 4.856 -0.338 19163 1236 1 4 . 1 1 26 26 ASN C C 26 175.820 175.820 174.467 1.353 19163 1237 1 4 . 1 1 26 26 ASN CA C 26 51.525 51.525 52.225 -0.700 19163 1238 1 4 . 1 1 26 26 ASN CB C 26 36.829 36.829 38.293 -1.464 19163 1239 1 4 . 1 1 26 26 ASN H H 26 7.138 7.138 8.373 -1.235 19163 1240 1 4 . 1 1 27 27 ALA N N 27 122.829 122.829 124.153 -1.324 19163 1241 1 4 . 1 1 27 27 ALA HA H 27 4.325 4.325 4.299 0.026 19163 1242 1 4 . 1 1 27 27 ALA C C 27 178.726 178.726 177.088 1.638 19163 1243 1 4 . 1 1 27 27 ALA CA C 27 52.961 52.961 52.376 0.585 19163 1244 1 4 . 1 1 27 27 ALA CB C 27 19.159 19.159 19.806 -0.647 19163 1245 1 4 . 1 1 27 27 ALA H H 27 7.637 7.637 7.595 0.042 19163 1246 1 4 . 1 1 28 28 THR N N 28 113.468 113.468 114.852 -1.384 19163 1247 1 4 . 1 1 28 28 THR HA H 28 4.493 4.493 4.402 0.091 19163 1248 1 4 . 1 1 28 28 THR C C 28 175.641 175.641 175.879 -0.238 19163 1249 1 4 . 1 1 28 28 THR CA C 28 60.592 60.592 61.502 -0.910 19163 1250 1 4 . 1 1 28 28 THR CB C 28 71.304 71.304 70.928 0.376 19163 1251 1 4 . 1 1 28 28 THR H H 28 8.829 8.829 8.208 0.621 19163 1252 1 4 . 1 1 29 29 GLN N N 29 119.445 119.445 122.027 -2.582 19163 1253 1 4 . 1 1 29 29 GLN HA H 29 4.035 4.035 3.932 0.103 19163 1254 1 4 . 1 1 29 29 GLN C C 29 179.117 179.117 178.423 0.694 19163 1255 1 4 . 1 1 29 29 GLN CA C 29 59.435 59.435 59.751 -0.316 19163 1256 1 4 . 1 1 29 29 GLN CB C 29 27.851 27.851 28.623 -0.773 19163 1257 1 4 . 1 1 29 29 GLN H H 29 9.015 9.015 8.822 0.193 19163 1258 1 4 . 1 1 30 30 GLU N N 30 119.343 119.343 119.392 -0.049 19163 1259 1 4 . 1 1 30 30 GLU HA H 30 4.059 4.059 4.127 -0.068 19163 1260 1 4 . 1 1 30 30 GLU C C 30 179.097 179.097 178.543 0.554 19163 1261 1 4 . 1 1 30 30 GLU CA C 30 59.847 59.847 59.224 0.623 19163 1262 1 4 . 1 1 30 30 GLU CB C 30 29.356 29.356 29.094 0.262 19163 1263 1 4 . 1 1 30 30 GLU H H 30 8.549 8.549 8.543 0.006 19163 1264 1 4 . 1 1 31 31 GLU N N 31 120.562 120.562 120.527 0.035 19163 1265 1 4 . 1 1 31 31 GLU HA H 31 3.906 3.906 4.090 -0.184 19163 1266 1 4 . 1 1 31 31 GLU C C 31 180.405 180.405 179.087 1.318 19163 1267 1 4 . 1 1 31 31 GLU CA C 31 59.592 59.592 59.345 0.247 19163 1268 1 4 . 1 1 31 31 GLU CB C 31 29.989 29.989 29.567 0.422 19163 1269 1 4 . 1 1 31 31 GLU H H 31 7.768 7.768 8.180 -0.412 19163 1270 1 4 . 1 1 32 32 LEU N N 32 120.518 120.518 120.159 0.359 19163 1271 1 4 . 1 1 32 32 LEU HA H 32 3.963 3.963 3.995 -0.032 19163 1272 1 4 . 1 1 32 32 LEU C C 32 177.873 177.873 178.942 -1.069 19163 1273 1 4 . 1 1 32 32 LEU CA C 32 58.593 58.593 57.802 0.791 19163 1274 1 4 . 1 1 32 32 LEU CB C 32 42.556 42.556 41.195 1.361 19163 1275 1 4 . 1 1 32 32 LEU H H 32 8.475 8.475 8.662 -0.187 19163 1276 1 4 . 1 1 33 33 LYS N N 33 119.091 119.091 119.636 -0.545 19163 1277 1 4 . 1 1 33 33 LYS HA H 33 4.000 4.000 4.191 -0.191 19163 1278 1 4 . 1 1 33 33 LYS C C 33 178.701 178.701 179.021 -0.320 19163 1279 1 4 . 1 1 33 33 LYS CA C 33 60.274 60.274 59.856 0.418 19163 1280 1 4 . 1 1 33 33 LYS CB C 33 32.656 32.656 32.375 0.281 19163 1281 1 4 . 1 1 33 33 LYS H H 33 8.077 8.077 7.752 0.325 19163 1282 1 4 . 1 1 34 34 LYS N N 34 118.527 118.527 118.752 -0.225 19163 1283 1 4 . 1 1 34 34 LYS HA H 34 3.890 3.890 4.082 -0.192 19163 1284 1 4 . 1 1 34 34 LYS C C 34 179.172 179.172 179.004 0.168 19163 1285 1 4 . 1 1 34 34 LYS CA C 34 59.927 59.927 58.760 1.167 19163 1286 1 4 . 1 1 34 34 LYS CB C 34 32.869 32.869 31.936 0.933 19163 1287 1 4 . 1 1 34 34 LYS H H 34 7.986 7.986 8.112 -0.126 19163 1288 1 4 . 1 1 35 35 ALA N N 35 122.190 122.190 122.814 -0.624 19163 1289 1 4 . 1 1 35 35 ALA HA H 35 4.116 4.116 4.042 0.074 19163 1290 1 4 . 1 1 35 35 ALA C C 35 179.982 179.982 178.940 1.042 19163 1291 1 4 . 1 1 35 35 ALA CA C 35 55.157 55.157 55.287 -0.130 19163 1292 1 4 . 1 1 35 35 ALA CB C 35 18.773 18.773 18.241 0.531 19163 1293 1 4 . 1 1 35 35 ALA H H 35 7.917 7.917 8.377 -0.460 19163 1294 1 4 . 1 1 36 36 TYR N N 36 117.701 117.701 120.396 -2.695 19163 1295 1 4 . 1 1 36 36 TYR HA H 36 3.818 3.818 4.001 -0.183 19163 1296 1 4 . 1 1 36 36 TYR C C 36 176.344 176.344 177.543 -1.199 19163 1297 1 4 . 1 1 36 36 TYR CA C 36 61.468 61.468 61.459 0.009 19163 1298 1 4 . 1 1 36 36 TYR CB C 36 38.890 38.890 38.216 0.674 19163 1299 1 4 . 1 1 36 36 TYR H H 36 8.402 8.402 7.817 0.585 19163 1300 1 4 . 1 1 37 37 ARG N N 37 117.423 117.423 118.955 -1.532 19163 1301 1 4 . 1 1 37 37 ARG HA H 37 3.481 3.481 3.689 -0.208 19163 1302 1 4 . 1 1 37 37 ARG C C 37 178.825 178.825 178.314 0.511 19163 1303 1 4 . 1 1 37 37 ARG CA C 37 59.397 59.397 59.602 -0.205 19163 1304 1 4 . 1 1 37 37 ARG CB C 37 29.710 29.710 30.084 -0.374 19163 1305 1 4 . 1 1 37 37 ARG H H 37 8.264 8.264 8.179 0.085 19163 1306 1 4 . 1 1 38 38 LYS N N 38 117.247 117.247 120.073 -2.826 19163 1307 1 4 . 1 1 38 38 LYS HA H 38 3.905 3.905 4.026 -0.121 19163 1308 1 4 . 1 1 38 38 LYS C C 38 179.444 179.444 179.195 0.249 19163 1309 1 4 . 1 1 38 38 LYS CA C 38 59.450 59.450 59.461 -0.011 19163 1310 1 4 . 1 1 38 38 LYS CB C 38 32.609 32.609 32.327 0.282 19163 1311 1 4 . 1 1 38 38 LYS H H 38 7.444 7.444 7.863 -0.419 19163 1312 1 4 . 1 1 39 39 LEU N N 39 119.901 119.901 119.263 0.638 19163 1313 1 4 . 1 1 39 39 LEU HA H 39 4.020 4.020 4.049 -0.029 19163 1314 1 4 . 1 1 39 39 LEU C C 39 178.801 178.801 178.677 0.124 19163 1315 1 4 . 1 1 39 39 LEU CA C 39 57.409 57.409 57.537 -0.128 19163 1316 1 4 . 1 1 39 39 LEU CB C 39 42.388 42.388 41.635 0.753 19163 1317 1 4 . 1 1 39 39 LEU H H 39 7.707 7.707 8.097 -0.390 19163 1318 1 4 . 1 1 40 40 ALA N N 40 122.772 122.772 122.319 0.453 19163 1319 1 4 . 1 1 40 40 ALA HA H 40 3.849 3.849 3.981 -0.132 19163 1320 1 4 . 1 1 40 40 ALA C C 40 179.446 179.446 179.425 0.021 19163 1321 1 4 . 1 1 40 40 ALA CA C 40 55.109 55.109 55.079 0.030 19163 1322 1 4 . 1 1 40 40 ALA CB C 40 17.116 17.116 18.100 -0.984 19163 1323 1 4 . 1 1 40 40 ALA H H 40 8.931 8.931 8.120 0.811 19163 1324 1 4 . 1 1 41 41 LEU N N 41 115.299 115.299 116.735 -1.436 19163 1325 1 4 . 1 1 41 41 LEU HA H 41 3.977 3.977 3.979 -0.002 19163 1326 1 4 . 1 1 41 41 LEU C C 41 178.216 178.216 178.338 -0.122 19163 1327 1 4 . 1 1 41 41 LEU CA C 41 57.088 57.088 57.179 -0.091 19163 1328 1 4 . 1 1 41 41 LEU CB C 41 42.162 42.162 41.687 0.475 19163 1329 1 4 . 1 1 41 41 LEU H H 41 7.133 7.133 7.428 -0.295 19163 1330 1 4 . 1 1 42 42 LYS N N 42 116.812 116.812 116.601 0.211 19163 1331 1 4 . 1 1 42 42 LYS HA H 42 3.925 3.925 4.011 -0.086 19163 1332 1 4 . 1 1 42 42 LYS C C 42 177.560 177.560 177.605 -0.045 19163 1333 1 4 . 1 1 42 42 LYS CA C 42 57.885 57.885 57.511 0.374 19163 1334 1 4 . 1 1 42 42 LYS CB C 42 33.427 33.427 32.969 0.458 19163 1335 1 4 . 1 1 42 42 LYS H H 42 7.038 7.038 7.309 -0.271 19163 1336 1 4 . 1 1 43 43 TYR N N 43 114.022 114.022 115.632 -1.610 19163 1337 1 4 . 1 1 43 43 TYR HA H 43 4.665 4.665 4.447 0.218 19163 1338 1 4 . 1 1 43 43 TYR C C 43 173.741 173.741 174.033 -0.292 19163 1339 1 4 . 1 1 43 43 TYR CA C 43 56.928 56.928 56.208 0.720 19163 1340 1 4 . 1 1 43 43 TYR CB C 43 39.579 39.579 37.533 2.046 19163 1341 1 4 . 1 1 43 43 TYR H H 43 7.683 7.683 8.001 -0.318 19163 1342 1 4 . 1 1 44 44 HIS N N 44 120.947 120.947 116.156 4.791 19163 1343 1 4 . 1 1 44 44 HIS HA H 44 3.697 3.697 4.509 -0.812 19163 1344 1 4 . 1 1 44 44 HIS C C 44 174.925 174.925 174.963 -0.038 19163 1345 1 4 . 1 1 44 44 HIS CA C 44 56.229 56.229 54.233 1.996 19163 1346 1 4 . 1 1 44 44 HIS CB C 44 30.852 30.852 29.335 1.517 19163 1347 1 4 . 1 1 44 44 HIS H H 44 7.814 7.814 7.565 0.249 19163 1348 1 4 . 1 1 45 45 PRO HA H 45 4.131 4.131 4.579 -0.448 19163 1349 1 4 . 1 1 45 45 PRO C C 45 177.269 177.269 177.693 -0.424 19163 1350 1 4 . 1 1 45 45 PRO CA C 45 64.723 64.723 64.315 0.408 19163 1351 1 4 . 1 1 45 45 PRO CB C 45 32.070 32.070 31.828 0.241 19163 1352 1 4 . 1 1 46 46 ASP N N 46 119.127 119.127 118.126 1.001 19163 1353 1 4 . 1 1 46 46 ASP HA H 46 4.375 4.375 4.402 -0.027 19163 1354 1 4 . 1 1 46 46 ASP C C 46 177.284 177.284 177.223 0.061 19163 1355 1 4 . 1 1 46 46 ASP CA C 46 56.020 56.020 56.968 -0.948 19163 1356 1 4 . 1 1 46 46 ASP CB C 46 40.221 40.221 40.230 -0.009 19163 1357 1 4 . 1 1 46 46 ASP H H 46 10.040 10.040 8.513 1.527 19163 1358 1 4 . 1 1 47 47 LYS N N 47 117.416 117.416 116.941 0.475 19163 1359 1 4 . 1 1 47 47 LYS HA H 47 4.315 4.315 4.470 -0.155 19163 1360 1 4 . 1 1 47 47 LYS C C 47 176.355 176.355 177.123 -0.768 19163 1361 1 4 . 1 1 47 47 LYS CA C 47 55.880 55.880 56.291 -0.411 19163 1362 1 4 . 1 1 47 47 LYS CB C 47 33.778 33.778 34.334 -0.556 19163 1363 1 4 . 1 1 47 47 LYS H H 47 7.826 7.826 7.586 0.240 19163 1364 1 4 . 1 1 48 48 ASN N N 48 116.573 116.573 118.607 -2.034 19163 1365 1 4 . 1 1 48 48 ASN HA H 48 5.021 5.021 5.133 -0.112 19163 1366 1 4 . 1 1 48 48 ASN C C 48 172.992 172.992 174.152 -1.160 19163 1367 1 4 . 1 1 48 48 ASN CA C 48 50.467 50.467 51.071 -0.604 19163 1368 1 4 . 1 1 48 48 ASN CB C 48 39.284 39.284 39.244 0.040 19163 1369 1 4 . 1 1 48 48 ASN H H 48 7.956 7.956 8.492 -0.536 19163 1370 1 4 . 1 1 49 49 PRO HA H 49 4.448 4.448 4.383 0.065 19163 1371 1 4 . 1 1 49 49 PRO C C 49 178.030 178.030 178.053 -0.023 19163 1372 1 4 . 1 1 49 49 PRO CA C 49 64.468 64.468 64.772 -0.304 19163 1373 1 4 . 1 1 49 49 PRO CB C 49 32.173 32.173 32.022 0.152 19163 1374 1 4 . 1 1 50 50 ASN N N 50 115.567 115.567 117.547 -1.980 19163 1375 1 4 . 1 1 50 50 ASN HA H 50 4.748 4.748 4.551 0.197 19163 1376 1 4 . 1 1 50 50 ASN C C 50 176.443 176.443 176.857 -0.414 19163 1377 1 4 . 1 1 50 50 ASN CA C 50 54.677 54.677 55.722 -1.046 19163 1378 1 4 . 1 1 50 50 ASN CB C 50 39.014 39.014 38.049 0.965 19163 1379 1 4 . 1 1 50 50 ASN H H 50 8.398 8.398 8.687 -0.289 19163 1380 1 4 . 1 1 51 51 GLU N N 51 119.270 119.270 119.017 0.253 19163 1381 1 4 . 1 1 51 51 GLU HA H 51 4.797 4.797 4.426 0.371 19163 1382 1 4 . 1 1 51 51 GLU C C 51 176.922 176.922 177.853 -0.931 19163 1383 1 4 . 1 1 51 51 GLU CA C 51 55.916 55.916 56.404 -0.488 19163 1384 1 4 . 1 1 51 51 GLU CB C 51 29.200 29.200 29.019 0.181 19163 1385 1 4 . 1 1 51 51 GLU H H 51 7.485 7.485 7.830 -0.345 19163 1386 1 4 . 1 1 52 52 GLY N N 52 107.541 107.541 108.368 -0.827 19163 1387 1 4 . 1 1 52 52 GLY C C 52 176.755 176.755 175.869 0.886 19163 1388 1 4 . 1 1 52 52 GLY CA C 52 47.914 47.914 46.709 1.205 19163 1389 1 4 . 1 1 52 52 GLY H H 52 8.092 8.092 7.754 0.338 19163 1390 1 4 . 1 1 53 53 GLU N N 53 121.603 121.603 120.787 0.816 19163 1391 1 4 . 1 1 53 53 GLU HA H 53 4.065 4.065 4.060 0.005 19163 1392 1 4 . 1 1 53 53 GLU C C 53 179.052 179.052 178.869 0.183 19163 1393 1 4 . 1 1 53 53 GLU CA C 53 59.280 59.280 59.403 -0.123 19163 1394 1 4 . 1 1 53 53 GLU CB C 53 28.968 28.968 29.202 -0.234 19163 1395 1 4 . 1 1 53 53 GLU H H 53 8.496 8.496 7.772 0.724 19163 1396 1 4 . 1 1 54 54 LYS N N 54 120.837 120.837 119.245 1.592 19163 1397 1 4 . 1 1 54 54 LYS HA H 54 3.923 3.923 4.061 -0.138 19163 1398 1 4 . 1 1 54 54 LYS C C 54 179.058 179.058 178.810 0.248 19163 1399 1 4 . 1 1 54 54 LYS CA C 54 58.800 58.800 58.385 0.415 19163 1400 1 4 . 1 1 54 54 LYS CB C 54 31.551 31.551 32.051 -0.500 19163 1401 1 4 . 1 1 54 54 LYS H H 54 7.857 7.857 7.735 0.122 19163 1402 1 4 . 1 1 55 55 PHE N N 55 118.608 118.608 120.536 -1.928 19163 1403 1 4 . 1 1 55 55 PHE HA H 55 4.021 4.021 4.063 -0.042 19163 1404 1 4 . 1 1 55 55 PHE C C 55 178.001 178.001 176.817 1.184 19163 1405 1 4 . 1 1 55 55 PHE CA C 55 61.911 61.911 60.989 0.922 19163 1406 1 4 . 1 1 55 55 PHE CB C 55 38.553 38.553 39.093 -0.540 19163 1407 1 4 . 1 1 55 55 PHE H H 55 8.382 8.382 7.847 0.535 19163 1408 1 4 . 1 1 56 56 LYS N N 56 120.898 120.898 119.481 1.417 19163 1409 1 4 . 1 1 56 56 LYS HA H 56 3.828 3.828 3.854 -0.026 19163 1410 1 4 . 1 1 56 56 LYS C C 56 178.817 178.817 178.595 0.222 19163 1411 1 4 . 1 1 56 56 LYS CA C 56 59.877 59.877 60.125 -0.248 19163 1412 1 4 . 1 1 56 56 LYS CB C 56 32.133 32.133 32.003 0.130 19163 1413 1 4 . 1 1 56 56 LYS H H 56 8.111 8.111 7.848 0.263 19163 1414 1 4 . 1 1 57 57 GLN N N 57 118.600 118.600 118.198 0.402 19163 1415 1 4 . 1 1 57 57 GLN HA H 57 4.009 4.009 4.043 -0.034 19163 1416 1 4 . 1 1 57 57 GLN C C 57 179.333 179.333 178.566 0.767 19163 1417 1 4 . 1 1 57 57 GLN CA C 57 59.109 59.109 58.663 0.446 19163 1418 1 4 . 1 1 57 57 GLN CB C 57 28.595 28.595 28.687 -0.092 19163 1419 1 4 . 1 1 57 57 GLN H H 57 7.613 7.613 7.489 0.124 19163 1420 1 4 . 1 1 58 58 ILE N N 58 118.709 118.709 120.465 -1.756 19163 1421 1 4 . 1 1 58 58 ILE HA H 58 3.559 3.559 3.573 -0.014 19163 1422 1 4 . 1 1 58 58 ILE C C 58 177.152 177.152 178.063 -0.911 19163 1423 1 4 . 1 1 58 58 ILE CA C 58 65.068 65.068 65.526 -0.458 19163 1424 1 4 . 1 1 58 58 ILE CB C 58 38.381 38.381 37.584 0.797 19163 1425 1 4 . 1 1 58 58 ILE H H 58 8.011 8.011 7.386 0.625 19163 1426 1 4 . 1 1 59 59 SER N N 59 116.112 116.112 114.903 1.209 19163 1427 1 4 . 1 1 59 59 SER HA H 59 3.948 3.948 3.993 -0.045 19163 1428 1 4 . 1 1 59 59 SER C C 59 175.949 175.949 176.919 -0.970 19163 1429 1 4 . 1 1 59 59 SER CA C 59 62.315 62.315 61.726 0.589 19163 1430 1 4 . 1 1 59 59 SER H H 59 8.030 8.030 8.224 -0.194 19163 1431 1 4 . 1 1 60 60 GLN N N 60 122.099 122.099 120.776 1.323 19163 1432 1 4 . 1 1 60 60 GLN HA H 60 3.801 3.801 3.944 -0.143 19163 1433 1 4 . 1 1 60 60 GLN C C 60 176.942 176.942 178.342 -1.400 19163 1434 1 4 . 1 1 60 60 GLN CA C 60 58.762 58.762 58.851 -0.089 19163 1435 1 4 . 1 1 60 60 GLN CB C 60 28.498 28.498 28.639 -0.141 19163 1436 1 4 . 1 1 60 60 GLN H H 60 7.933 7.933 7.574 0.359 19163 1437 1 4 . 1 1 61 61 ALA N N 61 119.367 119.367 122.188 -2.821 19163 1438 1 4 . 1 1 61 61 ALA HA H 61 2.636 2.636 3.802 -1.166 19163 1439 1 4 . 1 1 61 61 ALA C C 61 178.507 178.507 179.283 -0.776 19163 1440 1 4 . 1 1 61 61 ALA CA C 61 54.126 54.126 54.845 -0.719 19163 1441 1 4 . 1 1 61 61 ALA CB C 61 18.462 18.462 18.284 0.178 19163 1442 1 4 . 1 1 61 61 ALA H H 61 7.354 7.354 7.761 -0.407 19163 1443 1 4 . 1 1 62 62 TYR N N 62 115.613 115.613 120.122 -4.509 19163 1444 1 4 . 1 1 62 62 TYR HA H 62 3.633 3.633 3.906 -0.273 19163 1445 1 4 . 1 1 62 62 TYR C C 62 177.421 177.421 177.258 0.163 19163 1446 1 4 . 1 1 62 62 TYR CA C 62 61.676 61.676 61.009 0.667 19163 1447 1 4 . 1 1 62 62 TYR CB C 62 39.162 39.162 37.954 1.208 19163 1448 1 4 . 1 1 62 62 TYR H H 62 7.994 7.994 8.606 -0.612 19163 1449 1 4 . 1 1 63 63 GLU N N 63 121.396 121.396 119.927 1.469 19163 1450 1 4 . 1 1 63 63 GLU HA H 63 3.347 3.347 3.617 -0.270 19163 1451 1 4 . 1 1 63 63 GLU C C 63 177.687 177.687 178.903 -1.216 19163 1452 1 4 . 1 1 63 63 GLU CA C 63 59.562 59.562 59.215 0.347 19163 1453 1 4 . 1 1 63 63 GLU CB C 63 29.115 29.115 29.488 -0.372 19163 1454 1 4 . 1 1 63 63 GLU H H 63 8.151 8.151 7.984 0.167 19163 1455 1 4 . 1 1 64 64 VAL N N 64 115.850 115.850 119.251 -3.401 19163 1456 1 4 . 1 1 64 64 VAL HA H 64 3.377 3.377 3.731 -0.354 19163 1457 1 4 . 1 1 64 64 VAL C C 64 175.925 175.925 177.671 -1.746 19163 1458 1 4 . 1 1 64 64 VAL CA C 64 65.806 65.806 64.971 0.835 19163 1459 1 4 . 1 1 64 64 VAL CB C 64 31.786 31.786 31.317 0.469 19163 1460 1 4 . 1 1 64 64 VAL H H 64 6.814 6.814 7.259 -0.445 19163 1461 1 4 . 1 1 65 65 LEU N N 65 111.438 111.438 121.439 -10.001 19163 1462 1 4 . 1 1 65 65 LEU HA H 65 3.569 3.569 3.887 -0.318 19163 1463 1 4 . 1 1 65 65 LEU C C 65 177.124 177.124 178.313 -1.189 19163 1464 1 4 . 1 1 65 65 LEU CA C 65 56.645 56.645 57.417 -0.772 19163 1465 1 4 . 1 1 65 65 LEU CB C 65 42.589 42.589 40.943 1.646 19163 1466 1 4 . 1 1 65 65 LEU H H 65 7.398 7.398 8.321 -0.923 19163 1467 1 4 . 1 1 66 66 SER N N 66 108.642 108.642 109.732 -1.090 19163 1468 1 4 . 1 1 66 66 SER HA H 66 4.028 4.028 4.128 -0.100 19163 1469 1 4 . 1 1 66 66 SER C C 66 173.286 173.286 174.318 -1.032 19163 1470 1 4 . 1 1 66 66 SER CA C 66 59.232 59.232 59.687 -0.455 19163 1471 1 4 . 1 1 66 66 SER CB C 66 63.066 63.066 62.953 0.114 19163 1472 1 4 . 1 1 66 66 SER H H 66 7.700 7.700 7.701 -0.001 19163 1473 1 4 . 1 1 67 67 ASP N N 67 124.276 124.276 121.107 3.169 19163 1474 1 4 . 1 1 67 67 ASP HA H 67 4.668 4.668 4.720 -0.052 19163 1475 1 4 . 1 1 67 67 ASP C C 67 174.913 174.913 175.288 -0.375 19163 1476 1 4 . 1 1 67 67 ASP CA C 67 52.487 52.487 53.219 -0.732 19163 1477 1 4 . 1 1 67 67 ASP CB C 67 43.218 43.218 42.928 0.290 19163 1478 1 4 . 1 1 67 67 ASP H H 67 6.879 6.879 7.278 -0.399 19163 1479 1 4 . 1 1 68 68 ALA N N 68 127.326 127.326 130.515 -3.189 19163 1480 1 4 . 1 1 68 68 ALA HA H 68 3.853 3.853 3.912 -0.059 19163 1481 1 4 . 1 1 68 68 ALA C C 68 180.336 180.336 178.985 1.351 19163 1482 1 4 . 1 1 68 68 ALA CA C 68 55.912 55.912 55.642 0.271 19163 1483 1 4 . 1 1 68 68 ALA CB C 68 18.645 18.645 18.716 -0.071 19163 1484 1 4 . 1 1 68 68 ALA H H 68 8.693 8.693 8.535 0.158 19163 1485 1 4 . 1 1 69 69 LYS N N 69 116.929 116.929 117.816 -0.887 19163 1486 1 4 . 1 1 69 69 LYS HA H 69 4.162 4.162 4.027 0.135 19163 1487 1 4 . 1 1 69 69 LYS C C 69 179.515 179.515 178.746 0.769 19163 1488 1 4 . 1 1 69 69 LYS CA C 69 58.562 58.562 59.426 -0.864 19163 1489 1 4 . 1 1 69 69 LYS CB C 69 31.840 31.840 32.176 -0.336 19163 1490 1 4 . 1 1 69 69 LYS H H 69 7.950 7.950 8.400 -0.450 19163 1491 1 4 . 1 1 70 70 LYS N N 70 121.286 121.286 119.091 2.195 19163 1492 1 4 . 1 1 70 70 LYS HA H 70 3.960 3.960 3.959 0.001 19163 1493 1 4 . 1 1 70 70 LYS C C 70 179.938 179.938 179.004 0.934 19163 1494 1 4 . 1 1 70 70 LYS CA C 70 60.066 60.066 59.569 0.497 19163 1495 1 4 . 1 1 70 70 LYS CB C 70 32.695 32.695 32.276 0.419 19163 1496 1 4 . 1 1 70 70 LYS H H 70 8.184 8.184 8.259 -0.075 19163 1497 1 4 . 1 1 71 71 ARG N N 71 122.794 122.794 119.966 2.828 19163 1498 1 4 . 1 1 71 71 ARG HA H 71 3.668 3.668 3.860 -0.192 19163 1499 1 4 . 1 1 71 71 ARG C C 71 177.356 177.356 177.996 -0.640 19163 1500 1 4 . 1 1 71 71 ARG CA C 71 60.127 60.127 60.201 -0.074 19163 1501 1 4 . 1 1 71 71 ARG CB C 71 29.668 29.668 30.159 -0.491 19163 1502 1 4 . 1 1 71 71 ARG H H 71 9.290 9.290 8.455 0.835 19163 1503 1 4 . 1 1 72 72 GLU N N 72 118.390 118.390 119.650 -1.260 19163 1504 1 4 . 1 1 72 72 GLU HA H 72 4.096 4.096 4.125 -0.029 19163 1505 1 4 . 1 1 72 72 GLU C C 72 179.073 179.073 179.217 -0.144 19163 1506 1 4 . 1 1 72 72 GLU CA C 72 59.456 59.456 59.342 0.114 19163 1507 1 4 . 1 1 72 72 GLU CB C 72 29.615 29.615 29.555 0.060 19163 1508 1 4 . 1 1 72 72 GLU H H 72 7.607 7.607 7.732 -0.125 19163 1509 1 4 . 1 1 73 73 LEU N N 73 117.921 117.921 119.746 -1.825 19163 1510 1 4 . 1 1 73 73 LEU HA H 73 4.032 4.032 3.989 0.043 19163 1511 1 4 . 1 1 73 73 LEU C C 73 179.696 179.696 179.192 0.504 19163 1512 1 4 . 1 1 73 73 LEU CA C 73 57.597 57.597 57.552 0.045 19163 1513 1 4 . 1 1 73 73 LEU CB C 73 41.815 41.815 41.766 0.049 19163 1514 1 4 . 1 1 73 73 LEU H H 73 7.398 7.398 7.828 -0.430 19163 1515 1 4 . 1 1 74 74 TYR N N 74 122.662 122.662 119.699 2.963 19163 1516 1 4 . 1 1 74 74 TYR HA H 74 4.092 4.092 3.999 0.093 19163 1517 1 4 . 1 1 74 74 TYR C C 74 178.166 178.166 178.628 -0.462 19163 1518 1 4 . 1 1 74 74 TYR CA C 74 61.458 61.458 61.886 -0.428 19163 1519 1 4 . 1 1 74 74 TYR CB C 74 38.778 38.778 38.523 0.255 19163 1520 1 4 . 1 1 74 74 TYR H H 74 8.316 8.316 8.491 -0.175 19163 1521 1 4 . 1 1 75 75 ASP N N 75 118.842 118.842 119.024 -0.182 19163 1522 1 4 . 1 1 75 75 ASP HA H 75 4.423 4.423 4.552 -0.129 19163 1523 1 4 . 1 1 75 75 ASP C C 75 177.726 177.726 177.439 0.287 19163 1524 1 4 . 1 1 75 75 ASP CA C 75 56.177 56.177 56.918 -0.741 19163 1525 1 4 . 1 1 75 75 ASP CB C 75 40.800 40.800 40.523 0.277 19163 1526 1 4 . 1 1 75 75 ASP H H 75 8.770 8.770 8.549 0.221 19163 1527 1 4 . 1 1 76 76 LYS N N 76 118.955 118.955 118.984 -0.029 19163 1528 1 4 . 1 1 76 76 LYS HA H 76 4.130 4.130 4.281 -0.151 19163 1529 1 4 . 1 1 76 76 LYS C C 76 177.006 177.006 177.191 -0.185 19163 1530 1 4 . 1 1 76 76 LYS CA C 76 57.537 57.537 56.354 1.183 19163 1531 1 4 . 1 1 76 76 LYS CB C 76 33.136 33.136 33.226 -0.090 19163 1532 1 4 . 1 1 76 76 LYS H H 76 7.610 7.610 7.552 0.058 19163 1533 1 5 . 1 1 11 11 MET HA H 11 4.346 4.346 4.592 -0.246 19163 1534 1 5 . 1 1 11 11 MET C C 11 175.801 175.801 175.524 0.277 19163 1535 1 5 . 1 1 11 11 MET CA C 11 55.614 55.614 54.847 0.767 19163 1536 1 5 . 1 1 11 11 MET CB C 11 32.925 32.925 33.490 -0.565 19163 1537 1 5 . 1 1 12 12 VAL N N 12 121.226 121.226 125.356 -4.130 19163 1538 1 5 . 1 1 12 12 VAL HA H 12 4.026 4.026 4.157 -0.131 19163 1539 1 5 . 1 1 12 12 VAL C C 12 175.701 175.701 175.772 -0.071 19163 1540 1 5 . 1 1 12 12 VAL CA C 12 62.188 62.188 62.257 -0.069 19163 1541 1 5 . 1 1 12 12 VAL CB C 12 32.882 32.882 31.981 0.901 19163 1542 1 5 . 1 1 12 12 VAL H H 12 7.988 7.988 8.590 -0.602 19163 1543 1 5 . 1 1 13 13 LYS N N 13 125.255 125.255 127.942 -2.687 19163 1544 1 5 . 1 1 13 13 LYS HA H 13 4.211 4.211 4.468 -0.257 19163 1545 1 5 . 1 1 13 13 LYS C C 13 176.121 176.121 175.323 0.798 19163 1546 1 5 . 1 1 13 13 LYS CA C 13 56.355 56.355 55.580 0.775 19163 1547 1 5 . 1 1 13 13 LYS CB C 13 33.019 33.019 32.804 0.215 19163 1548 1 5 . 1 1 13 13 LYS H H 13 8.281 8.281 8.600 -0.319 19163 1549 1 5 . 1 1 14 14 GLU N N 14 123.004 123.004 122.486 0.518 19163 1550 1 5 . 1 1 14 14 GLU HA H 14 4.305 4.305 3.985 0.320 19163 1551 1 5 . 1 1 14 14 GLU C C 14 176.107 176.107 175.381 0.726 19163 1552 1 5 . 1 1 14 14 GLU CA C 14 56.343 56.343 56.539 -0.196 19163 1553 1 5 . 1 1 14 14 GLU CB C 14 30.534 30.534 29.360 1.174 19163 1554 1 5 . 1 1 14 14 GLU H H 14 8.424 8.424 8.695 -0.271 19163 1555 1 5 . 1 1 15 15 THR N N 15 115.895 115.895 115.996 -0.101 19163 1556 1 5 . 1 1 15 15 THR HA H 15 4.538 4.538 4.330 0.208 19163 1557 1 5 . 1 1 15 15 THR C C 15 175.233 175.233 174.133 1.100 19163 1558 1 5 . 1 1 15 15 THR CA C 15 61.981 61.981 62.625 -0.644 19163 1559 1 5 . 1 1 15 15 THR CB C 15 69.865 69.865 69.085 0.780 19163 1560 1 5 . 1 1 15 15 THR H H 15 8.335 8.335 8.157 0.178 19163 1561 1 5 . 1 1 16 16 THR N N 16 116.992 116.992 119.596 -2.604 19163 1562 1 5 . 1 1 16 16 THR HA H 16 4.366 4.366 4.338 0.028 19163 1563 1 5 . 1 1 16 16 THR C C 16 176.090 176.090 175.694 0.396 19163 1564 1 5 . 1 1 16 16 THR CA C 16 62.172 62.172 59.454 2.718 19163 1565 1 5 . 1 1 16 16 THR CB C 16 71.997 71.997 70.743 1.254 19163 1566 1 5 . 1 1 16 16 THR H H 16 8.798 8.798 8.174 0.624 19163 1567 1 5 . 1 1 17 17 TYR N N 17 117.617 117.617 120.192 -2.575 19163 1568 1 5 . 1 1 17 17 TYR HA H 17 4.329 4.329 4.318 0.011 19163 1569 1 5 . 1 1 17 17 TYR C C 17 177.105 177.105 177.841 -0.736 19163 1570 1 5 . 1 1 17 17 TYR CA C 17 57.577 57.577 61.779 -4.202 19163 1571 1 5 . 1 1 17 17 TYR CB C 17 37.113 37.113 38.111 -0.998 19163 1572 1 5 . 1 1 17 17 TYR H H 17 8.292 8.292 8.742 -0.450 19163 1573 1 5 . 1 1 18 18 TYR N N 18 115.048 115.048 117.814 -2.766 19163 1574 1 5 . 1 1 18 18 TYR HA H 18 3.775 3.775 4.350 -0.575 19163 1575 1 5 . 1 1 18 18 TYR C C 18 177.771 177.771 177.718 0.053 19163 1576 1 5 . 1 1 18 18 TYR CA C 18 61.430 61.430 61.314 0.116 19163 1577 1 5 . 1 1 18 18 TYR CB C 18 36.495 36.495 37.335 -0.840 19163 1578 1 5 . 1 1 18 18 TYR H H 18 7.047 7.047 8.065 -1.018 19163 1579 1 5 . 1 1 19 19 ASP N N 19 119.520 119.520 119.426 0.094 19163 1580 1 5 . 1 1 19 19 ASP HA H 19 4.406 4.406 4.445 -0.039 19163 1581 1 5 . 1 1 19 19 ASP C C 19 180.128 180.128 178.632 1.496 19163 1582 1 5 . 1 1 19 19 ASP CA C 19 57.475 57.475 57.590 -0.115 19163 1583 1 5 . 1 1 19 19 ASP CB C 19 40.659 40.659 40.629 0.030 19163 1584 1 5 . 1 1 19 19 ASP H H 19 7.685 7.685 8.443 -0.758 19163 1585 1 5 . 1 1 20 20 VAL N N 20 119.772 119.772 118.900 0.872 19163 1586 1 5 . 1 1 20 20 VAL HA H 20 3.608 3.608 3.757 -0.149 19163 1587 1 5 . 1 1 20 20 VAL C C 20 177.026 177.026 177.157 -0.131 19163 1588 1 5 . 1 1 20 20 VAL CA C 20 65.840 65.840 65.775 0.065 19163 1589 1 5 . 1 1 20 20 VAL CB C 20 31.530 31.530 31.474 0.056 19163 1590 1 5 . 1 1 20 20 VAL H H 20 8.004 8.004 8.354 -0.350 19163 1591 1 5 . 1 1 21 21 LEU N N 21 115.252 115.252 115.299 -0.047 19163 1592 1 5 . 1 1 21 21 LEU HA H 21 4.281 4.281 4.330 -0.049 19163 1593 1 5 . 1 1 21 21 LEU C C 21 175.757 175.757 177.209 -1.452 19163 1594 1 5 . 1 1 21 21 LEU CA C 21 54.554 54.554 54.874 -0.320 19163 1595 1 5 . 1 1 21 21 LEU CB C 21 42.869 42.869 41.854 1.015 19163 1596 1 5 . 1 1 21 21 LEU H H 21 6.847 6.847 7.516 -0.669 19163 1597 1 5 . 1 1 22 22 GLY N N 22 108.227 108.227 107.572 0.655 19163 1598 1 5 . 1 1 22 22 GLY C C 22 175.361 175.361 174.376 0.985 19163 1599 1 5 . 1 1 22 22 GLY CA C 22 46.574 46.574 45.666 0.908 19163 1600 1 5 . 1 1 22 22 GLY H H 22 7.874 7.874 7.492 0.382 19163 1601 1 5 . 1 1 23 23 VAL N N 23 110.675 110.675 118.479 -7.804 19163 1602 1 5 . 1 1 23 23 VAL HA H 23 4.767 4.767 4.503 0.264 19163 1603 1 5 . 1 1 23 23 VAL C C 23 174.674 174.674 174.577 0.097 19163 1604 1 5 . 1 1 23 23 VAL CA C 23 58.349 58.349 59.627 -1.278 19163 1605 1 5 . 1 1 23 23 VAL CB C 23 34.938 34.938 35.399 -0.461 19163 1606 1 5 . 1 1 23 23 VAL H H 23 7.815 7.815 8.227 -0.412 19163 1607 1 5 . 1 1 24 24 LYS N N 24 119.948 119.948 124.270 -4.322 19163 1608 1 5 . 1 1 24 24 LYS HA H 24 4.488 4.488 4.802 -0.314 19163 1609 1 5 . 1 1 24 24 LYS C C 24 175.442 175.442 176.088 -0.646 19163 1610 1 5 . 1 1 24 24 LYS CA C 24 54.001 54.001 53.960 0.041 19163 1611 1 5 . 1 1 24 24 LYS CB C 24 32.197 32.197 32.110 0.087 19163 1612 1 5 . 1 1 24 24 LYS H H 24 8.329 8.329 8.527 -0.198 19163 1613 1 5 . 1 1 25 25 PRO HA H 25 2.421 2.421 4.687 -2.266 19163 1614 1 5 . 1 1 25 25 PRO C C 25 175.635 175.635 176.626 -0.991 19163 1615 1 5 . 1 1 25 25 PRO CA C 25 63.362 63.362 64.794 -1.432 19163 1616 1 5 . 1 1 25 25 PRO CB C 25 31.839 31.839 31.827 0.012 19163 1617 1 5 . 1 1 26 26 ASN N N 26 111.739 111.739 114.590 -2.851 19163 1618 1 5 . 1 1 26 26 ASN HA H 26 4.518 4.518 4.814 -0.296 19163 1619 1 5 . 1 1 26 26 ASN C C 26 175.820 175.820 174.906 0.914 19163 1620 1 5 . 1 1 26 26 ASN CA C 26 51.525 51.525 52.067 -0.542 19163 1621 1 5 . 1 1 26 26 ASN CB C 26 36.829 36.829 38.117 -1.288 19163 1622 1 5 . 1 1 26 26 ASN H H 26 7.138 7.138 8.336 -1.198 19163 1623 1 5 . 1 1 27 27 ALA N N 27 122.829 122.829 123.737 -0.908 19163 1624 1 5 . 1 1 27 27 ALA HA H 27 4.325 4.325 4.754 -0.429 19163 1625 1 5 . 1 1 27 27 ALA C C 27 178.726 178.726 177.377 1.349 19163 1626 1 5 . 1 1 27 27 ALA CA C 27 52.961 52.961 52.186 0.775 19163 1627 1 5 . 1 1 27 27 ALA CB C 27 19.159 19.159 20.204 -1.045 19163 1628 1 5 . 1 1 27 27 ALA H H 27 7.637 7.637 7.526 0.111 19163 1629 1 5 . 1 1 28 28 THR N N 28 113.468 113.468 113.673 -0.205 19163 1630 1 5 . 1 1 28 28 THR HA H 28 4.493 4.493 4.510 -0.017 19163 1631 1 5 . 1 1 28 28 THR C C 28 175.641 175.641 175.834 -0.193 19163 1632 1 5 . 1 1 28 28 THR CA C 28 60.592 60.592 60.253 0.339 19163 1633 1 5 . 1 1 28 28 THR CB C 28 71.304 71.304 70.684 0.620 19163 1634 1 5 . 1 1 28 28 THR H H 28 8.829 8.829 8.214 0.615 19163 1635 1 5 . 1 1 29 29 GLN N N 29 119.445 119.445 121.705 -2.260 19163 1636 1 5 . 1 1 29 29 GLN HA H 29 4.035 4.035 3.953 0.082 19163 1637 1 5 . 1 1 29 29 GLN C C 29 179.117 179.117 178.540 0.577 19163 1638 1 5 . 1 1 29 29 GLN CA C 29 59.435 59.435 60.097 -0.662 19163 1639 1 5 . 1 1 29 29 GLN CB C 29 27.851 27.851 28.209 -0.358 19163 1640 1 5 . 1 1 29 29 GLN H H 29 9.015 9.015 8.868 0.147 19163 1641 1 5 . 1 1 30 30 GLU N N 30 119.343 119.343 118.837 0.506 19163 1642 1 5 . 1 1 30 30 GLU HA H 30 4.059 4.059 4.095 -0.036 19163 1643 1 5 . 1 1 30 30 GLU C C 30 179.097 179.097 178.636 0.461 19163 1644 1 5 . 1 1 30 30 GLU CA C 30 59.847 59.847 59.390 0.457 19163 1645 1 5 . 1 1 30 30 GLU CB C 30 29.356 29.356 29.175 0.181 19163 1646 1 5 . 1 1 30 30 GLU H H 30 8.549 8.549 8.779 -0.230 19163 1647 1 5 . 1 1 31 31 GLU N N 31 120.562 120.562 120.716 -0.154 19163 1648 1 5 . 1 1 31 31 GLU HA H 31 3.906 3.906 4.101 -0.195 19163 1649 1 5 . 1 1 31 31 GLU C C 31 180.405 180.405 179.122 1.283 19163 1650 1 5 . 1 1 31 31 GLU CA C 31 59.592 59.592 59.423 0.169 19163 1651 1 5 . 1 1 31 31 GLU CB C 31 29.989 29.989 29.570 0.419 19163 1652 1 5 . 1 1 31 31 GLU H H 31 7.768 7.768 8.104 -0.336 19163 1653 1 5 . 1 1 32 32 LEU N N 32 120.518 120.518 120.217 0.301 19163 1654 1 5 . 1 1 32 32 LEU HA H 32 3.963 3.963 4.062 -0.099 19163 1655 1 5 . 1 1 32 32 LEU C C 32 177.873 177.873 179.027 -1.154 19163 1656 1 5 . 1 1 32 32 LEU CA C 32 58.593 58.593 57.837 0.755 19163 1657 1 5 . 1 1 32 32 LEU CB C 32 42.556 42.556 41.252 1.304 19163 1658 1 5 . 1 1 32 32 LEU H H 32 8.475 8.475 8.610 -0.135 19163 1659 1 5 . 1 1 33 33 LYS N N 33 119.091 119.091 119.773 -0.682 19163 1660 1 5 . 1 1 33 33 LYS HA H 33 4.000 4.000 4.210 -0.210 19163 1661 1 5 . 1 1 33 33 LYS C C 33 178.701 178.701 178.940 -0.239 19163 1662 1 5 . 1 1 33 33 LYS CA C 33 60.274 60.274 59.806 0.468 19163 1663 1 5 . 1 1 33 33 LYS CB C 33 32.656 32.656 32.393 0.263 19163 1664 1 5 . 1 1 33 33 LYS H H 33 8.077 8.077 7.734 0.343 19163 1665 1 5 . 1 1 34 34 LYS N N 34 118.527 118.527 119.417 -0.890 19163 1666 1 5 . 1 1 34 34 LYS HA H 34 3.890 3.890 3.999 -0.109 19163 1667 1 5 . 1 1 34 34 LYS C C 34 179.172 179.172 178.529 0.643 19163 1668 1 5 . 1 1 34 34 LYS CA C 34 59.927 59.927 59.598 0.329 19163 1669 1 5 . 1 1 34 34 LYS CB C 34 32.869 32.869 32.411 0.458 19163 1670 1 5 . 1 1 34 34 LYS H H 34 7.986 7.986 8.146 -0.160 19163 1671 1 5 . 1 1 35 35 ALA N N 35 122.190 122.190 122.087 0.103 19163 1672 1 5 . 1 1 35 35 ALA HA H 35 4.116 4.116 4.027 0.089 19163 1673 1 5 . 1 1 35 35 ALA C C 35 179.982 179.982 178.954 1.028 19163 1674 1 5 . 1 1 35 35 ALA CA C 35 55.157 55.157 55.321 -0.164 19163 1675 1 5 . 1 1 35 35 ALA CB C 35 18.773 18.773 18.221 0.552 19163 1676 1 5 . 1 1 35 35 ALA H H 35 7.917 7.917 8.296 -0.379 19163 1677 1 5 . 1 1 36 36 TYR N N 36 117.701 117.701 120.282 -2.581 19163 1678 1 5 . 1 1 36 36 TYR HA H 36 3.818 3.818 3.919 -0.101 19163 1679 1 5 . 1 1 36 36 TYR C C 36 176.344 176.344 177.501 -1.157 19163 1680 1 5 . 1 1 36 36 TYR CA C 36 61.468 61.468 61.400 0.068 19163 1681 1 5 . 1 1 36 36 TYR CB C 36 38.890 38.890 37.884 1.006 19163 1682 1 5 . 1 1 36 36 TYR H H 36 8.402 8.402 7.731 0.671 19163 1683 1 5 . 1 1 37 37 ARG N N 37 117.423 117.423 119.138 -1.715 19163 1684 1 5 . 1 1 37 37 ARG HA H 37 3.481 3.481 3.748 -0.267 19163 1685 1 5 . 1 1 37 37 ARG C C 37 178.825 178.825 178.261 0.564 19163 1686 1 5 . 1 1 37 37 ARG CA C 37 59.397 59.397 59.704 -0.307 19163 1687 1 5 . 1 1 37 37 ARG CB C 37 29.710 29.710 30.084 -0.374 19163 1688 1 5 . 1 1 37 37 ARG H H 37 8.264 8.264 8.207 0.057 19163 1689 1 5 . 1 1 38 38 LYS N N 38 117.247 117.247 120.018 -2.771 19163 1690 1 5 . 1 1 38 38 LYS HA H 38 3.905 3.905 4.052 -0.147 19163 1691 1 5 . 1 1 38 38 LYS C C 38 179.444 179.444 179.197 0.247 19163 1692 1 5 . 1 1 38 38 LYS CA C 38 59.450 59.450 59.583 -0.133 19163 1693 1 5 . 1 1 38 38 LYS CB C 38 32.609 32.609 32.365 0.244 19163 1694 1 5 . 1 1 38 38 LYS H H 38 7.444 7.444 8.000 -0.556 19163 1695 1 5 . 1 1 39 39 LEU N N 39 119.901 119.901 119.331 0.570 19163 1696 1 5 . 1 1 39 39 LEU HA H 39 4.020 4.020 4.242 -0.222 19163 1697 1 5 . 1 1 39 39 LEU C C 39 178.801 178.801 178.870 -0.069 19163 1698 1 5 . 1 1 39 39 LEU CA C 39 57.409 57.409 57.761 -0.352 19163 1699 1 5 . 1 1 39 39 LEU CB C 39 42.388 42.388 41.640 0.748 19163 1700 1 5 . 1 1 39 39 LEU H H 39 7.707 7.707 8.166 -0.459 19163 1701 1 5 . 1 1 40 40 ALA N N 40 122.772 122.772 121.935 0.837 19163 1702 1 5 . 1 1 40 40 ALA HA H 40 3.849 3.849 4.082 -0.233 19163 1703 1 5 . 1 1 40 40 ALA C C 40 179.446 179.446 179.685 -0.239 19163 1704 1 5 . 1 1 40 40 ALA CA C 40 55.109 55.109 55.047 0.062 19163 1705 1 5 . 1 1 40 40 ALA CB C 40 17.116 17.116 18.279 -1.163 19163 1706 1 5 . 1 1 40 40 ALA H H 40 8.931 8.931 8.183 0.748 19163 1707 1 5 . 1 1 41 41 LEU N N 41 115.299 115.299 117.404 -2.105 19163 1708 1 5 . 1 1 41 41 LEU HA H 41 3.977 3.977 3.784 0.193 19163 1709 1 5 . 1 1 41 41 LEU C C 41 178.216 178.216 178.678 -0.462 19163 1710 1 5 . 1 1 41 41 LEU CA C 41 57.088 57.088 57.328 -0.240 19163 1711 1 5 . 1 1 41 41 LEU CB C 41 42.162 42.162 41.723 0.439 19163 1712 1 5 . 1 1 41 41 LEU H H 41 7.133 7.133 7.692 -0.559 19163 1713 1 5 . 1 1 42 42 LYS N N 42 116.812 116.812 117.167 -0.355 19163 1714 1 5 . 1 1 42 42 LYS HA H 42 3.925 3.925 4.017 -0.092 19163 1715 1 5 . 1 1 42 42 LYS C C 42 177.560 177.560 178.006 -0.446 19163 1716 1 5 . 1 1 42 42 LYS CA C 42 57.885 57.885 57.598 0.287 19163 1717 1 5 . 1 1 42 42 LYS CB C 42 33.427 33.427 32.935 0.492 19163 1718 1 5 . 1 1 42 42 LYS H H 42 7.038 7.038 7.478 -0.440 19163 1719 1 5 . 1 1 43 43 TYR N N 43 114.022 114.022 114.312 -0.290 19163 1720 1 5 . 1 1 43 43 TYR HA H 43 4.665 4.665 4.506 0.159 19163 1721 1 5 . 1 1 43 43 TYR C C 43 173.741 173.741 174.781 -1.040 19163 1722 1 5 . 1 1 43 43 TYR CA C 43 56.928 56.928 57.181 -0.253 19163 1723 1 5 . 1 1 43 43 TYR CB C 43 39.579 39.579 38.105 1.474 19163 1724 1 5 . 1 1 43 43 TYR H H 43 7.683 7.683 8.380 -0.697 19163 1725 1 5 . 1 1 44 44 HIS N N 44 120.947 120.947 122.546 -1.599 19163 1726 1 5 . 1 1 44 44 HIS HA H 44 3.697 3.697 3.995 -0.298 19163 1727 1 5 . 1 1 44 44 HIS C C 44 174.925 174.925 174.455 0.470 19163 1728 1 5 . 1 1 44 44 HIS CA C 44 56.229 56.229 55.605 0.624 19163 1729 1 5 . 1 1 44 44 HIS CB C 44 30.852 30.852 30.724 0.128 19163 1730 1 5 . 1 1 44 44 HIS H H 44 7.814 7.814 7.623 0.191 19163 1731 1 5 . 1 1 45 45 PRO HA H 45 4.131 4.131 4.378 -0.247 19163 1732 1 5 . 1 1 45 45 PRO C C 45 177.269 177.269 176.910 0.359 19163 1733 1 5 . 1 1 45 45 PRO CA C 45 64.723 64.723 64.743 -0.020 19163 1734 1 5 . 1 1 45 45 PRO CB C 45 32.070 32.070 31.852 0.218 19163 1735 1 5 . 1 1 46 46 ASP N N 46 119.127 119.127 116.345 2.782 19163 1736 1 5 . 1 1 46 46 ASP HA H 46 4.375 4.375 4.416 -0.041 19163 1737 1 5 . 1 1 46 46 ASP C C 46 177.284 177.284 176.854 0.430 19163 1738 1 5 . 1 1 46 46 ASP CA C 46 56.020 56.020 56.267 -0.247 19163 1739 1 5 . 1 1 46 46 ASP CB C 46 40.221 40.221 40.391 -0.170 19163 1740 1 5 . 1 1 46 46 ASP H H 46 10.040 10.040 7.942 2.098 19163 1741 1 5 . 1 1 47 47 LYS N N 47 117.416 117.416 119.092 -1.676 19163 1742 1 5 . 1 1 47 47 LYS HA H 47 4.315 4.315 4.345 -0.030 19163 1743 1 5 . 1 1 47 47 LYS C C 47 176.355 176.355 176.367 -0.012 19163 1744 1 5 . 1 1 47 47 LYS CA C 47 55.880 55.880 57.340 -1.460 19163 1745 1 5 . 1 1 47 47 LYS CB C 47 33.778 33.778 34.868 -1.091 19163 1746 1 5 . 1 1 47 47 LYS H H 47 7.826 7.826 7.545 0.281 19163 1747 1 5 . 1 1 48 48 ASN N N 48 116.573 116.573 118.811 -2.238 19163 1748 1 5 . 1 1 48 48 ASN HA H 48 5.021 5.021 5.163 -0.142 19163 1749 1 5 . 1 1 48 48 ASN C C 48 172.992 172.992 173.416 -0.424 19163 1750 1 5 . 1 1 48 48 ASN CA C 48 50.467 50.467 50.635 -0.168 19163 1751 1 5 . 1 1 48 48 ASN CB C 48 39.284 39.284 39.511 -0.227 19163 1752 1 5 . 1 1 48 48 ASN H H 48 7.956 7.956 8.384 -0.428 19163 1753 1 5 . 1 1 49 49 PRO HA H 49 4.448 4.448 4.411 0.037 19163 1754 1 5 . 1 1 49 49 PRO C C 49 178.030 178.030 176.856 1.174 19163 1755 1 5 . 1 1 49 49 PRO CA C 49 64.468 64.468 64.572 -0.104 19163 1756 1 5 . 1 1 49 49 PRO CB C 49 32.173 32.173 32.057 0.116 19163 1757 1 5 . 1 1 50 50 ASN N N 50 115.567 115.567 112.985 2.582 19163 1758 1 5 . 1 1 50 50 ASN HA H 50 4.748 4.748 4.567 0.181 19163 1759 1 5 . 1 1 50 50 ASN C C 50 176.443 176.443 175.906 0.537 19163 1760 1 5 . 1 1 50 50 ASN CA C 50 54.677 54.677 54.472 0.205 19163 1761 1 5 . 1 1 50 50 ASN CB C 50 39.014 39.014 37.110 1.904 19163 1762 1 5 . 1 1 50 50 ASN H H 50 8.398 8.398 8.655 -0.257 19163 1763 1 5 . 1 1 51 51 GLU N N 51 119.270 119.270 119.279 -0.009 19163 1764 1 5 . 1 1 51 51 GLU HA H 51 4.797 4.797 4.583 0.214 19163 1765 1 5 . 1 1 51 51 GLU C C 51 176.922 176.922 178.042 -1.120 19163 1766 1 5 . 1 1 51 51 GLU CA C 51 55.916 55.916 56.594 -0.678 19163 1767 1 5 . 1 1 51 51 GLU CB C 51 29.200 29.200 29.751 -0.551 19163 1768 1 5 . 1 1 51 51 GLU H H 51 7.485 7.485 7.703 -0.218 19163 1769 1 5 . 1 1 52 52 GLY N N 52 107.541 107.541 108.726 -1.185 19163 1770 1 5 . 1 1 52 52 GLY C C 52 176.755 176.755 175.452 1.303 19163 1771 1 5 . 1 1 52 52 GLY CA C 52 47.914 47.914 46.786 1.128 19163 1772 1 5 . 1 1 52 52 GLY H H 52 8.092 8.092 7.756 0.336 19163 1773 1 5 . 1 1 53 53 GLU N N 53 121.603 121.603 120.831 0.772 19163 1774 1 5 . 1 1 53 53 GLU HA H 53 4.065 4.065 4.032 0.033 19163 1775 1 5 . 1 1 53 53 GLU C C 53 179.052 179.052 178.878 0.174 19163 1776 1 5 . 1 1 53 53 GLU CA C 53 59.280 59.280 59.153 0.127 19163 1777 1 5 . 1 1 53 53 GLU CB C 53 28.968 28.968 29.318 -0.350 19163 1778 1 5 . 1 1 53 53 GLU H H 53 8.496 8.496 8.324 0.172 19163 1779 1 5 . 1 1 54 54 LYS N N 54 120.837 120.837 118.984 1.853 19163 1780 1 5 . 1 1 54 54 LYS HA H 54 3.923 3.923 4.107 -0.184 19163 1781 1 5 . 1 1 54 54 LYS C C 54 179.058 179.058 178.827 0.231 19163 1782 1 5 . 1 1 54 54 LYS CA C 54 58.800 58.800 58.693 0.107 19163 1783 1 5 . 1 1 54 54 LYS CB C 54 31.551 31.551 32.412 -0.861 19163 1784 1 5 . 1 1 54 54 LYS H H 54 7.857 7.857 7.667 0.190 19163 1785 1 5 . 1 1 55 55 PHE N N 55 118.608 118.608 120.708 -2.100 19163 1786 1 5 . 1 1 55 55 PHE HA H 55 4.021 4.021 4.172 -0.151 19163 1787 1 5 . 1 1 55 55 PHE C C 55 178.001 178.001 176.912 1.089 19163 1788 1 5 . 1 1 55 55 PHE CA C 55 61.911 61.911 60.713 1.198 19163 1789 1 5 . 1 1 55 55 PHE CB C 55 38.553 38.553 38.931 -0.378 19163 1790 1 5 . 1 1 55 55 PHE H H 55 8.382 8.382 7.673 0.709 19163 1791 1 5 . 1 1 56 56 LYS N N 56 120.898 120.898 119.264 1.634 19163 1792 1 5 . 1 1 56 56 LYS HA H 56 3.828 3.828 3.886 -0.058 19163 1793 1 5 . 1 1 56 56 LYS C C 56 178.817 178.817 178.780 0.037 19163 1794 1 5 . 1 1 56 56 LYS CA C 56 59.877 59.877 60.300 -0.423 19163 1795 1 5 . 1 1 56 56 LYS CB C 56 32.133 32.133 31.897 0.236 19163 1796 1 5 . 1 1 56 56 LYS H H 56 8.111 8.111 7.756 0.355 19163 1797 1 5 . 1 1 57 57 GLN N N 57 118.600 118.600 118.307 0.293 19163 1798 1 5 . 1 1 57 57 GLN HA H 57 4.009 4.009 4.084 -0.075 19163 1799 1 5 . 1 1 57 57 GLN C C 57 179.333 179.333 178.566 0.767 19163 1800 1 5 . 1 1 57 57 GLN CA C 57 59.109 59.109 58.769 0.340 19163 1801 1 5 . 1 1 57 57 GLN CB C 57 28.595 28.595 28.756 -0.161 19163 1802 1 5 . 1 1 57 57 GLN H H 57 7.613 7.613 7.585 0.029 19163 1803 1 5 . 1 1 58 58 ILE N N 58 118.709 118.709 120.601 -1.892 19163 1804 1 5 . 1 1 58 58 ILE HA H 58 3.559 3.559 3.573 -0.014 19163 1805 1 5 . 1 1 58 58 ILE C C 58 177.152 177.152 178.088 -0.936 19163 1806 1 5 . 1 1 58 58 ILE CA C 58 65.068 65.068 65.312 -0.244 19163 1807 1 5 . 1 1 58 58 ILE CB C 58 38.381 38.381 37.537 0.844 19163 1808 1 5 . 1 1 58 58 ILE H H 58 8.011 8.011 7.422 0.589 19163 1809 1 5 . 1 1 59 59 SER N N 59 116.112 116.112 115.573 0.539 19163 1810 1 5 . 1 1 59 59 SER HA H 59 3.948 3.948 4.021 -0.073 19163 1811 1 5 . 1 1 59 59 SER C C 59 175.949 175.949 176.846 -0.897 19163 1812 1 5 . 1 1 59 59 SER CA C 59 62.315 62.315 62.262 0.053 19163 1813 1 5 . 1 1 59 59 SER H H 59 8.030 8.030 8.184 -0.154 19163 1814 1 5 . 1 1 60 60 GLN N N 60 122.099 122.099 121.150 0.949 19163 1815 1 5 . 1 1 60 60 GLN HA H 60 3.801 3.801 3.950 -0.149 19163 1816 1 5 . 1 1 60 60 GLN C C 60 176.942 176.942 178.214 -1.272 19163 1817 1 5 . 1 1 60 60 GLN CA C 60 58.762 58.762 58.816 -0.054 19163 1818 1 5 . 1 1 60 60 GLN CB C 60 28.498 28.498 28.729 -0.231 19163 1819 1 5 . 1 1 60 60 GLN H H 60 7.933 7.933 7.582 0.351 19163 1820 1 5 . 1 1 61 61 ALA N N 61 119.367 119.367 122.442 -3.075 19163 1821 1 5 . 1 1 61 61 ALA HA H 61 2.636 2.636 3.903 -1.267 19163 1822 1 5 . 1 1 61 61 ALA C C 61 178.507 178.507 179.413 -0.906 19163 1823 1 5 . 1 1 61 61 ALA CA C 61 54.126 54.126 54.934 -0.809 19163 1824 1 5 . 1 1 61 61 ALA CB C 61 18.462 18.462 18.395 0.067 19163 1825 1 5 . 1 1 61 61 ALA H H 61 7.354 7.354 7.968 -0.614 19163 1826 1 5 . 1 1 62 62 TYR N N 62 115.613 115.613 119.949 -4.336 19163 1827 1 5 . 1 1 62 62 TYR HA H 62 3.633 3.633 3.981 -0.348 19163 1828 1 5 . 1 1 62 62 TYR C C 62 177.421 177.421 177.306 0.115 19163 1829 1 5 . 1 1 62 62 TYR CA C 62 61.676 61.676 60.604 1.072 19163 1830 1 5 . 1 1 62 62 TYR CB C 62 39.162 39.162 38.242 0.920 19163 1831 1 5 . 1 1 62 62 TYR H H 62 7.994 7.994 8.662 -0.668 19163 1832 1 5 . 1 1 63 63 GLU N N 63 121.396 121.396 119.438 1.958 19163 1833 1 5 . 1 1 63 63 GLU HA H 63 3.347 3.347 3.689 -0.342 19163 1834 1 5 . 1 1 63 63 GLU C C 63 177.687 177.687 179.076 -1.389 19163 1835 1 5 . 1 1 63 63 GLU CA C 63 59.562 59.562 59.561 0.001 19163 1836 1 5 . 1 1 63 63 GLU CB C 63 29.115 29.115 29.232 -0.117 19163 1837 1 5 . 1 1 63 63 GLU H H 63 8.151 8.151 7.937 0.214 19163 1838 1 5 . 1 1 64 64 VAL N N 64 115.850 115.850 119.516 -3.666 19163 1839 1 5 . 1 1 64 64 VAL HA H 64 3.377 3.377 3.716 -0.339 19163 1840 1 5 . 1 1 64 64 VAL C C 64 175.925 175.925 177.565 -1.640 19163 1841 1 5 . 1 1 64 64 VAL CA C 64 65.806 65.806 65.225 0.581 19163 1842 1 5 . 1 1 64 64 VAL CB C 64 31.786 31.786 31.337 0.449 19163 1843 1 5 . 1 1 64 64 VAL H H 64 6.814 6.814 7.260 -0.446 19163 1844 1 5 . 1 1 65 65 LEU N N 65 111.438 111.438 121.245 -9.807 19163 1845 1 5 . 1 1 65 65 LEU HA H 65 3.569 3.569 3.948 -0.379 19163 1846 1 5 . 1 1 65 65 LEU C C 65 177.124 177.124 178.380 -1.256 19163 1847 1 5 . 1 1 65 65 LEU CA C 65 56.645 56.645 56.966 -0.321 19163 1848 1 5 . 1 1 65 65 LEU CB C 65 42.589 42.589 40.622 1.967 19163 1849 1 5 . 1 1 65 65 LEU H H 65 7.398 7.398 8.359 -0.961 19163 1850 1 5 . 1 1 66 66 SER N N 66 108.642 108.642 111.150 -2.508 19163 1851 1 5 . 1 1 66 66 SER HA H 66 4.028 4.028 3.962 0.066 19163 1852 1 5 . 1 1 66 66 SER C C 66 173.286 173.286 173.812 -0.526 19163 1853 1 5 . 1 1 66 66 SER CA C 66 59.232 59.232 59.437 -0.205 19163 1854 1 5 . 1 1 66 66 SER CB C 66 63.066 63.066 62.980 0.086 19163 1855 1 5 . 1 1 66 66 SER H H 66 7.700 7.700 7.638 0.062 19163 1856 1 5 . 1 1 67 67 ASP N N 67 124.276 124.276 119.791 4.485 19163 1857 1 5 . 1 1 67 67 ASP HA H 67 4.668 4.668 4.682 -0.014 19163 1858 1 5 . 1 1 67 67 ASP C C 67 174.913 174.913 175.513 -0.600 19163 1859 1 5 . 1 1 67 67 ASP CA C 67 52.487 52.487 53.317 -0.830 19163 1860 1 5 . 1 1 67 67 ASP CB C 67 43.218 43.218 42.675 0.543 19163 1861 1 5 . 1 1 67 67 ASP H H 67 6.879 6.879 7.365 -0.486 19163 1862 1 5 . 1 1 68 68 ALA N N 68 127.326 127.326 130.320 -2.994 19163 1863 1 5 . 1 1 68 68 ALA HA H 68 3.853 3.853 3.911 -0.058 19163 1864 1 5 . 1 1 68 68 ALA C C 68 180.336 180.336 178.851 1.485 19163 1865 1 5 . 1 1 68 68 ALA CA C 68 55.912 55.912 55.526 0.386 19163 1866 1 5 . 1 1 68 68 ALA CB C 68 18.645 18.645 18.724 -0.078 19163 1867 1 5 . 1 1 68 68 ALA H H 68 8.693 8.693 8.660 0.033 19163 1868 1 5 . 1 1 69 69 LYS N N 69 116.929 116.929 117.744 -0.815 19163 1869 1 5 . 1 1 69 69 LYS HA H 69 4.162 4.162 4.058 0.104 19163 1870 1 5 . 1 1 69 69 LYS C C 69 179.515 179.515 178.783 0.732 19163 1871 1 5 . 1 1 69 69 LYS CA C 69 58.562 58.562 59.463 -0.901 19163 1872 1 5 . 1 1 69 69 LYS CB C 69 31.840 31.840 32.158 -0.319 19163 1873 1 5 . 1 1 69 69 LYS H H 69 7.950 7.950 8.396 -0.446 19163 1874 1 5 . 1 1 70 70 LYS N N 70 121.286 121.286 119.143 2.143 19163 1875 1 5 . 1 1 70 70 LYS HA H 70 3.960 3.960 3.945 0.015 19163 1876 1 5 . 1 1 70 70 LYS C C 70 179.938 179.938 178.911 1.027 19163 1877 1 5 . 1 1 70 70 LYS CA C 70 60.066 60.066 59.507 0.559 19163 1878 1 5 . 1 1 70 70 LYS CB C 70 32.695 32.695 32.278 0.417 19163 1879 1 5 . 1 1 70 70 LYS H H 70 8.184 8.184 7.934 0.251 19163 1880 1 5 . 1 1 71 71 ARG N N 71 122.794 122.794 119.861 2.933 19163 1881 1 5 . 1 1 71 71 ARG HA H 71 3.668 3.668 3.908 -0.240 19163 1882 1 5 . 1 1 71 71 ARG C C 71 177.356 177.356 178.105 -0.749 19163 1883 1 5 . 1 1 71 71 ARG CA C 71 60.127 60.127 60.206 -0.079 19163 1884 1 5 . 1 1 71 71 ARG CB C 71 29.668 29.668 30.147 -0.479 19163 1885 1 5 . 1 1 71 71 ARG H H 71 9.290 9.290 8.490 0.800 19163 1886 1 5 . 1 1 72 72 GLU N N 72 118.390 118.390 119.645 -1.255 19163 1887 1 5 . 1 1 72 72 GLU HA H 72 4.096 4.096 4.104 -0.008 19163 1888 1 5 . 1 1 72 72 GLU C C 72 179.073 179.073 179.032 0.041 19163 1889 1 5 . 1 1 72 72 GLU CA C 72 59.456 59.456 59.435 0.021 19163 1890 1 5 . 1 1 72 72 GLU CB C 72 29.615 29.615 29.587 0.028 19163 1891 1 5 . 1 1 72 72 GLU H H 72 7.607 7.607 7.693 -0.086 19163 1892 1 5 . 1 1 73 73 LEU N N 73 117.921 117.921 119.582 -1.661 19163 1893 1 5 . 1 1 73 73 LEU HA H 73 4.032 4.032 4.008 0.024 19163 1894 1 5 . 1 1 73 73 LEU C C 73 179.696 179.696 179.399 0.297 19163 1895 1 5 . 1 1 73 73 LEU CA C 73 57.597 57.597 57.697 -0.100 19163 1896 1 5 . 1 1 73 73 LEU CB C 73 41.815 41.815 41.879 -0.064 19163 1897 1 5 . 1 1 73 73 LEU H H 73 7.398 7.398 7.597 -0.199 19163 1898 1 5 . 1 1 74 74 TYR N N 74 122.662 122.662 119.528 3.134 19163 1899 1 5 . 1 1 74 74 TYR HA H 74 4.092 4.092 4.009 0.083 19163 1900 1 5 . 1 1 74 74 TYR C C 74 178.166 178.166 177.654 0.512 19163 1901 1 5 . 1 1 74 74 TYR CA C 74 61.458 61.458 60.820 0.638 19163 1902 1 5 . 1 1 74 74 TYR CB C 74 38.778 38.778 38.360 0.418 19163 1903 1 5 . 1 1 74 74 TYR H H 74 8.316 8.316 8.499 -0.183 19163 1904 1 5 . 1 1 75 75 ASP N N 75 118.842 118.842 118.070 0.772 19163 1905 1 5 . 1 1 75 75 ASP HA H 75 4.423 4.423 4.390 0.033 19163 1906 1 5 . 1 1 75 75 ASP C C 75 177.726 177.726 178.065 -0.339 19163 1907 1 5 . 1 1 75 75 ASP CA C 75 56.177 56.177 56.779 -0.602 19163 1908 1 5 . 1 1 75 75 ASP CB C 75 40.800 40.800 40.907 -0.107 19163 1909 1 5 . 1 1 75 75 ASP H H 75 8.770 8.770 8.396 0.374 19163 1910 1 5 . 1 1 76 76 LYS N N 76 118.955 118.955 116.821 2.134 19163 1911 1 5 . 1 1 76 76 LYS HA H 76 4.130 4.130 4.362 -0.232 19163 1912 1 5 . 1 1 76 76 LYS C C 76 177.006 177.006 176.517 0.489 19163 1913 1 5 . 1 1 76 76 LYS CA C 76 57.537 57.537 55.886 1.651 19163 1914 1 5 . 1 1 76 76 LYS CB C 76 33.136 33.136 32.973 0.163 19163 1915 1 5 . 1 1 76 76 LYS H H 76 7.610 7.610 7.648 -0.038 19163 1916 1 6 . 1 1 11 11 MET HA H 11 4.346 4.346 4.413 -0.067 19163 1917 1 6 . 1 1 11 11 MET C C 11 175.801 175.801 175.656 0.145 19163 1918 1 6 . 1 1 11 11 MET CA C 11 55.614 55.614 54.722 0.891 19163 1919 1 6 . 1 1 11 11 MET CB C 11 32.925 32.925 33.816 -0.892 19163 1920 1 6 . 1 1 12 12 VAL N N 12 121.226 121.226 124.339 -3.113 19163 1921 1 6 . 1 1 12 12 VAL HA H 12 4.026 4.026 3.982 0.044 19163 1922 1 6 . 1 1 12 12 VAL C C 12 175.701 175.701 175.304 0.397 19163 1923 1 6 . 1 1 12 12 VAL CA C 12 62.188 62.188 61.964 0.224 19163 1924 1 6 . 1 1 12 12 VAL CB C 12 32.882 32.882 31.826 1.056 19163 1925 1 6 . 1 1 12 12 VAL H H 12 7.988 7.988 8.394 -0.406 19163 1926 1 6 . 1 1 13 13 LYS N N 13 125.255 125.255 128.462 -3.207 19163 1927 1 6 . 1 1 13 13 LYS HA H 13 4.211 4.211 4.422 -0.211 19163 1928 1 6 . 1 1 13 13 LYS C C 13 176.121 176.121 175.088 1.033 19163 1929 1 6 . 1 1 13 13 LYS CA C 13 56.355 56.355 55.421 0.934 19163 1930 1 6 . 1 1 13 13 LYS CB C 13 33.019 33.019 32.307 0.712 19163 1931 1 6 . 1 1 13 13 LYS H H 13 8.281 8.281 8.484 -0.203 19163 1932 1 6 . 1 1 14 14 GLU N N 14 123.004 123.004 122.648 0.356 19163 1933 1 6 . 1 1 14 14 GLU HA H 14 4.305 4.305 4.024 0.281 19163 1934 1 6 . 1 1 14 14 GLU C C 14 176.107 176.107 175.497 0.610 19163 1935 1 6 . 1 1 14 14 GLU CA C 14 56.343 56.343 56.364 -0.021 19163 1936 1 6 . 1 1 14 14 GLU CB C 14 30.534 30.534 29.706 0.828 19163 1937 1 6 . 1 1 14 14 GLU H H 14 8.424 8.424 8.708 -0.284 19163 1938 1 6 . 1 1 15 15 THR N N 15 115.895 115.895 116.827 -0.932 19163 1939 1 6 . 1 1 15 15 THR HA H 15 4.538 4.538 4.512 0.026 19163 1940 1 6 . 1 1 15 15 THR C C 15 175.233 175.233 174.440 0.793 19163 1941 1 6 . 1 1 15 15 THR CA C 15 61.981 61.981 62.799 -0.818 19163 1942 1 6 . 1 1 15 15 THR CB C 15 69.865 69.865 68.321 1.544 19163 1943 1 6 . 1 1 15 15 THR H H 15 8.335 8.335 8.376 -0.041 19163 1944 1 6 . 1 1 16 16 THR N N 16 116.992 116.992 119.469 -2.477 19163 1945 1 6 . 1 1 16 16 THR HA H 16 4.366 4.366 4.385 -0.019 19163 1946 1 6 . 1 1 16 16 THR C C 16 176.090 176.090 175.431 0.659 19163 1947 1 6 . 1 1 16 16 THR CA C 16 62.172 62.172 59.664 2.507 19163 1948 1 6 . 1 1 16 16 THR CB C 16 71.997 71.997 70.609 1.388 19163 1949 1 6 . 1 1 16 16 THR H H 16 8.798 8.798 7.808 0.990 19163 1950 1 6 . 1 1 17 17 TYR N N 17 117.617 117.617 120.540 -2.923 19163 1951 1 6 . 1 1 17 17 TYR HA H 17 4.329 4.329 4.294 0.035 19163 1952 1 6 . 1 1 17 17 TYR C C 17 177.105 177.105 178.035 -0.930 19163 1953 1 6 . 1 1 17 17 TYR CA C 17 57.577 57.577 61.580 -4.003 19163 1954 1 6 . 1 1 17 17 TYR CB C 17 37.113 37.113 38.008 -0.895 19163 1955 1 6 . 1 1 17 17 TYR H H 17 8.292 8.292 9.049 -0.757 19163 1956 1 6 . 1 1 18 18 TYR N N 18 115.048 115.048 118.074 -3.026 19163 1957 1 6 . 1 1 18 18 TYR HA H 18 3.775 3.775 4.231 -0.456 19163 1958 1 6 . 1 1 18 18 TYR C C 18 177.771 177.771 177.875 -0.104 19163 1959 1 6 . 1 1 18 18 TYR CA C 18 61.430 61.430 62.728 -1.298 19163 1960 1 6 . 1 1 18 18 TYR CB C 18 36.495 36.495 37.677 -1.182 19163 1961 1 6 . 1 1 18 18 TYR H H 18 7.047 7.047 7.998 -0.951 19163 1962 1 6 . 1 1 19 19 ASP N N 19 119.520 119.520 119.256 0.264 19163 1963 1 6 . 1 1 19 19 ASP HA H 19 4.406 4.406 4.434 -0.028 19163 1964 1 6 . 1 1 19 19 ASP C C 19 180.128 180.128 178.519 1.609 19163 1965 1 6 . 1 1 19 19 ASP CA C 19 57.475 57.475 57.458 0.017 19163 1966 1 6 . 1 1 19 19 ASP CB C 19 40.659 40.659 40.722 -0.063 19163 1967 1 6 . 1 1 19 19 ASP H H 19 7.685 7.685 8.209 -0.524 19163 1968 1 6 . 1 1 20 20 VAL N N 20 119.772 119.772 119.268 0.504 19163 1969 1 6 . 1 1 20 20 VAL HA H 20 3.608 3.608 3.771 -0.163 19163 1970 1 6 . 1 1 20 20 VAL C C 20 177.026 177.026 177.732 -0.706 19163 1971 1 6 . 1 1 20 20 VAL CA C 20 65.840 65.840 66.384 -0.544 19163 1972 1 6 . 1 1 20 20 VAL CB C 20 31.530 31.530 32.087 -0.557 19163 1973 1 6 . 1 1 20 20 VAL H H 20 8.004 8.004 8.366 -0.362 19163 1974 1 6 . 1 1 21 21 LEU N N 21 115.252 115.252 117.687 -2.435 19163 1975 1 6 . 1 1 21 21 LEU HA H 21 4.281 4.281 4.312 -0.031 19163 1976 1 6 . 1 1 21 21 LEU C C 21 175.757 175.757 176.862 -1.105 19163 1977 1 6 . 1 1 21 21 LEU CA C 21 54.554 54.554 54.564 -0.010 19163 1978 1 6 . 1 1 21 21 LEU CB C 21 42.869 42.869 41.959 0.910 19163 1979 1 6 . 1 1 21 21 LEU H H 21 6.847 6.847 7.969 -1.122 19163 1980 1 6 . 1 1 22 22 GLY N N 22 108.227 108.227 107.005 1.222 19163 1981 1 6 . 1 1 22 22 GLY C C 22 175.361 175.361 174.074 1.287 19163 1982 1 6 . 1 1 22 22 GLY CA C 22 46.574 46.574 45.717 0.857 19163 1983 1 6 . 1 1 22 22 GLY H H 22 7.874 7.874 7.271 0.603 19163 1984 1 6 . 1 1 23 23 VAL N N 23 110.675 110.675 118.834 -8.159 19163 1985 1 6 . 1 1 23 23 VAL HA H 23 4.767 4.767 4.477 0.290 19163 1986 1 6 . 1 1 23 23 VAL C C 23 174.674 174.674 174.652 0.022 19163 1987 1 6 . 1 1 23 23 VAL CA C 23 58.349 58.349 59.665 -1.316 19163 1988 1 6 . 1 1 23 23 VAL CB C 23 34.938 34.938 35.522 -0.584 19163 1989 1 6 . 1 1 23 23 VAL H H 23 7.815 7.815 7.963 -0.148 19163 1990 1 6 . 1 1 24 24 LYS N N 24 119.948 119.948 123.199 -3.251 19163 1991 1 6 . 1 1 24 24 LYS HA H 24 4.488 4.488 4.702 -0.214 19163 1992 1 6 . 1 1 24 24 LYS C C 24 175.442 175.442 175.873 -0.431 19163 1993 1 6 . 1 1 24 24 LYS CA C 24 54.001 54.001 53.562 0.439 19163 1994 1 6 . 1 1 24 24 LYS CB C 24 32.197 32.197 31.725 0.472 19163 1995 1 6 . 1 1 24 24 LYS H H 24 8.329 8.329 8.333 -0.004 19163 1996 1 6 . 1 1 25 25 PRO HA H 25 2.421 2.421 4.433 -2.012 19163 1997 1 6 . 1 1 25 25 PRO C C 25 175.635 175.635 176.544 -0.909 19163 1998 1 6 . 1 1 25 25 PRO CA C 25 63.362 63.362 64.711 -1.349 19163 1999 1 6 . 1 1 25 25 PRO CB C 25 31.839 31.839 32.023 -0.184 19163 2000 1 6 . 1 1 26 26 ASN N N 26 111.739 111.739 114.454 -2.715 19163 2001 1 6 . 1 1 26 26 ASN HA H 26 4.518 4.518 4.839 -0.321 19163 2002 1 6 . 1 1 26 26 ASN C C 26 175.820 175.820 174.692 1.128 19163 2003 1 6 . 1 1 26 26 ASN CA C 26 51.525 51.525 52.030 -0.505 19163 2004 1 6 . 1 1 26 26 ASN CB C 26 36.829 36.829 38.150 -1.321 19163 2005 1 6 . 1 1 26 26 ASN H H 26 7.138 7.138 8.242 -1.104 19163 2006 1 6 . 1 1 27 27 ALA N N 27 122.829 122.829 124.048 -1.219 19163 2007 1 6 . 1 1 27 27 ALA HA H 27 4.325 4.325 4.939 -0.614 19163 2008 1 6 . 1 1 27 27 ALA C C 27 178.726 178.726 177.246 1.480 19163 2009 1 6 . 1 1 27 27 ALA CA C 27 52.961 52.961 51.982 0.979 19163 2010 1 6 . 1 1 27 27 ALA CB C 27 19.159 19.159 20.350 -1.191 19163 2011 1 6 . 1 1 27 27 ALA H H 27 7.637 7.637 7.578 0.059 19163 2012 1 6 . 1 1 28 28 THR N N 28 113.468 113.468 113.245 0.223 19163 2013 1 6 . 1 1 28 28 THR HA H 28 4.493 4.493 4.450 0.043 19163 2014 1 6 . 1 1 28 28 THR C C 28 175.641 175.641 175.487 0.154 19163 2015 1 6 . 1 1 28 28 THR CA C 28 60.592 60.592 60.172 0.420 19163 2016 1 6 . 1 1 28 28 THR CB C 28 71.304 71.304 70.349 0.955 19163 2017 1 6 . 1 1 28 28 THR H H 28 8.829 8.829 8.120 0.709 19163 2018 1 6 . 1 1 29 29 GLN N N 29 119.445 119.445 121.779 -2.334 19163 2019 1 6 . 1 1 29 29 GLN HA H 29 4.035 4.035 3.934 0.101 19163 2020 1 6 . 1 1 29 29 GLN C C 29 179.117 179.117 178.458 0.659 19163 2021 1 6 . 1 1 29 29 GLN CA C 29 59.435 59.435 60.048 -0.613 19163 2022 1 6 . 1 1 29 29 GLN CB C 29 27.851 27.851 28.238 -0.387 19163 2023 1 6 . 1 1 29 29 GLN H H 29 9.015 9.015 8.830 0.185 19163 2024 1 6 . 1 1 30 30 GLU N N 30 119.343 119.343 118.360 0.983 19163 2025 1 6 . 1 1 30 30 GLU HA H 30 4.059 4.059 4.080 -0.021 19163 2026 1 6 . 1 1 30 30 GLU C C 30 179.097 179.097 178.570 0.527 19163 2027 1 6 . 1 1 30 30 GLU CA C 30 59.847 59.847 59.496 0.351 19163 2028 1 6 . 1 1 30 30 GLU CB C 30 29.356 29.356 29.165 0.191 19163 2029 1 6 . 1 1 30 30 GLU H H 30 8.549 8.549 8.644 -0.095 19163 2030 1 6 . 1 1 31 31 GLU N N 31 120.562 120.562 120.627 -0.065 19163 2031 1 6 . 1 1 31 31 GLU HA H 31 3.906 3.906 4.079 -0.173 19163 2032 1 6 . 1 1 31 31 GLU C C 31 180.405 180.405 179.207 1.198 19163 2033 1 6 . 1 1 31 31 GLU CA C 31 59.592 59.592 59.395 0.197 19163 2034 1 6 . 1 1 31 31 GLU CB C 31 29.989 29.989 29.572 0.417 19163 2035 1 6 . 1 1 31 31 GLU H H 31 7.768 7.768 8.062 -0.294 19163 2036 1 6 . 1 1 32 32 LEU N N 32 120.518 120.518 120.086 0.432 19163 2037 1 6 . 1 1 32 32 LEU HA H 32 3.963 3.963 3.986 -0.023 19163 2038 1 6 . 1 1 32 32 LEU C C 32 177.873 177.873 179.192 -1.319 19163 2039 1 6 . 1 1 32 32 LEU CA C 32 58.593 58.593 57.976 0.617 19163 2040 1 6 . 1 1 32 32 LEU CB C 32 42.556 42.556 41.295 1.261 19163 2041 1 6 . 1 1 32 32 LEU H H 32 8.475 8.475 8.536 -0.061 19163 2042 1 6 . 1 1 33 33 LYS N N 33 119.091 119.091 118.774 0.317 19163 2043 1 6 . 1 1 33 33 LYS HA H 33 4.000 4.000 4.229 -0.229 19163 2044 1 6 . 1 1 33 33 LYS C C 33 178.701 178.701 179.048 -0.347 19163 2045 1 6 . 1 1 33 33 LYS CA C 33 60.274 60.274 60.061 0.213 19163 2046 1 6 . 1 1 33 33 LYS CB C 33 32.656 32.656 32.241 0.415 19163 2047 1 6 . 1 1 33 33 LYS H H 33 8.077 8.077 7.713 0.364 19163 2048 1 6 . 1 1 34 34 LYS N N 34 118.527 118.527 119.995 -1.468 19163 2049 1 6 . 1 1 34 34 LYS HA H 34 3.890 3.890 4.050 -0.160 19163 2050 1 6 . 1 1 34 34 LYS C C 34 179.172 179.172 178.714 0.458 19163 2051 1 6 . 1 1 34 34 LYS CA C 34 59.927 59.927 59.334 0.593 19163 2052 1 6 . 1 1 34 34 LYS CB C 34 32.869 32.869 32.488 0.381 19163 2053 1 6 . 1 1 34 34 LYS H H 34 7.986 7.986 8.329 -0.343 19163 2054 1 6 . 1 1 35 35 ALA N N 35 122.190 122.190 122.123 0.067 19163 2055 1 6 . 1 1 35 35 ALA HA H 35 4.116 4.116 4.032 0.084 19163 2056 1 6 . 1 1 35 35 ALA C C 35 179.982 179.982 178.902 1.080 19163 2057 1 6 . 1 1 35 35 ALA CA C 35 55.157 55.157 55.306 -0.149 19163 2058 1 6 . 1 1 35 35 ALA CB C 35 18.773 18.773 18.187 0.586 19163 2059 1 6 . 1 1 35 35 ALA H H 35 7.917 7.917 8.145 -0.228 19163 2060 1 6 . 1 1 36 36 TYR N N 36 117.701 117.701 120.431 -2.730 19163 2061 1 6 . 1 1 36 36 TYR HA H 36 3.818 3.818 3.999 -0.181 19163 2062 1 6 . 1 1 36 36 TYR C C 36 176.344 176.344 177.467 -1.123 19163 2063 1 6 . 1 1 36 36 TYR CA C 36 61.468 61.468 61.323 0.145 19163 2064 1 6 . 1 1 36 36 TYR CB C 36 38.890 38.890 38.169 0.721 19163 2065 1 6 . 1 1 36 36 TYR H H 36 8.402 8.402 7.768 0.634 19163 2066 1 6 . 1 1 37 37 ARG N N 37 117.423 117.423 118.939 -1.516 19163 2067 1 6 . 1 1 37 37 ARG HA H 37 3.481 3.481 3.644 -0.163 19163 2068 1 6 . 1 1 37 37 ARG C C 37 178.825 178.825 178.223 0.602 19163 2069 1 6 . 1 1 37 37 ARG CA C 37 59.397 59.397 59.568 -0.171 19163 2070 1 6 . 1 1 37 37 ARG CB C 37 29.710 29.710 30.059 -0.349 19163 2071 1 6 . 1 1 37 37 ARG H H 37 8.264 8.264 8.110 0.154 19163 2072 1 6 . 1 1 38 38 LYS N N 38 117.247 117.247 120.139 -2.892 19163 2073 1 6 . 1 1 38 38 LYS HA H 38 3.905 3.905 4.019 -0.114 19163 2074 1 6 . 1 1 38 38 LYS C C 38 179.444 179.444 179.124 0.320 19163 2075 1 6 . 1 1 38 38 LYS CA C 38 59.450 59.450 59.596 -0.146 19163 2076 1 6 . 1 1 38 38 LYS CB C 38 32.609 32.609 32.349 0.260 19163 2077 1 6 . 1 1 38 38 LYS H H 38 7.444 7.444 8.027 -0.583 19163 2078 1 6 . 1 1 39 39 LEU N N 39 119.901 119.901 119.151 0.750 19163 2079 1 6 . 1 1 39 39 LEU HA H 39 4.020 4.020 4.147 -0.127 19163 2080 1 6 . 1 1 39 39 LEU C C 39 178.801 178.801 178.841 -0.040 19163 2081 1 6 . 1 1 39 39 LEU CA C 39 57.409 57.409 57.648 -0.239 19163 2082 1 6 . 1 1 39 39 LEU CB C 39 42.388 42.388 41.688 0.700 19163 2083 1 6 . 1 1 39 39 LEU H H 39 7.707 7.707 8.284 -0.577 19163 2084 1 6 . 1 1 40 40 ALA N N 40 122.772 122.772 122.327 0.445 19163 2085 1 6 . 1 1 40 40 ALA HA H 40 3.849 3.849 4.035 -0.186 19163 2086 1 6 . 1 1 40 40 ALA C C 40 179.446 179.446 179.378 0.068 19163 2087 1 6 . 1 1 40 40 ALA CA C 40 55.109 55.109 55.149 -0.040 19163 2088 1 6 . 1 1 40 40 ALA CB C 40 17.116 17.116 17.947 -0.831 19163 2089 1 6 . 1 1 40 40 ALA H H 40 8.931 8.931 8.119 0.812 19163 2090 1 6 . 1 1 41 41 LEU N N 41 115.299 115.299 116.906 -1.607 19163 2091 1 6 . 1 1 41 41 LEU HA H 41 3.977 3.977 4.034 -0.057 19163 2092 1 6 . 1 1 41 41 LEU C C 41 178.216 178.216 179.645 -1.429 19163 2093 1 6 . 1 1 41 41 LEU CA C 41 57.088 57.088 57.205 -0.117 19163 2094 1 6 . 1 1 41 41 LEU CB C 41 42.162 42.162 41.730 0.432 19163 2095 1 6 . 1 1 41 41 LEU H H 41 7.133 7.133 7.816 -0.683 19163 2096 1 6 . 1 1 42 42 LYS N N 42 116.812 116.812 118.899 -2.087 19163 2097 1 6 . 1 1 42 42 LYS HA H 42 3.925 3.925 3.987 -0.062 19163 2098 1 6 . 1 1 42 42 LYS C C 42 177.560 177.560 177.760 -0.200 19163 2099 1 6 . 1 1 42 42 LYS CA C 42 57.885 57.885 58.361 -0.476 19163 2100 1 6 . 1 1 42 42 LYS CB C 42 33.427 33.427 32.628 0.799 19163 2101 1 6 . 1 1 42 42 LYS H H 42 7.038 7.038 7.416 -0.378 19163 2102 1 6 . 1 1 43 43 TYR N N 43 114.022 114.022 113.964 0.058 19163 2103 1 6 . 1 1 43 43 TYR HA H 43 4.665 4.665 4.638 0.027 19163 2104 1 6 . 1 1 43 43 TYR C C 43 173.741 173.741 174.434 -0.693 19163 2105 1 6 . 1 1 43 43 TYR CA C 43 56.928 56.928 56.541 0.387 19163 2106 1 6 . 1 1 43 43 TYR CB C 43 39.579 39.579 37.633 1.946 19163 2107 1 6 . 1 1 43 43 TYR H H 43 7.683 7.683 7.897 -0.214 19163 2108 1 6 . 1 1 44 44 HIS N N 44 120.947 120.947 122.885 -1.938 19163 2109 1 6 . 1 1 44 44 HIS HA H 44 3.697 3.697 4.375 -0.678 19163 2110 1 6 . 1 1 44 44 HIS C C 44 174.925 174.925 175.039 -0.114 19163 2111 1 6 . 1 1 44 44 HIS CA C 44 56.229 56.229 56.692 -0.463 19163 2112 1 6 . 1 1 44 44 HIS CB C 44 30.852 30.852 31.010 -0.158 19163 2113 1 6 . 1 1 44 44 HIS H H 44 7.814 7.814 7.752 0.062 19163 2114 1 6 . 1 1 45 45 PRO HA H 45 4.131 4.131 4.481 -0.350 19163 2115 1 6 . 1 1 45 45 PRO C C 45 177.269 177.269 177.527 -0.258 19163 2116 1 6 . 1 1 45 45 PRO CA C 45 64.723 64.723 64.986 -0.263 19163 2117 1 6 . 1 1 45 45 PRO CB C 45 32.070 32.070 31.836 0.234 19163 2118 1 6 . 1 1 46 46 ASP N N 46 119.127 119.127 117.449 1.678 19163 2119 1 6 . 1 1 46 46 ASP HA H 46 4.375 4.375 4.601 -0.226 19163 2120 1 6 . 1 1 46 46 ASP C C 46 177.284 177.284 177.127 0.157 19163 2121 1 6 . 1 1 46 46 ASP CA C 46 56.020 56.020 56.082 -0.062 19163 2122 1 6 . 1 1 46 46 ASP CB C 46 40.221 40.221 40.883 -0.662 19163 2123 1 6 . 1 1 46 46 ASP H H 46 10.040 10.040 8.048 1.992 19163 2124 1 6 . 1 1 47 47 LYS N N 47 117.416 117.416 118.699 -1.283 19163 2125 1 6 . 1 1 47 47 LYS HA H 47 4.315 4.315 4.316 -0.001 19163 2126 1 6 . 1 1 47 47 LYS C C 47 176.355 176.355 176.341 0.014 19163 2127 1 6 . 1 1 47 47 LYS CA C 47 55.880 55.880 57.268 -1.388 19163 2128 1 6 . 1 1 47 47 LYS CB C 47 33.778 33.778 34.542 -0.764 19163 2129 1 6 . 1 1 47 47 LYS H H 47 7.826 7.826 7.694 0.132 19163 2130 1 6 . 1 1 48 48 ASN N N 48 116.573 116.573 118.396 -1.823 19163 2131 1 6 . 1 1 48 48 ASN HA H 48 5.021 5.021 5.151 -0.130 19163 2132 1 6 . 1 1 48 48 ASN C C 48 172.992 172.992 173.726 -0.734 19163 2133 1 6 . 1 1 48 48 ASN CA C 48 50.467 50.467 50.930 -0.463 19163 2134 1 6 . 1 1 48 48 ASN CB C 48 39.284 39.284 39.748 -0.464 19163 2135 1 6 . 1 1 48 48 ASN H H 48 7.956 7.956 8.282 -0.326 19163 2136 1 6 . 1 1 49 49 PRO HA H 49 4.448 4.448 4.373 0.075 19163 2137 1 6 . 1 1 49 49 PRO C C 49 178.030 178.030 178.003 0.027 19163 2138 1 6 . 1 1 49 49 PRO CA C 49 64.468 64.468 64.880 -0.412 19163 2139 1 6 . 1 1 49 49 PRO CB C 49 32.173 32.173 32.015 0.158 19163 2140 1 6 . 1 1 50 50 ASN N N 50 115.567 115.567 117.128 -1.561 19163 2141 1 6 . 1 1 50 50 ASN HA H 50 4.748 4.748 4.539 0.209 19163 2142 1 6 . 1 1 50 50 ASN C C 50 176.443 176.443 176.467 -0.024 19163 2143 1 6 . 1 1 50 50 ASN CA C 50 54.677 54.677 55.355 -0.678 19163 2144 1 6 . 1 1 50 50 ASN CB C 50 39.014 39.014 37.779 1.235 19163 2145 1 6 . 1 1 50 50 ASN H H 50 8.398 8.398 8.633 -0.235 19163 2146 1 6 . 1 1 51 51 GLU N N 51 119.270 119.270 117.867 1.403 19163 2147 1 6 . 1 1 51 51 GLU HA H 51 4.797 4.797 4.484 0.313 19163 2148 1 6 . 1 1 51 51 GLU C C 51 176.922 176.922 177.255 -0.333 19163 2149 1 6 . 1 1 51 51 GLU CA C 51 55.916 55.916 55.884 0.032 19163 2150 1 6 . 1 1 51 51 GLU CB C 51 29.200 29.200 29.281 -0.081 19163 2151 1 6 . 1 1 51 51 GLU H H 51 7.485 7.485 7.830 -0.345 19163 2152 1 6 . 1 1 52 52 GLY N N 52 107.541 107.541 108.605 -1.064 19163 2153 1 6 . 1 1 52 52 GLY C C 52 176.755 176.755 175.655 1.100 19163 2154 1 6 . 1 1 52 52 GLY CA C 52 47.914 47.914 46.964 0.950 19163 2155 1 6 . 1 1 52 52 GLY H H 52 8.092 8.092 7.804 0.288 19163 2156 1 6 . 1 1 53 53 GLU N N 53 121.603 121.603 120.787 0.816 19163 2157 1 6 . 1 1 53 53 GLU HA H 53 4.065 4.065 4.037 0.028 19163 2158 1 6 . 1 1 53 53 GLU C C 53 179.052 179.052 179.033 0.019 19163 2159 1 6 . 1 1 53 53 GLU CA C 53 59.280 59.280 59.403 -0.123 19163 2160 1 6 . 1 1 53 53 GLU CB C 53 28.968 28.968 29.374 -0.406 19163 2161 1 6 . 1 1 53 53 GLU H H 53 8.496 8.496 8.129 0.367 19163 2162 1 6 . 1 1 54 54 LYS N N 54 120.837 120.837 119.319 1.518 19163 2163 1 6 . 1 1 54 54 LYS HA H 54 3.923 3.923 4.053 -0.130 19163 2164 1 6 . 1 1 54 54 LYS C C 54 179.058 179.058 178.849 0.209 19163 2165 1 6 . 1 1 54 54 LYS CA C 54 58.800 58.800 58.739 0.061 19163 2166 1 6 . 1 1 54 54 LYS CB C 54 31.551 31.551 32.189 -0.638 19163 2167 1 6 . 1 1 54 54 LYS H H 54 7.857 7.857 7.372 0.485 19163 2168 1 6 . 1 1 55 55 PHE N N 55 118.608 118.608 121.050 -2.442 19163 2169 1 6 . 1 1 55 55 PHE HA H 55 4.021 4.021 4.097 -0.076 19163 2170 1 6 . 1 1 55 55 PHE C C 55 178.001 178.001 176.782 1.219 19163 2171 1 6 . 1 1 55 55 PHE CA C 55 61.911 61.911 61.435 0.476 19163 2172 1 6 . 1 1 55 55 PHE CB C 55 38.553 38.553 39.109 -0.556 19163 2173 1 6 . 1 1 55 55 PHE H H 55 8.382 8.382 8.073 0.309 19163 2174 1 6 . 1 1 56 56 LYS N N 56 120.898 120.898 118.693 2.205 19163 2175 1 6 . 1 1 56 56 LYS HA H 56 3.828 3.828 3.873 -0.045 19163 2176 1 6 . 1 1 56 56 LYS C C 56 178.817 178.817 179.011 -0.194 19163 2177 1 6 . 1 1 56 56 LYS CA C 56 59.877 59.877 60.144 -0.267 19163 2178 1 6 . 1 1 56 56 LYS CB C 56 32.133 32.133 32.036 0.097 19163 2179 1 6 . 1 1 56 56 LYS H H 56 8.111 8.111 7.897 0.214 19163 2180 1 6 . 1 1 57 57 GLN N N 57 118.600 118.600 118.540 0.060 19163 2181 1 6 . 1 1 57 57 GLN HA H 57 4.009 4.009 4.081 -0.072 19163 2182 1 6 . 1 1 57 57 GLN C C 57 179.333 179.333 178.501 0.832 19163 2183 1 6 . 1 1 57 57 GLN CA C 57 59.109 59.109 58.781 0.328 19163 2184 1 6 . 1 1 57 57 GLN CB C 57 28.595 28.595 28.486 0.109 19163 2185 1 6 . 1 1 57 57 GLN H H 57 7.613 7.613 7.500 0.113 19163 2186 1 6 . 1 1 58 58 ILE N N 58 118.709 118.709 120.895 -2.186 19163 2187 1 6 . 1 1 58 58 ILE HA H 58 3.559 3.559 3.576 -0.017 19163 2188 1 6 . 1 1 58 58 ILE C C 58 177.152 177.152 177.952 -0.800 19163 2189 1 6 . 1 1 58 58 ILE CA C 58 65.068 65.068 65.573 -0.505 19163 2190 1 6 . 1 1 58 58 ILE CB C 58 38.381 38.381 37.620 0.761 19163 2191 1 6 . 1 1 58 58 ILE H H 58 8.011 8.011 7.565 0.446 19163 2192 1 6 . 1 1 59 59 SER N N 59 116.112 116.112 115.572 0.540 19163 2193 1 6 . 1 1 59 59 SER HA H 59 3.948 3.948 3.912 0.036 19163 2194 1 6 . 1 1 59 59 SER C C 59 175.949 175.949 177.044 -1.095 19163 2195 1 6 . 1 1 59 59 SER CA C 59 62.315 62.315 62.102 0.213 19163 2196 1 6 . 1 1 59 59 SER H H 59 8.030 8.030 8.253 -0.223 19163 2197 1 6 . 1 1 60 60 GLN N N 60 122.099 122.099 120.944 1.155 19163 2198 1 6 . 1 1 60 60 GLN HA H 60 3.801 3.801 3.919 -0.118 19163 2199 1 6 . 1 1 60 60 GLN C C 60 176.942 176.942 177.975 -1.033 19163 2200 1 6 . 1 1 60 60 GLN CA C 60 58.762 58.762 58.635 0.127 19163 2201 1 6 . 1 1 60 60 GLN CB C 60 28.498 28.498 28.529 -0.031 19163 2202 1 6 . 1 1 60 60 GLN H H 60 7.933 7.933 7.493 0.440 19163 2203 1 6 . 1 1 61 61 ALA N N 61 119.367 119.367 122.572 -3.205 19163 2204 1 6 . 1 1 61 61 ALA HA H 61 2.636 2.636 3.441 -0.805 19163 2205 1 6 . 1 1 61 61 ALA C C 61 178.507 178.507 178.863 -0.356 19163 2206 1 6 . 1 1 61 61 ALA CA C 61 54.126 54.126 55.012 -0.886 19163 2207 1 6 . 1 1 61 61 ALA CB C 61 18.462 18.462 18.463 -0.001 19163 2208 1 6 . 1 1 61 61 ALA H H 61 7.354 7.354 7.696 -0.342 19163 2209 1 6 . 1 1 62 62 TYR N N 62 115.613 115.613 119.569 -3.956 19163 2210 1 6 . 1 1 62 62 TYR HA H 62 3.633 3.633 3.900 -0.267 19163 2211 1 6 . 1 1 62 62 TYR C C 62 177.421 177.421 177.478 -0.057 19163 2212 1 6 . 1 1 62 62 TYR CA C 62 61.676 61.676 61.081 0.595 19163 2213 1 6 . 1 1 62 62 TYR CB C 62 39.162 39.162 37.978 1.184 19163 2214 1 6 . 1 1 62 62 TYR H H 62 7.994 7.994 8.464 -0.470 19163 2215 1 6 . 1 1 63 63 GLU N N 63 121.396 121.396 119.740 1.656 19163 2216 1 6 . 1 1 63 63 GLU HA H 63 3.347 3.347 3.665 -0.318 19163 2217 1 6 . 1 1 63 63 GLU C C 63 177.687 177.687 178.749 -1.062 19163 2218 1 6 . 1 1 63 63 GLU CA C 63 59.562 59.562 59.226 0.336 19163 2219 1 6 . 1 1 63 63 GLU CB C 63 29.115 29.115 28.893 0.222 19163 2220 1 6 . 1 1 63 63 GLU H H 63 8.151 8.151 8.027 0.124 19163 2221 1 6 . 1 1 64 64 VAL N N 64 115.850 115.850 118.992 -3.142 19163 2222 1 6 . 1 1 64 64 VAL HA H 64 3.377 3.377 3.790 -0.413 19163 2223 1 6 . 1 1 64 64 VAL C C 64 175.925 175.925 177.534 -1.609 19163 2224 1 6 . 1 1 64 64 VAL CA C 64 65.806 65.806 65.218 0.588 19163 2225 1 6 . 1 1 64 64 VAL CB C 64 31.786 31.786 31.413 0.373 19163 2226 1 6 . 1 1 64 64 VAL H H 64 6.814 6.814 7.179 -0.365 19163 2227 1 6 . 1 1 65 65 LEU N N 65 111.438 111.438 121.411 -9.973 19163 2228 1 6 . 1 1 65 65 LEU HA H 65 3.569 3.569 3.919 -0.350 19163 2229 1 6 . 1 1 65 65 LEU C C 65 177.124 177.124 178.320 -1.196 19163 2230 1 6 . 1 1 65 65 LEU CA C 65 56.645 56.645 57.259 -0.614 19163 2231 1 6 . 1 1 65 65 LEU CB C 65 42.589 42.589 40.782 1.808 19163 2232 1 6 . 1 1 65 65 LEU H H 65 7.398 7.398 8.329 -0.931 19163 2233 1 6 . 1 1 66 66 SER N N 66 108.642 108.642 112.149 -3.507 19163 2234 1 6 . 1 1 66 66 SER HA H 66 4.028 4.028 4.010 0.018 19163 2235 1 6 . 1 1 66 66 SER C C 66 173.286 173.286 173.233 0.053 19163 2236 1 6 . 1 1 66 66 SER CA C 66 59.232 59.232 59.580 -0.348 19163 2237 1 6 . 1 1 66 66 SER CB C 66 63.066 63.066 62.877 0.189 19163 2238 1 6 . 1 1 66 66 SER H H 66 7.700 7.700 7.571 0.129 19163 2239 1 6 . 1 1 67 67 ASP N N 67 124.276 124.276 120.315 3.961 19163 2240 1 6 . 1 1 67 67 ASP HA H 67 4.668 4.668 4.781 -0.113 19163 2241 1 6 . 1 1 67 67 ASP C C 67 174.913 174.913 175.518 -0.605 19163 2242 1 6 . 1 1 67 67 ASP CA C 67 52.487 52.487 53.523 -1.036 19163 2243 1 6 . 1 1 67 67 ASP CB C 67 43.218 43.218 43.243 -0.025 19163 2244 1 6 . 1 1 67 67 ASP H H 67 6.879 6.879 7.292 -0.413 19163 2245 1 6 . 1 1 68 68 ALA N N 68 127.326 127.326 127.953 -0.627 19163 2246 1 6 . 1 1 68 68 ALA HA H 68 3.853 3.853 3.866 -0.013 19163 2247 1 6 . 1 1 68 68 ALA C C 68 180.336 180.336 178.250 2.086 19163 2248 1 6 . 1 1 68 68 ALA CA C 68 55.912 55.912 55.755 0.157 19163 2249 1 6 . 1 1 68 68 ALA CB C 68 18.645 18.645 18.789 -0.144 19163 2250 1 6 . 1 1 68 68 ALA H H 68 8.693 8.693 8.300 0.393 19163 2251 1 6 . 1 1 69 69 LYS N N 69 116.929 116.929 118.459 -1.530 19163 2252 1 6 . 1 1 69 69 LYS HA H 69 4.162 4.162 4.023 0.139 19163 2253 1 6 . 1 1 69 69 LYS C C 69 179.515 179.515 178.438 1.077 19163 2254 1 6 . 1 1 69 69 LYS CA C 69 58.562 58.562 59.420 -0.858 19163 2255 1 6 . 1 1 69 69 LYS CB C 69 31.840 31.840 32.023 -0.183 19163 2256 1 6 . 1 1 69 69 LYS H H 69 7.950 7.950 8.374 -0.424 19163 2257 1 6 . 1 1 70 70 LYS N N 70 121.286 121.286 118.860 2.426 19163 2258 1 6 . 1 1 70 70 LYS HA H 70 3.960 3.960 3.965 -0.005 19163 2259 1 6 . 1 1 70 70 LYS C C 70 179.938 179.938 179.144 0.794 19163 2260 1 6 . 1 1 70 70 LYS CA C 70 60.066 60.066 59.474 0.592 19163 2261 1 6 . 1 1 70 70 LYS CB C 70 32.695 32.695 32.130 0.565 19163 2262 1 6 . 1 1 70 70 LYS H H 70 8.184 8.184 7.547 0.637 19163 2263 1 6 . 1 1 71 71 ARG N N 71 122.794 122.794 119.886 2.908 19163 2264 1 6 . 1 1 71 71 ARG HA H 71 3.668 3.668 3.951 -0.283 19163 2265 1 6 . 1 1 71 71 ARG C C 71 177.356 177.356 177.972 -0.616 19163 2266 1 6 . 1 1 71 71 ARG CA C 71 60.127 60.127 60.155 -0.028 19163 2267 1 6 . 1 1 71 71 ARG CB C 71 29.668 29.668 30.237 -0.569 19163 2268 1 6 . 1 1 71 71 ARG H H 71 9.290 9.290 8.421 0.869 19163 2269 1 6 . 1 1 72 72 GLU N N 72 118.390 118.390 119.924 -1.534 19163 2270 1 6 . 1 1 72 72 GLU HA H 72 4.096 4.096 4.146 -0.050 19163 2271 1 6 . 1 1 72 72 GLU C C 72 179.073 179.073 179.177 -0.104 19163 2272 1 6 . 1 1 72 72 GLU CA C 72 59.456 59.456 59.315 0.141 19163 2273 1 6 . 1 1 72 72 GLU CB C 72 29.615 29.615 29.428 0.187 19163 2274 1 6 . 1 1 72 72 GLU H H 72 7.607 7.607 7.840 -0.233 19163 2275 1 6 . 1 1 73 73 LEU N N 73 117.921 117.921 119.704 -1.783 19163 2276 1 6 . 1 1 73 73 LEU HA H 73 4.032 4.032 4.002 0.030 19163 2277 1 6 . 1 1 73 73 LEU C C 73 179.696 179.696 179.177 0.519 19163 2278 1 6 . 1 1 73 73 LEU CA C 73 57.597 57.597 57.659 -0.062 19163 2279 1 6 . 1 1 73 73 LEU CB C 73 41.815 41.815 41.671 0.144 19163 2280 1 6 . 1 1 73 73 LEU H H 73 7.398 7.398 7.879 -0.481 19163 2281 1 6 . 1 1 74 74 TYR N N 74 122.662 122.662 119.959 2.703 19163 2282 1 6 . 1 1 74 74 TYR HA H 74 4.092 4.092 4.100 -0.008 19163 2283 1 6 . 1 1 74 74 TYR C C 74 178.166 178.166 178.504 -0.338 19163 2284 1 6 . 1 1 74 74 TYR CA C 74 61.458 61.458 61.699 -0.241 19163 2285 1 6 . 1 1 74 74 TYR CB C 74 38.778 38.778 38.578 0.200 19163 2286 1 6 . 1 1 74 74 TYR H H 74 8.316 8.316 7.901 0.415 19163 2287 1 6 . 1 1 75 75 ASP N N 75 118.842 118.842 119.872 -1.030 19163 2288 1 6 . 1 1 75 75 ASP HA H 75 4.423 4.423 4.370 0.053 19163 2289 1 6 . 1 1 75 75 ASP C C 75 177.726 177.726 177.482 0.244 19163 2290 1 6 . 1 1 75 75 ASP CA C 75 56.177 56.177 57.090 -0.913 19163 2291 1 6 . 1 1 75 75 ASP CB C 75 40.800 40.800 40.650 0.150 19163 2292 1 6 . 1 1 75 75 ASP H H 75 8.770 8.770 8.692 0.078 19163 2293 1 6 . 1 1 76 76 LYS N N 76 118.955 118.955 118.589 0.366 19163 2294 1 6 . 1 1 76 76 LYS HA H 76 4.130 4.130 4.269 -0.139 19163 2295 1 6 . 1 1 76 76 LYS C C 76 177.006 177.006 176.966 0.040 19163 2296 1 6 . 1 1 76 76 LYS CA C 76 57.537 57.537 56.540 0.997 19163 2297 1 6 . 1 1 76 76 LYS CB C 76 33.136 33.136 33.359 -0.223 19163 2298 1 6 . 1 1 76 76 LYS H H 76 7.610 7.610 7.761 -0.151 19163 2299 1 7 . 1 1 11 11 MET HA H 11 4.346 4.346 4.505 -0.159 19163 2300 1 7 . 1 1 11 11 MET C C 11 175.801 175.801 175.859 -0.058 19163 2301 1 7 . 1 1 11 11 MET CA C 11 55.614 55.614 55.157 0.457 19163 2302 1 7 . 1 1 11 11 MET CB C 11 32.925 32.925 33.605 -0.680 19163 2303 1 7 . 1 1 12 12 VAL N N 12 121.226 121.226 123.882 -2.656 19163 2304 1 7 . 1 1 12 12 VAL HA H 12 4.026 4.026 4.078 -0.052 19163 2305 1 7 . 1 1 12 12 VAL C C 12 175.701 175.701 176.026 -0.325 19163 2306 1 7 . 1 1 12 12 VAL CA C 12 62.188 62.188 62.612 -0.424 19163 2307 1 7 . 1 1 12 12 VAL CB C 12 32.882 32.882 31.500 1.382 19163 2308 1 7 . 1 1 12 12 VAL H H 12 7.988 7.988 8.510 -0.522 19163 2309 1 7 . 1 1 13 13 LYS N N 13 125.255 125.255 128.494 -3.239 19163 2310 1 7 . 1 1 13 13 LYS HA H 13 4.211 4.211 4.487 -0.276 19163 2311 1 7 . 1 1 13 13 LYS C C 13 176.121 176.121 175.457 0.664 19163 2312 1 7 . 1 1 13 13 LYS CA C 13 56.355 56.355 55.696 0.659 19163 2313 1 7 . 1 1 13 13 LYS CB C 13 33.019 33.019 33.019 0.000 19163 2314 1 7 . 1 1 13 13 LYS H H 13 8.281 8.281 8.647 -0.366 19163 2315 1 7 . 1 1 14 14 GLU N N 14 123.004 123.004 121.518 1.486 19163 2316 1 7 . 1 1 14 14 GLU HA H 14 4.305 4.305 4.031 0.274 19163 2317 1 7 . 1 1 14 14 GLU C C 14 176.107 176.107 175.329 0.778 19163 2318 1 7 . 1 1 14 14 GLU CA C 14 56.343 56.343 56.502 -0.159 19163 2319 1 7 . 1 1 14 14 GLU CB C 14 30.534 30.534 29.397 1.137 19163 2320 1 7 . 1 1 14 14 GLU H H 14 8.424 8.424 8.727 -0.303 19163 2321 1 7 . 1 1 15 15 THR N N 15 115.895 115.895 115.197 0.698 19163 2322 1 7 . 1 1 15 15 THR HA H 15 4.538 4.538 4.378 0.160 19163 2323 1 7 . 1 1 15 15 THR C C 15 175.233 175.233 174.441 0.792 19163 2324 1 7 . 1 1 15 15 THR CA C 15 61.981 61.981 63.118 -1.137 19163 2325 1 7 . 1 1 15 15 THR CB C 15 69.865 69.865 69.108 0.757 19163 2326 1 7 . 1 1 15 15 THR H H 15 8.335 8.335 8.085 0.250 19163 2327 1 7 . 1 1 16 16 THR N N 16 116.992 116.992 120.873 -3.881 19163 2328 1 7 . 1 1 16 16 THR HA H 16 4.366 4.366 4.523 -0.157 19163 2329 1 7 . 1 1 16 16 THR C C 16 176.090 176.090 175.317 0.773 19163 2330 1 7 . 1 1 16 16 THR CA C 16 62.172 62.172 59.107 3.065 19163 2331 1 7 . 1 1 16 16 THR CB C 16 71.997 71.997 70.467 1.530 19163 2332 1 7 . 1 1 16 16 THR H H 16 8.798 8.798 8.119 0.679 19163 2333 1 7 . 1 1 17 17 TYR N N 17 117.617 117.617 121.025 -3.408 19163 2334 1 7 . 1 1 17 17 TYR HA H 17 4.329 4.329 4.280 0.049 19163 2335 1 7 . 1 1 17 17 TYR C C 17 177.105 177.105 178.164 -1.059 19163 2336 1 7 . 1 1 17 17 TYR CA C 17 57.577 57.577 61.935 -4.358 19163 2337 1 7 . 1 1 17 17 TYR CB C 17 37.113 37.113 37.975 -0.862 19163 2338 1 7 . 1 1 17 17 TYR H H 17 8.292 8.292 9.070 -0.778 19163 2339 1 7 . 1 1 18 18 TYR N N 18 115.048 115.048 117.588 -2.540 19163 2340 1 7 . 1 1 18 18 TYR HA H 18 3.775 3.775 4.217 -0.442 19163 2341 1 7 . 1 1 18 18 TYR C C 18 177.771 177.771 177.941 -0.170 19163 2342 1 7 . 1 1 18 18 TYR CA C 18 61.430 61.430 63.020 -1.590 19163 2343 1 7 . 1 1 18 18 TYR CB C 18 36.495 36.495 37.824 -1.329 19163 2344 1 7 . 1 1 18 18 TYR H H 18 7.047 7.047 8.386 -1.339 19163 2345 1 7 . 1 1 19 19 ASP N N 19 119.520 119.520 119.297 0.223 19163 2346 1 7 . 1 1 19 19 ASP HA H 19 4.406 4.406 4.414 -0.008 19163 2347 1 7 . 1 1 19 19 ASP C C 19 180.128 180.128 178.555 1.573 19163 2348 1 7 . 1 1 19 19 ASP CA C 19 57.475 57.475 57.496 -0.021 19163 2349 1 7 . 1 1 19 19 ASP CB C 19 40.659 40.659 40.718 -0.059 19163 2350 1 7 . 1 1 19 19 ASP H H 19 7.685 7.685 8.287 -0.602 19163 2351 1 7 . 1 1 20 20 VAL N N 20 119.772 119.772 119.146 0.626 19163 2352 1 7 . 1 1 20 20 VAL HA H 20 3.608 3.608 3.766 -0.158 19163 2353 1 7 . 1 1 20 20 VAL C C 20 177.026 177.026 177.308 -0.282 19163 2354 1 7 . 1 1 20 20 VAL CA C 20 65.840 65.840 65.624 0.216 19163 2355 1 7 . 1 1 20 20 VAL CB C 20 31.530 31.530 32.059 -0.529 19163 2356 1 7 . 1 1 20 20 VAL H H 20 8.004 8.004 8.279 -0.275 19163 2357 1 7 . 1 1 21 21 LEU N N 21 115.252 115.252 118.069 -2.817 19163 2358 1 7 . 1 1 21 21 LEU HA H 21 4.281 4.281 4.358 -0.077 19163 2359 1 7 . 1 1 21 21 LEU C C 21 175.757 175.757 176.696 -0.939 19163 2360 1 7 . 1 1 21 21 LEU CA C 21 54.554 54.554 54.729 -0.175 19163 2361 1 7 . 1 1 21 21 LEU CB C 21 42.869 42.869 42.427 0.442 19163 2362 1 7 . 1 1 21 21 LEU H H 21 6.847 6.847 7.855 -1.008 19163 2363 1 7 . 1 1 22 22 GLY N N 22 108.227 108.227 106.864 1.363 19163 2364 1 7 . 1 1 22 22 GLY C C 22 175.361 175.361 174.268 1.093 19163 2365 1 7 . 1 1 22 22 GLY CA C 22 46.574 46.574 45.548 1.026 19163 2366 1 7 . 1 1 22 22 GLY H H 22 7.874 7.874 7.284 0.590 19163 2367 1 7 . 1 1 23 23 VAL N N 23 110.675 110.675 118.976 -8.301 19163 2368 1 7 . 1 1 23 23 VAL HA H 23 4.767 4.767 4.391 0.376 19163 2369 1 7 . 1 1 23 23 VAL C C 23 174.674 174.674 174.447 0.227 19163 2370 1 7 . 1 1 23 23 VAL CA C 23 58.349 58.349 60.071 -1.722 19163 2371 1 7 . 1 1 23 23 VAL CB C 23 34.938 34.938 35.375 -0.437 19163 2372 1 7 . 1 1 23 23 VAL H H 23 7.815 7.815 8.112 -0.297 19163 2373 1 7 . 1 1 24 24 LYS N N 24 119.948 119.948 123.697 -3.749 19163 2374 1 7 . 1 1 24 24 LYS HA H 24 4.488 4.488 4.667 -0.179 19163 2375 1 7 . 1 1 24 24 LYS C C 24 175.442 175.442 176.466 -1.024 19163 2376 1 7 . 1 1 24 24 LYS CA C 24 54.001 54.001 54.107 -0.106 19163 2377 1 7 . 1 1 24 24 LYS CB C 24 32.197 32.197 31.461 0.736 19163 2378 1 7 . 1 1 24 24 LYS H H 24 8.329 8.329 8.434 -0.105 19163 2379 1 7 . 1 1 25 25 PRO HA H 25 2.421 2.421 4.499 -2.078 19163 2380 1 7 . 1 1 25 25 PRO C C 25 175.635 175.635 176.518 -0.883 19163 2381 1 7 . 1 1 25 25 PRO CA C 25 63.362 63.362 64.628 -1.266 19163 2382 1 7 . 1 1 25 25 PRO CB C 25 31.839 31.839 32.072 -0.233 19163 2383 1 7 . 1 1 26 26 ASN N N 26 111.739 111.739 112.397 -0.658 19163 2384 1 7 . 1 1 26 26 ASN HA H 26 4.518 4.518 4.782 -0.264 19163 2385 1 7 . 1 1 26 26 ASN C C 26 175.820 175.820 175.139 0.681 19163 2386 1 7 . 1 1 26 26 ASN CA C 26 51.525 51.525 51.333 0.192 19163 2387 1 7 . 1 1 26 26 ASN CB C 26 36.829 36.829 37.154 -0.325 19163 2388 1 7 . 1 1 26 26 ASN H H 26 7.138 7.138 8.073 -0.935 19163 2389 1 7 . 1 1 27 27 ALA N N 27 122.829 122.829 124.148 -1.319 19163 2390 1 7 . 1 1 27 27 ALA HA H 27 4.325 4.325 4.364 -0.039 19163 2391 1 7 . 1 1 27 27 ALA C C 27 178.726 178.726 176.915 1.811 19163 2392 1 7 . 1 1 27 27 ALA CA C 27 52.961 52.961 52.827 0.134 19163 2393 1 7 . 1 1 27 27 ALA CB C 27 19.159 19.159 19.744 -0.585 19163 2394 1 7 . 1 1 27 27 ALA H H 27 7.637 7.637 7.540 0.097 19163 2395 1 7 . 1 1 28 28 THR N N 28 113.468 113.468 112.649 0.819 19163 2396 1 7 . 1 1 28 28 THR HA H 28 4.493 4.493 4.355 0.138 19163 2397 1 7 . 1 1 28 28 THR C C 28 175.641 175.641 175.699 -0.058 19163 2398 1 7 . 1 1 28 28 THR CA C 28 60.592 60.592 60.843 -0.251 19163 2399 1 7 . 1 1 28 28 THR CB C 28 71.304 71.304 70.207 1.097 19163 2400 1 7 . 1 1 28 28 THR H H 28 8.829 8.829 7.720 1.109 19163 2401 1 7 . 1 1 29 29 GLN N N 29 119.445 119.445 121.582 -2.137 19163 2402 1 7 . 1 1 29 29 GLN HA H 29 4.035 4.035 3.837 0.198 19163 2403 1 7 . 1 1 29 29 GLN C C 29 179.117 179.117 178.069 1.048 19163 2404 1 7 . 1 1 29 29 GLN CA C 29 59.435 59.435 60.283 -0.848 19163 2405 1 7 . 1 1 29 29 GLN CB C 29 27.851 27.851 28.407 -0.556 19163 2406 1 7 . 1 1 29 29 GLN H H 29 9.015 9.015 8.826 0.189 19163 2407 1 7 . 1 1 30 30 GLU N N 30 119.343 119.343 118.920 0.423 19163 2408 1 7 . 1 1 30 30 GLU HA H 30 4.059 4.059 4.116 -0.057 19163 2409 1 7 . 1 1 30 30 GLU C C 30 179.097 179.097 178.881 0.216 19163 2410 1 7 . 1 1 30 30 GLU CA C 30 59.847 59.847 59.242 0.605 19163 2411 1 7 . 1 1 30 30 GLU CB C 30 29.356 29.356 29.058 0.298 19163 2412 1 7 . 1 1 30 30 GLU H H 30 8.549 8.549 8.555 -0.006 19163 2413 1 7 . 1 1 31 31 GLU N N 31 120.562 120.562 120.425 0.137 19163 2414 1 7 . 1 1 31 31 GLU HA H 31 3.906 3.906 4.157 -0.251 19163 2415 1 7 . 1 1 31 31 GLU C C 31 180.405 180.405 179.054 1.351 19163 2416 1 7 . 1 1 31 31 GLU CA C 31 59.592 59.592 59.020 0.572 19163 2417 1 7 . 1 1 31 31 GLU CB C 31 29.989 29.989 29.304 0.685 19163 2418 1 7 . 1 1 31 31 GLU H H 31 7.768 7.768 8.025 -0.257 19163 2419 1 7 . 1 1 32 32 LEU N N 32 120.518 120.518 119.752 0.766 19163 2420 1 7 . 1 1 32 32 LEU HA H 32 3.963 3.963 4.011 -0.048 19163 2421 1 7 . 1 1 32 32 LEU C C 32 177.873 177.873 179.126 -1.253 19163 2422 1 7 . 1 1 32 32 LEU CA C 32 58.593 58.593 57.755 0.838 19163 2423 1 7 . 1 1 32 32 LEU CB C 32 42.556 42.556 41.216 1.340 19163 2424 1 7 . 1 1 32 32 LEU H H 32 8.475 8.475 8.724 -0.249 19163 2425 1 7 . 1 1 33 33 LYS N N 33 119.091 119.091 118.409 0.682 19163 2426 1 7 . 1 1 33 33 LYS HA H 33 4.000 4.000 4.182 -0.182 19163 2427 1 7 . 1 1 33 33 LYS C C 33 178.701 178.701 178.736 -0.035 19163 2428 1 7 . 1 1 33 33 LYS CA C 33 60.274 60.274 59.544 0.730 19163 2429 1 7 . 1 1 33 33 LYS CB C 33 32.656 32.656 31.912 0.744 19163 2430 1 7 . 1 1 33 33 LYS H H 33 8.077 8.077 8.132 -0.055 19163 2431 1 7 . 1 1 34 34 LYS N N 34 118.527 118.527 121.054 -2.527 19163 2432 1 7 . 1 1 34 34 LYS HA H 34 3.890 3.890 3.982 -0.092 19163 2433 1 7 . 1 1 34 34 LYS C C 34 179.172 179.172 178.559 0.613 19163 2434 1 7 . 1 1 34 34 LYS CA C 34 59.927 59.927 59.799 0.128 19163 2435 1 7 . 1 1 34 34 LYS CB C 34 32.869 32.869 32.322 0.547 19163 2436 1 7 . 1 1 34 34 LYS H H 34 7.986 7.986 7.781 0.205 19163 2437 1 7 . 1 1 35 35 ALA N N 35 122.190 122.190 121.771 0.419 19163 2438 1 7 . 1 1 35 35 ALA HA H 35 4.116 4.116 4.064 0.052 19163 2439 1 7 . 1 1 35 35 ALA C C 35 179.982 179.982 179.106 0.876 19163 2440 1 7 . 1 1 35 35 ALA CA C 35 55.157 55.157 55.239 -0.082 19163 2441 1 7 . 1 1 35 35 ALA CB C 35 18.773 18.773 18.304 0.469 19163 2442 1 7 . 1 1 35 35 ALA H H 35 7.917 7.917 8.019 -0.102 19163 2443 1 7 . 1 1 36 36 TYR N N 36 117.701 117.701 120.537 -2.836 19163 2444 1 7 . 1 1 36 36 TYR HA H 36 3.818 3.818 4.079 -0.261 19163 2445 1 7 . 1 1 36 36 TYR C C 36 176.344 176.344 177.570 -1.226 19163 2446 1 7 . 1 1 36 36 TYR CA C 36 61.468 61.468 61.512 -0.044 19163 2447 1 7 . 1 1 36 36 TYR CB C 36 38.890 38.890 38.505 0.385 19163 2448 1 7 . 1 1 36 36 TYR H H 36 8.402 8.402 7.920 0.482 19163 2449 1 7 . 1 1 37 37 ARG N N 37 117.423 117.423 119.150 -1.727 19163 2450 1 7 . 1 1 37 37 ARG HA H 37 3.481 3.481 3.736 -0.255 19163 2451 1 7 . 1 1 37 37 ARG C C 37 178.825 178.825 178.271 0.554 19163 2452 1 7 . 1 1 37 37 ARG CA C 37 59.397 59.397 59.760 -0.362 19163 2453 1 7 . 1 1 37 37 ARG CB C 37 29.710 29.710 30.063 -0.353 19163 2454 1 7 . 1 1 37 37 ARG H H 37 8.264 8.264 8.653 -0.389 19163 2455 1 7 . 1 1 38 38 LYS N N 38 117.247 117.247 119.918 -2.671 19163 2456 1 7 . 1 1 38 38 LYS HA H 38 3.905 3.905 4.042 -0.137 19163 2457 1 7 . 1 1 38 38 LYS C C 38 179.444 179.444 179.132 0.312 19163 2458 1 7 . 1 1 38 38 LYS CA C 38 59.450 59.450 59.521 -0.071 19163 2459 1 7 . 1 1 38 38 LYS CB C 38 32.609 32.609 32.364 0.245 19163 2460 1 7 . 1 1 38 38 LYS H H 38 7.444 7.444 7.758 -0.314 19163 2461 1 7 . 1 1 39 39 LEU N N 39 119.901 119.901 119.368 0.533 19163 2462 1 7 . 1 1 39 39 LEU HA H 39 4.020 4.020 4.270 -0.250 19163 2463 1 7 . 1 1 39 39 LEU C C 39 178.801 178.801 178.971 -0.170 19163 2464 1 7 . 1 1 39 39 LEU CA C 39 57.409 57.409 57.787 -0.378 19163 2465 1 7 . 1 1 39 39 LEU CB C 39 42.388 42.388 41.707 0.681 19163 2466 1 7 . 1 1 39 39 LEU H H 39 7.707 7.707 8.143 -0.437 19163 2467 1 7 . 1 1 40 40 ALA N N 40 122.772 122.772 122.273 0.499 19163 2468 1 7 . 1 1 40 40 ALA HA H 40 3.849 3.849 4.090 -0.241 19163 2469 1 7 . 1 1 40 40 ALA C C 40 179.446 179.446 179.018 0.428 19163 2470 1 7 . 1 1 40 40 ALA CA C 40 55.109 55.109 55.183 -0.074 19163 2471 1 7 . 1 1 40 40 ALA CB C 40 17.116 17.116 18.043 -0.927 19163 2472 1 7 . 1 1 40 40 ALA H H 40 8.931 8.931 8.154 0.777 19163 2473 1 7 . 1 1 41 41 LEU N N 41 115.299 115.299 117.210 -1.911 19163 2474 1 7 . 1 1 41 41 LEU HA H 41 3.977 3.977 3.895 0.082 19163 2475 1 7 . 1 1 41 41 LEU C C 41 178.216 178.216 179.477 -1.261 19163 2476 1 7 . 1 1 41 41 LEU CA C 41 57.088 57.088 57.282 -0.194 19163 2477 1 7 . 1 1 41 41 LEU CB C 41 42.162 42.162 41.786 0.376 19163 2478 1 7 . 1 1 41 41 LEU H H 41 7.133 7.133 7.507 -0.374 19163 2479 1 7 . 1 1 42 42 LYS N N 42 116.812 116.812 117.811 -0.999 19163 2480 1 7 . 1 1 42 42 LYS HA H 42 3.925 3.925 4.052 -0.127 19163 2481 1 7 . 1 1 42 42 LYS C C 42 177.560 177.560 177.717 -0.157 19163 2482 1 7 . 1 1 42 42 LYS CA C 42 57.885 57.885 57.780 0.105 19163 2483 1 7 . 1 1 42 42 LYS CB C 42 33.427 33.427 32.679 0.748 19163 2484 1 7 . 1 1 42 42 LYS H H 42 7.038 7.038 7.486 -0.448 19163 2485 1 7 . 1 1 43 43 TYR N N 43 114.022 114.022 115.453 -1.431 19163 2486 1 7 . 1 1 43 43 TYR HA H 43 4.665 4.665 4.654 0.011 19163 2487 1 7 . 1 1 43 43 TYR C C 43 173.741 173.741 173.988 -0.247 19163 2488 1 7 . 1 1 43 43 TYR CA C 43 56.928 56.928 55.996 0.932 19163 2489 1 7 . 1 1 43 43 TYR CB C 43 39.579 39.579 37.505 2.074 19163 2490 1 7 . 1 1 43 43 TYR H H 43 7.683 7.683 8.115 -0.432 19163 2491 1 7 . 1 1 44 44 HIS N N 44 120.947 120.947 123.027 -2.080 19163 2492 1 7 . 1 1 44 44 HIS HA H 44 3.697 3.697 4.132 -0.435 19163 2493 1 7 . 1 1 44 44 HIS C C 44 174.925 174.925 174.462 0.463 19163 2494 1 7 . 1 1 44 44 HIS CA C 44 56.229 56.229 55.903 0.326 19163 2495 1 7 . 1 1 44 44 HIS CB C 44 30.852 30.852 30.774 0.077 19163 2496 1 7 . 1 1 44 44 HIS H H 44 7.814 7.814 7.805 0.009 19163 2497 1 7 . 1 1 45 45 PRO HA H 45 4.131 4.131 4.222 -0.091 19163 2498 1 7 . 1 1 45 45 PRO C C 45 177.269 177.269 177.803 -0.534 19163 2499 1 7 . 1 1 45 45 PRO CA C 45 64.723 64.723 65.614 -0.891 19163 2500 1 7 . 1 1 45 45 PRO CB C 45 32.070 32.070 31.763 0.307 19163 2501 1 7 . 1 1 46 46 ASP N N 46 119.127 119.127 114.966 4.161 19163 2502 1 7 . 1 1 46 46 ASP HA H 46 4.375 4.375 4.357 0.018 19163 2503 1 7 . 1 1 46 46 ASP C C 46 177.284 177.284 177.364 -0.080 19163 2504 1 7 . 1 1 46 46 ASP CA C 46 56.020 56.020 56.321 -0.301 19163 2505 1 7 . 1 1 46 46 ASP CB C 46 40.221 40.221 40.634 -0.413 19163 2506 1 7 . 1 1 46 46 ASP H H 46 10.040 10.040 8.300 1.740 19163 2507 1 7 . 1 1 47 47 LYS N N 47 117.416 117.416 116.845 0.571 19163 2508 1 7 . 1 1 47 47 LYS HA H 47 4.315 4.315 4.311 0.004 19163 2509 1 7 . 1 1 47 47 LYS C C 47 176.355 176.355 176.509 -0.154 19163 2510 1 7 . 1 1 47 47 LYS CA C 47 55.880 55.880 57.000 -1.120 19163 2511 1 7 . 1 1 47 47 LYS CB C 47 33.778 33.778 33.920 -0.142 19163 2512 1 7 . 1 1 47 47 LYS H H 47 7.826 7.826 7.488 0.338 19163 2513 1 7 . 1 1 48 48 ASN N N 48 116.573 116.573 117.248 -0.675 19163 2514 1 7 . 1 1 48 48 ASN HA H 48 5.021 5.021 5.088 -0.067 19163 2515 1 7 . 1 1 48 48 ASN C C 48 172.992 172.992 173.718 -0.726 19163 2516 1 7 . 1 1 48 48 ASN CA C 48 50.467 50.467 51.250 -0.783 19163 2517 1 7 . 1 1 48 48 ASN CB C 48 39.284 39.284 39.336 -0.052 19163 2518 1 7 . 1 1 48 48 ASN H H 48 7.956 7.956 8.077 -0.121 19163 2519 1 7 . 1 1 49 49 PRO HA H 49 4.448 4.448 4.368 0.080 19163 2520 1 7 . 1 1 49 49 PRO C C 49 178.030 178.030 177.922 0.108 19163 2521 1 7 . 1 1 49 49 PRO CA C 49 64.468 64.468 64.938 -0.470 19163 2522 1 7 . 1 1 49 49 PRO CB C 49 32.173 32.173 32.017 0.155 19163 2523 1 7 . 1 1 50 50 ASN N N 50 115.567 115.567 115.483 0.084 19163 2524 1 7 . 1 1 50 50 ASN HA H 50 4.748 4.748 4.541 0.207 19163 2525 1 7 . 1 1 50 50 ASN C C 50 176.443 176.443 176.259 0.184 19163 2526 1 7 . 1 1 50 50 ASN CA C 50 54.677 54.677 55.094 -0.417 19163 2527 1 7 . 1 1 50 50 ASN CB C 50 39.014 39.014 38.228 0.786 19163 2528 1 7 . 1 1 50 50 ASN H H 50 8.398 8.398 8.558 -0.160 19163 2529 1 7 . 1 1 51 51 GLU N N 51 119.270 119.270 117.643 1.627 19163 2530 1 7 . 1 1 51 51 GLU HA H 51 4.797 4.797 4.516 0.281 19163 2531 1 7 . 1 1 51 51 GLU C C 51 176.922 176.922 178.118 -1.196 19163 2532 1 7 . 1 1 51 51 GLU CA C 51 55.916 55.916 56.615 -0.699 19163 2533 1 7 . 1 1 51 51 GLU CB C 51 29.200 29.200 29.941 -0.741 19163 2534 1 7 . 1 1 51 51 GLU H H 51 7.485 7.485 7.758 -0.273 19163 2535 1 7 . 1 1 52 52 GLY N N 52 107.541 107.541 108.738 -1.197 19163 2536 1 7 . 1 1 52 52 GLY C C 52 176.755 176.755 175.914 0.841 19163 2537 1 7 . 1 1 52 52 GLY CA C 52 47.914 47.914 46.882 1.032 19163 2538 1 7 . 1 1 52 52 GLY H H 52 8.092 8.092 7.527 0.565 19163 2539 1 7 . 1 1 53 53 GLU N N 53 121.603 121.603 120.937 0.666 19163 2540 1 7 . 1 1 53 53 GLU HA H 53 4.065 4.065 4.091 -0.026 19163 2541 1 7 . 1 1 53 53 GLU C C 53 179.052 179.052 178.942 0.110 19163 2542 1 7 . 1 1 53 53 GLU CA C 53 59.280 59.280 59.306 -0.026 19163 2543 1 7 . 1 1 53 53 GLU CB C 53 28.968 28.968 29.359 -0.391 19163 2544 1 7 . 1 1 53 53 GLU H H 53 8.496 8.496 8.285 0.211 19163 2545 1 7 . 1 1 54 54 LYS N N 54 120.837 120.837 118.653 2.184 19163 2546 1 7 . 1 1 54 54 LYS HA H 54 3.923 3.923 4.079 -0.156 19163 2547 1 7 . 1 1 54 54 LYS C C 54 179.058 179.058 179.056 0.002 19163 2548 1 7 . 1 1 54 54 LYS CA C 54 58.800 58.800 58.883 -0.083 19163 2549 1 7 . 1 1 54 54 LYS CB C 54 31.551 31.551 32.224 -0.673 19163 2550 1 7 . 1 1 54 54 LYS H H 54 7.857 7.857 7.600 0.257 19163 2551 1 7 . 1 1 55 55 PHE N N 55 118.608 118.608 121.015 -2.407 19163 2552 1 7 . 1 1 55 55 PHE HA H 55 4.021 4.021 4.173 -0.152 19163 2553 1 7 . 1 1 55 55 PHE C C 55 178.001 178.001 176.841 1.160 19163 2554 1 7 . 1 1 55 55 PHE CA C 55 61.911 61.911 61.035 0.876 19163 2555 1 7 . 1 1 55 55 PHE CB C 55 38.553 38.553 38.938 -0.385 19163 2556 1 7 . 1 1 55 55 PHE H H 55 8.382 8.382 7.869 0.513 19163 2557 1 7 . 1 1 56 56 LYS N N 56 120.898 120.898 119.631 1.267 19163 2558 1 7 . 1 1 56 56 LYS HA H 56 3.828 3.828 4.013 -0.185 19163 2559 1 7 . 1 1 56 56 LYS C C 56 178.817 178.817 179.389 -0.572 19163 2560 1 7 . 1 1 56 56 LYS CA C 56 59.877 59.877 59.667 0.210 19163 2561 1 7 . 1 1 56 56 LYS CB C 56 32.133 32.133 32.036 0.097 19163 2562 1 7 . 1 1 56 56 LYS H H 56 8.111 8.111 7.807 0.304 19163 2563 1 7 . 1 1 57 57 GLN N N 57 118.600 118.600 119.001 -0.401 19163 2564 1 7 . 1 1 57 57 GLN HA H 57 4.009 4.009 4.333 -0.324 19163 2565 1 7 . 1 1 57 57 GLN C C 57 179.333 179.333 178.494 0.839 19163 2566 1 7 . 1 1 57 57 GLN CA C 57 59.109 59.109 58.737 0.372 19163 2567 1 7 . 1 1 57 57 GLN CB C 57 28.595 28.595 28.782 -0.187 19163 2568 1 7 . 1 1 57 57 GLN H H 57 7.613 7.613 7.650 -0.037 19163 2569 1 7 . 1 1 58 58 ILE N N 58 118.709 118.709 120.415 -1.706 19163 2570 1 7 . 1 1 58 58 ILE HA H 58 3.559 3.559 3.575 -0.016 19163 2571 1 7 . 1 1 58 58 ILE C C 58 177.152 177.152 177.871 -0.719 19163 2572 1 7 . 1 1 58 58 ILE CA C 58 65.068 65.068 65.300 -0.232 19163 2573 1 7 . 1 1 58 58 ILE CB C 58 38.381 38.381 37.429 0.952 19163 2574 1 7 . 1 1 58 58 ILE H H 58 8.011 8.011 7.436 0.575 19163 2575 1 7 . 1 1 59 59 SER N N 59 116.112 116.112 115.654 0.458 19163 2576 1 7 . 1 1 59 59 SER HA H 59 3.948 3.948 4.034 -0.086 19163 2577 1 7 . 1 1 59 59 SER C C 59 175.949 175.949 177.036 -1.087 19163 2578 1 7 . 1 1 59 59 SER CA C 59 62.315 62.315 61.742 0.572 19163 2579 1 7 . 1 1 59 59 SER H H 59 8.030 8.030 8.264 -0.234 19163 2580 1 7 . 1 1 60 60 GLN N N 60 122.099 122.099 122.039 0.060 19163 2581 1 7 . 1 1 60 60 GLN HA H 60 3.801 3.801 3.873 -0.072 19163 2582 1 7 . 1 1 60 60 GLN C C 60 176.942 176.942 177.902 -0.960 19163 2583 1 7 . 1 1 60 60 GLN CA C 60 58.762 58.762 58.567 0.195 19163 2584 1 7 . 1 1 60 60 GLN CB C 60 28.498 28.498 28.413 0.085 19163 2585 1 7 . 1 1 60 60 GLN H H 60 7.933 7.933 7.582 0.351 19163 2586 1 7 . 1 1 61 61 ALA N N 61 119.367 119.367 122.498 -3.131 19163 2587 1 7 . 1 1 61 61 ALA HA H 61 2.636 2.636 3.500 -0.864 19163 2588 1 7 . 1 1 61 61 ALA C C 61 178.507 178.507 178.791 -0.284 19163 2589 1 7 . 1 1 61 61 ALA CA C 61 54.126 54.126 54.931 -0.805 19163 2590 1 7 . 1 1 61 61 ALA CB C 61 18.462 18.462 18.416 0.046 19163 2591 1 7 . 1 1 61 61 ALA H H 61 7.354 7.354 7.875 -0.521 19163 2592 1 7 . 1 1 62 62 TYR N N 62 115.613 115.613 119.942 -4.329 19163 2593 1 7 . 1 1 62 62 TYR HA H 62 3.633 3.633 3.887 -0.254 19163 2594 1 7 . 1 1 62 62 TYR C C 62 177.421 177.421 177.203 0.218 19163 2595 1 7 . 1 1 62 62 TYR CA C 62 61.676 61.676 61.363 0.313 19163 2596 1 7 . 1 1 62 62 TYR CB C 62 39.162 39.162 38.014 1.148 19163 2597 1 7 . 1 1 62 62 TYR H H 62 7.994 7.994 8.328 -0.334 19163 2598 1 7 . 1 1 63 63 GLU N N 63 121.396 121.396 119.945 1.451 19163 2599 1 7 . 1 1 63 63 GLU HA H 63 3.347 3.347 3.683 -0.336 19163 2600 1 7 . 1 1 63 63 GLU C C 63 177.687 177.687 178.421 -0.734 19163 2601 1 7 . 1 1 63 63 GLU CA C 63 59.562 59.562 59.180 0.382 19163 2602 1 7 . 1 1 63 63 GLU CB C 63 29.115 29.115 29.655 -0.540 19163 2603 1 7 . 1 1 63 63 GLU H H 63 8.151 8.151 7.738 0.413 19163 2604 1 7 . 1 1 64 64 VAL N N 64 115.850 115.850 118.662 -2.812 19163 2605 1 7 . 1 1 64 64 VAL HA H 64 3.377 3.377 3.694 -0.317 19163 2606 1 7 . 1 1 64 64 VAL C C 64 175.925 175.925 177.432 -1.507 19163 2607 1 7 . 1 1 64 64 VAL CA C 64 65.806 65.806 64.955 0.851 19163 2608 1 7 . 1 1 64 64 VAL CB C 64 31.786 31.786 31.664 0.122 19163 2609 1 7 . 1 1 64 64 VAL H H 64 6.814 6.814 7.204 -0.390 19163 2610 1 7 . 1 1 65 65 LEU N N 65 111.438 111.438 118.910 -7.472 19163 2611 1 7 . 1 1 65 65 LEU HA H 65 3.569 3.569 3.899 -0.330 19163 2612 1 7 . 1 1 65 65 LEU C C 65 177.124 177.124 178.710 -1.586 19163 2613 1 7 . 1 1 65 65 LEU CA C 65 56.645 56.645 57.483 -0.838 19163 2614 1 7 . 1 1 65 65 LEU CB C 65 42.589 42.589 41.205 1.384 19163 2615 1 7 . 1 1 65 65 LEU H H 65 7.398 7.398 8.235 -0.837 19163 2616 1 7 . 1 1 66 66 SER N N 66 108.642 108.642 110.484 -1.842 19163 2617 1 7 . 1 1 66 66 SER HA H 66 4.028 4.028 4.096 -0.068 19163 2618 1 7 . 1 1 66 66 SER C C 66 173.286 173.286 174.312 -1.026 19163 2619 1 7 . 1 1 66 66 SER CA C 66 59.232 59.232 59.785 -0.553 19163 2620 1 7 . 1 1 66 66 SER CB C 66 63.066 63.066 63.296 -0.230 19163 2621 1 7 . 1 1 66 66 SER H H 66 7.700 7.700 7.462 0.238 19163 2622 1 7 . 1 1 67 67 ASP N N 67 124.276 124.276 121.788 2.488 19163 2623 1 7 . 1 1 67 67 ASP HA H 67 4.668 4.668 4.696 -0.028 19163 2624 1 7 . 1 1 67 67 ASP C C 67 174.913 174.913 175.629 -0.716 19163 2625 1 7 . 1 1 67 67 ASP CA C 67 52.487 52.487 52.709 -0.222 19163 2626 1 7 . 1 1 67 67 ASP CB C 67 43.218 43.218 42.149 1.069 19163 2627 1 7 . 1 1 67 67 ASP H H 67 6.879 6.879 7.062 -0.183 19163 2628 1 7 . 1 1 68 68 ALA N N 68 127.326 127.326 130.861 -3.535 19163 2629 1 7 . 1 1 68 68 ALA HA H 68 3.853 3.853 3.910 -0.057 19163 2630 1 7 . 1 1 68 68 ALA C C 68 180.336 180.336 178.797 1.539 19163 2631 1 7 . 1 1 68 68 ALA CA C 68 55.912 55.912 55.364 0.548 19163 2632 1 7 . 1 1 68 68 ALA CB C 68 18.645 18.645 18.845 -0.200 19163 2633 1 7 . 1 1 68 68 ALA H H 68 8.693 8.693 8.799 -0.106 19163 2634 1 7 . 1 1 69 69 LYS N N 69 116.929 116.929 117.949 -1.020 19163 2635 1 7 . 1 1 69 69 LYS HA H 69 4.162 4.162 4.047 0.115 19163 2636 1 7 . 1 1 69 69 LYS C C 69 179.515 179.515 178.641 0.874 19163 2637 1 7 . 1 1 69 69 LYS CA C 69 58.562 58.562 59.205 -0.642 19163 2638 1 7 . 1 1 69 69 LYS CB C 69 31.840 31.840 32.241 -0.401 19163 2639 1 7 . 1 1 69 69 LYS H H 69 7.950 7.950 7.844 0.106 19163 2640 1 7 . 1 1 70 70 LYS N N 70 121.286 121.286 119.230 2.056 19163 2641 1 7 . 1 1 70 70 LYS HA H 70 3.960 3.960 3.974 -0.014 19163 2642 1 7 . 1 1 70 70 LYS C C 70 179.938 179.938 178.992 0.946 19163 2643 1 7 . 1 1 70 70 LYS CA C 70 60.066 60.066 59.661 0.405 19163 2644 1 7 . 1 1 70 70 LYS CB C 70 32.695 32.695 32.339 0.356 19163 2645 1 7 . 1 1 70 70 LYS H H 70 8.184 8.184 8.720 -0.536 19163 2646 1 7 . 1 1 71 71 ARG N N 71 122.794 122.794 119.643 3.151 19163 2647 1 7 . 1 1 71 71 ARG HA H 71 3.668 3.668 4.048 -0.380 19163 2648 1 7 . 1 1 71 71 ARG C C 71 177.356 177.356 178.169 -0.813 19163 2649 1 7 . 1 1 71 71 ARG CA C 71 60.127 60.127 59.829 0.298 19163 2650 1 7 . 1 1 71 71 ARG CB C 71 29.668 29.668 30.169 -0.501 19163 2651 1 7 . 1 1 71 71 ARG H H 71 9.290 9.290 8.639 0.651 19163 2652 1 7 . 1 1 72 72 GLU N N 72 118.390 118.390 119.759 -1.369 19163 2653 1 7 . 1 1 72 72 GLU HA H 72 4.096 4.096 4.137 -0.041 19163 2654 1 7 . 1 1 72 72 GLU C C 72 179.073 179.073 179.068 0.005 19163 2655 1 7 . 1 1 72 72 GLU CA C 72 59.456 59.456 59.379 0.077 19163 2656 1 7 . 1 1 72 72 GLU CB C 72 29.615 29.615 29.526 0.089 19163 2657 1 7 . 1 1 72 72 GLU H H 72 7.607 7.607 7.705 -0.098 19163 2658 1 7 . 1 1 73 73 LEU N N 73 117.921 117.921 119.926 -2.005 19163 2659 1 7 . 1 1 73 73 LEU HA H 73 4.032 4.032 3.995 0.037 19163 2660 1 7 . 1 1 73 73 LEU C C 73 179.696 179.696 178.688 1.008 19163 2661 1 7 . 1 1 73 73 LEU CA C 73 57.597 57.597 57.712 -0.114 19163 2662 1 7 . 1 1 73 73 LEU CB C 73 41.815 41.815 41.850 -0.035 19163 2663 1 7 . 1 1 73 73 LEU H H 73 7.398 7.398 7.708 -0.310 19163 2664 1 7 . 1 1 74 74 TYR N N 74 122.662 122.662 118.576 4.086 19163 2665 1 7 . 1 1 74 74 TYR HA H 74 4.092 4.092 4.140 -0.048 19163 2666 1 7 . 1 1 74 74 TYR C C 74 178.166 178.166 178.616 -0.450 19163 2667 1 7 . 1 1 74 74 TYR CA C 74 61.458 61.458 61.167 0.291 19163 2668 1 7 . 1 1 74 74 TYR CB C 74 38.778 38.778 38.964 -0.186 19163 2669 1 7 . 1 1 74 74 TYR H H 74 8.316 8.316 8.315 0.001 19163 2670 1 7 . 1 1 75 75 ASP N N 75 118.842 118.842 120.023 -1.181 19163 2671 1 7 . 1 1 75 75 ASP HA H 75 4.423 4.423 4.375 0.048 19163 2672 1 7 . 1 1 75 75 ASP C C 75 177.726 177.726 177.697 0.029 19163 2673 1 7 . 1 1 75 75 ASP CA C 75 56.177 56.177 56.788 -0.611 19163 2674 1 7 . 1 1 75 75 ASP CB C 75 40.800 40.800 40.998 -0.198 19163 2675 1 7 . 1 1 75 75 ASP H H 75 8.770 8.770 8.530 0.240 19163 2676 1 7 . 1 1 76 76 LYS N N 76 118.955 118.955 117.599 1.356 19163 2677 1 7 . 1 1 76 76 LYS HA H 76 4.130 4.130 4.295 -0.165 19163 2678 1 7 . 1 1 76 76 LYS C C 76 177.006 177.006 176.434 0.572 19163 2679 1 7 . 1 1 76 76 LYS CA C 76 57.537 57.537 56.330 1.207 19163 2680 1 7 . 1 1 76 76 LYS CB C 76 33.136 33.136 33.343 -0.207 19163 2681 1 7 . 1 1 76 76 LYS H H 76 7.610 7.610 7.817 -0.207 19163 2682 1 8 . 1 1 11 11 MET HA H 11 4.346 4.346 4.478 -0.132 19163 2683 1 8 . 1 1 11 11 MET C C 11 175.801 175.801 175.182 0.619 19163 2684 1 8 . 1 1 11 11 MET CA C 11 55.614 55.614 55.747 -0.133 19163 2685 1 8 . 1 1 11 11 MET CB C 11 32.925 32.925 33.419 -0.494 19163 2686 1 8 . 1 1 12 12 VAL N N 12 121.226 121.226 122.921 -1.695 19163 2687 1 8 . 1 1 12 12 VAL HA H 12 4.026 4.026 4.242 -0.216 19163 2688 1 8 . 1 1 12 12 VAL C C 12 175.701 175.701 174.263 1.438 19163 2689 1 8 . 1 1 12 12 VAL CA C 12 62.188 62.188 61.466 0.722 19163 2690 1 8 . 1 1 12 12 VAL CB C 12 32.882 32.882 33.703 -0.821 19163 2691 1 8 . 1 1 12 12 VAL H H 12 7.988 7.988 8.211 -0.223 19163 2692 1 8 . 1 1 13 13 LYS N N 13 125.255 125.255 127.174 -1.919 19163 2693 1 8 . 1 1 13 13 LYS HA H 13 4.211 4.211 4.693 -0.482 19163 2694 1 8 . 1 1 13 13 LYS C C 13 176.121 176.121 176.124 -0.003 19163 2695 1 8 . 1 1 13 13 LYS CA C 13 56.355 56.355 55.484 0.871 19163 2696 1 8 . 1 1 13 13 LYS CB C 13 33.019 33.019 33.338 -0.319 19163 2697 1 8 . 1 1 13 13 LYS H H 13 8.281 8.281 8.249 0.032 19163 2698 1 8 . 1 1 14 14 GLU N N 14 123.004 123.004 121.695 1.309 19163 2699 1 8 . 1 1 14 14 GLU HA H 14 4.305 4.305 4.041 0.264 19163 2700 1 8 . 1 1 14 14 GLU C C 14 176.107 176.107 175.333 0.774 19163 2701 1 8 . 1 1 14 14 GLU CA C 14 56.343 56.343 56.447 -0.104 19163 2702 1 8 . 1 1 14 14 GLU CB C 14 30.534 30.534 29.015 1.519 19163 2703 1 8 . 1 1 14 14 GLU H H 14 8.424 8.424 8.735 -0.311 19163 2704 1 8 . 1 1 15 15 THR N N 15 115.895 115.895 116.054 -0.159 19163 2705 1 8 . 1 1 15 15 THR HA H 15 4.538 4.538 4.377 0.162 19163 2706 1 8 . 1 1 15 15 THR C C 15 175.233 175.233 174.587 0.646 19163 2707 1 8 . 1 1 15 15 THR CA C 15 61.981 61.981 62.405 -0.424 19163 2708 1 8 . 1 1 15 15 THR CB C 15 69.865 69.865 69.640 0.225 19163 2709 1 8 . 1 1 15 15 THR H H 15 8.335 8.335 7.987 0.348 19163 2710 1 8 . 1 1 16 16 THR N N 16 116.992 116.992 117.958 -0.966 19163 2711 1 8 . 1 1 16 16 THR HA H 16 4.366 4.366 4.427 -0.061 19163 2712 1 8 . 1 1 16 16 THR C C 16 176.090 176.090 175.372 0.718 19163 2713 1 8 . 1 1 16 16 THR CA C 16 62.172 62.172 60.362 1.810 19163 2714 1 8 . 1 1 16 16 THR CB C 16 71.997 71.997 70.693 1.304 19163 2715 1 8 . 1 1 16 16 THR H H 16 8.798 8.798 8.243 0.555 19163 2716 1 8 . 1 1 17 17 TYR N N 17 117.617 117.617 120.587 -2.970 19163 2717 1 8 . 1 1 17 17 TYR HA H 17 4.329 4.329 4.253 0.076 19163 2718 1 8 . 1 1 17 17 TYR C C 17 177.105 177.105 178.220 -1.115 19163 2719 1 8 . 1 1 17 17 TYR CA C 17 57.577 57.577 62.519 -4.942 19163 2720 1 8 . 1 1 17 17 TYR CB C 17 37.113 37.113 37.712 -0.599 19163 2721 1 8 . 1 1 17 17 TYR H H 17 8.292 8.292 8.995 -0.703 19163 2722 1 8 . 1 1 18 18 TYR N N 18 115.048 115.048 117.743 -2.695 19163 2723 1 8 . 1 1 18 18 TYR HA H 18 3.775 3.775 4.254 -0.479 19163 2724 1 8 . 1 1 18 18 TYR C C 18 177.771 177.771 177.904 -0.133 19163 2725 1 8 . 1 1 18 18 TYR CA C 18 61.430 61.430 60.801 0.629 19163 2726 1 8 . 1 1 18 18 TYR CB C 18 36.495 36.495 37.431 -0.936 19163 2727 1 8 . 1 1 18 18 TYR H H 18 7.047 7.047 8.565 -1.518 19163 2728 1 8 . 1 1 19 19 ASP N N 19 119.520 119.520 120.018 -0.498 19163 2729 1 8 . 1 1 19 19 ASP HA H 19 4.406 4.406 4.455 -0.049 19163 2730 1 8 . 1 1 19 19 ASP C C 19 180.128 180.128 178.679 1.449 19163 2731 1 8 . 1 1 19 19 ASP CA C 19 57.475 57.475 57.504 -0.029 19163 2732 1 8 . 1 1 19 19 ASP CB C 19 40.659 40.659 40.897 -0.238 19163 2733 1 8 . 1 1 19 19 ASP H H 19 7.685 7.685 8.293 -0.608 19163 2734 1 8 . 1 1 20 20 VAL N N 20 119.772 119.772 118.649 1.123 19163 2735 1 8 . 1 1 20 20 VAL HA H 20 3.608 3.608 3.826 -0.218 19163 2736 1 8 . 1 1 20 20 VAL C C 20 177.026 177.026 177.302 -0.276 19163 2737 1 8 . 1 1 20 20 VAL CA C 20 65.840 65.840 65.875 -0.035 19163 2738 1 8 . 1 1 20 20 VAL CB C 20 31.530 31.530 31.989 -0.459 19163 2739 1 8 . 1 1 20 20 VAL H H 20 8.004 8.004 8.215 -0.211 19163 2740 1 8 . 1 1 21 21 LEU N N 21 115.252 115.252 116.502 -1.250 19163 2741 1 8 . 1 1 21 21 LEU HA H 21 4.281 4.281 4.381 -0.100 19163 2742 1 8 . 1 1 21 21 LEU C C 21 175.757 175.757 177.385 -1.628 19163 2743 1 8 . 1 1 21 21 LEU CA C 21 54.554 54.554 54.778 -0.224 19163 2744 1 8 . 1 1 21 21 LEU CB C 21 42.869 42.869 41.678 1.191 19163 2745 1 8 . 1 1 21 21 LEU H H 21 6.847 6.847 7.696 -0.849 19163 2746 1 8 . 1 1 22 22 GLY N N 22 108.227 108.227 107.557 0.670 19163 2747 1 8 . 1 1 22 22 GLY C C 22 175.361 175.361 173.840 1.521 19163 2748 1 8 . 1 1 22 22 GLY CA C 22 46.574 46.574 45.944 0.630 19163 2749 1 8 . 1 1 22 22 GLY H H 22 7.874 7.874 7.474 0.400 19163 2750 1 8 . 1 1 23 23 VAL N N 23 110.675 110.675 118.444 -7.769 19163 2751 1 8 . 1 1 23 23 VAL HA H 23 4.767 4.767 4.542 0.225 19163 2752 1 8 . 1 1 23 23 VAL C C 23 174.674 174.674 174.599 0.075 19163 2753 1 8 . 1 1 23 23 VAL CA C 23 58.349 58.349 59.503 -1.154 19163 2754 1 8 . 1 1 23 23 VAL CB C 23 34.938 34.938 35.685 -0.747 19163 2755 1 8 . 1 1 23 23 VAL H H 23 7.815 7.815 7.948 -0.133 19163 2756 1 8 . 1 1 24 24 LYS N N 24 119.948 119.948 124.177 -4.229 19163 2757 1 8 . 1 1 24 24 LYS HA H 24 4.488 4.488 4.753 -0.265 19163 2758 1 8 . 1 1 24 24 LYS C C 24 175.442 175.442 175.800 -0.358 19163 2759 1 8 . 1 1 24 24 LYS CA C 24 54.001 54.001 54.207 -0.206 19163 2760 1 8 . 1 1 24 24 LYS CB C 24 32.197 32.197 32.235 -0.038 19163 2761 1 8 . 1 1 24 24 LYS H H 24 8.329 8.329 8.362 -0.033 19163 2762 1 8 . 1 1 25 25 PRO HA H 25 2.421 2.421 4.424 -2.003 19163 2763 1 8 . 1 1 25 25 PRO C C 25 175.635 175.635 176.224 -0.589 19163 2764 1 8 . 1 1 25 25 PRO CA C 25 63.362 63.362 64.474 -1.112 19163 2765 1 8 . 1 1 25 25 PRO CB C 25 31.839 31.839 31.729 0.111 19163 2766 1 8 . 1 1 26 26 ASN N N 26 111.739 111.739 112.576 -0.837 19163 2767 1 8 . 1 1 26 26 ASN HA H 26 4.518 4.518 4.752 -0.234 19163 2768 1 8 . 1 1 26 26 ASN C C 26 175.820 175.820 175.113 0.707 19163 2769 1 8 . 1 1 26 26 ASN CA C 26 51.525 51.525 52.026 -0.501 19163 2770 1 8 . 1 1 26 26 ASN CB C 26 36.829 36.829 38.085 -1.256 19163 2771 1 8 . 1 1 26 26 ASN H H 26 7.138 7.138 8.048 -0.910 19163 2772 1 8 . 1 1 27 27 ALA N N 27 122.829 122.829 125.872 -3.043 19163 2773 1 8 . 1 1 27 27 ALA HA H 27 4.325 4.325 4.440 -0.115 19163 2774 1 8 . 1 1 27 27 ALA C C 27 178.726 178.726 176.767 1.959 19163 2775 1 8 . 1 1 27 27 ALA CA C 27 52.961 52.961 52.391 0.570 19163 2776 1 8 . 1 1 27 27 ALA CB C 27 19.159 19.159 19.303 -0.144 19163 2777 1 8 . 1 1 27 27 ALA H H 27 7.637 7.637 7.819 -0.182 19163 2778 1 8 . 1 1 28 28 THR N N 28 113.468 113.468 114.081 -0.613 19163 2779 1 8 . 1 1 28 28 THR HA H 28 4.493 4.493 4.432 0.061 19163 2780 1 8 . 1 1 28 28 THR C C 28 175.641 175.641 175.784 -0.143 19163 2781 1 8 . 1 1 28 28 THR CA C 28 60.592 60.592 60.299 0.293 19163 2782 1 8 . 1 1 28 28 THR CB C 28 71.304 71.304 70.645 0.659 19163 2783 1 8 . 1 1 28 28 THR H H 28 8.829 8.829 8.136 0.693 19163 2784 1 8 . 1 1 29 29 GLN N N 29 119.445 119.445 121.838 -2.393 19163 2785 1 8 . 1 1 29 29 GLN HA H 29 4.035 4.035 3.924 0.111 19163 2786 1 8 . 1 1 29 29 GLN C C 29 179.117 179.117 178.494 0.623 19163 2787 1 8 . 1 1 29 29 GLN CA C 29 59.435 59.435 59.878 -0.443 19163 2788 1 8 . 1 1 29 29 GLN CB C 29 27.851 27.851 28.624 -0.773 19163 2789 1 8 . 1 1 29 29 GLN H H 29 9.015 9.015 8.854 0.162 19163 2790 1 8 . 1 1 30 30 GLU N N 30 119.343 119.343 118.925 0.418 19163 2791 1 8 . 1 1 30 30 GLU HA H 30 4.059 4.059 4.044 0.015 19163 2792 1 8 . 1 1 30 30 GLU C C 30 179.097 179.097 178.617 0.480 19163 2793 1 8 . 1 1 30 30 GLU CA C 30 59.847 59.847 59.579 0.268 19163 2794 1 8 . 1 1 30 30 GLU CB C 30 29.356 29.356 29.390 -0.034 19163 2795 1 8 . 1 1 30 30 GLU H H 30 8.549 8.549 8.640 -0.091 19163 2796 1 8 . 1 1 31 31 GLU N N 31 120.562 120.562 120.724 -0.162 19163 2797 1 8 . 1 1 31 31 GLU HA H 31 3.906 3.906 4.123 -0.217 19163 2798 1 8 . 1 1 31 31 GLU C C 31 180.405 180.405 179.044 1.361 19163 2799 1 8 . 1 1 31 31 GLU CA C 31 59.592 59.592 58.940 0.652 19163 2800 1 8 . 1 1 31 31 GLU CB C 31 29.989 29.989 29.192 0.797 19163 2801 1 8 . 1 1 31 31 GLU H H 31 7.768 7.768 8.255 -0.487 19163 2802 1 8 . 1 1 32 32 LEU N N 32 120.518 120.518 120.107 0.411 19163 2803 1 8 . 1 1 32 32 LEU HA H 32 3.963 3.963 4.030 -0.067 19163 2804 1 8 . 1 1 32 32 LEU C C 32 177.873 177.873 179.358 -1.485 19163 2805 1 8 . 1 1 32 32 LEU CA C 32 58.593 58.593 57.858 0.735 19163 2806 1 8 . 1 1 32 32 LEU CB C 32 42.556 42.556 41.136 1.420 19163 2807 1 8 . 1 1 32 32 LEU H H 32 8.475 8.475 8.527 -0.052 19163 2808 1 8 . 1 1 33 33 LYS N N 33 119.091 119.091 119.115 -0.024 19163 2809 1 8 . 1 1 33 33 LYS HA H 33 4.000 4.000 4.245 -0.245 19163 2810 1 8 . 1 1 33 33 LYS C C 33 178.701 178.701 178.918 -0.217 19163 2811 1 8 . 1 1 33 33 LYS CA C 33 60.274 60.274 60.145 0.129 19163 2812 1 8 . 1 1 33 33 LYS CB C 33 32.656 32.656 32.216 0.440 19163 2813 1 8 . 1 1 33 33 LYS H H 33 8.077 8.077 7.710 0.367 19163 2814 1 8 . 1 1 34 34 LYS N N 34 118.527 118.527 120.017 -1.490 19163 2815 1 8 . 1 1 34 34 LYS HA H 34 3.890 3.890 4.046 -0.156 19163 2816 1 8 . 1 1 34 34 LYS C C 34 179.172 179.172 178.778 0.394 19163 2817 1 8 . 1 1 34 34 LYS CA C 34 59.927 59.927 59.377 0.550 19163 2818 1 8 . 1 1 34 34 LYS CB C 34 32.869 32.869 32.467 0.402 19163 2819 1 8 . 1 1 34 34 LYS H H 34 7.986 7.986 7.874 0.112 19163 2820 1 8 . 1 1 35 35 ALA N N 35 122.190 122.190 122.339 -0.149 19163 2821 1 8 . 1 1 35 35 ALA HA H 35 4.116 4.116 4.031 0.085 19163 2822 1 8 . 1 1 35 35 ALA C C 35 179.982 179.982 178.958 1.024 19163 2823 1 8 . 1 1 35 35 ALA CA C 35 55.157 55.157 55.294 -0.137 19163 2824 1 8 . 1 1 35 35 ALA CB C 35 18.773 18.773 18.285 0.488 19163 2825 1 8 . 1 1 35 35 ALA H H 35 7.917 7.917 8.375 -0.458 19163 2826 1 8 . 1 1 36 36 TYR N N 36 117.701 117.701 120.474 -2.773 19163 2827 1 8 . 1 1 36 36 TYR HA H 36 3.818 3.818 3.996 -0.178 19163 2828 1 8 . 1 1 36 36 TYR C C 36 176.344 176.344 177.505 -1.161 19163 2829 1 8 . 1 1 36 36 TYR CA C 36 61.468 61.468 61.463 0.005 19163 2830 1 8 . 1 1 36 36 TYR CB C 36 38.890 38.890 38.175 0.715 19163 2831 1 8 . 1 1 36 36 TYR H H 36 8.402 8.402 7.853 0.549 19163 2832 1 8 . 1 1 37 37 ARG N N 37 117.423 117.423 119.057 -1.634 19163 2833 1 8 . 1 1 37 37 ARG HA H 37 3.481 3.481 3.698 -0.217 19163 2834 1 8 . 1 1 37 37 ARG C C 37 178.825 178.825 178.215 0.610 19163 2835 1 8 . 1 1 37 37 ARG CA C 37 59.397 59.397 59.595 -0.198 19163 2836 1 8 . 1 1 37 37 ARG CB C 37 29.710 29.710 30.051 -0.341 19163 2837 1 8 . 1 1 37 37 ARG H H 37 8.264 8.264 8.335 -0.071 19163 2838 1 8 . 1 1 38 38 LYS N N 38 117.247 117.247 120.025 -2.778 19163 2839 1 8 . 1 1 38 38 LYS HA H 38 3.905 3.905 3.986 -0.081 19163 2840 1 8 . 1 1 38 38 LYS C C 38 179.444 179.444 179.075 0.369 19163 2841 1 8 . 1 1 38 38 LYS CA C 38 59.450 59.450 59.501 -0.051 19163 2842 1 8 . 1 1 38 38 LYS CB C 38 32.609 32.609 32.298 0.311 19163 2843 1 8 . 1 1 38 38 LYS H H 38 7.444 7.444 7.776 -0.332 19163 2844 1 8 . 1 1 39 39 LEU N N 39 119.901 119.901 119.065 0.836 19163 2845 1 8 . 1 1 39 39 LEU HA H 39 4.020 4.020 3.982 0.038 19163 2846 1 8 . 1 1 39 39 LEU C C 39 178.801 178.801 178.768 0.033 19163 2847 1 8 . 1 1 39 39 LEU CA C 39 57.409 57.409 57.495 -0.086 19163 2848 1 8 . 1 1 39 39 LEU CB C 39 42.388 42.388 41.636 0.751 19163 2849 1 8 . 1 1 39 39 LEU H H 39 7.707 7.707 8.137 -0.430 19163 2850 1 8 . 1 1 40 40 ALA N N 40 122.772 122.772 122.067 0.705 19163 2851 1 8 . 1 1 40 40 ALA HA H 40 3.849 3.849 4.119 -0.270 19163 2852 1 8 . 1 1 40 40 ALA C C 40 179.446 179.446 179.662 -0.216 19163 2853 1 8 . 1 1 40 40 ALA CA C 40 55.109 55.109 55.073 0.036 19163 2854 1 8 . 1 1 40 40 ALA CB C 40 17.116 17.116 18.203 -1.087 19163 2855 1 8 . 1 1 40 40 ALA H H 40 8.931 8.931 8.264 0.667 19163 2856 1 8 . 1 1 41 41 LEU N N 41 115.299 115.299 117.103 -1.804 19163 2857 1 8 . 1 1 41 41 LEU HA H 41 3.977 3.977 3.889 0.088 19163 2858 1 8 . 1 1 41 41 LEU C C 41 178.216 178.216 178.685 -0.469 19163 2859 1 8 . 1 1 41 41 LEU CA C 41 57.088 57.088 57.396 -0.308 19163 2860 1 8 . 1 1 41 41 LEU CB C 41 42.162 42.162 41.447 0.715 19163 2861 1 8 . 1 1 41 41 LEU H H 41 7.133 7.133 7.471 -0.338 19163 2862 1 8 . 1 1 42 42 LYS N N 42 116.812 116.812 117.623 -0.811 19163 2863 1 8 . 1 1 42 42 LYS HA H 42 3.925 3.925 4.027 -0.102 19163 2864 1 8 . 1 1 42 42 LYS C C 42 177.560 177.560 177.302 0.258 19163 2865 1 8 . 1 1 42 42 LYS CA C 42 57.885 57.885 58.215 -0.330 19163 2866 1 8 . 1 1 42 42 LYS CB C 42 33.427 33.427 32.258 1.169 19163 2867 1 8 . 1 1 42 42 LYS H H 42 7.038 7.038 7.356 -0.318 19163 2868 1 8 . 1 1 43 43 TYR N N 43 114.022 114.022 115.686 -1.664 19163 2869 1 8 . 1 1 43 43 TYR HA H 43 4.665 4.665 4.601 0.064 19163 2870 1 8 . 1 1 43 43 TYR C C 43 173.741 173.741 174.421 -0.680 19163 2871 1 8 . 1 1 43 43 TYR CA C 43 56.928 56.928 56.231 0.697 19163 2872 1 8 . 1 1 43 43 TYR CB C 43 39.579 39.579 37.258 2.321 19163 2873 1 8 . 1 1 43 43 TYR H H 43 7.683 7.683 8.213 -0.530 19163 2874 1 8 . 1 1 44 44 HIS N N 44 120.947 120.947 122.803 -1.856 19163 2875 1 8 . 1 1 44 44 HIS HA H 44 3.697 3.697 3.941 -0.244 19163 2876 1 8 . 1 1 44 44 HIS C C 44 174.925 174.925 174.438 0.487 19163 2877 1 8 . 1 1 44 44 HIS CA C 44 56.229 56.229 55.057 1.172 19163 2878 1 8 . 1 1 44 44 HIS CB C 44 30.852 30.852 30.921 -0.069 19163 2879 1 8 . 1 1 44 44 HIS H H 44 7.814 7.814 7.576 0.238 19163 2880 1 8 . 1 1 45 45 PRO HA H 45 4.131 4.131 4.297 -0.166 19163 2881 1 8 . 1 1 45 45 PRO C C 45 177.269 177.269 177.194 0.075 19163 2882 1 8 . 1 1 45 45 PRO CA C 45 64.723 64.723 65.271 -0.548 19163 2883 1 8 . 1 1 45 45 PRO CB C 45 32.070 32.070 31.860 0.210 19163 2884 1 8 . 1 1 46 46 ASP N N 46 119.127 119.127 115.656 3.471 19163 2885 1 8 . 1 1 46 46 ASP HA H 46 4.375 4.375 4.375 -0.000 19163 2886 1 8 . 1 1 46 46 ASP C C 46 177.284 177.284 176.962 0.322 19163 2887 1 8 . 1 1 46 46 ASP CA C 46 56.020 56.020 56.256 -0.236 19163 2888 1 8 . 1 1 46 46 ASP CB C 46 40.221 40.221 40.239 -0.018 19163 2889 1 8 . 1 1 46 46 ASP H H 46 10.040 10.040 7.825 2.215 19163 2890 1 8 . 1 1 47 47 LYS N N 47 117.416 117.416 118.382 -0.966 19163 2891 1 8 . 1 1 47 47 LYS HA H 47 4.315 4.315 4.356 -0.041 19163 2892 1 8 . 1 1 47 47 LYS C C 47 176.355 176.355 176.314 0.041 19163 2893 1 8 . 1 1 47 47 LYS CA C 47 55.880 55.880 57.278 -1.398 19163 2894 1 8 . 1 1 47 47 LYS CB C 47 33.778 33.778 34.637 -0.859 19163 2895 1 8 . 1 1 47 47 LYS H H 47 7.826 7.826 7.561 0.265 19163 2896 1 8 . 1 1 48 48 ASN N N 48 116.573 116.573 118.960 -2.387 19163 2897 1 8 . 1 1 48 48 ASN HA H 48 5.021 5.021 5.157 -0.136 19163 2898 1 8 . 1 1 48 48 ASN C C 48 172.992 172.992 173.253 -0.261 19163 2899 1 8 . 1 1 48 48 ASN CA C 48 50.467 50.467 51.028 -0.561 19163 2900 1 8 . 1 1 48 48 ASN CB C 48 39.284 39.284 39.924 -0.640 19163 2901 1 8 . 1 1 48 48 ASN H H 48 7.956 7.956 8.301 -0.345 19163 2902 1 8 . 1 1 49 49 PRO HA H 49 4.448 4.448 4.392 0.056 19163 2903 1 8 . 1 1 49 49 PRO C C 49 178.030 178.030 178.223 -0.193 19163 2904 1 8 . 1 1 49 49 PRO CA C 49 64.468 64.468 64.798 -0.330 19163 2905 1 8 . 1 1 49 49 PRO CB C 49 32.173 32.173 32.324 -0.151 19163 2906 1 8 . 1 1 50 50 ASN N N 50 115.567 115.567 117.405 -1.838 19163 2907 1 8 . 1 1 50 50 ASN HA H 50 4.748 4.748 4.510 0.238 19163 2908 1 8 . 1 1 50 50 ASN C C 50 176.443 176.443 176.954 -0.511 19163 2909 1 8 . 1 1 50 50 ASN CA C 50 54.677 54.677 55.809 -1.131 19163 2910 1 8 . 1 1 50 50 ASN CB C 50 39.014 39.014 38.208 0.806 19163 2911 1 8 . 1 1 50 50 ASN H H 50 8.398 8.398 8.630 -0.232 19163 2912 1 8 . 1 1 51 51 GLU N N 51 119.270 119.270 118.499 0.771 19163 2913 1 8 . 1 1 51 51 GLU HA H 51 4.797 4.797 4.371 0.426 19163 2914 1 8 . 1 1 51 51 GLU C C 51 176.922 176.922 177.844 -0.922 19163 2915 1 8 . 1 1 51 51 GLU CA C 51 55.916 55.916 56.595 -0.679 19163 2916 1 8 . 1 1 51 51 GLU CB C 51 29.200 29.200 29.023 0.177 19163 2917 1 8 . 1 1 51 51 GLU H H 51 7.485 7.485 7.739 -0.254 19163 2918 1 8 . 1 1 52 52 GLY N N 52 107.541 107.541 108.285 -0.744 19163 2919 1 8 . 1 1 52 52 GLY C C 52 176.755 176.755 175.409 1.346 19163 2920 1 8 . 1 1 52 52 GLY CA C 52 47.914 47.914 47.095 0.819 19163 2921 1 8 . 1 1 52 52 GLY H H 52 8.092 8.092 7.722 0.370 19163 2922 1 8 . 1 1 53 53 GLU N N 53 121.603 121.603 120.883 0.720 19163 2923 1 8 . 1 1 53 53 GLU HA H 53 4.065 4.065 4.075 -0.010 19163 2924 1 8 . 1 1 53 53 GLU C C 53 179.052 179.052 178.645 0.407 19163 2925 1 8 . 1 1 53 53 GLU CA C 53 59.280 59.280 59.334 -0.054 19163 2926 1 8 . 1 1 53 53 GLU CB C 53 28.968 28.968 29.376 -0.408 19163 2927 1 8 . 1 1 53 53 GLU H H 53 8.496 8.496 8.167 0.329 19163 2928 1 8 . 1 1 54 54 LYS N N 54 120.837 120.837 118.793 2.044 19163 2929 1 8 . 1 1 54 54 LYS HA H 54 3.923 3.923 4.018 -0.095 19163 2930 1 8 . 1 1 54 54 LYS C C 54 179.058 179.058 178.992 0.066 19163 2931 1 8 . 1 1 54 54 LYS CA C 54 58.800 58.800 58.938 -0.138 19163 2932 1 8 . 1 1 54 54 LYS CB C 54 31.551 31.551 32.145 -0.595 19163 2933 1 8 . 1 1 54 54 LYS H H 54 7.857 7.857 7.297 0.560 19163 2934 1 8 . 1 1 55 55 PHE N N 55 118.608 118.608 120.828 -2.220 19163 2935 1 8 . 1 1 55 55 PHE HA H 55 4.021 4.021 4.194 -0.173 19163 2936 1 8 . 1 1 55 55 PHE C C 55 178.001 178.001 176.923 1.078 19163 2937 1 8 . 1 1 55 55 PHE CA C 55 61.911 61.911 60.862 1.048 19163 2938 1 8 . 1 1 55 55 PHE CB C 55 38.553 38.553 39.129 -0.576 19163 2939 1 8 . 1 1 55 55 PHE H H 55 8.382 8.382 8.166 0.216 19163 2940 1 8 . 1 1 56 56 LYS N N 56 120.898 120.898 119.868 1.030 19163 2941 1 8 . 1 1 56 56 LYS HA H 56 3.828 3.828 3.872 -0.044 19163 2942 1 8 . 1 1 56 56 LYS C C 56 178.817 178.817 178.511 0.306 19163 2943 1 8 . 1 1 56 56 LYS CA C 56 59.877 59.877 60.431 -0.554 19163 2944 1 8 . 1 1 56 56 LYS CB C 56 32.133 32.133 32.063 0.070 19163 2945 1 8 . 1 1 56 56 LYS H H 56 8.111 8.111 8.072 0.039 19163 2946 1 8 . 1 1 57 57 GLN N N 57 118.600 118.600 118.009 0.591 19163 2947 1 8 . 1 1 57 57 GLN HA H 57 4.009 4.009 4.048 -0.039 19163 2948 1 8 . 1 1 57 57 GLN C C 57 179.333 179.333 178.693 0.640 19163 2949 1 8 . 1 1 57 57 GLN CA C 57 59.109 59.109 58.746 0.363 19163 2950 1 8 . 1 1 57 57 GLN CB C 57 28.595 28.595 28.578 0.017 19163 2951 1 8 . 1 1 57 57 GLN H H 57 7.613 7.613 7.611 0.002 19163 2952 1 8 . 1 1 58 58 ILE N N 58 118.709 118.709 120.674 -1.965 19163 2953 1 8 . 1 1 58 58 ILE HA H 58 3.559 3.559 3.631 -0.072 19163 2954 1 8 . 1 1 58 58 ILE C C 58 177.152 177.152 177.965 -0.813 19163 2955 1 8 . 1 1 58 58 ILE CA C 58 65.068 65.068 65.715 -0.647 19163 2956 1 8 . 1 1 58 58 ILE CB C 58 38.381 38.381 37.630 0.751 19163 2957 1 8 . 1 1 58 58 ILE H H 58 8.011 8.011 7.510 0.501 19163 2958 1 8 . 1 1 59 59 SER N N 59 116.112 116.112 115.227 0.885 19163 2959 1 8 . 1 1 59 59 SER HA H 59 3.948 3.948 4.044 -0.096 19163 2960 1 8 . 1 1 59 59 SER C C 59 175.949 175.949 177.193 -1.244 19163 2961 1 8 . 1 1 59 59 SER CA C 59 62.315 62.315 62.268 0.047 19163 2962 1 8 . 1 1 59 59 SER H H 59 8.030 8.030 8.190 -0.160 19163 2963 1 8 . 1 1 60 60 GLN N N 60 122.099 122.099 120.452 1.647 19163 2964 1 8 . 1 1 60 60 GLN HA H 60 3.801 3.801 4.055 -0.254 19163 2965 1 8 . 1 1 60 60 GLN C C 60 176.942 176.942 178.395 -1.453 19163 2966 1 8 . 1 1 60 60 GLN CA C 60 58.762 58.762 58.661 0.101 19163 2967 1 8 . 1 1 60 60 GLN CB C 60 28.498 28.498 28.726 -0.228 19163 2968 1 8 . 1 1 60 60 GLN H H 60 7.933 7.933 7.639 0.294 19163 2969 1 8 . 1 1 61 61 ALA N N 61 119.367 119.367 122.811 -3.444 19163 2970 1 8 . 1 1 61 61 ALA HA H 61 2.636 2.636 4.017 -1.381 19163 2971 1 8 . 1 1 61 61 ALA C C 61 178.507 178.507 179.358 -0.851 19163 2972 1 8 . 1 1 61 61 ALA CA C 61 54.126 54.126 55.051 -0.925 19163 2973 1 8 . 1 1 61 61 ALA CB C 61 18.462 18.462 18.385 0.077 19163 2974 1 8 . 1 1 61 61 ALA H H 61 7.354 7.354 7.858 -0.504 19163 2975 1 8 . 1 1 62 62 TYR N N 62 115.613 115.613 120.052 -4.439 19163 2976 1 8 . 1 1 62 62 TYR HA H 62 3.633 3.633 3.948 -0.315 19163 2977 1 8 . 1 1 62 62 TYR C C 62 177.421 177.421 177.326 0.095 19163 2978 1 8 . 1 1 62 62 TYR CA C 62 61.676 61.676 61.090 0.586 19163 2979 1 8 . 1 1 62 62 TYR CB C 62 39.162 39.162 37.976 1.186 19163 2980 1 8 . 1 1 62 62 TYR H H 62 7.994 7.994 8.790 -0.796 19163 2981 1 8 . 1 1 63 63 GLU N N 63 121.396 121.396 119.152 2.244 19163 2982 1 8 . 1 1 63 63 GLU HA H 63 3.347 3.347 3.598 -0.251 19163 2983 1 8 . 1 1 63 63 GLU C C 63 177.687 177.687 179.055 -1.368 19163 2984 1 8 . 1 1 63 63 GLU CA C 63 59.562 59.562 59.276 0.286 19163 2985 1 8 . 1 1 63 63 GLU CB C 63 29.115 29.115 29.236 -0.121 19163 2986 1 8 . 1 1 63 63 GLU H H 63 8.151 8.151 7.734 0.417 19163 2987 1 8 . 1 1 64 64 VAL N N 64 115.850 115.850 119.027 -3.177 19163 2988 1 8 . 1 1 64 64 VAL HA H 64 3.377 3.377 3.716 -0.339 19163 2989 1 8 . 1 1 64 64 VAL C C 64 175.925 175.925 177.461 -1.536 19163 2990 1 8 . 1 1 64 64 VAL CA C 64 65.806 65.806 65.147 0.659 19163 2991 1 8 . 1 1 64 64 VAL CB C 64 31.786 31.786 31.842 -0.056 19163 2992 1 8 . 1 1 64 64 VAL H H 64 6.814 6.814 7.258 -0.444 19163 2993 1 8 . 1 1 65 65 LEU N N 65 111.438 111.438 121.173 -9.735 19163 2994 1 8 . 1 1 65 65 LEU HA H 65 3.569 3.569 3.892 -0.323 19163 2995 1 8 . 1 1 65 65 LEU C C 65 177.124 177.124 178.325 -1.201 19163 2996 1 8 . 1 1 65 65 LEU CA C 65 56.645 56.645 57.482 -0.837 19163 2997 1 8 . 1 1 65 65 LEU CB C 65 42.589 42.589 40.969 1.620 19163 2998 1 8 . 1 1 65 65 LEU H H 65 7.398 7.398 8.360 -0.962 19163 2999 1 8 . 1 1 66 66 SER N N 66 108.642 108.642 112.639 -3.997 19163 3000 1 8 . 1 1 66 66 SER HA H 66 4.028 4.028 4.065 -0.037 19163 3001 1 8 . 1 1 66 66 SER C C 66 173.286 173.286 173.647 -0.361 19163 3002 1 8 . 1 1 66 66 SER CA C 66 59.232 59.232 59.666 -0.434 19163 3003 1 8 . 1 1 66 66 SER CB C 66 63.066 63.066 62.911 0.155 19163 3004 1 8 . 1 1 66 66 SER H H 66 7.700 7.700 7.693 0.007 19163 3005 1 8 . 1 1 67 67 ASP N N 67 124.276 124.276 119.262 5.014 19163 3006 1 8 . 1 1 67 67 ASP HA H 67 4.668 4.668 4.757 -0.089 19163 3007 1 8 . 1 1 67 67 ASP C C 67 174.913 174.913 175.133 -0.220 19163 3008 1 8 . 1 1 67 67 ASP CA C 67 52.487 52.487 52.802 -0.315 19163 3009 1 8 . 1 1 67 67 ASP CB C 67 43.218 43.218 42.855 0.363 19163 3010 1 8 . 1 1 67 67 ASP H H 67 6.879 6.879 7.360 -0.481 19163 3011 1 8 . 1 1 68 68 ALA N N 68 127.326 127.326 130.484 -3.158 19163 3012 1 8 . 1 1 68 68 ALA HA H 68 3.853 3.853 3.929 -0.076 19163 3013 1 8 . 1 1 68 68 ALA C C 68 180.336 180.336 178.702 1.634 19163 3014 1 8 . 1 1 68 68 ALA CA C 68 55.912 55.912 55.446 0.466 19163 3015 1 8 . 1 1 68 68 ALA CB C 68 18.645 18.645 18.751 -0.106 19163 3016 1 8 . 1 1 68 68 ALA H H 68 8.693 8.693 8.962 -0.269 19163 3017 1 8 . 1 1 69 69 LYS N N 69 116.929 116.929 117.813 -0.884 19163 3018 1 8 . 1 1 69 69 LYS HA H 69 4.162 4.162 4.007 0.155 19163 3019 1 8 . 1 1 69 69 LYS C C 69 179.515 179.515 178.366 1.149 19163 3020 1 8 . 1 1 69 69 LYS CA C 69 58.562 58.562 59.586 -1.024 19163 3021 1 8 . 1 1 69 69 LYS CB C 69 31.840 31.840 32.352 -0.512 19163 3022 1 8 . 1 1 69 69 LYS H H 69 7.950 7.950 7.961 -0.011 19163 3023 1 8 . 1 1 70 70 LYS N N 70 121.286 121.286 119.027 2.259 19163 3024 1 8 . 1 1 70 70 LYS HA H 70 3.960 3.960 3.949 0.011 19163 3025 1 8 . 1 1 70 70 LYS C C 70 179.938 179.938 179.013 0.925 19163 3026 1 8 . 1 1 70 70 LYS CA C 70 60.066 60.066 59.478 0.588 19163 3027 1 8 . 1 1 70 70 LYS CB C 70 32.695 32.695 32.281 0.414 19163 3028 1 8 . 1 1 70 70 LYS H H 70 8.184 8.184 7.945 0.239 19163 3029 1 8 . 1 1 71 71 ARG N N 71 122.794 122.794 119.784 3.010 19163 3030 1 8 . 1 1 71 71 ARG HA H 71 3.668 3.668 3.891 -0.223 19163 3031 1 8 . 1 1 71 71 ARG C C 71 177.356 177.356 178.269 -0.913 19163 3032 1 8 . 1 1 71 71 ARG CA C 71 60.127 60.127 60.127 -0.000 19163 3033 1 8 . 1 1 71 71 ARG CB C 71 29.668 29.668 30.160 -0.492 19163 3034 1 8 . 1 1 71 71 ARG H H 71 9.290 9.290 8.527 0.763 19163 3035 1 8 . 1 1 72 72 GLU N N 72 118.390 118.390 119.676 -1.286 19163 3036 1 8 . 1 1 72 72 GLU HA H 72 4.096 4.096 4.081 0.015 19163 3037 1 8 . 1 1 72 72 GLU C C 72 179.073 179.073 178.971 0.102 19163 3038 1 8 . 1 1 72 72 GLU CA C 72 59.456 59.456 59.357 0.099 19163 3039 1 8 . 1 1 72 72 GLU CB C 72 29.615 29.615 29.730 -0.115 19163 3040 1 8 . 1 1 72 72 GLU H H 72 7.607 7.607 7.823 -0.216 19163 3041 1 8 . 1 1 73 73 LEU N N 73 117.921 117.921 119.815 -1.894 19163 3042 1 8 . 1 1 73 73 LEU HA H 73 4.032 4.032 3.976 0.056 19163 3043 1 8 . 1 1 73 73 LEU C C 73 179.696 179.696 179.354 0.342 19163 3044 1 8 . 1 1 73 73 LEU CA C 73 57.597 57.597 57.656 -0.059 19163 3045 1 8 . 1 1 73 73 LEU CB C 73 41.815 41.815 41.819 -0.004 19163 3046 1 8 . 1 1 73 73 LEU H H 73 7.398 7.398 8.159 -0.761 19163 3047 1 8 . 1 1 74 74 TYR N N 74 122.662 122.662 119.426 3.236 19163 3048 1 8 . 1 1 74 74 TYR HA H 74 4.092 4.092 4.060 0.032 19163 3049 1 8 . 1 1 74 74 TYR C C 74 178.166 178.166 178.597 -0.431 19163 3050 1 8 . 1 1 74 74 TYR CA C 74 61.458 61.458 60.866 0.592 19163 3051 1 8 . 1 1 74 74 TYR CB C 74 38.778 38.778 38.135 0.643 19163 3052 1 8 . 1 1 74 74 TYR H H 74 8.316 8.316 8.738 -0.422 19163 3053 1 8 . 1 1 75 75 ASP N N 75 118.842 118.842 119.927 -1.085 19163 3054 1 8 . 1 1 75 75 ASP HA H 75 4.423 4.423 4.400 0.023 19163 3055 1 8 . 1 1 75 75 ASP C C 75 177.726 177.726 177.605 0.121 19163 3056 1 8 . 1 1 75 75 ASP CA C 75 56.177 56.177 56.709 -0.532 19163 3057 1 8 . 1 1 75 75 ASP CB C 75 40.800 40.800 40.936 -0.136 19163 3058 1 8 . 1 1 75 75 ASP H H 75 8.770 8.770 7.931 0.839 19163 3059 1 8 . 1 1 76 76 LYS N N 76 118.955 118.955 117.406 1.549 19163 3060 1 8 . 1 1 76 76 LYS HA H 76 4.130 4.130 4.300 -0.170 19163 3061 1 8 . 1 1 76 76 LYS C C 76 177.006 177.006 177.082 -0.076 19163 3062 1 8 . 1 1 76 76 LYS CA C 76 57.537 57.537 56.322 1.215 19163 3063 1 8 . 1 1 76 76 LYS CB C 76 33.136 33.136 33.020 0.116 19163 3064 1 8 . 1 1 76 76 LYS H H 76 7.610 7.610 7.662 -0.052 19163 3065 1 9 . 1 1 11 11 MET HA H 11 4.346 4.346 4.667 -0.321 19163 3066 1 9 . 1 1 11 11 MET C C 11 175.801 175.801 175.594 0.207 19163 3067 1 9 . 1 1 11 11 MET CA C 11 55.614 55.614 54.114 1.500 19163 3068 1 9 . 1 1 11 11 MET CB C 11 32.925 32.925 32.590 0.335 19163 3069 1 9 . 1 1 12 12 VAL N N 12 121.226 121.226 125.478 -4.252 19163 3070 1 9 . 1 1 12 12 VAL HA H 12 4.026 4.026 4.136 -0.110 19163 3071 1 9 . 1 1 12 12 VAL C C 12 175.701 175.701 175.459 0.242 19163 3072 1 9 . 1 1 12 12 VAL CA C 12 62.188 62.188 62.236 -0.048 19163 3073 1 9 . 1 1 12 12 VAL CB C 12 32.882 32.882 32.180 0.702 19163 3074 1 9 . 1 1 12 12 VAL H H 12 7.988 7.988 8.526 -0.538 19163 3075 1 9 . 1 1 13 13 LYS N N 13 125.255 125.255 129.111 -3.856 19163 3076 1 9 . 1 1 13 13 LYS HA H 13 4.211 4.211 4.522 -0.311 19163 3077 1 9 . 1 1 13 13 LYS C C 13 176.121 176.121 175.761 0.360 19163 3078 1 9 . 1 1 13 13 LYS CA C 13 56.355 56.355 55.792 0.563 19163 3079 1 9 . 1 1 13 13 LYS CB C 13 33.019 33.019 32.839 0.180 19163 3080 1 9 . 1 1 13 13 LYS H H 13 8.281 8.281 8.574 -0.293 19163 3081 1 9 . 1 1 14 14 GLU N N 14 123.004 123.004 123.617 -0.613 19163 3082 1 9 . 1 1 14 14 GLU HA H 14 4.305 4.305 4.035 0.270 19163 3083 1 9 . 1 1 14 14 GLU C C 14 176.107 176.107 175.305 0.802 19163 3084 1 9 . 1 1 14 14 GLU CA C 14 56.343 56.343 56.466 -0.123 19163 3085 1 9 . 1 1 14 14 GLU CB C 14 30.534 30.534 29.576 0.959 19163 3086 1 9 . 1 1 14 14 GLU H H 14 8.424 8.424 8.635 -0.211 19163 3087 1 9 . 1 1 15 15 THR N N 15 115.895 115.895 117.284 -1.389 19163 3088 1 9 . 1 1 15 15 THR HA H 15 4.538 4.538 4.366 0.172 19163 3089 1 9 . 1 1 15 15 THR C C 15 175.233 175.233 173.781 1.452 19163 3090 1 9 . 1 1 15 15 THR CA C 15 61.981 61.981 62.044 -0.063 19163 3091 1 9 . 1 1 15 15 THR CB C 15 69.865 69.865 69.547 0.318 19163 3092 1 9 . 1 1 15 15 THR H H 15 8.335 8.335 8.221 0.114 19163 3093 1 9 . 1 1 16 16 THR N N 16 116.992 116.992 116.935 0.057 19163 3094 1 9 . 1 1 16 16 THR HA H 16 4.366 4.366 4.477 -0.111 19163 3095 1 9 . 1 1 16 16 THR C C 16 176.090 176.090 174.357 1.733 19163 3096 1 9 . 1 1 16 16 THR CA C 16 62.172 62.172 60.202 1.970 19163 3097 1 9 . 1 1 16 16 THR CB C 16 71.997 71.997 70.389 1.608 19163 3098 1 9 . 1 1 16 16 THR H H 16 8.798 8.798 7.942 0.856 19163 3099 1 9 . 1 1 17 17 TYR N N 17 117.617 117.617 122.218 -4.601 19163 3100 1 9 . 1 1 17 17 TYR HA H 17 4.329 4.329 4.337 -0.008 19163 3101 1 9 . 1 1 17 17 TYR C C 17 177.105 177.105 177.932 -0.827 19163 3102 1 9 . 1 1 17 17 TYR CA C 17 57.577 57.577 61.737 -4.160 19163 3103 1 9 . 1 1 17 17 TYR CB C 17 37.113 37.113 38.123 -1.010 19163 3104 1 9 . 1 1 17 17 TYR H H 17 8.292 8.292 9.074 -0.782 19163 3105 1 9 . 1 1 18 18 TYR N N 18 115.048 115.048 117.824 -2.776 19163 3106 1 9 . 1 1 18 18 TYR HA H 18 3.775 3.775 4.227 -0.452 19163 3107 1 9 . 1 1 18 18 TYR C C 18 177.771 177.771 177.832 -0.061 19163 3108 1 9 . 1 1 18 18 TYR CA C 18 61.430 61.430 62.052 -0.622 19163 3109 1 9 . 1 1 18 18 TYR CB C 18 36.495 36.495 37.635 -1.140 19163 3110 1 9 . 1 1 18 18 TYR H H 18 7.047 7.047 7.964 -0.917 19163 3111 1 9 . 1 1 19 19 ASP N N 19 119.520 119.520 119.544 -0.024 19163 3112 1 9 . 1 1 19 19 ASP HA H 19 4.406 4.406 4.396 0.010 19163 3113 1 9 . 1 1 19 19 ASP C C 19 180.128 180.128 178.483 1.645 19163 3114 1 9 . 1 1 19 19 ASP CA C 19 57.475 57.475 57.562 -0.087 19163 3115 1 9 . 1 1 19 19 ASP CB C 19 40.659 40.659 40.862 -0.203 19163 3116 1 9 . 1 1 19 19 ASP H H 19 7.685 7.685 7.697 -0.012 19163 3117 1 9 . 1 1 20 20 VAL N N 20 119.772 119.772 119.681 0.091 19163 3118 1 9 . 1 1 20 20 VAL HA H 20 3.608 3.608 3.696 -0.088 19163 3119 1 9 . 1 1 20 20 VAL C C 20 177.026 177.026 178.103 -1.077 19163 3120 1 9 . 1 1 20 20 VAL CA C 20 65.840 65.840 66.212 -0.372 19163 3121 1 9 . 1 1 20 20 VAL CB C 20 31.530 31.530 31.965 -0.435 19163 3122 1 9 . 1 1 20 20 VAL H H 20 8.004 8.004 8.374 -0.370 19163 3123 1 9 . 1 1 21 21 LEU N N 21 115.252 115.252 117.442 -2.190 19163 3124 1 9 . 1 1 21 21 LEU HA H 21 4.281 4.281 4.269 0.012 19163 3125 1 9 . 1 1 21 21 LEU C C 21 175.757 175.757 176.626 -0.869 19163 3126 1 9 . 1 1 21 21 LEU CA C 21 54.554 54.554 54.695 -0.141 19163 3127 1 9 . 1 1 21 21 LEU CB C 21 42.869 42.869 42.234 0.635 19163 3128 1 9 . 1 1 21 21 LEU H H 21 6.847 6.847 7.852 -1.005 19163 3129 1 9 . 1 1 22 22 GLY N N 22 108.227 108.227 107.780 0.447 19163 3130 1 9 . 1 1 22 22 GLY C C 22 175.361 175.361 174.377 0.984 19163 3131 1 9 . 1 1 22 22 GLY CA C 22 46.574 46.574 45.910 0.664 19163 3132 1 9 . 1 1 22 22 GLY H H 22 7.874 7.874 7.258 0.616 19163 3133 1 9 . 1 1 23 23 VAL N N 23 110.675 110.675 118.909 -8.234 19163 3134 1 9 . 1 1 23 23 VAL HA H 23 4.767 4.767 4.392 0.375 19163 3135 1 9 . 1 1 23 23 VAL C C 23 174.674 174.674 174.456 0.218 19163 3136 1 9 . 1 1 23 23 VAL CA C 23 58.349 58.349 59.935 -1.586 19163 3137 1 9 . 1 1 23 23 VAL CB C 23 34.938 34.938 35.629 -0.691 19163 3138 1 9 . 1 1 23 23 VAL H H 23 7.815 7.815 8.020 -0.205 19163 3139 1 9 . 1 1 24 24 LYS N N 24 119.948 119.948 122.826 -2.878 19163 3140 1 9 . 1 1 24 24 LYS HA H 24 4.488 4.488 4.741 -0.253 19163 3141 1 9 . 1 1 24 24 LYS C C 24 175.442 175.442 175.978 -0.536 19163 3142 1 9 . 1 1 24 24 LYS CA C 24 54.001 54.001 54.389 -0.388 19163 3143 1 9 . 1 1 24 24 LYS CB C 24 32.197 32.197 31.951 0.246 19163 3144 1 9 . 1 1 24 24 LYS H H 24 8.329 8.329 8.484 -0.155 19163 3145 1 9 . 1 1 25 25 PRO HA H 25 2.421 2.421 4.421 -2.000 19163 3146 1 9 . 1 1 25 25 PRO C C 25 175.635 175.635 176.340 -0.705 19163 3147 1 9 . 1 1 25 25 PRO CA C 25 63.362 63.362 64.713 -1.351 19163 3148 1 9 . 1 1 25 25 PRO CB C 25 31.839 31.839 31.756 0.083 19163 3149 1 9 . 1 1 26 26 ASN N N 26 111.739 111.739 113.744 -2.005 19163 3150 1 9 . 1 1 26 26 ASN HA H 26 4.518 4.518 4.786 -0.268 19163 3151 1 9 . 1 1 26 26 ASN C C 26 175.820 175.820 174.629 1.191 19163 3152 1 9 . 1 1 26 26 ASN CA C 26 51.525 51.525 51.509 0.016 19163 3153 1 9 . 1 1 26 26 ASN CB C 26 36.829 36.829 37.328 -0.499 19163 3154 1 9 . 1 1 26 26 ASN H H 26 7.138 7.138 8.347 -1.209 19163 3155 1 9 . 1 1 27 27 ALA N N 27 122.829 122.829 124.326 -1.497 19163 3156 1 9 . 1 1 27 27 ALA HA H 27 4.325 4.325 4.381 -0.056 19163 3157 1 9 . 1 1 27 27 ALA C C 27 178.726 178.726 177.361 1.365 19163 3158 1 9 . 1 1 27 27 ALA CA C 27 52.961 52.961 52.492 0.469 19163 3159 1 9 . 1 1 27 27 ALA CB C 27 19.159 19.159 19.727 -0.568 19163 3160 1 9 . 1 1 27 27 ALA H H 27 7.637 7.637 7.487 0.150 19163 3161 1 9 . 1 1 28 28 THR N N 28 113.468 113.468 113.181 0.287 19163 3162 1 9 . 1 1 28 28 THR HA H 28 4.493 4.493 4.470 0.023 19163 3163 1 9 . 1 1 28 28 THR C C 28 175.641 175.641 175.626 0.015 19163 3164 1 9 . 1 1 28 28 THR CA C 28 60.592 60.592 60.245 0.346 19163 3165 1 9 . 1 1 28 28 THR CB C 28 71.304 71.304 70.129 1.175 19163 3166 1 9 . 1 1 28 28 THR H H 28 8.829 8.829 7.858 0.971 19163 3167 1 9 . 1 1 29 29 GLN N N 29 119.445 119.445 121.922 -2.477 19163 3168 1 9 . 1 1 29 29 GLN HA H 29 4.035 4.035 3.887 0.148 19163 3169 1 9 . 1 1 29 29 GLN C C 29 179.117 179.117 178.440 0.677 19163 3170 1 9 . 1 1 29 29 GLN CA C 29 59.435 59.435 59.841 -0.406 19163 3171 1 9 . 1 1 29 29 GLN CB C 29 27.851 27.851 28.555 -0.705 19163 3172 1 9 . 1 1 29 29 GLN H H 29 9.015 9.015 8.839 0.176 19163 3173 1 9 . 1 1 30 30 GLU N N 30 119.343 119.343 118.963 0.380 19163 3174 1 9 . 1 1 30 30 GLU HA H 30 4.059 4.059 4.022 0.036 19163 3175 1 9 . 1 1 30 30 GLU C C 30 179.097 179.097 178.646 0.451 19163 3176 1 9 . 1 1 30 30 GLU CA C 30 59.847 59.847 59.631 0.216 19163 3177 1 9 . 1 1 30 30 GLU CB C 30 29.356 29.356 29.383 -0.027 19163 3178 1 9 . 1 1 30 30 GLU H H 30 8.549 8.549 8.649 -0.100 19163 3179 1 9 . 1 1 31 31 GLU N N 31 120.562 120.562 120.639 -0.077 19163 3180 1 9 . 1 1 31 31 GLU HA H 31 3.906 3.906 4.119 -0.213 19163 3181 1 9 . 1 1 31 31 GLU C C 31 180.405 180.405 179.096 1.309 19163 3182 1 9 . 1 1 31 31 GLU CA C 31 59.592 59.592 59.001 0.591 19163 3183 1 9 . 1 1 31 31 GLU CB C 31 29.989 29.989 29.253 0.736 19163 3184 1 9 . 1 1 31 31 GLU H H 31 7.768 7.768 8.160 -0.392 19163 3185 1 9 . 1 1 32 32 LEU N N 32 120.518 120.518 120.332 0.186 19163 3186 1 9 . 1 1 32 32 LEU HA H 32 3.963 3.963 3.994 -0.031 19163 3187 1 9 . 1 1 32 32 LEU C C 32 177.873 177.873 179.068 -1.195 19163 3188 1 9 . 1 1 32 32 LEU CA C 32 58.593 58.593 57.693 0.900 19163 3189 1 9 . 1 1 32 32 LEU CB C 32 42.556 42.556 41.103 1.453 19163 3190 1 9 . 1 1 32 32 LEU H H 32 8.475 8.475 8.642 -0.167 19163 3191 1 9 . 1 1 33 33 LYS N N 33 119.091 119.091 119.683 -0.592 19163 3192 1 9 . 1 1 33 33 LYS HA H 33 4.000 4.000 4.189 -0.189 19163 3193 1 9 . 1 1 33 33 LYS C C 33 178.701 178.701 178.951 -0.250 19163 3194 1 9 . 1 1 33 33 LYS CA C 33 60.274 60.274 59.981 0.292 19163 3195 1 9 . 1 1 33 33 LYS CB C 33 32.656 32.656 32.357 0.299 19163 3196 1 9 . 1 1 33 33 LYS H H 33 8.077 8.077 7.796 0.281 19163 3197 1 9 . 1 1 34 34 LYS N N 34 118.527 118.527 119.190 -0.663 19163 3198 1 9 . 1 1 34 34 LYS HA H 34 3.890 3.890 4.033 -0.143 19163 3199 1 9 . 1 1 34 34 LYS C C 34 179.172 179.172 178.979 0.193 19163 3200 1 9 . 1 1 34 34 LYS CA C 34 59.927 59.927 59.395 0.532 19163 3201 1 9 . 1 1 34 34 LYS CB C 34 32.869 32.869 32.362 0.507 19163 3202 1 9 . 1 1 34 34 LYS H H 34 7.986 7.986 7.976 0.010 19163 3203 1 9 . 1 1 35 35 ALA N N 35 122.190 122.190 122.681 -0.491 19163 3204 1 9 . 1 1 35 35 ALA HA H 35 4.116 4.116 4.059 0.057 19163 3205 1 9 . 1 1 35 35 ALA C C 35 179.982 179.982 178.987 0.995 19163 3206 1 9 . 1 1 35 35 ALA CA C 35 55.157 55.157 55.213 -0.056 19163 3207 1 9 . 1 1 35 35 ALA CB C 35 18.773 18.773 18.373 0.400 19163 3208 1 9 . 1 1 35 35 ALA H H 35 7.917 7.917 8.231 -0.314 19163 3209 1 9 . 1 1 36 36 TYR N N 36 117.701 117.701 120.504 -2.803 19163 3210 1 9 . 1 1 36 36 TYR HA H 36 3.818 3.818 4.032 -0.214 19163 3211 1 9 . 1 1 36 36 TYR C C 36 176.344 176.344 177.471 -1.127 19163 3212 1 9 . 1 1 36 36 TYR CA C 36 61.468 61.468 61.477 -0.009 19163 3213 1 9 . 1 1 36 36 TYR CB C 36 38.890 38.890 38.395 0.495 19163 3214 1 9 . 1 1 36 36 TYR H H 36 8.402 8.402 7.928 0.474 19163 3215 1 9 . 1 1 37 37 ARG N N 37 117.423 117.423 119.036 -1.613 19163 3216 1 9 . 1 1 37 37 ARG HA H 37 3.481 3.481 3.658 -0.177 19163 3217 1 9 . 1 1 37 37 ARG C C 37 178.825 178.825 178.169 0.656 19163 3218 1 9 . 1 1 37 37 ARG CA C 37 59.397 59.397 59.683 -0.286 19163 3219 1 9 . 1 1 37 37 ARG CB C 37 29.710 29.710 30.069 -0.359 19163 3220 1 9 . 1 1 37 37 ARG H H 37 8.264 8.264 8.356 -0.092 19163 3221 1 9 . 1 1 38 38 LYS N N 38 117.247 117.247 120.052 -2.805 19163 3222 1 9 . 1 1 38 38 LYS HA H 38 3.905 3.905 4.021 -0.116 19163 3223 1 9 . 1 1 38 38 LYS C C 38 179.444 179.444 179.086 0.358 19163 3224 1 9 . 1 1 38 38 LYS CA C 38 59.450 59.450 59.553 -0.103 19163 3225 1 9 . 1 1 38 38 LYS CB C 38 32.609 32.609 32.280 0.329 19163 3226 1 9 . 1 1 38 38 LYS H H 38 7.444 7.444 7.797 -0.353 19163 3227 1 9 . 1 1 39 39 LEU N N 39 119.901 119.901 119.299 0.602 19163 3228 1 9 . 1 1 39 39 LEU HA H 39 4.020 4.020 4.220 -0.200 19163 3229 1 9 . 1 1 39 39 LEU C C 39 178.801 178.801 178.934 -0.133 19163 3230 1 9 . 1 1 39 39 LEU CA C 39 57.409 57.409 57.689 -0.280 19163 3231 1 9 . 1 1 39 39 LEU CB C 39 42.388 42.388 41.677 0.711 19163 3232 1 9 . 1 1 39 39 LEU H H 39 7.707 7.707 8.022 -0.315 19163 3233 1 9 . 1 1 40 40 ALA N N 40 122.772 122.772 121.516 1.256 19163 3234 1 9 . 1 1 40 40 ALA HA H 40 3.849 3.849 3.947 -0.098 19163 3235 1 9 . 1 1 40 40 ALA C C 40 179.446 179.446 179.172 0.274 19163 3236 1 9 . 1 1 40 40 ALA CA C 40 55.109 55.109 54.841 0.268 19163 3237 1 9 . 1 1 40 40 ALA CB C 40 17.116 17.116 18.173 -1.057 19163 3238 1 9 . 1 1 40 40 ALA H H 40 8.931 8.931 8.083 0.848 19163 3239 1 9 . 1 1 41 41 LEU N N 41 115.299 115.299 116.801 -1.502 19163 3240 1 9 . 1 1 41 41 LEU HA H 41 3.977 3.977 3.988 -0.011 19163 3241 1 9 . 1 1 41 41 LEU C C 41 178.216 178.216 178.447 -0.231 19163 3242 1 9 . 1 1 41 41 LEU CA C 41 57.088 57.088 57.343 -0.255 19163 3243 1 9 . 1 1 41 41 LEU CB C 41 42.162 42.162 41.942 0.220 19163 3244 1 9 . 1 1 41 41 LEU H H 41 7.133 7.133 7.778 -0.645 19163 3245 1 9 . 1 1 42 42 LYS N N 42 116.812 116.812 116.668 0.144 19163 3246 1 9 . 1 1 42 42 LYS HA H 42 3.925 3.925 4.032 -0.107 19163 3247 1 9 . 1 1 42 42 LYS C C 42 177.560 177.560 178.197 -0.637 19163 3248 1 9 . 1 1 42 42 LYS CA C 42 57.885 57.885 57.638 0.247 19163 3249 1 9 . 1 1 42 42 LYS CB C 42 33.427 33.427 32.785 0.642 19163 3250 1 9 . 1 1 42 42 LYS H H 42 7.038 7.038 7.546 -0.508 19163 3251 1 9 . 1 1 43 43 TYR N N 43 114.022 114.022 115.478 -1.456 19163 3252 1 9 . 1 1 43 43 TYR HA H 43 4.665 4.665 4.504 0.161 19163 3253 1 9 . 1 1 43 43 TYR C C 43 173.741 173.741 174.552 -0.811 19163 3254 1 9 . 1 1 43 43 TYR CA C 43 56.928 56.928 56.985 -0.057 19163 3255 1 9 . 1 1 43 43 TYR CB C 43 39.579 39.579 38.058 1.521 19163 3256 1 9 . 1 1 43 43 TYR H H 43 7.683 7.683 8.072 -0.389 19163 3257 1 9 . 1 1 44 44 HIS N N 44 120.947 120.947 122.809 -1.862 19163 3258 1 9 . 1 1 44 44 HIS HA H 44 3.697 3.697 4.157 -0.460 19163 3259 1 9 . 1 1 44 44 HIS C C 44 174.925 174.925 174.944 -0.019 19163 3260 1 9 . 1 1 44 44 HIS CA C 44 56.229 56.229 56.081 0.148 19163 3261 1 9 . 1 1 44 44 HIS CB C 44 30.852 30.852 30.583 0.269 19163 3262 1 9 . 1 1 44 44 HIS H H 44 7.814 7.814 7.643 0.171 19163 3263 1 9 . 1 1 45 45 PRO HA H 45 4.131 4.131 4.471 -0.340 19163 3264 1 9 . 1 1 45 45 PRO C C 45 177.269 177.269 178.311 -1.042 19163 3265 1 9 . 1 1 45 45 PRO CA C 45 64.723 64.723 65.370 -0.647 19163 3266 1 9 . 1 1 45 45 PRO CB C 45 32.070 32.070 32.067 0.003 19163 3267 1 9 . 1 1 46 46 ASP N N 46 119.127 119.127 117.462 1.665 19163 3268 1 9 . 1 1 46 46 ASP HA H 46 4.375 4.375 4.461 -0.086 19163 3269 1 9 . 1 1 46 46 ASP C C 46 177.284 177.284 177.526 -0.242 19163 3270 1 9 . 1 1 46 46 ASP CA C 46 56.020 56.020 56.058 -0.038 19163 3271 1 9 . 1 1 46 46 ASP CB C 46 40.221 40.221 41.002 -0.781 19163 3272 1 9 . 1 1 46 46 ASP H H 46 10.040 10.040 8.060 1.980 19163 3273 1 9 . 1 1 47 47 LYS N N 47 117.416 117.416 117.489 -0.073 19163 3274 1 9 . 1 1 47 47 LYS HA H 47 4.315 4.315 4.279 0.036 19163 3275 1 9 . 1 1 47 47 LYS C C 47 176.355 176.355 176.421 -0.066 19163 3276 1 9 . 1 1 47 47 LYS CA C 47 55.880 55.880 56.924 -1.044 19163 3277 1 9 . 1 1 47 47 LYS CB C 47 33.778 33.778 34.385 -0.607 19163 3278 1 9 . 1 1 47 47 LYS H H 47 7.826 7.826 7.529 0.297 19163 3279 1 9 . 1 1 48 48 ASN N N 48 116.573 116.573 118.807 -2.234 19163 3280 1 9 . 1 1 48 48 ASN HA H 48 5.021 5.021 5.131 -0.110 19163 3281 1 9 . 1 1 48 48 ASN C C 48 172.992 172.992 173.645 -0.653 19163 3282 1 9 . 1 1 48 48 ASN CA C 48 50.467 50.467 51.003 -0.536 19163 3283 1 9 . 1 1 48 48 ASN CB C 48 39.284 39.284 39.817 -0.533 19163 3284 1 9 . 1 1 48 48 ASN H H 48 7.956 7.956 8.421 -0.465 19163 3285 1 9 . 1 1 49 49 PRO HA H 49 4.448 4.448 4.448 0.000 19163 3286 1 9 . 1 1 49 49 PRO C C 49 178.030 178.030 178.322 -0.292 19163 3287 1 9 . 1 1 49 49 PRO CA C 49 64.468 64.468 65.099 -0.631 19163 3288 1 9 . 1 1 49 49 PRO CB C 49 32.173 32.173 32.154 0.019 19163 3289 1 9 . 1 1 50 50 ASN N N 50 115.567 115.567 116.542 -0.975 19163 3290 1 9 . 1 1 50 50 ASN HA H 50 4.748 4.748 4.570 0.178 19163 3291 1 9 . 1 1 50 50 ASN C C 50 176.443 176.443 177.041 -0.598 19163 3292 1 9 . 1 1 50 50 ASN CA C 50 54.677 54.677 55.408 -0.731 19163 3293 1 9 . 1 1 50 50 ASN CB C 50 39.014 39.014 38.157 0.857 19163 3294 1 9 . 1 1 50 50 ASN H H 50 8.398 8.398 8.691 -0.293 19163 3295 1 9 . 1 1 51 51 GLU N N 51 119.270 119.270 118.785 0.485 19163 3296 1 9 . 1 1 51 51 GLU HA H 51 4.797 4.797 4.473 0.324 19163 3297 1 9 . 1 1 51 51 GLU C C 51 176.922 176.922 178.000 -1.078 19163 3298 1 9 . 1 1 51 51 GLU CA C 51 55.916 55.916 56.429 -0.513 19163 3299 1 9 . 1 1 51 51 GLU CB C 51 29.200 29.200 29.269 -0.069 19163 3300 1 9 . 1 1 51 51 GLU H H 51 7.485 7.485 7.753 -0.268 19163 3301 1 9 . 1 1 52 52 GLY N N 52 107.541 107.541 108.343 -0.802 19163 3302 1 9 . 1 1 52 52 GLY C C 52 176.755 176.755 175.795 0.960 19163 3303 1 9 . 1 1 52 52 GLY CA C 52 47.914 47.914 46.924 0.990 19163 3304 1 9 . 1 1 52 52 GLY H H 52 8.092 8.092 7.768 0.324 19163 3305 1 9 . 1 1 53 53 GLU N N 53 121.603 121.603 120.962 0.641 19163 3306 1 9 . 1 1 53 53 GLU HA H 53 4.065 4.065 4.134 -0.069 19163 3307 1 9 . 1 1 53 53 GLU C C 53 179.052 179.052 178.674 0.378 19163 3308 1 9 . 1 1 53 53 GLU CA C 53 59.280 59.280 59.050 0.230 19163 3309 1 9 . 1 1 53 53 GLU CB C 53 28.968 28.968 29.329 -0.361 19163 3310 1 9 . 1 1 53 53 GLU H H 53 8.496 8.496 7.978 0.518 19163 3311 1 9 . 1 1 54 54 LYS N N 54 120.837 120.837 119.007 1.830 19163 3312 1 9 . 1 1 54 54 LYS HA H 54 3.923 3.923 4.041 -0.118 19163 3313 1 9 . 1 1 54 54 LYS C C 54 179.058 179.058 179.063 -0.005 19163 3314 1 9 . 1 1 54 54 LYS CA C 54 58.800 58.800 58.968 -0.168 19163 3315 1 9 . 1 1 54 54 LYS CB C 54 31.551 31.551 32.235 -0.684 19163 3316 1 9 . 1 1 54 54 LYS H H 54 7.857 7.857 7.395 0.462 19163 3317 1 9 . 1 1 55 55 PHE N N 55 118.608 118.608 120.358 -1.750 19163 3318 1 9 . 1 1 55 55 PHE HA H 55 4.021 4.021 4.178 -0.157 19163 3319 1 9 . 1 1 55 55 PHE C C 55 178.001 178.001 176.752 1.249 19163 3320 1 9 . 1 1 55 55 PHE CA C 55 61.911 61.911 60.401 1.510 19163 3321 1 9 . 1 1 55 55 PHE CB C 55 38.553 38.553 39.144 -0.591 19163 3322 1 9 . 1 1 55 55 PHE H H 55 8.382 8.382 7.912 0.470 19163 3323 1 9 . 1 1 56 56 LYS N N 56 120.898 120.898 119.842 1.056 19163 3324 1 9 . 1 1 56 56 LYS HA H 56 3.828 3.828 3.830 -0.002 19163 3325 1 9 . 1 1 56 56 LYS C C 56 178.817 178.817 178.599 0.218 19163 3326 1 9 . 1 1 56 56 LYS CA C 56 59.877 59.877 60.183 -0.306 19163 3327 1 9 . 1 1 56 56 LYS CB C 56 32.133 32.133 32.028 0.105 19163 3328 1 9 . 1 1 56 56 LYS H H 56 8.111 8.111 7.938 0.173 19163 3329 1 9 . 1 1 57 57 GLN N N 57 118.600 118.600 117.866 0.734 19163 3330 1 9 . 1 1 57 57 GLN HA H 57 4.009 4.009 4.284 -0.275 19163 3331 1 9 . 1 1 57 57 GLN C C 57 179.333 179.333 178.750 0.583 19163 3332 1 9 . 1 1 57 57 GLN CA C 57 59.109 59.109 58.690 0.420 19163 3333 1 9 . 1 1 57 57 GLN CB C 57 28.595 28.595 28.766 -0.171 19163 3334 1 9 . 1 1 57 57 GLN H H 57 7.613 7.613 7.613 0.000 19163 3335 1 9 . 1 1 58 58 ILE N N 58 118.709 118.709 120.851 -2.142 19163 3336 1 9 . 1 1 58 58 ILE HA H 58 3.559 3.559 3.592 -0.033 19163 3337 1 9 . 1 1 58 58 ILE C C 58 177.152 177.152 177.824 -0.672 19163 3338 1 9 . 1 1 58 58 ILE CA C 58 65.068 65.068 65.678 -0.610 19163 3339 1 9 . 1 1 58 58 ILE CB C 58 38.381 38.381 37.609 0.772 19163 3340 1 9 . 1 1 58 58 ILE H H 58 8.011 8.011 7.466 0.545 19163 3341 1 9 . 1 1 59 59 SER N N 59 116.112 116.112 115.146 0.966 19163 3342 1 9 . 1 1 59 59 SER HA H 59 3.948 3.948 3.884 0.064 19163 3343 1 9 . 1 1 59 59 SER C C 59 175.949 175.949 176.914 -0.965 19163 3344 1 9 . 1 1 59 59 SER CA C 59 62.315 62.315 62.080 0.235 19163 3345 1 9 . 1 1 59 59 SER H H 59 8.030 8.030 8.095 -0.065 19163 3346 1 9 . 1 1 60 60 GLN N N 60 122.099 122.099 120.315 1.784 19163 3347 1 9 . 1 1 60 60 GLN HA H 60 3.801 3.801 3.838 -0.037 19163 3348 1 9 . 1 1 60 60 GLN C C 60 176.942 176.942 177.860 -0.918 19163 3349 1 9 . 1 1 60 60 GLN CA C 60 58.762 58.762 58.533 0.229 19163 3350 1 9 . 1 1 60 60 GLN CB C 60 28.498 28.498 28.495 0.003 19163 3351 1 9 . 1 1 60 60 GLN H H 60 7.933 7.933 7.546 0.387 19163 3352 1 9 . 1 1 61 61 ALA N N 61 119.367 119.367 122.561 -3.194 19163 3353 1 9 . 1 1 61 61 ALA HA H 61 2.636 2.636 3.356 -0.720 19163 3354 1 9 . 1 1 61 61 ALA C C 61 178.507 178.507 178.718 -0.211 19163 3355 1 9 . 1 1 61 61 ALA CA C 61 54.126 54.126 54.934 -0.807 19163 3356 1 9 . 1 1 61 61 ALA CB C 61 18.462 18.462 18.374 0.088 19163 3357 1 9 . 1 1 61 61 ALA H H 61 7.354 7.354 7.599 -0.245 19163 3358 1 9 . 1 1 62 62 TYR N N 62 115.613 115.613 119.592 -3.979 19163 3359 1 9 . 1 1 62 62 TYR HA H 62 3.633 3.633 3.847 -0.214 19163 3360 1 9 . 1 1 62 62 TYR C C 62 177.421 177.421 177.540 -0.119 19163 3361 1 9 . 1 1 62 62 TYR CA C 62 61.676 61.676 61.205 0.471 19163 3362 1 9 . 1 1 62 62 TYR CB C 62 39.162 39.162 37.910 1.252 19163 3363 1 9 . 1 1 62 62 TYR H H 62 7.994 7.994 8.356 -0.362 19163 3364 1 9 . 1 1 63 63 GLU N N 63 121.396 121.396 119.672 1.724 19163 3365 1 9 . 1 1 63 63 GLU HA H 63 3.347 3.347 3.688 -0.341 19163 3366 1 9 . 1 1 63 63 GLU C C 63 177.687 177.687 178.666 -0.979 19163 3367 1 9 . 1 1 63 63 GLU CA C 63 59.562 59.562 59.394 0.168 19163 3368 1 9 . 1 1 63 63 GLU CB C 63 29.115 29.115 29.105 0.010 19163 3369 1 9 . 1 1 63 63 GLU H H 63 8.151 8.151 7.960 0.191 19163 3370 1 9 . 1 1 64 64 VAL N N 64 115.850 115.850 118.802 -2.952 19163 3371 1 9 . 1 1 64 64 VAL HA H 64 3.377 3.377 3.840 -0.463 19163 3372 1 9 . 1 1 64 64 VAL C C 64 175.925 175.925 177.800 -1.875 19163 3373 1 9 . 1 1 64 64 VAL CA C 64 65.806 65.806 65.466 0.340 19163 3374 1 9 . 1 1 64 64 VAL CB C 64 31.786 31.786 31.916 -0.130 19163 3375 1 9 . 1 1 64 64 VAL H H 64 6.814 6.814 7.158 -0.344 19163 3376 1 9 . 1 1 65 65 LEU N N 65 111.438 111.438 121.637 -10.199 19163 3377 1 9 . 1 1 65 65 LEU HA H 65 3.569 3.569 3.908 -0.339 19163 3378 1 9 . 1 1 65 65 LEU C C 65 177.124 177.124 178.445 -1.321 19163 3379 1 9 . 1 1 65 65 LEU CA C 65 56.645 56.645 57.363 -0.718 19163 3380 1 9 . 1 1 65 65 LEU CB C 65 42.589 42.589 40.723 1.866 19163 3381 1 9 . 1 1 65 65 LEU H H 65 7.398 7.398 8.413 -1.015 19163 3382 1 9 . 1 1 66 66 SER N N 66 108.642 108.642 112.048 -3.406 19163 3383 1 9 . 1 1 66 66 SER HA H 66 4.028 4.028 4.083 -0.055 19163 3384 1 9 . 1 1 66 66 SER C C 66 173.286 173.286 173.784 -0.498 19163 3385 1 9 . 1 1 66 66 SER CA C 66 59.232 59.232 59.543 -0.311 19163 3386 1 9 . 1 1 66 66 SER CB C 66 63.066 63.066 62.693 0.373 19163 3387 1 9 . 1 1 66 66 SER H H 66 7.700 7.700 7.451 0.249 19163 3388 1 9 . 1 1 67 67 ASP N N 67 124.276 124.276 120.409 3.867 19163 3389 1 9 . 1 1 67 67 ASP HA H 67 4.668 4.668 4.655 0.013 19163 3390 1 9 . 1 1 67 67 ASP C C 67 174.913 174.913 175.461 -0.548 19163 3391 1 9 . 1 1 67 67 ASP CA C 67 52.487 52.487 52.986 -0.499 19163 3392 1 9 . 1 1 67 67 ASP CB C 67 43.218 43.218 42.796 0.422 19163 3393 1 9 . 1 1 67 67 ASP H H 67 6.879 6.879 7.274 -0.395 19163 3394 1 9 . 1 1 68 68 ALA N N 68 127.326 127.326 130.125 -2.799 19163 3395 1 9 . 1 1 68 68 ALA HA H 68 3.853 3.853 3.959 -0.106 19163 3396 1 9 . 1 1 68 68 ALA C C 68 180.336 180.336 178.772 1.564 19163 3397 1 9 . 1 1 68 68 ALA CA C 68 55.912 55.912 55.363 0.549 19163 3398 1 9 . 1 1 68 68 ALA CB C 68 18.645 18.645 18.904 -0.259 19163 3399 1 9 . 1 1 68 68 ALA H H 68 8.693 8.693 8.538 0.155 19163 3400 1 9 . 1 1 69 69 LYS N N 69 116.929 116.929 118.498 -1.569 19163 3401 1 9 . 1 1 69 69 LYS HA H 69 4.162 4.162 4.043 0.119 19163 3402 1 9 . 1 1 69 69 LYS C C 69 179.515 179.515 178.701 0.814 19163 3403 1 9 . 1 1 69 69 LYS CA C 69 58.562 58.562 59.370 -0.808 19163 3404 1 9 . 1 1 69 69 LYS CB C 69 31.840 31.840 32.323 -0.483 19163 3405 1 9 . 1 1 69 69 LYS H H 69 7.950 7.950 7.906 0.044 19163 3406 1 9 . 1 1 70 70 LYS N N 70 121.286 121.286 119.198 2.088 19163 3407 1 9 . 1 1 70 70 LYS HA H 70 3.960 3.960 3.954 0.006 19163 3408 1 9 . 1 1 70 70 LYS C C 70 179.938 179.938 179.037 0.901 19163 3409 1 9 . 1 1 70 70 LYS CA C 70 60.066 60.066 59.617 0.449 19163 3410 1 9 . 1 1 70 70 LYS CB C 70 32.695 32.695 32.283 0.412 19163 3411 1 9 . 1 1 70 70 LYS H H 70 8.184 8.184 8.422 -0.238 19163 3412 1 9 . 1 1 71 71 ARG N N 71 122.794 122.794 119.771 3.023 19163 3413 1 9 . 1 1 71 71 ARG HA H 71 3.668 3.668 4.015 -0.347 19163 3414 1 9 . 1 1 71 71 ARG C C 71 177.356 177.356 178.069 -0.713 19163 3415 1 9 . 1 1 71 71 ARG CA C 71 60.127 60.127 59.774 0.353 19163 3416 1 9 . 1 1 71 71 ARG CB C 71 29.668 29.668 30.160 -0.492 19163 3417 1 9 . 1 1 71 71 ARG H H 71 9.290 9.290 8.536 0.754 19163 3418 1 9 . 1 1 72 72 GLU N N 72 118.390 118.390 119.804 -1.414 19163 3419 1 9 . 1 1 72 72 GLU HA H 72 4.096 4.096 4.143 -0.047 19163 3420 1 9 . 1 1 72 72 GLU C C 72 179.073 179.073 179.172 -0.099 19163 3421 1 9 . 1 1 72 72 GLU CA C 72 59.456 59.456 59.269 0.187 19163 3422 1 9 . 1 1 72 72 GLU CB C 72 29.615 29.615 29.505 0.111 19163 3423 1 9 . 1 1 72 72 GLU H H 72 7.607 7.607 7.743 -0.136 19163 3424 1 9 . 1 1 73 73 LEU N N 73 117.921 117.921 119.919 -1.998 19163 3425 1 9 . 1 1 73 73 LEU HA H 73 4.032 4.032 4.000 0.032 19163 3426 1 9 . 1 1 73 73 LEU C C 73 179.696 179.696 179.109 0.587 19163 3427 1 9 . 1 1 73 73 LEU CA C 73 57.597 57.597 57.623 -0.026 19163 3428 1 9 . 1 1 73 73 LEU CB C 73 41.815 41.815 41.719 0.096 19163 3429 1 9 . 1 1 73 73 LEU H H 73 7.398 7.398 8.034 -0.636 19163 3430 1 9 . 1 1 74 74 TYR N N 74 122.662 122.662 119.992 2.670 19163 3431 1 9 . 1 1 74 74 TYR HA H 74 4.092 4.092 4.078 0.014 19163 3432 1 9 . 1 1 74 74 TYR C C 74 178.166 178.166 178.153 0.013 19163 3433 1 9 . 1 1 74 74 TYR CA C 74 61.458 61.458 61.625 -0.167 19163 3434 1 9 . 1 1 74 74 TYR CB C 74 38.778 38.778 38.443 0.335 19163 3435 1 9 . 1 1 74 74 TYR H H 74 8.316 8.316 8.316 -0.000 19163 3436 1 9 . 1 1 75 75 ASP N N 75 118.842 118.842 119.382 -0.540 19163 3437 1 9 . 1 1 75 75 ASP HA H 75 4.423 4.423 4.412 0.011 19163 3438 1 9 . 1 1 75 75 ASP C C 75 177.726 177.726 177.319 0.407 19163 3439 1 9 . 1 1 75 75 ASP CA C 75 56.177 56.177 57.004 -0.827 19163 3440 1 9 . 1 1 75 75 ASP CB C 75 40.800 40.800 40.680 0.120 19163 3441 1 9 . 1 1 75 75 ASP H H 75 8.770 8.770 8.405 0.365 19163 3442 1 9 . 1 1 76 76 LYS N N 76 118.955 118.955 118.666 0.289 19163 3443 1 9 . 1 1 76 76 LYS HA H 76 4.130 4.130 4.316 -0.186 19163 3444 1 9 . 1 1 76 76 LYS C C 76 177.006 177.006 177.127 -0.121 19163 3445 1 9 . 1 1 76 76 LYS CA C 76 57.537 57.537 56.503 1.034 19163 3446 1 9 . 1 1 76 76 LYS CB C 76 33.136 33.136 33.517 -0.381 19163 3447 1 9 . 1 1 76 76 LYS H H 76 7.610 7.610 7.585 0.025 19163 3448 1 10 . 1 1 11 11 MET HA H 11 4.346 4.346 4.573 -0.227 19163 3449 1 10 . 1 1 11 11 MET C C 11 175.801 175.801 176.324 -0.523 19163 3450 1 10 . 1 1 11 11 MET CA C 11 55.614 55.614 55.057 0.557 19163 3451 1 10 . 1 1 11 11 MET CB C 11 32.925 32.925 33.219 -0.294 19163 3452 1 10 . 1 1 12 12 VAL N N 12 121.226 121.226 120.746 0.480 19163 3453 1 10 . 1 1 12 12 VAL HA H 12 4.026 4.026 4.210 -0.184 19163 3454 1 10 . 1 1 12 12 VAL C C 12 175.701 175.701 175.548 0.153 19163 3455 1 10 . 1 1 12 12 VAL CA C 12 62.188 62.188 62.678 -0.490 19163 3456 1 10 . 1 1 12 12 VAL CB C 12 32.882 32.882 31.932 0.950 19163 3457 1 10 . 1 1 12 12 VAL H H 12 7.988 7.988 8.374 -0.386 19163 3458 1 10 . 1 1 13 13 LYS N N 13 125.255 125.255 127.567 -2.312 19163 3459 1 10 . 1 1 13 13 LYS HA H 13 4.211 4.211 4.383 -0.172 19163 3460 1 10 . 1 1 13 13 LYS C C 13 176.121 176.121 176.362 -0.241 19163 3461 1 10 . 1 1 13 13 LYS CA C 13 56.355 56.355 56.919 -0.563 19163 3462 1 10 . 1 1 13 13 LYS CB C 13 33.019 33.019 33.493 -0.474 19163 3463 1 10 . 1 1 13 13 LYS H H 13 8.281 8.281 8.897 -0.616 19163 3464 1 10 . 1 1 14 14 GLU N N 14 123.004 123.004 120.386 2.618 19163 3465 1 10 . 1 1 14 14 GLU HA H 14 4.305 4.305 4.445 -0.140 19163 3466 1 10 . 1 1 14 14 GLU C C 14 176.107 176.107 174.849 1.258 19163 3467 1 10 . 1 1 14 14 GLU CA C 14 56.343 56.343 56.684 -0.341 19163 3468 1 10 . 1 1 14 14 GLU CB C 14 30.534 30.534 30.186 0.348 19163 3469 1 10 . 1 1 14 14 GLU H H 14 8.424 8.424 8.088 0.336 19163 3470 1 10 . 1 1 15 15 THR N N 15 115.895 115.895 117.893 -1.998 19163 3471 1 10 . 1 1 15 15 THR HA H 15 4.538 4.538 4.728 -0.190 19163 3472 1 10 . 1 1 15 15 THR C C 15 175.233 175.233 174.146 1.087 19163 3473 1 10 . 1 1 15 15 THR CA C 15 61.981 61.981 62.296 -0.315 19163 3474 1 10 . 1 1 15 15 THR CB C 15 69.865 69.865 69.105 0.760 19163 3475 1 10 . 1 1 15 15 THR H H 15 8.335 8.335 8.275 0.060 19163 3476 1 10 . 1 1 16 16 THR N N 16 116.992 116.992 120.041 -3.049 19163 3477 1 10 . 1 1 16 16 THR HA H 16 4.366 4.366 4.492 -0.126 19163 3478 1 10 . 1 1 16 16 THR C C 16 176.090 176.090 175.220 0.870 19163 3479 1 10 . 1 1 16 16 THR CA C 16 62.172 62.172 59.310 2.862 19163 3480 1 10 . 1 1 16 16 THR CB C 16 71.997 71.997 70.335 1.662 19163 3481 1 10 . 1 1 16 16 THR H H 16 8.798 8.798 8.344 0.454 19163 3482 1 10 . 1 1 17 17 TYR N N 17 117.617 117.617 119.504 -1.887 19163 3483 1 10 . 1 1 17 17 TYR HA H 17 4.329 4.329 4.261 0.068 19163 3484 1 10 . 1 1 17 17 TYR C C 17 177.105 177.105 177.866 -0.761 19163 3485 1 10 . 1 1 17 17 TYR CA C 17 57.577 57.577 62.096 -4.519 19163 3486 1 10 . 1 1 17 17 TYR CB C 17 37.113 37.113 38.234 -1.121 19163 3487 1 10 . 1 1 17 17 TYR H H 17 8.292 8.292 9.021 -0.729 19163 3488 1 10 . 1 1 18 18 TYR N N 18 115.048 115.048 117.773 -2.725 19163 3489 1 10 . 1 1 18 18 TYR HA H 18 3.775 3.775 4.333 -0.558 19163 3490 1 10 . 1 1 18 18 TYR C C 18 177.771 177.771 177.645 0.126 19163 3491 1 10 . 1 1 18 18 TYR CA C 18 61.430 61.430 61.832 -0.402 19163 3492 1 10 . 1 1 18 18 TYR CB C 18 36.495 36.495 37.353 -0.858 19163 3493 1 10 . 1 1 18 18 TYR H H 18 7.047 7.047 8.190 -1.143 19163 3494 1 10 . 1 1 19 19 ASP N N 19 119.520 119.520 119.106 0.414 19163 3495 1 10 . 1 1 19 19 ASP HA H 19 4.406 4.406 4.478 -0.072 19163 3496 1 10 . 1 1 19 19 ASP C C 19 180.128 180.128 178.619 1.509 19163 3497 1 10 . 1 1 19 19 ASP CA C 19 57.475 57.475 57.353 0.122 19163 3498 1 10 . 1 1 19 19 ASP CB C 19 40.659 40.659 40.401 0.258 19163 3499 1 10 . 1 1 19 19 ASP H H 19 7.685 7.685 8.417 -0.732 19163 3500 1 10 . 1 1 20 20 VAL N N 20 119.772 119.772 120.120 -0.348 19163 3501 1 10 . 1 1 20 20 VAL HA H 20 3.608 3.608 3.793 -0.185 19163 3502 1 10 . 1 1 20 20 VAL C C 20 177.026 177.026 177.931 -0.905 19163 3503 1 10 . 1 1 20 20 VAL CA C 20 65.840 65.840 66.358 -0.518 19163 3504 1 10 . 1 1 20 20 VAL CB C 20 31.530 31.530 31.991 -0.461 19163 3505 1 10 . 1 1 20 20 VAL H H 20 8.004 8.004 8.410 -0.406 19163 3506 1 10 . 1 1 21 21 LEU N N 21 115.252 115.252 117.963 -2.711 19163 3507 1 10 . 1 1 21 21 LEU HA H 21 4.281 4.281 4.458 -0.177 19163 3508 1 10 . 1 1 21 21 LEU C C 21 175.757 175.757 176.653 -0.896 19163 3509 1 10 . 1 1 21 21 LEU CA C 21 54.554 54.554 54.236 0.318 19163 3510 1 10 . 1 1 21 21 LEU CB C 21 42.869 42.869 42.228 0.641 19163 3511 1 10 . 1 1 21 21 LEU H H 21 6.847 6.847 7.924 -1.077 19163 3512 1 10 . 1 1 22 22 GLY N N 22 108.227 108.227 107.742 0.485 19163 3513 1 10 . 1 1 22 22 GLY C C 22 175.361 175.361 174.295 1.066 19163 3514 1 10 . 1 1 22 22 GLY CA C 22 46.574 46.574 45.669 0.905 19163 3515 1 10 . 1 1 22 22 GLY H H 22 7.874 7.874 7.333 0.541 19163 3516 1 10 . 1 1 23 23 VAL N N 23 110.675 110.675 118.815 -8.140 19163 3517 1 10 . 1 1 23 23 VAL HA H 23 4.767 4.767 4.465 0.302 19163 3518 1 10 . 1 1 23 23 VAL C C 23 174.674 174.674 174.635 0.039 19163 3519 1 10 . 1 1 23 23 VAL CA C 23 58.349 58.349 59.452 -1.103 19163 3520 1 10 . 1 1 23 23 VAL CB C 23 34.938 34.938 35.053 -0.115 19163 3521 1 10 . 1 1 23 23 VAL H H 23 7.815 7.815 8.183 -0.368 19163 3522 1 10 . 1 1 24 24 LYS N N 24 119.948 119.948 123.418 -3.470 19163 3523 1 10 . 1 1 24 24 LYS HA H 24 4.488 4.488 4.731 -0.243 19163 3524 1 10 . 1 1 24 24 LYS C C 24 175.442 175.442 176.041 -0.599 19163 3525 1 10 . 1 1 24 24 LYS CA C 24 54.001 54.001 53.062 0.939 19163 3526 1 10 . 1 1 24 24 LYS CB C 24 32.197 32.197 31.763 0.434 19163 3527 1 10 . 1 1 24 24 LYS H H 24 8.329 8.329 8.285 0.044 19163 3528 1 10 . 1 1 25 25 PRO HA H 25 2.421 2.421 4.449 -2.028 19163 3529 1 10 . 1 1 25 25 PRO C C 25 175.635 175.635 176.338 -0.703 19163 3530 1 10 . 1 1 25 25 PRO CA C 25 63.362 63.362 64.847 -1.485 19163 3531 1 10 . 1 1 25 25 PRO CB C 25 31.839 31.839 31.834 0.005 19163 3532 1 10 . 1 1 26 26 ASN N N 26 111.739 111.739 114.584 -2.845 19163 3533 1 10 . 1 1 26 26 ASN HA H 26 4.518 4.518 4.805 -0.287 19163 3534 1 10 . 1 1 26 26 ASN C C 26 175.820 175.820 174.682 1.138 19163 3535 1 10 . 1 1 26 26 ASN CA C 26 51.525 51.525 52.239 -0.714 19163 3536 1 10 . 1 1 26 26 ASN CB C 26 36.829 36.829 38.163 -1.334 19163 3537 1 10 . 1 1 26 26 ASN H H 26 7.138 7.138 8.286 -1.148 19163 3538 1 10 . 1 1 27 27 ALA N N 27 122.829 122.829 124.633 -1.804 19163 3539 1 10 . 1 1 27 27 ALA HA H 27 4.325 4.325 4.414 -0.089 19163 3540 1 10 . 1 1 27 27 ALA C C 27 178.726 178.726 177.042 1.684 19163 3541 1 10 . 1 1 27 27 ALA CA C 27 52.961 52.961 52.331 0.630 19163 3542 1 10 . 1 1 27 27 ALA CB C 27 19.159 19.159 19.401 -0.242 19163 3543 1 10 . 1 1 27 27 ALA H H 27 7.637 7.637 7.615 0.022 19163 3544 1 10 . 1 1 28 28 THR N N 28 113.468 113.468 113.432 0.036 19163 3545 1 10 . 1 1 28 28 THR HA H 28 4.493 4.493 4.411 0.082 19163 3546 1 10 . 1 1 28 28 THR C C 28 175.641 175.641 175.852 -0.211 19163 3547 1 10 . 1 1 28 28 THR CA C 28 60.592 60.592 61.277 -0.685 19163 3548 1 10 . 1 1 28 28 THR CB C 28 71.304 71.304 70.661 0.643 19163 3549 1 10 . 1 1 28 28 THR H H 28 8.829 8.829 7.849 0.980 19163 3550 1 10 . 1 1 29 29 GLN N N 29 119.445 119.445 122.130 -2.685 19163 3551 1 10 . 1 1 29 29 GLN HA H 29 4.035 4.035 3.942 0.093 19163 3552 1 10 . 1 1 29 29 GLN C C 29 179.117 179.117 178.468 0.649 19163 3553 1 10 . 1 1 29 29 GLN CA C 29 59.435 59.435 59.982 -0.547 19163 3554 1 10 . 1 1 29 29 GLN CB C 29 27.851 27.851 28.585 -0.734 19163 3555 1 10 . 1 1 29 29 GLN H H 29 9.015 9.015 8.798 0.217 19163 3556 1 10 . 1 1 30 30 GLU N N 30 119.343 119.343 118.860 0.483 19163 3557 1 10 . 1 1 30 30 GLU HA H 30 4.059 4.059 4.073 -0.014 19163 3558 1 10 . 1 1 30 30 GLU C C 30 179.097 179.097 178.649 0.448 19163 3559 1 10 . 1 1 30 30 GLU CA C 30 59.847 59.847 59.534 0.313 19163 3560 1 10 . 1 1 30 30 GLU CB C 30 29.356 29.356 29.265 0.092 19163 3561 1 10 . 1 1 30 30 GLU H H 30 8.549 8.549 8.560 -0.011 19163 3562 1 10 . 1 1 31 31 GLU N N 31 120.562 120.562 120.657 -0.095 19163 3563 1 10 . 1 1 31 31 GLU HA H 31 3.906 3.906 4.116 -0.210 19163 3564 1 10 . 1 1 31 31 GLU C C 31 180.405 180.405 179.147 1.258 19163 3565 1 10 . 1 1 31 31 GLU CA C 31 59.592 59.592 59.072 0.520 19163 3566 1 10 . 1 1 31 31 GLU CB C 31 29.989 29.989 29.259 0.730 19163 3567 1 10 . 1 1 31 31 GLU H H 31 7.768 7.768 8.180 -0.412 19163 3568 1 10 . 1 1 32 32 LEU N N 32 120.518 120.518 120.015 0.503 19163 3569 1 10 . 1 1 32 32 LEU HA H 32 3.963 3.963 3.996 -0.033 19163 3570 1 10 . 1 1 32 32 LEU C C 32 177.873 177.873 179.244 -1.371 19163 3571 1 10 . 1 1 32 32 LEU CA C 32 58.593 58.593 57.938 0.655 19163 3572 1 10 . 1 1 32 32 LEU CB C 32 42.556 42.556 41.211 1.345 19163 3573 1 10 . 1 1 32 32 LEU H H 32 8.475 8.475 8.691 -0.216 19163 3574 1 10 . 1 1 33 33 LYS N N 33 119.091 119.091 119.756 -0.665 19163 3575 1 10 . 1 1 33 33 LYS HA H 33 4.000 4.000 4.174 -0.174 19163 3576 1 10 . 1 1 33 33 LYS C C 33 178.701 178.701 179.420 -0.719 19163 3577 1 10 . 1 1 33 33 LYS CA C 33 60.274 60.274 59.972 0.302 19163 3578 1 10 . 1 1 33 33 LYS CB C 33 32.656 32.656 32.315 0.341 19163 3579 1 10 . 1 1 33 33 LYS H H 33 8.077 8.077 7.822 0.255 19163 3580 1 10 . 1 1 34 34 LYS N N 34 118.527 118.527 119.588 -1.061 19163 3581 1 10 . 1 1 34 34 LYS HA H 34 3.890 3.890 4.039 -0.149 19163 3582 1 10 . 1 1 34 34 LYS C C 34 179.172 179.172 179.077 0.095 19163 3583 1 10 . 1 1 34 34 LYS CA C 34 59.927 59.927 59.415 0.512 19163 3584 1 10 . 1 1 34 34 LYS CB C 34 32.869 32.869 32.313 0.556 19163 3585 1 10 . 1 1 34 34 LYS H H 34 7.986 7.986 8.246 -0.260 19163 3586 1 10 . 1 1 35 35 ALA N N 35 122.190 122.190 122.753 -0.563 19163 3587 1 10 . 1 1 35 35 ALA HA H 35 4.116 4.116 4.062 0.054 19163 3588 1 10 . 1 1 35 35 ALA C C 35 179.982 179.982 178.955 1.027 19163 3589 1 10 . 1 1 35 35 ALA CA C 35 55.157 55.157 55.261 -0.104 19163 3590 1 10 . 1 1 35 35 ALA CB C 35 18.773 18.773 18.357 0.416 19163 3591 1 10 . 1 1 35 35 ALA H H 35 7.917 7.917 8.304 -0.387 19163 3592 1 10 . 1 1 36 36 TYR N N 36 117.701 117.701 120.046 -2.345 19163 3593 1 10 . 1 1 36 36 TYR HA H 36 3.818 3.818 4.077 -0.259 19163 3594 1 10 . 1 1 36 36 TYR C C 36 176.344 176.344 177.857 -1.513 19163 3595 1 10 . 1 1 36 36 TYR CA C 36 61.468 61.468 61.641 -0.173 19163 3596 1 10 . 1 1 36 36 TYR CB C 36 38.890 38.890 38.447 0.443 19163 3597 1 10 . 1 1 36 36 TYR H H 36 8.402 8.402 7.967 0.435 19163 3598 1 10 . 1 1 37 37 ARG N N 37 117.423 117.423 118.130 -0.707 19163 3599 1 10 . 1 1 37 37 ARG HA H 37 3.481 3.481 3.657 -0.176 19163 3600 1 10 . 1 1 37 37 ARG C C 37 178.825 178.825 178.424 0.401 19163 3601 1 10 . 1 1 37 37 ARG CA C 37 59.397 59.397 59.714 -0.317 19163 3602 1 10 . 1 1 37 37 ARG CB C 37 29.710 29.710 29.987 -0.277 19163 3603 1 10 . 1 1 37 37 ARG H H 37 8.264 8.264 8.563 -0.299 19163 3604 1 10 . 1 1 38 38 LYS N N 38 117.247 117.247 120.949 -3.702 19163 3605 1 10 . 1 1 38 38 LYS HA H 38 3.905 3.905 4.010 -0.105 19163 3606 1 10 . 1 1 38 38 LYS C C 38 179.444 179.444 179.064 0.380 19163 3607 1 10 . 1 1 38 38 LYS CA C 38 59.450 59.450 59.535 -0.085 19163 3608 1 10 . 1 1 38 38 LYS CB C 38 32.609 32.609 32.369 0.240 19163 3609 1 10 . 1 1 38 38 LYS H H 38 7.444 7.444 7.830 -0.386 19163 3610 1 10 . 1 1 39 39 LEU N N 39 119.901 119.901 119.465 0.436 19163 3611 1 10 . 1 1 39 39 LEU HA H 39 4.020 4.020 4.173 -0.153 19163 3612 1 10 . 1 1 39 39 LEU C C 39 178.801 178.801 178.846 -0.045 19163 3613 1 10 . 1 1 39 39 LEU CA C 39 57.409 57.409 57.758 -0.349 19163 3614 1 10 . 1 1 39 39 LEU CB C 39 42.388 42.388 41.768 0.620 19163 3615 1 10 . 1 1 39 39 LEU H H 39 7.707 7.707 8.113 -0.406 19163 3616 1 10 . 1 1 40 40 ALA N N 40 122.772 122.772 121.713 1.059 19163 3617 1 10 . 1 1 40 40 ALA HA H 40 3.849 3.849 4.109 -0.260 19163 3618 1 10 . 1 1 40 40 ALA C C 40 179.446 179.446 179.406 0.040 19163 3619 1 10 . 1 1 40 40 ALA CA C 40 55.109 55.109 55.130 -0.021 19163 3620 1 10 . 1 1 40 40 ALA CB C 40 17.116 17.116 18.208 -1.092 19163 3621 1 10 . 1 1 40 40 ALA H H 40 8.931 8.931 8.326 0.605 19163 3622 1 10 . 1 1 41 41 LEU N N 41 115.299 115.299 116.833 -1.534 19163 3623 1 10 . 1 1 41 41 LEU HA H 41 3.977 3.977 3.711 0.266 19163 3624 1 10 . 1 1 41 41 LEU C C 41 178.216 178.216 178.767 -0.551 19163 3625 1 10 . 1 1 41 41 LEU CA C 41 57.088 57.088 57.110 -0.022 19163 3626 1 10 . 1 1 41 41 LEU CB C 41 42.162 42.162 41.702 0.460 19163 3627 1 10 . 1 1 41 41 LEU H H 41 7.133 7.133 7.774 -0.641 19163 3628 1 10 . 1 1 42 42 LYS N N 42 116.812 116.812 117.100 -0.288 19163 3629 1 10 . 1 1 42 42 LYS HA H 42 3.925 3.925 3.932 -0.007 19163 3630 1 10 . 1 1 42 42 LYS C C 42 177.560 177.560 178.978 -1.418 19163 3631 1 10 . 1 1 42 42 LYS CA C 42 57.885 57.885 58.121 -0.236 19163 3632 1 10 . 1 1 42 42 LYS CB C 42 33.427 33.427 32.578 0.849 19163 3633 1 10 . 1 1 42 42 LYS H H 42 7.038 7.038 7.354 -0.316 19163 3634 1 10 . 1 1 43 43 TYR N N 43 114.022 114.022 114.864 -0.842 19163 3635 1 10 . 1 1 43 43 TYR HA H 43 4.665 4.665 4.598 0.067 19163 3636 1 10 . 1 1 43 43 TYR C C 43 173.741 173.741 174.195 -0.454 19163 3637 1 10 . 1 1 43 43 TYR CA C 43 56.928 56.928 56.470 0.458 19163 3638 1 10 . 1 1 43 43 TYR CB C 43 39.579 39.579 37.318 2.261 19163 3639 1 10 . 1 1 43 43 TYR H H 43 7.683 7.683 8.098 -0.415 19163 3640 1 10 . 1 1 44 44 HIS N N 44 120.947 120.947 122.436 -1.489 19163 3641 1 10 . 1 1 44 44 HIS HA H 44 3.697 3.697 4.156 -0.459 19163 3642 1 10 . 1 1 44 44 HIS C C 44 174.925 174.925 174.951 -0.026 19163 3643 1 10 . 1 1 44 44 HIS CA C 44 56.229 56.229 55.674 0.555 19163 3644 1 10 . 1 1 44 44 HIS CB C 44 30.852 30.852 30.842 0.010 19163 3645 1 10 . 1 1 44 44 HIS H H 44 7.814 7.814 7.335 0.479 19163 3646 1 10 . 1 1 45 45 PRO HA H 45 4.131 4.131 4.275 -0.144 19163 3647 1 10 . 1 1 45 45 PRO C C 45 177.269 177.269 177.027 0.242 19163 3648 1 10 . 1 1 45 45 PRO CA C 45 64.723 64.723 64.988 -0.265 19163 3649 1 10 . 1 1 45 45 PRO CB C 45 32.070 32.070 31.720 0.350 19163 3650 1 10 . 1 1 46 46 ASP N N 46 119.127 119.127 116.069 3.058 19163 3651 1 10 . 1 1 46 46 ASP HA H 46 4.375 4.375 4.346 0.029 19163 3652 1 10 . 1 1 46 46 ASP C C 46 177.284 177.284 176.734 0.550 19163 3653 1 10 . 1 1 46 46 ASP CA C 46 56.020 56.020 55.932 0.088 19163 3654 1 10 . 1 1 46 46 ASP CB C 46 40.221 40.221 40.334 -0.113 19163 3655 1 10 . 1 1 46 46 ASP H H 46 10.040 10.040 7.485 2.555 19163 3656 1 10 . 1 1 47 47 LYS N N 47 117.416 117.416 119.348 -1.932 19163 3657 1 10 . 1 1 47 47 LYS HA H 47 4.315 4.315 4.291 0.024 19163 3658 1 10 . 1 1 47 47 LYS C C 47 176.355 176.355 176.303 0.052 19163 3659 1 10 . 1 1 47 47 LYS CA C 47 55.880 55.880 57.422 -1.542 19163 3660 1 10 . 1 1 47 47 LYS CB C 47 33.778 33.778 34.775 -0.997 19163 3661 1 10 . 1 1 47 47 LYS H H 47 7.826 7.826 7.548 0.278 19163 3662 1 10 . 1 1 48 48 ASN N N 48 116.573 116.573 118.787 -2.214 19163 3663 1 10 . 1 1 48 48 ASN HA H 48 5.021 5.021 5.161 -0.140 19163 3664 1 10 . 1 1 48 48 ASN C C 48 172.992 172.992 173.815 -0.823 19163 3665 1 10 . 1 1 48 48 ASN CA C 48 50.467 50.467 50.573 -0.106 19163 3666 1 10 . 1 1 48 48 ASN CB C 48 39.284 39.284 39.399 -0.115 19163 3667 1 10 . 1 1 48 48 ASN H H 48 7.956 7.956 8.354 -0.398 19163 3668 1 10 . 1 1 49 49 PRO HA H 49 4.448 4.448 4.380 0.068 19163 3669 1 10 . 1 1 49 49 PRO C C 49 178.030 178.030 177.510 0.520 19163 3670 1 10 . 1 1 49 49 PRO CA C 49 64.468 64.468 64.922 -0.454 19163 3671 1 10 . 1 1 49 49 PRO CB C 49 32.173 32.173 32.030 0.143 19163 3672 1 10 . 1 1 50 50 ASN N N 50 115.567 115.567 115.774 -0.207 19163 3673 1 10 . 1 1 50 50 ASN HA H 50 4.748 4.748 4.567 0.181 19163 3674 1 10 . 1 1 50 50 ASN C C 50 176.443 176.443 176.080 0.363 19163 3675 1 10 . 1 1 50 50 ASN CA C 50 54.677 54.677 54.865 -0.188 19163 3676 1 10 . 1 1 50 50 ASN CB C 50 39.014 39.014 37.039 1.975 19163 3677 1 10 . 1 1 50 50 ASN H H 50 8.398 8.398 8.689 -0.291 19163 3678 1 10 . 1 1 51 51 GLU N N 51 119.270 119.270 119.067 0.203 19163 3679 1 10 . 1 1 51 51 GLU HA H 51 4.797 4.797 4.553 0.244 19163 3680 1 10 . 1 1 51 51 GLU C C 51 176.922 176.922 177.666 -0.744 19163 3681 1 10 . 1 1 51 51 GLU CA C 51 55.916 55.916 56.376 -0.460 19163 3682 1 10 . 1 1 51 51 GLU CB C 51 29.200 29.200 29.613 -0.413 19163 3683 1 10 . 1 1 51 51 GLU H H 51 7.485 7.485 7.876 -0.391 19163 3684 1 10 . 1 1 52 52 GLY N N 52 107.541 107.541 108.622 -1.081 19163 3685 1 10 . 1 1 52 52 GLY C C 52 176.755 176.755 175.798 0.957 19163 3686 1 10 . 1 1 52 52 GLY CA C 52 47.914 47.914 47.243 0.671 19163 3687 1 10 . 1 1 52 52 GLY H H 52 8.092 8.092 7.629 0.463 19163 3688 1 10 . 1 1 53 53 GLU N N 53 121.603 121.603 120.986 0.617 19163 3689 1 10 . 1 1 53 53 GLU HA H 53 4.065 4.065 4.094 -0.029 19163 3690 1 10 . 1 1 53 53 GLU C C 53 179.052 179.052 178.743 0.309 19163 3691 1 10 . 1 1 53 53 GLU CA C 53 59.280 59.280 59.276 0.004 19163 3692 1 10 . 1 1 53 53 GLU CB C 53 28.968 28.968 29.222 -0.254 19163 3693 1 10 . 1 1 53 53 GLU H H 53 8.496 8.496 8.428 0.068 19163 3694 1 10 . 1 1 54 54 LYS N N 54 120.837 120.837 118.996 1.841 19163 3695 1 10 . 1 1 54 54 LYS HA H 54 3.923 3.923 4.056 -0.133 19163 3696 1 10 . 1 1 54 54 LYS C C 54 179.058 179.058 179.161 -0.103 19163 3697 1 10 . 1 1 54 54 LYS CA C 54 58.800 58.800 58.895 -0.095 19163 3698 1 10 . 1 1 54 54 LYS CB C 54 31.551 31.551 32.255 -0.704 19163 3699 1 10 . 1 1 54 54 LYS H H 54 7.857 7.857 7.487 0.370 19163 3700 1 10 . 1 1 55 55 PHE N N 55 118.608 118.608 120.646 -2.038 19163 3701 1 10 . 1 1 55 55 PHE HA H 55 4.021 4.021 4.196 -0.175 19163 3702 1 10 . 1 1 55 55 PHE C C 55 178.001 178.001 176.984 1.017 19163 3703 1 10 . 1 1 55 55 PHE CA C 55 61.911 61.911 60.815 1.096 19163 3704 1 10 . 1 1 55 55 PHE CB C 55 38.553 38.553 39.165 -0.612 19163 3705 1 10 . 1 1 55 55 PHE H H 55 8.382 8.382 8.371 0.011 19163 3706 1 10 . 1 1 56 56 LYS N N 56 120.898 120.898 119.881 1.017 19163 3707 1 10 . 1 1 56 56 LYS HA H 56 3.828 3.828 3.841 -0.013 19163 3708 1 10 . 1 1 56 56 LYS C C 56 178.817 178.817 178.514 0.303 19163 3709 1 10 . 1 1 56 56 LYS CA C 56 59.877 59.877 60.033 -0.156 19163 3710 1 10 . 1 1 56 56 LYS CB C 56 32.133 32.133 32.089 0.044 19163 3711 1 10 . 1 1 56 56 LYS H H 56 8.111 8.111 7.977 0.134 19163 3712 1 10 . 1 1 57 57 GLN N N 57 118.600 118.600 118.261 0.339 19163 3713 1 10 . 1 1 57 57 GLN HA H 57 4.009 4.009 4.049 -0.040 19163 3714 1 10 . 1 1 57 57 GLN C C 57 179.333 179.333 178.675 0.658 19163 3715 1 10 . 1 1 57 57 GLN CA C 57 59.109 59.109 58.694 0.415 19163 3716 1 10 . 1 1 57 57 GLN CB C 57 28.595 28.595 28.681 -0.086 19163 3717 1 10 . 1 1 57 57 GLN H H 57 7.613 7.613 7.585 0.028 19163 3718 1 10 . 1 1 58 58 ILE N N 58 118.709 118.709 120.556 -1.847 19163 3719 1 10 . 1 1 58 58 ILE HA H 58 3.559 3.559 3.654 -0.095 19163 3720 1 10 . 1 1 58 58 ILE C C 58 177.152 177.152 178.113 -0.961 19163 3721 1 10 . 1 1 58 58 ILE CA C 58 65.068 65.068 65.328 -0.260 19163 3722 1 10 . 1 1 58 58 ILE CB C 58 38.381 38.381 37.740 0.641 19163 3723 1 10 . 1 1 58 58 ILE H H 58 8.011 8.011 7.607 0.404 19163 3724 1 10 . 1 1 59 59 SER N N 59 116.112 116.112 115.710 0.402 19163 3725 1 10 . 1 1 59 59 SER HA H 59 3.948 3.948 4.010 -0.062 19163 3726 1 10 . 1 1 59 59 SER C C 59 175.949 175.949 176.798 -0.849 19163 3727 1 10 . 1 1 59 59 SER CA C 59 62.315 62.315 62.184 0.131 19163 3728 1 10 . 1 1 59 59 SER H H 59 8.030 8.030 8.122 -0.092 19163 3729 1 10 . 1 1 60 60 GLN N N 60 122.099 122.099 121.436 0.663 19163 3730 1 10 . 1 1 60 60 GLN HA H 60 3.801 3.801 3.966 -0.165 19163 3731 1 10 . 1 1 60 60 GLN C C 60 176.942 176.942 178.229 -1.287 19163 3732 1 10 . 1 1 60 60 GLN CA C 60 58.762 58.762 58.967 -0.205 19163 3733 1 10 . 1 1 60 60 GLN CB C 60 28.498 28.498 28.885 -0.387 19163 3734 1 10 . 1 1 60 60 GLN H H 60 7.933 7.933 7.707 0.226 19163 3735 1 10 . 1 1 61 61 ALA N N 61 119.367 119.367 122.571 -3.204 19163 3736 1 10 . 1 1 61 61 ALA HA H 61 2.636 2.636 3.756 -1.120 19163 3737 1 10 . 1 1 61 61 ALA C C 61 178.507 178.507 178.932 -0.425 19163 3738 1 10 . 1 1 61 61 ALA CA C 61 54.126 54.126 55.092 -0.966 19163 3739 1 10 . 1 1 61 61 ALA CB C 61 18.462 18.462 18.539 -0.077 19163 3740 1 10 . 1 1 61 61 ALA H H 61 7.354 7.354 7.836 -0.482 19163 3741 1 10 . 1 1 62 62 TYR N N 62 115.613 115.613 120.666 -5.053 19163 3742 1 10 . 1 1 62 62 TYR HA H 62 3.633 3.633 3.973 -0.340 19163 3743 1 10 . 1 1 62 62 TYR C C 62 177.421 177.421 177.779 -0.358 19163 3744 1 10 . 1 1 62 62 TYR CA C 62 61.676 61.676 60.677 0.999 19163 3745 1 10 . 1 1 62 62 TYR CB C 62 39.162 39.162 37.866 1.296 19163 3746 1 10 . 1 1 62 62 TYR H H 62 7.994 7.994 8.511 -0.517 19163 3747 1 10 . 1 1 63 63 GLU N N 63 121.396 121.396 119.218 2.178 19163 3748 1 10 . 1 1 63 63 GLU HA H 63 3.347 3.347 3.552 -0.205 19163 3749 1 10 . 1 1 63 63 GLU C C 63 177.687 177.687 178.106 -0.419 19163 3750 1 10 . 1 1 63 63 GLU CA C 63 59.562 59.562 59.214 0.348 19163 3751 1 10 . 1 1 63 63 GLU CB C 63 29.115 29.115 29.443 -0.328 19163 3752 1 10 . 1 1 63 63 GLU H H 63 8.151 8.151 7.693 0.458 19163 3753 1 10 . 1 1 64 64 VAL N N 64 115.850 115.850 117.528 -1.678 19163 3754 1 10 . 1 1 64 64 VAL HA H 64 3.377 3.377 3.722 -0.345 19163 3755 1 10 . 1 1 64 64 VAL C C 64 175.925 175.925 177.454 -1.529 19163 3756 1 10 . 1 1 64 64 VAL CA C 64 65.806 65.806 64.891 0.915 19163 3757 1 10 . 1 1 64 64 VAL CB C 64 31.786 31.786 32.063 -0.277 19163 3758 1 10 . 1 1 64 64 VAL H H 64 6.814 6.814 7.200 -0.386 19163 3759 1 10 . 1 1 65 65 LEU N N 65 111.438 111.438 119.167 -7.729 19163 3760 1 10 . 1 1 65 65 LEU HA H 65 3.569 3.569 3.879 -0.310 19163 3761 1 10 . 1 1 65 65 LEU C C 65 177.124 177.124 178.889 -1.765 19163 3762 1 10 . 1 1 65 65 LEU CA C 65 56.645 56.645 57.717 -1.072 19163 3763 1 10 . 1 1 65 65 LEU CB C 65 42.589 42.589 41.229 1.360 19163 3764 1 10 . 1 1 65 65 LEU H H 65 7.398 7.398 8.174 -0.776 19163 3765 1 10 . 1 1 66 66 SER N N 66 108.642 108.642 111.169 -2.527 19163 3766 1 10 . 1 1 66 66 SER HA H 66 4.028 4.028 4.212 -0.184 19163 3767 1 10 . 1 1 66 66 SER C C 66 173.286 173.286 173.647 -0.361 19163 3768 1 10 . 1 1 66 66 SER CA C 66 59.232 59.232 60.233 -1.001 19163 3769 1 10 . 1 1 66 66 SER CB C 66 63.066 63.066 63.475 -0.409 19163 3770 1 10 . 1 1 66 66 SER H H 66 7.700 7.700 7.368 0.332 19163 3771 1 10 . 1 1 67 67 ASP N N 67 124.276 124.276 121.498 2.778 19163 3772 1 10 . 1 1 67 67 ASP HA H 67 4.668 4.668 4.687 -0.019 19163 3773 1 10 . 1 1 67 67 ASP C C 67 174.913 174.913 175.563 -0.650 19163 3774 1 10 . 1 1 67 67 ASP CA C 67 52.487 52.487 52.339 0.148 19163 3775 1 10 . 1 1 67 67 ASP CB C 67 43.218 43.218 41.756 1.462 19163 3776 1 10 . 1 1 67 67 ASP H H 67 6.879 6.879 7.129 -0.250 19163 3777 1 10 . 1 1 68 68 ALA N N 68 127.326 127.326 130.244 -2.918 19163 3778 1 10 . 1 1 68 68 ALA HA H 68 3.853 3.853 3.948 -0.095 19163 3779 1 10 . 1 1 68 68 ALA C C 68 180.336 180.336 178.722 1.614 19163 3780 1 10 . 1 1 68 68 ALA CA C 68 55.912 55.912 55.091 0.821 19163 3781 1 10 . 1 1 68 68 ALA CB C 68 18.645 18.645 18.865 -0.220 19163 3782 1 10 . 1 1 68 68 ALA H H 68 8.693 8.693 8.786 -0.093 19163 3783 1 10 . 1 1 69 69 LYS N N 69 116.929 116.929 118.685 -1.756 19163 3784 1 10 . 1 1 69 69 LYS HA H 69 4.162 4.162 4.038 0.124 19163 3785 1 10 . 1 1 69 69 LYS C C 69 179.515 179.515 178.712 0.803 19163 3786 1 10 . 1 1 69 69 LYS CA C 69 58.562 58.562 59.207 -0.645 19163 3787 1 10 . 1 1 69 69 LYS CB C 69 31.840 31.840 32.354 -0.514 19163 3788 1 10 . 1 1 69 69 LYS H H 69 7.950 7.950 7.824 0.126 19163 3789 1 10 . 1 1 70 70 LYS N N 70 121.286 121.286 119.190 2.096 19163 3790 1 10 . 1 1 70 70 LYS HA H 70 3.960 3.960 3.965 -0.005 19163 3791 1 10 . 1 1 70 70 LYS C C 70 179.938 179.938 178.934 1.004 19163 3792 1 10 . 1 1 70 70 LYS CA C 70 60.066 60.066 59.570 0.496 19163 3793 1 10 . 1 1 70 70 LYS CB C 70 32.695 32.695 32.336 0.360 19163 3794 1 10 . 1 1 70 70 LYS H H 70 8.184 8.184 8.659 -0.475 19163 3795 1 10 . 1 1 71 71 ARG N N 71 122.794 122.794 119.901 2.893 19163 3796 1 10 . 1 1 71 71 ARG HA H 71 3.668 3.668 3.918 -0.250 19163 3797 1 10 . 1 1 71 71 ARG C C 71 177.356 177.356 178.048 -0.692 19163 3798 1 10 . 1 1 71 71 ARG CA C 71 60.127 60.127 60.189 -0.062 19163 3799 1 10 . 1 1 71 71 ARG CB C 71 29.668 29.668 30.156 -0.488 19163 3800 1 10 . 1 1 71 71 ARG H H 71 9.290 9.290 8.533 0.757 19163 3801 1 10 . 1 1 72 72 GLU N N 72 118.390 118.390 119.502 -1.112 19163 3802 1 10 . 1 1 72 72 GLU HA H 72 4.096 4.096 4.114 -0.018 19163 3803 1 10 . 1 1 72 72 GLU C C 72 179.073 179.073 179.047 0.026 19163 3804 1 10 . 1 1 72 72 GLU CA C 72 59.456 59.456 59.330 0.126 19163 3805 1 10 . 1 1 72 72 GLU CB C 72 29.615 29.615 29.572 0.043 19163 3806 1 10 . 1 1 72 72 GLU H H 72 7.607 7.607 7.610 -0.003 19163 3807 1 10 . 1 1 73 73 LEU N N 73 117.921 117.921 120.092 -2.171 19163 3808 1 10 . 1 1 73 73 LEU HA H 73 4.032 4.032 3.999 0.033 19163 3809 1 10 . 1 1 73 73 LEU C C 73 179.696 179.696 178.905 0.791 19163 3810 1 10 . 1 1 73 73 LEU CA C 73 57.597 57.597 57.904 -0.307 19163 3811 1 10 . 1 1 73 73 LEU CB C 73 41.815 41.815 41.602 0.213 19163 3812 1 10 . 1 1 73 73 LEU H H 73 7.398 7.398 7.723 -0.325 19163 3813 1 10 . 1 1 74 74 TYR N N 74 122.662 122.662 120.134 2.528 19163 3814 1 10 . 1 1 74 74 TYR HA H 74 4.092 4.092 3.972 0.120 19163 3815 1 10 . 1 1 74 74 TYR C C 74 178.166 178.166 177.221 0.945 19163 3816 1 10 . 1 1 74 74 TYR CA C 74 61.458 61.458 61.586 -0.128 19163 3817 1 10 . 1 1 74 74 TYR CB C 74 38.778 38.778 38.520 0.258 19163 3818 1 10 . 1 1 74 74 TYR H H 74 8.316 8.316 8.442 -0.126 19163 3819 1 10 . 1 1 75 75 ASP N N 75 118.842 118.842 117.545 1.297 19163 3820 1 10 . 1 1 75 75 ASP HA H 75 4.423 4.423 4.411 0.012 19163 3821 1 10 . 1 1 75 75 ASP C C 75 177.726 177.726 177.920 -0.194 19163 3822 1 10 . 1 1 75 75 ASP CA C 75 56.177 56.177 56.843 -0.666 19163 3823 1 10 . 1 1 75 75 ASP CB C 75 40.800 40.800 41.036 -0.236 19163 3824 1 10 . 1 1 75 75 ASP H H 75 8.770 8.770 8.104 0.666 19163 3825 1 10 . 1 1 76 76 LYS N N 76 118.955 118.955 119.418 -0.463 19163 3826 1 10 . 1 1 76 76 LYS HA H 76 4.130 4.130 4.144 -0.014 19163 3827 1 10 . 1 1 76 76 LYS C C 76 177.006 177.006 176.774 0.232 19163 3828 1 10 . 1 1 76 76 LYS CA C 76 57.537 57.537 57.219 0.318 19163 3829 1 10 . 1 1 76 76 LYS CB C 76 33.136 33.136 33.785 -0.649 19163 3830 1 10 . 1 1 76 76 LYS H H 76 7.610 7.610 7.781 -0.171 19163 3831 1 11 . 1 1 11 11 MET HA H 11 4.346 4.346 4.276 0.070 19163 3832 1 11 . 1 1 11 11 MET C C 11 175.801 175.801 176.127 -0.326 19163 3833 1 11 . 1 1 11 11 MET CA C 11 55.614 55.614 55.029 0.585 19163 3834 1 11 . 1 1 11 11 MET CB C 11 32.925 32.925 33.156 -0.231 19163 3835 1 11 . 1 1 12 12 VAL N N 12 121.226 121.226 119.463 1.763 19163 3836 1 11 . 1 1 12 12 VAL HA H 12 4.026 4.026 4.199 -0.173 19163 3837 1 11 . 1 1 12 12 VAL C C 12 175.701 175.701 175.531 0.170 19163 3838 1 11 . 1 1 12 12 VAL CA C 12 62.188 62.188 61.715 0.473 19163 3839 1 11 . 1 1 12 12 VAL CB C 12 32.882 32.882 32.022 0.860 19163 3840 1 11 . 1 1 12 12 VAL H H 12 7.988 7.988 8.221 -0.233 19163 3841 1 11 . 1 1 13 13 LYS N N 13 125.255 125.255 127.533 -2.278 19163 3842 1 11 . 1 1 13 13 LYS HA H 13 4.211 4.211 4.414 -0.203 19163 3843 1 11 . 1 1 13 13 LYS C C 13 176.121 176.121 175.706 0.415 19163 3844 1 11 . 1 1 13 13 LYS CA C 13 56.355 56.355 55.481 0.874 19163 3845 1 11 . 1 1 13 13 LYS CB C 13 33.019 33.019 32.134 0.885 19163 3846 1 11 . 1 1 13 13 LYS H H 13 8.281 8.281 8.620 -0.339 19163 3847 1 11 . 1 1 14 14 GLU N N 14 123.004 123.004 122.472 0.532 19163 3848 1 11 . 1 1 14 14 GLU HA H 14 4.305 4.305 4.003 0.302 19163 3849 1 11 . 1 1 14 14 GLU C C 14 176.107 176.107 175.350 0.757 19163 3850 1 11 . 1 1 14 14 GLU CA C 14 56.343 56.343 56.399 -0.056 19163 3851 1 11 . 1 1 14 14 GLU CB C 14 30.534 30.534 29.264 1.270 19163 3852 1 11 . 1 1 14 14 GLU H H 14 8.424 8.424 8.748 -0.324 19163 3853 1 11 . 1 1 15 15 THR N N 15 115.895 115.895 116.478 -0.583 19163 3854 1 11 . 1 1 15 15 THR HA H 15 4.538 4.538 4.266 0.272 19163 3855 1 11 . 1 1 15 15 THR C C 15 175.233 175.233 174.401 0.832 19163 3856 1 11 . 1 1 15 15 THR CA C 15 61.981 61.981 62.498 -0.517 19163 3857 1 11 . 1 1 15 15 THR CB C 15 69.865 69.865 69.272 0.593 19163 3858 1 11 . 1 1 15 15 THR H H 15 8.335 8.335 8.068 0.267 19163 3859 1 11 . 1 1 16 16 THR N N 16 116.992 116.992 119.908 -2.916 19163 3860 1 11 . 1 1 16 16 THR HA H 16 4.366 4.366 4.430 -0.064 19163 3861 1 11 . 1 1 16 16 THR C C 16 176.090 176.090 175.238 0.852 19163 3862 1 11 . 1 1 16 16 THR CA C 16 62.172 62.172 59.457 2.715 19163 3863 1 11 . 1 1 16 16 THR CB C 16 71.997 71.997 70.203 1.794 19163 3864 1 11 . 1 1 16 16 THR H H 16 8.798 8.798 8.179 0.619 19163 3865 1 11 . 1 1 17 17 TYR N N 17 117.617 117.617 120.669 -3.052 19163 3866 1 11 . 1 1 17 17 TYR HA H 17 4.329 4.329 4.229 0.100 19163 3867 1 11 . 1 1 17 17 TYR C C 17 177.105 177.105 177.753 -0.648 19163 3868 1 11 . 1 1 17 17 TYR CA C 17 57.577 57.577 62.061 -4.484 19163 3869 1 11 . 1 1 17 17 TYR CB C 17 37.113 37.113 38.189 -1.076 19163 3870 1 11 . 1 1 17 17 TYR H H 17 8.292 8.292 8.886 -0.594 19163 3871 1 11 . 1 1 18 18 TYR N N 18 115.048 115.048 117.895 -2.847 19163 3872 1 11 . 1 1 18 18 TYR HA H 18 3.775 3.775 4.275 -0.500 19163 3873 1 11 . 1 1 18 18 TYR C C 18 177.771 177.771 177.597 0.174 19163 3874 1 11 . 1 1 18 18 TYR CA C 18 61.430 61.430 61.626 -0.196 19163 3875 1 11 . 1 1 18 18 TYR CB C 18 36.495 36.495 37.497 -1.002 19163 3876 1 11 . 1 1 18 18 TYR H H 18 7.047 7.047 7.958 -0.911 19163 3877 1 11 . 1 1 19 19 ASP N N 19 119.520 119.520 119.380 0.140 19163 3878 1 11 . 1 1 19 19 ASP HA H 19 4.406 4.406 4.417 -0.011 19163 3879 1 11 . 1 1 19 19 ASP C C 19 180.128 180.128 178.586 1.542 19163 3880 1 11 . 1 1 19 19 ASP CA C 19 57.475 57.475 57.342 0.133 19163 3881 1 11 . 1 1 19 19 ASP CB C 19 40.659 40.659 40.641 0.018 19163 3882 1 11 . 1 1 19 19 ASP H H 19 7.685 7.685 8.428 -0.743 19163 3883 1 11 . 1 1 20 20 VAL N N 20 119.772 119.772 119.445 0.327 19163 3884 1 11 . 1 1 20 20 VAL HA H 20 3.608 3.608 3.754 -0.146 19163 3885 1 11 . 1 1 20 20 VAL C C 20 177.026 177.026 177.406 -0.380 19163 3886 1 11 . 1 1 20 20 VAL CA C 20 65.840 65.840 65.470 0.370 19163 3887 1 11 . 1 1 20 20 VAL CB C 20 31.530 31.530 31.606 -0.076 19163 3888 1 11 . 1 1 20 20 VAL H H 20 8.004 8.004 8.258 -0.254 19163 3889 1 11 . 1 1 21 21 LEU N N 21 115.252 115.252 115.853 -0.601 19163 3890 1 11 . 1 1 21 21 LEU HA H 21 4.281 4.281 4.296 -0.015 19163 3891 1 11 . 1 1 21 21 LEU C C 21 175.757 175.757 177.327 -1.570 19163 3892 1 11 . 1 1 21 21 LEU CA C 21 54.554 54.554 54.705 -0.151 19163 3893 1 11 . 1 1 21 21 LEU CB C 21 42.869 42.869 41.696 1.173 19163 3894 1 11 . 1 1 21 21 LEU H H 21 6.847 6.847 7.622 -0.775 19163 3895 1 11 . 1 1 22 22 GLY N N 22 108.227 108.227 107.310 0.917 19163 3896 1 11 . 1 1 22 22 GLY C C 22 175.361 175.361 173.887 1.474 19163 3897 1 11 . 1 1 22 22 GLY CA C 22 46.574 46.574 45.786 0.788 19163 3898 1 11 . 1 1 22 22 GLY H H 22 7.874 7.874 7.694 0.180 19163 3899 1 11 . 1 1 23 23 VAL N N 23 110.675 110.675 118.401 -7.726 19163 3900 1 11 . 1 1 23 23 VAL HA H 23 4.767 4.767 4.436 0.331 19163 3901 1 11 . 1 1 23 23 VAL C C 23 174.674 174.674 174.594 0.080 19163 3902 1 11 . 1 1 23 23 VAL CA C 23 58.349 58.349 59.663 -1.314 19163 3903 1 11 . 1 1 23 23 VAL CB C 23 34.938 34.938 36.022 -1.084 19163 3904 1 11 . 1 1 23 23 VAL H H 23 7.815 7.815 8.233 -0.418 19163 3905 1 11 . 1 1 24 24 LYS N N 24 119.948 119.948 123.347 -3.399 19163 3906 1 11 . 1 1 24 24 LYS HA H 24 4.488 4.488 4.655 -0.167 19163 3907 1 11 . 1 1 24 24 LYS C C 24 175.442 175.442 176.010 -0.568 19163 3908 1 11 . 1 1 24 24 LYS CA C 24 54.001 54.001 54.785 -0.784 19163 3909 1 11 . 1 1 24 24 LYS CB C 24 32.197 32.197 31.893 0.304 19163 3910 1 11 . 1 1 24 24 LYS H H 24 8.329 8.329 8.341 -0.012 19163 3911 1 11 . 1 1 25 25 PRO HA H 25 2.421 2.421 4.171 -1.750 19163 3912 1 11 . 1 1 25 25 PRO C C 25 175.635 175.635 176.088 -0.453 19163 3913 1 11 . 1 1 25 25 PRO CA C 25 63.362 63.362 64.458 -1.096 19163 3914 1 11 . 1 1 25 25 PRO CB C 25 31.839 31.839 31.791 0.048 19163 3915 1 11 . 1 1 26 26 ASN N N 26 111.739 111.739 112.578 -0.839 19163 3916 1 11 . 1 1 26 26 ASN HA H 26 4.518 4.518 4.697 -0.179 19163 3917 1 11 . 1 1 26 26 ASN C C 26 175.820 175.820 175.124 0.696 19163 3918 1 11 . 1 1 26 26 ASN CA C 26 51.525 51.525 51.717 -0.192 19163 3919 1 11 . 1 1 26 26 ASN CB C 26 36.829 36.829 38.380 -1.550 19163 3920 1 11 . 1 1 26 26 ASN H H 26 7.138 7.138 8.010 -0.872 19163 3921 1 11 . 1 1 27 27 ALA N N 27 122.829 122.829 124.868 -2.039 19163 3922 1 11 . 1 1 27 27 ALA HA H 27 4.325 4.325 4.911 -0.586 19163 3923 1 11 . 1 1 27 27 ALA C C 27 178.726 178.726 177.367 1.359 19163 3924 1 11 . 1 1 27 27 ALA CA C 27 52.961 52.961 52.243 0.718 19163 3925 1 11 . 1 1 27 27 ALA CB C 27 19.159 19.159 20.474 -1.315 19163 3926 1 11 . 1 1 27 27 ALA H H 27 7.637 7.637 7.736 -0.099 19163 3927 1 11 . 1 1 28 28 THR N N 28 113.468 113.468 114.329 -0.861 19163 3928 1 11 . 1 1 28 28 THR HA H 28 4.493 4.493 4.511 -0.018 19163 3929 1 11 . 1 1 28 28 THR C C 28 175.641 175.641 175.824 -0.183 19163 3930 1 11 . 1 1 28 28 THR CA C 28 60.592 60.592 60.342 0.250 19163 3931 1 11 . 1 1 28 28 THR CB C 28 71.304 71.304 70.797 0.507 19163 3932 1 11 . 1 1 28 28 THR H H 28 8.829 8.829 8.186 0.643 19163 3933 1 11 . 1 1 29 29 GLN N N 29 119.445 119.445 122.357 -2.912 19163 3934 1 11 . 1 1 29 29 GLN HA H 29 4.035 4.035 3.930 0.105 19163 3935 1 11 . 1 1 29 29 GLN C C 29 179.117 179.117 178.347 0.770 19163 3936 1 11 . 1 1 29 29 GLN CA C 29 59.435 59.435 60.094 -0.659 19163 3937 1 11 . 1 1 29 29 GLN CB C 29 27.851 27.851 28.224 -0.373 19163 3938 1 11 . 1 1 29 29 GLN H H 29 9.015 9.015 8.883 0.132 19163 3939 1 11 . 1 1 30 30 GLU N N 30 119.343 119.343 119.275 0.068 19163 3940 1 11 . 1 1 30 30 GLU HA H 30 4.059 4.059 4.128 -0.069 19163 3941 1 11 . 1 1 30 30 GLU C C 30 179.097 179.097 178.712 0.385 19163 3942 1 11 . 1 1 30 30 GLU CA C 30 59.847 59.847 59.300 0.547 19163 3943 1 11 . 1 1 30 30 GLU CB C 30 29.356 29.356 29.075 0.281 19163 3944 1 11 . 1 1 30 30 GLU H H 30 8.549 8.549 8.573 -0.024 19163 3945 1 11 . 1 1 31 31 GLU N N 31 120.562 120.562 120.279 0.283 19163 3946 1 11 . 1 1 31 31 GLU HA H 31 3.906 3.906 4.105 -0.199 19163 3947 1 11 . 1 1 31 31 GLU C C 31 180.405 180.405 179.105 1.300 19163 3948 1 11 . 1 1 31 31 GLU CA C 31 59.592 59.592 59.285 0.307 19163 3949 1 11 . 1 1 31 31 GLU CB C 31 29.989 29.989 29.587 0.402 19163 3950 1 11 . 1 1 31 31 GLU H H 31 7.768 7.768 8.129 -0.361 19163 3951 1 11 . 1 1 32 32 LEU N N 32 120.518 120.518 120.443 0.075 19163 3952 1 11 . 1 1 32 32 LEU HA H 32 3.963 3.963 3.984 -0.021 19163 3953 1 11 . 1 1 32 32 LEU C C 32 177.873 177.873 179.031 -1.158 19163 3954 1 11 . 1 1 32 32 LEU CA C 32 58.593 58.593 57.712 0.881 19163 3955 1 11 . 1 1 32 32 LEU CB C 32 42.556 42.556 41.134 1.422 19163 3956 1 11 . 1 1 32 32 LEU H H 32 8.475 8.475 8.677 -0.202 19163 3957 1 11 . 1 1 33 33 LYS N N 33 119.091 119.091 119.174 -0.083 19163 3958 1 11 . 1 1 33 33 LYS HA H 33 4.000 4.000 4.192 -0.192 19163 3959 1 11 . 1 1 33 33 LYS C C 33 178.701 178.701 178.780 -0.079 19163 3960 1 11 . 1 1 33 33 LYS CA C 33 60.274 60.274 59.851 0.423 19163 3961 1 11 . 1 1 33 33 LYS CB C 33 32.656 32.656 32.389 0.267 19163 3962 1 11 . 1 1 33 33 LYS H H 33 8.077 8.077 7.912 0.165 19163 3963 1 11 . 1 1 34 34 LYS N N 34 118.527 118.527 119.695 -1.168 19163 3964 1 11 . 1 1 34 34 LYS HA H 34 3.890 3.890 3.997 -0.107 19163 3965 1 11 . 1 1 34 34 LYS C C 34 179.172 179.172 178.546 0.626 19163 3966 1 11 . 1 1 34 34 LYS CA C 34 59.927 59.927 59.627 0.300 19163 3967 1 11 . 1 1 34 34 LYS CB C 34 32.869 32.869 32.378 0.491 19163 3968 1 11 . 1 1 34 34 LYS H H 34 7.986 7.986 8.005 -0.019 19163 3969 1 11 . 1 1 35 35 ALA N N 35 122.190 122.190 121.875 0.315 19163 3970 1 11 . 1 1 35 35 ALA HA H 35 4.116 4.116 4.032 0.084 19163 3971 1 11 . 1 1 35 35 ALA C C 35 179.982 179.982 179.002 0.980 19163 3972 1 11 . 1 1 35 35 ALA CA C 35 55.157 55.157 55.229 -0.072 19163 3973 1 11 . 1 1 35 35 ALA CB C 35 18.773 18.773 18.253 0.520 19163 3974 1 11 . 1 1 35 35 ALA H H 35 7.917 7.917 8.169 -0.252 19163 3975 1 11 . 1 1 36 36 TYR N N 36 117.701 117.701 120.439 -2.738 19163 3976 1 11 . 1 1 36 36 TYR HA H 36 3.818 3.818 3.993 -0.175 19163 3977 1 11 . 1 1 36 36 TYR C C 36 176.344 176.344 177.407 -1.063 19163 3978 1 11 . 1 1 36 36 TYR CA C 36 61.468 61.468 61.457 0.011 19163 3979 1 11 . 1 1 36 36 TYR CB C 36 38.890 38.890 38.225 0.665 19163 3980 1 11 . 1 1 36 36 TYR H H 36 8.402 8.402 7.882 0.520 19163 3981 1 11 . 1 1 37 37 ARG N N 37 117.423 117.423 119.061 -1.638 19163 3982 1 11 . 1 1 37 37 ARG HA H 37 3.481 3.481 3.685 -0.204 19163 3983 1 11 . 1 1 37 37 ARG C C 37 178.825 178.825 178.167 0.658 19163 3984 1 11 . 1 1 37 37 ARG CA C 37 59.397 59.397 59.701 -0.304 19163 3985 1 11 . 1 1 37 37 ARG CB C 37 29.710 29.710 30.010 -0.300 19163 3986 1 11 . 1 1 37 37 ARG H H 37 8.264 8.264 8.131 0.133 19163 3987 1 11 . 1 1 38 38 LYS N N 38 117.247 117.247 119.967 -2.720 19163 3988 1 11 . 1 1 38 38 LYS HA H 38 3.905 3.905 4.022 -0.117 19163 3989 1 11 . 1 1 38 38 LYS C C 38 179.444 179.444 179.179 0.265 19163 3990 1 11 . 1 1 38 38 LYS CA C 38 59.450 59.450 59.522 -0.072 19163 3991 1 11 . 1 1 38 38 LYS CB C 38 32.609 32.609 32.336 0.273 19163 3992 1 11 . 1 1 38 38 LYS H H 38 7.444 7.444 7.774 -0.330 19163 3993 1 11 . 1 1 39 39 LEU N N 39 119.901 119.901 119.231 0.670 19163 3994 1 11 . 1 1 39 39 LEU HA H 39 4.020 4.020 4.196 -0.176 19163 3995 1 11 . 1 1 39 39 LEU C C 39 178.801 178.801 178.859 -0.058 19163 3996 1 11 . 1 1 39 39 LEU CA C 39 57.409 57.409 57.602 -0.193 19163 3997 1 11 . 1 1 39 39 LEU CB C 39 42.388 42.388 41.633 0.755 19163 3998 1 11 . 1 1 39 39 LEU H H 39 7.707 7.707 8.113 -0.406 19163 3999 1 11 . 1 1 40 40 ALA N N 40 122.772 122.772 122.173 0.599 19163 4000 1 11 . 1 1 40 40 ALA HA H 40 3.849 3.849 4.012 -0.163 19163 4001 1 11 . 1 1 40 40 ALA C C 40 179.446 179.446 179.488 -0.042 19163 4002 1 11 . 1 1 40 40 ALA CA C 40 55.109 55.109 55.087 0.022 19163 4003 1 11 . 1 1 40 40 ALA CB C 40 17.116 17.116 18.212 -1.096 19163 4004 1 11 . 1 1 40 40 ALA H H 40 8.931 8.931 8.246 0.685 19163 4005 1 11 . 1 1 41 41 LEU N N 41 115.299 115.299 117.130 -1.831 19163 4006 1 11 . 1 1 41 41 LEU HA H 41 3.977 3.977 3.849 0.128 19163 4007 1 11 . 1 1 41 41 LEU C C 41 178.216 178.216 178.290 -0.074 19163 4008 1 11 . 1 1 41 41 LEU CA C 41 57.088 57.088 57.225 -0.137 19163 4009 1 11 . 1 1 41 41 LEU CB C 41 42.162 42.162 41.669 0.493 19163 4010 1 11 . 1 1 41 41 LEU H H 41 7.133 7.133 7.597 -0.464 19163 4011 1 11 . 1 1 42 42 LYS N N 42 116.812 116.812 116.532 0.280 19163 4012 1 11 . 1 1 42 42 LYS HA H 42 3.925 3.925 4.016 -0.091 19163 4013 1 11 . 1 1 42 42 LYS C C 42 177.560 177.560 178.143 -0.583 19163 4014 1 11 . 1 1 42 42 LYS CA C 42 57.885 57.885 58.002 -0.117 19163 4015 1 11 . 1 1 42 42 LYS CB C 42 33.427 33.427 33.179 0.248 19163 4016 1 11 . 1 1 42 42 LYS H H 42 7.038 7.038 7.462 -0.424 19163 4017 1 11 . 1 1 43 43 TYR N N 43 114.022 114.022 115.051 -1.029 19163 4018 1 11 . 1 1 43 43 TYR HA H 43 4.665 4.665 4.529 0.136 19163 4019 1 11 . 1 1 43 43 TYR C C 43 173.741 173.741 174.398 -0.657 19163 4020 1 11 . 1 1 43 43 TYR CA C 43 56.928 56.928 56.699 0.229 19163 4021 1 11 . 1 1 43 43 TYR CB C 43 39.579 39.579 38.033 1.546 19163 4022 1 11 . 1 1 43 43 TYR H H 43 7.683 7.683 8.262 -0.579 19163 4023 1 11 . 1 1 44 44 HIS N N 44 120.947 120.947 123.475 -2.528 19163 4024 1 11 . 1 1 44 44 HIS HA H 44 3.697 3.697 4.110 -0.413 19163 4025 1 11 . 1 1 44 44 HIS C C 44 174.925 174.925 174.629 0.296 19163 4026 1 11 . 1 1 44 44 HIS CA C 44 56.229 56.229 54.466 1.763 19163 4027 1 11 . 1 1 44 44 HIS CB C 44 30.852 30.852 30.521 0.331 19163 4028 1 11 . 1 1 44 44 HIS H H 44 7.814 7.814 7.526 0.288 19163 4029 1 11 . 1 1 45 45 PRO HA H 45 4.131 4.131 4.378 -0.247 19163 4030 1 11 . 1 1 45 45 PRO C C 45 177.269 177.269 177.694 -0.425 19163 4031 1 11 . 1 1 45 45 PRO CA C 45 64.723 64.723 65.144 -0.421 19163 4032 1 11 . 1 1 45 45 PRO CB C 45 32.070 32.070 31.892 0.178 19163 4033 1 11 . 1 1 46 46 ASP N N 46 119.127 119.127 116.257 2.870 19163 4034 1 11 . 1 1 46 46 ASP HA H 46 4.375 4.375 4.330 0.045 19163 4035 1 11 . 1 1 46 46 ASP C C 46 177.284 177.284 177.006 0.278 19163 4036 1 11 . 1 1 46 46 ASP CA C 46 56.020 56.020 55.144 0.876 19163 4037 1 11 . 1 1 46 46 ASP CB C 46 40.221 40.221 40.719 -0.498 19163 4038 1 11 . 1 1 46 46 ASP H H 46 10.040 10.040 7.097 2.943 19163 4039 1 11 . 1 1 47 47 LYS N N 47 117.416 117.416 117.925 -0.509 19163 4040 1 11 . 1 1 47 47 LYS HA H 47 4.315 4.315 4.255 0.060 19163 4041 1 11 . 1 1 47 47 LYS C C 47 176.355 176.355 176.491 -0.136 19163 4042 1 11 . 1 1 47 47 LYS CA C 47 55.880 55.880 57.010 -1.130 19163 4043 1 11 . 1 1 47 47 LYS CB C 47 33.778 33.778 34.485 -0.707 19163 4044 1 11 . 1 1 47 47 LYS H H 47 7.826 7.826 7.306 0.520 19163 4045 1 11 . 1 1 48 48 ASN N N 48 116.573 116.573 118.938 -2.365 19163 4046 1 11 . 1 1 48 48 ASN HA H 48 5.021 5.021 5.149 -0.128 19163 4047 1 11 . 1 1 48 48 ASN C C 48 172.992 172.992 173.747 -0.755 19163 4048 1 11 . 1 1 48 48 ASN CA C 48 50.467 50.467 50.362 0.105 19163 4049 1 11 . 1 1 48 48 ASN CB C 48 39.284 39.284 38.813 0.471 19163 4050 1 11 . 1 1 48 48 ASN H H 48 7.956 7.956 8.347 -0.391 19163 4051 1 11 . 1 1 49 49 PRO HA H 49 4.448 4.448 4.488 -0.040 19163 4052 1 11 . 1 1 49 49 PRO C C 49 178.030 178.030 177.877 0.153 19163 4053 1 11 . 1 1 49 49 PRO CA C 49 64.468 64.468 64.924 -0.455 19163 4054 1 11 . 1 1 49 49 PRO CB C 49 32.173 32.173 32.069 0.104 19163 4055 1 11 . 1 1 50 50 ASN N N 50 115.567 115.567 116.630 -1.063 19163 4056 1 11 . 1 1 50 50 ASN HA H 50 4.748 4.748 4.616 0.132 19163 4057 1 11 . 1 1 50 50 ASN C C 50 176.443 176.443 176.312 0.131 19163 4058 1 11 . 1 1 50 50 ASN CA C 50 54.677 54.677 55.191 -0.513 19163 4059 1 11 . 1 1 50 50 ASN CB C 50 39.014 39.014 37.548 1.466 19163 4060 1 11 . 1 1 50 50 ASN H H 50 8.398 8.398 8.640 -0.242 19163 4061 1 11 . 1 1 51 51 GLU N N 51 119.270 119.270 117.783 1.487 19163 4062 1 11 . 1 1 51 51 GLU HA H 51 4.797 4.797 4.631 0.166 19163 4063 1 11 . 1 1 51 51 GLU C C 51 176.922 176.922 177.786 -0.864 19163 4064 1 11 . 1 1 51 51 GLU CA C 51 55.916 55.916 56.066 -0.150 19163 4065 1 11 . 1 1 51 51 GLU CB C 51 29.200 29.200 29.783 -0.583 19163 4066 1 11 . 1 1 51 51 GLU H H 51 7.485 7.485 7.726 -0.241 19163 4067 1 11 . 1 1 52 52 GLY N N 52 107.541 107.541 108.777 -1.236 19163 4068 1 11 . 1 1 52 52 GLY C C 52 176.755 176.755 175.503 1.252 19163 4069 1 11 . 1 1 52 52 GLY CA C 52 47.914 47.914 47.173 0.741 19163 4070 1 11 . 1 1 52 52 GLY H H 52 8.092 8.092 7.679 0.413 19163 4071 1 11 . 1 1 53 53 GLU N N 53 121.603 121.603 120.767 0.836 19163 4072 1 11 . 1 1 53 53 GLU HA H 53 4.065 4.065 4.076 -0.011 19163 4073 1 11 . 1 1 53 53 GLU C C 53 179.052 179.052 178.735 0.317 19163 4074 1 11 . 1 1 53 53 GLU CA C 53 59.280 59.280 59.448 -0.168 19163 4075 1 11 . 1 1 53 53 GLU CB C 53 28.968 28.968 29.322 -0.354 19163 4076 1 11 . 1 1 53 53 GLU H H 53 8.496 8.496 8.548 -0.052 19163 4077 1 11 . 1 1 54 54 LYS N N 54 120.837 120.837 119.063 1.774 19163 4078 1 11 . 1 1 54 54 LYS HA H 54 3.923 3.923 4.290 -0.367 19163 4079 1 11 . 1 1 54 54 LYS C C 54 179.058 179.058 179.117 -0.059 19163 4080 1 11 . 1 1 54 54 LYS CA C 54 58.800 58.800 58.922 -0.122 19163 4081 1 11 . 1 1 54 54 LYS CB C 54 31.551 31.551 32.296 -0.745 19163 4082 1 11 . 1 1 54 54 LYS H H 54 7.857 7.857 7.573 0.284 19163 4083 1 11 . 1 1 55 55 PHE N N 55 118.608 118.608 120.890 -2.282 19163 4084 1 11 . 1 1 55 55 PHE HA H 55 4.021 4.021 4.154 -0.133 19163 4085 1 11 . 1 1 55 55 PHE C C 55 178.001 178.001 177.006 0.995 19163 4086 1 11 . 1 1 55 55 PHE CA C 55 61.911 61.911 60.887 1.024 19163 4087 1 11 . 1 1 55 55 PHE CB C 55 38.553 38.553 38.943 -0.390 19163 4088 1 11 . 1 1 55 55 PHE H H 55 8.382 8.382 8.222 0.160 19163 4089 1 11 . 1 1 56 56 LYS N N 56 120.898 120.898 118.958 1.940 19163 4090 1 11 . 1 1 56 56 LYS HA H 56 3.828 3.828 3.873 -0.045 19163 4091 1 11 . 1 1 56 56 LYS C C 56 178.817 178.817 178.832 -0.015 19163 4092 1 11 . 1 1 56 56 LYS CA C 56 59.877 59.877 60.050 -0.173 19163 4093 1 11 . 1 1 56 56 LYS CB C 56 32.133 32.133 31.959 0.174 19163 4094 1 11 . 1 1 56 56 LYS H H 56 8.111 8.111 7.888 0.223 19163 4095 1 11 . 1 1 57 57 GLN N N 57 118.600 118.600 118.672 -0.072 19163 4096 1 11 . 1 1 57 57 GLN HA H 57 4.009 4.009 4.021 -0.012 19163 4097 1 11 . 1 1 57 57 GLN C C 57 179.333 179.333 178.479 0.854 19163 4098 1 11 . 1 1 57 57 GLN CA C 57 59.109 59.109 58.729 0.380 19163 4099 1 11 . 1 1 57 57 GLN CB C 57 28.595 28.595 28.597 -0.002 19163 4100 1 11 . 1 1 57 57 GLN H H 57 7.613 7.613 7.604 0.009 19163 4101 1 11 . 1 1 58 58 ILE N N 58 118.709 118.709 120.322 -1.613 19163 4102 1 11 . 1 1 58 58 ILE HA H 58 3.559 3.559 3.590 -0.031 19163 4103 1 11 . 1 1 58 58 ILE C C 58 177.152 177.152 178.104 -0.952 19163 4104 1 11 . 1 1 58 58 ILE CA C 58 65.068 65.068 65.254 -0.186 19163 4105 1 11 . 1 1 58 58 ILE CB C 58 38.381 38.381 37.651 0.730 19163 4106 1 11 . 1 1 58 58 ILE H H 58 8.011 8.011 7.432 0.579 19163 4107 1 11 . 1 1 59 59 SER N N 59 116.112 116.112 115.758 0.354 19163 4108 1 11 . 1 1 59 59 SER HA H 59 3.948 3.948 4.005 -0.057 19163 4109 1 11 . 1 1 59 59 SER C C 59 175.949 175.949 176.813 -0.864 19163 4110 1 11 . 1 1 59 59 SER CA C 59 62.315 62.315 62.304 0.011 19163 4111 1 11 . 1 1 59 59 SER H H 59 8.030 8.030 8.211 -0.181 19163 4112 1 11 . 1 1 60 60 GLN N N 60 122.099 122.099 121.330 0.769 19163 4113 1 11 . 1 1 60 60 GLN HA H 60 3.801 3.801 3.948 -0.147 19163 4114 1 11 . 1 1 60 60 GLN C C 60 176.942 176.942 178.328 -1.386 19163 4115 1 11 . 1 1 60 60 GLN CA C 60 58.762 58.762 58.976 -0.214 19163 4116 1 11 . 1 1 60 60 GLN CB C 60 28.498 28.498 28.684 -0.186 19163 4117 1 11 . 1 1 60 60 GLN H H 60 7.933 7.933 7.794 0.139 19163 4118 1 11 . 1 1 61 61 ALA N N 61 119.367 119.367 122.232 -2.865 19163 4119 1 11 . 1 1 61 61 ALA HA H 61 2.636 2.636 3.913 -1.277 19163 4120 1 11 . 1 1 61 61 ALA C C 61 178.507 178.507 179.323 -0.816 19163 4121 1 11 . 1 1 61 61 ALA CA C 61 54.126 54.126 54.920 -0.794 19163 4122 1 11 . 1 1 61 61 ALA CB C 61 18.462 18.462 18.332 0.130 19163 4123 1 11 . 1 1 61 61 ALA H H 61 7.354 7.354 7.660 -0.306 19163 4124 1 11 . 1 1 62 62 TYR N N 62 115.613 115.613 119.981 -4.368 19163 4125 1 11 . 1 1 62 62 TYR HA H 62 3.633 3.633 3.914 -0.281 19163 4126 1 11 . 1 1 62 62 TYR C C 62 177.421 177.421 177.380 0.041 19163 4127 1 11 . 1 1 62 62 TYR CA C 62 61.676 61.676 61.184 0.492 19163 4128 1 11 . 1 1 62 62 TYR CB C 62 39.162 39.162 38.180 0.982 19163 4129 1 11 . 1 1 62 62 TYR H H 62 7.994 7.994 8.649 -0.655 19163 4130 1 11 . 1 1 63 63 GLU N N 63 121.396 121.396 119.370 2.026 19163 4131 1 11 . 1 1 63 63 GLU HA H 63 3.347 3.347 3.664 -0.317 19163 4132 1 11 . 1 1 63 63 GLU C C 63 177.687 177.687 179.140 -1.453 19163 4133 1 11 . 1 1 63 63 GLU CA C 63 59.562 59.562 59.438 0.124 19163 4134 1 11 . 1 1 63 63 GLU CB C 63 29.115 29.115 29.329 -0.214 19163 4135 1 11 . 1 1 63 63 GLU H H 63 8.151 8.151 8.016 0.135 19163 4136 1 11 . 1 1 64 64 VAL N N 64 115.850 115.850 118.021 -2.171 19163 4137 1 11 . 1 1 64 64 VAL HA H 64 3.377 3.377 3.679 -0.302 19163 4138 1 11 . 1 1 64 64 VAL C C 64 175.925 175.925 177.351 -1.426 19163 4139 1 11 . 1 1 64 64 VAL CA C 64 65.806 65.806 65.060 0.746 19163 4140 1 11 . 1 1 64 64 VAL CB C 64 31.786 31.786 31.923 -0.137 19163 4141 1 11 . 1 1 64 64 VAL H H 64 6.814 6.814 7.254 -0.440 19163 4142 1 11 . 1 1 65 65 LEU N N 65 111.438 111.438 119.891 -8.453 19163 4143 1 11 . 1 1 65 65 LEU HA H 65 3.569 3.569 3.860 -0.291 19163 4144 1 11 . 1 1 65 65 LEU C C 65 177.124 177.124 179.041 -1.917 19163 4145 1 11 . 1 1 65 65 LEU CA C 65 56.645 56.645 57.326 -0.681 19163 4146 1 11 . 1 1 65 65 LEU CB C 65 42.589 42.589 40.772 1.817 19163 4147 1 11 . 1 1 65 65 LEU H H 65 7.398 7.398 8.394 -0.996 19163 4148 1 11 . 1 1 66 66 SER N N 66 108.642 108.642 111.533 -2.891 19163 4149 1 11 . 1 1 66 66 SER HA H 66 4.028 4.028 4.112 -0.084 19163 4150 1 11 . 1 1 66 66 SER C C 66 173.286 173.286 173.992 -0.706 19163 4151 1 11 . 1 1 66 66 SER CA C 66 59.232 59.232 59.503 -0.271 19163 4152 1 11 . 1 1 66 66 SER CB C 66 63.066 63.066 63.038 0.028 19163 4153 1 11 . 1 1 66 66 SER H H 66 7.700 7.700 7.712 -0.012 19163 4154 1 11 . 1 1 67 67 ASP N N 67 124.276 124.276 120.825 3.451 19163 4155 1 11 . 1 1 67 67 ASP HA H 67 4.668 4.668 4.673 -0.005 19163 4156 1 11 . 1 1 67 67 ASP C C 67 174.913 174.913 175.693 -0.780 19163 4157 1 11 . 1 1 67 67 ASP CA C 67 52.487 52.487 52.652 -0.165 19163 4158 1 11 . 1 1 67 67 ASP CB C 67 43.218 43.218 42.237 0.981 19163 4159 1 11 . 1 1 67 67 ASP H H 67 6.879 6.879 7.173 -0.294 19163 4160 1 11 . 1 1 68 68 ALA N N 68 127.326 127.326 130.873 -3.547 19163 4161 1 11 . 1 1 68 68 ALA HA H 68 3.853 3.853 3.909 -0.056 19163 4162 1 11 . 1 1 68 68 ALA C C 68 180.336 180.336 178.835 1.501 19163 4163 1 11 . 1 1 68 68 ALA CA C 68 55.912 55.912 55.387 0.525 19163 4164 1 11 . 1 1 68 68 ALA CB C 68 18.645 18.645 18.790 -0.145 19163 4165 1 11 . 1 1 68 68 ALA H H 68 8.693 8.693 8.846 -0.153 19163 4166 1 11 . 1 1 69 69 LYS N N 69 116.929 116.929 118.310 -1.381 19163 4167 1 11 . 1 1 69 69 LYS HA H 69 4.162 4.162 4.040 0.122 19163 4168 1 11 . 1 1 69 69 LYS C C 69 179.515 179.515 178.671 0.844 19163 4169 1 11 . 1 1 69 69 LYS CA C 69 58.562 58.562 59.215 -0.653 19163 4170 1 11 . 1 1 69 69 LYS CB C 69 31.840 31.840 32.307 -0.467 19163 4171 1 11 . 1 1 69 69 LYS H H 69 7.950 7.950 7.759 0.191 19163 4172 1 11 . 1 1 70 70 LYS N N 70 121.286 121.286 119.334 1.952 19163 4173 1 11 . 1 1 70 70 LYS HA H 70 3.960 3.960 3.957 0.003 19163 4174 1 11 . 1 1 70 70 LYS C C 70 179.938 179.938 178.977 0.961 19163 4175 1 11 . 1 1 70 70 LYS CA C 70 60.066 60.066 59.707 0.359 19163 4176 1 11 . 1 1 70 70 LYS CB C 70 32.695 32.695 32.307 0.388 19163 4177 1 11 . 1 1 70 70 LYS H H 70 8.184 8.184 8.731 -0.547 19163 4178 1 11 . 1 1 71 71 ARG N N 71 122.794 122.794 119.653 3.141 19163 4179 1 11 . 1 1 71 71 ARG HA H 71 3.668 3.668 3.884 -0.216 19163 4180 1 11 . 1 1 71 71 ARG C C 71 177.356 177.356 178.185 -0.829 19163 4181 1 11 . 1 1 71 71 ARG CA C 71 60.127 60.127 60.139 -0.012 19163 4182 1 11 . 1 1 71 71 ARG CB C 71 29.668 29.668 30.192 -0.524 19163 4183 1 11 . 1 1 71 71 ARG H H 71 9.290 9.290 8.622 0.668 19163 4184 1 11 . 1 1 72 72 GLU N N 72 118.390 118.390 119.662 -1.272 19163 4185 1 11 . 1 1 72 72 GLU HA H 72 4.096 4.096 4.080 0.016 19163 4186 1 11 . 1 1 72 72 GLU C C 72 179.073 179.073 178.930 0.143 19163 4187 1 11 . 1 1 72 72 GLU CA C 72 59.456 59.456 59.282 0.174 19163 4188 1 11 . 1 1 72 72 GLU CB C 72 29.615 29.615 29.615 0.000 19163 4189 1 11 . 1 1 72 72 GLU H H 72 7.607 7.607 7.602 0.005 19163 4190 1 11 . 1 1 73 73 LEU N N 73 117.921 117.921 119.749 -1.828 19163 4191 1 11 . 1 1 73 73 LEU HA H 73 4.032 4.032 4.022 0.010 19163 4192 1 11 . 1 1 73 73 LEU C C 73 179.696 179.696 179.034 0.662 19163 4193 1 11 . 1 1 73 73 LEU CA C 73 57.597 57.597 57.848 -0.251 19163 4194 1 11 . 1 1 73 73 LEU CB C 73 41.815 41.815 41.842 -0.027 19163 4195 1 11 . 1 1 73 73 LEU H H 73 7.398 7.398 8.145 -0.747 19163 4196 1 11 . 1 1 74 74 TYR N N 74 122.662 122.662 118.605 4.057 19163 4197 1 11 . 1 1 74 74 TYR HA H 74 4.092 4.092 4.163 -0.071 19163 4198 1 11 . 1 1 74 74 TYR C C 74 178.166 178.166 178.046 0.120 19163 4199 1 11 . 1 1 74 74 TYR CA C 74 61.458 61.458 61.081 0.377 19163 4200 1 11 . 1 1 74 74 TYR CB C 74 38.778 38.778 38.871 -0.093 19163 4201 1 11 . 1 1 74 74 TYR H H 74 8.316 8.316 8.457 -0.141 19163 4202 1 11 . 1 1 75 75 ASP N N 75 118.842 118.842 120.180 -1.338 19163 4203 1 11 . 1 1 75 75 ASP HA H 75 4.423 4.423 4.448 -0.025 19163 4204 1 11 . 1 1 75 75 ASP C C 75 177.726 177.726 177.567 0.159 19163 4205 1 11 . 1 1 75 75 ASP CA C 75 56.177 56.177 56.862 -0.685 19163 4206 1 11 . 1 1 75 75 ASP CB C 75 40.800 40.800 40.709 0.091 19163 4207 1 11 . 1 1 75 75 ASP H H 75 8.770 8.770 8.038 0.732 19163 4208 1 11 . 1 1 76 76 LYS N N 76 118.955 118.955 117.990 0.965 19163 4209 1 11 . 1 1 76 76 LYS HA H 76 4.130 4.130 4.298 -0.168 19163 4210 1 11 . 1 1 76 76 LYS C C 76 177.006 177.006 177.203 -0.197 19163 4211 1 11 . 1 1 76 76 LYS CA C 76 57.537 57.537 55.818 1.719 19163 4212 1 11 . 1 1 76 76 LYS CB C 76 33.136 33.136 32.255 0.881 19163 4213 1 11 . 1 1 76 76 LYS H H 76 7.610 7.610 7.573 0.037 19163 4214 1 12 . 1 1 11 11 MET HA H 11 4.346 4.346 4.682 -0.336 19163 4215 1 12 . 1 1 11 11 MET C C 11 175.801 175.801 175.652 0.149 19163 4216 1 12 . 1 1 11 11 MET CA C 11 55.614 55.614 55.008 0.606 19163 4217 1 12 . 1 1 11 11 MET CB C 11 32.925 32.925 33.020 -0.095 19163 4218 1 12 . 1 1 12 12 VAL N N 12 121.226 121.226 125.873 -4.647 19163 4219 1 12 . 1 1 12 12 VAL HA H 12 4.026 4.026 4.242 -0.216 19163 4220 1 12 . 1 1 12 12 VAL C C 12 175.701 175.701 175.909 -0.208 19163 4221 1 12 . 1 1 12 12 VAL CA C 12 62.188 62.188 62.224 -0.036 19163 4222 1 12 . 1 1 12 12 VAL CB C 12 32.882 32.882 32.046 0.836 19163 4223 1 12 . 1 1 12 12 VAL H H 12 7.988 7.988 8.659 -0.671 19163 4224 1 12 . 1 1 13 13 LYS N N 13 125.255 125.255 128.263 -3.008 19163 4225 1 12 . 1 1 13 13 LYS HA H 13 4.211 4.211 4.496 -0.285 19163 4226 1 12 . 1 1 13 13 LYS C C 13 176.121 176.121 175.309 0.812 19163 4227 1 12 . 1 1 13 13 LYS CA C 13 56.355 56.355 55.743 0.612 19163 4228 1 12 . 1 1 13 13 LYS CB C 13 33.019 33.019 32.632 0.387 19163 4229 1 12 . 1 1 13 13 LYS H H 13 8.281 8.281 8.619 -0.338 19163 4230 1 12 . 1 1 14 14 GLU N N 14 123.004 123.004 121.777 1.227 19163 4231 1 12 . 1 1 14 14 GLU HA H 14 4.305 4.305 4.068 0.237 19163 4232 1 12 . 1 1 14 14 GLU C C 14 176.107 176.107 175.186 0.921 19163 4233 1 12 . 1 1 14 14 GLU CA C 14 56.343 56.343 56.365 -0.022 19163 4234 1 12 . 1 1 14 14 GLU CB C 14 30.534 30.534 29.687 0.847 19163 4235 1 12 . 1 1 14 14 GLU H H 14 8.424 8.424 8.547 -0.123 19163 4236 1 12 . 1 1 15 15 THR N N 15 115.895 115.895 116.658 -0.763 19163 4237 1 12 . 1 1 15 15 THR HA H 15 4.538 4.538 4.629 -0.091 19163 4238 1 12 . 1 1 15 15 THR C C 15 175.233 175.233 174.541 0.692 19163 4239 1 12 . 1 1 15 15 THR CA C 15 61.981 61.981 62.487 -0.506 19163 4240 1 12 . 1 1 15 15 THR CB C 15 69.865 69.865 69.317 0.548 19163 4241 1 12 . 1 1 15 15 THR H H 15 8.335 8.335 8.290 0.045 19163 4242 1 12 . 1 1 16 16 THR N N 16 116.992 116.992 119.764 -2.772 19163 4243 1 12 . 1 1 16 16 THR HA H 16 4.366 4.366 4.412 -0.046 19163 4244 1 12 . 1 1 16 16 THR C C 16 176.090 176.090 175.569 0.521 19163 4245 1 12 . 1 1 16 16 THR CA C 16 62.172 62.172 59.533 2.639 19163 4246 1 12 . 1 1 16 16 THR CB C 16 71.997 71.997 70.756 1.241 19163 4247 1 12 . 1 1 16 16 THR H H 16 8.798 8.798 8.311 0.487 19163 4248 1 12 . 1 1 17 17 TYR N N 17 117.617 117.617 120.181 -2.564 19163 4249 1 12 . 1 1 17 17 TYR HA H 17 4.329 4.329 4.192 0.137 19163 4250 1 12 . 1 1 17 17 TYR C C 17 177.105 177.105 178.057 -0.952 19163 4251 1 12 . 1 1 17 17 TYR CA C 17 57.577 57.577 62.215 -4.638 19163 4252 1 12 . 1 1 17 17 TYR CB C 17 37.113 37.113 38.019 -0.906 19163 4253 1 12 . 1 1 17 17 TYR H H 17 8.292 8.292 9.009 -0.717 19163 4254 1 12 . 1 1 18 18 TYR N N 18 115.048 115.048 117.588 -2.540 19163 4255 1 12 . 1 1 18 18 TYR HA H 18 3.775 3.775 4.293 -0.518 19163 4256 1 12 . 1 1 18 18 TYR C C 18 177.771 177.771 177.727 0.044 19163 4257 1 12 . 1 1 18 18 TYR CA C 18 61.430 61.430 61.549 -0.119 19163 4258 1 12 . 1 1 18 18 TYR CB C 18 36.495 36.495 37.233 -0.738 19163 4259 1 12 . 1 1 18 18 TYR H H 18 7.047 7.047 8.011 -0.964 19163 4260 1 12 . 1 1 19 19 ASP N N 19 119.520 119.520 119.272 0.248 19163 4261 1 12 . 1 1 19 19 ASP HA H 19 4.406 4.406 4.463 -0.057 19163 4262 1 12 . 1 1 19 19 ASP C C 19 180.128 180.128 178.624 1.504 19163 4263 1 12 . 1 1 19 19 ASP CA C 19 57.475 57.475 57.175 0.300 19163 4264 1 12 . 1 1 19 19 ASP CB C 19 40.659 40.659 40.209 0.450 19163 4265 1 12 . 1 1 19 19 ASP H H 19 7.685 7.685 8.473 -0.788 19163 4266 1 12 . 1 1 20 20 VAL N N 20 119.772 119.772 119.459 0.313 19163 4267 1 12 . 1 1 20 20 VAL HA H 20 3.608 3.608 3.710 -0.102 19163 4268 1 12 . 1 1 20 20 VAL C C 20 177.026 177.026 177.209 -0.183 19163 4269 1 12 . 1 1 20 20 VAL CA C 20 65.840 65.840 66.004 -0.164 19163 4270 1 12 . 1 1 20 20 VAL CB C 20 31.530 31.530 31.951 -0.421 19163 4271 1 12 . 1 1 20 20 VAL H H 20 8.004 8.004 8.225 -0.221 19163 4272 1 12 . 1 1 21 21 LEU N N 21 115.252 115.252 116.787 -1.535 19163 4273 1 12 . 1 1 21 21 LEU HA H 21 4.281 4.281 4.290 -0.009 19163 4274 1 12 . 1 1 21 21 LEU C C 21 175.757 175.757 176.831 -1.074 19163 4275 1 12 . 1 1 21 21 LEU CA C 21 54.554 54.554 54.379 0.175 19163 4276 1 12 . 1 1 21 21 LEU CB C 21 42.869 42.869 42.235 0.634 19163 4277 1 12 . 1 1 21 21 LEU H H 21 6.847 6.847 7.562 -0.715 19163 4278 1 12 . 1 1 22 22 GLY N N 22 108.227 108.227 107.120 1.107 19163 4279 1 12 . 1 1 22 22 GLY C C 22 175.361 175.361 174.320 1.041 19163 4280 1 12 . 1 1 22 22 GLY CA C 22 46.574 46.574 45.508 1.066 19163 4281 1 12 . 1 1 22 22 GLY H H 22 7.874 7.874 7.465 0.409 19163 4282 1 12 . 1 1 23 23 VAL N N 23 110.675 110.675 118.789 -8.114 19163 4283 1 12 . 1 1 23 23 VAL HA H 23 4.767 4.767 4.432 0.335 19163 4284 1 12 . 1 1 23 23 VAL C C 23 174.674 174.674 174.558 0.116 19163 4285 1 12 . 1 1 23 23 VAL CA C 23 58.349 58.349 60.158 -1.809 19163 4286 1 12 . 1 1 23 23 VAL CB C 23 34.938 34.938 35.226 -0.288 19163 4287 1 12 . 1 1 23 23 VAL H H 23 7.815 7.815 8.357 -0.542 19163 4288 1 12 . 1 1 24 24 LYS N N 24 119.948 119.948 124.443 -4.495 19163 4289 1 12 . 1 1 24 24 LYS HA H 24 4.488 4.488 4.694 -0.206 19163 4290 1 12 . 1 1 24 24 LYS C C 24 175.442 175.442 176.071 -0.629 19163 4291 1 12 . 1 1 24 24 LYS CA C 24 54.001 54.001 54.353 -0.352 19163 4292 1 12 . 1 1 24 24 LYS CB C 24 32.197 32.197 32.261 -0.064 19163 4293 1 12 . 1 1 24 24 LYS H H 24 8.329 8.329 8.361 -0.032 19163 4294 1 12 . 1 1 25 25 PRO HA H 25 2.421 2.421 4.137 -1.716 19163 4295 1 12 . 1 1 25 25 PRO C C 25 175.635 175.635 176.080 -0.445 19163 4296 1 12 . 1 1 25 25 PRO CA C 25 63.362 63.362 64.555 -1.193 19163 4297 1 12 . 1 1 25 25 PRO CB C 25 31.839 31.839 31.597 0.242 19163 4298 1 12 . 1 1 26 26 ASN N N 26 111.739 111.739 113.865 -2.126 19163 4299 1 12 . 1 1 26 26 ASN HA H 26 4.518 4.518 4.778 -0.260 19163 4300 1 12 . 1 1 26 26 ASN C C 26 175.820 175.820 174.645 1.175 19163 4301 1 12 . 1 1 26 26 ASN CA C 26 51.525 51.525 51.726 -0.201 19163 4302 1 12 . 1 1 26 26 ASN CB C 26 36.829 36.829 37.448 -0.619 19163 4303 1 12 . 1 1 26 26 ASN H H 26 7.138 7.138 8.299 -1.161 19163 4304 1 12 . 1 1 27 27 ALA N N 27 122.829 122.829 125.084 -2.255 19163 4305 1 12 . 1 1 27 27 ALA HA H 27 4.325 4.325 4.418 -0.093 19163 4306 1 12 . 1 1 27 27 ALA C C 27 178.726 178.726 176.691 2.035 19163 4307 1 12 . 1 1 27 27 ALA CA C 27 52.961 52.961 52.005 0.956 19163 4308 1 12 . 1 1 27 27 ALA CB C 27 19.159 19.159 19.700 -0.541 19163 4309 1 12 . 1 1 27 27 ALA H H 27 7.637 7.637 7.721 -0.084 19163 4310 1 12 . 1 1 28 28 THR N N 28 113.468 113.468 113.440 0.028 19163 4311 1 12 . 1 1 28 28 THR HA H 28 4.493 4.493 4.417 0.076 19163 4312 1 12 . 1 1 28 28 THR C C 28 175.641 175.641 175.765 -0.124 19163 4313 1 12 . 1 1 28 28 THR CA C 28 60.592 60.592 61.074 -0.482 19163 4314 1 12 . 1 1 28 28 THR CB C 28 71.304 71.304 70.825 0.479 19163 4315 1 12 . 1 1 28 28 THR H H 28 8.829 8.829 7.985 0.844 19163 4316 1 12 . 1 1 29 29 GLN N N 29 119.445 119.445 122.063 -2.618 19163 4317 1 12 . 1 1 29 29 GLN HA H 29 4.035 4.035 3.973 0.062 19163 4318 1 12 . 1 1 29 29 GLN C C 29 179.117 179.117 178.487 0.630 19163 4319 1 12 . 1 1 29 29 GLN CA C 29 59.435 59.435 59.987 -0.552 19163 4320 1 12 . 1 1 29 29 GLN CB C 29 27.851 27.851 28.260 -0.409 19163 4321 1 12 . 1 1 29 29 GLN H H 29 9.015 9.015 8.798 0.217 19163 4322 1 12 . 1 1 30 30 GLU N N 30 119.343 119.343 118.163 1.180 19163 4323 1 12 . 1 1 30 30 GLU HA H 30 4.059 4.059 4.069 -0.010 19163 4324 1 12 . 1 1 30 30 GLU C C 30 179.097 179.097 178.712 0.385 19163 4325 1 12 . 1 1 30 30 GLU CA C 30 59.847 59.847 59.572 0.275 19163 4326 1 12 . 1 1 30 30 GLU CB C 30 29.356 29.356 29.186 0.170 19163 4327 1 12 . 1 1 30 30 GLU H H 30 8.549 8.549 8.606 -0.057 19163 4328 1 12 . 1 1 31 31 GLU N N 31 120.562 120.562 120.818 -0.256 19163 4329 1 12 . 1 1 31 31 GLU HA H 31 3.906 3.906 4.127 -0.221 19163 4330 1 12 . 1 1 31 31 GLU C C 31 180.405 180.405 179.059 1.346 19163 4331 1 12 . 1 1 31 31 GLU CA C 31 59.592 59.592 59.005 0.587 19163 4332 1 12 . 1 1 31 31 GLU CB C 31 29.989 29.989 29.236 0.753 19163 4333 1 12 . 1 1 31 31 GLU H H 31 7.768 7.768 8.261 -0.493 19163 4334 1 12 . 1 1 32 32 LEU N N 32 120.518 120.518 120.425 0.093 19163 4335 1 12 . 1 1 32 32 LEU HA H 32 3.963 3.963 4.003 -0.040 19163 4336 1 12 . 1 1 32 32 LEU C C 32 177.873 177.873 178.983 -1.110 19163 4337 1 12 . 1 1 32 32 LEU CA C 32 58.593 58.593 57.891 0.702 19163 4338 1 12 . 1 1 32 32 LEU CB C 32 42.556 42.556 41.258 1.298 19163 4339 1 12 . 1 1 32 32 LEU H H 32 8.475 8.475 8.623 -0.148 19163 4340 1 12 . 1 1 33 33 LYS N N 33 119.091 119.091 119.640 -0.549 19163 4341 1 12 . 1 1 33 33 LYS HA H 33 4.000 4.000 4.106 -0.106 19163 4342 1 12 . 1 1 33 33 LYS C C 33 178.701 178.701 178.986 -0.285 19163 4343 1 12 . 1 1 33 33 LYS CA C 33 60.274 60.274 59.904 0.370 19163 4344 1 12 . 1 1 33 33 LYS CB C 33 32.656 32.656 32.346 0.310 19163 4345 1 12 . 1 1 33 33 LYS H H 33 8.077 8.077 7.831 0.246 19163 4346 1 12 . 1 1 34 34 LYS N N 34 118.527 118.527 119.267 -0.740 19163 4347 1 12 . 1 1 34 34 LYS HA H 34 3.890 3.890 4.031 -0.141 19163 4348 1 12 . 1 1 34 34 LYS C C 34 179.172 179.172 178.933 0.239 19163 4349 1 12 . 1 1 34 34 LYS CA C 34 59.927 59.927 59.365 0.562 19163 4350 1 12 . 1 1 34 34 LYS CB C 34 32.869 32.869 32.383 0.486 19163 4351 1 12 . 1 1 34 34 LYS H H 34 7.986 7.986 8.141 -0.155 19163 4352 1 12 . 1 1 35 35 ALA N N 35 122.190 122.190 122.864 -0.674 19163 4353 1 12 . 1 1 35 35 ALA HA H 35 4.116 4.116 4.058 0.058 19163 4354 1 12 . 1 1 35 35 ALA C C 35 179.982 179.982 179.005 0.977 19163 4355 1 12 . 1 1 35 35 ALA CA C 35 55.157 55.157 55.310 -0.153 19163 4356 1 12 . 1 1 35 35 ALA CB C 35 18.773 18.773 18.337 0.436 19163 4357 1 12 . 1 1 35 35 ALA H H 35 7.917 7.917 8.458 -0.541 19163 4358 1 12 . 1 1 36 36 TYR N N 36 117.701 117.701 120.378 -2.677 19163 4359 1 12 . 1 1 36 36 TYR HA H 36 3.818 3.818 4.044 -0.226 19163 4360 1 12 . 1 1 36 36 TYR C C 36 176.344 176.344 177.486 -1.142 19163 4361 1 12 . 1 1 36 36 TYR CA C 36 61.468 61.468 61.353 0.115 19163 4362 1 12 . 1 1 36 36 TYR CB C 36 38.890 38.890 38.391 0.499 19163 4363 1 12 . 1 1 36 36 TYR H H 36 8.402 8.402 7.824 0.578 19163 4364 1 12 . 1 1 37 37 ARG N N 37 117.423 117.423 119.233 -1.810 19163 4365 1 12 . 1 1 37 37 ARG HA H 37 3.481 3.481 3.722 -0.241 19163 4366 1 12 . 1 1 37 37 ARG C C 37 178.825 178.825 178.272 0.553 19163 4367 1 12 . 1 1 37 37 ARG CA C 37 59.397 59.397 59.829 -0.432 19163 4368 1 12 . 1 1 37 37 ARG CB C 37 29.710 29.710 30.053 -0.343 19163 4369 1 12 . 1 1 37 37 ARG H H 37 8.264 8.264 8.333 -0.069 19163 4370 1 12 . 1 1 38 38 LYS N N 38 117.247 117.247 119.716 -2.469 19163 4371 1 12 . 1 1 38 38 LYS HA H 38 3.905 3.905 4.051 -0.145 19163 4372 1 12 . 1 1 38 38 LYS C C 38 179.444 179.444 179.182 0.262 19163 4373 1 12 . 1 1 38 38 LYS CA C 38 59.450 59.450 59.482 -0.032 19163 4374 1 12 . 1 1 38 38 LYS CB C 38 32.609 32.609 32.394 0.215 19163 4375 1 12 . 1 1 38 38 LYS H H 38 7.444 7.444 7.948 -0.504 19163 4376 1 12 . 1 1 39 39 LEU N N 39 119.901 119.901 119.367 0.534 19163 4377 1 12 . 1 1 39 39 LEU HA H 39 4.020 4.020 4.210 -0.190 19163 4378 1 12 . 1 1 39 39 LEU C C 39 178.801 178.801 178.861 -0.060 19163 4379 1 12 . 1 1 39 39 LEU CA C 39 57.409 57.409 57.660 -0.251 19163 4380 1 12 . 1 1 39 39 LEU CB C 39 42.388 42.388 41.663 0.725 19163 4381 1 12 . 1 1 39 39 LEU H H 39 7.707 7.707 8.081 -0.374 19163 4382 1 12 . 1 1 40 40 ALA N N 40 122.772 122.772 121.879 0.893 19163 4383 1 12 . 1 1 40 40 ALA HA H 40 3.849 3.849 3.992 -0.143 19163 4384 1 12 . 1 1 40 40 ALA C C 40 179.446 179.446 179.364 0.082 19163 4385 1 12 . 1 1 40 40 ALA CA C 40 55.109 55.109 55.022 0.087 19163 4386 1 12 . 1 1 40 40 ALA CB C 40 17.116 17.116 17.994 -0.878 19163 4387 1 12 . 1 1 40 40 ALA H H 40 8.931 8.931 8.178 0.753 19163 4388 1 12 . 1 1 41 41 LEU N N 41 115.299 115.299 116.888 -1.589 19163 4389 1 12 . 1 1 41 41 LEU HA H 41 3.977 3.977 3.956 0.021 19163 4390 1 12 . 1 1 41 41 LEU C C 41 178.216 178.216 179.710 -1.494 19163 4391 1 12 . 1 1 41 41 LEU CA C 41 57.088 57.088 57.250 -0.162 19163 4392 1 12 . 1 1 41 41 LEU CB C 41 42.162 42.162 41.661 0.501 19163 4393 1 12 . 1 1 41 41 LEU H H 41 7.133 7.133 7.515 -0.382 19163 4394 1 12 . 1 1 42 42 LYS N N 42 116.812 116.812 118.691 -1.879 19163 4395 1 12 . 1 1 42 42 LYS HA H 42 3.925 3.925 4.004 -0.079 19163 4396 1 12 . 1 1 42 42 LYS C C 42 177.560 177.560 177.881 -0.321 19163 4397 1 12 . 1 1 42 42 LYS CA C 42 57.885 57.885 58.304 -0.419 19163 4398 1 12 . 1 1 42 42 LYS CB C 42 33.427 33.427 32.454 0.973 19163 4399 1 12 . 1 1 42 42 LYS H H 42 7.038 7.038 7.438 -0.400 19163 4400 1 12 . 1 1 43 43 TYR N N 43 114.022 114.022 115.674 -1.652 19163 4401 1 12 . 1 1 43 43 TYR HA H 43 4.665 4.665 4.594 0.071 19163 4402 1 12 . 1 1 43 43 TYR C C 43 173.741 173.741 174.003 -0.262 19163 4403 1 12 . 1 1 43 43 TYR CA C 43 56.928 56.928 56.125 0.803 19163 4404 1 12 . 1 1 43 43 TYR CB C 43 39.579 39.579 37.322 2.257 19163 4405 1 12 . 1 1 43 43 TYR H H 43 7.683 7.683 8.156 -0.473 19163 4406 1 12 . 1 1 44 44 HIS N N 44 120.947 120.947 123.240 -2.293 19163 4407 1 12 . 1 1 44 44 HIS HA H 44 3.697 3.697 4.398 -0.701 19163 4408 1 12 . 1 1 44 44 HIS C C 44 174.925 174.925 174.686 0.239 19163 4409 1 12 . 1 1 44 44 HIS CA C 44 56.229 56.229 56.237 -0.008 19163 4410 1 12 . 1 1 44 44 HIS CB C 44 30.852 30.852 30.893 -0.041 19163 4411 1 12 . 1 1 44 44 HIS H H 44 7.814 7.814 7.691 0.123 19163 4412 1 12 . 1 1 45 45 PRO HA H 45 4.131 4.131 4.452 -0.321 19163 4413 1 12 . 1 1 45 45 PRO C C 45 177.269 177.269 177.849 -0.580 19163 4414 1 12 . 1 1 45 45 PRO CA C 45 64.723 64.723 64.970 -0.247 19163 4415 1 12 . 1 1 45 45 PRO CB C 45 32.070 32.070 31.901 0.170 19163 4416 1 12 . 1 1 46 46 ASP N N 46 119.127 119.127 117.905 1.222 19163 4417 1 12 . 1 1 46 46 ASP HA H 46 4.375 4.375 4.573 -0.198 19163 4418 1 12 . 1 1 46 46 ASP C C 46 177.284 177.284 177.690 -0.406 19163 4419 1 12 . 1 1 46 46 ASP CA C 46 56.020 56.020 55.884 0.136 19163 4420 1 12 . 1 1 46 46 ASP CB C 46 40.221 40.221 41.334 -1.113 19163 4421 1 12 . 1 1 46 46 ASP H H 46 10.040 10.040 7.940 2.100 19163 4422 1 12 . 1 1 47 47 LYS N N 47 117.416 117.416 117.703 -0.287 19163 4423 1 12 . 1 1 47 47 LYS HA H 47 4.315 4.315 4.330 -0.015 19163 4424 1 12 . 1 1 47 47 LYS C C 47 176.355 176.355 176.380 -0.025 19163 4425 1 12 . 1 1 47 47 LYS CA C 47 55.880 55.880 56.969 -1.089 19163 4426 1 12 . 1 1 47 47 LYS CB C 47 33.778 33.778 33.938 -0.160 19163 4427 1 12 . 1 1 47 47 LYS H H 47 7.826 7.826 7.799 0.027 19163 4428 1 12 . 1 1 48 48 ASN N N 48 116.573 116.573 118.067 -1.494 19163 4429 1 12 . 1 1 48 48 ASN HA H 48 5.021 5.021 5.115 -0.094 19163 4430 1 12 . 1 1 48 48 ASN C C 48 172.992 172.992 173.723 -0.731 19163 4431 1 12 . 1 1 48 48 ASN CA C 48 50.467 50.467 50.884 -0.417 19163 4432 1 12 . 1 1 48 48 ASN CB C 48 39.284 39.284 39.338 -0.054 19163 4433 1 12 . 1 1 48 48 ASN H H 48 7.956 7.956 8.224 -0.268 19163 4434 1 12 . 1 1 49 49 PRO HA H 49 4.448 4.448 4.457 -0.009 19163 4435 1 12 . 1 1 49 49 PRO C C 49 178.030 178.030 178.090 -0.060 19163 4436 1 12 . 1 1 49 49 PRO CA C 49 64.468 64.468 64.781 -0.313 19163 4437 1 12 . 1 1 49 49 PRO CB C 49 32.173 32.173 31.986 0.187 19163 4438 1 12 . 1 1 50 50 ASN N N 50 115.567 115.567 116.624 -1.057 19163 4439 1 12 . 1 1 50 50 ASN HA H 50 4.748 4.748 4.574 0.174 19163 4440 1 12 . 1 1 50 50 ASN C C 50 176.443 176.443 176.145 0.298 19163 4441 1 12 . 1 1 50 50 ASN CA C 50 54.677 54.677 55.267 -0.590 19163 4442 1 12 . 1 1 50 50 ASN CB C 50 39.014 39.014 38.170 0.844 19163 4443 1 12 . 1 1 50 50 ASN H H 50 8.398 8.398 8.630 -0.232 19163 4444 1 12 . 1 1 51 51 GLU N N 51 119.270 119.270 119.019 0.251 19163 4445 1 12 . 1 1 51 51 GLU HA H 51 4.797 4.797 4.507 0.290 19163 4446 1 12 . 1 1 51 51 GLU C C 51 176.922 176.922 177.812 -0.890 19163 4447 1 12 . 1 1 51 51 GLU CA C 51 55.916 55.916 56.182 -0.266 19163 4448 1 12 . 1 1 51 51 GLU CB C 51 29.200 29.200 29.411 -0.211 19163 4449 1 12 . 1 1 51 51 GLU H H 51 7.485 7.485 7.663 -0.178 19163 4450 1 12 . 1 1 52 52 GLY N N 52 107.541 107.541 108.713 -1.172 19163 4451 1 12 . 1 1 52 52 GLY C C 52 176.755 176.755 175.934 0.821 19163 4452 1 12 . 1 1 52 52 GLY CA C 52 47.914 47.914 47.065 0.849 19163 4453 1 12 . 1 1 52 52 GLY H H 52 8.092 8.092 7.736 0.356 19163 4454 1 12 . 1 1 53 53 GLU N N 53 121.603 121.603 120.512 1.091 19163 4455 1 12 . 1 1 53 53 GLU HA H 53 4.065 4.065 4.110 -0.045 19163 4456 1 12 . 1 1 53 53 GLU C C 53 179.052 179.052 179.031 0.021 19163 4457 1 12 . 1 1 53 53 GLU CA C 53 59.280 59.280 59.350 -0.070 19163 4458 1 12 . 1 1 53 53 GLU CB C 53 28.968 28.968 29.182 -0.214 19163 4459 1 12 . 1 1 53 53 GLU H H 53 8.496 8.496 8.126 0.370 19163 4460 1 12 . 1 1 54 54 LYS N N 54 120.837 120.837 119.618 1.219 19163 4461 1 12 . 1 1 54 54 LYS HA H 54 3.923 3.923 4.045 -0.122 19163 4462 1 12 . 1 1 54 54 LYS C C 54 179.058 179.058 178.997 0.061 19163 4463 1 12 . 1 1 54 54 LYS CA C 54 58.800 58.800 58.890 -0.090 19163 4464 1 12 . 1 1 54 54 LYS CB C 54 31.551 31.551 32.196 -0.644 19163 4465 1 12 . 1 1 54 54 LYS H H 54 7.857 7.857 7.395 0.462 19163 4466 1 12 . 1 1 55 55 PHE N N 55 118.608 118.608 120.229 -1.621 19163 4467 1 12 . 1 1 55 55 PHE HA H 55 4.021 4.021 4.155 -0.134 19163 4468 1 12 . 1 1 55 55 PHE C C 55 178.001 178.001 176.984 1.017 19163 4469 1 12 . 1 1 55 55 PHE CA C 55 61.911 61.911 60.506 1.405 19163 4470 1 12 . 1 1 55 55 PHE CB C 55 38.553 38.553 39.153 -0.600 19163 4471 1 12 . 1 1 55 55 PHE H H 55 8.382 8.382 8.218 0.164 19163 4472 1 12 . 1 1 56 56 LYS N N 56 120.898 120.898 120.271 0.627 19163 4473 1 12 . 1 1 56 56 LYS HA H 56 3.828 3.828 3.839 -0.011 19163 4474 1 12 . 1 1 56 56 LYS C C 56 178.817 178.817 178.426 0.391 19163 4475 1 12 . 1 1 56 56 LYS CA C 56 59.877 59.877 60.115 -0.238 19163 4476 1 12 . 1 1 56 56 LYS CB C 56 32.133 32.133 32.030 0.103 19163 4477 1 12 . 1 1 56 56 LYS H H 56 8.111 8.111 7.892 0.219 19163 4478 1 12 . 1 1 57 57 GLN N N 57 118.600 118.600 118.085 0.515 19163 4479 1 12 . 1 1 57 57 GLN HA H 57 4.009 4.009 4.160 -0.151 19163 4480 1 12 . 1 1 57 57 GLN C C 57 179.333 179.333 178.680 0.653 19163 4481 1 12 . 1 1 57 57 GLN CA C 57 59.109 59.109 58.660 0.449 19163 4482 1 12 . 1 1 57 57 GLN CB C 57 28.595 28.595 28.681 -0.086 19163 4483 1 12 . 1 1 57 57 GLN H H 57 7.613 7.613 7.585 0.028 19163 4484 1 12 . 1 1 58 58 ILE N N 58 118.709 118.709 120.586 -1.877 19163 4485 1 12 . 1 1 58 58 ILE HA H 58 3.559 3.559 3.555 0.004 19163 4486 1 12 . 1 1 58 58 ILE C C 58 177.152 177.152 178.046 -0.894 19163 4487 1 12 . 1 1 58 58 ILE CA C 58 65.068 65.068 65.284 -0.216 19163 4488 1 12 . 1 1 58 58 ILE CB C 58 38.381 38.381 37.588 0.793 19163 4489 1 12 . 1 1 58 58 ILE H H 58 8.011 8.011 7.445 0.566 19163 4490 1 12 . 1 1 59 59 SER N N 59 116.112 116.112 115.686 0.426 19163 4491 1 12 . 1 1 59 59 SER HA H 59 3.948 3.948 3.932 0.016 19163 4492 1 12 . 1 1 59 59 SER C C 59 175.949 175.949 176.784 -0.835 19163 4493 1 12 . 1 1 59 59 SER CA C 59 62.315 62.315 62.278 0.037 19163 4494 1 12 . 1 1 59 59 SER H H 59 8.030 8.030 8.233 -0.203 19163 4495 1 12 . 1 1 60 60 GLN N N 60 122.099 122.099 121.136 0.963 19163 4496 1 12 . 1 1 60 60 GLN HA H 60 3.801 3.801 3.978 -0.177 19163 4497 1 12 . 1 1 60 60 GLN C C 60 176.942 176.942 178.236 -1.294 19163 4498 1 12 . 1 1 60 60 GLN CA C 60 58.762 58.762 58.897 -0.135 19163 4499 1 12 . 1 1 60 60 GLN CB C 60 28.498 28.498 28.730 -0.232 19163 4500 1 12 . 1 1 60 60 GLN H H 60 7.933 7.933 7.654 0.279 19163 4501 1 12 . 1 1 61 61 ALA N N 61 119.367 119.367 122.504 -3.137 19163 4502 1 12 . 1 1 61 61 ALA HA H 61 2.636 2.636 4.008 -1.372 19163 4503 1 12 . 1 1 61 61 ALA C C 61 178.507 178.507 179.285 -0.778 19163 4504 1 12 . 1 1 61 61 ALA CA C 61 54.126 54.126 55.032 -0.906 19163 4505 1 12 . 1 1 61 61 ALA CB C 61 18.462 18.462 18.270 0.192 19163 4506 1 12 . 1 1 61 61 ALA H H 61 7.354 7.354 7.907 -0.553 19163 4507 1 12 . 1 1 62 62 TYR N N 62 115.613 115.613 119.880 -4.267 19163 4508 1 12 . 1 1 62 62 TYR HA H 62 3.633 3.633 3.903 -0.270 19163 4509 1 12 . 1 1 62 62 TYR C C 62 177.421 177.421 177.488 -0.067 19163 4510 1 12 . 1 1 62 62 TYR CA C 62 61.676 61.676 61.099 0.577 19163 4511 1 12 . 1 1 62 62 TYR CB C 62 39.162 39.162 38.001 1.161 19163 4512 1 12 . 1 1 62 62 TYR H H 62 7.994 7.994 8.584 -0.590 19163 4513 1 12 . 1 1 63 63 GLU N N 63 121.396 121.396 120.273 1.123 19163 4514 1 12 . 1 1 63 63 GLU HA H 63 3.347 3.347 3.696 -0.349 19163 4515 1 12 . 1 1 63 63 GLU C C 63 177.687 177.687 178.860 -1.173 19163 4516 1 12 . 1 1 63 63 GLU CA C 63 59.562 59.562 58.948 0.614 19163 4517 1 12 . 1 1 63 63 GLU CB C 63 29.115 29.115 28.969 0.146 19163 4518 1 12 . 1 1 63 63 GLU H H 63 8.151 8.151 8.066 0.085 19163 4519 1 12 . 1 1 64 64 VAL N N 64 115.850 115.850 118.204 -2.354 19163 4520 1 12 . 1 1 64 64 VAL HA H 64 3.377 3.377 3.735 -0.358 19163 4521 1 12 . 1 1 64 64 VAL C C 64 175.925 175.925 177.298 -1.373 19163 4522 1 12 . 1 1 64 64 VAL CA C 64 65.806 65.806 64.925 0.881 19163 4523 1 12 . 1 1 64 64 VAL CB C 64 31.786 31.786 31.969 -0.183 19163 4524 1 12 . 1 1 64 64 VAL H H 64 6.814 6.814 7.252 -0.438 19163 4525 1 12 . 1 1 65 65 LEU N N 65 111.438 111.438 119.181 -7.743 19163 4526 1 12 . 1 1 65 65 LEU HA H 65 3.569 3.569 3.843 -0.274 19163 4527 1 12 . 1 1 65 65 LEU C C 65 177.124 177.124 178.494 -1.370 19163 4528 1 12 . 1 1 65 65 LEU CA C 65 56.645 56.645 57.454 -0.809 19163 4529 1 12 . 1 1 65 65 LEU CB C 65 42.589 42.589 41.114 1.475 19163 4530 1 12 . 1 1 65 65 LEU H H 65 7.398 7.398 8.317 -0.919 19163 4531 1 12 . 1 1 66 66 SER N N 66 108.642 108.642 109.433 -0.791 19163 4532 1 12 . 1 1 66 66 SER HA H 66 4.028 4.028 4.107 -0.079 19163 4533 1 12 . 1 1 66 66 SER C C 66 173.286 173.286 174.024 -0.738 19163 4534 1 12 . 1 1 66 66 SER CA C 66 59.232 59.232 59.944 -0.712 19163 4535 1 12 . 1 1 66 66 SER CB C 66 63.066 63.066 62.944 0.122 19163 4536 1 12 . 1 1 66 66 SER H H 66 7.700 7.700 7.646 0.054 19163 4537 1 12 . 1 1 67 67 ASP N N 67 124.276 124.276 122.456 1.820 19163 4538 1 12 . 1 1 67 67 ASP HA H 67 4.668 4.668 4.713 -0.045 19163 4539 1 12 . 1 1 67 67 ASP C C 67 174.913 174.913 175.573 -0.660 19163 4540 1 12 . 1 1 67 67 ASP CA C 67 52.487 52.487 52.951 -0.464 19163 4541 1 12 . 1 1 67 67 ASP CB C 67 43.218 43.218 42.106 1.112 19163 4542 1 12 . 1 1 67 67 ASP H H 67 6.879 6.879 7.176 -0.297 19163 4543 1 12 . 1 1 68 68 ALA N N 68 127.326 127.326 130.182 -2.856 19163 4544 1 12 . 1 1 68 68 ALA HA H 68 3.853 3.853 3.893 -0.040 19163 4545 1 12 . 1 1 68 68 ALA C C 68 180.336 180.336 178.524 1.812 19163 4546 1 12 . 1 1 68 68 ALA CA C 68 55.912 55.912 55.311 0.601 19163 4547 1 12 . 1 1 68 68 ALA CB C 68 18.645 18.645 18.759 -0.114 19163 4548 1 12 . 1 1 68 68 ALA H H 68 8.693 8.693 8.622 0.071 19163 4549 1 12 . 1 1 69 69 LYS N N 69 116.929 116.929 118.786 -1.857 19163 4550 1 12 . 1 1 69 69 LYS HA H 69 4.162 4.162 4.026 0.136 19163 4551 1 12 . 1 1 69 69 LYS C C 69 179.515 179.515 178.635 0.880 19163 4552 1 12 . 1 1 69 69 LYS CA C 69 58.562 58.562 59.290 -0.728 19163 4553 1 12 . 1 1 69 69 LYS CB C 69 31.840 31.840 32.335 -0.495 19163 4554 1 12 . 1 1 69 69 LYS H H 69 7.950 7.950 7.851 0.099 19163 4555 1 12 . 1 1 70 70 LYS N N 70 121.286 121.286 118.965 2.321 19163 4556 1 12 . 1 1 70 70 LYS HA H 70 3.960 3.960 3.950 0.010 19163 4557 1 12 . 1 1 70 70 LYS C C 70 179.938 179.938 178.987 0.951 19163 4558 1 12 . 1 1 70 70 LYS CA C 70 60.066 60.066 59.562 0.504 19163 4559 1 12 . 1 1 70 70 LYS CB C 70 32.695 32.695 32.263 0.432 19163 4560 1 12 . 1 1 70 70 LYS H H 70 8.184 8.184 8.066 0.118 19163 4561 1 12 . 1 1 71 71 ARG N N 71 122.794 122.794 119.732 3.062 19163 4562 1 12 . 1 1 71 71 ARG HA H 71 3.668 3.668 3.923 -0.255 19163 4563 1 12 . 1 1 71 71 ARG C C 71 177.356 177.356 178.176 -0.820 19163 4564 1 12 . 1 1 71 71 ARG CA C 71 60.127 60.127 59.697 0.430 19163 4565 1 12 . 1 1 71 71 ARG CB C 71 29.668 29.668 30.119 -0.451 19163 4566 1 12 . 1 1 71 71 ARG H H 71 9.290 9.290 8.375 0.915 19163 4567 1 12 . 1 1 72 72 GLU N N 72 118.390 118.390 119.552 -1.162 19163 4568 1 12 . 1 1 72 72 GLU HA H 72 4.096 4.096 4.162 -0.066 19163 4569 1 12 . 1 1 72 72 GLU C C 72 179.073 179.073 179.135 -0.062 19163 4570 1 12 . 1 1 72 72 GLU CA C 72 59.456 59.456 59.172 0.284 19163 4571 1 12 . 1 1 72 72 GLU CB C 72 29.615 29.615 29.613 0.003 19163 4572 1 12 . 1 1 72 72 GLU H H 72 7.607 7.607 7.697 -0.090 19163 4573 1 12 . 1 1 73 73 LEU N N 73 117.921 117.921 120.320 -2.399 19163 4574 1 12 . 1 1 73 73 LEU HA H 73 4.032 4.032 3.963 0.069 19163 4575 1 12 . 1 1 73 73 LEU C C 73 179.696 179.696 178.810 0.886 19163 4576 1 12 . 1 1 73 73 LEU CA C 73 57.597 57.597 58.045 -0.448 19163 4577 1 12 . 1 1 73 73 LEU CB C 73 41.815 41.815 41.565 0.250 19163 4578 1 12 . 1 1 73 73 LEU H H 73 7.398 7.398 8.294 -0.896 19163 4579 1 12 . 1 1 74 74 TYR N N 74 122.662 122.662 119.838 2.824 19163 4580 1 12 . 1 1 74 74 TYR HA H 74 4.092 4.092 3.941 0.151 19163 4581 1 12 . 1 1 74 74 TYR C C 74 178.166 178.166 177.393 0.773 19163 4582 1 12 . 1 1 74 74 TYR CA C 74 61.458 61.458 61.582 -0.124 19163 4583 1 12 . 1 1 74 74 TYR CB C 74 38.778 38.778 38.448 0.330 19163 4584 1 12 . 1 1 74 74 TYR H H 74 8.316 8.316 8.476 -0.160 19163 4585 1 12 . 1 1 75 75 ASP N N 75 118.842 118.842 117.959 0.883 19163 4586 1 12 . 1 1 75 75 ASP HA H 75 4.423 4.423 4.476 -0.053 19163 4587 1 12 . 1 1 75 75 ASP C C 75 177.726 177.726 178.049 -0.323 19163 4588 1 12 . 1 1 75 75 ASP CA C 75 56.177 56.177 56.742 -0.565 19163 4589 1 12 . 1 1 75 75 ASP CB C 75 40.800 40.800 40.970 -0.170 19163 4590 1 12 . 1 1 75 75 ASP H H 75 8.770 8.770 7.978 0.792 19163 4591 1 12 . 1 1 76 76 LYS N N 76 118.955 118.955 117.787 1.168 19163 4592 1 12 . 1 1 76 76 LYS HA H 76 4.130 4.130 4.231 -0.101 19163 4593 1 12 . 1 1 76 76 LYS C C 76 177.006 177.006 177.066 -0.060 19163 4594 1 12 . 1 1 76 76 LYS CA C 76 57.537 57.537 56.587 0.950 19163 4595 1 12 . 1 1 76 76 LYS CB C 76 33.136 33.136 33.569 -0.433 19163 4596 1 12 . 1 1 76 76 LYS H H 76 7.610 7.610 7.939 -0.329 19163 4597 1 13 . 1 1 11 11 MET HA H 11 4.346 4.346 4.476 -0.130 19163 4598 1 13 . 1 1 11 11 MET C C 11 175.801 175.801 175.925 -0.124 19163 4599 1 13 . 1 1 11 11 MET CA C 11 55.614 55.614 54.468 1.146 19163 4600 1 13 . 1 1 11 11 MET CB C 11 32.925 32.925 33.087 -0.162 19163 4601 1 13 . 1 1 12 12 VAL N N 12 121.226 121.226 121.910 -0.684 19163 4602 1 13 . 1 1 12 12 VAL HA H 12 4.026 4.026 4.109 -0.083 19163 4603 1 13 . 1 1 12 12 VAL C C 12 175.701 175.701 175.330 0.371 19163 4604 1 13 . 1 1 12 12 VAL CA C 12 62.188 62.188 61.660 0.528 19163 4605 1 13 . 1 1 12 12 VAL CB C 12 32.882 32.882 31.078 1.804 19163 4606 1 13 . 1 1 12 12 VAL H H 12 7.988 7.988 8.390 -0.402 19163 4607 1 13 . 1 1 13 13 LYS N N 13 125.255 125.255 128.089 -2.834 19163 4608 1 13 . 1 1 13 13 LYS HA H 13 4.211 4.211 4.424 -0.213 19163 4609 1 13 . 1 1 13 13 LYS C C 13 176.121 176.121 175.572 0.549 19163 4610 1 13 . 1 1 13 13 LYS CA C 13 56.355 56.355 55.444 0.911 19163 4611 1 13 . 1 1 13 13 LYS CB C 13 33.019 33.019 32.536 0.483 19163 4612 1 13 . 1 1 13 13 LYS H H 13 8.281 8.281 8.421 -0.140 19163 4613 1 13 . 1 1 14 14 GLU N N 14 123.004 123.004 122.885 0.119 19163 4614 1 13 . 1 1 14 14 GLU HA H 14 4.305 4.305 4.031 0.274 19163 4615 1 13 . 1 1 14 14 GLU C C 14 176.107 176.107 175.354 0.753 19163 4616 1 13 . 1 1 14 14 GLU CA C 14 56.343 56.343 56.372 -0.029 19163 4617 1 13 . 1 1 14 14 GLU CB C 14 30.534 30.534 29.569 0.965 19163 4618 1 13 . 1 1 14 14 GLU H H 14 8.424 8.424 8.774 -0.350 19163 4619 1 13 . 1 1 15 15 THR N N 15 115.895 115.895 117.171 -1.276 19163 4620 1 13 . 1 1 15 15 THR HA H 15 4.538 4.538 4.579 -0.041 19163 4621 1 13 . 1 1 15 15 THR C C 15 175.233 175.233 174.623 0.610 19163 4622 1 13 . 1 1 15 15 THR CA C 15 61.981 61.981 62.854 -0.873 19163 4623 1 13 . 1 1 15 15 THR CB C 15 69.865 69.865 69.263 0.602 19163 4624 1 13 . 1 1 15 15 THR H H 15 8.335 8.335 8.299 0.036 19163 4625 1 13 . 1 1 16 16 THR N N 16 116.992 116.992 120.937 -3.945 19163 4626 1 13 . 1 1 16 16 THR HA H 16 4.366 4.366 4.697 -0.331 19163 4627 1 13 . 1 1 16 16 THR C C 16 176.090 176.090 175.496 0.594 19163 4628 1 13 . 1 1 16 16 THR CA C 16 62.172 62.172 59.668 2.504 19163 4629 1 13 . 1 1 16 16 THR CB C 16 71.997 71.997 70.498 1.499 19163 4630 1 13 . 1 1 16 16 THR H H 16 8.798 8.798 8.212 0.586 19163 4631 1 13 . 1 1 17 17 TYR N N 17 117.617 117.617 121.254 -3.637 19163 4632 1 13 . 1 1 17 17 TYR HA H 17 4.329 4.329 4.261 0.068 19163 4633 1 13 . 1 1 17 17 TYR C C 17 177.105 177.105 177.832 -0.727 19163 4634 1 13 . 1 1 17 17 TYR CA C 17 57.577 57.577 59.832 -2.255 19163 4635 1 13 . 1 1 17 17 TYR CB C 17 37.113 37.113 37.867 -0.754 19163 4636 1 13 . 1 1 17 17 TYR H H 17 8.292 8.292 8.977 -0.685 19163 4637 1 13 . 1 1 18 18 TYR N N 18 115.048 115.048 117.639 -2.591 19163 4638 1 13 . 1 1 18 18 TYR HA H 18 3.775 3.775 4.168 -0.393 19163 4639 1 13 . 1 1 18 18 TYR C C 18 177.771 177.771 177.690 0.081 19163 4640 1 13 . 1 1 18 18 TYR CA C 18 61.430 61.430 62.674 -1.244 19163 4641 1 13 . 1 1 18 18 TYR CB C 18 36.495 36.495 37.739 -1.244 19163 4642 1 13 . 1 1 18 18 TYR H H 18 7.047 7.047 7.826 -0.779 19163 4643 1 13 . 1 1 19 19 ASP N N 19 119.520 119.520 119.019 0.501 19163 4644 1 13 . 1 1 19 19 ASP HA H 19 4.406 4.406 4.418 -0.012 19163 4645 1 13 . 1 1 19 19 ASP C C 19 180.128 180.128 178.342 1.786 19163 4646 1 13 . 1 1 19 19 ASP CA C 19 57.475 57.475 57.308 0.167 19163 4647 1 13 . 1 1 19 19 ASP CB C 19 40.659 40.659 40.708 -0.049 19163 4648 1 13 . 1 1 19 19 ASP H H 19 7.685 7.685 8.272 -0.587 19163 4649 1 13 . 1 1 20 20 VAL N N 20 119.772 119.772 120.058 -0.286 19163 4650 1 13 . 1 1 20 20 VAL HA H 20 3.608 3.608 3.815 -0.207 19163 4651 1 13 . 1 1 20 20 VAL C C 20 177.026 177.026 177.172 -0.146 19163 4652 1 13 . 1 1 20 20 VAL CA C 20 65.840 65.840 65.558 0.282 19163 4653 1 13 . 1 1 20 20 VAL CB C 20 31.530 31.530 31.775 -0.245 19163 4654 1 13 . 1 1 20 20 VAL H H 20 8.004 8.004 8.117 -0.113 19163 4655 1 13 . 1 1 21 21 LEU N N 21 115.252 115.252 116.155 -0.903 19163 4656 1 13 . 1 1 21 21 LEU HA H 21 4.281 4.281 4.357 -0.076 19163 4657 1 13 . 1 1 21 21 LEU C C 21 175.757 175.757 177.242 -1.485 19163 4658 1 13 . 1 1 21 21 LEU CA C 21 54.554 54.554 54.642 -0.087 19163 4659 1 13 . 1 1 21 21 LEU CB C 21 42.869 42.869 41.667 1.202 19163 4660 1 13 . 1 1 21 21 LEU H H 21 6.847 6.847 7.425 -0.578 19163 4661 1 13 . 1 1 22 22 GLY N N 22 108.227 108.227 107.457 0.770 19163 4662 1 13 . 1 1 22 22 GLY C C 22 175.361 175.361 174.565 0.796 19163 4663 1 13 . 1 1 22 22 GLY CA C 22 46.574 46.574 45.624 0.950 19163 4664 1 13 . 1 1 22 22 GLY H H 22 7.874 7.874 7.388 0.486 19163 4665 1 13 . 1 1 23 23 VAL N N 23 110.675 110.675 119.660 -8.985 19163 4666 1 13 . 1 1 23 23 VAL HA H 23 4.767 4.767 4.450 0.317 19163 4667 1 13 . 1 1 23 23 VAL C C 23 174.674 174.674 174.662 0.012 19163 4668 1 13 . 1 1 23 23 VAL CA C 23 58.349 58.349 59.633 -1.284 19163 4669 1 13 . 1 1 23 23 VAL CB C 23 34.938 34.938 34.512 0.426 19163 4670 1 13 . 1 1 23 23 VAL H H 23 7.815 7.815 8.090 -0.275 19163 4671 1 13 . 1 1 24 24 LYS N N 24 119.948 119.948 124.289 -4.341 19163 4672 1 13 . 1 1 24 24 LYS HA H 24 4.488 4.488 4.797 -0.309 19163 4673 1 13 . 1 1 24 24 LYS C C 24 175.442 175.442 176.213 -0.771 19163 4674 1 13 . 1 1 24 24 LYS CA C 24 54.001 54.001 54.075 -0.074 19163 4675 1 13 . 1 1 24 24 LYS CB C 24 32.197 32.197 31.960 0.236 19163 4676 1 13 . 1 1 24 24 LYS H H 24 8.329 8.329 8.584 -0.255 19163 4677 1 13 . 1 1 25 25 PRO HA H 25 2.421 2.421 4.444 -2.023 19163 4678 1 13 . 1 1 25 25 PRO C C 25 175.635 175.635 176.276 -0.641 19163 4679 1 13 . 1 1 25 25 PRO CA C 25 63.362 63.362 65.012 -1.650 19163 4680 1 13 . 1 1 25 25 PRO CB C 25 31.839 31.839 31.643 0.196 19163 4681 1 13 . 1 1 26 26 ASN N N 26 111.739 111.739 114.469 -2.730 19163 4682 1 13 . 1 1 26 26 ASN HA H 26 4.518 4.518 4.753 -0.235 19163 4683 1 13 . 1 1 26 26 ASN C C 26 175.820 175.820 174.586 1.234 19163 4684 1 13 . 1 1 26 26 ASN CA C 26 51.525 51.525 51.768 -0.243 19163 4685 1 13 . 1 1 26 26 ASN CB C 26 36.829 36.829 37.583 -0.754 19163 4686 1 13 . 1 1 26 26 ASN H H 26 7.138 7.138 8.075 -0.937 19163 4687 1 13 . 1 1 27 27 ALA N N 27 122.829 122.829 125.592 -2.763 19163 4688 1 13 . 1 1 27 27 ALA HA H 27 4.325 4.325 4.468 -0.143 19163 4689 1 13 . 1 1 27 27 ALA C C 27 178.726 178.726 177.371 1.355 19163 4690 1 13 . 1 1 27 27 ALA CA C 27 52.961 52.961 52.097 0.864 19163 4691 1 13 . 1 1 27 27 ALA CB C 27 19.159 19.159 19.758 -0.599 19163 4692 1 13 . 1 1 27 27 ALA H H 27 7.637 7.637 7.731 -0.094 19163 4693 1 13 . 1 1 28 28 THR N N 28 113.468 113.468 115.065 -1.597 19163 4694 1 13 . 1 1 28 28 THR HA H 28 4.493 4.493 4.401 0.092 19163 4695 1 13 . 1 1 28 28 THR C C 28 175.641 175.641 175.870 -0.229 19163 4696 1 13 . 1 1 28 28 THR CA C 28 60.592 60.592 61.444 -0.852 19163 4697 1 13 . 1 1 28 28 THR CB C 28 71.304 71.304 70.753 0.551 19163 4698 1 13 . 1 1 28 28 THR H H 28 8.829 8.829 8.237 0.592 19163 4699 1 13 . 1 1 29 29 GLN N N 29 119.445 119.445 121.968 -2.523 19163 4700 1 13 . 1 1 29 29 GLN HA H 29 4.035 4.035 3.927 0.108 19163 4701 1 13 . 1 1 29 29 GLN C C 29 179.117 179.117 178.565 0.552 19163 4702 1 13 . 1 1 29 29 GLN CA C 29 59.435 59.435 59.969 -0.534 19163 4703 1 13 . 1 1 29 29 GLN CB C 29 27.851 27.851 28.619 -0.768 19163 4704 1 13 . 1 1 29 29 GLN H H 29 9.015 9.015 8.789 0.226 19163 4705 1 13 . 1 1 30 30 GLU N N 30 119.343 119.343 118.873 0.470 19163 4706 1 13 . 1 1 30 30 GLU HA H 30 4.059 4.059 4.052 0.007 19163 4707 1 13 . 1 1 30 30 GLU C C 30 179.097 179.097 178.555 0.542 19163 4708 1 13 . 1 1 30 30 GLU CA C 30 59.847 59.847 59.494 0.353 19163 4709 1 13 . 1 1 30 30 GLU CB C 30 29.356 29.356 29.365 -0.009 19163 4710 1 13 . 1 1 30 30 GLU H H 30 8.549 8.549 8.676 -0.127 19163 4711 1 13 . 1 1 31 31 GLU N N 31 120.562 120.562 120.760 -0.198 19163 4712 1 13 . 1 1 31 31 GLU HA H 31 3.906 3.906 4.096 -0.190 19163 4713 1 13 . 1 1 31 31 GLU C C 31 180.405 180.405 179.077 1.328 19163 4714 1 13 . 1 1 31 31 GLU CA C 31 59.592 59.592 59.375 0.217 19163 4715 1 13 . 1 1 31 31 GLU CB C 31 29.989 29.989 29.509 0.480 19163 4716 1 13 . 1 1 31 31 GLU H H 31 7.768 7.768 8.162 -0.394 19163 4717 1 13 . 1 1 32 32 LEU N N 32 120.518 120.518 119.976 0.542 19163 4718 1 13 . 1 1 32 32 LEU HA H 32 3.963 3.963 4.011 -0.048 19163 4719 1 13 . 1 1 32 32 LEU C C 32 177.873 177.873 179.264 -1.391 19163 4720 1 13 . 1 1 32 32 LEU CA C 32 58.593 58.593 57.789 0.804 19163 4721 1 13 . 1 1 32 32 LEU CB C 32 42.556 42.556 41.065 1.491 19163 4722 1 13 . 1 1 32 32 LEU H H 32 8.475 8.475 8.585 -0.110 19163 4723 1 13 . 1 1 33 33 LYS N N 33 119.091 119.091 119.120 -0.029 19163 4724 1 13 . 1 1 33 33 LYS HA H 33 4.000 4.000 4.247 -0.247 19163 4725 1 13 . 1 1 33 33 LYS C C 33 178.701 178.701 178.942 -0.241 19163 4726 1 13 . 1 1 33 33 LYS CA C 33 60.274 60.274 60.139 0.135 19163 4727 1 13 . 1 1 33 33 LYS CB C 33 32.656 32.656 32.210 0.446 19163 4728 1 13 . 1 1 33 33 LYS H H 33 8.077 8.077 7.659 0.418 19163 4729 1 13 . 1 1 34 34 LYS N N 34 118.527 118.527 120.074 -1.547 19163 4730 1 13 . 1 1 34 34 LYS HA H 34 3.890 3.890 4.038 -0.148 19163 4731 1 13 . 1 1 34 34 LYS C C 34 179.172 179.172 178.776 0.396 19163 4732 1 13 . 1 1 34 34 LYS CA C 34 59.927 59.927 59.455 0.472 19163 4733 1 13 . 1 1 34 34 LYS CB C 34 32.869 32.869 32.467 0.402 19163 4734 1 13 . 1 1 34 34 LYS H H 34 7.986 7.986 8.084 -0.098 19163 4735 1 13 . 1 1 35 35 ALA N N 35 122.190 122.190 121.552 0.638 19163 4736 1 13 . 1 1 35 35 ALA HA H 35 4.116 4.116 4.036 0.080 19163 4737 1 13 . 1 1 35 35 ALA C C 35 179.982 179.982 178.942 1.040 19163 4738 1 13 . 1 1 35 35 ALA CA C 35 55.157 55.157 55.220 -0.063 19163 4739 1 13 . 1 1 35 35 ALA CB C 35 18.773 18.773 18.303 0.470 19163 4740 1 13 . 1 1 35 35 ALA H H 35 7.917 7.917 8.232 -0.315 19163 4741 1 13 . 1 1 36 36 TYR N N 36 117.701 117.701 120.528 -2.827 19163 4742 1 13 . 1 1 36 36 TYR HA H 36 3.818 3.818 4.030 -0.212 19163 4743 1 13 . 1 1 36 36 TYR C C 36 176.344 176.344 177.443 -1.099 19163 4744 1 13 . 1 1 36 36 TYR CA C 36 61.468 61.468 61.288 0.180 19163 4745 1 13 . 1 1 36 36 TYR CB C 36 38.890 38.890 38.315 0.575 19163 4746 1 13 . 1 1 36 36 TYR H H 36 8.402 8.402 7.813 0.589 19163 4747 1 13 . 1 1 37 37 ARG N N 37 117.423 117.423 119.201 -1.778 19163 4748 1 13 . 1 1 37 37 ARG HA H 37 3.481 3.481 3.653 -0.172 19163 4749 1 13 . 1 1 37 37 ARG C C 37 178.825 178.825 178.283 0.542 19163 4750 1 13 . 1 1 37 37 ARG CA C 37 59.397 59.397 59.765 -0.368 19163 4751 1 13 . 1 1 37 37 ARG CB C 37 29.710 29.710 30.033 -0.323 19163 4752 1 13 . 1 1 37 37 ARG H H 37 8.264 8.264 8.487 -0.223 19163 4753 1 13 . 1 1 38 38 LYS N N 38 117.247 117.247 119.729 -2.482 19163 4754 1 13 . 1 1 38 38 LYS HA H 38 3.905 3.905 4.037 -0.132 19163 4755 1 13 . 1 1 38 38 LYS C C 38 179.444 179.444 179.161 0.283 19163 4756 1 13 . 1 1 38 38 LYS CA C 38 59.450 59.450 59.453 -0.003 19163 4757 1 13 . 1 1 38 38 LYS CB C 38 32.609 32.609 32.356 0.253 19163 4758 1 13 . 1 1 38 38 LYS H H 38 7.444 7.444 7.699 -0.255 19163 4759 1 13 . 1 1 39 39 LEU N N 39 119.901 119.901 119.477 0.424 19163 4760 1 13 . 1 1 39 39 LEU HA H 39 4.020 4.020 4.121 -0.101 19163 4761 1 13 . 1 1 39 39 LEU C C 39 178.801 178.801 178.836 -0.035 19163 4762 1 13 . 1 1 39 39 LEU CA C 39 57.409 57.409 57.681 -0.272 19163 4763 1 13 . 1 1 39 39 LEU CB C 39 42.388 42.388 41.601 0.787 19163 4764 1 13 . 1 1 39 39 LEU H H 39 7.707 7.707 8.078 -0.371 19163 4765 1 13 . 1 1 40 40 ALA N N 40 122.772 122.772 121.384 1.388 19163 4766 1 13 . 1 1 40 40 ALA HA H 40 3.849 3.849 3.927 -0.078 19163 4767 1 13 . 1 1 40 40 ALA C C 40 179.446 179.446 178.935 0.511 19163 4768 1 13 . 1 1 40 40 ALA CA C 40 55.109 55.109 54.903 0.206 19163 4769 1 13 . 1 1 40 40 ALA CB C 40 17.116 17.116 18.115 -0.999 19163 4770 1 13 . 1 1 40 40 ALA H H 40 8.931 8.931 8.228 0.703 19163 4771 1 13 . 1 1 41 41 LEU N N 41 115.299 115.299 117.307 -2.008 19163 4772 1 13 . 1 1 41 41 LEU HA H 41 3.977 3.977 3.875 0.102 19163 4773 1 13 . 1 1 41 41 LEU C C 41 178.216 178.216 179.183 -0.967 19163 4774 1 13 . 1 1 41 41 LEU CA C 41 57.088 57.088 57.097 -0.009 19163 4775 1 13 . 1 1 41 41 LEU CB C 41 42.162 42.162 41.788 0.374 19163 4776 1 13 . 1 1 41 41 LEU H H 41 7.133 7.133 7.380 -0.247 19163 4777 1 13 . 1 1 42 42 LYS N N 42 116.812 116.812 119.389 -2.577 19163 4778 1 13 . 1 1 42 42 LYS HA H 42 3.925 3.925 4.089 -0.164 19163 4779 1 13 . 1 1 42 42 LYS C C 42 177.560 177.560 177.861 -0.301 19163 4780 1 13 . 1 1 42 42 LYS CA C 42 57.885 57.885 57.998 -0.113 19163 4781 1 13 . 1 1 42 42 LYS CB C 42 33.427 33.427 32.373 1.054 19163 4782 1 13 . 1 1 42 42 LYS H H 42 7.038 7.038 7.586 -0.548 19163 4783 1 13 . 1 1 43 43 TYR N N 43 114.022 114.022 114.633 -0.611 19163 4784 1 13 . 1 1 43 43 TYR HA H 43 4.665 4.665 4.498 0.167 19163 4785 1 13 . 1 1 43 43 TYR C C 43 173.741 173.741 174.732 -0.991 19163 4786 1 13 . 1 1 43 43 TYR CA C 43 56.928 56.928 57.120 -0.192 19163 4787 1 13 . 1 1 43 43 TYR CB C 43 39.579 39.579 37.886 1.693 19163 4788 1 13 . 1 1 43 43 TYR H H 43 7.683 7.683 8.212 -0.529 19163 4789 1 13 . 1 1 44 44 HIS N N 44 120.947 120.947 122.673 -1.726 19163 4790 1 13 . 1 1 44 44 HIS HA H 44 3.697 3.697 4.162 -0.465 19163 4791 1 13 . 1 1 44 44 HIS C C 44 174.925 174.925 174.837 0.088 19163 4792 1 13 . 1 1 44 44 HIS CA C 44 56.229 56.229 54.714 1.515 19163 4793 1 13 . 1 1 44 44 HIS CB C 44 30.852 30.852 30.058 0.794 19163 4794 1 13 . 1 1 44 44 HIS H H 44 7.814 7.814 7.468 0.346 19163 4795 1 13 . 1 1 45 45 PRO HA H 45 4.131 4.131 4.401 -0.270 19163 4796 1 13 . 1 1 45 45 PRO C C 45 177.269 177.269 177.438 -0.169 19163 4797 1 13 . 1 1 45 45 PRO CA C 45 64.723 64.723 65.273 -0.550 19163 4798 1 13 . 1 1 45 45 PRO CB C 45 32.070 32.070 32.027 0.043 19163 4799 1 13 . 1 1 46 46 ASP N N 46 119.127 119.127 116.975 2.152 19163 4800 1 13 . 1 1 46 46 ASP HA H 46 4.375 4.375 4.349 0.026 19163 4801 1 13 . 1 1 46 46 ASP C C 46 177.284 177.284 176.947 0.337 19163 4802 1 13 . 1 1 46 46 ASP CA C 46 56.020 56.020 55.958 0.062 19163 4803 1 13 . 1 1 46 46 ASP CB C 46 40.221 40.221 40.334 -0.113 19163 4804 1 13 . 1 1 46 46 ASP H H 46 10.040 10.040 7.328 2.712 19163 4805 1 13 . 1 1 47 47 LYS N N 47 117.416 117.416 118.443 -1.027 19163 4806 1 13 . 1 1 47 47 LYS HA H 47 4.315 4.315 4.237 0.078 19163 4807 1 13 . 1 1 47 47 LYS C C 47 176.355 176.355 176.312 0.043 19163 4808 1 13 . 1 1 47 47 LYS CA C 47 55.880 55.880 57.196 -1.316 19163 4809 1 13 . 1 1 47 47 LYS CB C 47 33.778 33.778 34.546 -0.768 19163 4810 1 13 . 1 1 47 47 LYS H H 47 7.826 7.826 7.267 0.559 19163 4811 1 13 . 1 1 48 48 ASN N N 48 116.573 116.573 118.287 -1.714 19163 4812 1 13 . 1 1 48 48 ASN HA H 48 5.021 5.021 5.170 -0.149 19163 4813 1 13 . 1 1 48 48 ASN C C 48 172.992 172.992 174.066 -1.074 19163 4814 1 13 . 1 1 48 48 ASN CA C 48 50.467 50.467 50.584 -0.117 19163 4815 1 13 . 1 1 48 48 ASN CB C 48 39.284 39.284 40.002 -0.718 19163 4816 1 13 . 1 1 48 48 ASN H H 48 7.956 7.956 8.336 -0.380 19163 4817 1 13 . 1 1 49 49 PRO HA H 49 4.448 4.448 4.269 0.179 19163 4818 1 13 . 1 1 49 49 PRO C C 49 178.030 178.030 177.263 0.767 19163 4819 1 13 . 1 1 49 49 PRO CA C 49 64.468 64.468 64.762 -0.294 19163 4820 1 13 . 1 1 49 49 PRO CB C 49 32.173 32.173 31.893 0.280 19163 4821 1 13 . 1 1 50 50 ASN N N 50 115.567 115.567 113.050 2.517 19163 4822 1 13 . 1 1 50 50 ASN HA H 50 4.748 4.748 4.548 0.200 19163 4823 1 13 . 1 1 50 50 ASN C C 50 176.443 176.443 175.292 1.151 19163 4824 1 13 . 1 1 50 50 ASN CA C 50 54.677 54.677 54.548 0.129 19163 4825 1 13 . 1 1 50 50 ASN CB C 50 39.014 39.014 37.319 1.695 19163 4826 1 13 . 1 1 50 50 ASN H H 50 8.398 8.398 8.628 -0.230 19163 4827 1 13 . 1 1 51 51 GLU N N 51 119.270 119.270 118.937 0.333 19163 4828 1 13 . 1 1 51 51 GLU HA H 51 4.797 4.797 4.578 0.219 19163 4829 1 13 . 1 1 51 51 GLU C C 51 176.922 176.922 178.147 -1.225 19163 4830 1 13 . 1 1 51 51 GLU CA C 51 55.916 55.916 57.080 -1.164 19163 4831 1 13 . 1 1 51 51 GLU CB C 51 29.200 29.200 30.044 -0.844 19163 4832 1 13 . 1 1 51 51 GLU H H 51 7.485 7.485 7.871 -0.386 19163 4833 1 13 . 1 1 52 52 GLY N N 52 107.541 107.541 108.329 -0.788 19163 4834 1 13 . 1 1 52 52 GLY C C 52 176.755 176.755 175.762 0.993 19163 4835 1 13 . 1 1 52 52 GLY CA C 52 47.914 47.914 46.729 1.185 19163 4836 1 13 . 1 1 52 52 GLY H H 52 8.092 8.092 7.605 0.487 19163 4837 1 13 . 1 1 53 53 GLU N N 53 121.603 121.603 120.951 0.652 19163 4838 1 13 . 1 1 53 53 GLU HA H 53 4.065 4.065 4.059 0.006 19163 4839 1 13 . 1 1 53 53 GLU C C 53 179.052 179.052 179.060 -0.008 19163 4840 1 13 . 1 1 53 53 GLU CA C 53 59.280 59.280 59.679 -0.399 19163 4841 1 13 . 1 1 53 53 GLU CB C 53 28.968 28.968 29.223 -0.255 19163 4842 1 13 . 1 1 53 53 GLU H H 53 8.496 8.496 8.241 0.255 19163 4843 1 13 . 1 1 54 54 LYS N N 54 120.837 120.837 118.577 2.260 19163 4844 1 13 . 1 1 54 54 LYS HA H 54 3.923 3.923 4.335 -0.412 19163 4845 1 13 . 1 1 54 54 LYS C C 54 179.058 179.058 179.071 -0.013 19163 4846 1 13 . 1 1 54 54 LYS CA C 54 58.800 58.800 57.815 0.985 19163 4847 1 13 . 1 1 54 54 LYS CB C 54 31.551 31.551 32.028 -0.477 19163 4848 1 13 . 1 1 54 54 LYS H H 54 7.857 7.857 7.815 0.042 19163 4849 1 13 . 1 1 55 55 PHE N N 55 118.608 118.608 121.142 -2.534 19163 4850 1 13 . 1 1 55 55 PHE HA H 55 4.021 4.021 4.093 -0.072 19163 4851 1 13 . 1 1 55 55 PHE C C 55 178.001 178.001 176.761 1.240 19163 4852 1 13 . 1 1 55 55 PHE CA C 55 61.911 61.911 60.817 1.094 19163 4853 1 13 . 1 1 55 55 PHE CB C 55 38.553 38.553 38.809 -0.256 19163 4854 1 13 . 1 1 55 55 PHE H H 55 8.382 8.382 8.031 0.351 19163 4855 1 13 . 1 1 56 56 LYS N N 56 120.898 120.898 119.076 1.822 19163 4856 1 13 . 1 1 56 56 LYS HA H 56 3.828 3.828 3.829 -0.001 19163 4857 1 13 . 1 1 56 56 LYS C C 56 178.817 178.817 178.869 -0.052 19163 4858 1 13 . 1 1 56 56 LYS CA C 56 59.877 59.877 60.031 -0.154 19163 4859 1 13 . 1 1 56 56 LYS CB C 56 32.133 32.133 31.938 0.195 19163 4860 1 13 . 1 1 56 56 LYS H H 56 8.111 8.111 7.835 0.276 19163 4861 1 13 . 1 1 57 57 GLN N N 57 118.600 118.600 118.538 0.062 19163 4862 1 13 . 1 1 57 57 GLN HA H 57 4.009 4.009 3.912 0.097 19163 4863 1 13 . 1 1 57 57 GLN C C 57 179.333 179.333 178.277 1.056 19163 4864 1 13 . 1 1 57 57 GLN CA C 57 59.109 59.109 58.590 0.519 19163 4865 1 13 . 1 1 57 57 GLN CB C 57 28.595 28.595 28.597 -0.002 19163 4866 1 13 . 1 1 57 57 GLN H H 57 7.613 7.613 7.604 0.009 19163 4867 1 13 . 1 1 58 58 ILE N N 58 118.709 118.709 120.740 -2.031 19163 4868 1 13 . 1 1 58 58 ILE HA H 58 3.559 3.559 3.449 0.110 19163 4869 1 13 . 1 1 58 58 ILE C C 58 177.152 177.152 177.800 -0.648 19163 4870 1 13 . 1 1 58 58 ILE CA C 58 65.068 65.068 65.610 -0.542 19163 4871 1 13 . 1 1 58 58 ILE CB C 58 38.381 38.381 37.486 0.895 19163 4872 1 13 . 1 1 58 58 ILE H H 58 8.011 8.011 7.397 0.614 19163 4873 1 13 . 1 1 59 59 SER N N 59 116.112 116.112 114.997 1.115 19163 4874 1 13 . 1 1 59 59 SER HA H 59 3.948 3.948 3.890 0.058 19163 4875 1 13 . 1 1 59 59 SER C C 59 175.949 175.949 176.953 -1.004 19163 4876 1 13 . 1 1 59 59 SER CA C 59 62.315 62.315 62.041 0.274 19163 4877 1 13 . 1 1 59 59 SER H H 59 8.030 8.030 8.050 -0.020 19163 4878 1 13 . 1 1 60 60 GLN N N 60 122.099 122.099 120.679 1.420 19163 4879 1 13 . 1 1 60 60 GLN HA H 60 3.801 3.801 3.931 -0.130 19163 4880 1 13 . 1 1 60 60 GLN C C 60 176.942 176.942 178.298 -1.356 19163 4881 1 13 . 1 1 60 60 GLN CA C 60 58.762 58.762 58.691 0.072 19163 4882 1 13 . 1 1 60 60 GLN CB C 60 28.498 28.498 28.454 0.044 19163 4883 1 13 . 1 1 60 60 GLN H H 60 7.933 7.933 7.484 0.449 19163 4884 1 13 . 1 1 61 61 ALA N N 61 119.367 119.367 121.827 -2.460 19163 4885 1 13 . 1 1 61 61 ALA HA H 61 2.636 2.636 3.797 -1.161 19163 4886 1 13 . 1 1 61 61 ALA C C 61 178.507 178.507 179.222 -0.715 19163 4887 1 13 . 1 1 61 61 ALA CA C 61 54.126 54.126 54.635 -0.509 19163 4888 1 13 . 1 1 61 61 ALA CB C 61 18.462 18.462 17.934 0.528 19163 4889 1 13 . 1 1 61 61 ALA H H 61 7.354 7.354 7.595 -0.241 19163 4890 1 13 . 1 1 62 62 TYR N N 62 115.613 115.613 119.935 -4.322 19163 4891 1 13 . 1 1 62 62 TYR HA H 62 3.633 3.633 3.858 -0.225 19163 4892 1 13 . 1 1 62 62 TYR C C 62 177.421 177.421 177.327 0.094 19163 4893 1 13 . 1 1 62 62 TYR CA C 62 61.676 61.676 61.253 0.423 19163 4894 1 13 . 1 1 62 62 TYR CB C 62 39.162 39.162 38.106 1.056 19163 4895 1 13 . 1 1 62 62 TYR H H 62 7.994 7.994 8.554 -0.560 19163 4896 1 13 . 1 1 63 63 GLU N N 63 121.396 121.396 119.022 2.374 19163 4897 1 13 . 1 1 63 63 GLU HA H 63 3.347 3.347 3.693 -0.346 19163 4898 1 13 . 1 1 63 63 GLU C C 63 177.687 177.687 178.597 -0.910 19163 4899 1 13 . 1 1 63 63 GLU CA C 63 59.562 59.562 59.342 0.220 19163 4900 1 13 . 1 1 63 63 GLU CB C 63 29.115 29.115 29.554 -0.439 19163 4901 1 13 . 1 1 63 63 GLU H H 63 8.151 8.151 7.891 0.260 19163 4902 1 13 . 1 1 64 64 VAL N N 64 115.850 115.850 119.028 -3.178 19163 4903 1 13 . 1 1 64 64 VAL HA H 64 3.377 3.377 3.826 -0.449 19163 4904 1 13 . 1 1 64 64 VAL C C 64 175.925 175.925 177.760 -1.835 19163 4905 1 13 . 1 1 64 64 VAL CA C 64 65.806 65.806 65.014 0.792 19163 4906 1 13 . 1 1 64 64 VAL CB C 64 31.786 31.786 31.754 0.032 19163 4907 1 13 . 1 1 64 64 VAL H H 64 6.814 6.814 7.408 -0.594 19163 4908 1 13 . 1 1 65 65 LEU N N 65 111.438 111.438 121.792 -10.354 19163 4909 1 13 . 1 1 65 65 LEU HA H 65 3.569 3.569 3.900 -0.331 19163 4910 1 13 . 1 1 65 65 LEU C C 65 177.124 177.124 178.499 -1.375 19163 4911 1 13 . 1 1 65 65 LEU CA C 65 56.645 56.645 57.262 -0.617 19163 4912 1 13 . 1 1 65 65 LEU CB C 65 42.589 42.589 40.630 1.959 19163 4913 1 13 . 1 1 65 65 LEU H H 65 7.398 7.398 8.522 -1.124 19163 4914 1 13 . 1 1 66 66 SER N N 66 108.642 108.642 112.121 -3.479 19163 4915 1 13 . 1 1 66 66 SER HA H 66 4.028 4.028 4.018 0.010 19163 4916 1 13 . 1 1 66 66 SER C C 66 173.286 173.286 174.085 -0.799 19163 4917 1 13 . 1 1 66 66 SER CA C 66 59.232 59.232 59.962 -0.730 19163 4918 1 13 . 1 1 66 66 SER CB C 66 63.066 63.066 62.730 0.336 19163 4919 1 13 . 1 1 66 66 SER H H 66 7.700 7.700 7.606 0.094 19163 4920 1 13 . 1 1 67 67 ASP N N 67 124.276 124.276 120.321 3.955 19163 4921 1 13 . 1 1 67 67 ASP HA H 67 4.668 4.668 4.708 -0.040 19163 4922 1 13 . 1 1 67 67 ASP C C 67 174.913 174.913 175.312 -0.399 19163 4923 1 13 . 1 1 67 67 ASP CA C 67 52.487 52.487 53.062 -0.575 19163 4924 1 13 . 1 1 67 67 ASP CB C 67 43.218 43.218 42.847 0.371 19163 4925 1 13 . 1 1 67 67 ASP H H 67 6.879 6.879 7.282 -0.403 19163 4926 1 13 . 1 1 68 68 ALA N N 68 127.326 127.326 130.922 -3.596 19163 4927 1 13 . 1 1 68 68 ALA HA H 68 3.853 3.853 3.893 -0.040 19163 4928 1 13 . 1 1 68 68 ALA C C 68 180.336 180.336 178.793 1.543 19163 4929 1 13 . 1 1 68 68 ALA CA C 68 55.912 55.912 55.915 -0.003 19163 4930 1 13 . 1 1 68 68 ALA CB C 68 18.645 18.645 18.838 -0.193 19163 4931 1 13 . 1 1 68 68 ALA H H 68 8.693 8.693 8.928 -0.235 19163 4932 1 13 . 1 1 69 69 LYS N N 69 116.929 116.929 117.308 -0.379 19163 4933 1 13 . 1 1 69 69 LYS HA H 69 4.162 4.162 4.033 0.129 19163 4934 1 13 . 1 1 69 69 LYS C C 69 179.515 179.515 178.663 0.852 19163 4935 1 13 . 1 1 69 69 LYS CA C 69 58.562 58.562 59.561 -0.999 19163 4936 1 13 . 1 1 69 69 LYS CB C 69 31.840 31.840 32.251 -0.411 19163 4937 1 13 . 1 1 69 69 LYS H H 69 7.950 7.950 8.113 -0.163 19163 4938 1 13 . 1 1 70 70 LYS N N 70 121.286 121.286 118.947 2.339 19163 4939 1 13 . 1 1 70 70 LYS HA H 70 3.960 3.960 3.990 -0.030 19163 4940 1 13 . 1 1 70 70 LYS C C 70 179.938 179.938 179.089 0.849 19163 4941 1 13 . 1 1 70 70 LYS CA C 70 60.066 60.066 59.421 0.645 19163 4942 1 13 . 1 1 70 70 LYS CB C 70 32.695 32.695 32.355 0.340 19163 4943 1 13 . 1 1 70 70 LYS H H 70 8.184 8.184 7.807 0.377 19163 4944 1 13 . 1 1 71 71 ARG N N 71 122.794 122.794 120.097 2.697 19163 4945 1 13 . 1 1 71 71 ARG HA H 71 3.668 3.668 3.929 -0.261 19163 4946 1 13 . 1 1 71 71 ARG C C 71 177.356 177.356 178.094 -0.738 19163 4947 1 13 . 1 1 71 71 ARG CA C 71 60.127 60.127 60.133 -0.006 19163 4948 1 13 . 1 1 71 71 ARG CB C 71 29.668 29.668 30.195 -0.527 19163 4949 1 13 . 1 1 71 71 ARG H H 71 9.290 9.290 8.531 0.759 19163 4950 1 13 . 1 1 72 72 GLU N N 72 118.390 118.390 119.505 -1.115 19163 4951 1 13 . 1 1 72 72 GLU HA H 72 4.096 4.096 4.179 -0.083 19163 4952 1 13 . 1 1 72 72 GLU C C 72 179.073 179.073 179.119 -0.046 19163 4953 1 13 . 1 1 72 72 GLU CA C 72 59.456 59.456 59.278 0.178 19163 4954 1 13 . 1 1 72 72 GLU CB C 72 29.615 29.615 29.579 0.036 19163 4955 1 13 . 1 1 72 72 GLU H H 72 7.607 7.607 7.934 -0.327 19163 4956 1 13 . 1 1 73 73 LEU N N 73 117.921 117.921 119.819 -1.898 19163 4957 1 13 . 1 1 73 73 LEU HA H 73 4.032 4.032 4.003 0.029 19163 4958 1 13 . 1 1 73 73 LEU C C 73 179.696 179.696 178.865 0.831 19163 4959 1 13 . 1 1 73 73 LEU CA C 73 57.597 57.597 57.791 -0.194 19163 4960 1 13 . 1 1 73 73 LEU CB C 73 41.815 41.815 41.489 0.326 19163 4961 1 13 . 1 1 73 73 LEU H H 73 7.398 7.398 7.783 -0.385 19163 4962 1 13 . 1 1 74 74 TYR N N 74 122.662 122.662 120.649 2.013 19163 4963 1 13 . 1 1 74 74 TYR HA H 74 4.092 4.092 4.005 0.087 19163 4964 1 13 . 1 1 74 74 TYR C C 74 178.166 178.166 177.207 0.959 19163 4965 1 13 . 1 1 74 74 TYR CA C 74 61.458 61.458 61.602 -0.144 19163 4966 1 13 . 1 1 74 74 TYR CB C 74 38.778 38.778 38.298 0.480 19163 4967 1 13 . 1 1 74 74 TYR H H 74 8.316 8.316 8.099 0.217 19163 4968 1 13 . 1 1 75 75 ASP N N 75 118.842 118.842 118.568 0.274 19163 4969 1 13 . 1 1 75 75 ASP HA H 75 4.423 4.423 4.267 0.156 19163 4970 1 13 . 1 1 75 75 ASP C C 75 177.726 177.726 178.066 -0.340 19163 4971 1 13 . 1 1 75 75 ASP CA C 75 56.177 56.177 57.184 -1.007 19163 4972 1 13 . 1 1 75 75 ASP CB C 75 40.800 40.800 40.960 -0.160 19163 4973 1 13 . 1 1 75 75 ASP H H 75 8.770 8.770 8.280 0.490 19163 4974 1 13 . 1 1 76 76 LYS N N 76 118.955 118.955 118.789 0.166 19163 4975 1 13 . 1 1 76 76 LYS HA H 76 4.130 4.130 4.189 -0.059 19163 4976 1 13 . 1 1 76 76 LYS C C 76 177.006 177.006 177.650 -0.644 19163 4977 1 13 . 1 1 76 76 LYS CA C 76 57.537 57.537 57.444 0.093 19163 4978 1 13 . 1 1 76 76 LYS CB C 76 33.136 33.136 33.179 -0.043 19163 4979 1 13 . 1 1 76 76 LYS H H 76 7.610 7.610 7.758 -0.148 19163 4980 1 14 . 1 1 11 11 MET HA H 11 4.346 4.346 4.623 -0.277 19163 4981 1 14 . 1 1 11 11 MET C C 11 175.801 175.801 175.477 0.324 19163 4982 1 14 . 1 1 11 11 MET CA C 11 55.614 55.614 54.474 1.141 19163 4983 1 14 . 1 1 11 11 MET CB C 11 32.925 32.925 34.198 -1.273 19163 4984 1 14 . 1 1 12 12 VAL N N 12 121.226 121.226 123.795 -2.569 19163 4985 1 14 . 1 1 12 12 VAL HA H 12 4.026 4.026 4.104 -0.078 19163 4986 1 14 . 1 1 12 12 VAL C C 12 175.701 175.701 175.689 0.012 19163 4987 1 14 . 1 1 12 12 VAL CA C 12 62.188 62.188 62.425 -0.236 19163 4988 1 14 . 1 1 12 12 VAL CB C 12 32.882 32.882 31.367 1.514 19163 4989 1 14 . 1 1 12 12 VAL H H 12 7.988 7.988 8.501 -0.513 19163 4990 1 14 . 1 1 13 13 LYS N N 13 125.255 125.255 128.148 -2.893 19163 4991 1 14 . 1 1 13 13 LYS HA H 13 4.211 4.211 4.486 -0.275 19163 4992 1 14 . 1 1 13 13 LYS C C 13 176.121 176.121 175.960 0.161 19163 4993 1 14 . 1 1 13 13 LYS CA C 13 56.355 56.355 55.048 1.307 19163 4994 1 14 . 1 1 13 13 LYS CB C 13 33.019 33.019 32.762 0.257 19163 4995 1 14 . 1 1 13 13 LYS H H 13 8.281 8.281 8.303 -0.022 19163 4996 1 14 . 1 1 14 14 GLU N N 14 123.004 123.004 122.342 0.662 19163 4997 1 14 . 1 1 14 14 GLU HA H 14 4.305 4.305 4.064 0.241 19163 4998 1 14 . 1 1 14 14 GLU C C 14 176.107 176.107 175.520 0.587 19163 4999 1 14 . 1 1 14 14 GLU CA C 14 56.343 56.343 56.798 -0.455 19163 5000 1 14 . 1 1 14 14 GLU CB C 14 30.534 30.534 29.039 1.495 19163 5001 1 14 . 1 1 14 14 GLU H H 14 8.424 8.424 8.703 -0.279 19163 5002 1 14 . 1 1 15 15 THR N N 15 115.895 115.895 115.738 0.157 19163 5003 1 14 . 1 1 15 15 THR HA H 15 4.538 4.538 4.315 0.223 19163 5004 1 14 . 1 1 15 15 THR C C 15 175.233 175.233 174.750 0.483 19163 5005 1 14 . 1 1 15 15 THR CA C 15 61.981 61.981 62.858 -0.877 19163 5006 1 14 . 1 1 15 15 THR CB C 15 69.865 69.865 69.094 0.771 19163 5007 1 14 . 1 1 15 15 THR H H 15 8.335 8.335 8.145 0.190 19163 5008 1 14 . 1 1 16 16 THR N N 16 116.992 116.992 121.035 -4.043 19163 5009 1 14 . 1 1 16 16 THR HA H 16 4.366 4.366 4.449 -0.083 19163 5010 1 14 . 1 1 16 16 THR C C 16 176.090 176.090 174.995 1.095 19163 5011 1 14 . 1 1 16 16 THR CA C 16 62.172 62.172 59.356 2.816 19163 5012 1 14 . 1 1 16 16 THR CB C 16 71.997 71.997 70.534 1.464 19163 5013 1 14 . 1 1 16 16 THR H H 16 8.798 8.798 8.126 0.672 19163 5014 1 14 . 1 1 17 17 TYR N N 17 117.617 117.617 120.902 -3.285 19163 5015 1 14 . 1 1 17 17 TYR HA H 17 4.329 4.329 4.207 0.122 19163 5016 1 14 . 1 1 17 17 TYR C C 17 177.105 177.105 177.930 -0.825 19163 5017 1 14 . 1 1 17 17 TYR CA C 17 57.577 57.577 62.641 -5.064 19163 5018 1 14 . 1 1 17 17 TYR CB C 17 37.113 37.113 37.963 -0.850 19163 5019 1 14 . 1 1 17 17 TYR H H 17 8.292 8.292 9.009 -0.717 19163 5020 1 14 . 1 1 18 18 TYR N N 18 115.048 115.048 117.369 -2.321 19163 5021 1 14 . 1 1 18 18 TYR HA H 18 3.775 3.775 4.246 -0.471 19163 5022 1 14 . 1 1 18 18 TYR C C 18 177.771 177.771 177.951 -0.180 19163 5023 1 14 . 1 1 18 18 TYR CA C 18 61.430 61.430 60.410 1.020 19163 5024 1 14 . 1 1 18 18 TYR CB C 18 36.495 36.495 37.388 -0.893 19163 5025 1 14 . 1 1 18 18 TYR H H 18 7.047 7.047 7.742 -0.695 19163 5026 1 14 . 1 1 19 19 ASP N N 19 119.520 119.520 119.931 -0.411 19163 5027 1 14 . 1 1 19 19 ASP HA H 19 4.406 4.406 4.428 -0.022 19163 5028 1 14 . 1 1 19 19 ASP C C 19 180.128 180.128 178.424 1.704 19163 5029 1 14 . 1 1 19 19 ASP CA C 19 57.475 57.475 57.132 0.343 19163 5030 1 14 . 1 1 19 19 ASP CB C 19 40.659 40.659 40.689 -0.030 19163 5031 1 14 . 1 1 19 19 ASP H H 19 7.685 7.685 8.121 -0.436 19163 5032 1 14 . 1 1 20 20 VAL N N 20 119.772 119.772 120.348 -0.576 19163 5033 1 14 . 1 1 20 20 VAL HA H 20 3.608 3.608 3.737 -0.129 19163 5034 1 14 . 1 1 20 20 VAL C C 20 177.026 177.026 177.271 -0.245 19163 5035 1 14 . 1 1 20 20 VAL CA C 20 65.840 65.840 65.936 -0.096 19163 5036 1 14 . 1 1 20 20 VAL CB C 20 31.530 31.530 31.841 -0.311 19163 5037 1 14 . 1 1 20 20 VAL H H 20 8.004 8.004 8.312 -0.308 19163 5038 1 14 . 1 1 21 21 LEU N N 21 115.252 115.252 117.222 -1.970 19163 5039 1 14 . 1 1 21 21 LEU HA H 21 4.281 4.281 4.377 -0.096 19163 5040 1 14 . 1 1 21 21 LEU C C 21 175.757 175.757 176.871 -1.114 19163 5041 1 14 . 1 1 21 21 LEU CA C 21 54.554 54.554 54.678 -0.124 19163 5042 1 14 . 1 1 21 21 LEU CB C 21 42.869 42.869 42.502 0.367 19163 5043 1 14 . 1 1 21 21 LEU H H 21 6.847 6.847 7.859 -1.012 19163 5044 1 14 . 1 1 22 22 GLY N N 22 108.227 108.227 107.226 1.001 19163 5045 1 14 . 1 1 22 22 GLY C C 22 175.361 175.361 174.247 1.114 19163 5046 1 14 . 1 1 22 22 GLY CA C 22 46.574 46.574 45.721 0.853 19163 5047 1 14 . 1 1 22 22 GLY H H 22 7.874 7.874 7.380 0.494 19163 5048 1 14 . 1 1 23 23 VAL N N 23 110.675 110.675 119.295 -8.620 19163 5049 1 14 . 1 1 23 23 VAL HA H 23 4.767 4.767 4.355 0.412 19163 5050 1 14 . 1 1 23 23 VAL C C 23 174.674 174.674 174.404 0.270 19163 5051 1 14 . 1 1 23 23 VAL CA C 23 58.349 58.349 60.130 -1.782 19163 5052 1 14 . 1 1 23 23 VAL CB C 23 34.938 34.938 35.593 -0.654 19163 5053 1 14 . 1 1 23 23 VAL H H 23 7.815 7.815 8.196 -0.381 19163 5054 1 14 . 1 1 24 24 LYS N N 24 119.948 119.948 123.186 -3.238 19163 5055 1 14 . 1 1 24 24 LYS HA H 24 4.488 4.488 4.716 -0.228 19163 5056 1 14 . 1 1 24 24 LYS C C 24 175.442 175.442 176.014 -0.572 19163 5057 1 14 . 1 1 24 24 LYS CA C 24 54.001 54.001 54.052 -0.051 19163 5058 1 14 . 1 1 24 24 LYS CB C 24 32.197 32.197 31.596 0.601 19163 5059 1 14 . 1 1 24 24 LYS H H 24 8.329 8.329 8.114 0.215 19163 5060 1 14 . 1 1 25 25 PRO HA H 25 2.421 2.421 3.872 -1.451 19163 5061 1 14 . 1 1 25 25 PRO C C 25 175.635 175.635 175.749 -0.114 19163 5062 1 14 . 1 1 25 25 PRO CA C 25 63.362 63.362 64.923 -1.561 19163 5063 1 14 . 1 1 25 25 PRO CB C 25 31.839 31.839 31.745 0.094 19163 5064 1 14 . 1 1 26 26 ASN N N 26 111.739 111.739 112.864 -1.125 19163 5065 1 14 . 1 1 26 26 ASN HA H 26 4.518 4.518 4.675 -0.157 19163 5066 1 14 . 1 1 26 26 ASN C C 26 175.820 175.820 174.643 1.177 19163 5067 1 14 . 1 1 26 26 ASN CA C 26 51.525 51.525 51.302 0.223 19163 5068 1 14 . 1 1 26 26 ASN CB C 26 36.829 36.829 37.462 -0.633 19163 5069 1 14 . 1 1 26 26 ASN H H 26 7.138 7.138 7.928 -0.790 19163 5070 1 14 . 1 1 27 27 ALA N N 27 122.829 122.829 123.893 -1.064 19163 5071 1 14 . 1 1 27 27 ALA HA H 27 4.325 4.325 4.197 0.128 19163 5072 1 14 . 1 1 27 27 ALA C C 27 178.726 178.726 177.131 1.595 19163 5073 1 14 . 1 1 27 27 ALA CA C 27 52.961 52.961 52.404 0.557 19163 5074 1 14 . 1 1 27 27 ALA CB C 27 19.159 19.159 19.264 -0.105 19163 5075 1 14 . 1 1 27 27 ALA H H 27 7.637 7.637 7.317 0.320 19163 5076 1 14 . 1 1 28 28 THR N N 28 113.468 113.468 113.874 -0.406 19163 5077 1 14 . 1 1 28 28 THR HA H 28 4.493 4.493 4.303 0.190 19163 5078 1 14 . 1 1 28 28 THR C C 28 175.641 175.641 175.757 -0.116 19163 5079 1 14 . 1 1 28 28 THR CA C 28 60.592 60.592 61.268 -0.676 19163 5080 1 14 . 1 1 28 28 THR CB C 28 71.304 71.304 70.112 1.192 19163 5081 1 14 . 1 1 28 28 THR H H 28 8.829 8.829 7.863 0.966 19163 5082 1 14 . 1 1 29 29 GLN N N 29 119.445 119.445 122.115 -2.670 19163 5083 1 14 . 1 1 29 29 GLN HA H 29 4.035 4.035 3.904 0.131 19163 5084 1 14 . 1 1 29 29 GLN C C 29 179.117 179.117 178.308 0.809 19163 5085 1 14 . 1 1 29 29 GLN CA C 29 59.435 59.435 59.904 -0.469 19163 5086 1 14 . 1 1 29 29 GLN CB C 29 27.851 27.851 28.560 -0.709 19163 5087 1 14 . 1 1 29 29 GLN H H 29 9.015 9.015 8.792 0.223 19163 5088 1 14 . 1 1 30 30 GLU N N 30 119.343 119.343 119.137 0.206 19163 5089 1 14 . 1 1 30 30 GLU HA H 30 4.059 4.059 4.094 -0.035 19163 5090 1 14 . 1 1 30 30 GLU C C 30 179.097 179.097 178.494 0.603 19163 5091 1 14 . 1 1 30 30 GLU CA C 30 59.847 59.847 59.421 0.426 19163 5092 1 14 . 1 1 30 30 GLU CB C 30 29.356 29.356 29.261 0.095 19163 5093 1 14 . 1 1 30 30 GLU H H 30 8.549 8.549 8.582 -0.033 19163 5094 1 14 . 1 1 31 31 GLU N N 31 120.562 120.562 120.671 -0.109 19163 5095 1 14 . 1 1 31 31 GLU HA H 31 3.906 3.906 4.090 -0.184 19163 5096 1 14 . 1 1 31 31 GLU C C 31 180.405 180.405 179.139 1.266 19163 5097 1 14 . 1 1 31 31 GLU CA C 31 59.592 59.592 59.371 0.221 19163 5098 1 14 . 1 1 31 31 GLU CB C 31 29.989 29.989 29.561 0.428 19163 5099 1 14 . 1 1 31 31 GLU H H 31 7.768 7.768 8.071 -0.303 19163 5100 1 14 . 1 1 32 32 LEU N N 32 120.518 120.518 120.032 0.486 19163 5101 1 14 . 1 1 32 32 LEU HA H 32 3.963 3.963 4.060 -0.097 19163 5102 1 14 . 1 1 32 32 LEU C C 32 177.873 177.873 179.282 -1.409 19163 5103 1 14 . 1 1 32 32 LEU CA C 32 58.593 58.593 57.911 0.682 19163 5104 1 14 . 1 1 32 32 LEU CB C 32 42.556 42.556 41.206 1.350 19163 5105 1 14 . 1 1 32 32 LEU H H 32 8.475 8.475 8.708 -0.233 19163 5106 1 14 . 1 1 33 33 LYS N N 33 119.091 119.091 118.845 0.246 19163 5107 1 14 . 1 1 33 33 LYS HA H 33 4.000 4.000 4.271 -0.271 19163 5108 1 14 . 1 1 33 33 LYS C C 33 178.701 178.701 179.038 -0.337 19163 5109 1 14 . 1 1 33 33 LYS CA C 33 60.274 60.274 60.047 0.227 19163 5110 1 14 . 1 1 33 33 LYS CB C 33 32.656 32.656 32.233 0.423 19163 5111 1 14 . 1 1 33 33 LYS H H 33 8.077 8.077 7.779 0.298 19163 5112 1 14 . 1 1 34 34 LYS N N 34 118.527 118.527 120.162 -1.635 19163 5113 1 14 . 1 1 34 34 LYS HA H 34 3.890 3.890 4.046 -0.156 19163 5114 1 14 . 1 1 34 34 LYS C C 34 179.172 179.172 178.723 0.449 19163 5115 1 14 . 1 1 34 34 LYS CA C 34 59.927 59.927 59.431 0.496 19163 5116 1 14 . 1 1 34 34 LYS CB C 34 32.869 32.869 32.499 0.370 19163 5117 1 14 . 1 1 34 34 LYS H H 34 7.986 7.986 8.142 -0.156 19163 5118 1 14 . 1 1 35 35 ALA N N 35 122.190 122.190 121.838 0.352 19163 5119 1 14 . 1 1 35 35 ALA HA H 35 4.116 4.116 4.046 0.070 19163 5120 1 14 . 1 1 35 35 ALA C C 35 179.982 179.982 179.054 0.928 19163 5121 1 14 . 1 1 35 35 ALA CA C 35 55.157 55.157 55.304 -0.147 19163 5122 1 14 . 1 1 35 35 ALA CB C 35 18.773 18.773 18.273 0.499 19163 5123 1 14 . 1 1 35 35 ALA H H 35 7.917 7.917 8.432 -0.515 19163 5124 1 14 . 1 1 36 36 TYR N N 36 117.701 117.701 120.382 -2.681 19163 5125 1 14 . 1 1 36 36 TYR HA H 36 3.818 3.818 4.056 -0.237 19163 5126 1 14 . 1 1 36 36 TYR C C 36 176.344 176.344 177.498 -1.154 19163 5127 1 14 . 1 1 36 36 TYR CA C 36 61.468 61.468 61.468 -0.000 19163 5128 1 14 . 1 1 36 36 TYR CB C 36 38.890 38.890 38.342 0.548 19163 5129 1 14 . 1 1 36 36 TYR H H 36 8.402 8.402 7.810 0.592 19163 5130 1 14 . 1 1 37 37 ARG N N 37 117.423 117.423 119.107 -1.684 19163 5131 1 14 . 1 1 37 37 ARG HA H 37 3.481 3.481 3.716 -0.235 19163 5132 1 14 . 1 1 37 37 ARG C C 37 178.825 178.825 178.287 0.538 19163 5133 1 14 . 1 1 37 37 ARG CA C 37 59.397 59.397 59.704 -0.307 19163 5134 1 14 . 1 1 37 37 ARG CB C 37 29.710 29.710 30.073 -0.363 19163 5135 1 14 . 1 1 37 37 ARG H H 37 8.264 8.264 8.104 0.160 19163 5136 1 14 . 1 1 38 38 LYS N N 38 117.247 117.247 119.811 -2.564 19163 5137 1 14 . 1 1 38 38 LYS HA H 38 3.905 3.905 4.028 -0.123 19163 5138 1 14 . 1 1 38 38 LYS C C 38 179.444 179.444 179.169 0.275 19163 5139 1 14 . 1 1 38 38 LYS CA C 38 59.450 59.450 59.455 -0.005 19163 5140 1 14 . 1 1 38 38 LYS CB C 38 32.609 32.609 32.352 0.257 19163 5141 1 14 . 1 1 38 38 LYS H H 38 7.444 7.444 7.847 -0.403 19163 5142 1 14 . 1 1 39 39 LEU N N 39 119.901 119.901 119.367 0.534 19163 5143 1 14 . 1 1 39 39 LEU HA H 39 4.020 4.020 4.101 -0.081 19163 5144 1 14 . 1 1 39 39 LEU C C 39 178.801 178.801 178.777 0.024 19163 5145 1 14 . 1 1 39 39 LEU CA C 39 57.409 57.409 57.669 -0.260 19163 5146 1 14 . 1 1 39 39 LEU CB C 39 42.388 42.388 41.651 0.737 19163 5147 1 14 . 1 1 39 39 LEU H H 39 7.707 7.707 8.148 -0.441 19163 5148 1 14 . 1 1 40 40 ALA N N 40 122.772 122.772 122.270 0.502 19163 5149 1 14 . 1 1 40 40 ALA HA H 40 3.849 3.849 4.035 -0.186 19163 5150 1 14 . 1 1 40 40 ALA C C 40 179.446 179.446 179.466 -0.020 19163 5151 1 14 . 1 1 40 40 ALA CA C 40 55.109 55.109 55.139 -0.030 19163 5152 1 14 . 1 1 40 40 ALA CB C 40 17.116 17.116 17.930 -0.814 19163 5153 1 14 . 1 1 40 40 ALA H H 40 8.931 8.931 8.247 0.684 19163 5154 1 14 . 1 1 41 41 LEU N N 41 115.299 115.299 117.354 -2.055 19163 5155 1 14 . 1 1 41 41 LEU HA H 41 3.977 3.977 3.798 0.179 19163 5156 1 14 . 1 1 41 41 LEU C C 41 178.216 178.216 179.348 -1.132 19163 5157 1 14 . 1 1 41 41 LEU CA C 41 57.088 57.088 57.241 -0.153 19163 5158 1 14 . 1 1 41 41 LEU CB C 41 42.162 42.162 41.533 0.629 19163 5159 1 14 . 1 1 41 41 LEU H H 41 7.133 7.133 7.433 -0.300 19163 5160 1 14 . 1 1 42 42 LYS N N 42 116.812 116.812 118.016 -1.204 19163 5161 1 14 . 1 1 42 42 LYS HA H 42 3.925 3.925 3.893 0.032 19163 5162 1 14 . 1 1 42 42 LYS C C 42 177.560 177.560 177.834 -0.274 19163 5163 1 14 . 1 1 42 42 LYS CA C 42 57.885 57.885 58.380 -0.495 19163 5164 1 14 . 1 1 42 42 LYS CB C 42 33.427 33.427 32.675 0.752 19163 5165 1 14 . 1 1 42 42 LYS H H 42 7.038 7.038 7.355 -0.317 19163 5166 1 14 . 1 1 43 43 TYR N N 43 114.022 114.022 114.708 -0.686 19163 5167 1 14 . 1 1 43 43 TYR HA H 43 4.665 4.665 4.657 0.008 19163 5168 1 14 . 1 1 43 43 TYR C C 43 173.741 173.741 174.344 -0.603 19163 5169 1 14 . 1 1 43 43 TYR CA C 43 56.928 56.928 56.925 0.003 19163 5170 1 14 . 1 1 43 43 TYR CB C 43 39.579 39.579 37.737 1.842 19163 5171 1 14 . 1 1 43 43 TYR H H 43 7.683 7.683 8.069 -0.386 19163 5172 1 14 . 1 1 44 44 HIS N N 44 120.947 120.947 116.384 4.563 19163 5173 1 14 . 1 1 44 44 HIS HA H 44 3.697 3.697 4.324 -0.627 19163 5174 1 14 . 1 1 44 44 HIS C C 44 174.925 174.925 174.286 0.639 19163 5175 1 14 . 1 1 44 44 HIS CA C 44 56.229 56.229 54.158 2.071 19163 5176 1 14 . 1 1 44 44 HIS CB C 44 30.852 30.852 29.234 1.618 19163 5177 1 14 . 1 1 44 44 HIS H H 44 7.814 7.814 7.405 0.409 19163 5178 1 14 . 1 1 45 45 PRO HA H 45 4.131 4.131 4.411 -0.280 19163 5179 1 14 . 1 1 45 45 PRO C C 45 177.269 177.269 177.619 -0.350 19163 5180 1 14 . 1 1 45 45 PRO CA C 45 64.723 64.723 64.379 0.344 19163 5181 1 14 . 1 1 45 45 PRO CB C 45 32.070 32.070 31.634 0.436 19163 5182 1 14 . 1 1 46 46 ASP N N 46 119.127 119.127 117.517 1.610 19163 5183 1 14 . 1 1 46 46 ASP HA H 46 4.375 4.375 4.335 0.040 19163 5184 1 14 . 1 1 46 46 ASP C C 46 177.284 177.284 176.955 0.329 19163 5185 1 14 . 1 1 46 46 ASP CA C 46 56.020 56.020 56.814 -0.794 19163 5186 1 14 . 1 1 46 46 ASP CB C 46 40.221 40.221 40.342 -0.121 19163 5187 1 14 . 1 1 46 46 ASP H H 46 10.040 10.040 8.422 1.618 19163 5188 1 14 . 1 1 47 47 LYS N N 47 117.416 117.416 117.823 -0.407 19163 5189 1 14 . 1 1 47 47 LYS HA H 47 4.315 4.315 4.183 0.132 19163 5190 1 14 . 1 1 47 47 LYS C C 47 176.355 176.355 176.531 -0.176 19163 5191 1 14 . 1 1 47 47 LYS CA C 47 55.880 55.880 56.648 -0.768 19163 5192 1 14 . 1 1 47 47 LYS CB C 47 33.778 33.778 34.225 -0.447 19163 5193 1 14 . 1 1 47 47 LYS H H 47 7.826 7.826 7.222 0.604 19163 5194 1 14 . 1 1 48 48 ASN N N 48 116.573 116.573 117.877 -1.304 19163 5195 1 14 . 1 1 48 48 ASN HA H 48 5.021 5.021 5.137 -0.116 19163 5196 1 14 . 1 1 48 48 ASN C C 48 172.992 172.992 174.123 -1.131 19163 5197 1 14 . 1 1 48 48 ASN CA C 48 50.467 50.467 50.672 -0.205 19163 5198 1 14 . 1 1 48 48 ASN CB C 48 39.284 39.284 39.013 0.271 19163 5199 1 14 . 1 1 48 48 ASN H H 48 7.956 7.956 8.073 -0.117 19163 5200 1 14 . 1 1 49 49 PRO HA H 49 4.448 4.448 4.383 0.065 19163 5201 1 14 . 1 1 49 49 PRO C C 49 178.030 178.030 176.852 1.178 19163 5202 1 14 . 1 1 49 49 PRO CA C 49 64.468 64.468 64.660 -0.192 19163 5203 1 14 . 1 1 49 49 PRO CB C 49 32.173 32.173 31.988 0.185 19163 5204 1 14 . 1 1 50 50 ASN N N 50 115.567 115.567 113.043 2.524 19163 5205 1 14 . 1 1 50 50 ASN HA H 50 4.748 4.748 4.579 0.169 19163 5206 1 14 . 1 1 50 50 ASN C C 50 176.443 176.443 175.936 0.507 19163 5207 1 14 . 1 1 50 50 ASN CA C 50 54.677 54.677 54.509 0.168 19163 5208 1 14 . 1 1 50 50 ASN CB C 50 39.014 39.014 37.360 1.654 19163 5209 1 14 . 1 1 50 50 ASN H H 50 8.398 8.398 8.739 -0.341 19163 5210 1 14 . 1 1 51 51 GLU N N 51 119.270 119.270 120.540 -1.270 19163 5211 1 14 . 1 1 51 51 GLU HA H 51 4.797 4.797 4.550 0.247 19163 5212 1 14 . 1 1 51 51 GLU C C 51 176.922 176.922 177.923 -1.001 19163 5213 1 14 . 1 1 51 51 GLU CA C 51 55.916 55.916 56.921 -1.005 19163 5214 1 14 . 1 1 51 51 GLU CB C 51 29.200 29.200 29.786 -0.586 19163 5215 1 14 . 1 1 51 51 GLU H H 51 7.485 7.485 7.728 -0.243 19163 5216 1 14 . 1 1 52 52 GLY N N 52 107.541 107.541 108.227 -0.686 19163 5217 1 14 . 1 1 52 52 GLY C C 52 176.755 176.755 175.273 1.482 19163 5218 1 14 . 1 1 52 52 GLY CA C 52 47.914 47.914 46.688 1.226 19163 5219 1 14 . 1 1 52 52 GLY H H 52 8.092 8.092 7.786 0.306 19163 5220 1 14 . 1 1 53 53 GLU N N 53 121.603 121.603 121.122 0.481 19163 5221 1 14 . 1 1 53 53 GLU HA H 53 4.065 4.065 4.038 0.027 19163 5222 1 14 . 1 1 53 53 GLU C C 53 179.052 179.052 178.575 0.477 19163 5223 1 14 . 1 1 53 53 GLU CA C 53 59.280 59.280 59.490 -0.210 19163 5224 1 14 . 1 1 53 53 GLU CB C 53 28.968 28.968 29.343 -0.375 19163 5225 1 14 . 1 1 53 53 GLU H H 53 8.496 8.496 8.010 0.486 19163 5226 1 14 . 1 1 54 54 LYS N N 54 120.837 120.837 118.300 2.537 19163 5227 1 14 . 1 1 54 54 LYS HA H 54 3.923 3.923 4.166 -0.243 19163 5228 1 14 . 1 1 54 54 LYS C C 54 179.058 179.058 178.802 0.256 19163 5229 1 14 . 1 1 54 54 LYS CA C 54 58.800 58.800 58.552 0.248 19163 5230 1 14 . 1 1 54 54 LYS CB C 54 31.551 31.551 32.119 -0.568 19163 5231 1 14 . 1 1 54 54 LYS H H 54 7.857 7.857 7.560 0.297 19163 5232 1 14 . 1 1 55 55 PHE N N 55 118.608 118.608 120.918 -2.310 19163 5233 1 14 . 1 1 55 55 PHE HA H 55 4.021 4.021 4.125 -0.104 19163 5234 1 14 . 1 1 55 55 PHE C C 55 178.001 178.001 176.892 1.109 19163 5235 1 14 . 1 1 55 55 PHE CA C 55 61.911 61.911 60.855 1.056 19163 5236 1 14 . 1 1 55 55 PHE CB C 55 38.553 38.553 38.979 -0.426 19163 5237 1 14 . 1 1 55 55 PHE H H 55 8.382 8.382 7.663 0.719 19163 5238 1 14 . 1 1 56 56 LYS N N 56 120.898 120.898 118.732 2.166 19163 5239 1 14 . 1 1 56 56 LYS HA H 56 3.828 3.828 3.974 -0.146 19163 5240 1 14 . 1 1 56 56 LYS C C 56 178.817 178.817 179.252 -0.435 19163 5241 1 14 . 1 1 56 56 LYS CA C 56 59.877 59.877 59.470 0.407 19163 5242 1 14 . 1 1 56 56 LYS CB C 56 32.133 32.133 31.494 0.639 19163 5243 1 14 . 1 1 56 56 LYS H H 56 8.111 8.111 8.033 0.078 19163 5244 1 14 . 1 1 57 57 GLN N N 57 118.600 118.600 118.721 -0.121 19163 5245 1 14 . 1 1 57 57 GLN HA H 57 4.009 4.009 4.030 -0.021 19163 5246 1 14 . 1 1 57 57 GLN C C 57 179.333 179.333 178.410 0.923 19163 5247 1 14 . 1 1 57 57 GLN CA C 57 59.109 59.109 58.572 0.537 19163 5248 1 14 . 1 1 57 57 GLN CB C 57 28.595 28.595 28.622 -0.027 19163 5249 1 14 . 1 1 57 57 GLN H H 57 7.613 7.613 7.504 0.109 19163 5250 1 14 . 1 1 58 58 ILE N N 58 118.709 118.709 120.847 -2.138 19163 5251 1 14 . 1 1 58 58 ILE HA H 58 3.559 3.559 3.589 -0.030 19163 5252 1 14 . 1 1 58 58 ILE C C 58 177.152 177.152 177.927 -0.775 19163 5253 1 14 . 1 1 58 58 ILE CA C 58 65.068 65.068 65.666 -0.598 19163 5254 1 14 . 1 1 58 58 ILE CB C 58 38.381 38.381 37.574 0.807 19163 5255 1 14 . 1 1 58 58 ILE H H 58 8.011 8.011 7.581 0.430 19163 5256 1 14 . 1 1 59 59 SER N N 59 116.112 116.112 114.998 1.114 19163 5257 1 14 . 1 1 59 59 SER HA H 59 3.948 3.948 4.014 -0.066 19163 5258 1 14 . 1 1 59 59 SER C C 59 175.949 175.949 176.951 -1.002 19163 5259 1 14 . 1 1 59 59 SER CA C 59 62.315 62.315 61.886 0.429 19163 5260 1 14 . 1 1 59 59 SER H H 59 8.030 8.030 8.195 -0.165 19163 5261 1 14 . 1 1 60 60 GLN N N 60 122.099 122.099 120.681 1.418 19163 5262 1 14 . 1 1 60 60 GLN HA H 60 3.801 3.801 4.010 -0.209 19163 5263 1 14 . 1 1 60 60 GLN C C 60 176.942 176.942 178.261 -1.319 19163 5264 1 14 . 1 1 60 60 GLN CA C 60 58.762 58.762 58.872 -0.110 19163 5265 1 14 . 1 1 60 60 GLN CB C 60 28.498 28.498 28.723 -0.225 19163 5266 1 14 . 1 1 60 60 GLN H H 60 7.933 7.933 7.532 0.401 19163 5267 1 14 . 1 1 61 61 ALA N N 61 119.367 119.367 122.268 -2.901 19163 5268 1 14 . 1 1 61 61 ALA HA H 61 2.636 2.636 4.052 -1.416 19163 5269 1 14 . 1 1 61 61 ALA C C 61 178.507 178.507 179.411 -0.904 19163 5270 1 14 . 1 1 61 61 ALA CA C 61 54.126 54.126 55.082 -0.956 19163 5271 1 14 . 1 1 61 61 ALA CB C 61 18.462 18.462 18.404 0.058 19163 5272 1 14 . 1 1 61 61 ALA H H 61 7.354 7.354 7.844 -0.490 19163 5273 1 14 . 1 1 62 62 TYR N N 62 115.613 115.613 120.101 -4.488 19163 5274 1 14 . 1 1 62 62 TYR HA H 62 3.633 3.633 3.992 -0.359 19163 5275 1 14 . 1 1 62 62 TYR C C 62 177.421 177.421 177.519 -0.098 19163 5276 1 14 . 1 1 62 62 TYR CA C 62 61.676 61.676 61.217 0.459 19163 5277 1 14 . 1 1 62 62 TYR CB C 62 39.162 39.162 38.032 1.130 19163 5278 1 14 . 1 1 62 62 TYR H H 62 7.994 7.994 8.634 -0.640 19163 5279 1 14 . 1 1 63 63 GLU N N 63 121.396 121.396 119.957 1.439 19163 5280 1 14 . 1 1 63 63 GLU HA H 63 3.347 3.347 3.693 -0.346 19163 5281 1 14 . 1 1 63 63 GLU C C 63 177.687 177.687 179.053 -1.366 19163 5282 1 14 . 1 1 63 63 GLU CA C 63 59.562 59.562 59.444 0.118 19163 5283 1 14 . 1 1 63 63 GLU CB C 63 29.115 29.115 29.575 -0.460 19163 5284 1 14 . 1 1 63 63 GLU H H 63 8.151 8.151 8.116 0.035 19163 5285 1 14 . 1 1 64 64 VAL N N 64 115.850 115.850 119.174 -3.324 19163 5286 1 14 . 1 1 64 64 VAL HA H 64 3.377 3.377 3.752 -0.375 19163 5287 1 14 . 1 1 64 64 VAL C C 64 175.925 175.925 177.292 -1.367 19163 5288 1 14 . 1 1 64 64 VAL CA C 64 65.806 65.806 65.370 0.436 19163 5289 1 14 . 1 1 64 64 VAL CB C 64 31.786 31.786 31.983 -0.197 19163 5290 1 14 . 1 1 64 64 VAL H H 64 6.814 6.814 7.323 -0.509 19163 5291 1 14 . 1 1 65 65 LEU N N 65 111.438 111.438 119.513 -8.075 19163 5292 1 14 . 1 1 65 65 LEU HA H 65 3.569 3.569 3.982 -0.413 19163 5293 1 14 . 1 1 65 65 LEU C C 65 177.124 177.124 178.868 -1.744 19163 5294 1 14 . 1 1 65 65 LEU CA C 65 56.645 56.645 57.592 -0.947 19163 5295 1 14 . 1 1 65 65 LEU CB C 65 42.589 42.589 41.149 1.440 19163 5296 1 14 . 1 1 65 65 LEU H H 65 7.398 7.398 8.389 -0.991 19163 5297 1 14 . 1 1 66 66 SER N N 66 108.642 108.642 110.741 -2.099 19163 5298 1 14 . 1 1 66 66 SER HA H 66 4.028 4.028 4.127 -0.099 19163 5299 1 14 . 1 1 66 66 SER C C 66 173.286 173.286 174.588 -1.302 19163 5300 1 14 . 1 1 66 66 SER CA C 66 59.232 59.232 60.261 -1.029 19163 5301 1 14 . 1 1 66 66 SER CB C 66 63.066 63.066 62.997 0.069 19163 5302 1 14 . 1 1 66 66 SER H H 66 7.700 7.700 7.718 -0.018 19163 5303 1 14 . 1 1 67 67 ASP N N 67 124.276 124.276 122.179 2.097 19163 5304 1 14 . 1 1 67 67 ASP HA H 67 4.668 4.668 4.704 -0.036 19163 5305 1 14 . 1 1 67 67 ASP C C 67 174.913 174.913 175.482 -0.569 19163 5306 1 14 . 1 1 67 67 ASP CA C 67 52.487 52.487 52.747 -0.260 19163 5307 1 14 . 1 1 67 67 ASP CB C 67 43.218 43.218 42.231 0.987 19163 5308 1 14 . 1 1 67 67 ASP H H 67 6.879 6.879 7.199 -0.320 19163 5309 1 14 . 1 1 68 68 ALA N N 68 127.326 127.326 130.720 -3.394 19163 5310 1 14 . 1 1 68 68 ALA HA H 68 3.853 3.853 3.947 -0.094 19163 5311 1 14 . 1 1 68 68 ALA C C 68 180.336 180.336 178.631 1.705 19163 5312 1 14 . 1 1 68 68 ALA CA C 68 55.912 55.912 55.126 0.786 19163 5313 1 14 . 1 1 68 68 ALA CB C 68 18.645 18.645 18.837 -0.192 19163 5314 1 14 . 1 1 68 68 ALA H H 68 8.693 8.693 8.876 -0.183 19163 5315 1 14 . 1 1 69 69 LYS N N 69 116.929 116.929 118.246 -1.317 19163 5316 1 14 . 1 1 69 69 LYS HA H 69 4.162 4.162 4.063 0.099 19163 5317 1 14 . 1 1 69 69 LYS C C 69 179.515 179.515 178.602 0.913 19163 5318 1 14 . 1 1 69 69 LYS CA C 69 58.562 58.562 59.100 -0.538 19163 5319 1 14 . 1 1 69 69 LYS CB C 69 31.840 31.840 32.344 -0.504 19163 5320 1 14 . 1 1 69 69 LYS H H 69 7.950 7.950 7.878 0.072 19163 5321 1 14 . 1 1 70 70 LYS N N 70 121.286 121.286 119.342 1.944 19163 5322 1 14 . 1 1 70 70 LYS HA H 70 3.960 3.960 3.951 0.009 19163 5323 1 14 . 1 1 70 70 LYS C C 70 179.938 179.938 178.972 0.966 19163 5324 1 14 . 1 1 70 70 LYS CA C 70 60.066 60.066 59.584 0.482 19163 5325 1 14 . 1 1 70 70 LYS CB C 70 32.695 32.695 32.312 0.383 19163 5326 1 14 . 1 1 70 70 LYS H H 70 8.184 8.184 8.246 -0.062 19163 5327 1 14 . 1 1 71 71 ARG N N 71 122.794 122.794 119.610 3.184 19163 5328 1 14 . 1 1 71 71 ARG HA H 71 3.668 3.668 3.986 -0.318 19163 5329 1 14 . 1 1 71 71 ARG C C 71 177.356 177.356 177.916 -0.560 19163 5330 1 14 . 1 1 71 71 ARG CA C 71 60.127 60.127 59.685 0.442 19163 5331 1 14 . 1 1 71 71 ARG CB C 71 29.668 29.668 30.145 -0.477 19163 5332 1 14 . 1 1 71 71 ARG H H 71 9.290 9.290 8.545 0.745 19163 5333 1 14 . 1 1 72 72 GLU N N 72 118.390 118.390 119.964 -1.574 19163 5334 1 14 . 1 1 72 72 GLU HA H 72 4.096 4.096 4.044 0.052 19163 5335 1 14 . 1 1 72 72 GLU C C 72 179.073 179.073 178.934 0.139 19163 5336 1 14 . 1 1 72 72 GLU CA C 72 59.456 59.456 59.546 -0.090 19163 5337 1 14 . 1 1 72 72 GLU CB C 72 29.615 29.615 29.445 0.170 19163 5338 1 14 . 1 1 72 72 GLU H H 72 7.607 7.607 7.684 -0.077 19163 5339 1 14 . 1 1 73 73 LEU N N 73 117.921 117.921 119.587 -1.666 19163 5340 1 14 . 1 1 73 73 LEU HA H 73 4.032 4.032 3.977 0.055 19163 5341 1 14 . 1 1 73 73 LEU C C 73 179.696 179.696 179.181 0.515 19163 5342 1 14 . 1 1 73 73 LEU CA C 73 57.597 57.597 57.938 -0.341 19163 5343 1 14 . 1 1 73 73 LEU CB C 73 41.815 41.815 41.657 0.158 19163 5344 1 14 . 1 1 73 73 LEU H H 73 7.398 7.398 7.618 -0.220 19163 5345 1 14 . 1 1 74 74 TYR N N 74 122.662 122.662 120.559 2.103 19163 5346 1 14 . 1 1 74 74 TYR HA H 74 4.092 4.092 3.915 0.177 19163 5347 1 14 . 1 1 74 74 TYR C C 74 178.166 178.166 177.606 0.560 19163 5348 1 14 . 1 1 74 74 TYR CA C 74 61.458 61.458 61.724 -0.266 19163 5349 1 14 . 1 1 74 74 TYR CB C 74 38.778 38.778 38.533 0.245 19163 5350 1 14 . 1 1 74 74 TYR H H 74 8.316 8.316 8.086 0.230 19163 5351 1 14 . 1 1 75 75 ASP N N 75 118.842 118.842 118.015 0.827 19163 5352 1 14 . 1 1 75 75 ASP HA H 75 4.423 4.423 4.442 -0.019 19163 5353 1 14 . 1 1 75 75 ASP C C 75 177.726 177.726 177.773 -0.047 19163 5354 1 14 . 1 1 75 75 ASP CA C 75 56.177 56.177 56.456 -0.279 19163 5355 1 14 . 1 1 75 75 ASP CB C 75 40.800 40.800 41.199 -0.399 19163 5356 1 14 . 1 1 75 75 ASP H H 75 8.770 8.770 8.412 0.358 19163 5357 1 14 . 1 1 76 76 LYS N N 76 118.955 118.955 118.291 0.664 19163 5358 1 14 . 1 1 76 76 LYS HA H 76 4.130 4.130 4.181 -0.051 19163 5359 1 14 . 1 1 76 76 LYS C C 76 177.006 177.006 176.931 0.075 19163 5360 1 14 . 1 1 76 76 LYS CA C 76 57.537 57.537 56.989 0.548 19163 5361 1 14 . 1 1 76 76 LYS CB C 76 33.136 33.136 33.838 -0.702 19163 5362 1 14 . 1 1 76 76 LYS H H 76 7.610 7.610 7.942 -0.333 19163 5363 1 15 . 1 1 11 11 MET HA H 11 4.346 4.346 4.479 -0.133 19163 5364 1 15 . 1 1 11 11 MET C C 11 175.801 175.801 176.110 -0.309 19163 5365 1 15 . 1 1 11 11 MET CA C 11 55.614 55.614 55.389 0.225 19163 5366 1 15 . 1 1 11 11 MET CB C 11 32.925 32.925 32.957 -0.032 19163 5367 1 15 . 1 1 12 12 VAL N N 12 121.226 121.226 121.509 -0.283 19163 5368 1 15 . 1 1 12 12 VAL HA H 12 4.026 4.026 4.243 -0.217 19163 5369 1 15 . 1 1 12 12 VAL C C 12 175.701 175.701 175.526 0.175 19163 5370 1 15 . 1 1 12 12 VAL CA C 12 62.188 62.188 61.886 0.301 19163 5371 1 15 . 1 1 12 12 VAL CB C 12 32.882 32.882 31.293 1.589 19163 5372 1 15 . 1 1 12 12 VAL H H 12 7.988 7.988 8.552 -0.564 19163 5373 1 15 . 1 1 13 13 LYS N N 13 125.255 125.255 128.114 -2.859 19163 5374 1 15 . 1 1 13 13 LYS HA H 13 4.211 4.211 4.457 -0.246 19163 5375 1 15 . 1 1 13 13 LYS C C 13 176.121 176.121 175.609 0.512 19163 5376 1 15 . 1 1 13 13 LYS CA C 13 56.355 56.355 55.553 0.802 19163 5377 1 15 . 1 1 13 13 LYS CB C 13 33.019 33.019 32.910 0.109 19163 5378 1 15 . 1 1 13 13 LYS H H 13 8.281 8.281 8.491 -0.209 19163 5379 1 15 . 1 1 14 14 GLU N N 14 123.004 123.004 122.267 0.737 19163 5380 1 15 . 1 1 14 14 GLU HA H 14 4.305 4.305 3.991 0.314 19163 5381 1 15 . 1 1 14 14 GLU C C 14 176.107 176.107 175.386 0.721 19163 5382 1 15 . 1 1 14 14 GLU CA C 14 56.343 56.343 56.479 -0.136 19163 5383 1 15 . 1 1 14 14 GLU CB C 14 30.534 30.534 29.378 1.156 19163 5384 1 15 . 1 1 14 14 GLU H H 14 8.424 8.424 8.797 -0.373 19163 5385 1 15 . 1 1 15 15 THR N N 15 115.895 115.895 114.191 1.704 19163 5386 1 15 . 1 1 15 15 THR HA H 15 4.538 4.538 4.518 0.021 19163 5387 1 15 . 1 1 15 15 THR C C 15 175.233 175.233 174.235 0.998 19163 5388 1 15 . 1 1 15 15 THR CA C 15 61.981 61.981 63.123 -1.141 19163 5389 1 15 . 1 1 15 15 THR CB C 15 69.865 69.865 68.724 1.141 19163 5390 1 15 . 1 1 15 15 THR H H 15 8.335 8.335 8.170 0.165 19163 5391 1 15 . 1 1 16 16 THR N N 16 116.992 116.992 119.609 -2.617 19163 5392 1 15 . 1 1 16 16 THR HA H 16 4.366 4.366 4.424 -0.058 19163 5393 1 15 . 1 1 16 16 THR C C 16 176.090 176.090 175.644 0.446 19163 5394 1 15 . 1 1 16 16 THR CA C 16 62.172 62.172 58.890 3.282 19163 5395 1 15 . 1 1 16 16 THR CB C 16 71.997 71.997 70.324 1.673 19163 5396 1 15 . 1 1 16 16 THR H H 16 8.798 8.798 7.926 0.872 19163 5397 1 15 . 1 1 17 17 TYR N N 17 117.617 117.617 119.007 -1.390 19163 5398 1 15 . 1 1 17 17 TYR HA H 17 4.329 4.329 4.255 0.074 19163 5399 1 15 . 1 1 17 17 TYR C C 17 177.105 177.105 177.821 -0.716 19163 5400 1 15 . 1 1 17 17 TYR CA C 17 57.577 57.577 61.953 -4.376 19163 5401 1 15 . 1 1 17 17 TYR CB C 17 37.113 37.113 38.096 -0.983 19163 5402 1 15 . 1 1 17 17 TYR H H 17 8.292 8.292 8.820 -0.528 19163 5403 1 15 . 1 1 18 18 TYR N N 18 115.048 115.048 117.687 -2.639 19163 5404 1 15 . 1 1 18 18 TYR HA H 18 3.775 3.775 4.226 -0.451 19163 5405 1 15 . 1 1 18 18 TYR C C 18 177.771 177.771 177.800 -0.029 19163 5406 1 15 . 1 1 18 18 TYR CA C 18 61.430 61.430 62.830 -1.400 19163 5407 1 15 . 1 1 18 18 TYR CB C 18 36.495 36.495 37.782 -1.288 19163 5408 1 15 . 1 1 18 18 TYR H H 18 7.047 7.047 8.131 -1.084 19163 5409 1 15 . 1 1 19 19 ASP N N 19 119.520 119.520 118.940 0.580 19163 5410 1 15 . 1 1 19 19 ASP HA H 19 4.406 4.406 4.411 -0.005 19163 5411 1 15 . 1 1 19 19 ASP C C 19 180.128 180.128 178.428 1.700 19163 5412 1 15 . 1 1 19 19 ASP CA C 19 57.475 57.475 57.261 0.214 19163 5413 1 15 . 1 1 19 19 ASP CB C 19 40.659 40.659 40.611 0.048 19163 5414 1 15 . 1 1 19 19 ASP H H 19 7.685 7.685 8.211 -0.526 19163 5415 1 15 . 1 1 20 20 VAL N N 20 119.772 119.772 118.813 0.959 19163 5416 1 15 . 1 1 20 20 VAL HA H 20 3.608 3.608 3.753 -0.145 19163 5417 1 15 . 1 1 20 20 VAL C C 20 177.026 177.026 177.276 -0.250 19163 5418 1 15 . 1 1 20 20 VAL CA C 20 65.840 65.840 65.560 0.280 19163 5419 1 15 . 1 1 20 20 VAL CB C 20 31.530 31.530 31.481 0.049 19163 5420 1 15 . 1 1 20 20 VAL H H 20 8.004 8.004 8.312 -0.308 19163 5421 1 15 . 1 1 21 21 LEU N N 21 115.252 115.252 116.775 -1.523 19163 5422 1 15 . 1 1 21 21 LEU HA H 21 4.281 4.281 4.309 -0.028 19163 5423 1 15 . 1 1 21 21 LEU C C 21 175.757 175.757 177.525 -1.768 19163 5424 1 15 . 1 1 21 21 LEU CA C 21 54.554 54.554 54.701 -0.147 19163 5425 1 15 . 1 1 21 21 LEU CB C 21 42.869 42.869 41.915 0.954 19163 5426 1 15 . 1 1 21 21 LEU H H 21 6.847 6.847 7.616 -0.769 19163 5427 1 15 . 1 1 22 22 GLY N N 22 108.227 108.227 107.078 1.149 19163 5428 1 15 . 1 1 22 22 GLY C C 22 175.361 175.361 173.887 1.474 19163 5429 1 15 . 1 1 22 22 GLY CA C 22 46.574 46.574 45.794 0.780 19163 5430 1 15 . 1 1 22 22 GLY H H 22 7.874 7.874 7.601 0.273 19163 5431 1 15 . 1 1 23 23 VAL N N 23 110.675 110.675 118.716 -8.041 19163 5432 1 15 . 1 1 23 23 VAL HA H 23 4.767 4.767 4.378 0.389 19163 5433 1 15 . 1 1 23 23 VAL C C 23 174.674 174.674 174.587 0.087 19163 5434 1 15 . 1 1 23 23 VAL CA C 23 58.349 58.349 60.271 -1.922 19163 5435 1 15 . 1 1 23 23 VAL CB C 23 34.938 34.938 35.636 -0.698 19163 5436 1 15 . 1 1 23 23 VAL H H 23 7.815 7.815 8.090 -0.275 19163 5437 1 15 . 1 1 24 24 LYS N N 24 119.948 119.948 125.335 -5.387 19163 5438 1 15 . 1 1 24 24 LYS HA H 24 4.488 4.488 4.806 -0.318 19163 5439 1 15 . 1 1 24 24 LYS C C 24 175.442 175.442 176.022 -0.580 19163 5440 1 15 . 1 1 24 24 LYS CA C 24 54.001 54.001 53.416 0.585 19163 5441 1 15 . 1 1 24 24 LYS CB C 24 32.197 32.197 31.424 0.773 19163 5442 1 15 . 1 1 24 24 LYS H H 24 8.329 8.329 8.487 -0.158 19163 5443 1 15 . 1 1 25 25 PRO HA H 25 2.421 2.421 4.337 -1.916 19163 5444 1 15 . 1 1 25 25 PRO C C 25 175.635 175.635 176.020 -0.385 19163 5445 1 15 . 1 1 25 25 PRO CA C 25 63.362 63.362 64.805 -1.443 19163 5446 1 15 . 1 1 25 25 PRO CB C 25 31.839 31.839 31.555 0.284 19163 5447 1 15 . 1 1 26 26 ASN N N 26 111.739 111.739 113.925 -2.186 19163 5448 1 15 . 1 1 26 26 ASN HA H 26 4.518 4.518 4.758 -0.240 19163 5449 1 15 . 1 1 26 26 ASN C C 26 175.820 175.820 174.784 1.036 19163 5450 1 15 . 1 1 26 26 ASN CA C 26 51.525 51.525 51.652 -0.127 19163 5451 1 15 . 1 1 26 26 ASN CB C 26 36.829 36.829 37.661 -0.832 19163 5452 1 15 . 1 1 26 26 ASN H H 26 7.138 7.138 8.069 -0.931 19163 5453 1 15 . 1 1 27 27 ALA N N 27 122.829 122.829 124.545 -1.716 19163 5454 1 15 . 1 1 27 27 ALA HA H 27 4.325 4.325 4.470 -0.145 19163 5455 1 15 . 1 1 27 27 ALA C C 27 178.726 178.726 176.710 2.016 19163 5456 1 15 . 1 1 27 27 ALA CA C 27 52.961 52.961 52.387 0.574 19163 5457 1 15 . 1 1 27 27 ALA CB C 27 19.159 19.159 19.340 -0.181 19163 5458 1 15 . 1 1 27 27 ALA H H 27 7.637 7.637 7.652 -0.015 19163 5459 1 15 . 1 1 28 28 THR N N 28 113.468 113.468 113.126 0.342 19163 5460 1 15 . 1 1 28 28 THR HA H 28 4.493 4.493 4.411 0.082 19163 5461 1 15 . 1 1 28 28 THR C C 28 175.641 175.641 175.969 -0.328 19163 5462 1 15 . 1 1 28 28 THR CA C 28 60.592 60.592 61.189 -0.597 19163 5463 1 15 . 1 1 28 28 THR CB C 28 71.304 71.304 70.016 1.288 19163 5464 1 15 . 1 1 28 28 THR H H 28 8.829 8.829 7.999 0.830 19163 5465 1 15 . 1 1 29 29 GLN N N 29 119.445 119.445 121.347 -1.902 19163 5466 1 15 . 1 1 29 29 GLN HA H 29 4.035 4.035 3.970 0.065 19163 5467 1 15 . 1 1 29 29 GLN C C 29 179.117 179.117 178.684 0.433 19163 5468 1 15 . 1 1 29 29 GLN CA C 29 59.435 59.435 60.055 -0.620 19163 5469 1 15 . 1 1 29 29 GLN CB C 29 27.851 27.851 28.006 -0.155 19163 5470 1 15 . 1 1 29 29 GLN H H 29 9.015 9.015 8.851 0.164 19163 5471 1 15 . 1 1 30 30 GLU N N 30 119.343 119.343 119.488 -0.145 19163 5472 1 15 . 1 1 30 30 GLU HA H 30 4.059 4.059 4.161 -0.102 19163 5473 1 15 . 1 1 30 30 GLU C C 30 179.097 179.097 178.723 0.374 19163 5474 1 15 . 1 1 30 30 GLU CA C 30 59.847 59.847 59.283 0.564 19163 5475 1 15 . 1 1 30 30 GLU CB C 30 29.356 29.356 29.189 0.167 19163 5476 1 15 . 1 1 30 30 GLU H H 30 8.549 8.549 8.588 -0.039 19163 5477 1 15 . 1 1 31 31 GLU N N 31 120.562 120.562 120.508 0.054 19163 5478 1 15 . 1 1 31 31 GLU HA H 31 3.906 3.906 4.093 -0.187 19163 5479 1 15 . 1 1 31 31 GLU C C 31 180.405 180.405 179.055 1.350 19163 5480 1 15 . 1 1 31 31 GLU CA C 31 59.592 59.592 59.336 0.256 19163 5481 1 15 . 1 1 31 31 GLU CB C 31 29.989 29.989 29.544 0.445 19163 5482 1 15 . 1 1 31 31 GLU H H 31 7.768 7.768 8.166 -0.399 19163 5483 1 15 . 1 1 32 32 LEU N N 32 120.518 120.518 120.036 0.482 19163 5484 1 15 . 1 1 32 32 LEU HA H 32 3.963 3.963 4.023 -0.060 19163 5485 1 15 . 1 1 32 32 LEU C C 32 177.873 177.873 179.244 -1.371 19163 5486 1 15 . 1 1 32 32 LEU CA C 32 58.593 58.593 57.862 0.731 19163 5487 1 15 . 1 1 32 32 LEU CB C 32 42.556 42.556 41.144 1.412 19163 5488 1 15 . 1 1 32 32 LEU H H 32 8.475 8.475 8.627 -0.152 19163 5489 1 15 . 1 1 33 33 LYS N N 33 119.091 119.091 119.275 -0.184 19163 5490 1 15 . 1 1 33 33 LYS HA H 33 4.000 4.000 4.185 -0.185 19163 5491 1 15 . 1 1 33 33 LYS C C 33 178.701 178.701 179.183 -0.482 19163 5492 1 15 . 1 1 33 33 LYS CA C 33 60.274 60.274 59.970 0.304 19163 5493 1 15 . 1 1 33 33 LYS CB C 33 32.656 32.656 32.202 0.454 19163 5494 1 15 . 1 1 33 33 LYS H H 33 8.077 8.077 7.721 0.356 19163 5495 1 15 . 1 1 34 34 LYS N N 34 118.527 118.527 119.146 -0.619 19163 5496 1 15 . 1 1 34 34 LYS HA H 34 3.890 3.890 4.084 -0.194 19163 5497 1 15 . 1 1 34 34 LYS C C 34 179.172 179.172 178.986 0.186 19163 5498 1 15 . 1 1 34 34 LYS CA C 34 59.927 59.927 58.668 1.259 19163 5499 1 15 . 1 1 34 34 LYS CB C 34 32.869 32.869 31.809 1.060 19163 5500 1 15 . 1 1 34 34 LYS H H 34 7.986 7.986 7.885 0.101 19163 5501 1 15 . 1 1 35 35 ALA N N 35 122.190 122.190 122.709 -0.519 19163 5502 1 15 . 1 1 35 35 ALA HA H 35 4.116 4.116 4.033 0.083 19163 5503 1 15 . 1 1 35 35 ALA C C 35 179.982 179.982 178.923 1.059 19163 5504 1 15 . 1 1 35 35 ALA CA C 35 55.157 55.157 55.219 -0.062 19163 5505 1 15 . 1 1 35 35 ALA CB C 35 18.773 18.773 18.256 0.517 19163 5506 1 15 . 1 1 35 35 ALA H H 35 7.917 7.917 8.469 -0.552 19163 5507 1 15 . 1 1 36 36 TYR N N 36 117.701 117.701 120.300 -2.599 19163 5508 1 15 . 1 1 36 36 TYR HA H 36 3.818 3.818 3.931 -0.113 19163 5509 1 15 . 1 1 36 36 TYR C C 36 176.344 176.344 177.410 -1.066 19163 5510 1 15 . 1 1 36 36 TYR CA C 36 61.468 61.468 61.183 0.285 19163 5511 1 15 . 1 1 36 36 TYR CB C 36 38.890 38.890 37.946 0.944 19163 5512 1 15 . 1 1 36 36 TYR H H 36 8.402 8.402 7.747 0.655 19163 5513 1 15 . 1 1 37 37 ARG N N 37 117.423 117.423 119.021 -1.598 19163 5514 1 15 . 1 1 37 37 ARG HA H 37 3.481 3.481 3.676 -0.195 19163 5515 1 15 . 1 1 37 37 ARG C C 37 178.825 178.825 178.215 0.610 19163 5516 1 15 . 1 1 37 37 ARG CA C 37 59.397 59.397 59.737 -0.341 19163 5517 1 15 . 1 1 37 37 ARG CB C 37 29.710 29.710 30.020 -0.310 19163 5518 1 15 . 1 1 37 37 ARG H H 37 8.264 8.264 8.243 0.021 19163 5519 1 15 . 1 1 38 38 LYS N N 38 117.247 117.247 119.827 -2.580 19163 5520 1 15 . 1 1 38 38 LYS HA H 38 3.905 3.905 4.032 -0.127 19163 5521 1 15 . 1 1 38 38 LYS C C 38 179.444 179.444 179.153 0.291 19163 5522 1 15 . 1 1 38 38 LYS CA C 38 59.450 59.450 59.538 -0.088 19163 5523 1 15 . 1 1 38 38 LYS CB C 38 32.609 32.609 32.320 0.289 19163 5524 1 15 . 1 1 38 38 LYS H H 38 7.444 7.444 7.794 -0.350 19163 5525 1 15 . 1 1 39 39 LEU N N 39 119.901 119.901 119.254 0.647 19163 5526 1 15 . 1 1 39 39 LEU HA H 39 4.020 4.020 4.174 -0.154 19163 5527 1 15 . 1 1 39 39 LEU C C 39 178.801 178.801 178.878 -0.077 19163 5528 1 15 . 1 1 39 39 LEU CA C 39 57.409 57.409 57.664 -0.255 19163 5529 1 15 . 1 1 39 39 LEU CB C 39 42.388 42.388 41.634 0.754 19163 5530 1 15 . 1 1 39 39 LEU H H 39 7.707 7.707 7.928 -0.221 19163 5531 1 15 . 1 1 40 40 ALA N N 40 122.772 122.772 122.310 0.462 19163 5532 1 15 . 1 1 40 40 ALA HA H 40 3.849 3.849 4.130 -0.281 19163 5533 1 15 . 1 1 40 40 ALA C C 40 179.446 179.446 179.563 -0.117 19163 5534 1 15 . 1 1 40 40 ALA CA C 40 55.109 55.109 55.206 -0.097 19163 5535 1 15 . 1 1 40 40 ALA CB C 40 17.116 17.116 17.977 -0.861 19163 5536 1 15 . 1 1 40 40 ALA H H 40 8.931 8.931 8.215 0.716 19163 5537 1 15 . 1 1 41 41 LEU N N 41 115.299 115.299 117.095 -1.796 19163 5538 1 15 . 1 1 41 41 LEU HA H 41 3.977 3.977 4.033 -0.056 19163 5539 1 15 . 1 1 41 41 LEU C C 41 178.216 178.216 179.611 -1.395 19163 5540 1 15 . 1 1 41 41 LEU CA C 41 57.088 57.088 57.298 -0.210 19163 5541 1 15 . 1 1 41 41 LEU CB C 41 42.162 42.162 41.742 0.420 19163 5542 1 15 . 1 1 41 41 LEU H H 41 7.133 7.133 7.761 -0.628 19163 5543 1 15 . 1 1 42 42 LYS N N 42 116.812 116.812 118.295 -1.483 19163 5544 1 15 . 1 1 42 42 LYS HA H 42 3.925 3.925 4.138 -0.213 19163 5545 1 15 . 1 1 42 42 LYS C C 42 177.560 177.560 177.953 -0.393 19163 5546 1 15 . 1 1 42 42 LYS CA C 42 57.885 57.885 58.367 -0.482 19163 5547 1 15 . 1 1 42 42 LYS CB C 42 33.427 33.427 32.757 0.670 19163 5548 1 15 . 1 1 42 42 LYS H H 42 7.038 7.038 7.514 -0.476 19163 5549 1 15 . 1 1 43 43 TYR N N 43 114.022 114.022 115.750 -1.728 19163 5550 1 15 . 1 1 43 43 TYR HA H 43 4.665 4.665 4.599 0.066 19163 5551 1 15 . 1 1 43 43 TYR C C 43 173.741 173.741 174.201 -0.460 19163 5552 1 15 . 1 1 43 43 TYR CA C 43 56.928 56.928 56.547 0.381 19163 5553 1 15 . 1 1 43 43 TYR CB C 43 39.579 39.579 37.550 2.029 19163 5554 1 15 . 1 1 43 43 TYR H H 43 7.683 7.683 8.282 -0.599 19163 5555 1 15 . 1 1 44 44 HIS N N 44 120.947 120.947 122.777 -1.830 19163 5556 1 15 . 1 1 44 44 HIS HA H 44 3.697 3.697 4.250 -0.553 19163 5557 1 15 . 1 1 44 44 HIS C C 44 174.925 174.925 174.902 0.023 19163 5558 1 15 . 1 1 44 44 HIS CA C 44 56.229 56.229 56.755 -0.526 19163 5559 1 15 . 1 1 44 44 HIS CB C 44 30.852 30.852 30.739 0.113 19163 5560 1 15 . 1 1 44 44 HIS H H 44 7.814 7.814 7.565 0.249 19163 5561 1 15 . 1 1 45 45 PRO HA H 45 4.131 4.131 4.374 -0.243 19163 5562 1 15 . 1 1 45 45 PRO C C 45 177.269 177.269 177.897 -0.628 19163 5563 1 15 . 1 1 45 45 PRO CA C 45 64.723 64.723 65.259 -0.536 19163 5564 1 15 . 1 1 45 45 PRO CB C 45 32.070 32.070 31.872 0.198 19163 5565 1 15 . 1 1 46 46 ASP N N 46 119.127 119.127 117.652 1.475 19163 5566 1 15 . 1 1 46 46 ASP HA H 46 4.375 4.375 4.569 -0.194 19163 5567 1 15 . 1 1 46 46 ASP C C 46 177.284 177.284 177.403 -0.119 19163 5568 1 15 . 1 1 46 46 ASP CA C 46 56.020 56.020 56.344 -0.324 19163 5569 1 15 . 1 1 46 46 ASP CB C 46 40.221 40.221 41.000 -0.779 19163 5570 1 15 . 1 1 46 46 ASP H H 46 10.040 10.040 7.865 2.175 19163 5571 1 15 . 1 1 47 47 LYS N N 47 117.416 117.416 118.742 -1.326 19163 5572 1 15 . 1 1 47 47 LYS HA H 47 4.315 4.315 4.307 0.008 19163 5573 1 15 . 1 1 47 47 LYS C C 47 176.355 176.355 176.395 -0.040 19163 5574 1 15 . 1 1 47 47 LYS CA C 47 55.880 55.880 57.235 -1.355 19163 5575 1 15 . 1 1 47 47 LYS CB C 47 33.778 33.778 34.669 -0.891 19163 5576 1 15 . 1 1 47 47 LYS H H 47 7.826 7.826 7.791 0.035 19163 5577 1 15 . 1 1 48 48 ASN N N 48 116.573 116.573 118.050 -1.477 19163 5578 1 15 . 1 1 48 48 ASN HA H 48 5.021 5.021 5.152 -0.131 19163 5579 1 15 . 1 1 48 48 ASN C C 48 172.992 172.992 173.925 -0.933 19163 5580 1 15 . 1 1 48 48 ASN CA C 48 50.467 50.467 50.841 -0.374 19163 5581 1 15 . 1 1 48 48 ASN CB C 48 39.284 39.284 39.689 -0.405 19163 5582 1 15 . 1 1 48 48 ASN H H 48 7.956 7.956 8.260 -0.304 19163 5583 1 15 . 1 1 49 49 PRO HA H 49 4.448 4.448 4.493 -0.045 19163 5584 1 15 . 1 1 49 49 PRO C C 49 178.030 178.030 177.862 0.168 19163 5585 1 15 . 1 1 49 49 PRO CA C 49 64.468 64.468 64.924 -0.456 19163 5586 1 15 . 1 1 49 49 PRO CB C 49 32.173 32.173 32.264 -0.091 19163 5587 1 15 . 1 1 50 50 ASN N N 50 115.567 115.567 116.804 -1.237 19163 5588 1 15 . 1 1 50 50 ASN HA H 50 4.748 4.748 4.585 0.163 19163 5589 1 15 . 1 1 50 50 ASN C C 50 176.443 176.443 177.205 -0.762 19163 5590 1 15 . 1 1 50 50 ASN CA C 50 54.677 54.677 55.520 -0.843 19163 5591 1 15 . 1 1 50 50 ASN CB C 50 39.014 39.014 37.631 1.383 19163 5592 1 15 . 1 1 50 50 ASN H H 50 8.398 8.398 8.742 -0.344 19163 5593 1 15 . 1 1 51 51 GLU N N 51 119.270 119.270 119.088 0.182 19163 5594 1 15 . 1 1 51 51 GLU HA H 51 4.797 4.797 4.534 0.263 19163 5595 1 15 . 1 1 51 51 GLU C C 51 176.922 176.922 177.771 -0.849 19163 5596 1 15 . 1 1 51 51 GLU CA C 51 55.916 55.916 56.500 -0.584 19163 5597 1 15 . 1 1 51 51 GLU CB C 51 29.200 29.200 28.874 0.326 19163 5598 1 15 . 1 1 51 51 GLU H H 51 7.485 7.485 7.663 -0.178 19163 5599 1 15 . 1 1 52 52 GLY N N 52 107.541 107.541 108.339 -0.798 19163 5600 1 15 . 1 1 52 52 GLY C C 52 176.755 176.755 175.638 1.117 19163 5601 1 15 . 1 1 52 52 GLY CA C 52 47.914 47.914 46.978 0.936 19163 5602 1 15 . 1 1 52 52 GLY H H 52 8.092 8.092 7.808 0.284 19163 5603 1 15 . 1 1 53 53 GLU N N 53 121.603 121.603 120.766 0.837 19163 5604 1 15 . 1 1 53 53 GLU HA H 53 4.065 4.065 4.059 0.006 19163 5605 1 15 . 1 1 53 53 GLU C C 53 179.052 179.052 178.927 0.125 19163 5606 1 15 . 1 1 53 53 GLU CA C 53 59.280 59.280 59.270 0.010 19163 5607 1 15 . 1 1 53 53 GLU CB C 53 28.968 28.968 29.440 -0.472 19163 5608 1 15 . 1 1 53 53 GLU H H 53 8.496 8.496 8.020 0.476 19163 5609 1 15 . 1 1 54 54 LYS N N 54 120.837 120.837 119.549 1.288 19163 5610 1 15 . 1 1 54 54 LYS HA H 54 3.923 3.923 4.038 -0.115 19163 5611 1 15 . 1 1 54 54 LYS C C 54 179.058 179.058 178.858 0.200 19163 5612 1 15 . 1 1 54 54 LYS CA C 54 58.800 58.800 58.914 -0.114 19163 5613 1 15 . 1 1 54 54 LYS CB C 54 31.551 31.551 32.209 -0.657 19163 5614 1 15 . 1 1 54 54 LYS H H 54 7.857 7.857 7.417 0.440 19163 5615 1 15 . 1 1 55 55 PHE N N 55 118.608 118.608 121.347 -2.739 19163 5616 1 15 . 1 1 55 55 PHE HA H 55 4.021 4.021 4.095 -0.074 19163 5617 1 15 . 1 1 55 55 PHE C C 55 178.001 178.001 176.854 1.147 19163 5618 1 15 . 1 1 55 55 PHE CA C 55 61.911 61.911 61.404 0.507 19163 5619 1 15 . 1 1 55 55 PHE CB C 55 38.553 38.553 38.958 -0.405 19163 5620 1 15 . 1 1 55 55 PHE H H 55 8.382 8.382 7.917 0.465 19163 5621 1 15 . 1 1 56 56 LYS N N 56 120.898 120.898 118.915 1.983 19163 5622 1 15 . 1 1 56 56 LYS HA H 56 3.828 3.828 3.840 -0.012 19163 5623 1 15 . 1 1 56 56 LYS C C 56 178.817 178.817 178.967 -0.150 19163 5624 1 15 . 1 1 56 56 LYS CA C 56 59.877 59.877 60.080 -0.203 19163 5625 1 15 . 1 1 56 56 LYS CB C 56 32.133 32.133 32.004 0.129 19163 5626 1 15 . 1 1 56 56 LYS H H 56 8.111 8.111 7.984 0.127 19163 5627 1 15 . 1 1 57 57 GLN N N 57 118.600 118.600 118.622 -0.022 19163 5628 1 15 . 1 1 57 57 GLN HA H 57 4.009 4.009 4.028 -0.019 19163 5629 1 15 . 1 1 57 57 GLN C C 57 179.333 179.333 178.522 0.811 19163 5630 1 15 . 1 1 57 57 GLN CA C 57 59.109 59.109 58.801 0.308 19163 5631 1 15 . 1 1 57 57 GLN CB C 57 28.595 28.595 28.626 -0.031 19163 5632 1 15 . 1 1 57 57 GLN H H 57 7.613 7.613 7.458 0.155 19163 5633 1 15 . 1 1 58 58 ILE N N 58 118.709 118.709 120.602 -1.893 19163 5634 1 15 . 1 1 58 58 ILE HA H 58 3.559 3.559 3.582 -0.023 19163 5635 1 15 . 1 1 58 58 ILE C C 58 177.152 177.152 178.087 -0.935 19163 5636 1 15 . 1 1 58 58 ILE CA C 58 65.068 65.068 65.681 -0.613 19163 5637 1 15 . 1 1 58 58 ILE CB C 58 38.381 38.381 37.680 0.701 19163 5638 1 15 . 1 1 58 58 ILE H H 58 8.011 8.011 7.536 0.475 19163 5639 1 15 . 1 1 59 59 SER N N 59 116.112 116.112 115.116 0.996 19163 5640 1 15 . 1 1 59 59 SER HA H 59 3.948 3.948 3.992 -0.044 19163 5641 1 15 . 1 1 59 59 SER C C 59 175.949 175.949 176.979 -1.030 19163 5642 1 15 . 1 1 59 59 SER CA C 59 62.315 62.315 62.225 0.090 19163 5643 1 15 . 1 1 59 59 SER H H 59 8.030 8.030 8.256 -0.226 19163 5644 1 15 . 1 1 60 60 GLN N N 60 122.099 122.099 120.934 1.165 19163 5645 1 15 . 1 1 60 60 GLN HA H 60 3.801 3.801 4.378 -0.577 19163 5646 1 15 . 1 1 60 60 GLN C C 60 176.942 176.942 178.535 -1.593 19163 5647 1 15 . 1 1 60 60 GLN CA C 60 58.762 58.762 58.657 0.105 19163 5648 1 15 . 1 1 60 60 GLN CB C 60 28.498 28.498 28.701 -0.203 19163 5649 1 15 . 1 1 60 60 GLN H H 60 7.933 7.933 7.724 0.209 19163 5650 1 15 . 1 1 61 61 ALA N N 61 119.367 119.367 122.190 -2.823 19163 5651 1 15 . 1 1 61 61 ALA HA H 61 2.636 2.636 3.844 -1.208 19163 5652 1 15 . 1 1 61 61 ALA C C 61 178.507 178.507 179.273 -0.766 19163 5653 1 15 . 1 1 61 61 ALA CA C 61 54.126 54.126 54.822 -0.695 19163 5654 1 15 . 1 1 61 61 ALA CB C 61 18.462 18.462 18.276 0.186 19163 5655 1 15 . 1 1 61 61 ALA H H 61 7.354 7.354 7.858 -0.504 19163 5656 1 15 . 1 1 62 62 TYR N N 62 115.613 115.613 119.580 -3.967 19163 5657 1 15 . 1 1 62 62 TYR HA H 62 3.633 3.633 3.898 -0.265 19163 5658 1 15 . 1 1 62 62 TYR C C 62 177.421 177.421 177.682 -0.261 19163 5659 1 15 . 1 1 62 62 TYR CA C 62 61.676 61.676 60.618 1.058 19163 5660 1 15 . 1 1 62 62 TYR CB C 62 39.162 39.162 37.955 1.207 19163 5661 1 15 . 1 1 62 62 TYR H H 62 7.994 7.994 8.547 -0.553 19163 5662 1 15 . 1 1 63 63 GLU N N 63 121.396 121.396 118.654 2.742 19163 5663 1 15 . 1 1 63 63 GLU HA H 63 3.347 3.347 3.617 -0.270 19163 5664 1 15 . 1 1 63 63 GLU C C 63 177.687 177.687 178.462 -0.775 19163 5665 1 15 . 1 1 63 63 GLU CA C 63 59.562 59.562 58.912 0.650 19163 5666 1 15 . 1 1 63 63 GLU CB C 63 29.115 29.115 29.276 -0.161 19163 5667 1 15 . 1 1 63 63 GLU H H 63 8.151 8.151 7.823 0.328 19163 5668 1 15 . 1 1 64 64 VAL N N 64 115.850 115.850 117.215 -1.365 19163 5669 1 15 . 1 1 64 64 VAL HA H 64 3.377 3.377 3.643 -0.266 19163 5670 1 15 . 1 1 64 64 VAL C C 64 175.925 175.925 176.988 -1.063 19163 5671 1 15 . 1 1 64 64 VAL CA C 64 65.806 65.806 64.874 0.933 19163 5672 1 15 . 1 1 64 64 VAL CB C 64 31.786 31.786 32.078 -0.292 19163 5673 1 15 . 1 1 64 64 VAL H H 64 6.814 6.814 7.209 -0.395 19163 5674 1 15 . 1 1 65 65 LEU N N 65 111.438 111.438 119.144 -7.706 19163 5675 1 15 . 1 1 65 65 LEU HA H 65 3.569 3.569 3.890 -0.321 19163 5676 1 15 . 1 1 65 65 LEU C C 65 177.124 177.124 178.763 -1.639 19163 5677 1 15 . 1 1 65 65 LEU CA C 65 56.645 56.645 57.419 -0.773 19163 5678 1 15 . 1 1 65 65 LEU CB C 65 42.589 42.589 41.303 1.286 19163 5679 1 15 . 1 1 65 65 LEU H H 65 7.398 7.398 8.246 -0.848 19163 5680 1 15 . 1 1 66 66 SER N N 66 108.642 108.642 108.967 -0.325 19163 5681 1 15 . 1 1 66 66 SER HA H 66 4.028 4.028 4.338 -0.310 19163 5682 1 15 . 1 1 66 66 SER C C 66 173.286 173.286 174.204 -0.918 19163 5683 1 15 . 1 1 66 66 SER CA C 66 59.232 59.232 59.452 -0.220 19163 5684 1 15 . 1 1 66 66 SER CB C 66 63.066 63.066 63.093 -0.027 19163 5685 1 15 . 1 1 66 66 SER H H 66 7.700 7.700 7.704 -0.004 19163 5686 1 15 . 1 1 67 67 ASP N N 67 124.276 124.276 122.824 1.452 19163 5687 1 15 . 1 1 67 67 ASP HA H 67 4.668 4.668 4.669 -0.001 19163 5688 1 15 . 1 1 67 67 ASP C C 67 174.913 174.913 175.515 -0.602 19163 5689 1 15 . 1 1 67 67 ASP CA C 67 52.487 52.487 52.721 -0.234 19163 5690 1 15 . 1 1 67 67 ASP CB C 67 43.218 43.218 42.073 1.145 19163 5691 1 15 . 1 1 67 67 ASP H H 67 6.879 6.879 7.207 -0.328 19163 5692 1 15 . 1 1 68 68 ALA N N 68 127.326 127.326 130.368 -3.042 19163 5693 1 15 . 1 1 68 68 ALA HA H 68 3.853 3.853 3.915 -0.062 19163 5694 1 15 . 1 1 68 68 ALA C C 68 180.336 180.336 178.761 1.575 19163 5695 1 15 . 1 1 68 68 ALA CA C 68 55.912 55.912 55.332 0.580 19163 5696 1 15 . 1 1 68 68 ALA CB C 68 18.645 18.645 18.809 -0.164 19163 5697 1 15 . 1 1 68 68 ALA H H 68 8.693 8.693 8.812 -0.119 19163 5698 1 15 . 1 1 69 69 LYS N N 69 116.929 116.929 118.562 -1.633 19163 5699 1 15 . 1 1 69 69 LYS HA H 69 4.162 4.162 4.026 0.136 19163 5700 1 15 . 1 1 69 69 LYS C C 69 179.515 179.515 178.741 0.774 19163 5701 1 15 . 1 1 69 69 LYS CA C 69 58.562 58.562 59.230 -0.668 19163 5702 1 15 . 1 1 69 69 LYS CB C 69 31.840 31.840 32.318 -0.478 19163 5703 1 15 . 1 1 69 69 LYS H H 69 7.950 7.950 7.818 0.132 19163 5704 1 15 . 1 1 70 70 LYS N N 70 121.286 121.286 119.132 2.154 19163 5705 1 15 . 1 1 70 70 LYS HA H 70 3.960 3.960 3.980 -0.020 19163 5706 1 15 . 1 1 70 70 LYS C C 70 179.938 179.938 179.021 0.917 19163 5707 1 15 . 1 1 70 70 LYS CA C 70 60.066 60.066 59.621 0.445 19163 5708 1 15 . 1 1 70 70 LYS CB C 70 32.695 32.695 32.344 0.351 19163 5709 1 15 . 1 1 70 70 LYS H H 70 8.184 8.184 8.640 -0.456 19163 5710 1 15 . 1 1 71 71 ARG N N 71 122.794 122.794 119.816 2.978 19163 5711 1 15 . 1 1 71 71 ARG HA H 71 3.668 3.668 3.877 -0.209 19163 5712 1 15 . 1 1 71 71 ARG C C 71 177.356 177.356 178.023 -0.667 19163 5713 1 15 . 1 1 71 71 ARG CA C 71 60.127 60.127 60.230 -0.103 19163 5714 1 15 . 1 1 71 71 ARG CB C 71 29.668 29.668 30.208 -0.540 19163 5715 1 15 . 1 1 71 71 ARG H H 71 9.290 9.290 8.761 0.529 19163 5716 1 15 . 1 1 72 72 GLU N N 72 118.390 118.390 119.600 -1.210 19163 5717 1 15 . 1 1 72 72 GLU HA H 72 4.096 4.096 4.142 -0.046 19163 5718 1 15 . 1 1 72 72 GLU C C 72 179.073 179.073 179.109 -0.036 19163 5719 1 15 . 1 1 72 72 GLU CA C 72 59.456 59.456 59.356 0.100 19163 5720 1 15 . 1 1 72 72 GLU CB C 72 29.615 29.615 29.526 0.089 19163 5721 1 15 . 1 1 72 72 GLU H H 72 7.607 7.607 7.662 -0.055 19163 5722 1 15 . 1 1 73 73 LEU N N 73 117.921 117.921 119.963 -2.042 19163 5723 1 15 . 1 1 73 73 LEU HA H 73 4.032 4.032 3.975 0.057 19163 5724 1 15 . 1 1 73 73 LEU C C 73 179.696 179.696 179.370 0.326 19163 5725 1 15 . 1 1 73 73 LEU CA C 73 57.597 57.597 58.026 -0.429 19163 5726 1 15 . 1 1 73 73 LEU CB C 73 41.815 41.815 41.716 0.099 19163 5727 1 15 . 1 1 73 73 LEU H H 73 7.398 7.398 7.821 -0.423 19163 5728 1 15 . 1 1 74 74 TYR N N 74 122.662 122.662 119.861 2.801 19163 5729 1 15 . 1 1 74 74 TYR HA H 74 4.092 4.092 3.960 0.132 19163 5730 1 15 . 1 1 74 74 TYR C C 74 178.166 178.166 178.142 0.024 19163 5731 1 15 . 1 1 74 74 TYR CA C 74 61.458 61.458 62.075 -0.618 19163 5732 1 15 . 1 1 74 74 TYR CB C 74 38.778 38.778 38.438 0.340 19163 5733 1 15 . 1 1 74 74 TYR H H 74 8.316 8.316 8.390 -0.074 19163 5734 1 15 . 1 1 75 75 ASP N N 75 118.842 118.842 118.211 0.631 19163 5735 1 15 . 1 1 75 75 ASP HA H 75 4.423 4.423 4.475 -0.052 19163 5736 1 15 . 1 1 75 75 ASP C C 75 177.726 177.726 178.088 -0.362 19163 5737 1 15 . 1 1 75 75 ASP CA C 75 56.177 56.177 57.027 -0.850 19163 5738 1 15 . 1 1 75 75 ASP CB C 75 40.800 40.800 40.691 0.109 19163 5739 1 15 . 1 1 75 75 ASP H H 75 8.770 8.770 8.362 0.408 19163 5740 1 15 . 1 1 76 76 LYS N N 76 118.955 118.955 119.322 -0.367 19163 5741 1 15 . 1 1 76 76 LYS HA H 76 4.130 4.130 4.135 -0.005 19163 5742 1 15 . 1 1 76 76 LYS C C 76 177.006 177.006 177.157 -0.151 19163 5743 1 15 . 1 1 76 76 LYS CA C 76 57.537 57.537 57.347 0.190 19163 5744 1 15 . 1 1 76 76 LYS CB C 76 33.136 33.136 33.691 -0.554 19163 5745 1 15 . 1 1 76 76 LYS H H 76 7.610 7.610 7.889 -0.279 19163 5746 1 16 . 1 1 11 11 MET HA H 11 4.346 4.346 4.567 -0.221 19163 5747 1 16 . 1 1 11 11 MET C C 11 175.801 175.801 175.423 0.378 19163 5748 1 16 . 1 1 11 11 MET CA C 11 55.614 55.614 53.339 2.275 19163 5749 1 16 . 1 1 11 11 MET CB C 11 32.925 32.925 33.062 -0.137 19163 5750 1 16 . 1 1 12 12 VAL N N 12 121.226 121.226 121.951 -0.725 19163 5751 1 16 . 1 1 12 12 VAL HA H 12 4.026 4.026 4.025 0.001 19163 5752 1 16 . 1 1 12 12 VAL C C 12 175.701 175.701 175.826 -0.125 19163 5753 1 16 . 1 1 12 12 VAL CA C 12 62.188 62.188 62.428 -0.240 19163 5754 1 16 . 1 1 12 12 VAL CB C 12 32.882 32.882 31.761 1.121 19163 5755 1 16 . 1 1 12 12 VAL H H 12 7.988 7.988 8.278 -0.290 19163 5756 1 16 . 1 1 13 13 LYS N N 13 125.255 125.255 128.785 -3.530 19163 5757 1 16 . 1 1 13 13 LYS HA H 13 4.211 4.211 4.402 -0.191 19163 5758 1 16 . 1 1 13 13 LYS C C 13 176.121 176.121 175.152 0.969 19163 5759 1 16 . 1 1 13 13 LYS CA C 13 56.355 56.355 55.792 0.563 19163 5760 1 16 . 1 1 13 13 LYS CB C 13 33.019 33.019 33.163 -0.143 19163 5761 1 16 . 1 1 13 13 LYS H H 13 8.281 8.281 8.676 -0.395 19163 5762 1 16 . 1 1 14 14 GLU N N 14 123.004 123.004 122.565 0.439 19163 5763 1 16 . 1 1 14 14 GLU HA H 14 4.305 4.305 4.098 0.207 19163 5764 1 16 . 1 1 14 14 GLU C C 14 176.107 176.107 175.082 1.025 19163 5765 1 16 . 1 1 14 14 GLU CA C 14 56.343 56.343 56.668 -0.325 19163 5766 1 16 . 1 1 14 14 GLU CB C 14 30.534 30.534 29.473 1.061 19163 5767 1 16 . 1 1 14 14 GLU H H 14 8.424 8.424 8.781 -0.357 19163 5768 1 16 . 1 1 15 15 THR N N 15 115.895 115.895 117.304 -1.409 19163 5769 1 16 . 1 1 15 15 THR HA H 15 4.538 4.538 4.484 0.054 19163 5770 1 16 . 1 1 15 15 THR C C 15 175.233 175.233 174.144 1.089 19163 5771 1 16 . 1 1 15 15 THR CA C 15 61.981 61.981 62.786 -0.805 19163 5772 1 16 . 1 1 15 15 THR CB C 15 69.865 69.865 69.054 0.811 19163 5773 1 16 . 1 1 15 15 THR H H 15 8.335 8.335 8.348 -0.013 19163 5774 1 16 . 1 1 16 16 THR N N 16 116.992 116.992 120.108 -3.116 19163 5775 1 16 . 1 1 16 16 THR HA H 16 4.366 4.366 4.543 -0.177 19163 5776 1 16 . 1 1 16 16 THR C C 16 176.090 176.090 175.477 0.613 19163 5777 1 16 . 1 1 16 16 THR CA C 16 62.172 62.172 59.929 2.243 19163 5778 1 16 . 1 1 16 16 THR CB C 16 71.997 71.997 70.772 1.225 19163 5779 1 16 . 1 1 16 16 THR H H 16 8.798 8.798 8.242 0.556 19163 5780 1 16 . 1 1 17 17 TYR N N 17 117.617 117.617 119.469 -1.852 19163 5781 1 16 . 1 1 17 17 TYR HA H 17 4.329 4.329 4.243 0.086 19163 5782 1 16 . 1 1 17 17 TYR C C 17 177.105 177.105 178.084 -0.979 19163 5783 1 16 . 1 1 17 17 TYR CA C 17 57.577 57.577 62.358 -4.780 19163 5784 1 16 . 1 1 17 17 TYR CB C 17 37.113 37.113 38.046 -0.933 19163 5785 1 16 . 1 1 17 17 TYR H H 17 8.292 8.292 9.222 -0.930 19163 5786 1 16 . 1 1 18 18 TYR N N 18 115.048 115.048 117.463 -2.415 19163 5787 1 16 . 1 1 18 18 TYR HA H 18 3.775 3.775 4.220 -0.445 19163 5788 1 16 . 1 1 18 18 TYR C C 18 177.771 177.771 177.806 -0.035 19163 5789 1 16 . 1 1 18 18 TYR CA C 18 61.430 61.430 62.989 -1.559 19163 5790 1 16 . 1 1 18 18 TYR CB C 18 36.495 36.495 37.808 -1.313 19163 5791 1 16 . 1 1 18 18 TYR H H 18 7.047 7.047 8.194 -1.147 19163 5792 1 16 . 1 1 19 19 ASP N N 19 119.520 119.520 120.365 -0.845 19163 5793 1 16 . 1 1 19 19 ASP HA H 19 4.406 4.406 4.524 -0.118 19163 5794 1 16 . 1 1 19 19 ASP C C 19 180.128 180.128 178.870 1.258 19163 5795 1 16 . 1 1 19 19 ASP CA C 19 57.475 57.475 57.460 0.015 19163 5796 1 16 . 1 1 19 19 ASP CB C 19 40.659 40.659 40.701 -0.042 19163 5797 1 16 . 1 1 19 19 ASP H H 19 7.685 7.685 8.338 -0.652 19163 5798 1 16 . 1 1 20 20 VAL N N 20 119.772 119.772 119.452 0.320 19163 5799 1 16 . 1 1 20 20 VAL HA H 20 3.608 3.608 3.654 -0.046 19163 5800 1 16 . 1 1 20 20 VAL C C 20 177.026 177.026 177.222 -0.196 19163 5801 1 16 . 1 1 20 20 VAL CA C 20 65.840 65.840 65.278 0.562 19163 5802 1 16 . 1 1 20 20 VAL CB C 20 31.530 31.530 31.903 -0.373 19163 5803 1 16 . 1 1 20 20 VAL H H 20 8.004 8.004 8.477 -0.473 19163 5804 1 16 . 1 1 21 21 LEU N N 21 115.252 115.252 115.946 -0.694 19163 5805 1 16 . 1 1 21 21 LEU HA H 21 4.281 4.281 4.313 -0.032 19163 5806 1 16 . 1 1 21 21 LEU C C 21 175.757 175.757 177.393 -1.636 19163 5807 1 16 . 1 1 21 21 LEU CA C 21 54.554 54.554 54.426 0.128 19163 5808 1 16 . 1 1 21 21 LEU CB C 21 42.869 42.869 41.451 1.418 19163 5809 1 16 . 1 1 21 21 LEU H H 21 6.847 6.847 7.438 -0.591 19163 5810 1 16 . 1 1 22 22 GLY N N 22 108.227 108.227 107.301 0.926 19163 5811 1 16 . 1 1 22 22 GLY C C 22 175.361 175.361 174.305 1.056 19163 5812 1 16 . 1 1 22 22 GLY CA C 22 46.574 46.574 45.607 0.967 19163 5813 1 16 . 1 1 22 22 GLY H H 22 7.874 7.874 7.547 0.327 19163 5814 1 16 . 1 1 23 23 VAL N N 23 110.675 110.675 118.943 -8.268 19163 5815 1 16 . 1 1 23 23 VAL HA H 23 4.767 4.767 4.461 0.306 19163 5816 1 16 . 1 1 23 23 VAL C C 23 174.674 174.674 174.615 0.059 19163 5817 1 16 . 1 1 23 23 VAL CA C 23 58.349 58.349 59.710 -1.361 19163 5818 1 16 . 1 1 23 23 VAL CB C 23 34.938 34.938 34.819 0.119 19163 5819 1 16 . 1 1 23 23 VAL H H 23 7.815 7.815 7.992 -0.177 19163 5820 1 16 . 1 1 24 24 LYS N N 24 119.948 119.948 123.040 -3.092 19163 5821 1 16 . 1 1 24 24 LYS HA H 24 4.488 4.488 4.675 -0.187 19163 5822 1 16 . 1 1 24 24 LYS C C 24 175.442 175.442 175.775 -0.333 19163 5823 1 16 . 1 1 24 24 LYS CA C 24 54.001 54.001 54.568 -0.567 19163 5824 1 16 . 1 1 24 24 LYS CB C 24 32.197 32.197 32.218 -0.021 19163 5825 1 16 . 1 1 24 24 LYS H H 24 8.329 8.329 8.414 -0.085 19163 5826 1 16 . 1 1 25 25 PRO HA H 25 2.421 2.421 4.291 -1.870 19163 5827 1 16 . 1 1 25 25 PRO C C 25 175.635 175.635 176.791 -1.156 19163 5828 1 16 . 1 1 25 25 PRO CA C 25 63.362 63.362 64.785 -1.423 19163 5829 1 16 . 1 1 25 25 PRO CB C 25 31.839 31.839 31.867 -0.028 19163 5830 1 16 . 1 1 26 26 ASN N N 26 111.739 111.739 114.468 -2.729 19163 5831 1 16 . 1 1 26 26 ASN HA H 26 4.518 4.518 4.801 -0.283 19163 5832 1 16 . 1 1 26 26 ASN C C 26 175.820 175.820 175.051 0.769 19163 5833 1 16 . 1 1 26 26 ASN CA C 26 51.525 51.525 51.857 -0.332 19163 5834 1 16 . 1 1 26 26 ASN CB C 26 36.829 36.829 38.257 -1.428 19163 5835 1 16 . 1 1 26 26 ASN H H 26 7.138 7.138 8.233 -1.095 19163 5836 1 16 . 1 1 27 27 ALA N N 27 122.829 122.829 124.575 -1.746 19163 5837 1 16 . 1 1 27 27 ALA HA H 27 4.325 4.325 4.782 -0.457 19163 5838 1 16 . 1 1 27 27 ALA C C 27 178.726 178.726 177.524 1.202 19163 5839 1 16 . 1 1 27 27 ALA CA C 27 52.961 52.961 52.187 0.774 19163 5840 1 16 . 1 1 27 27 ALA CB C 27 19.159 19.159 20.315 -1.156 19163 5841 1 16 . 1 1 27 27 ALA H H 27 7.637 7.637 7.585 0.052 19163 5842 1 16 . 1 1 28 28 THR N N 28 113.468 113.468 113.888 -0.420 19163 5843 1 16 . 1 1 28 28 THR HA H 28 4.493 4.493 4.446 0.047 19163 5844 1 16 . 1 1 28 28 THR C C 28 175.641 175.641 175.482 0.159 19163 5845 1 16 . 1 1 28 28 THR CA C 28 60.592 60.592 60.778 -0.186 19163 5846 1 16 . 1 1 28 28 THR CB C 28 71.304 71.304 70.968 0.336 19163 5847 1 16 . 1 1 28 28 THR H H 28 8.829 8.829 8.167 0.662 19163 5848 1 16 . 1 1 29 29 GLN N N 29 119.445 119.445 122.058 -2.613 19163 5849 1 16 . 1 1 29 29 GLN HA H 29 4.035 4.035 3.939 0.096 19163 5850 1 16 . 1 1 29 29 GLN C C 29 179.117 179.117 178.438 0.679 19163 5851 1 16 . 1 1 29 29 GLN CA C 29 59.435 59.435 59.958 -0.523 19163 5852 1 16 . 1 1 29 29 GLN CB C 29 27.851 27.851 28.574 -0.723 19163 5853 1 16 . 1 1 29 29 GLN H H 29 9.015 9.015 8.800 0.215 19163 5854 1 16 . 1 1 30 30 GLU N N 30 119.343 119.343 119.220 0.123 19163 5855 1 16 . 1 1 30 30 GLU HA H 30 4.059 4.059 4.025 0.034 19163 5856 1 16 . 1 1 30 30 GLU C C 30 179.097 179.097 178.596 0.501 19163 5857 1 16 . 1 1 30 30 GLU CA C 30 59.847 59.847 59.610 0.237 19163 5858 1 16 . 1 1 30 30 GLU CB C 30 29.356 29.356 29.369 -0.013 19163 5859 1 16 . 1 1 30 30 GLU H H 30 8.549 8.549 8.681 -0.132 19163 5860 1 16 . 1 1 31 31 GLU N N 31 120.562 120.562 120.425 0.137 19163 5861 1 16 . 1 1 31 31 GLU HA H 31 3.906 3.906 4.091 -0.185 19163 5862 1 16 . 1 1 31 31 GLU C C 31 180.405 180.405 179.161 1.244 19163 5863 1 16 . 1 1 31 31 GLU CA C 31 59.592 59.592 59.286 0.306 19163 5864 1 16 . 1 1 31 31 GLU CB C 31 29.989 29.989 29.582 0.407 19163 5865 1 16 . 1 1 31 31 GLU H H 31 7.768 7.768 8.045 -0.277 19163 5866 1 16 . 1 1 32 32 LEU N N 32 120.518 120.518 120.406 0.112 19163 5867 1 16 . 1 1 32 32 LEU HA H 32 3.963 3.963 3.999 -0.036 19163 5868 1 16 . 1 1 32 32 LEU C C 32 177.873 177.873 178.993 -1.120 19163 5869 1 16 . 1 1 32 32 LEU CA C 32 58.593 58.593 57.733 0.860 19163 5870 1 16 . 1 1 32 32 LEU CB C 32 42.556 42.556 41.131 1.425 19163 5871 1 16 . 1 1 32 32 LEU H H 32 8.475 8.475 8.681 -0.206 19163 5872 1 16 . 1 1 33 33 LYS N N 33 119.091 119.091 119.478 -0.387 19163 5873 1 16 . 1 1 33 33 LYS HA H 33 4.000 4.000 4.186 -0.186 19163 5874 1 16 . 1 1 33 33 LYS C C 33 178.701 178.701 178.956 -0.255 19163 5875 1 16 . 1 1 33 33 LYS CA C 33 60.274 60.274 59.849 0.424 19163 5876 1 16 . 1 1 33 33 LYS CB C 33 32.656 32.656 32.391 0.265 19163 5877 1 16 . 1 1 33 33 LYS H H 33 8.077 8.077 7.804 0.273 19163 5878 1 16 . 1 1 34 34 LYS N N 34 118.527 118.527 119.454 -0.927 19163 5879 1 16 . 1 1 34 34 LYS HA H 34 3.890 3.890 3.998 -0.108 19163 5880 1 16 . 1 1 34 34 LYS C C 34 179.172 179.172 178.896 0.276 19163 5881 1 16 . 1 1 34 34 LYS CA C 34 59.927 59.927 59.444 0.483 19163 5882 1 16 . 1 1 34 34 LYS CB C 34 32.869 32.869 32.323 0.546 19163 5883 1 16 . 1 1 34 34 LYS H H 34 7.986 7.986 7.921 0.065 19163 5884 1 16 . 1 1 35 35 ALA N N 35 122.190 122.190 122.555 -0.365 19163 5885 1 16 . 1 1 35 35 ALA HA H 35 4.116 4.116 4.025 0.091 19163 5886 1 16 . 1 1 35 35 ALA C C 35 179.982 179.982 178.972 1.010 19163 5887 1 16 . 1 1 35 35 ALA CA C 35 55.157 55.157 55.213 -0.056 19163 5888 1 16 . 1 1 35 35 ALA CB C 35 18.773 18.773 18.332 0.441 19163 5889 1 16 . 1 1 35 35 ALA H H 35 7.917 7.917 8.201 -0.284 19163 5890 1 16 . 1 1 36 36 TYR N N 36 117.701 117.701 120.441 -2.740 19163 5891 1 16 . 1 1 36 36 TYR HA H 36 3.818 3.818 3.996 -0.178 19163 5892 1 16 . 1 1 36 36 TYR C C 36 176.344 176.344 177.494 -1.150 19163 5893 1 16 . 1 1 36 36 TYR CA C 36 61.468 61.468 61.296 0.172 19163 5894 1 16 . 1 1 36 36 TYR CB C 36 38.890 38.890 38.240 0.649 19163 5895 1 16 . 1 1 36 36 TYR H H 36 8.402 8.402 7.952 0.450 19163 5896 1 16 . 1 1 37 37 ARG N N 37 117.423 117.423 119.074 -1.651 19163 5897 1 16 . 1 1 37 37 ARG HA H 37 3.481 3.481 3.688 -0.207 19163 5898 1 16 . 1 1 37 37 ARG C C 37 178.825 178.825 178.255 0.570 19163 5899 1 16 . 1 1 37 37 ARG CA C 37 59.397 59.397 59.747 -0.350 19163 5900 1 16 . 1 1 37 37 ARG CB C 37 29.710 29.710 30.049 -0.339 19163 5901 1 16 . 1 1 37 37 ARG H H 37 8.264 8.264 8.459 -0.195 19163 5902 1 16 . 1 1 38 38 LYS N N 38 117.247 117.247 119.822 -2.575 19163 5903 1 16 . 1 1 38 38 LYS HA H 38 3.905 3.905 4.001 -0.096 19163 5904 1 16 . 1 1 38 38 LYS C C 38 179.444 179.444 179.140 0.304 19163 5905 1 16 . 1 1 38 38 LYS CA C 38 59.450 59.450 59.419 0.031 19163 5906 1 16 . 1 1 38 38 LYS CB C 38 32.609 32.609 32.316 0.294 19163 5907 1 16 . 1 1 38 38 LYS H H 38 7.444 7.444 7.759 -0.315 19163 5908 1 16 . 1 1 39 39 LEU N N 39 119.901 119.901 119.376 0.525 19163 5909 1 16 . 1 1 39 39 LEU HA H 39 4.020 4.020 4.087 -0.067 19163 5910 1 16 . 1 1 39 39 LEU C C 39 178.801 178.801 178.807 -0.006 19163 5911 1 16 . 1 1 39 39 LEU CA C 39 57.409 57.409 57.642 -0.234 19163 5912 1 16 . 1 1 39 39 LEU CB C 39 42.388 42.388 41.626 0.762 19163 5913 1 16 . 1 1 39 39 LEU H H 39 7.707 7.707 8.087 -0.380 19163 5914 1 16 . 1 1 40 40 ALA N N 40 122.772 122.772 122.031 0.741 19163 5915 1 16 . 1 1 40 40 ALA HA H 40 3.849 3.849 4.128 -0.279 19163 5916 1 16 . 1 1 40 40 ALA C C 40 179.446 179.446 179.293 0.153 19163 5917 1 16 . 1 1 40 40 ALA CA C 40 55.109 55.109 55.103 0.006 19163 5918 1 16 . 1 1 40 40 ALA CB C 40 17.116 17.116 18.198 -1.082 19163 5919 1 16 . 1 1 40 40 ALA H H 40 8.931 8.931 8.184 0.747 19163 5920 1 16 . 1 1 41 41 LEU N N 41 115.299 115.299 117.151 -1.852 19163 5921 1 16 . 1 1 41 41 LEU HA H 41 3.977 3.977 3.674 0.303 19163 5922 1 16 . 1 1 41 41 LEU C C 41 178.216 178.216 179.497 -1.281 19163 5923 1 16 . 1 1 41 41 LEU CA C 41 57.088 57.088 57.234 -0.146 19163 5924 1 16 . 1 1 41 41 LEU CB C 41 42.162 42.162 41.533 0.629 19163 5925 1 16 . 1 1 41 41 LEU H H 41 7.133 7.133 7.463 -0.330 19163 5926 1 16 . 1 1 42 42 LYS N N 42 116.812 116.812 118.704 -1.892 19163 5927 1 16 . 1 1 42 42 LYS HA H 42 3.925 3.925 3.937 -0.012 19163 5928 1 16 . 1 1 42 42 LYS C C 42 177.560 177.560 177.917 -0.357 19163 5929 1 16 . 1 1 42 42 LYS CA C 42 57.885 57.885 58.096 -0.211 19163 5930 1 16 . 1 1 42 42 LYS CB C 42 33.427 33.427 32.693 0.734 19163 5931 1 16 . 1 1 42 42 LYS H H 42 7.038 7.038 7.461 -0.423 19163 5932 1 16 . 1 1 43 43 TYR N N 43 114.022 114.022 114.673 -0.651 19163 5933 1 16 . 1 1 43 43 TYR HA H 43 4.665 4.665 4.574 0.091 19163 5934 1 16 . 1 1 43 43 TYR C C 43 173.741 173.741 174.173 -0.432 19163 5935 1 16 . 1 1 43 43 TYR CA C 43 56.928 56.928 56.499 0.429 19163 5936 1 16 . 1 1 43 43 TYR CB C 43 39.579 39.579 37.671 1.908 19163 5937 1 16 . 1 1 43 43 TYR H H 43 7.683 7.683 7.994 -0.311 19163 5938 1 16 . 1 1 44 44 HIS N N 44 120.947 120.947 122.909 -1.962 19163 5939 1 16 . 1 1 44 44 HIS HA H 44 3.697 3.697 4.269 -0.572 19163 5940 1 16 . 1 1 44 44 HIS C C 44 174.925 174.925 174.866 0.059 19163 5941 1 16 . 1 1 44 44 HIS CA C 44 56.229 56.229 55.253 0.976 19163 5942 1 16 . 1 1 44 44 HIS CB C 44 30.852 30.852 30.135 0.717 19163 5943 1 16 . 1 1 44 44 HIS H H 44 7.814 7.814 7.673 0.141 19163 5944 1 16 . 1 1 45 45 PRO HA H 45 4.131 4.131 4.368 -0.237 19163 5945 1 16 . 1 1 45 45 PRO C C 45 177.269 177.269 177.032 0.237 19163 5946 1 16 . 1 1 45 45 PRO CA C 45 64.723 64.723 64.655 0.068 19163 5947 1 16 . 1 1 45 45 PRO CB C 45 32.070 32.070 31.830 0.240 19163 5948 1 16 . 1 1 46 46 ASP N N 46 119.127 119.127 114.602 4.525 19163 5949 1 16 . 1 1 46 46 ASP HA H 46 4.375 4.375 4.373 0.002 19163 5950 1 16 . 1 1 46 46 ASP C C 46 177.284 177.284 176.678 0.606 19163 5951 1 16 . 1 1 46 46 ASP CA C 46 56.020 56.020 55.279 0.741 19163 5952 1 16 . 1 1 46 46 ASP CB C 46 40.221 40.221 40.001 0.220 19163 5953 1 16 . 1 1 46 46 ASP H H 46 10.040 10.040 8.221 1.819 19163 5954 1 16 . 1 1 47 47 LYS N N 47 117.416 117.416 119.620 -2.204 19163 5955 1 16 . 1 1 47 47 LYS HA H 47 4.315 4.315 4.269 0.046 19163 5956 1 16 . 1 1 47 47 LYS C C 47 176.355 176.355 176.580 -0.225 19163 5957 1 16 . 1 1 47 47 LYS CA C 47 55.880 55.880 57.359 -1.479 19163 5958 1 16 . 1 1 47 47 LYS CB C 47 33.778 33.778 34.630 -0.852 19163 5959 1 16 . 1 1 47 47 LYS H H 47 7.826 7.826 7.479 0.347 19163 5960 1 16 . 1 1 48 48 ASN N N 48 116.573 116.573 117.958 -1.385 19163 5961 1 16 . 1 1 48 48 ASN HA H 48 5.021 5.021 5.235 -0.214 19163 5962 1 16 . 1 1 48 48 ASN C C 48 172.992 172.992 173.950 -0.958 19163 5963 1 16 . 1 1 48 48 ASN CA C 48 50.467 50.467 50.640 -0.173 19163 5964 1 16 . 1 1 48 48 ASN CB C 48 39.284 39.284 39.839 -0.555 19163 5965 1 16 . 1 1 48 48 ASN H H 48 7.956 7.956 8.407 -0.451 19163 5966 1 16 . 1 1 49 49 PRO HA H 49 4.448 4.448 4.466 -0.018 19163 5967 1 16 . 1 1 49 49 PRO C C 49 178.030 178.030 178.027 0.003 19163 5968 1 16 . 1 1 49 49 PRO CA C 49 64.468 64.468 64.724 -0.256 19163 5969 1 16 . 1 1 49 49 PRO CB C 49 32.173 32.173 32.103 0.070 19163 5970 1 16 . 1 1 50 50 ASN N N 50 115.567 115.567 116.330 -0.763 19163 5971 1 16 . 1 1 50 50 ASN HA H 50 4.748 4.748 4.518 0.230 19163 5972 1 16 . 1 1 50 50 ASN C C 50 176.443 176.443 176.609 -0.166 19163 5973 1 16 . 1 1 50 50 ASN CA C 50 54.677 54.677 56.154 -1.477 19163 5974 1 16 . 1 1 50 50 ASN CB C 50 39.014 39.014 37.853 1.161 19163 5975 1 16 . 1 1 50 50 ASN H H 50 8.398 8.398 8.562 -0.164 19163 5976 1 16 . 1 1 51 51 GLU N N 51 119.270 119.270 117.735 1.535 19163 5977 1 16 . 1 1 51 51 GLU HA H 51 4.797 4.797 4.499 0.298 19163 5978 1 16 . 1 1 51 51 GLU C C 51 176.922 176.922 177.293 -0.371 19163 5979 1 16 . 1 1 51 51 GLU CA C 51 55.916 55.916 55.860 0.056 19163 5980 1 16 . 1 1 51 51 GLU CB C 51 29.200 29.200 29.033 0.167 19163 5981 1 16 . 1 1 51 51 GLU H H 51 7.485 7.485 7.715 -0.230 19163 5982 1 16 . 1 1 52 52 GLY N N 52 107.541 107.541 108.662 -1.121 19163 5983 1 16 . 1 1 52 52 GLY C C 52 176.755 176.755 175.938 0.817 19163 5984 1 16 . 1 1 52 52 GLY CA C 52 47.914 47.914 47.114 0.800 19163 5985 1 16 . 1 1 52 52 GLY H H 52 8.092 8.092 7.804 0.287 19163 5986 1 16 . 1 1 53 53 GLU N N 53 121.603 121.603 120.699 0.904 19163 5987 1 16 . 1 1 53 53 GLU HA H 53 4.065 4.065 4.063 0.002 19163 5988 1 16 . 1 1 53 53 GLU C C 53 179.052 179.052 179.069 -0.017 19163 5989 1 16 . 1 1 53 53 GLU CA C 53 59.280 59.280 59.839 -0.559 19163 5990 1 16 . 1 1 53 53 GLU CB C 53 28.968 28.968 29.092 -0.124 19163 5991 1 16 . 1 1 53 53 GLU H H 53 8.496 8.496 8.243 0.253 19163 5992 1 16 . 1 1 54 54 LYS N N 54 120.837 120.837 119.764 1.073 19163 5993 1 16 . 1 1 54 54 LYS HA H 54 3.923 3.923 4.009 -0.086 19163 5994 1 16 . 1 1 54 54 LYS C C 54 179.058 179.058 178.969 0.089 19163 5995 1 16 . 1 1 54 54 LYS CA C 54 58.800 58.800 58.938 -0.138 19163 5996 1 16 . 1 1 54 54 LYS CB C 54 31.551 31.551 32.141 -0.590 19163 5997 1 16 . 1 1 54 54 LYS H H 54 7.857 7.857 7.490 0.367 19163 5998 1 16 . 1 1 55 55 PHE N N 55 118.608 118.608 120.595 -1.987 19163 5999 1 16 . 1 1 55 55 PHE HA H 55 4.021 4.021 4.120 -0.099 19163 6000 1 16 . 1 1 55 55 PHE C C 55 178.001 178.001 177.202 0.799 19163 6001 1 16 . 1 1 55 55 PHE CA C 55 61.911 61.911 60.782 1.129 19163 6002 1 16 . 1 1 55 55 PHE CB C 55 38.553 38.553 39.024 -0.471 19163 6003 1 16 . 1 1 55 55 PHE H H 55 8.382 8.382 8.079 0.303 19163 6004 1 16 . 1 1 56 56 LYS N N 56 120.898 120.898 119.829 1.069 19163 6005 1 16 . 1 1 56 56 LYS HA H 56 3.828 3.828 3.876 -0.048 19163 6006 1 16 . 1 1 56 56 LYS C C 56 178.817 178.817 178.532 0.285 19163 6007 1 16 . 1 1 56 56 LYS CA C 56 59.877 59.877 60.022 -0.145 19163 6008 1 16 . 1 1 56 56 LYS CB C 56 32.133 32.133 32.111 0.022 19163 6009 1 16 . 1 1 56 56 LYS H H 56 8.111 8.111 8.046 0.065 19163 6010 1 16 . 1 1 57 57 GLN N N 57 118.600 118.600 118.346 0.254 19163 6011 1 16 . 1 1 57 57 GLN HA H 57 4.009 4.009 3.960 0.049 19163 6012 1 16 . 1 1 57 57 GLN C C 57 179.333 179.333 178.515 0.818 19163 6013 1 16 . 1 1 57 57 GLN CA C 57 59.109 59.109 58.662 0.447 19163 6014 1 16 . 1 1 57 57 GLN CB C 57 28.595 28.595 28.621 -0.026 19163 6015 1 16 . 1 1 57 57 GLN H H 57 7.613 7.613 7.505 0.108 19163 6016 1 16 . 1 1 58 58 ILE N N 58 118.709 118.709 120.360 -1.651 19163 6017 1 16 . 1 1 58 58 ILE HA H 58 3.559 3.559 3.553 0.006 19163 6018 1 16 . 1 1 58 58 ILE C C 58 177.152 177.152 178.069 -0.917 19163 6019 1 16 . 1 1 58 58 ILE CA C 58 65.068 65.068 65.261 -0.193 19163 6020 1 16 . 1 1 58 58 ILE CB C 58 38.381 38.381 37.593 0.788 19163 6021 1 16 . 1 1 58 58 ILE H H 58 8.011 8.011 7.433 0.578 19163 6022 1 16 . 1 1 59 59 SER N N 59 116.112 116.112 115.730 0.382 19163 6023 1 16 . 1 1 59 59 SER HA H 59 3.948 3.948 3.989 -0.041 19163 6024 1 16 . 1 1 59 59 SER C C 59 175.949 175.949 176.865 -0.916 19163 6025 1 16 . 1 1 59 59 SER CA C 59 62.315 62.315 62.228 0.087 19163 6026 1 16 . 1 1 59 59 SER H H 59 8.030 8.030 8.245 -0.215 19163 6027 1 16 . 1 1 60 60 GLN N N 60 122.099 122.099 120.955 1.144 19163 6028 1 16 . 1 1 60 60 GLN HA H 60 3.801 3.801 4.017 -0.216 19163 6029 1 16 . 1 1 60 60 GLN C C 60 176.942 176.942 178.280 -1.338 19163 6030 1 16 . 1 1 60 60 GLN CA C 60 58.762 58.762 58.891 -0.129 19163 6031 1 16 . 1 1 60 60 GLN CB C 60 28.498 28.498 28.762 -0.264 19163 6032 1 16 . 1 1 60 60 GLN H H 60 7.933 7.933 7.585 0.348 19163 6033 1 16 . 1 1 61 61 ALA N N 61 119.367 119.367 122.472 -3.105 19163 6034 1 16 . 1 1 61 61 ALA HA H 61 2.636 2.636 4.104 -1.468 19163 6035 1 16 . 1 1 61 61 ALA C C 61 178.507 178.507 179.346 -0.839 19163 6036 1 16 . 1 1 61 61 ALA CA C 61 54.126 54.126 55.000 -0.874 19163 6037 1 16 . 1 1 61 61 ALA CB C 61 18.462 18.462 18.339 0.123 19163 6038 1 16 . 1 1 61 61 ALA H H 61 7.354 7.354 7.683 -0.329 19163 6039 1 16 . 1 1 62 62 TYR N N 62 115.613 115.613 120.176 -4.563 19163 6040 1 16 . 1 1 62 62 TYR HA H 62 3.633 3.633 3.888 -0.255 19163 6041 1 16 . 1 1 62 62 TYR C C 62 177.421 177.421 177.333 0.088 19163 6042 1 16 . 1 1 62 62 TYR CA C 62 61.676 61.676 61.014 0.662 19163 6043 1 16 . 1 1 62 62 TYR CB C 62 39.162 39.162 38.029 1.133 19163 6044 1 16 . 1 1 62 62 TYR H H 62 7.994 7.994 8.639 -0.645 19163 6045 1 16 . 1 1 63 63 GLU N N 63 121.396 121.396 119.540 1.856 19163 6046 1 16 . 1 1 63 63 GLU HA H 63 3.347 3.347 3.632 -0.285 19163 6047 1 16 . 1 1 63 63 GLU C C 63 177.687 177.687 179.165 -1.478 19163 6048 1 16 . 1 1 63 63 GLU CA C 63 59.562 59.562 59.099 0.463 19163 6049 1 16 . 1 1 63 63 GLU CB C 63 29.115 29.115 28.884 0.231 19163 6050 1 16 . 1 1 63 63 GLU H H 63 8.151 8.151 7.982 0.169 19163 6051 1 16 . 1 1 64 64 VAL N N 64 115.850 115.850 117.903 -2.053 19163 6052 1 16 . 1 1 64 64 VAL HA H 64 3.377 3.377 3.661 -0.284 19163 6053 1 16 . 1 1 64 64 VAL C C 64 175.925 175.925 177.285 -1.360 19163 6054 1 16 . 1 1 64 64 VAL CA C 64 65.806 65.806 65.047 0.759 19163 6055 1 16 . 1 1 64 64 VAL CB C 64 31.786 31.786 31.862 -0.076 19163 6056 1 16 . 1 1 64 64 VAL H H 64 6.814 6.814 7.271 -0.457 19163 6057 1 16 . 1 1 65 65 LEU N N 65 111.438 111.438 119.848 -8.410 19163 6058 1 16 . 1 1 65 65 LEU HA H 65 3.569 3.569 3.862 -0.293 19163 6059 1 16 . 1 1 65 65 LEU C C 65 177.124 177.124 179.069 -1.945 19163 6060 1 16 . 1 1 65 65 LEU CA C 65 56.645 56.645 57.425 -0.779 19163 6061 1 16 . 1 1 65 65 LEU CB C 65 42.589 42.589 40.868 1.721 19163 6062 1 16 . 1 1 65 65 LEU H H 65 7.398 7.398 8.370 -0.972 19163 6063 1 16 . 1 1 66 66 SER N N 66 108.642 108.642 111.993 -3.351 19163 6064 1 16 . 1 1 66 66 SER HA H 66 4.028 4.028 4.129 -0.101 19163 6065 1 16 . 1 1 66 66 SER C C 66 173.286 173.286 174.029 -0.743 19163 6066 1 16 . 1 1 66 66 SER CA C 66 59.232 59.232 59.498 -0.266 19163 6067 1 16 . 1 1 66 66 SER CB C 66 63.066 63.066 62.945 0.121 19163 6068 1 16 . 1 1 66 66 SER H H 66 7.700 7.700 7.746 -0.046 19163 6069 1 16 . 1 1 67 67 ASP N N 67 124.276 124.276 120.811 3.465 19163 6070 1 16 . 1 1 67 67 ASP HA H 67 4.668 4.668 4.697 -0.029 19163 6071 1 16 . 1 1 67 67 ASP C C 67 174.913 174.913 175.503 -0.590 19163 6072 1 16 . 1 1 67 67 ASP CA C 67 52.487 52.487 52.682 -0.195 19163 6073 1 16 . 1 1 67 67 ASP CB C 67 43.218 43.218 42.393 0.825 19163 6074 1 16 . 1 1 67 67 ASP H H 67 6.879 6.879 7.251 -0.372 19163 6075 1 16 . 1 1 68 68 ALA N N 68 127.326 127.326 130.761 -3.435 19163 6076 1 16 . 1 1 68 68 ALA HA H 68 3.853 3.853 3.897 -0.044 19163 6077 1 16 . 1 1 68 68 ALA C C 68 180.336 180.336 179.007 1.329 19163 6078 1 16 . 1 1 68 68 ALA CA C 68 55.912 55.912 55.552 0.360 19163 6079 1 16 . 1 1 68 68 ALA CB C 68 18.645 18.645 18.596 0.049 19163 6080 1 16 . 1 1 68 68 ALA H H 68 8.693 8.693 8.969 -0.276 19163 6081 1 16 . 1 1 69 69 LYS N N 69 116.929 116.929 118.442 -1.513 19163 6082 1 16 . 1 1 69 69 LYS HA H 69 4.162 4.162 4.044 0.118 19163 6083 1 16 . 1 1 69 69 LYS C C 69 179.515 179.515 178.862 0.653 19163 6084 1 16 . 1 1 69 69 LYS CA C 69 58.562 58.562 59.468 -0.906 19163 6085 1 16 . 1 1 69 69 LYS CB C 69 31.840 31.840 32.161 -0.321 19163 6086 1 16 . 1 1 69 69 LYS H H 69 7.950 7.950 8.304 -0.354 19163 6087 1 16 . 1 1 70 70 LYS N N 70 121.286 121.286 118.974 2.312 19163 6088 1 16 . 1 1 70 70 LYS HA H 70 3.960 3.960 3.967 -0.007 19163 6089 1 16 . 1 1 70 70 LYS C C 70 179.938 179.938 179.111 0.827 19163 6090 1 16 . 1 1 70 70 LYS CA C 70 60.066 60.066 59.594 0.472 19163 6091 1 16 . 1 1 70 70 LYS CB C 70 32.695 32.695 32.333 0.362 19163 6092 1 16 . 1 1 70 70 LYS H H 70 8.184 8.184 8.674 -0.490 19163 6093 1 16 . 1 1 71 71 ARG N N 71 122.794 122.794 119.893 2.901 19163 6094 1 16 . 1 1 71 71 ARG HA H 71 3.668 3.668 3.885 -0.217 19163 6095 1 16 . 1 1 71 71 ARG C C 71 177.356 177.356 178.056 -0.700 19163 6096 1 16 . 1 1 71 71 ARG CA C 71 60.127 60.127 60.191 -0.064 19163 6097 1 16 . 1 1 71 71 ARG CB C 71 29.668 29.668 30.227 -0.559 19163 6098 1 16 . 1 1 71 71 ARG H H 71 9.290 9.290 8.641 0.649 19163 6099 1 16 . 1 1 72 72 GLU N N 72 118.390 118.390 119.616 -1.226 19163 6100 1 16 . 1 1 72 72 GLU HA H 72 4.096 4.096 4.168 -0.072 19163 6101 1 16 . 1 1 72 72 GLU C C 72 179.073 179.073 179.180 -0.107 19163 6102 1 16 . 1 1 72 72 GLU CA C 72 59.456 59.456 59.243 0.213 19163 6103 1 16 . 1 1 72 72 GLU CB C 72 29.615 29.615 29.573 0.042 19163 6104 1 16 . 1 1 72 72 GLU H H 72 7.607 7.607 7.879 -0.272 19163 6105 1 16 . 1 1 73 73 LEU N N 73 117.921 117.921 120.258 -2.337 19163 6106 1 16 . 1 1 73 73 LEU HA H 73 4.032 4.032 3.982 0.050 19163 6107 1 16 . 1 1 73 73 LEU C C 73 179.696 179.696 178.977 0.719 19163 6108 1 16 . 1 1 73 73 LEU CA C 73 57.597 57.597 57.932 -0.335 19163 6109 1 16 . 1 1 73 73 LEU CB C 73 41.815 41.815 41.577 0.238 19163 6110 1 16 . 1 1 73 73 LEU H H 73 7.398 7.398 8.072 -0.674 19163 6111 1 16 . 1 1 74 74 TYR N N 74 122.662 122.662 120.619 2.043 19163 6112 1 16 . 1 1 74 74 TYR HA H 74 4.092 4.092 4.033 0.059 19163 6113 1 16 . 1 1 74 74 TYR C C 74 178.166 178.166 177.538 0.628 19163 6114 1 16 . 1 1 74 74 TYR CA C 74 61.458 61.458 61.289 0.169 19163 6115 1 16 . 1 1 74 74 TYR CB C 74 38.778 38.778 38.664 0.114 19163 6116 1 16 . 1 1 74 74 TYR H H 74 8.316 8.316 8.419 -0.103 19163 6117 1 16 . 1 1 75 75 ASP N N 75 118.842 118.842 117.527 1.315 19163 6118 1 16 . 1 1 75 75 ASP HA H 75 4.423 4.423 4.420 0.003 19163 6119 1 16 . 1 1 75 75 ASP C C 75 177.726 177.726 177.779 -0.053 19163 6120 1 16 . 1 1 75 75 ASP CA C 75 56.177 56.177 56.725 -0.548 19163 6121 1 16 . 1 1 75 75 ASP CB C 75 40.800 40.800 40.883 -0.083 19163 6122 1 16 . 1 1 75 75 ASP H H 75 8.770 8.770 8.181 0.589 19163 6123 1 16 . 1 1 76 76 LYS N N 76 118.955 118.955 119.234 -0.279 19163 6124 1 16 . 1 1 76 76 LYS HA H 76 4.130 4.130 4.143 -0.013 19163 6125 1 16 . 1 1 76 76 LYS C C 76 177.006 177.006 176.845 0.161 19163 6126 1 16 . 1 1 76 76 LYS CA C 76 57.537 57.537 57.206 0.331 19163 6127 1 16 . 1 1 76 76 LYS CB C 76 33.136 33.136 33.853 -0.717 19163 6128 1 16 . 1 1 76 76 LYS H H 76 7.610 7.610 7.883 -0.273 19163 6129 1 17 . 1 1 11 11 MET HA H 11 4.346 4.346 4.572 -0.226 19163 6130 1 17 . 1 1 11 11 MET C C 11 175.801 175.801 174.776 1.025 19163 6131 1 17 . 1 1 11 11 MET CA C 11 55.614 55.614 54.259 1.355 19163 6132 1 17 . 1 1 11 11 MET CB C 11 32.925 32.925 35.588 -2.663 19163 6133 1 17 . 1 1 12 12 VAL N N 12 121.226 121.226 120.302 0.924 19163 6134 1 17 . 1 1 12 12 VAL HA H 12 4.026 4.026 4.240 -0.214 19163 6135 1 17 . 1 1 12 12 VAL C C 12 175.701 175.701 175.395 0.306 19163 6136 1 17 . 1 1 12 12 VAL CA C 12 62.188 62.188 61.970 0.218 19163 6137 1 17 . 1 1 12 12 VAL CB C 12 32.882 32.882 31.997 0.885 19163 6138 1 17 . 1 1 12 12 VAL H H 12 7.988 7.988 8.337 -0.349 19163 6139 1 17 . 1 1 13 13 LYS N N 13 125.255 125.255 127.490 -2.235 19163 6140 1 17 . 1 1 13 13 LYS HA H 13 4.211 4.211 4.426 -0.215 19163 6141 1 17 . 1 1 13 13 LYS C C 13 176.121 176.121 175.596 0.525 19163 6142 1 17 . 1 1 13 13 LYS CA C 13 56.355 56.355 55.618 0.737 19163 6143 1 17 . 1 1 13 13 LYS CB C 13 33.019 33.019 33.147 -0.128 19163 6144 1 17 . 1 1 13 13 LYS H H 13 8.281 8.281 8.458 -0.177 19163 6145 1 17 . 1 1 14 14 GLU N N 14 123.004 123.004 123.596 -0.592 19163 6146 1 17 . 1 1 14 14 GLU HA H 14 4.305 4.305 4.033 0.272 19163 6147 1 17 . 1 1 14 14 GLU C C 14 176.107 176.107 175.244 0.863 19163 6148 1 17 . 1 1 14 14 GLU CA C 14 56.343 56.343 56.689 -0.346 19163 6149 1 17 . 1 1 14 14 GLU CB C 14 30.534 30.534 29.164 1.370 19163 6150 1 17 . 1 1 14 14 GLU H H 14 8.424 8.424 8.684 -0.260 19163 6151 1 17 . 1 1 15 15 THR N N 15 115.895 115.895 117.125 -1.230 19163 6152 1 17 . 1 1 15 15 THR HA H 15 4.538 4.538 4.336 0.202 19163 6153 1 17 . 1 1 15 15 THR C C 15 175.233 175.233 174.577 0.656 19163 6154 1 17 . 1 1 15 15 THR CA C 15 61.981 61.981 62.572 -0.591 19163 6155 1 17 . 1 1 15 15 THR CB C 15 69.865 69.865 69.596 0.269 19163 6156 1 17 . 1 1 15 15 THR H H 15 8.335 8.335 7.925 0.410 19163 6157 1 17 . 1 1 16 16 THR N N 16 116.992 116.992 118.752 -1.760 19163 6158 1 17 . 1 1 16 16 THR HA H 16 4.366 4.366 4.476 -0.110 19163 6159 1 17 . 1 1 16 16 THR C C 16 176.090 176.090 175.281 0.809 19163 6160 1 17 . 1 1 16 16 THR CA C 16 62.172 62.172 60.785 1.387 19163 6161 1 17 . 1 1 16 16 THR CB C 16 71.997 71.997 70.791 1.206 19163 6162 1 17 . 1 1 16 16 THR H H 16 8.798 8.798 8.128 0.670 19163 6163 1 17 . 1 1 17 17 TYR N N 17 117.617 117.617 120.627 -3.010 19163 6164 1 17 . 1 1 17 17 TYR HA H 17 4.329 4.329 4.223 0.106 19163 6165 1 17 . 1 1 17 17 TYR C C 17 177.105 177.105 178.222 -1.117 19163 6166 1 17 . 1 1 17 17 TYR CA C 17 57.577 57.577 62.616 -5.039 19163 6167 1 17 . 1 1 17 17 TYR CB C 17 37.113 37.113 37.778 -0.665 19163 6168 1 17 . 1 1 17 17 TYR H H 17 8.292 8.292 9.046 -0.754 19163 6169 1 17 . 1 1 18 18 TYR N N 18 115.048 115.048 117.493 -2.445 19163 6170 1 17 . 1 1 18 18 TYR HA H 18 3.775 3.775 4.226 -0.451 19163 6171 1 17 . 1 1 18 18 TYR C C 18 177.771 177.771 177.894 -0.123 19163 6172 1 17 . 1 1 18 18 TYR CA C 18 61.430 61.430 60.382 1.048 19163 6173 1 17 . 1 1 18 18 TYR CB C 18 36.495 36.495 37.364 -0.869 19163 6174 1 17 . 1 1 18 18 TYR H H 18 7.047 7.047 8.586 -1.539 19163 6175 1 17 . 1 1 19 19 ASP N N 19 119.520 119.520 120.127 -0.607 19163 6176 1 17 . 1 1 19 19 ASP HA H 19 4.406 4.406 4.396 0.010 19163 6177 1 17 . 1 1 19 19 ASP C C 19 180.128 180.128 178.667 1.461 19163 6178 1 17 . 1 1 19 19 ASP CA C 19 57.475 57.475 57.408 0.067 19163 6179 1 17 . 1 1 19 19 ASP CB C 19 40.659 40.659 40.877 -0.218 19163 6180 1 17 . 1 1 19 19 ASP H H 19 7.685 7.685 8.097 -0.412 19163 6181 1 17 . 1 1 20 20 VAL N N 20 119.772 119.772 119.470 0.302 19163 6182 1 17 . 1 1 20 20 VAL HA H 20 3.608 3.608 3.656 -0.048 19163 6183 1 17 . 1 1 20 20 VAL C C 20 177.026 177.026 177.587 -0.561 19163 6184 1 17 . 1 1 20 20 VAL CA C 20 65.840 65.840 65.848 -0.008 19163 6185 1 17 . 1 1 20 20 VAL CB C 20 31.530 31.530 31.925 -0.395 19163 6186 1 17 . 1 1 20 20 VAL H H 20 8.004 8.004 8.238 -0.234 19163 6187 1 17 . 1 1 21 21 LEU N N 21 115.252 115.252 116.276 -1.024 19163 6188 1 17 . 1 1 21 21 LEU HA H 21 4.281 4.281 4.445 -0.164 19163 6189 1 17 . 1 1 21 21 LEU C C 21 175.757 175.757 176.998 -1.241 19163 6190 1 17 . 1 1 21 21 LEU CA C 21 54.554 54.554 54.755 -0.202 19163 6191 1 17 . 1 1 21 21 LEU CB C 21 42.869 42.869 41.717 1.152 19163 6192 1 17 . 1 1 21 21 LEU H H 21 6.847 6.847 7.508 -0.661 19163 6193 1 17 . 1 1 22 22 GLY N N 22 108.227 108.227 107.128 1.099 19163 6194 1 17 . 1 1 22 22 GLY C C 22 175.361 175.361 174.171 1.190 19163 6195 1 17 . 1 1 22 22 GLY CA C 22 46.574 46.574 45.562 1.012 19163 6196 1 17 . 1 1 22 22 GLY H H 22 7.874 7.874 7.295 0.579 19163 6197 1 17 . 1 1 23 23 VAL N N 23 110.675 110.675 118.286 -7.611 19163 6198 1 17 . 1 1 23 23 VAL HA H 23 4.767 4.767 4.447 0.320 19163 6199 1 17 . 1 1 23 23 VAL C C 23 174.674 174.674 174.529 0.145 19163 6200 1 17 . 1 1 23 23 VAL CA C 23 58.349 58.349 59.686 -1.337 19163 6201 1 17 . 1 1 23 23 VAL CB C 23 34.938 34.938 34.312 0.626 19163 6202 1 17 . 1 1 23 23 VAL H H 23 7.815 7.815 7.837 -0.022 19163 6203 1 17 . 1 1 24 24 LYS N N 24 119.948 119.948 123.564 -3.616 19163 6204 1 17 . 1 1 24 24 LYS HA H 24 4.488 4.488 4.669 -0.181 19163 6205 1 17 . 1 1 24 24 LYS C C 24 175.442 175.442 175.888 -0.446 19163 6206 1 17 . 1 1 24 24 LYS CA C 24 54.001 54.001 54.546 -0.545 19163 6207 1 17 . 1 1 24 24 LYS CB C 24 32.197 32.197 32.265 -0.068 19163 6208 1 17 . 1 1 24 24 LYS H H 24 8.329 8.329 8.375 -0.046 19163 6209 1 17 . 1 1 25 25 PRO HA H 25 2.421 2.421 4.538 -2.117 19163 6210 1 17 . 1 1 25 25 PRO C C 25 175.635 175.635 176.778 -1.143 19163 6211 1 17 . 1 1 25 25 PRO CA C 25 63.362 63.362 64.997 -1.635 19163 6212 1 17 . 1 1 25 25 PRO CB C 25 31.839 31.839 31.903 -0.064 19163 6213 1 17 . 1 1 26 26 ASN N N 26 111.739 111.739 114.154 -2.415 19163 6214 1 17 . 1 1 26 26 ASN HA H 26 4.518 4.518 4.808 -0.290 19163 6215 1 17 . 1 1 26 26 ASN C C 26 175.820 175.820 174.836 0.984 19163 6216 1 17 . 1 1 26 26 ASN CA C 26 51.525 51.525 52.287 -0.762 19163 6217 1 17 . 1 1 26 26 ASN CB C 26 36.829 36.829 38.168 -1.339 19163 6218 1 17 . 1 1 26 26 ASN H H 26 7.138 7.138 8.256 -1.118 19163 6219 1 17 . 1 1 27 27 ALA N N 27 122.829 122.829 124.172 -1.343 19163 6220 1 17 . 1 1 27 27 ALA HA H 27 4.325 4.325 4.298 0.027 19163 6221 1 17 . 1 1 27 27 ALA C C 27 178.726 178.726 176.932 1.794 19163 6222 1 17 . 1 1 27 27 ALA CA C 27 52.961 52.961 52.381 0.580 19163 6223 1 17 . 1 1 27 27 ALA CB C 27 19.159 19.159 19.787 -0.628 19163 6224 1 17 . 1 1 27 27 ALA H H 27 7.637 7.637 7.555 0.082 19163 6225 1 17 . 1 1 28 28 THR N N 28 113.468 113.468 114.451 -0.983 19163 6226 1 17 . 1 1 28 28 THR HA H 28 4.493 4.493 4.386 0.107 19163 6227 1 17 . 1 1 28 28 THR C C 28 175.641 175.641 175.871 -0.230 19163 6228 1 17 . 1 1 28 28 THR CA C 28 60.592 60.592 61.570 -0.978 19163 6229 1 17 . 1 1 28 28 THR CB C 28 71.304 71.304 71.155 0.149 19163 6230 1 17 . 1 1 28 28 THR H H 28 8.829 8.829 8.149 0.680 19163 6231 1 17 . 1 1 29 29 GLN N N 29 119.445 119.445 122.315 -2.870 19163 6232 1 17 . 1 1 29 29 GLN HA H 29 4.035 4.035 3.963 0.072 19163 6233 1 17 . 1 1 29 29 GLN C C 29 179.117 179.117 178.446 0.671 19163 6234 1 17 . 1 1 29 29 GLN CA C 29 59.435 59.435 60.519 -1.084 19163 6235 1 17 . 1 1 29 29 GLN CB C 29 27.851 27.851 28.470 -0.619 19163 6236 1 17 . 1 1 29 29 GLN H H 29 9.015 9.015 8.821 0.194 19163 6237 1 17 . 1 1 30 30 GLU N N 30 119.343 119.343 118.693 0.650 19163 6238 1 17 . 1 1 30 30 GLU HA H 30 4.059 4.059 4.088 -0.029 19163 6239 1 17 . 1 1 30 30 GLU C C 30 179.097 179.097 178.628 0.469 19163 6240 1 17 . 1 1 30 30 GLU CA C 30 59.847 59.847 59.511 0.336 19163 6241 1 17 . 1 1 30 30 GLU CB C 30 29.356 29.356 29.276 0.080 19163 6242 1 17 . 1 1 30 30 GLU H H 30 8.549 8.549 8.537 0.012 19163 6243 1 17 . 1 1 31 31 GLU N N 31 120.562 120.562 120.711 -0.149 19163 6244 1 17 . 1 1 31 31 GLU HA H 31 3.906 3.906 4.119 -0.213 19163 6245 1 17 . 1 1 31 31 GLU C C 31 180.405 180.405 179.047 1.358 19163 6246 1 17 . 1 1 31 31 GLU CA C 31 59.592 59.592 58.987 0.605 19163 6247 1 17 . 1 1 31 31 GLU CB C 31 29.989 29.989 29.219 0.770 19163 6248 1 17 . 1 1 31 31 GLU H H 31 7.768 7.768 8.204 -0.436 19163 6249 1 17 . 1 1 32 32 LEU N N 32 120.518 120.518 120.003 0.515 19163 6250 1 17 . 1 1 32 32 LEU HA H 32 3.963 3.963 4.019 -0.056 19163 6251 1 17 . 1 1 32 32 LEU C C 32 177.873 177.873 179.349 -1.476 19163 6252 1 17 . 1 1 32 32 LEU CA C 32 58.593 58.593 57.875 0.718 19163 6253 1 17 . 1 1 32 32 LEU CB C 32 42.556 42.556 41.116 1.440 19163 6254 1 17 . 1 1 32 32 LEU H H 32 8.475 8.475 8.600 -0.125 19163 6255 1 17 . 1 1 33 33 LYS N N 33 119.091 119.091 118.881 0.210 19163 6256 1 17 . 1 1 33 33 LYS HA H 33 4.000 4.000 4.223 -0.223 19163 6257 1 17 . 1 1 33 33 LYS C C 33 178.701 178.701 178.886 -0.185 19163 6258 1 17 . 1 1 33 33 LYS CA C 33 60.274 60.274 60.052 0.222 19163 6259 1 17 . 1 1 33 33 LYS CB C 33 32.656 32.656 32.217 0.439 19163 6260 1 17 . 1 1 33 33 LYS H H 33 8.077 8.077 7.676 0.401 19163 6261 1 17 . 1 1 34 34 LYS N N 34 118.527 118.527 120.114 -1.587 19163 6262 1 17 . 1 1 34 34 LYS HA H 34 3.890 3.890 4.011 -0.121 19163 6263 1 17 . 1 1 34 34 LYS C C 34 179.172 179.172 178.805 0.367 19163 6264 1 17 . 1 1 34 34 LYS CA C 34 59.927 59.927 59.442 0.485 19163 6265 1 17 . 1 1 34 34 LYS CB C 34 32.869 32.869 32.450 0.419 19163 6266 1 17 . 1 1 34 34 LYS H H 34 7.986 7.986 7.946 0.040 19163 6267 1 17 . 1 1 35 35 ALA N N 35 122.190 122.190 121.893 0.297 19163 6268 1 17 . 1 1 35 35 ALA HA H 35 4.116 4.116 4.024 0.092 19163 6269 1 17 . 1 1 35 35 ALA C C 35 179.982 179.982 179.030 0.952 19163 6270 1 17 . 1 1 35 35 ALA CA C 35 55.157 55.157 55.246 -0.089 19163 6271 1 17 . 1 1 35 35 ALA CB C 35 18.773 18.773 18.348 0.425 19163 6272 1 17 . 1 1 35 35 ALA H H 35 7.917 7.917 8.382 -0.465 19163 6273 1 17 . 1 1 36 36 TYR N N 36 117.701 117.701 119.929 -2.228 19163 6274 1 17 . 1 1 36 36 TYR HA H 36 3.818 3.818 3.982 -0.164 19163 6275 1 17 . 1 1 36 36 TYR C C 36 176.344 176.344 177.685 -1.341 19163 6276 1 17 . 1 1 36 36 TYR CA C 36 61.468 61.468 61.300 0.168 19163 6277 1 17 . 1 1 36 36 TYR CB C 36 38.890 38.890 38.111 0.779 19163 6278 1 17 . 1 1 36 36 TYR H H 36 8.402 8.402 7.816 0.586 19163 6279 1 17 . 1 1 37 37 ARG N N 37 117.423 117.423 118.038 -0.615 19163 6280 1 17 . 1 1 37 37 ARG HA H 37 3.481 3.481 3.591 -0.110 19163 6281 1 17 . 1 1 37 37 ARG C C 37 178.825 178.825 178.352 0.473 19163 6282 1 17 . 1 1 37 37 ARG CA C 37 59.397 59.397 59.627 -0.230 19163 6283 1 17 . 1 1 37 37 ARG CB C 37 29.710 29.710 29.900 -0.190 19163 6284 1 17 . 1 1 37 37 ARG H H 37 8.264 8.264 8.245 0.019 19163 6285 1 17 . 1 1 38 38 LYS N N 38 117.247 117.247 120.691 -3.444 19163 6286 1 17 . 1 1 38 38 LYS HA H 38 3.905 3.905 3.974 -0.069 19163 6287 1 17 . 1 1 38 38 LYS C C 38 179.444 179.444 178.979 0.465 19163 6288 1 17 . 1 1 38 38 LYS CA C 38 59.450 59.450 59.371 0.079 19163 6289 1 17 . 1 1 38 38 LYS CB C 38 32.609 32.609 32.315 0.295 19163 6290 1 17 . 1 1 38 38 LYS H H 38 7.444 7.444 7.576 -0.132 19163 6291 1 17 . 1 1 39 39 LEU N N 39 119.901 119.901 119.315 0.586 19163 6292 1 17 . 1 1 39 39 LEU HA H 39 4.020 4.020 4.005 0.015 19163 6293 1 17 . 1 1 39 39 LEU C C 39 178.801 178.801 178.716 0.085 19163 6294 1 17 . 1 1 39 39 LEU CA C 39 57.409 57.409 57.508 -0.098 19163 6295 1 17 . 1 1 39 39 LEU CB C 39 42.388 42.388 41.618 0.770 19163 6296 1 17 . 1 1 39 39 LEU H H 39 7.707 7.707 7.881 -0.174 19163 6297 1 17 . 1 1 40 40 ALA N N 40 122.772 122.772 122.270 0.502 19163 6298 1 17 . 1 1 40 40 ALA HA H 40 3.849 3.849 4.048 -0.199 19163 6299 1 17 . 1 1 40 40 ALA C C 40 179.446 179.446 179.630 -0.184 19163 6300 1 17 . 1 1 40 40 ALA CA C 40 55.109 55.109 55.133 -0.024 19163 6301 1 17 . 1 1 40 40 ALA CB C 40 17.116 17.116 17.868 -0.752 19163 6302 1 17 . 1 1 40 40 ALA H H 40 8.931 8.931 8.182 0.749 19163 6303 1 17 . 1 1 41 41 LEU N N 41 115.299 115.299 116.949 -1.650 19163 6304 1 17 . 1 1 41 41 LEU HA H 41 3.977 3.977 3.750 0.227 19163 6305 1 17 . 1 1 41 41 LEU C C 41 178.216 178.216 178.589 -0.373 19163 6306 1 17 . 1 1 41 41 LEU CA C 41 57.088 57.088 56.992 0.096 19163 6307 1 17 . 1 1 41 41 LEU CB C 41 42.162 42.162 41.482 0.680 19163 6308 1 17 . 1 1 41 41 LEU H H 41 7.133 7.133 7.326 -0.193 19163 6309 1 17 . 1 1 42 42 LYS N N 42 116.812 116.812 117.879 -1.067 19163 6310 1 17 . 1 1 42 42 LYS HA H 42 3.925 3.925 3.877 0.048 19163 6311 1 17 . 1 1 42 42 LYS C C 42 177.560 177.560 178.104 -0.544 19163 6312 1 17 . 1 1 42 42 LYS CA C 42 57.885 57.885 58.221 -0.337 19163 6313 1 17 . 1 1 42 42 LYS CB C 42 33.427 33.427 32.708 0.719 19163 6314 1 17 . 1 1 42 42 LYS H H 42 7.038 7.038 7.345 -0.307 19163 6315 1 17 . 1 1 43 43 TYR N N 43 114.022 114.022 115.384 -1.362 19163 6316 1 17 . 1 1 43 43 TYR HA H 43 4.665 4.665 4.648 0.017 19163 6317 1 17 . 1 1 43 43 TYR C C 43 173.741 173.741 174.566 -0.825 19163 6318 1 17 . 1 1 43 43 TYR CA C 43 56.928 56.928 56.691 0.237 19163 6319 1 17 . 1 1 43 43 TYR CB C 43 39.579 39.579 37.853 1.726 19163 6320 1 17 . 1 1 43 43 TYR H H 43 7.683 7.683 8.091 -0.408 19163 6321 1 17 . 1 1 44 44 HIS N N 44 120.947 120.947 117.886 3.061 19163 6322 1 17 . 1 1 44 44 HIS HA H 44 3.697 3.697 4.208 -0.511 19163 6323 1 17 . 1 1 44 44 HIS C C 44 174.925 174.925 174.538 0.387 19163 6324 1 17 . 1 1 44 44 HIS CA C 44 56.229 56.229 53.912 2.317 19163 6325 1 17 . 1 1 44 44 HIS CB C 44 30.852 30.852 29.702 1.150 19163 6326 1 17 . 1 1 44 44 HIS H H 44 7.814 7.814 7.443 0.371 19163 6327 1 17 . 1 1 45 45 PRO HA H 45 4.131 4.131 4.445 -0.314 19163 6328 1 17 . 1 1 45 45 PRO C C 45 177.269 177.269 177.546 -0.277 19163 6329 1 17 . 1 1 45 45 PRO CA C 45 64.723 64.723 64.487 0.236 19163 6330 1 17 . 1 1 45 45 PRO CB C 45 32.070 32.070 31.723 0.347 19163 6331 1 17 . 1 1 46 46 ASP N N 46 119.127 119.127 117.300 1.827 19163 6332 1 17 . 1 1 46 46 ASP HA H 46 4.375 4.375 4.363 0.012 19163 6333 1 17 . 1 1 46 46 ASP C C 46 177.284 177.284 176.806 0.478 19163 6334 1 17 . 1 1 46 46 ASP CA C 46 56.020 56.020 56.543 -0.523 19163 6335 1 17 . 1 1 46 46 ASP CB C 46 40.221 40.221 40.385 -0.164 19163 6336 1 17 . 1 1 46 46 ASP H H 46 10.040 10.040 8.289 1.751 19163 6337 1 17 . 1 1 47 47 LYS N N 47 117.416 117.416 118.507 -1.091 19163 6338 1 17 . 1 1 47 47 LYS HA H 47 4.315 4.315 4.160 0.155 19163 6339 1 17 . 1 1 47 47 LYS C C 47 176.355 176.355 176.513 -0.158 19163 6340 1 17 . 1 1 47 47 LYS CA C 47 55.880 55.880 56.723 -0.843 19163 6341 1 17 . 1 1 47 47 LYS CB C 47 33.778 33.778 34.176 -0.398 19163 6342 1 17 . 1 1 47 47 LYS H H 47 7.826 7.826 7.402 0.424 19163 6343 1 17 . 1 1 48 48 ASN N N 48 116.573 116.573 117.791 -1.218 19163 6344 1 17 . 1 1 48 48 ASN HA H 48 5.021 5.021 5.173 -0.152 19163 6345 1 17 . 1 1 48 48 ASN C C 48 172.992 172.992 174.141 -1.149 19163 6346 1 17 . 1 1 48 48 ASN CA C 48 50.467 50.467 50.994 -0.527 19163 6347 1 17 . 1 1 48 48 ASN CB C 48 39.284 39.284 39.377 -0.093 19163 6348 1 17 . 1 1 48 48 ASN H H 48 7.956 7.956 8.106 -0.150 19163 6349 1 17 . 1 1 49 49 PRO HA H 49 4.448 4.448 4.340 0.108 19163 6350 1 17 . 1 1 49 49 PRO C C 49 178.030 178.030 177.802 0.228 19163 6351 1 17 . 1 1 49 49 PRO CA C 49 64.468 64.468 64.990 -0.522 19163 6352 1 17 . 1 1 49 49 PRO CB C 49 32.173 32.173 31.941 0.232 19163 6353 1 17 . 1 1 50 50 ASN N N 50 115.567 115.567 115.832 -0.265 19163 6354 1 17 . 1 1 50 50 ASN HA H 50 4.748 4.748 4.515 0.233 19163 6355 1 17 . 1 1 50 50 ASN C C 50 176.443 176.443 176.199 0.244 19163 6356 1 17 . 1 1 50 50 ASN CA C 50 54.677 54.677 55.473 -0.796 19163 6357 1 17 . 1 1 50 50 ASN CB C 50 39.014 39.014 37.504 1.510 19163 6358 1 17 . 1 1 50 50 ASN H H 50 8.398 8.398 8.846 -0.448 19163 6359 1 17 . 1 1 51 51 GLU N N 51 119.270 119.270 119.150 0.120 19163 6360 1 17 . 1 1 51 51 GLU HA H 51 4.797 4.797 4.543 0.254 19163 6361 1 17 . 1 1 51 51 GLU C C 51 176.922 176.922 177.717 -0.795 19163 6362 1 17 . 1 1 51 51 GLU CA C 51 55.916 55.916 55.861 0.055 19163 6363 1 17 . 1 1 51 51 GLU CB C 51 29.200 29.200 29.264 -0.064 19163 6364 1 17 . 1 1 51 51 GLU H H 51 7.485 7.485 7.817 -0.332 19163 6365 1 17 . 1 1 52 52 GLY N N 52 107.541 107.541 108.876 -1.335 19163 6366 1 17 . 1 1 52 52 GLY C C 52 176.755 176.755 175.438 1.317 19163 6367 1 17 . 1 1 52 52 GLY CA C 52 47.914 47.914 47.135 0.779 19163 6368 1 17 . 1 1 52 52 GLY H H 52 8.092 8.092 8.009 0.083 19163 6369 1 17 . 1 1 53 53 GLU N N 53 121.603 121.603 120.897 0.706 19163 6370 1 17 . 1 1 53 53 GLU HA H 53 4.065 4.065 4.060 0.005 19163 6371 1 17 . 1 1 53 53 GLU C C 53 179.052 179.052 178.489 0.563 19163 6372 1 17 . 1 1 53 53 GLU CA C 53 59.280 59.280 59.951 -0.671 19163 6373 1 17 . 1 1 53 53 GLU CB C 53 28.968 28.968 29.368 -0.400 19163 6374 1 17 . 1 1 53 53 GLU H H 53 8.496 8.496 8.125 0.371 19163 6375 1 17 . 1 1 54 54 LYS N N 54 120.837 120.837 118.117 2.720 19163 6376 1 17 . 1 1 54 54 LYS HA H 54 3.923 3.923 3.993 -0.070 19163 6377 1 17 . 1 1 54 54 LYS C C 54 179.058 179.058 179.004 0.054 19163 6378 1 17 . 1 1 54 54 LYS CA C 54 58.800 58.800 58.397 0.403 19163 6379 1 17 . 1 1 54 54 LYS CB C 54 31.551 31.551 31.482 0.069 19163 6380 1 17 . 1 1 54 54 LYS H H 54 7.857 7.857 7.439 0.418 19163 6381 1 17 . 1 1 55 55 PHE N N 55 118.608 118.608 121.192 -2.584 19163 6382 1 17 . 1 1 55 55 PHE HA H 55 4.021 4.021 4.165 -0.144 19163 6383 1 17 . 1 1 55 55 PHE C C 55 178.001 178.001 177.099 0.902 19163 6384 1 17 . 1 1 55 55 PHE CA C 55 61.911 61.911 61.628 0.283 19163 6385 1 17 . 1 1 55 55 PHE CB C 55 38.553 38.553 39.180 -0.627 19163 6386 1 17 . 1 1 55 55 PHE H H 55 8.382 8.382 8.176 0.206 19163 6387 1 17 . 1 1 56 56 LYS N N 56 120.898 120.898 119.076 1.822 19163 6388 1 17 . 1 1 56 56 LYS HA H 56 3.828 3.828 3.863 -0.035 19163 6389 1 17 . 1 1 56 56 LYS C C 56 178.817 178.817 178.948 -0.131 19163 6390 1 17 . 1 1 56 56 LYS CA C 56 59.877 59.877 60.157 -0.280 19163 6391 1 17 . 1 1 56 56 LYS CB C 56 32.133 32.133 32.107 0.026 19163 6392 1 17 . 1 1 56 56 LYS H H 56 8.111 8.111 8.251 -0.140 19163 6393 1 17 . 1 1 57 57 GLN N N 57 118.600 118.600 118.730 -0.130 19163 6394 1 17 . 1 1 57 57 GLN HA H 57 4.009 4.009 4.016 -0.007 19163 6395 1 17 . 1 1 57 57 GLN C C 57 179.333 179.333 178.776 0.557 19163 6396 1 17 . 1 1 57 57 GLN CA C 57 59.109 59.109 58.904 0.205 19163 6397 1 17 . 1 1 57 57 GLN CB C 57 28.595 28.595 28.738 -0.143 19163 6398 1 17 . 1 1 57 57 GLN H H 57 7.613 7.613 7.528 0.085 19163 6399 1 17 . 1 1 58 58 ILE N N 58 118.709 118.709 120.653 -1.944 19163 6400 1 17 . 1 1 58 58 ILE HA H 58 3.559 3.559 3.632 -0.073 19163 6401 1 17 . 1 1 58 58 ILE C C 58 177.152 177.152 178.027 -0.875 19163 6402 1 17 . 1 1 58 58 ILE CA C 58 65.068 65.068 65.762 -0.694 19163 6403 1 17 . 1 1 58 58 ILE CB C 58 38.381 38.381 37.750 0.631 19163 6404 1 17 . 1 1 58 58 ILE H H 58 8.011 8.011 8.009 0.002 19163 6405 1 17 . 1 1 59 59 SER N N 59 116.112 116.112 115.406 0.706 19163 6406 1 17 . 1 1 59 59 SER HA H 59 3.948 3.948 3.975 -0.027 19163 6407 1 17 . 1 1 59 59 SER C C 59 175.949 175.949 177.035 -1.086 19163 6408 1 17 . 1 1 59 59 SER CA C 59 62.315 62.315 62.265 0.050 19163 6409 1 17 . 1 1 59 59 SER H H 59 8.030 8.030 8.154 -0.124 19163 6410 1 17 . 1 1 60 60 GLN N N 60 122.099 122.099 120.674 1.425 19163 6411 1 17 . 1 1 60 60 GLN HA H 60 3.801 3.801 3.961 -0.160 19163 6412 1 17 . 1 1 60 60 GLN C C 60 176.942 176.942 178.406 -1.464 19163 6413 1 17 . 1 1 60 60 GLN CA C 60 58.762 58.762 58.838 -0.076 19163 6414 1 17 . 1 1 60 60 GLN CB C 60 28.498 28.498 28.620 -0.122 19163 6415 1 17 . 1 1 60 60 GLN H H 60 7.933 7.933 7.988 -0.055 19163 6416 1 17 . 1 1 61 61 ALA N N 61 119.367 119.367 122.190 -2.823 19163 6417 1 17 . 1 1 61 61 ALA HA H 61 2.636 2.636 3.933 -1.297 19163 6418 1 17 . 1 1 61 61 ALA C C 61 178.507 178.507 179.290 -0.783 19163 6419 1 17 . 1 1 61 61 ALA CA C 61 54.126 54.126 54.951 -0.825 19163 6420 1 17 . 1 1 61 61 ALA CB C 61 18.462 18.462 18.358 0.104 19163 6421 1 17 . 1 1 61 61 ALA H H 61 7.354 7.354 7.808 -0.454 19163 6422 1 17 . 1 1 62 62 TYR N N 62 115.613 115.613 120.209 -4.596 19163 6423 1 17 . 1 1 62 62 TYR HA H 62 3.633 3.633 3.897 -0.265 19163 6424 1 17 . 1 1 62 62 TYR C C 62 177.421 177.421 177.351 0.070 19163 6425 1 17 . 1 1 62 62 TYR CA C 62 61.676 61.676 61.044 0.632 19163 6426 1 17 . 1 1 62 62 TYR CB C 62 39.162 39.162 37.872 1.290 19163 6427 1 17 . 1 1 62 62 TYR H H 62 7.994 7.994 8.682 -0.688 19163 6428 1 17 . 1 1 63 63 GLU N N 63 121.396 121.396 120.012 1.384 19163 6429 1 17 . 1 1 63 63 GLU HA H 63 3.347 3.347 3.566 -0.219 19163 6430 1 17 . 1 1 63 63 GLU C C 63 177.687 177.687 178.958 -1.271 19163 6431 1 17 . 1 1 63 63 GLU CA C 63 59.562 59.562 59.209 0.353 19163 6432 1 17 . 1 1 63 63 GLU CB C 63 29.115 29.115 29.404 -0.288 19163 6433 1 17 . 1 1 63 63 GLU H H 63 8.151 8.151 7.925 0.226 19163 6434 1 17 . 1 1 64 64 VAL N N 64 115.850 115.850 118.031 -2.181 19163 6435 1 17 . 1 1 64 64 VAL HA H 64 3.377 3.377 3.618 -0.241 19163 6436 1 17 . 1 1 64 64 VAL C C 64 175.925 175.925 177.379 -1.454 19163 6437 1 17 . 1 1 64 64 VAL CA C 64 65.806 65.806 65.186 0.620 19163 6438 1 17 . 1 1 64 64 VAL CB C 64 31.786 31.786 31.849 -0.063 19163 6439 1 17 . 1 1 64 64 VAL H H 64 6.814 6.814 7.165 -0.351 19163 6440 1 17 . 1 1 65 65 LEU N N 65 111.438 111.438 119.342 -7.904 19163 6441 1 17 . 1 1 65 65 LEU HA H 65 3.569 3.569 3.859 -0.290 19163 6442 1 17 . 1 1 65 65 LEU C C 65 177.124 177.124 178.693 -1.569 19163 6443 1 17 . 1 1 65 65 LEU CA C 65 56.645 56.645 57.353 -0.708 19163 6444 1 17 . 1 1 65 65 LEU CB C 65 42.589 42.589 41.123 1.466 19163 6445 1 17 . 1 1 65 65 LEU H H 65 7.398 7.398 8.445 -1.047 19163 6446 1 17 . 1 1 66 66 SER N N 66 108.642 108.642 110.569 -1.927 19163 6447 1 17 . 1 1 66 66 SER HA H 66 4.028 4.028 4.092 -0.064 19163 6448 1 17 . 1 1 66 66 SER C C 66 173.286 173.286 174.127 -0.841 19163 6449 1 17 . 1 1 66 66 SER CA C 66 59.232 59.232 60.137 -0.905 19163 6450 1 17 . 1 1 66 66 SER CB C 66 63.066 63.066 63.029 0.037 19163 6451 1 17 . 1 1 66 66 SER H H 66 7.700 7.700 7.694 0.006 19163 6452 1 17 . 1 1 67 67 ASP N N 67 124.276 124.276 121.180 3.096 19163 6453 1 17 . 1 1 67 67 ASP HA H 67 4.668 4.668 4.777 -0.109 19163 6454 1 17 . 1 1 67 67 ASP C C 67 174.913 174.913 175.376 -0.463 19163 6455 1 17 . 1 1 67 67 ASP CA C 67 52.487 52.487 52.645 -0.158 19163 6456 1 17 . 1 1 67 67 ASP CB C 67 43.218 43.218 42.629 0.589 19163 6457 1 17 . 1 1 67 67 ASP H H 67 6.879 6.879 7.286 -0.407 19163 6458 1 17 . 1 1 68 68 ALA N N 68 127.326 127.326 131.072 -3.746 19163 6459 1 17 . 1 1 68 68 ALA HA H 68 3.853 3.853 3.905 -0.052 19163 6460 1 17 . 1 1 68 68 ALA C C 68 180.336 180.336 178.755 1.581 19163 6461 1 17 . 1 1 68 68 ALA CA C 68 55.912 55.912 55.661 0.251 19163 6462 1 17 . 1 1 68 68 ALA CB C 68 18.645 18.645 18.853 -0.208 19163 6463 1 17 . 1 1 68 68 ALA H H 68 8.693 8.693 8.780 -0.087 19163 6464 1 17 . 1 1 69 69 LYS N N 69 116.929 116.929 117.118 -0.189 19163 6465 1 17 . 1 1 69 69 LYS HA H 69 4.162 4.162 4.031 0.131 19163 6466 1 17 . 1 1 69 69 LYS C C 69 179.515 179.515 178.354 1.161 19163 6467 1 17 . 1 1 69 69 LYS CA C 69 58.562 58.562 59.377 -0.815 19163 6468 1 17 . 1 1 69 69 LYS CB C 69 31.840 31.840 32.236 -0.396 19163 6469 1 17 . 1 1 69 69 LYS H H 69 7.950 7.950 8.184 -0.234 19163 6470 1 17 . 1 1 70 70 LYS N N 70 121.286 121.286 119.265 2.021 19163 6471 1 17 . 1 1 70 70 LYS HA H 70 3.960 3.960 3.951 0.009 19163 6472 1 17 . 1 1 70 70 LYS C C 70 179.938 179.938 178.982 0.956 19163 6473 1 17 . 1 1 70 70 LYS CA C 70 60.066 60.066 59.560 0.506 19163 6474 1 17 . 1 1 70 70 LYS CB C 70 32.695 32.695 32.310 0.385 19163 6475 1 17 . 1 1 70 70 LYS H H 70 8.184 8.184 8.165 0.019 19163 6476 1 17 . 1 1 71 71 ARG N N 71 122.794 122.794 119.709 3.085 19163 6477 1 17 . 1 1 71 71 ARG HA H 71 3.668 3.668 3.884 -0.216 19163 6478 1 17 . 1 1 71 71 ARG C C 71 177.356 177.356 178.139 -0.783 19163 6479 1 17 . 1 1 71 71 ARG CA C 71 60.127 60.127 60.237 -0.110 19163 6480 1 17 . 1 1 71 71 ARG CB C 71 29.668 29.668 30.203 -0.535 19163 6481 1 17 . 1 1 71 71 ARG H H 71 9.290 9.290 8.636 0.654 19163 6482 1 17 . 1 1 72 72 GLU N N 72 118.390 118.390 119.620 -1.230 19163 6483 1 17 . 1 1 72 72 GLU HA H 72 4.096 4.096 4.133 -0.037 19163 6484 1 17 . 1 1 72 72 GLU C C 72 179.073 179.073 179.079 -0.006 19163 6485 1 17 . 1 1 72 72 GLU CA C 72 59.456 59.456 59.318 0.138 19163 6486 1 17 . 1 1 72 72 GLU CB C 72 29.615 29.615 29.590 0.025 19163 6487 1 17 . 1 1 72 72 GLU H H 72 7.607 7.607 7.797 -0.190 19163 6488 1 17 . 1 1 73 73 LEU N N 73 117.921 117.921 120.142 -2.221 19163 6489 1 17 . 1 1 73 73 LEU HA H 73 4.032 4.032 3.999 0.033 19163 6490 1 17 . 1 1 73 73 LEU C C 73 179.696 179.696 179.081 0.615 19163 6491 1 17 . 1 1 73 73 LEU CA C 73 57.597 57.597 57.846 -0.249 19163 6492 1 17 . 1 1 73 73 LEU CB C 73 41.815 41.815 41.741 0.074 19163 6493 1 17 . 1 1 73 73 LEU H H 73 7.398 7.398 7.782 -0.384 19163 6494 1 17 . 1 1 74 74 TYR N N 74 122.662 122.662 119.877 2.785 19163 6495 1 17 . 1 1 74 74 TYR HA H 74 4.092 4.092 4.012 0.080 19163 6496 1 17 . 1 1 74 74 TYR C C 74 178.166 178.166 177.596 0.570 19163 6497 1 17 . 1 1 74 74 TYR CA C 74 61.458 61.458 61.562 -0.104 19163 6498 1 17 . 1 1 74 74 TYR CB C 74 38.778 38.778 38.478 0.300 19163 6499 1 17 . 1 1 74 74 TYR H H 74 8.316 8.316 8.647 -0.331 19163 6500 1 17 . 1 1 75 75 ASP N N 75 118.842 118.842 117.980 0.862 19163 6501 1 17 . 1 1 75 75 ASP HA H 75 4.423 4.423 4.468 -0.045 19163 6502 1 17 . 1 1 75 75 ASP C C 75 177.726 177.726 177.994 -0.268 19163 6503 1 17 . 1 1 75 75 ASP CA C 75 56.177 56.177 56.486 -0.309 19163 6504 1 17 . 1 1 75 75 ASP CB C 75 40.800 40.800 41.091 -0.291 19163 6505 1 17 . 1 1 75 75 ASP H H 75 8.770 8.770 8.200 0.570 19163 6506 1 17 . 1 1 76 76 LYS N N 76 118.955 118.955 118.754 0.201 19163 6507 1 17 . 1 1 76 76 LYS HA H 76 4.130 4.130 4.123 0.007 19163 6508 1 17 . 1 1 76 76 LYS C C 76 177.006 177.006 176.891 0.115 19163 6509 1 17 . 1 1 76 76 LYS CA C 76 57.537 57.537 57.304 0.232 19163 6510 1 17 . 1 1 76 76 LYS CB C 76 33.136 33.136 33.340 -0.204 19163 6511 1 17 . 1 1 76 76 LYS H H 76 7.610 7.610 7.728 -0.118 19163 6512 1 18 . 1 1 11 11 MET HA H 11 4.346 4.346 4.319 0.027 19163 6513 1 18 . 1 1 11 11 MET C C 11 175.801 175.801 175.769 0.032 19163 6514 1 18 . 1 1 11 11 MET CA C 11 55.614 55.614 54.497 1.117 19163 6515 1 18 . 1 1 11 11 MET CB C 11 32.925 32.925 34.047 -1.122 19163 6516 1 18 . 1 1 12 12 VAL N N 12 121.226 121.226 124.975 -3.749 19163 6517 1 18 . 1 1 12 12 VAL HA H 12 4.026 4.026 4.000 0.026 19163 6518 1 18 . 1 1 12 12 VAL C C 12 175.701 175.701 175.895 -0.194 19163 6519 1 18 . 1 1 12 12 VAL CA C 12 62.188 62.188 63.181 -0.993 19163 6520 1 18 . 1 1 12 12 VAL CB C 12 32.882 32.882 30.660 2.222 19163 6521 1 18 . 1 1 12 12 VAL H H 12 7.988 7.988 8.494 -0.506 19163 6522 1 18 . 1 1 13 13 LYS N N 13 125.255 125.255 127.931 -2.676 19163 6523 1 18 . 1 1 13 13 LYS HA H 13 4.211 4.211 4.447 -0.236 19163 6524 1 18 . 1 1 13 13 LYS C C 13 176.121 176.121 176.236 -0.115 19163 6525 1 18 . 1 1 13 13 LYS CA C 13 56.355 56.355 56.520 -0.165 19163 6526 1 18 . 1 1 13 13 LYS CB C 13 33.019 33.019 33.986 -0.967 19163 6527 1 18 . 1 1 13 13 LYS H H 13 8.281 8.281 8.790 -0.509 19163 6528 1 18 . 1 1 14 14 GLU N N 14 123.004 123.004 120.366 2.638 19163 6529 1 18 . 1 1 14 14 GLU HA H 14 4.305 4.305 4.468 -0.163 19163 6530 1 18 . 1 1 14 14 GLU C C 14 176.107 176.107 174.768 1.339 19163 6531 1 18 . 1 1 14 14 GLU CA C 14 56.343 56.343 56.864 -0.521 19163 6532 1 18 . 1 1 14 14 GLU CB C 14 30.534 30.534 30.797 -0.262 19163 6533 1 18 . 1 1 14 14 GLU H H 14 8.424 8.424 8.194 0.230 19163 6534 1 18 . 1 1 15 15 THR N N 15 115.895 115.895 120.076 -4.181 19163 6535 1 18 . 1 1 15 15 THR HA H 15 4.538 4.538 4.698 -0.160 19163 6536 1 18 . 1 1 15 15 THR C C 15 175.233 175.233 172.913 2.320 19163 6537 1 18 . 1 1 15 15 THR CA C 15 61.981 61.981 61.372 0.609 19163 6538 1 18 . 1 1 15 15 THR CB C 15 69.865 69.865 70.240 -0.375 19163 6539 1 18 . 1 1 15 15 THR H H 15 8.335 8.335 8.245 0.090 19163 6540 1 18 . 1 1 16 16 THR N N 16 116.992 116.992 116.186 0.806 19163 6541 1 18 . 1 1 16 16 THR HA H 16 4.366 4.366 4.377 -0.011 19163 6542 1 18 . 1 1 16 16 THR C C 16 176.090 176.090 174.100 1.990 19163 6543 1 18 . 1 1 16 16 THR CA C 16 62.172 62.172 60.072 2.100 19163 6544 1 18 . 1 1 16 16 THR CB C 16 71.997 71.997 70.502 1.495 19163 6545 1 18 . 1 1 16 16 THR H H 16 8.798 8.798 8.142 0.656 19163 6546 1 18 . 1 1 17 17 TYR N N 17 117.617 117.617 120.101 -2.484 19163 6547 1 18 . 1 1 17 17 TYR HA H 17 4.329 4.329 4.252 0.077 19163 6548 1 18 . 1 1 17 17 TYR C C 17 177.105 177.105 177.860 -0.755 19163 6549 1 18 . 1 1 17 17 TYR CA C 17 57.577 57.577 61.193 -3.616 19163 6550 1 18 . 1 1 17 17 TYR CB C 17 37.113 37.113 37.853 -0.741 19163 6551 1 18 . 1 1 17 17 TYR H H 17 8.292 8.292 8.540 -0.248 19163 6552 1 18 . 1 1 18 18 TYR N N 18 115.048 115.048 117.965 -2.917 19163 6553 1 18 . 1 1 18 18 TYR HA H 18 3.775 3.775 4.333 -0.558 19163 6554 1 18 . 1 1 18 18 TYR C C 18 177.771 177.771 177.811 -0.040 19163 6555 1 18 . 1 1 18 18 TYR CA C 18 61.430 61.430 59.227 2.203 19163 6556 1 18 . 1 1 18 18 TYR CB C 18 36.495 36.495 37.337 -0.842 19163 6557 1 18 . 1 1 18 18 TYR H H 18 7.047 7.047 7.801 -0.754 19163 6558 1 18 . 1 1 19 19 ASP N N 19 119.520 119.520 119.556 -0.036 19163 6559 1 18 . 1 1 19 19 ASP HA H 19 4.406 4.406 4.385 0.021 19163 6560 1 18 . 1 1 19 19 ASP C C 19 180.128 180.128 178.643 1.485 19163 6561 1 18 . 1 1 19 19 ASP CA C 19 57.475 57.475 57.355 0.120 19163 6562 1 18 . 1 1 19 19 ASP CB C 19 40.659 40.659 40.768 -0.109 19163 6563 1 18 . 1 1 19 19 ASP H H 19 7.685 7.685 7.625 0.060 19163 6564 1 18 . 1 1 20 20 VAL N N 20 119.772 119.772 119.915 -0.143 19163 6565 1 18 . 1 1 20 20 VAL HA H 20 3.608 3.608 3.730 -0.122 19163 6566 1 18 . 1 1 20 20 VAL C C 20 177.026 177.026 177.189 -0.163 19163 6567 1 18 . 1 1 20 20 VAL CA C 20 65.840 65.840 66.127 -0.287 19163 6568 1 18 . 1 1 20 20 VAL CB C 20 31.530 31.530 31.987 -0.457 19163 6569 1 18 . 1 1 20 20 VAL H H 20 8.004 8.004 8.288 -0.284 19163 6570 1 18 . 1 1 21 21 LEU N N 21 115.252 115.252 116.440 -1.188 19163 6571 1 18 . 1 1 21 21 LEU HA H 21 4.281 4.281 4.333 -0.052 19163 6572 1 18 . 1 1 21 21 LEU C C 21 175.757 175.757 176.753 -0.996 19163 6573 1 18 . 1 1 21 21 LEU CA C 21 54.554 54.554 54.514 0.040 19163 6574 1 18 . 1 1 21 21 LEU CB C 21 42.869 42.869 42.704 0.165 19163 6575 1 18 . 1 1 21 21 LEU H H 21 6.847 6.847 7.784 -0.937 19163 6576 1 18 . 1 1 22 22 GLY N N 22 108.227 108.227 107.441 0.786 19163 6577 1 18 . 1 1 22 22 GLY C C 22 175.361 175.361 174.242 1.119 19163 6578 1 18 . 1 1 22 22 GLY CA C 22 46.574 46.574 45.922 0.652 19163 6579 1 18 . 1 1 22 22 GLY H H 22 7.874 7.874 7.516 0.358 19163 6580 1 18 . 1 1 23 23 VAL N N 23 110.675 110.675 118.385 -7.710 19163 6581 1 18 . 1 1 23 23 VAL HA H 23 4.767 4.767 4.355 0.412 19163 6582 1 18 . 1 1 23 23 VAL C C 23 174.674 174.674 174.136 0.538 19163 6583 1 18 . 1 1 23 23 VAL CA C 23 58.349 58.349 59.974 -1.625 19163 6584 1 18 . 1 1 23 23 VAL CB C 23 34.938 34.938 34.843 0.095 19163 6585 1 18 . 1 1 23 23 VAL H H 23 7.815 7.815 8.094 -0.279 19163 6586 1 18 . 1 1 24 24 LYS N N 24 119.948 119.948 123.169 -3.221 19163 6587 1 18 . 1 1 24 24 LYS HA H 24 4.488 4.488 4.616 -0.128 19163 6588 1 18 . 1 1 24 24 LYS C C 24 175.442 175.442 175.524 -0.082 19163 6589 1 18 . 1 1 24 24 LYS CA C 24 54.001 54.001 53.671 0.330 19163 6590 1 18 . 1 1 24 24 LYS CB C 24 32.197 32.197 31.817 0.380 19163 6591 1 18 . 1 1 24 24 LYS H H 24 8.329 8.329 8.240 0.089 19163 6592 1 18 . 1 1 25 25 PRO HA H 25 2.421 2.421 4.019 -1.598 19163 6593 1 18 . 1 1 25 25 PRO C C 25 175.635 175.635 176.996 -1.361 19163 6594 1 18 . 1 1 25 25 PRO CA C 25 63.362 63.362 64.695 -1.333 19163 6595 1 18 . 1 1 25 25 PRO CB C 25 31.839 31.839 32.072 -0.233 19163 6596 1 18 . 1 1 26 26 ASN N N 26 111.739 111.739 113.903 -2.164 19163 6597 1 18 . 1 1 26 26 ASN HA H 26 4.518 4.518 4.672 -0.154 19163 6598 1 18 . 1 1 26 26 ASN C C 26 175.820 175.820 175.226 0.594 19163 6599 1 18 . 1 1 26 26 ASN CA C 26 51.525 51.525 51.930 -0.405 19163 6600 1 18 . 1 1 26 26 ASN CB C 26 36.829 36.829 38.414 -1.585 19163 6601 1 18 . 1 1 26 26 ASN H H 26 7.138 7.138 8.104 -0.966 19163 6602 1 18 . 1 1 27 27 ALA N N 27 122.829 122.829 124.269 -1.440 19163 6603 1 18 . 1 1 27 27 ALA HA H 27 4.325 4.325 4.273 0.052 19163 6604 1 18 . 1 1 27 27 ALA C C 27 178.726 178.726 176.817 1.909 19163 6605 1 18 . 1 1 27 27 ALA CA C 27 52.961 52.961 52.088 0.873 19163 6606 1 18 . 1 1 27 27 ALA CB C 27 19.159 19.159 19.548 -0.389 19163 6607 1 18 . 1 1 27 27 ALA H H 27 7.637 7.637 7.320 0.317 19163 6608 1 18 . 1 1 28 28 THR N N 28 113.468 113.468 114.209 -0.741 19163 6609 1 18 . 1 1 28 28 THR HA H 28 4.493 4.493 4.316 0.177 19163 6610 1 18 . 1 1 28 28 THR C C 28 175.641 175.641 175.760 -0.119 19163 6611 1 18 . 1 1 28 28 THR CA C 28 60.592 60.592 61.158 -0.566 19163 6612 1 18 . 1 1 28 28 THR CB C 28 71.304 71.304 70.400 0.904 19163 6613 1 18 . 1 1 28 28 THR H H 28 8.829 8.829 8.050 0.779 19163 6614 1 18 . 1 1 29 29 GLN N N 29 119.445 119.445 122.188 -2.743 19163 6615 1 18 . 1 1 29 29 GLN HA H 29 4.035 4.035 3.931 0.104 19163 6616 1 18 . 1 1 29 29 GLN C C 29 179.117 179.117 178.324 0.793 19163 6617 1 18 . 1 1 29 29 GLN CA C 29 59.435 59.435 60.285 -0.850 19163 6618 1 18 . 1 1 29 29 GLN CB C 29 27.851 27.851 28.326 -0.475 19163 6619 1 18 . 1 1 29 29 GLN H H 29 9.015 9.015 8.795 0.220 19163 6620 1 18 . 1 1 30 30 GLU N N 30 119.343 119.343 118.706 0.637 19163 6621 1 18 . 1 1 30 30 GLU HA H 30 4.059 4.059 4.086 -0.027 19163 6622 1 18 . 1 1 30 30 GLU C C 30 179.097 179.097 178.624 0.473 19163 6623 1 18 . 1 1 30 30 GLU CA C 30 59.847 59.847 59.564 0.283 19163 6624 1 18 . 1 1 30 30 GLU CB C 30 29.356 29.356 29.250 0.106 19163 6625 1 18 . 1 1 30 30 GLU H H 30 8.549 8.549 8.559 -0.010 19163 6626 1 18 . 1 1 31 31 GLU N N 31 120.562 120.562 120.660 -0.098 19163 6627 1 18 . 1 1 31 31 GLU HA H 31 3.906 3.906 4.112 -0.206 19163 6628 1 18 . 1 1 31 31 GLU C C 31 180.405 180.405 179.052 1.353 19163 6629 1 18 . 1 1 31 31 GLU CA C 31 59.592 59.592 59.030 0.562 19163 6630 1 18 . 1 1 31 31 GLU CB C 31 29.989 29.989 29.217 0.772 19163 6631 1 18 . 1 1 31 31 GLU H H 31 7.768 7.768 8.250 -0.482 19163 6632 1 18 . 1 1 32 32 LEU N N 32 120.518 120.518 120.434 0.084 19163 6633 1 18 . 1 1 32 32 LEU HA H 32 3.963 3.963 4.029 -0.066 19163 6634 1 18 . 1 1 32 32 LEU C C 32 177.873 177.873 179.094 -1.221 19163 6635 1 18 . 1 1 32 32 LEU CA C 32 58.593 58.593 57.898 0.695 19163 6636 1 18 . 1 1 32 32 LEU CB C 32 42.556 42.556 41.248 1.308 19163 6637 1 18 . 1 1 32 32 LEU H H 32 8.475 8.475 8.550 -0.075 19163 6638 1 18 . 1 1 33 33 LYS N N 33 119.091 119.091 119.405 -0.314 19163 6639 1 18 . 1 1 33 33 LYS HA H 33 4.000 4.000 4.206 -0.206 19163 6640 1 18 . 1 1 33 33 LYS C C 33 178.701 178.701 178.763 -0.062 19163 6641 1 18 . 1 1 33 33 LYS CA C 33 60.274 60.274 59.958 0.316 19163 6642 1 18 . 1 1 33 33 LYS CB C 33 32.656 32.656 32.424 0.232 19163 6643 1 18 . 1 1 33 33 LYS H H 33 8.077 8.077 7.799 0.278 19163 6644 1 18 . 1 1 34 34 LYS N N 34 118.527 118.527 119.689 -1.162 19163 6645 1 18 . 1 1 34 34 LYS HA H 34 3.890 3.890 4.060 -0.170 19163 6646 1 18 . 1 1 34 34 LYS C C 34 179.172 179.172 178.778 0.394 19163 6647 1 18 . 1 1 34 34 LYS CA C 34 59.927 59.927 59.502 0.425 19163 6648 1 18 . 1 1 34 34 LYS CB C 34 32.869 32.869 32.472 0.397 19163 6649 1 18 . 1 1 34 34 LYS H H 34 7.986 7.986 8.150 -0.164 19163 6650 1 18 . 1 1 35 35 ALA N N 35 122.190 122.190 122.105 0.085 19163 6651 1 18 . 1 1 35 35 ALA HA H 35 4.116 4.116 4.047 0.069 19163 6652 1 18 . 1 1 35 35 ALA C C 35 179.982 179.982 178.995 0.987 19163 6653 1 18 . 1 1 35 35 ALA CA C 35 55.157 55.157 55.346 -0.188 19163 6654 1 18 . 1 1 35 35 ALA CB C 35 18.773 18.773 18.363 0.410 19163 6655 1 18 . 1 1 35 35 ALA H H 35 7.917 7.917 8.438 -0.521 19163 6656 1 18 . 1 1 36 36 TYR N N 36 117.701 117.701 120.559 -2.858 19163 6657 1 18 . 1 1 36 36 TYR HA H 36 3.818 3.818 4.074 -0.256 19163 6658 1 18 . 1 1 36 36 TYR C C 36 176.344 176.344 177.578 -1.234 19163 6659 1 18 . 1 1 36 36 TYR CA C 36 61.468 61.468 61.552 -0.084 19163 6660 1 18 . 1 1 36 36 TYR CB C 36 38.890 38.890 38.487 0.403 19163 6661 1 18 . 1 1 36 36 TYR H H 36 8.402 8.402 8.005 0.397 19163 6662 1 18 . 1 1 37 37 ARG N N 37 117.423 117.423 119.033 -1.610 19163 6663 1 18 . 1 1 37 37 ARG HA H 37 3.481 3.481 3.715 -0.234 19163 6664 1 18 . 1 1 37 37 ARG C C 37 178.825 178.825 178.322 0.503 19163 6665 1 18 . 1 1 37 37 ARG CA C 37 59.397 59.397 59.637 -0.240 19163 6666 1 18 . 1 1 37 37 ARG CB C 37 29.710 29.710 30.087 -0.377 19163 6667 1 18 . 1 1 37 37 ARG H H 37 8.264 8.264 8.492 -0.228 19163 6668 1 18 . 1 1 38 38 LYS N N 38 117.247 117.247 120.051 -2.804 19163 6669 1 18 . 1 1 38 38 LYS HA H 38 3.905 3.905 4.045 -0.140 19163 6670 1 18 . 1 1 38 38 LYS C C 38 179.444 179.444 179.190 0.254 19163 6671 1 18 . 1 1 38 38 LYS CA C 38 59.450 59.450 59.516 -0.066 19163 6672 1 18 . 1 1 38 38 LYS CB C 38 32.609 32.609 32.384 0.225 19163 6673 1 18 . 1 1 38 38 LYS H H 38 7.444 7.444 7.798 -0.354 19163 6674 1 18 . 1 1 39 39 LEU N N 39 119.901 119.901 119.259 0.642 19163 6675 1 18 . 1 1 39 39 LEU HA H 39 4.020 4.020 4.205 -0.185 19163 6676 1 18 . 1 1 39 39 LEU C C 39 178.801 178.801 178.888 -0.087 19163 6677 1 18 . 1 1 39 39 LEU CA C 39 57.409 57.409 57.623 -0.214 19163 6678 1 18 . 1 1 39 39 LEU CB C 39 42.388 42.388 41.680 0.708 19163 6679 1 18 . 1 1 39 39 LEU H H 39 7.707 7.707 8.290 -0.583 19163 6680 1 18 . 1 1 40 40 ALA N N 40 122.772 122.772 122.282 0.490 19163 6681 1 18 . 1 1 40 40 ALA HA H 40 3.849 3.849 4.197 -0.348 19163 6682 1 18 . 1 1 40 40 ALA C C 40 179.446 179.446 179.264 0.182 19163 6683 1 18 . 1 1 40 40 ALA CA C 40 55.109 55.109 55.152 -0.043 19163 6684 1 18 . 1 1 40 40 ALA CB C 40 17.116 17.116 17.975 -0.859 19163 6685 1 18 . 1 1 40 40 ALA H H 40 8.931 8.931 8.157 0.774 19163 6686 1 18 . 1 1 41 41 LEU N N 41 115.299 115.299 117.422 -2.123 19163 6687 1 18 . 1 1 41 41 LEU HA H 41 3.977 3.977 3.921 0.056 19163 6688 1 18 . 1 1 41 41 LEU C C 41 178.216 178.216 179.491 -1.275 19163 6689 1 18 . 1 1 41 41 LEU CA C 41 57.088 57.088 57.291 -0.203 19163 6690 1 18 . 1 1 41 41 LEU CB C 41 42.162 42.162 41.847 0.315 19163 6691 1 18 . 1 1 41 41 LEU H H 41 7.133 7.133 7.540 -0.407 19163 6692 1 18 . 1 1 42 42 LYS N N 42 116.812 116.812 118.392 -1.580 19163 6693 1 18 . 1 1 42 42 LYS HA H 42 3.925 3.925 4.075 -0.150 19163 6694 1 18 . 1 1 42 42 LYS C C 42 177.560 177.560 178.119 -0.559 19163 6695 1 18 . 1 1 42 42 LYS CA C 42 57.885 57.885 58.415 -0.530 19163 6696 1 18 . 1 1 42 42 LYS CB C 42 33.427 33.427 32.693 0.734 19163 6697 1 18 . 1 1 42 42 LYS H H 42 7.038 7.038 7.485 -0.447 19163 6698 1 18 . 1 1 43 43 TYR N N 43 114.022 114.022 114.200 -0.178 19163 6699 1 18 . 1 1 43 43 TYR HA H 43 4.665 4.665 4.626 0.039 19163 6700 1 18 . 1 1 43 43 TYR C C 43 173.741 173.741 174.521 -0.780 19163 6701 1 18 . 1 1 43 43 TYR CA C 43 56.928 56.928 57.048 -0.120 19163 6702 1 18 . 1 1 43 43 TYR CB C 43 39.579 39.579 38.302 1.277 19163 6703 1 18 . 1 1 43 43 TYR H H 43 7.683 7.683 8.125 -0.442 19163 6704 1 18 . 1 1 44 44 HIS N N 44 120.947 120.947 123.239 -2.292 19163 6705 1 18 . 1 1 44 44 HIS HA H 44 3.697 3.697 4.220 -0.523 19163 6706 1 18 . 1 1 44 44 HIS C C 44 174.925 174.925 174.467 0.458 19163 6707 1 18 . 1 1 44 44 HIS CA C 44 56.229 56.229 55.462 0.768 19163 6708 1 18 . 1 1 44 44 HIS CB C 44 30.852 30.852 30.311 0.541 19163 6709 1 18 . 1 1 44 44 HIS H H 44 7.814 7.814 7.472 0.342 19163 6710 1 18 . 1 1 45 45 PRO HA H 45 4.131 4.131 4.377 -0.246 19163 6711 1 18 . 1 1 45 45 PRO C C 45 177.269 177.269 177.095 0.174 19163 6712 1 18 . 1 1 45 45 PRO CA C 45 64.723 64.723 64.973 -0.250 19163 6713 1 18 . 1 1 45 45 PRO CB C 45 32.070 32.070 31.716 0.354 19163 6714 1 18 . 1 1 46 46 ASP N N 46 119.127 119.127 115.592 3.535 19163 6715 1 18 . 1 1 46 46 ASP HA H 46 4.375 4.375 4.287 0.088 19163 6716 1 18 . 1 1 46 46 ASP C C 46 177.284 177.284 176.681 0.603 19163 6717 1 18 . 1 1 46 46 ASP CA C 46 56.020 56.020 56.082 -0.062 19163 6718 1 18 . 1 1 46 46 ASP CB C 46 40.221 40.221 40.208 0.013 19163 6719 1 18 . 1 1 46 46 ASP H H 46 10.040 10.040 7.552 2.488 19163 6720 1 18 . 1 1 47 47 LYS N N 47 117.416 117.416 119.152 -1.736 19163 6721 1 18 . 1 1 47 47 LYS HA H 47 4.315 4.315 4.273 0.042 19163 6722 1 18 . 1 1 47 47 LYS C C 47 176.355 176.355 176.371 -0.016 19163 6723 1 18 . 1 1 47 47 LYS CA C 47 55.880 55.880 57.429 -1.549 19163 6724 1 18 . 1 1 47 47 LYS CB C 47 33.778 33.778 34.712 -0.934 19163 6725 1 18 . 1 1 47 47 LYS H H 47 7.826 7.826 7.410 0.416 19163 6726 1 18 . 1 1 48 48 ASN N N 48 116.573 116.573 118.939 -2.366 19163 6727 1 18 . 1 1 48 48 ASN HA H 48 5.021 5.021 5.164 -0.143 19163 6728 1 18 . 1 1 48 48 ASN C C 48 172.992 172.992 173.647 -0.655 19163 6729 1 18 . 1 1 48 48 ASN CA C 48 50.467 50.467 50.620 -0.153 19163 6730 1 18 . 1 1 48 48 ASN CB C 48 39.284 39.284 38.949 0.335 19163 6731 1 18 . 1 1 48 48 ASN H H 48 7.956 7.956 8.280 -0.324 19163 6732 1 18 . 1 1 49 49 PRO HA H 49 4.448 4.448 4.311 0.137 19163 6733 1 18 . 1 1 49 49 PRO C C 49 178.030 178.030 177.770 0.260 19163 6734 1 18 . 1 1 49 49 PRO CA C 49 64.468 64.468 65.145 -0.677 19163 6735 1 18 . 1 1 49 49 PRO CB C 49 32.173 32.173 31.936 0.237 19163 6736 1 18 . 1 1 50 50 ASN N N 50 115.567 115.567 114.092 1.475 19163 6737 1 18 . 1 1 50 50 ASN HA H 50 4.748 4.748 4.638 0.111 19163 6738 1 18 . 1 1 50 50 ASN C C 50 176.443 176.443 176.280 0.163 19163 6739 1 18 . 1 1 50 50 ASN CA C 50 54.677 54.677 54.828 -0.151 19163 6740 1 18 . 1 1 50 50 ASN CB C 50 39.014 39.014 37.538 1.476 19163 6741 1 18 . 1 1 50 50 ASN H H 50 8.398 8.398 8.680 -0.282 19163 6742 1 18 . 1 1 51 51 GLU N N 51 119.270 119.270 117.972 1.298 19163 6743 1 18 . 1 1 51 51 GLU HA H 51 4.797 4.797 4.674 0.123 19163 6744 1 18 . 1 1 51 51 GLU C C 51 176.922 176.922 177.823 -0.901 19163 6745 1 18 . 1 1 51 51 GLU CA C 51 55.916 55.916 55.928 -0.013 19163 6746 1 18 . 1 1 51 51 GLU CB C 51 29.200 29.200 29.680 -0.480 19163 6747 1 18 . 1 1 51 51 GLU H H 51 7.485 7.485 8.073 -0.588 19163 6748 1 18 . 1 1 52 52 GLY N N 52 107.541 107.541 108.873 -1.332 19163 6749 1 18 . 1 1 52 52 GLY C C 52 176.755 176.755 175.578 1.177 19163 6750 1 18 . 1 1 52 52 GLY CA C 52 47.914 47.914 47.245 0.669 19163 6751 1 18 . 1 1 52 52 GLY H H 52 8.092 8.092 7.733 0.359 19163 6752 1 18 . 1 1 53 53 GLU N N 53 121.603 121.603 120.713 0.890 19163 6753 1 18 . 1 1 53 53 GLU HA H 53 4.065 4.065 4.112 -0.047 19163 6754 1 18 . 1 1 53 53 GLU C C 53 179.052 179.052 178.656 0.396 19163 6755 1 18 . 1 1 53 53 GLU CA C 53 59.280 59.280 59.700 -0.420 19163 6756 1 18 . 1 1 53 53 GLU CB C 53 28.968 28.968 29.279 -0.311 19163 6757 1 18 . 1 1 53 53 GLU H H 53 8.496 8.496 8.441 0.055 19163 6758 1 18 . 1 1 54 54 LYS N N 54 120.837 120.837 118.959 1.878 19163 6759 1 18 . 1 1 54 54 LYS HA H 54 3.923 3.923 4.242 -0.319 19163 6760 1 18 . 1 1 54 54 LYS C C 54 179.058 179.058 179.198 -0.140 19163 6761 1 18 . 1 1 54 54 LYS CA C 54 58.800 58.800 58.527 0.273 19163 6762 1 18 . 1 1 54 54 LYS CB C 54 31.551 31.551 31.853 -0.302 19163 6763 1 18 . 1 1 54 54 LYS H H 54 7.857 7.857 7.656 0.201 19163 6764 1 18 . 1 1 55 55 PHE N N 55 118.608 118.608 120.792 -2.184 19163 6765 1 18 . 1 1 55 55 PHE HA H 55 4.021 4.021 4.136 -0.115 19163 6766 1 18 . 1 1 55 55 PHE C C 55 178.001 178.001 176.943 1.058 19163 6767 1 18 . 1 1 55 55 PHE CA C 55 61.911 61.911 61.096 0.815 19163 6768 1 18 . 1 1 55 55 PHE CB C 55 38.553 38.553 39.227 -0.674 19163 6769 1 18 . 1 1 55 55 PHE H H 55 8.382 8.382 8.328 0.054 19163 6770 1 18 . 1 1 56 56 LYS N N 56 120.898 120.898 119.765 1.133 19163 6771 1 18 . 1 1 56 56 LYS HA H 56 3.828 3.828 3.871 -0.043 19163 6772 1 18 . 1 1 56 56 LYS C C 56 178.817 178.817 178.609 0.208 19163 6773 1 18 . 1 1 56 56 LYS CA C 56 59.877 59.877 60.394 -0.517 19163 6774 1 18 . 1 1 56 56 LYS CB C 56 32.133 32.133 32.042 0.091 19163 6775 1 18 . 1 1 56 56 LYS H H 56 8.111 8.111 8.078 0.033 19163 6776 1 18 . 1 1 57 57 GLN N N 57 118.600 118.600 118.148 0.452 19163 6777 1 18 . 1 1 57 57 GLN HA H 57 4.009 4.009 4.077 -0.068 19163 6778 1 18 . 1 1 57 57 GLN C C 57 179.333 179.333 178.656 0.677 19163 6779 1 18 . 1 1 57 57 GLN CA C 57 59.109 59.109 58.780 0.329 19163 6780 1 18 . 1 1 57 57 GLN CB C 57 28.595 28.595 28.596 -0.002 19163 6781 1 18 . 1 1 57 57 GLN H H 57 7.613 7.613 7.610 0.003 19163 6782 1 18 . 1 1 58 58 ILE N N 58 118.709 118.709 120.756 -2.047 19163 6783 1 18 . 1 1 58 58 ILE HA H 58 3.559 3.559 3.589 -0.030 19163 6784 1 18 . 1 1 58 58 ILE C C 58 177.152 177.152 177.973 -0.821 19163 6785 1 18 . 1 1 58 58 ILE CA C 58 65.068 65.068 65.693 -0.625 19163 6786 1 18 . 1 1 58 58 ILE CB C 58 38.381 38.381 37.574 0.807 19163 6787 1 18 . 1 1 58 58 ILE H H 58 8.011 8.011 7.553 0.458 19163 6788 1 18 . 1 1 59 59 SER N N 59 116.112 116.112 115.123 0.989 19163 6789 1 18 . 1 1 59 59 SER HA H 59 3.948 3.948 4.011 -0.063 19163 6790 1 18 . 1 1 59 59 SER C C 59 175.949 175.949 176.889 -0.940 19163 6791 1 18 . 1 1 59 59 SER CA C 59 62.315 62.315 61.741 0.574 19163 6792 1 18 . 1 1 59 59 SER H H 59 8.030 8.030 8.190 -0.160 19163 6793 1 18 . 1 1 60 60 GLN N N 60 122.099 122.099 120.552 1.547 19163 6794 1 18 . 1 1 60 60 GLN HA H 60 3.801 3.801 3.887 -0.086 19163 6795 1 18 . 1 1 60 60 GLN C C 60 176.942 176.942 177.996 -1.054 19163 6796 1 18 . 1 1 60 60 GLN CA C 60 58.762 58.762 58.714 0.048 19163 6797 1 18 . 1 1 60 60 GLN CB C 60 28.498 28.498 28.643 -0.145 19163 6798 1 18 . 1 1 60 60 GLN H H 60 7.933 7.933 7.847 0.086 19163 6799 1 18 . 1 1 61 61 ALA N N 61 119.367 119.367 122.746 -3.379 19163 6800 1 18 . 1 1 61 61 ALA HA H 61 2.636 2.636 3.388 -0.752 19163 6801 1 18 . 1 1 61 61 ALA C C 61 178.507 178.507 178.799 -0.292 19163 6802 1 18 . 1 1 61 61 ALA CA C 61 54.126 54.126 55.051 -0.925 19163 6803 1 18 . 1 1 61 61 ALA CB C 61 18.462 18.462 18.460 0.002 19163 6804 1 18 . 1 1 61 61 ALA H H 61 7.354 7.354 8.079 -0.725 19163 6805 1 18 . 1 1 62 62 TYR N N 62 115.613 115.613 119.779 -4.166 19163 6806 1 18 . 1 1 62 62 TYR HA H 62 3.633 3.633 3.908 -0.275 19163 6807 1 18 . 1 1 62 62 TYR C C 62 177.421 177.421 177.405 0.016 19163 6808 1 18 . 1 1 62 62 TYR CA C 62 61.676 61.676 61.476 0.200 19163 6809 1 18 . 1 1 62 62 TYR CB C 62 39.162 39.162 38.136 1.026 19163 6810 1 18 . 1 1 62 62 TYR H H 62 7.994 7.994 8.388 -0.394 19163 6811 1 18 . 1 1 63 63 GLU N N 63 121.396 121.396 119.824 1.572 19163 6812 1 18 . 1 1 63 63 GLU HA H 63 3.347 3.347 3.688 -0.341 19163 6813 1 18 . 1 1 63 63 GLU C C 63 177.687 177.687 178.696 -1.009 19163 6814 1 18 . 1 1 63 63 GLU CA C 63 59.562 59.562 59.169 0.393 19163 6815 1 18 . 1 1 63 63 GLU CB C 63 29.115 29.115 29.547 -0.432 19163 6816 1 18 . 1 1 63 63 GLU H H 63 8.151 8.151 7.957 0.194 19163 6817 1 18 . 1 1 64 64 VAL N N 64 115.850 115.850 118.393 -2.543 19163 6818 1 18 . 1 1 64 64 VAL HA H 64 3.377 3.377 3.671 -0.294 19163 6819 1 18 . 1 1 64 64 VAL C C 64 175.925 175.925 177.223 -1.298 19163 6820 1 18 . 1 1 64 64 VAL CA C 64 65.806 65.806 65.306 0.500 19163 6821 1 18 . 1 1 64 64 VAL CB C 64 31.786 31.786 31.843 -0.057 19163 6822 1 18 . 1 1 64 64 VAL H H 64 6.814 6.814 7.208 -0.394 19163 6823 1 18 . 1 1 65 65 LEU N N 65 111.438 111.438 119.253 -7.815 19163 6824 1 18 . 1 1 65 65 LEU HA H 65 3.569 3.569 4.003 -0.434 19163 6825 1 18 . 1 1 65 65 LEU C C 65 177.124 177.124 178.883 -1.759 19163 6826 1 18 . 1 1 65 65 LEU CA C 65 56.645 56.645 57.419 -0.774 19163 6827 1 18 . 1 1 65 65 LEU CB C 65 42.589 42.589 41.014 1.575 19163 6828 1 18 . 1 1 65 65 LEU H H 65 7.398 7.398 8.266 -0.868 19163 6829 1 18 . 1 1 66 66 SER N N 66 108.642 108.642 112.961 -4.319 19163 6830 1 18 . 1 1 66 66 SER HA H 66 4.028 4.028 4.008 0.020 19163 6831 1 18 . 1 1 66 66 SER C C 66 173.286 173.286 174.237 -0.951 19163 6832 1 18 . 1 1 66 66 SER CA C 66 59.232 59.232 60.566 -1.334 19163 6833 1 18 . 1 1 66 66 SER CB C 66 63.066 63.066 62.913 0.153 19163 6834 1 18 . 1 1 66 66 SER H H 66 7.700 7.700 7.742 -0.042 19163 6835 1 18 . 1 1 67 67 ASP N N 67 124.276 124.276 122.910 1.366 19163 6836 1 18 . 1 1 67 67 ASP HA H 67 4.668 4.668 4.721 -0.053 19163 6837 1 18 . 1 1 67 67 ASP C C 67 174.913 174.913 175.798 -0.885 19163 6838 1 18 . 1 1 67 67 ASP CA C 67 52.487 52.487 53.611 -1.124 19163 6839 1 18 . 1 1 67 67 ASP CB C 67 43.218 43.218 41.200 2.018 19163 6840 1 18 . 1 1 67 67 ASP H H 67 6.879 6.879 7.216 -0.337 19163 6841 1 18 . 1 1 68 68 ALA N N 68 127.326 127.326 129.851 -2.525 19163 6842 1 18 . 1 1 68 68 ALA HA H 68 3.853 3.853 3.912 -0.059 19163 6843 1 18 . 1 1 68 68 ALA C C 68 180.336 180.336 179.159 1.177 19163 6844 1 18 . 1 1 68 68 ALA CA C 68 55.912 55.912 55.531 0.381 19163 6845 1 18 . 1 1 68 68 ALA CB C 68 18.645 18.645 18.795 -0.150 19163 6846 1 18 . 1 1 68 68 ALA H H 68 8.693 8.693 8.798 -0.105 19163 6847 1 18 . 1 1 69 69 LYS N N 69 116.929 116.929 118.103 -1.174 19163 6848 1 18 . 1 1 69 69 LYS HA H 69 4.162 4.162 4.007 0.155 19163 6849 1 18 . 1 1 69 69 LYS C C 69 179.515 179.515 178.595 0.920 19163 6850 1 18 . 1 1 69 69 LYS CA C 69 58.562 58.562 59.629 -1.067 19163 6851 1 18 . 1 1 69 69 LYS CB C 69 31.840 31.840 32.063 -0.223 19163 6852 1 18 . 1 1 69 69 LYS H H 69 7.950 7.950 8.351 -0.401 19163 6853 1 18 . 1 1 70 70 LYS N N 70 121.286 121.286 118.421 2.865 19163 6854 1 18 . 1 1 70 70 LYS HA H 70 3.960 3.960 3.984 -0.024 19163 6855 1 18 . 1 1 70 70 LYS C C 70 179.938 179.938 179.054 0.884 19163 6856 1 18 . 1 1 70 70 LYS CA C 70 60.066 60.066 59.475 0.591 19163 6857 1 18 . 1 1 70 70 LYS CB C 70 32.695 32.695 32.011 0.684 19163 6858 1 18 . 1 1 70 70 LYS H H 70 8.184 8.184 7.545 0.639 19163 6859 1 18 . 1 1 71 71 ARG N N 71 122.794 122.794 119.713 3.081 19163 6860 1 18 . 1 1 71 71 ARG HA H 71 3.668 3.668 3.947 -0.279 19163 6861 1 18 . 1 1 71 71 ARG C C 71 177.356 177.356 178.269 -0.913 19163 6862 1 18 . 1 1 71 71 ARG CA C 71 60.127 60.127 60.257 -0.130 19163 6863 1 18 . 1 1 71 71 ARG CB C 71 29.668 29.668 30.244 -0.577 19163 6864 1 18 . 1 1 71 71 ARG H H 71 9.290 9.290 8.603 0.687 19163 6865 1 18 . 1 1 72 72 GLU N N 72 118.390 118.390 119.633 -1.243 19163 6866 1 18 . 1 1 72 72 GLU HA H 72 4.096 4.096 4.139 -0.043 19163 6867 1 18 . 1 1 72 72 GLU C C 72 179.073 179.073 179.011 0.062 19163 6868 1 18 . 1 1 72 72 GLU CA C 72 59.456 59.456 59.279 0.177 19163 6869 1 18 . 1 1 72 72 GLU CB C 72 29.615 29.615 29.576 0.039 19163 6870 1 18 . 1 1 72 72 GLU H H 72 7.607 7.607 7.736 -0.129 19163 6871 1 18 . 1 1 73 73 LEU N N 73 117.921 117.921 120.381 -2.460 19163 6872 1 18 . 1 1 73 73 LEU HA H 73 4.032 4.032 3.985 0.047 19163 6873 1 18 . 1 1 73 73 LEU C C 73 179.696 179.696 179.010 0.686 19163 6874 1 18 . 1 1 73 73 LEU CA C 73 57.597 57.597 57.901 -0.304 19163 6875 1 18 . 1 1 73 73 LEU CB C 73 41.815 41.815 41.649 0.166 19163 6876 1 18 . 1 1 73 73 LEU H H 73 7.398 7.398 7.948 -0.550 19163 6877 1 18 . 1 1 74 74 TYR N N 74 122.662 122.662 120.378 2.284 19163 6878 1 18 . 1 1 74 74 TYR HA H 74 4.092 4.092 4.067 0.025 19163 6879 1 18 . 1 1 74 74 TYR C C 74 178.166 178.166 177.456 0.710 19163 6880 1 18 . 1 1 74 74 TYR CA C 74 61.458 61.458 61.647 -0.189 19163 6881 1 18 . 1 1 74 74 TYR CB C 74 38.778 38.778 38.469 0.309 19163 6882 1 18 . 1 1 74 74 TYR H H 74 8.316 8.316 8.375 -0.059 19163 6883 1 18 . 1 1 75 75 ASP N N 75 118.842 118.842 119.144 -0.302 19163 6884 1 18 . 1 1 75 75 ASP HA H 75 4.423 4.423 4.362 0.061 19163 6885 1 18 . 1 1 75 75 ASP C C 75 177.726 177.726 177.733 -0.007 19163 6886 1 18 . 1 1 75 75 ASP CA C 75 56.177 56.177 56.225 -0.048 19163 6887 1 18 . 1 1 75 75 ASP CB C 75 40.800 40.800 40.982 -0.182 19163 6888 1 18 . 1 1 75 75 ASP H H 75 8.770 8.770 8.100 0.670 19163 6889 1 18 . 1 1 76 76 LYS N N 76 118.955 118.955 118.455 0.500 19163 6890 1 18 . 1 1 76 76 LYS HA H 76 4.130 4.130 4.199 -0.069 19163 6891 1 18 . 1 1 76 76 LYS C C 76 177.006 177.006 177.281 -0.275 19163 6892 1 18 . 1 1 76 76 LYS CA C 76 57.537 57.537 57.283 0.254 19163 6893 1 18 . 1 1 76 76 LYS CB C 76 33.136 33.136 33.456 -0.320 19163 6894 1 18 . 1 1 76 76 LYS H H 76 7.610 7.610 7.824 -0.214 19163 6895 1 19 . 1 1 11 11 MET HA H 11 4.346 4.346 4.537 -0.191 19163 6896 1 19 . 1 1 11 11 MET C C 11 175.801 175.801 176.051 -0.250 19163 6897 1 19 . 1 1 11 11 MET CA C 11 55.614 55.614 54.710 0.904 19163 6898 1 19 . 1 1 11 11 MET CB C 11 32.925 32.925 33.761 -0.836 19163 6899 1 19 . 1 1 12 12 VAL N N 12 121.226 121.226 119.224 2.002 19163 6900 1 19 . 1 1 12 12 VAL HA H 12 4.026 4.026 4.065 -0.039 19163 6901 1 19 . 1 1 12 12 VAL C C 12 175.701 175.701 175.383 0.318 19163 6902 1 19 . 1 1 12 12 VAL CA C 12 62.188 62.188 61.710 0.478 19163 6903 1 19 . 1 1 12 12 VAL CB C 12 32.882 32.882 30.046 2.836 19163 6904 1 19 . 1 1 12 12 VAL H H 12 7.988 7.988 8.281 -0.293 19163 6905 1 19 . 1 1 13 13 LYS N N 13 125.255 125.255 128.047 -2.792 19163 6906 1 19 . 1 1 13 13 LYS HA H 13 4.211 4.211 4.429 -0.218 19163 6907 1 19 . 1 1 13 13 LYS C C 13 176.121 176.121 175.422 0.699 19163 6908 1 19 . 1 1 13 13 LYS CA C 13 56.355 56.355 55.849 0.506 19163 6909 1 19 . 1 1 13 13 LYS CB C 13 33.019 33.019 32.806 0.213 19163 6910 1 19 . 1 1 13 13 LYS H H 13 8.281 8.281 7.860 0.421 19163 6911 1 19 . 1 1 14 14 GLU N N 14 123.004 123.004 122.440 0.564 19163 6912 1 19 . 1 1 14 14 GLU HA H 14 4.305 4.305 4.031 0.274 19163 6913 1 19 . 1 1 14 14 GLU C C 14 176.107 176.107 175.319 0.788 19163 6914 1 19 . 1 1 14 14 GLU CA C 14 56.343 56.343 56.535 -0.193 19163 6915 1 19 . 1 1 14 14 GLU CB C 14 30.534 30.534 29.256 1.278 19163 6916 1 19 . 1 1 14 14 GLU H H 14 8.424 8.424 8.605 -0.181 19163 6917 1 19 . 1 1 15 15 THR N N 15 115.895 115.895 115.505 0.390 19163 6918 1 19 . 1 1 15 15 THR HA H 15 4.538 4.538 4.495 0.043 19163 6919 1 19 . 1 1 15 15 THR C C 15 175.233 175.233 173.871 1.362 19163 6920 1 19 . 1 1 15 15 THR CA C 15 61.981 61.981 62.260 -0.279 19163 6921 1 19 . 1 1 15 15 THR CB C 15 69.865 69.865 69.563 0.302 19163 6922 1 19 . 1 1 15 15 THR H H 15 8.335 8.335 8.101 0.234 19163 6923 1 19 . 1 1 16 16 THR N N 16 116.992 116.992 117.167 -0.175 19163 6924 1 19 . 1 1 16 16 THR HA H 16 4.366 4.366 4.498 -0.133 19163 6925 1 19 . 1 1 16 16 THR C C 16 176.090 176.090 174.855 1.235 19163 6926 1 19 . 1 1 16 16 THR CA C 16 62.172 62.172 59.035 3.138 19163 6927 1 19 . 1 1 16 16 THR CB C 16 71.997 71.997 70.008 1.988 19163 6928 1 19 . 1 1 16 16 THR H H 16 8.798 8.798 7.940 0.858 19163 6929 1 19 . 1 1 17 17 TYR N N 17 117.617 117.617 119.722 -2.105 19163 6930 1 19 . 1 1 17 17 TYR HA H 17 4.329 4.329 4.292 0.037 19163 6931 1 19 . 1 1 17 17 TYR C C 17 177.105 177.105 177.782 -0.677 19163 6932 1 19 . 1 1 17 17 TYR CA C 17 57.577 57.577 62.236 -4.659 19163 6933 1 19 . 1 1 17 17 TYR CB C 17 37.113 37.113 38.160 -1.047 19163 6934 1 19 . 1 1 17 17 TYR H H 17 8.292 8.292 8.873 -0.581 19163 6935 1 19 . 1 1 18 18 TYR N N 18 115.048 115.048 117.606 -2.558 19163 6936 1 19 . 1 1 18 18 TYR HA H 18 3.775 3.775 4.337 -0.562 19163 6937 1 19 . 1 1 18 18 TYR C C 18 177.771 177.771 177.679 0.092 19163 6938 1 19 . 1 1 18 18 TYR CA C 18 61.430 61.430 61.887 -0.457 19163 6939 1 19 . 1 1 18 18 TYR CB C 18 36.495 36.495 37.514 -1.019 19163 6940 1 19 . 1 1 18 18 TYR H H 18 7.047 7.047 8.378 -1.331 19163 6941 1 19 . 1 1 19 19 ASP N N 19 119.520 119.520 119.196 0.324 19163 6942 1 19 . 1 1 19 19 ASP HA H 19 4.406 4.406 4.502 -0.096 19163 6943 1 19 . 1 1 19 19 ASP C C 19 180.128 180.128 178.717 1.411 19163 6944 1 19 . 1 1 19 19 ASP CA C 19 57.475 57.475 57.434 0.041 19163 6945 1 19 . 1 1 19 19 ASP CB C 19 40.659 40.659 40.516 0.143 19163 6946 1 19 . 1 1 19 19 ASP H H 19 7.685 7.685 8.560 -0.875 19163 6947 1 19 . 1 1 20 20 VAL N N 20 119.772 119.772 119.221 0.551 19163 6948 1 19 . 1 1 20 20 VAL HA H 20 3.608 3.608 3.783 -0.175 19163 6949 1 19 . 1 1 20 20 VAL C C 20 177.026 177.026 177.283 -0.257 19163 6950 1 19 . 1 1 20 20 VAL CA C 20 65.840 65.840 65.571 0.269 19163 6951 1 19 . 1 1 20 20 VAL CB C 20 31.530 31.530 31.924 -0.394 19163 6952 1 19 . 1 1 20 20 VAL H H 20 8.004 8.004 8.238 -0.234 19163 6953 1 19 . 1 1 21 21 LEU N N 21 115.252 115.252 116.620 -1.368 19163 6954 1 19 . 1 1 21 21 LEU HA H 21 4.281 4.281 4.394 -0.113 19163 6955 1 19 . 1 1 21 21 LEU C C 21 175.757 175.757 177.100 -1.343 19163 6956 1 19 . 1 1 21 21 LEU CA C 21 54.554 54.554 55.290 -0.736 19163 6957 1 19 . 1 1 21 21 LEU CB C 21 42.869 42.869 42.275 0.594 19163 6958 1 19 . 1 1 21 21 LEU H H 21 6.847 6.847 7.717 -0.870 19163 6959 1 19 . 1 1 22 22 GLY N N 22 108.227 108.227 107.149 1.078 19163 6960 1 19 . 1 1 22 22 GLY C C 22 175.361 175.361 174.349 1.012 19163 6961 1 19 . 1 1 22 22 GLY CA C 22 46.574 46.574 45.998 0.576 19163 6962 1 19 . 1 1 22 22 GLY H H 22 7.874 7.874 7.343 0.531 19163 6963 1 19 . 1 1 23 23 VAL N N 23 110.675 110.675 118.872 -8.197 19163 6964 1 19 . 1 1 23 23 VAL HA H 23 4.767 4.767 4.427 0.340 19163 6965 1 19 . 1 1 23 23 VAL C C 23 174.674 174.674 174.712 -0.038 19163 6966 1 19 . 1 1 23 23 VAL CA C 23 58.349 58.349 60.049 -1.700 19163 6967 1 19 . 1 1 23 23 VAL CB C 23 34.938 34.938 35.442 -0.504 19163 6968 1 19 . 1 1 23 23 VAL H H 23 7.815 7.815 8.022 -0.207 19163 6969 1 19 . 1 1 24 24 LYS N N 24 119.948 119.948 123.615 -3.667 19163 6970 1 19 . 1 1 24 24 LYS HA H 24 4.488 4.488 4.765 -0.277 19163 6971 1 19 . 1 1 24 24 LYS C C 24 175.442 175.442 175.885 -0.443 19163 6972 1 19 . 1 1 24 24 LYS CA C 24 54.001 54.001 54.191 -0.190 19163 6973 1 19 . 1 1 24 24 LYS CB C 24 32.197 32.197 32.177 0.020 19163 6974 1 19 . 1 1 24 24 LYS H H 24 8.329 8.329 8.331 -0.002 19163 6975 1 19 . 1 1 25 25 PRO HA H 25 2.421 2.421 4.578 -2.157 19163 6976 1 19 . 1 1 25 25 PRO C C 25 175.635 175.635 176.823 -1.188 19163 6977 1 19 . 1 1 25 25 PRO CA C 25 63.362 63.362 65.007 -1.645 19163 6978 1 19 . 1 1 25 25 PRO CB C 25 31.839 31.839 31.945 -0.105 19163 6979 1 19 . 1 1 26 26 ASN N N 26 111.739 111.739 114.380 -2.641 19163 6980 1 19 . 1 1 26 26 ASN HA H 26 4.518 4.518 4.750 -0.232 19163 6981 1 19 . 1 1 26 26 ASN C C 26 175.820 175.820 174.910 0.910 19163 6982 1 19 . 1 1 26 26 ASN CA C 26 51.525 51.525 52.163 -0.637 19163 6983 1 19 . 1 1 26 26 ASN CB C 26 36.829 36.829 38.005 -1.176 19163 6984 1 19 . 1 1 26 26 ASN H H 26 7.138 7.138 8.227 -1.089 19163 6985 1 19 . 1 1 27 27 ALA N N 27 122.829 122.829 123.699 -0.870 19163 6986 1 19 . 1 1 27 27 ALA HA H 27 4.325 4.325 4.714 -0.389 19163 6987 1 19 . 1 1 27 27 ALA C C 27 178.726 178.726 177.620 1.106 19163 6988 1 19 . 1 1 27 27 ALA CA C 27 52.961 52.961 52.158 0.803 19163 6989 1 19 . 1 1 27 27 ALA CB C 27 19.159 19.159 20.088 -0.929 19163 6990 1 19 . 1 1 27 27 ALA H H 27 7.637 7.637 7.434 0.203 19163 6991 1 19 . 1 1 28 28 THR N N 28 113.468 113.468 115.289 -1.821 19163 6992 1 19 . 1 1 28 28 THR HA H 28 4.493 4.493 4.479 0.014 19163 6993 1 19 . 1 1 28 28 THR C C 28 175.641 175.641 175.690 -0.049 19163 6994 1 19 . 1 1 28 28 THR CA C 28 60.592 60.592 60.514 0.078 19163 6995 1 19 . 1 1 28 28 THR CB C 28 71.304 71.304 70.570 0.734 19163 6996 1 19 . 1 1 28 28 THR H H 28 8.829 8.829 8.317 0.512 19163 6997 1 19 . 1 1 29 29 GLN N N 29 119.445 119.445 121.902 -2.457 19163 6998 1 19 . 1 1 29 29 GLN HA H 29 4.035 4.035 3.888 0.147 19163 6999 1 19 . 1 1 29 29 GLN C C 29 179.117 179.117 178.323 0.794 19163 7000 1 19 . 1 1 29 29 GLN CA C 29 59.435 59.435 60.178 -0.743 19163 7001 1 19 . 1 1 29 29 GLN CB C 29 27.851 27.851 28.443 -0.592 19163 7002 1 19 . 1 1 29 29 GLN H H 29 9.015 9.015 8.852 0.163 19163 7003 1 19 . 1 1 30 30 GLU N N 30 119.343 119.343 118.991 0.352 19163 7004 1 19 . 1 1 30 30 GLU HA H 30 4.059 4.059 4.085 -0.026 19163 7005 1 19 . 1 1 30 30 GLU C C 30 179.097 179.097 178.601 0.496 19163 7006 1 19 . 1 1 30 30 GLU CA C 30 59.847 59.847 59.352 0.494 19163 7007 1 19 . 1 1 30 30 GLU CB C 30 29.356 29.356 29.249 0.107 19163 7008 1 19 . 1 1 30 30 GLU H H 30 8.549 8.549 8.626 -0.077 19163 7009 1 19 . 1 1 31 31 GLU N N 31 120.562 120.562 120.590 -0.028 19163 7010 1 19 . 1 1 31 31 GLU HA H 31 3.906 3.906 4.104 -0.198 19163 7011 1 19 . 1 1 31 31 GLU C C 31 180.405 180.405 179.088 1.317 19163 7012 1 19 . 1 1 31 31 GLU CA C 31 59.592 59.592 59.330 0.262 19163 7013 1 19 . 1 1 31 31 GLU CB C 31 29.989 29.989 29.550 0.438 19163 7014 1 19 . 1 1 31 31 GLU H H 31 7.768 7.768 8.171 -0.403 19163 7015 1 19 . 1 1 32 32 LEU N N 32 120.518 120.518 120.448 0.070 19163 7016 1 19 . 1 1 32 32 LEU HA H 32 3.963 3.963 4.007 -0.044 19163 7017 1 19 . 1 1 32 32 LEU C C 32 177.873 177.873 179.010 -1.137 19163 7018 1 19 . 1 1 32 32 LEU CA C 32 58.593 58.593 57.737 0.856 19163 7019 1 19 . 1 1 32 32 LEU CB C 32 42.556 42.556 41.087 1.469 19163 7020 1 19 . 1 1 32 32 LEU H H 32 8.475 8.475 8.622 -0.147 19163 7021 1 19 . 1 1 33 33 LYS N N 33 119.091 119.091 119.419 -0.328 19163 7022 1 19 . 1 1 33 33 LYS HA H 33 4.000 4.000 4.153 -0.153 19163 7023 1 19 . 1 1 33 33 LYS C C 33 178.701 178.701 178.630 0.071 19163 7024 1 19 . 1 1 33 33 LYS CA C 33 60.274 60.274 59.903 0.371 19163 7025 1 19 . 1 1 33 33 LYS CB C 33 32.656 32.656 32.380 0.276 19163 7026 1 19 . 1 1 33 33 LYS H H 33 8.077 8.077 7.801 0.276 19163 7027 1 19 . 1 1 34 34 LYS N N 34 118.527 118.527 119.701 -1.174 19163 7028 1 19 . 1 1 34 34 LYS HA H 34 3.890 3.890 4.017 -0.127 19163 7029 1 19 . 1 1 34 34 LYS C C 34 179.172 179.172 178.795 0.377 19163 7030 1 19 . 1 1 34 34 LYS CA C 34 59.927 59.927 59.515 0.412 19163 7031 1 19 . 1 1 34 34 LYS CB C 34 32.869 32.869 32.448 0.421 19163 7032 1 19 . 1 1 34 34 LYS H H 34 7.986 7.986 7.993 -0.007 19163 7033 1 19 . 1 1 35 35 ALA N N 35 122.190 122.190 121.653 0.537 19163 7034 1 19 . 1 1 35 35 ALA HA H 35 4.116 4.116 4.038 0.078 19163 7035 1 19 . 1 1 35 35 ALA C C 35 179.982 179.982 178.949 1.033 19163 7036 1 19 . 1 1 35 35 ALA CA C 35 55.157 55.157 55.290 -0.133 19163 7037 1 19 . 1 1 35 35 ALA CB C 35 18.773 18.773 18.309 0.464 19163 7038 1 19 . 1 1 35 35 ALA H H 35 7.917 7.917 8.324 -0.407 19163 7039 1 19 . 1 1 36 36 TYR N N 36 117.701 117.701 120.538 -2.837 19163 7040 1 19 . 1 1 36 36 TYR HA H 36 3.818 3.818 4.045 -0.227 19163 7041 1 19 . 1 1 36 36 TYR C C 36 176.344 176.344 177.521 -1.177 19163 7042 1 19 . 1 1 36 36 TYR CA C 36 61.468 61.468 61.356 0.112 19163 7043 1 19 . 1 1 36 36 TYR CB C 36 38.890 38.890 38.318 0.572 19163 7044 1 19 . 1 1 36 36 TYR H H 36 8.402 8.402 7.866 0.536 19163 7045 1 19 . 1 1 37 37 ARG N N 37 117.423 117.423 119.067 -1.644 19163 7046 1 19 . 1 1 37 37 ARG HA H 37 3.481 3.481 3.653 -0.172 19163 7047 1 19 . 1 1 37 37 ARG C C 37 178.825 178.825 178.163 0.662 19163 7048 1 19 . 1 1 37 37 ARG CA C 37 59.397 59.397 59.844 -0.447 19163 7049 1 19 . 1 1 37 37 ARG CB C 37 29.710 29.710 30.037 -0.327 19163 7050 1 19 . 1 1 37 37 ARG H H 37 8.264 8.264 8.682 -0.418 19163 7051 1 19 . 1 1 38 38 LYS N N 38 117.247 117.247 119.792 -2.545 19163 7052 1 19 . 1 1 38 38 LYS HA H 38 3.905 3.905 3.995 -0.090 19163 7053 1 19 . 1 1 38 38 LYS C C 38 179.444 179.444 179.112 0.332 19163 7054 1 19 . 1 1 38 38 LYS CA C 38 59.450 59.450 59.431 0.019 19163 7055 1 19 . 1 1 38 38 LYS CB C 38 32.609 32.609 32.301 0.308 19163 7056 1 19 . 1 1 38 38 LYS H H 38 7.444 7.444 7.758 -0.314 19163 7057 1 19 . 1 1 39 39 LEU N N 39 119.901 119.901 119.417 0.484 19163 7058 1 19 . 1 1 39 39 LEU HA H 39 4.020 4.020 3.970 0.050 19163 7059 1 19 . 1 1 39 39 LEU C C 39 178.801 178.801 178.716 0.085 19163 7060 1 19 . 1 1 39 39 LEU CA C 39 57.409 57.409 57.644 -0.235 19163 7061 1 19 . 1 1 39 39 LEU CB C 39 42.388 42.388 41.677 0.711 19163 7062 1 19 . 1 1 39 39 LEU H H 39 7.707 7.707 8.178 -0.471 19163 7063 1 19 . 1 1 40 40 ALA N N 40 122.772 122.772 121.540 1.232 19163 7064 1 19 . 1 1 40 40 ALA HA H 40 3.849 3.849 3.847 0.002 19163 7065 1 19 . 1 1 40 40 ALA C C 40 179.446 179.446 178.505 0.941 19163 7066 1 19 . 1 1 40 40 ALA CA C 40 55.109 55.109 54.679 0.430 19163 7067 1 19 . 1 1 40 40 ALA CB C 40 17.116 17.116 18.002 -0.886 19163 7068 1 19 . 1 1 40 40 ALA H H 40 8.931 8.931 8.055 0.876 19163 7069 1 19 . 1 1 41 41 LEU N N 41 115.299 115.299 116.685 -1.386 19163 7070 1 19 . 1 1 41 41 LEU HA H 41 3.977 3.977 3.827 0.150 19163 7071 1 19 . 1 1 41 41 LEU C C 41 178.216 178.216 179.709 -1.493 19163 7072 1 19 . 1 1 41 41 LEU CA C 41 57.088 57.088 56.841 0.247 19163 7073 1 19 . 1 1 41 41 LEU CB C 41 42.162 42.162 41.751 0.411 19163 7074 1 19 . 1 1 41 41 LEU H H 41 7.133 7.133 7.543 -0.410 19163 7075 1 19 . 1 1 42 42 LYS N N 42 116.812 116.812 118.492 -1.680 19163 7076 1 19 . 1 1 42 42 LYS HA H 42 3.925 3.925 3.980 -0.055 19163 7077 1 19 . 1 1 42 42 LYS C C 42 177.560 177.560 177.893 -0.333 19163 7078 1 19 . 1 1 42 42 LYS CA C 42 57.885 57.885 58.248 -0.363 19163 7079 1 19 . 1 1 42 42 LYS CB C 42 33.427 33.427 32.219 1.208 19163 7080 1 19 . 1 1 42 42 LYS H H 42 7.038 7.038 7.292 -0.254 19163 7081 1 19 . 1 1 43 43 TYR N N 43 114.022 114.022 115.515 -1.493 19163 7082 1 19 . 1 1 43 43 TYR HA H 43 4.665 4.665 4.535 0.130 19163 7083 1 19 . 1 1 43 43 TYR C C 43 173.741 173.741 174.080 -0.339 19163 7084 1 19 . 1 1 43 43 TYR CA C 43 56.928 56.928 56.219 0.709 19163 7085 1 19 . 1 1 43 43 TYR CB C 43 39.579 39.579 37.121 2.458 19163 7086 1 19 . 1 1 43 43 TYR H H 43 7.683 7.683 7.939 -0.256 19163 7087 1 19 . 1 1 44 44 HIS N N 44 120.947 120.947 121.813 -0.866 19163 7088 1 19 . 1 1 44 44 HIS HA H 44 3.697 3.697 4.260 -0.563 19163 7089 1 19 . 1 1 44 44 HIS C C 44 174.925 174.925 174.568 0.357 19163 7090 1 19 . 1 1 44 44 HIS CA C 44 56.229 56.229 56.872 -0.643 19163 7091 1 19 . 1 1 44 44 HIS CB C 44 30.852 30.852 29.793 1.059 19163 7092 1 19 . 1 1 44 44 HIS H H 44 7.814 7.814 7.375 0.439 19163 7093 1 19 . 1 1 45 45 PRO HA H 45 4.131 4.131 4.422 -0.291 19163 7094 1 19 . 1 1 45 45 PRO C C 45 177.269 177.269 177.631 -0.362 19163 7095 1 19 . 1 1 45 45 PRO CA C 45 64.723 64.723 64.983 -0.260 19163 7096 1 19 . 1 1 45 45 PRO CB C 45 32.070 32.070 31.979 0.091 19163 7097 1 19 . 1 1 46 46 ASP N N 46 119.127 119.127 115.522 3.605 19163 7098 1 19 . 1 1 46 46 ASP HA H 46 4.375 4.375 4.412 -0.037 19163 7099 1 19 . 1 1 46 46 ASP C C 46 177.284 177.284 177.028 0.256 19163 7100 1 19 . 1 1 46 46 ASP CA C 46 56.020 56.020 55.924 0.096 19163 7101 1 19 . 1 1 46 46 ASP CB C 46 40.221 40.221 40.173 0.048 19163 7102 1 19 . 1 1 46 46 ASP H H 46 10.040 10.040 8.525 1.515 19163 7103 1 19 . 1 1 47 47 LYS N N 47 117.416 117.416 118.870 -1.454 19163 7104 1 19 . 1 1 47 47 LYS HA H 47 4.315 4.315 4.281 0.034 19163 7105 1 19 . 1 1 47 47 LYS C C 47 176.355 176.355 176.597 -0.242 19163 7106 1 19 . 1 1 47 47 LYS CA C 47 55.880 55.880 57.131 -1.251 19163 7107 1 19 . 1 1 47 47 LYS CB C 47 33.778 33.778 34.427 -0.649 19163 7108 1 19 . 1 1 47 47 LYS H H 47 7.826 7.826 7.579 0.247 19163 7109 1 19 . 1 1 48 48 ASN N N 48 116.573 116.573 118.443 -1.870 19163 7110 1 19 . 1 1 48 48 ASN HA H 48 5.021 5.021 5.137 -0.116 19163 7111 1 19 . 1 1 48 48 ASN C C 48 172.992 172.992 173.580 -0.588 19163 7112 1 19 . 1 1 48 48 ASN CA C 48 50.467 50.467 51.202 -0.735 19163 7113 1 19 . 1 1 48 48 ASN CB C 48 39.284 39.284 39.654 -0.370 19163 7114 1 19 . 1 1 48 48 ASN H H 48 7.956 7.956 8.418 -0.462 19163 7115 1 19 . 1 1 49 49 PRO HA H 49 4.448 4.448 4.446 0.002 19163 7116 1 19 . 1 1 49 49 PRO C C 49 178.030 178.030 178.404 -0.374 19163 7117 1 19 . 1 1 49 49 PRO CA C 49 64.468 64.468 64.904 -0.436 19163 7118 1 19 . 1 1 49 49 PRO CB C 49 32.173 32.173 32.161 0.012 19163 7119 1 19 . 1 1 50 50 ASN N N 50 115.567 115.567 116.423 -0.856 19163 7120 1 19 . 1 1 50 50 ASN HA H 50 4.748 4.748 4.528 0.220 19163 7121 1 19 . 1 1 50 50 ASN C C 50 176.443 176.443 176.172 0.271 19163 7122 1 19 . 1 1 50 50 ASN CA C 50 54.677 54.677 55.605 -0.928 19163 7123 1 19 . 1 1 50 50 ASN CB C 50 39.014 39.014 38.298 0.716 19163 7124 1 19 . 1 1 50 50 ASN H H 50 8.398 8.398 8.529 -0.131 19163 7125 1 19 . 1 1 51 51 GLU N N 51 119.270 119.270 117.995 1.275 19163 7126 1 19 . 1 1 51 51 GLU HA H 51 4.797 4.797 4.454 0.343 19163 7127 1 19 . 1 1 51 51 GLU C C 51 176.922 176.922 177.962 -1.040 19163 7128 1 19 . 1 1 51 51 GLU CA C 51 55.916 55.916 56.245 -0.328 19163 7129 1 19 . 1 1 51 51 GLU CB C 51 29.200 29.200 29.636 -0.436 19163 7130 1 19 . 1 1 51 51 GLU H H 51 7.485 7.485 7.696 -0.210 19163 7131 1 19 . 1 1 52 52 GLY N N 52 107.541 107.541 108.587 -1.046 19163 7132 1 19 . 1 1 52 52 GLY C C 52 176.755 176.755 175.504 1.251 19163 7133 1 19 . 1 1 52 52 GLY CA C 52 47.914 47.914 47.022 0.892 19163 7134 1 19 . 1 1 52 52 GLY H H 52 8.092 8.092 7.763 0.329 19163 7135 1 19 . 1 1 53 53 GLU N N 53 121.603 121.603 121.249 0.354 19163 7136 1 19 . 1 1 53 53 GLU HA H 53 4.065 4.065 4.077 -0.012 19163 7137 1 19 . 1 1 53 53 GLU C C 53 179.052 179.052 178.188 0.864 19163 7138 1 19 . 1 1 53 53 GLU CA C 53 59.280 59.280 59.194 0.086 19163 7139 1 19 . 1 1 53 53 GLU CB C 53 28.968 28.968 29.268 -0.300 19163 7140 1 19 . 1 1 53 53 GLU H H 53 8.496 8.496 8.122 0.374 19163 7141 1 19 . 1 1 54 54 LYS N N 54 120.837 120.837 118.947 1.890 19163 7142 1 19 . 1 1 54 54 LYS HA H 54 3.923 3.923 4.044 -0.121 19163 7143 1 19 . 1 1 54 54 LYS C C 54 179.058 179.058 178.817 0.241 19163 7144 1 19 . 1 1 54 54 LYS CA C 54 58.800 58.800 58.893 -0.093 19163 7145 1 19 . 1 1 54 54 LYS CB C 54 31.551 31.551 32.238 -0.687 19163 7146 1 19 . 1 1 54 54 LYS H H 54 7.857 7.857 8.009 -0.152 19163 7147 1 19 . 1 1 55 55 PHE N N 55 118.608 118.608 120.563 -1.955 19163 7148 1 19 . 1 1 55 55 PHE HA H 55 4.021 4.021 4.201 -0.180 19163 7149 1 19 . 1 1 55 55 PHE C C 55 178.001 178.001 176.881 1.120 19163 7150 1 19 . 1 1 55 55 PHE CA C 55 61.911 61.911 60.508 1.403 19163 7151 1 19 . 1 1 55 55 PHE CB C 55 38.553 38.553 38.920 -0.367 19163 7152 1 19 . 1 1 55 55 PHE H H 55 8.382 8.382 8.254 0.128 19163 7153 1 19 . 1 1 56 56 LYS N N 56 120.898 120.898 119.153 1.745 19163 7154 1 19 . 1 1 56 56 LYS HA H 56 3.828 3.828 3.856 -0.028 19163 7155 1 19 . 1 1 56 56 LYS C C 56 178.817 178.817 178.864 -0.047 19163 7156 1 19 . 1 1 56 56 LYS CA C 56 59.877 59.877 60.135 -0.258 19163 7157 1 19 . 1 1 56 56 LYS CB C 56 32.133 32.133 31.915 0.218 19163 7158 1 19 . 1 1 56 56 LYS H H 56 8.111 8.111 7.850 0.261 19163 7159 1 19 . 1 1 57 57 GLN N N 57 118.600 118.600 118.350 0.250 19163 7160 1 19 . 1 1 57 57 GLN HA H 57 4.009 4.009 4.071 -0.062 19163 7161 1 19 . 1 1 57 57 GLN C C 57 179.333 179.333 178.525 0.808 19163 7162 1 19 . 1 1 57 57 GLN CA C 57 59.109 59.109 58.856 0.253 19163 7163 1 19 . 1 1 57 57 GLN CB C 57 28.595 28.595 28.757 -0.162 19163 7164 1 19 . 1 1 57 57 GLN H H 57 7.613 7.613 7.605 0.008 19163 7165 1 19 . 1 1 58 58 ILE N N 58 118.709 118.709 120.458 -1.749 19163 7166 1 19 . 1 1 58 58 ILE HA H 58 3.559 3.559 3.619 -0.060 19163 7167 1 19 . 1 1 58 58 ILE C C 58 177.152 177.152 178.130 -0.978 19163 7168 1 19 . 1 1 58 58 ILE CA C 58 65.068 65.068 65.433 -0.365 19163 7169 1 19 . 1 1 58 58 ILE CB C 58 38.381 38.381 37.726 0.655 19163 7170 1 19 . 1 1 58 58 ILE H H 58 8.011 8.011 7.439 0.572 19163 7171 1 19 . 1 1 59 59 SER N N 59 116.112 116.112 114.612 1.500 19163 7172 1 19 . 1 1 59 59 SER HA H 59 3.948 3.948 3.953 -0.005 19163 7173 1 19 . 1 1 59 59 SER C C 59 175.949 175.949 176.760 -0.811 19163 7174 1 19 . 1 1 59 59 SER CA C 59 62.315 62.315 61.827 0.488 19163 7175 1 19 . 1 1 59 59 SER H H 59 8.030 8.030 8.118 -0.088 19163 7176 1 19 . 1 1 60 60 GLN N N 60 122.099 122.099 120.667 1.432 19163 7177 1 19 . 1 1 60 60 GLN HA H 60 3.801 3.801 3.941 -0.140 19163 7178 1 19 . 1 1 60 60 GLN C C 60 176.942 176.942 178.308 -1.366 19163 7179 1 19 . 1 1 60 60 GLN CA C 60 58.762 58.762 58.753 0.009 19163 7180 1 19 . 1 1 60 60 GLN CB C 60 28.498 28.498 28.882 -0.384 19163 7181 1 19 . 1 1 60 60 GLN H H 60 7.933 7.933 7.689 0.244 19163 7182 1 19 . 1 1 61 61 ALA N N 61 119.367 119.367 122.362 -2.995 19163 7183 1 19 . 1 1 61 61 ALA HA H 61 2.636 2.636 3.975 -1.339 19163 7184 1 19 . 1 1 61 61 ALA C C 61 178.507 178.507 179.278 -0.771 19163 7185 1 19 . 1 1 61 61 ALA CA C 61 54.126 54.126 55.002 -0.875 19163 7186 1 19 . 1 1 61 61 ALA CB C 61 18.462 18.462 18.332 0.130 19163 7187 1 19 . 1 1 61 61 ALA H H 61 7.354 7.354 8.180 -0.826 19163 7188 1 19 . 1 1 62 62 TYR N N 62 115.613 115.613 119.701 -4.088 19163 7189 1 19 . 1 1 62 62 TYR HA H 62 3.633 3.633 3.922 -0.289 19163 7190 1 19 . 1 1 62 62 TYR C C 62 177.421 177.421 177.547 -0.126 19163 7191 1 19 . 1 1 62 62 TYR CA C 62 61.676 61.676 61.033 0.643 19163 7192 1 19 . 1 1 62 62 TYR CB C 62 39.162 39.162 37.768 1.394 19163 7193 1 19 . 1 1 62 62 TYR H H 62 7.994 7.994 8.279 -0.285 19163 7194 1 19 . 1 1 63 63 GLU N N 63 121.396 121.396 118.973 2.423 19163 7195 1 19 . 1 1 63 63 GLU HA H 63 3.347 3.347 3.542 -0.195 19163 7196 1 19 . 1 1 63 63 GLU C C 63 177.687 177.687 178.938 -1.251 19163 7197 1 19 . 1 1 63 63 GLU CA C 63 59.562 59.562 58.836 0.726 19163 7198 1 19 . 1 1 63 63 GLU CB C 63 29.115 29.115 29.347 -0.232 19163 7199 1 19 . 1 1 63 63 GLU H H 63 8.151 8.151 7.693 0.458 19163 7200 1 19 . 1 1 64 64 VAL N N 64 115.850 115.850 119.394 -3.544 19163 7201 1 19 . 1 1 64 64 VAL HA H 64 3.377 3.377 3.524 -0.147 19163 7202 1 19 . 1 1 64 64 VAL C C 64 175.925 175.925 176.783 -0.858 19163 7203 1 19 . 1 1 64 64 VAL CA C 64 65.806 65.806 64.702 1.104 19163 7204 1 19 . 1 1 64 64 VAL CB C 64 31.786 31.786 31.166 0.620 19163 7205 1 19 . 1 1 64 64 VAL H H 64 6.814 6.814 7.226 -0.412 19163 7206 1 19 . 1 1 65 65 LEU N N 65 111.438 111.438 119.238 -7.800 19163 7207 1 19 . 1 1 65 65 LEU HA H 65 3.569 3.569 3.872 -0.303 19163 7208 1 19 . 1 1 65 65 LEU C C 65 177.124 177.124 178.885 -1.761 19163 7209 1 19 . 1 1 65 65 LEU CA C 65 56.645 56.645 57.389 -0.744 19163 7210 1 19 . 1 1 65 65 LEU CB C 65 42.589 42.589 41.210 1.379 19163 7211 1 19 . 1 1 65 65 LEU H H 65 7.398 7.398 8.170 -0.772 19163 7212 1 19 . 1 1 66 66 SER N N 66 108.642 108.642 109.187 -0.545 19163 7213 1 19 . 1 1 66 66 SER HA H 66 4.028 4.028 4.119 -0.091 19163 7214 1 19 . 1 1 66 66 SER C C 66 173.286 173.286 174.068 -0.782 19163 7215 1 19 . 1 1 66 66 SER CA C 66 59.232 59.232 59.720 -0.488 19163 7216 1 19 . 1 1 66 66 SER CB C 66 63.066 63.066 63.146 -0.080 19163 7217 1 19 . 1 1 66 66 SER H H 66 7.700 7.700 7.634 0.066 19163 7218 1 19 . 1 1 67 67 ASP N N 67 124.276 124.276 122.526 1.750 19163 7219 1 19 . 1 1 67 67 ASP HA H 67 4.668 4.668 4.668 -0.000 19163 7220 1 19 . 1 1 67 67 ASP C C 67 174.913 174.913 175.522 -0.609 19163 7221 1 19 . 1 1 67 67 ASP CA C 67 52.487 52.487 52.895 -0.408 19163 7222 1 19 . 1 1 67 67 ASP CB C 67 43.218 43.218 42.399 0.819 19163 7223 1 19 . 1 1 67 67 ASP H H 67 6.879 6.879 7.101 -0.222 19163 7224 1 19 . 1 1 68 68 ALA N N 68 127.326 127.326 130.630 -3.304 19163 7225 1 19 . 1 1 68 68 ALA HA H 68 3.853 3.853 3.888 -0.035 19163 7226 1 19 . 1 1 68 68 ALA C C 68 180.336 180.336 178.780 1.556 19163 7227 1 19 . 1 1 68 68 ALA CA C 68 55.912 55.912 55.428 0.484 19163 7228 1 19 . 1 1 68 68 ALA CB C 68 18.645 18.645 18.766 -0.121 19163 7229 1 19 . 1 1 68 68 ALA H H 68 8.693 8.693 8.817 -0.124 19163 7230 1 19 . 1 1 69 69 LYS N N 69 116.929 116.929 118.494 -1.565 19163 7231 1 19 . 1 1 69 69 LYS HA H 69 4.162 4.162 4.028 0.134 19163 7232 1 19 . 1 1 69 69 LYS C C 69 179.515 179.515 178.790 0.725 19163 7233 1 19 . 1 1 69 69 LYS CA C 69 58.562 58.562 59.324 -0.762 19163 7234 1 19 . 1 1 69 69 LYS CB C 69 31.840 31.840 32.279 -0.439 19163 7235 1 19 . 1 1 69 69 LYS H H 69 7.950 7.950 7.756 0.194 19163 7236 1 19 . 1 1 70 70 LYS N N 70 121.286 121.286 119.165 2.121 19163 7237 1 19 . 1 1 70 70 LYS HA H 70 3.960 3.960 3.982 -0.022 19163 7238 1 19 . 1 1 70 70 LYS C C 70 179.938 179.938 178.914 1.024 19163 7239 1 19 . 1 1 70 70 LYS CA C 70 60.066 60.066 59.625 0.441 19163 7240 1 19 . 1 1 70 70 LYS CB C 70 32.695 32.695 32.186 0.509 19163 7241 1 19 . 1 1 70 70 LYS H H 70 8.184 8.184 8.543 -0.359 19163 7242 1 19 . 1 1 71 71 ARG N N 71 122.794 122.794 119.881 2.913 19163 7243 1 19 . 1 1 71 71 ARG HA H 71 3.668 3.668 3.856 -0.188 19163 7244 1 19 . 1 1 71 71 ARG C C 71 177.356 177.356 178.179 -0.823 19163 7245 1 19 . 1 1 71 71 ARG CA C 71 60.127 60.127 60.163 -0.036 19163 7246 1 19 . 1 1 71 71 ARG CB C 71 29.668 29.668 30.165 -0.497 19163 7247 1 19 . 1 1 71 71 ARG H H 71 9.290 9.290 8.615 0.675 19163 7248 1 19 . 1 1 72 72 GLU N N 72 118.390 118.390 119.709 -1.319 19163 7249 1 19 . 1 1 72 72 GLU HA H 72 4.096 4.096 4.115 -0.019 19163 7250 1 19 . 1 1 72 72 GLU C C 72 179.073 179.073 179.064 0.009 19163 7251 1 19 . 1 1 72 72 GLU CA C 72 59.456 59.456 59.394 0.062 19163 7252 1 19 . 1 1 72 72 GLU CB C 72 29.615 29.615 29.613 0.002 19163 7253 1 19 . 1 1 72 72 GLU H H 72 7.607 7.607 7.635 -0.028 19163 7254 1 19 . 1 1 73 73 LEU N N 73 117.921 117.921 120.186 -2.265 19163 7255 1 19 . 1 1 73 73 LEU HA H 73 4.032 4.032 3.997 0.035 19163 7256 1 19 . 1 1 73 73 LEU C C 73 179.696 179.696 179.629 0.067 19163 7257 1 19 . 1 1 73 73 LEU CA C 73 57.597 57.597 57.921 -0.324 19163 7258 1 19 . 1 1 73 73 LEU CB C 73 41.815 41.815 41.904 -0.089 19163 7259 1 19 . 1 1 73 73 LEU H H 73 7.398 7.398 7.964 -0.566 19163 7260 1 19 . 1 1 74 74 TYR N N 74 122.662 122.662 116.762 5.900 19163 7261 1 19 . 1 1 74 74 TYR HA H 74 4.092 4.092 4.210 -0.118 19163 7262 1 19 . 1 1 74 74 TYR C C 74 178.166 178.166 177.597 0.569 19163 7263 1 19 . 1 1 74 74 TYR CA C 74 61.458 61.458 61.165 0.293 19163 7264 1 19 . 1 1 74 74 TYR CB C 74 38.778 38.778 38.055 0.723 19163 7265 1 19 . 1 1 74 74 TYR H H 74 8.316 8.316 8.682 -0.366 19163 7266 1 19 . 1 1 75 75 ASP N N 75 118.842 118.842 118.206 0.636 19163 7267 1 19 . 1 1 75 75 ASP HA H 75 4.423 4.423 4.548 -0.125 19163 7268 1 19 . 1 1 75 75 ASP C C 75 177.726 177.726 177.692 0.034 19163 7269 1 19 . 1 1 75 75 ASP CA C 75 56.177 56.177 56.349 -0.172 19163 7270 1 19 . 1 1 75 75 ASP CB C 75 40.800 40.800 41.151 -0.351 19163 7271 1 19 . 1 1 75 75 ASP H H 75 8.770 8.770 8.244 0.526 19163 7272 1 19 . 1 1 76 76 LYS N N 76 118.955 118.955 117.827 1.128 19163 7273 1 19 . 1 1 76 76 LYS HA H 76 4.130 4.130 4.288 -0.158 19163 7274 1 19 . 1 1 76 76 LYS C C 76 177.006 177.006 177.686 -0.680 19163 7275 1 19 . 1 1 76 76 LYS CA C 76 57.537 57.537 56.866 0.671 19163 7276 1 19 . 1 1 76 76 LYS CB C 76 33.136 33.136 33.075 0.061 19163 7277 1 19 . 1 1 76 76 LYS H H 76 7.610 7.610 7.706 -0.096 19163 7278 1 20 . 1 1 11 11 MET HA H 11 4.346 4.346 4.622 -0.276 19163 7279 1 20 . 1 1 11 11 MET C C 11 175.801 175.801 175.715 0.086 19163 7280 1 20 . 1 1 11 11 MET CA C 11 55.614 55.614 54.215 1.399 19163 7281 1 20 . 1 1 11 11 MET CB C 11 32.925 32.925 33.398 -0.473 19163 7282 1 20 . 1 1 12 12 VAL N N 12 121.226 121.226 118.913 2.313 19163 7283 1 20 . 1 1 12 12 VAL HA H 12 4.026 4.026 4.213 -0.187 19163 7284 1 20 . 1 1 12 12 VAL C C 12 175.701 175.701 175.699 0.002 19163 7285 1 20 . 1 1 12 12 VAL CA C 12 62.188 62.188 62.361 -0.173 19163 7286 1 20 . 1 1 12 12 VAL CB C 12 32.882 32.882 32.011 0.871 19163 7287 1 20 . 1 1 12 12 VAL H H 12 7.988 7.988 8.428 -0.440 19163 7288 1 20 . 1 1 13 13 LYS N N 13 125.255 125.255 128.184 -2.929 19163 7289 1 20 . 1 1 13 13 LYS HA H 13 4.211 4.211 4.419 -0.208 19163 7290 1 20 . 1 1 13 13 LYS C C 13 176.121 176.121 175.572 0.549 19163 7291 1 20 . 1 1 13 13 LYS CA C 13 56.355 56.355 55.374 0.981 19163 7292 1 20 . 1 1 13 13 LYS CB C 13 33.019 33.019 32.262 0.757 19163 7293 1 20 . 1 1 13 13 LYS H H 13 8.281 8.281 8.686 -0.405 19163 7294 1 20 . 1 1 14 14 GLU N N 14 123.004 123.004 122.465 0.539 19163 7295 1 20 . 1 1 14 14 GLU HA H 14 4.305 4.305 3.994 0.311 19163 7296 1 20 . 1 1 14 14 GLU C C 14 176.107 176.107 175.319 0.788 19163 7297 1 20 . 1 1 14 14 GLU CA C 14 56.343 56.343 56.500 -0.157 19163 7298 1 20 . 1 1 14 14 GLU CB C 14 30.534 30.534 29.455 1.079 19163 7299 1 20 . 1 1 14 14 GLU H H 14 8.424 8.424 8.708 -0.284 19163 7300 1 20 . 1 1 15 15 THR N N 15 115.895 115.895 115.679 0.216 19163 7301 1 20 . 1 1 15 15 THR HA H 15 4.538 4.538 4.469 0.069 19163 7302 1 20 . 1 1 15 15 THR C C 15 175.233 175.233 174.232 1.001 19163 7303 1 20 . 1 1 15 15 THR CA C 15 61.981 61.981 62.880 -0.899 19163 7304 1 20 . 1 1 15 15 THR CB C 15 69.865 69.865 69.074 0.791 19163 7305 1 20 . 1 1 15 15 THR H H 15 8.335 8.335 8.199 0.136 19163 7306 1 20 . 1 1 16 16 THR N N 16 116.992 116.992 119.936 -2.944 19163 7307 1 20 . 1 1 16 16 THR HA H 16 4.366 4.366 4.588 -0.222 19163 7308 1 20 . 1 1 16 16 THR C C 16 176.090 176.090 174.717 1.373 19163 7309 1 20 . 1 1 16 16 THR CA C 16 62.172 62.172 58.879 3.293 19163 7310 1 20 . 1 1 16 16 THR CB C 16 71.997 71.997 69.969 2.028 19163 7311 1 20 . 1 1 16 16 THR H H 16 8.798 8.798 8.102 0.696 19163 7312 1 20 . 1 1 17 17 TYR N N 17 117.617 117.617 119.428 -1.811 19163 7313 1 20 . 1 1 17 17 TYR HA H 17 4.329 4.329 4.273 0.056 19163 7314 1 20 . 1 1 17 17 TYR C C 17 177.105 177.105 177.704 -0.599 19163 7315 1 20 . 1 1 17 17 TYR CA C 17 57.577 57.577 62.224 -4.647 19163 7316 1 20 . 1 1 17 17 TYR CB C 17 37.113 37.113 38.201 -1.088 19163 7317 1 20 . 1 1 17 17 TYR H H 17 8.292 8.292 9.086 -0.794 19163 7318 1 20 . 1 1 18 18 TYR N N 18 115.048 115.048 117.945 -2.897 19163 7319 1 20 . 1 1 18 18 TYR HA H 18 3.775 3.775 4.306 -0.531 19163 7320 1 20 . 1 1 18 18 TYR C C 18 177.771 177.771 177.613 0.158 19163 7321 1 20 . 1 1 18 18 TYR CA C 18 61.430 61.430 61.397 0.033 19163 7322 1 20 . 1 1 18 18 TYR CB C 18 36.495 36.495 37.311 -0.816 19163 7323 1 20 . 1 1 18 18 TYR H H 18 7.047 7.047 8.264 -1.217 19163 7324 1 20 . 1 1 19 19 ASP N N 19 119.520 119.520 119.320 0.200 19163 7325 1 20 . 1 1 19 19 ASP HA H 19 4.406 4.406 4.443 -0.037 19163 7326 1 20 . 1 1 19 19 ASP C C 19 180.128 180.128 178.646 1.482 19163 7327 1 20 . 1 1 19 19 ASP CA C 19 57.475 57.475 57.461 0.014 19163 7328 1 20 . 1 1 19 19 ASP CB C 19 40.659 40.659 40.620 0.039 19163 7329 1 20 . 1 1 19 19 ASP H H 19 7.685 7.685 8.386 -0.701 19163 7330 1 20 . 1 1 20 20 VAL N N 20 119.772 119.772 119.043 0.729 19163 7331 1 20 . 1 1 20 20 VAL HA H 20 3.608 3.608 3.772 -0.164 19163 7332 1 20 . 1 1 20 20 VAL C C 20 177.026 177.026 177.510 -0.484 19163 7333 1 20 . 1 1 20 20 VAL CA C 20 65.840 65.840 65.454 0.386 19163 7334 1 20 . 1 1 20 20 VAL CB C 20 31.530 31.530 31.488 0.042 19163 7335 1 20 . 1 1 20 20 VAL H H 20 8.004 8.004 8.351 -0.347 19163 7336 1 20 . 1 1 21 21 LEU N N 21 115.252 115.252 117.764 -2.512 19163 7337 1 20 . 1 1 21 21 LEU HA H 21 4.281 4.281 4.320 -0.039 19163 7338 1 20 . 1 1 21 21 LEU C C 21 175.757 175.757 176.822 -1.065 19163 7339 1 20 . 1 1 21 21 LEU CA C 21 54.554 54.554 54.589 -0.035 19163 7340 1 20 . 1 1 21 21 LEU CB C 21 42.869 42.869 42.363 0.506 19163 7341 1 20 . 1 1 21 21 LEU H H 21 6.847 6.847 7.744 -0.897 19163 7342 1 20 . 1 1 22 22 GLY N N 22 108.227 108.227 107.389 0.838 19163 7343 1 20 . 1 1 22 22 GLY C C 22 175.361 175.361 174.061 1.300 19163 7344 1 20 . 1 1 22 22 GLY CA C 22 46.574 46.574 45.711 0.863 19163 7345 1 20 . 1 1 22 22 GLY H H 22 7.874 7.874 7.364 0.510 19163 7346 1 20 . 1 1 23 23 VAL N N 23 110.675 110.675 118.457 -7.782 19163 7347 1 20 . 1 1 23 23 VAL HA H 23 4.767 4.767 4.505 0.262 19163 7348 1 20 . 1 1 23 23 VAL C C 23 174.674 174.674 174.516 0.158 19163 7349 1 20 . 1 1 23 23 VAL CA C 23 58.349 58.349 59.412 -1.063 19163 7350 1 20 . 1 1 23 23 VAL CB C 23 34.938 34.938 35.179 -0.241 19163 7351 1 20 . 1 1 23 23 VAL H H 23 7.815 7.815 8.032 -0.217 19163 7352 1 20 . 1 1 24 24 LYS N N 24 119.948 119.948 123.317 -3.369 19163 7353 1 20 . 1 1 24 24 LYS HA H 24 4.488 4.488 4.747 -0.259 19163 7354 1 20 . 1 1 24 24 LYS C C 24 175.442 175.442 175.758 -0.316 19163 7355 1 20 . 1 1 24 24 LYS CA C 24 54.001 54.001 54.131 -0.130 19163 7356 1 20 . 1 1 24 24 LYS CB C 24 32.197 32.197 32.077 0.120 19163 7357 1 20 . 1 1 24 24 LYS H H 24 8.329 8.329 8.345 -0.016 19163 7358 1 20 . 1 1 25 25 PRO HA H 25 2.421 2.421 4.601 -2.180 19163 7359 1 20 . 1 1 25 25 PRO C C 25 175.635 175.635 176.937 -1.302 19163 7360 1 20 . 1 1 25 25 PRO CA C 25 63.362 63.362 64.859 -1.497 19163 7361 1 20 . 1 1 25 25 PRO CB C 25 31.839 31.839 31.921 -0.082 19163 7362 1 20 . 1 1 26 26 ASN N N 26 111.739 111.739 114.650 -2.911 19163 7363 1 20 . 1 1 26 26 ASN HA H 26 4.518 4.518 4.793 -0.275 19163 7364 1 20 . 1 1 26 26 ASN C C 26 175.820 175.820 174.864 0.956 19163 7365 1 20 . 1 1 26 26 ASN CA C 26 51.525 51.525 52.107 -0.582 19163 7366 1 20 . 1 1 26 26 ASN CB C 26 36.829 36.829 38.006 -1.177 19163 7367 1 20 . 1 1 26 26 ASN H H 26 7.138 7.138 8.296 -1.158 19163 7368 1 20 . 1 1 27 27 ALA N N 27 122.829 122.829 124.278 -1.449 19163 7369 1 20 . 1 1 27 27 ALA HA H 27 4.325 4.325 4.345 -0.020 19163 7370 1 20 . 1 1 27 27 ALA C C 27 178.726 178.726 176.680 2.046 19163 7371 1 20 . 1 1 27 27 ALA CA C 27 52.961 52.961 52.251 0.710 19163 7372 1 20 . 1 1 27 27 ALA CB C 27 19.159 19.159 19.719 -0.560 19163 7373 1 20 . 1 1 27 27 ALA H H 27 7.637 7.637 7.569 0.068 19163 7374 1 20 . 1 1 28 28 THR N N 28 113.468 113.468 114.919 -1.451 19163 7375 1 20 . 1 1 28 28 THR HA H 28 4.493 4.493 4.365 0.128 19163 7376 1 20 . 1 1 28 28 THR C C 28 175.641 175.641 175.837 -0.196 19163 7377 1 20 . 1 1 28 28 THR CA C 28 60.592 60.592 61.377 -0.784 19163 7378 1 20 . 1 1 28 28 THR CB C 28 71.304 71.304 70.356 0.948 19163 7379 1 20 . 1 1 28 28 THR H H 28 8.829 8.829 8.157 0.672 19163 7380 1 20 . 1 1 29 29 GLN N N 29 119.445 119.445 121.896 -2.451 19163 7381 1 20 . 1 1 29 29 GLN HA H 29 4.035 4.035 3.896 0.139 19163 7382 1 20 . 1 1 29 29 GLN C C 29 179.117 179.117 178.357 0.760 19163 7383 1 20 . 1 1 29 29 GLN CA C 29 59.435 59.435 60.013 -0.577 19163 7384 1 20 . 1 1 29 29 GLN CB C 29 27.851 27.851 28.584 -0.733 19163 7385 1 20 . 1 1 29 29 GLN H H 29 9.015 9.015 8.791 0.224 19163 7386 1 20 . 1 1 30 30 GLU N N 30 119.343 119.343 118.560 0.783 19163 7387 1 20 . 1 1 30 30 GLU HA H 30 4.059 4.059 4.102 -0.043 19163 7388 1 20 . 1 1 30 30 GLU C C 30 179.097 179.097 178.675 0.422 19163 7389 1 20 . 1 1 30 30 GLU CA C 30 59.847 59.847 59.308 0.539 19163 7390 1 20 . 1 1 30 30 GLU CB C 30 29.356 29.356 29.284 0.072 19163 7391 1 20 . 1 1 30 30 GLU H H 30 8.549 8.549 8.561 -0.012 19163 7392 1 20 . 1 1 31 31 GLU N N 31 120.562 120.562 121.017 -0.455 19163 7393 1 20 . 1 1 31 31 GLU HA H 31 3.906 3.906 4.113 -0.207 19163 7394 1 20 . 1 1 31 31 GLU C C 31 180.405 180.405 179.029 1.376 19163 7395 1 20 . 1 1 31 31 GLU CA C 31 59.592 59.592 59.137 0.455 19163 7396 1 20 . 1 1 31 31 GLU CB C 31 29.989 29.989 29.236 0.753 19163 7397 1 20 . 1 1 31 31 GLU H H 31 7.768 7.768 8.115 -0.347 19163 7398 1 20 . 1 1 32 32 LEU N N 32 120.518 120.518 120.011 0.507 19163 7399 1 20 . 1 1 32 32 LEU HA H 32 3.963 3.963 4.005 -0.042 19163 7400 1 20 . 1 1 32 32 LEU C C 32 177.873 177.873 179.263 -1.390 19163 7401 1 20 . 1 1 32 32 LEU CA C 32 58.593 58.593 57.911 0.682 19163 7402 1 20 . 1 1 32 32 LEU CB C 32 42.556 42.556 41.215 1.341 19163 7403 1 20 . 1 1 32 32 LEU H H 32 8.475 8.475 8.599 -0.124 19163 7404 1 20 . 1 1 33 33 LYS N N 33 119.091 119.091 119.145 -0.054 19163 7405 1 20 . 1 1 33 33 LYS HA H 33 4.000 4.000 4.236 -0.236 19163 7406 1 20 . 1 1 33 33 LYS C C 33 178.701 178.701 179.171 -0.470 19163 7407 1 20 . 1 1 33 33 LYS CA C 33 60.274 60.274 60.129 0.145 19163 7408 1 20 . 1 1 33 33 LYS CB C 33 32.656 32.656 32.233 0.423 19163 7409 1 20 . 1 1 33 33 LYS H H 33 8.077 8.077 7.818 0.259 19163 7410 1 20 . 1 1 34 34 LYS N N 34 118.527 118.527 120.144 -1.617 19163 7411 1 20 . 1 1 34 34 LYS HA H 34 3.890 3.890 4.041 -0.151 19163 7412 1 20 . 1 1 34 34 LYS C C 34 179.172 179.172 178.769 0.403 19163 7413 1 20 . 1 1 34 34 LYS CA C 34 59.927 59.927 59.467 0.460 19163 7414 1 20 . 1 1 34 34 LYS CB C 34 32.869 32.869 32.471 0.398 19163 7415 1 20 . 1 1 34 34 LYS H H 34 7.986 7.986 8.177 -0.191 19163 7416 1 20 . 1 1 35 35 ALA N N 35 122.190 122.190 121.993 0.197 19163 7417 1 20 . 1 1 35 35 ALA HA H 35 4.116 4.116 4.044 0.072 19163 7418 1 20 . 1 1 35 35 ALA C C 35 179.982 179.982 179.036 0.946 19163 7419 1 20 . 1 1 35 35 ALA CA C 35 55.157 55.157 55.329 -0.172 19163 7420 1 20 . 1 1 35 35 ALA CB C 35 18.773 18.773 18.247 0.526 19163 7421 1 20 . 1 1 35 35 ALA H H 35 7.917 7.917 8.290 -0.373 19163 7422 1 20 . 1 1 36 36 TYR N N 36 117.701 117.701 120.478 -2.777 19163 7423 1 20 . 1 1 36 36 TYR HA H 36 3.818 3.818 4.046 -0.228 19163 7424 1 20 . 1 1 36 36 TYR C C 36 176.344 176.344 177.538 -1.194 19163 7425 1 20 . 1 1 36 36 TYR CA C 36 61.468 61.468 61.560 -0.092 19163 7426 1 20 . 1 1 36 36 TYR CB C 36 38.890 38.890 38.410 0.480 19163 7427 1 20 . 1 1 36 36 TYR H H 36 8.402 8.402 7.907 0.495 19163 7428 1 20 . 1 1 37 37 ARG N N 37 117.423 117.423 119.176 -1.753 19163 7429 1 20 . 1 1 37 37 ARG HA H 37 3.481 3.481 3.746 -0.265 19163 7430 1 20 . 1 1 37 37 ARG C C 37 178.825 178.825 178.271 0.554 19163 7431 1 20 . 1 1 37 37 ARG CA C 37 59.397 59.397 59.754 -0.357 19163 7432 1 20 . 1 1 37 37 ARG CB C 37 29.710 29.710 30.091 -0.381 19163 7433 1 20 . 1 1 37 37 ARG H H 37 8.264 8.264 8.530 -0.266 19163 7434 1 20 . 1 1 38 38 LYS N N 38 117.247 117.247 120.069 -2.822 19163 7435 1 20 . 1 1 38 38 LYS HA H 38 3.905 3.905 4.030 -0.125 19163 7436 1 20 . 1 1 38 38 LYS C C 38 179.444 179.444 179.090 0.354 19163 7437 1 20 . 1 1 38 38 LYS CA C 38 59.450 59.450 59.547 -0.097 19163 7438 1 20 . 1 1 38 38 LYS CB C 38 32.609 32.609 32.337 0.272 19163 7439 1 20 . 1 1 38 38 LYS H H 38 7.444 7.444 8.002 -0.558 19163 7440 1 20 . 1 1 39 39 LEU N N 39 119.901 119.901 119.330 0.571 19163 7441 1 20 . 1 1 39 39 LEU HA H 39 4.020 4.020 4.183 -0.163 19163 7442 1 20 . 1 1 39 39 LEU C C 39 178.801 178.801 178.923 -0.122 19163 7443 1 20 . 1 1 39 39 LEU CA C 39 57.409 57.409 57.669 -0.260 19163 7444 1 20 . 1 1 39 39 LEU CB C 39 42.388 42.388 41.685 0.703 19163 7445 1 20 . 1 1 39 39 LEU H H 39 7.707 7.707 8.183 -0.476 19163 7446 1 20 . 1 1 40 40 ALA N N 40 122.772 122.772 121.979 0.793 19163 7447 1 20 . 1 1 40 40 ALA HA H 40 3.849 3.849 4.055 -0.206 19163 7448 1 20 . 1 1 40 40 ALA C C 40 179.446 179.446 179.544 -0.098 19163 7449 1 20 . 1 1 40 40 ALA CA C 40 55.109 55.109 55.127 -0.018 19163 7450 1 20 . 1 1 40 40 ALA CB C 40 17.116 17.116 18.176 -1.060 19163 7451 1 20 . 1 1 40 40 ALA H H 40 8.931 8.931 8.275 0.656 19163 7452 1 20 . 1 1 41 41 LEU N N 41 115.299 115.299 117.039 -1.740 19163 7453 1 20 . 1 1 41 41 LEU HA H 41 3.977 3.977 3.924 0.053 19163 7454 1 20 . 1 1 41 41 LEU C C 41 178.216 178.216 179.431 -1.215 19163 7455 1 20 . 1 1 41 41 LEU CA C 41 57.088 57.088 57.300 -0.212 19163 7456 1 20 . 1 1 41 41 LEU CB C 41 42.162 42.162 41.653 0.509 19163 7457 1 20 . 1 1 41 41 LEU H H 41 7.133 7.133 7.633 -0.500 19163 7458 1 20 . 1 1 42 42 LYS N N 42 116.812 116.812 118.749 -1.937 19163 7459 1 20 . 1 1 42 42 LYS HA H 42 3.925 3.925 4.017 -0.092 19163 7460 1 20 . 1 1 42 42 LYS C C 42 177.560 177.560 178.040 -0.480 19163 7461 1 20 . 1 1 42 42 LYS CA C 42 57.885 57.885 58.063 -0.178 19163 7462 1 20 . 1 1 42 42 LYS CB C 42 33.427 33.427 32.795 0.632 19163 7463 1 20 . 1 1 42 42 LYS H H 42 7.038 7.038 7.590 -0.552 19163 7464 1 20 . 1 1 43 43 TYR N N 43 114.022 114.022 114.760 -0.738 19163 7465 1 20 . 1 1 43 43 TYR HA H 43 4.665 4.665 4.529 0.136 19163 7466 1 20 . 1 1 43 43 TYR C C 43 173.741 173.741 174.200 -0.459 19163 7467 1 20 . 1 1 43 43 TYR CA C 43 56.928 56.928 56.801 0.127 19163 7468 1 20 . 1 1 43 43 TYR CB C 43 39.579 39.579 37.639 1.940 19163 7469 1 20 . 1 1 43 43 TYR H H 43 7.683 7.683 7.976 -0.293 19163 7470 1 20 . 1 1 44 44 HIS N N 44 120.947 120.947 122.537 -1.590 19163 7471 1 20 . 1 1 44 44 HIS HA H 44 3.697 3.697 4.227 -0.530 19163 7472 1 20 . 1 1 44 44 HIS C C 44 174.925 174.925 174.882 0.043 19163 7473 1 20 . 1 1 44 44 HIS CA C 44 56.229 56.229 56.363 -0.134 19163 7474 1 20 . 1 1 44 44 HIS CB C 44 30.852 30.852 30.948 -0.096 19163 7475 1 20 . 1 1 44 44 HIS H H 44 7.814 7.814 7.645 0.169 19163 7476 1 20 . 1 1 45 45 PRO HA H 45 4.131 4.131 4.346 -0.215 19163 7477 1 20 . 1 1 45 45 PRO C C 45 177.269 177.269 177.617 -0.348 19163 7478 1 20 . 1 1 45 45 PRO CA C 45 64.723 64.723 65.363 -0.640 19163 7479 1 20 . 1 1 45 45 PRO CB C 45 32.070 32.070 31.868 0.202 19163 7480 1 20 . 1 1 46 46 ASP N N 46 119.127 119.127 117.106 2.021 19163 7481 1 20 . 1 1 46 46 ASP HA H 46 4.375 4.375 4.512 -0.137 19163 7482 1 20 . 1 1 46 46 ASP C C 46 177.284 177.284 177.401 -0.117 19163 7483 1 20 . 1 1 46 46 ASP CA C 46 56.020 56.020 56.308 -0.288 19163 7484 1 20 . 1 1 46 46 ASP CB C 46 40.221 40.221 40.691 -0.469 19163 7485 1 20 . 1 1 46 46 ASP H H 46 10.040 10.040 7.628 2.412 19163 7486 1 20 . 1 1 47 47 LYS N N 47 117.416 117.416 119.252 -1.836 19163 7487 1 20 . 1 1 47 47 LYS HA H 47 4.315 4.315 4.401 -0.086 19163 7488 1 20 . 1 1 47 47 LYS C C 47 176.355 176.355 176.975 -0.620 19163 7489 1 20 . 1 1 47 47 LYS CA C 47 55.880 55.880 57.254 -1.374 19163 7490 1 20 . 1 1 47 47 LYS CB C 47 33.778 33.778 34.590 -0.812 19163 7491 1 20 . 1 1 47 47 LYS H H 47 7.826 7.826 7.782 0.044 19163 7492 1 20 . 1 1 48 48 ASN N N 48 116.573 116.573 118.690 -2.117 19163 7493 1 20 . 1 1 48 48 ASN HA H 48 5.021 5.021 5.215 -0.194 19163 7494 1 20 . 1 1 48 48 ASN C C 48 172.992 172.992 173.262 -0.270 19163 7495 1 20 . 1 1 48 48 ASN CA C 48 50.467 50.467 51.444 -0.977 19163 7496 1 20 . 1 1 48 48 ASN CB C 48 39.284 39.284 39.182 0.102 19163 7497 1 20 . 1 1 48 48 ASN H H 48 7.956 7.956 8.435 -0.479 19163 7498 1 20 . 1 1 49 49 PRO HA H 49 4.448 4.448 4.452 -0.004 19163 7499 1 20 . 1 1 49 49 PRO C C 49 178.030 178.030 178.277 -0.247 19163 7500 1 20 . 1 1 49 49 PRO CA C 49 64.468 64.468 64.989 -0.521 19163 7501 1 20 . 1 1 49 49 PRO CB C 49 32.173 32.173 31.983 0.190 19163 7502 1 20 . 1 1 50 50 ASN N N 50 115.567 115.567 117.553 -1.986 19163 7503 1 20 . 1 1 50 50 ASN HA H 50 4.748 4.748 4.518 0.230 19163 7504 1 20 . 1 1 50 50 ASN C C 50 176.443 176.443 176.691 -0.248 19163 7505 1 20 . 1 1 50 50 ASN CA C 50 54.677 54.677 55.735 -1.058 19163 7506 1 20 . 1 1 50 50 ASN CB C 50 39.014 39.014 38.042 0.972 19163 7507 1 20 . 1 1 50 50 ASN H H 50 8.398 8.398 8.740 -0.342 19163 7508 1 20 . 1 1 51 51 GLU N N 51 119.270 119.270 119.214 0.056 19163 7509 1 20 . 1 1 51 51 GLU HA H 51 4.797 4.797 4.410 0.387 19163 7510 1 20 . 1 1 51 51 GLU C C 51 176.922 176.922 177.948 -1.026 19163 7511 1 20 . 1 1 51 51 GLU CA C 51 55.916 55.916 57.008 -1.092 19163 7512 1 20 . 1 1 51 51 GLU CB C 51 29.200 29.200 29.089 0.111 19163 7513 1 20 . 1 1 51 51 GLU H H 51 7.485 7.485 7.751 -0.266 19163 7514 1 20 . 1 1 52 52 GLY N N 52 107.541 107.541 108.025 -0.484 19163 7515 1 20 . 1 1 52 52 GLY C C 52 176.755 176.755 175.776 0.979 19163 7516 1 20 . 1 1 52 52 GLY CA C 52 47.914 47.914 46.920 0.994 19163 7517 1 20 . 1 1 52 52 GLY H H 52 8.092 8.092 7.760 0.332 19163 7518 1 20 . 1 1 53 53 GLU N N 53 121.603 121.603 121.019 0.584 19163 7519 1 20 . 1 1 53 53 GLU HA H 53 4.065 4.065 4.113 -0.048 19163 7520 1 20 . 1 1 53 53 GLU C C 53 179.052 179.052 178.820 0.232 19163 7521 1 20 . 1 1 53 53 GLU CA C 53 59.280 59.280 59.244 0.036 19163 7522 1 20 . 1 1 53 53 GLU CB C 53 28.968 28.968 29.350 -0.382 19163 7523 1 20 . 1 1 53 53 GLU H H 53 8.496 8.496 7.781 0.715 19163 7524 1 20 . 1 1 54 54 LYS N N 54 120.837 120.837 118.851 1.986 19163 7525 1 20 . 1 1 54 54 LYS HA H 54 3.923 3.923 4.046 -0.123 19163 7526 1 20 . 1 1 54 54 LYS C C 54 179.058 179.058 179.074 -0.016 19163 7527 1 20 . 1 1 54 54 LYS CA C 54 58.800 58.800 58.883 -0.083 19163 7528 1 20 . 1 1 54 54 LYS CB C 54 31.551 31.551 32.197 -0.646 19163 7529 1 20 . 1 1 54 54 LYS H H 54 7.857 7.857 7.509 0.348 19163 7530 1 20 . 1 1 55 55 PHE N N 55 118.608 118.608 120.784 -2.176 19163 7531 1 20 . 1 1 55 55 PHE HA H 55 4.021 4.021 4.117 -0.096 19163 7532 1 20 . 1 1 55 55 PHE C C 55 178.001 178.001 176.820 1.181 19163 7533 1 20 . 1 1 55 55 PHE CA C 55 61.911 61.911 60.695 1.216 19163 7534 1 20 . 1 1 55 55 PHE CB C 55 38.553 38.553 39.039 -0.486 19163 7535 1 20 . 1 1 55 55 PHE H H 55 8.382 8.382 8.385 -0.003 19163 7536 1 20 . 1 1 56 56 LYS N N 56 120.898 120.898 119.957 0.941 19163 7537 1 20 . 1 1 56 56 LYS HA H 56 3.828 3.828 3.878 -0.050 19163 7538 1 20 . 1 1 56 56 LYS C C 56 178.817 178.817 178.587 0.230 19163 7539 1 20 . 1 1 56 56 LYS CA C 56 59.877 59.877 60.151 -0.274 19163 7540 1 20 . 1 1 56 56 LYS CB C 56 32.133 32.133 32.019 0.114 19163 7541 1 20 . 1 1 56 56 LYS H H 56 8.111 8.111 7.898 0.213 19163 7542 1 20 . 1 1 57 57 GLN N N 57 118.600 118.600 118.216 0.384 19163 7543 1 20 . 1 1 57 57 GLN HA H 57 4.009 4.009 4.083 -0.074 19163 7544 1 20 . 1 1 57 57 GLN C C 57 179.333 179.333 178.667 0.666 19163 7545 1 20 . 1 1 57 57 GLN CA C 57 59.109 59.109 58.681 0.428 19163 7546 1 20 . 1 1 57 57 GLN CB C 57 28.595 28.595 28.657 -0.062 19163 7547 1 20 . 1 1 57 57 GLN H H 57 7.613 7.613 7.601 0.012 19163 7548 1 20 . 1 1 58 58 ILE N N 58 118.709 118.709 120.738 -2.029 19163 7549 1 20 . 1 1 58 58 ILE HA H 58 3.559 3.559 3.597 -0.038 19163 7550 1 20 . 1 1 58 58 ILE C C 58 177.152 177.152 177.964 -0.812 19163 7551 1 20 . 1 1 58 58 ILE CA C 58 65.068 65.068 65.428 -0.360 19163 7552 1 20 . 1 1 58 58 ILE CB C 58 38.381 38.381 37.524 0.857 19163 7553 1 20 . 1 1 58 58 ILE H H 58 8.011 8.011 7.465 0.546 19163 7554 1 20 . 1 1 59 59 SER N N 59 116.112 116.112 115.068 1.044 19163 7555 1 20 . 1 1 59 59 SER HA H 59 3.948 3.948 3.971 -0.023 19163 7556 1 20 . 1 1 59 59 SER C C 59 175.949 175.949 176.808 -0.859 19163 7557 1 20 . 1 1 59 59 SER CA C 59 62.315 62.315 62.016 0.299 19163 7558 1 20 . 1 1 59 59 SER H H 59 8.030 8.030 8.090 -0.060 19163 7559 1 20 . 1 1 60 60 GLN N N 60 122.099 122.099 120.777 1.322 19163 7560 1 20 . 1 1 60 60 GLN HA H 60 3.801 3.801 3.903 -0.102 19163 7561 1 20 . 1 1 60 60 GLN C C 60 176.942 176.942 178.196 -1.254 19163 7562 1 20 . 1 1 60 60 GLN CA C 60 58.762 58.762 58.737 0.025 19163 7563 1 20 . 1 1 60 60 GLN CB C 60 28.498 28.498 28.818 -0.320 19163 7564 1 20 . 1 1 60 60 GLN H H 60 7.933 7.933 7.813 0.120 19163 7565 1 20 . 1 1 61 61 ALA N N 61 119.367 119.367 123.058 -3.691 19163 7566 1 20 . 1 1 61 61 ALA HA H 61 2.636 2.636 3.736 -1.100 19163 7567 1 20 . 1 1 61 61 ALA C C 61 178.507 178.507 178.820 -0.313 19163 7568 1 20 . 1 1 61 61 ALA CA C 61 54.126 54.126 55.259 -1.133 19163 7569 1 20 . 1 1 61 61 ALA CB C 61 18.462 18.462 18.516 -0.054 19163 7570 1 20 . 1 1 61 61 ALA H H 61 7.354 7.354 8.296 -0.942 19163 7571 1 20 . 1 1 62 62 TYR N N 62 115.613 115.613 119.791 -4.178 19163 7572 1 20 . 1 1 62 62 TYR HA H 62 3.633 3.633 3.890 -0.257 19163 7573 1 20 . 1 1 62 62 TYR C C 62 177.421 177.421 177.693 -0.272 19163 7574 1 20 . 1 1 62 62 TYR CA C 62 61.676 61.676 61.370 0.306 19163 7575 1 20 . 1 1 62 62 TYR CB C 62 39.162 39.162 37.949 1.213 19163 7576 1 20 . 1 1 62 62 TYR H H 62 7.994 7.994 8.655 -0.661 19163 7577 1 20 . 1 1 63 63 GLU N N 63 121.396 121.396 120.076 1.320 19163 7578 1 20 . 1 1 63 63 GLU HA H 63 3.347 3.347 3.633 -0.286 19163 7579 1 20 . 1 1 63 63 GLU C C 63 177.687 177.687 178.171 -0.484 19163 7580 1 20 . 1 1 63 63 GLU CA C 63 59.562 59.562 59.274 0.288 19163 7581 1 20 . 1 1 63 63 GLU CB C 63 29.115 29.115 29.092 0.023 19163 7582 1 20 . 1 1 63 63 GLU H H 63 8.151 8.151 8.046 0.105 19163 7583 1 20 . 1 1 64 64 VAL N N 64 115.850 115.850 117.271 -1.421 19163 7584 1 20 . 1 1 64 64 VAL HA H 64 3.377 3.377 3.755 -0.378 19163 7585 1 20 . 1 1 64 64 VAL C C 64 175.925 175.925 177.923 -1.998 19163 7586 1 20 . 1 1 64 64 VAL CA C 64 65.806 65.806 64.889 0.917 19163 7587 1 20 . 1 1 64 64 VAL CB C 64 31.786 31.786 31.361 0.425 19163 7588 1 20 . 1 1 64 64 VAL H H 64 6.814 6.814 7.159 -0.345 19163 7589 1 20 . 1 1 65 65 LEU N N 65 111.438 111.438 121.376 -9.938 19163 7590 1 20 . 1 1 65 65 LEU HA H 65 3.569 3.569 3.925 -0.356 19163 7591 1 20 . 1 1 65 65 LEU C C 65 177.124 177.124 178.417 -1.293 19163 7592 1 20 . 1 1 65 65 LEU CA C 65 56.645 56.645 57.143 -0.498 19163 7593 1 20 . 1 1 65 65 LEU CB C 65 42.589 42.589 40.555 2.034 19163 7594 1 20 . 1 1 65 65 LEU H H 65 7.398 7.398 8.470 -1.072 19163 7595 1 20 . 1 1 66 66 SER N N 66 108.642 108.642 112.455 -3.813 19163 7596 1 20 . 1 1 66 66 SER HA H 66 4.028 4.028 4.095 -0.067 19163 7597 1 20 . 1 1 66 66 SER C C 66 173.286 173.286 173.808 -0.522 19163 7598 1 20 . 1 1 66 66 SER CA C 66 59.232 59.232 60.790 -1.558 19163 7599 1 20 . 1 1 66 66 SER CB C 66 63.066 63.066 63.415 -0.349 19163 7600 1 20 . 1 1 66 66 SER H H 66 7.700 7.700 7.411 0.289 19163 7601 1 20 . 1 1 67 67 ASP N N 67 124.276 124.276 120.837 3.439 19163 7602 1 20 . 1 1 67 67 ASP HA H 67 4.668 4.668 4.789 -0.121 19163 7603 1 20 . 1 1 67 67 ASP C C 67 174.913 174.913 175.314 -0.401 19163 7604 1 20 . 1 1 67 67 ASP CA C 67 52.487 52.487 53.195 -0.708 19163 7605 1 20 . 1 1 67 67 ASP CB C 67 43.218 43.218 42.955 0.264 19163 7606 1 20 . 1 1 67 67 ASP H H 67 6.879 6.879 7.328 -0.449 19163 7607 1 20 . 1 1 68 68 ALA N N 68 127.326 127.326 128.678 -1.352 19163 7608 1 20 . 1 1 68 68 ALA HA H 68 3.853 3.853 3.902 -0.049 19163 7609 1 20 . 1 1 68 68 ALA C C 68 180.336 180.336 179.080 1.256 19163 7610 1 20 . 1 1 68 68 ALA CA C 68 55.912 55.912 55.564 0.348 19163 7611 1 20 . 1 1 68 68 ALA CB C 68 18.645 18.645 18.667 -0.022 19163 7612 1 20 . 1 1 68 68 ALA H H 68 8.693 8.693 8.835 -0.142 19163 7613 1 20 . 1 1 69 69 LYS N N 69 116.929 116.929 118.256 -1.327 19163 7614 1 20 . 1 1 69 69 LYS HA H 69 4.162 4.162 4.048 0.114 19163 7615 1 20 . 1 1 69 69 LYS C C 69 179.515 179.515 178.773 0.742 19163 7616 1 20 . 1 1 69 69 LYS CA C 69 58.562 58.562 59.653 -1.091 19163 7617 1 20 . 1 1 69 69 LYS CB C 69 31.840 31.840 32.058 -0.218 19163 7618 1 20 . 1 1 69 69 LYS H H 69 7.950 7.950 8.440 -0.490 19163 7619 1 20 . 1 1 70 70 LYS N N 70 121.286 121.286 118.847 2.439 19163 7620 1 20 . 1 1 70 70 LYS HA H 70 3.960 3.960 3.972 -0.012 19163 7621 1 20 . 1 1 70 70 LYS C C 70 179.938 179.938 179.091 0.847 19163 7622 1 20 . 1 1 70 70 LYS CA C 70 60.066 60.066 59.483 0.583 19163 7623 1 20 . 1 1 70 70 LYS CB C 70 32.695 32.695 32.154 0.541 19163 7624 1 20 . 1 1 70 70 LYS H H 70 8.184 8.184 7.621 0.563 19163 7625 1 20 . 1 1 71 71 ARG N N 71 122.794 122.794 119.789 3.005 19163 7626 1 20 . 1 1 71 71 ARG HA H 71 3.668 3.668 3.971 -0.303 19163 7627 1 20 . 1 1 71 71 ARG C C 71 177.356 177.356 178.183 -0.827 19163 7628 1 20 . 1 1 71 71 ARG CA C 71 60.127 60.127 59.682 0.445 19163 7629 1 20 . 1 1 71 71 ARG CB C 71 29.668 29.668 30.147 -0.479 19163 7630 1 20 . 1 1 71 71 ARG H H 71 9.290 9.290 8.174 1.116 19163 7631 1 20 . 1 1 72 72 GLU N N 72 118.390 118.390 119.541 -1.151 19163 7632 1 20 . 1 1 72 72 GLU HA H 72 4.096 4.096 4.160 -0.064 19163 7633 1 20 . 1 1 72 72 GLU C C 72 179.073 179.073 179.208 -0.135 19163 7634 1 20 . 1 1 72 72 GLU CA C 72 59.456 59.456 59.230 0.226 19163 7635 1 20 . 1 1 72 72 GLU CB C 72 29.615 29.615 29.638 -0.023 19163 7636 1 20 . 1 1 72 72 GLU H H 72 7.607 7.607 7.890 -0.283 19163 7637 1 20 . 1 1 73 73 LEU N N 73 117.921 117.921 119.837 -1.916 19163 7638 1 20 . 1 1 73 73 LEU HA H 73 4.032 4.032 3.992 0.040 19163 7639 1 20 . 1 1 73 73 LEU C C 73 179.696 179.696 178.883 0.813 19163 7640 1 20 . 1 1 73 73 LEU CA C 73 57.597 57.597 57.573 0.024 19163 7641 1 20 . 1 1 73 73 LEU CB C 73 41.815 41.815 41.724 0.091 19163 7642 1 20 . 1 1 73 73 LEU H H 73 7.398 7.398 8.077 -0.679 19163 7643 1 20 . 1 1 74 74 TYR N N 74 122.662 122.662 119.643 3.019 19163 7644 1 20 . 1 1 74 74 TYR HA H 74 4.092 4.092 4.046 0.046 19163 7645 1 20 . 1 1 74 74 TYR C C 74 178.166 178.166 178.527 -0.361 19163 7646 1 20 . 1 1 74 74 TYR CA C 74 61.458 61.458 61.688 -0.230 19163 7647 1 20 . 1 1 74 74 TYR CB C 74 38.778 38.778 38.538 0.239 19163 7648 1 20 . 1 1 74 74 TYR H H 74 8.316 8.316 8.258 0.058 19163 7649 1 20 . 1 1 75 75 ASP N N 75 118.842 118.842 119.233 -0.391 19163 7650 1 20 . 1 1 75 75 ASP HA H 75 4.423 4.423 4.457 -0.034 19163 7651 1 20 . 1 1 75 75 ASP C C 75 177.726 177.726 177.383 0.343 19163 7652 1 20 . 1 1 75 75 ASP CA C 75 56.177 56.177 56.842 -0.665 19163 7653 1 20 . 1 1 75 75 ASP CB C 75 40.800 40.800 40.678 0.122 19163 7654 1 20 . 1 1 75 75 ASP H H 75 8.770 8.770 8.116 0.654 19163 7655 1 20 . 1 1 76 76 LYS N N 76 118.955 118.955 117.535 1.420 19163 7656 1 20 . 1 1 76 76 LYS HA H 76 4.130 4.130 4.357 -0.227 19163 7657 1 20 . 1 1 76 76 LYS C C 76 177.006 177.006 176.893 0.113 19163 7658 1 20 . 1 1 76 76 LYS CA C 76 57.537 57.537 56.183 1.354 19163 7659 1 20 . 1 1 76 76 LYS CB C 76 33.136 33.136 33.268 -0.132 19163 7660 1 20 . 1 1 76 76 LYS H H 76 7.610 7.610 7.613 -0.003 19163 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 62 2.464 0.966 2.285 19163 2 1 1 "Average Difference" HA 68 0.326 0.099 0.313 19163 3 1 1 "Average Difference" C 66 0.824 -0.015 0.830 19163 4 1 1 "Average Difference" CA 66 0.931 0.063 0.936 19163 5 1 1 "Average Difference" CB 63 0.626 -0.170 0.607 19163 6 1 1 "Average Difference" HN 62 0.556 0.062 0.557 19163 7 1 2 "Average Difference" N 62 2.335 0.800 2.212 19163 8 1 2 "Average Difference" HA 68 0.339 0.110 0.323 19163 9 1 2 "Average Difference" C 66 0.858 -0.027 0.864 19163 10 1 2 "Average Difference" CA 66 0.914 0.081 0.918 19163 11 1 2 "Average Difference" CB 63 0.786 -0.151 0.778 19163 12 1 2 "Average Difference" HN 62 0.575 0.061 0.577 19163 13 1 3 "Average Difference" N 62 2.514 0.834 2.391 19163 14 1 3 "Average Difference" HA 68 0.315 0.106 0.299 19163 15 1 3 "Average Difference" C 66 0.801 0.038 0.807 19163 16 1 3 "Average Difference" CA 66 0.917 -0.008 0.924 19163 17 1 3 "Average Difference" CB 63 0.738 -0.291 0.684 19163 18 1 3 "Average Difference" HN 62 0.497 0.043 0.499 19163 19 1 4 "Average Difference" N 62 2.537 0.842 2.413 19163 20 1 4 "Average Difference" HA 68 0.351 0.115 0.334 19163 21 1 4 "Average Difference" C 66 0.840 0.003 0.847 19163 22 1 4 "Average Difference" CA 66 0.926 0.032 0.932 19163 23 1 4 "Average Difference" CB 63 0.709 -0.189 0.689 19163 24 1 4 "Average Difference" HN 62 0.494 0.057 0.494 19163 25 1 5 "Average Difference" N 62 2.595 0.842 2.475 19163 26 1 5 "Average Difference" HA 68 0.370 0.125 0.351 19163 27 1 5 "Average Difference" C 66 0.818 -0.048 0.823 19163 28 1 5 "Average Difference" CA 66 0.856 0.005 0.863 19163 29 1 5 "Average Difference" CB 63 0.716 -0.158 0.704 19163 30 1 5 "Average Difference" HN 62 0.539 0.072 0.539 19163 31 1 6 "Average Difference" N 62 2.564 0.996 2.382 19163 32 1 6 "Average Difference" HA 68 0.331 0.116 0.313 19163 33 1 6 "Average Difference" C 66 0.811 -0.042 0.817 19163 34 1 6 "Average Difference" CA 66 0.829 0.092 0.830 19163 35 1 6 "Average Difference" CB 63 0.742 -0.163 0.729 19163 36 1 6 "Average Difference" HN 62 0.542 0.037 0.545 19163 37 1 7 "Average Difference" N 62 2.499 0.833 2.375 19163 38 1 7 "Average Difference" HA 68 0.331 0.112 0.313 19163 39 1 7 "Average Difference" C 66 0.824 -0.006 0.830 19163 40 1 7 "Average Difference" CA 66 0.909 0.068 0.913 19163 41 1 7 "Average Difference" CB 63 0.702 -0.159 0.689 19163 42 1 7 "Average Difference" HN 62 0.515 0.049 0.517 19163 43 1 8 "Average Difference" N 62 2.614 0.894 2.476 19163 44 1 8 "Average Difference" HA 68 0.348 0.111 0.333 19163 45 1 8 "Average Difference" C 66 0.852 -0.051 0.857 19163 46 1 8 "Average Difference" CA 66 0.875 0.063 0.880 19163 47 1 8 "Average Difference" CB 63 0.723 -0.123 0.718 19163 48 1 8 "Average Difference" HN 62 0.555 0.057 0.556 19163 49 1 9 "Average Difference" N 62 2.601 1.039 2.404 19163 50 1 9 "Average Difference" HA 68 0.322 0.107 0.306 19163 51 1 9 "Average Difference" C 66 0.821 -0.020 0.827 19163 52 1 9 "Average Difference" CA 66 0.815 0.059 0.819 19163 53 1 9 "Average Difference" CB 63 0.670 -0.134 0.662 19163 54 1 9 "Average Difference" HN 62 0.532 0.029 0.535 19163 55 1 10 "Average Difference" N 62 2.404 0.916 2.241 19163 56 1 10 "Average Difference" HA 68 0.335 0.121 0.314 19163 57 1 10 "Average Difference" C 66 0.835 -0.023 0.841 19163 58 1 10 "Average Difference" CA 66 0.879 0.081 0.882 19163 59 1 10 "Average Difference" CB 63 0.748 -0.132 0.743 19163 60 1 10 "Average Difference" HN 62 0.573 0.062 0.574 19163 61 1 11 "Average Difference" N 62 2.435 0.830 2.308 19163 62 1 11 "Average Difference" HA 68 0.324 0.106 0.309 19163 63 1 11 "Average Difference" C 66 0.814 -0.009 0.820 19163 64 1 11 "Average Difference" CA 66 0.874 -0.025 0.880 19163 65 1 11 "Average Difference" CB 63 0.754 -0.165 0.742 19163 66 1 11 "Average Difference" HN 62 0.572 0.054 0.574 19163 67 1 12 "Average Difference" N 62 2.387 1.016 2.178 19163 68 1 12 "Average Difference" HA 68 0.330 0.123 0.309 19163 69 1 12 "Average Difference" C 66 0.816 -0.013 0.822 19163 70 1 12 "Average Difference" CA 66 0.880 0.036 0.886 19163 71 1 12 "Average Difference" CB 63 0.656 -0.176 0.637 19163 72 1 12 "Average Difference" HN 62 0.543 0.076 0.542 19163 73 1 13 "Average Difference" N 62 2.713 1.012 2.538 19163 74 1 13 "Average Difference" HA 68 0.339 0.107 0.324 19163 75 1 13 "Average Difference" C 66 0.850 -0.025 0.857 19163 76 1 13 "Average Difference" CA 66 0.776 0.024 0.782 19163 77 1 13 "Average Difference" CB 63 0.749 -0.227 0.719 19163 78 1 13 "Average Difference" HN 62 0.555 0.027 0.559 19163 79 1 14 "Average Difference" N 62 2.496 0.840 2.369 19163 80 1 14 "Average Difference" HA 68 0.318 0.101 0.304 19163 81 1 14 "Average Difference" C 66 0.866 -0.045 0.872 19163 82 1 14 "Average Difference" CA 66 0.980 0.020 0.987 19163 83 1 14 "Average Difference" CB 63 0.761 -0.216 0.735 19163 84 1 14 "Average Difference" HN 62 0.491 0.020 0.495 19163 85 1 15 "Average Difference" N 62 2.303 0.835 2.164 19163 86 1 15 "Average Difference" HA 68 0.338 0.123 0.318 19163 87 1 15 "Average Difference" C 66 0.846 0.050 0.851 19163 88 1 15 "Average Difference" CA 66 0.927 0.110 0.928 19163 89 1 15 "Average Difference" CB 63 0.764 -0.229 0.734 19163 90 1 15 "Average Difference" HN 62 0.522 0.058 0.523 19163 91 1 16 "Average Difference" N 62 2.468 0.964 2.290 19163 92 1 16 "Average Difference" HA 68 0.344 0.103 0.331 19163 93 1 16 "Average Difference" C 66 0.806 0.005 0.812 19163 94 1 16 "Average Difference" CA 66 0.936 0.052 0.942 19163 95 1 16 "Average Difference" CB 63 0.729 -0.161 0.717 19163 96 1 16 "Average Difference" HN 62 0.503 0.097 0.498 19163 97 1 17 "Average Difference" N 62 2.338 0.779 2.222 19163 98 1 17 "Average Difference" HA 68 0.348 0.094 0.338 19163 99 1 17 "Average Difference" C 66 0.858 -0.019 0.864 19163 100 1 17 "Average Difference" CA 66 0.916 0.091 0.919 19163 101 1 17 "Average Difference" CB 63 0.758 -0.156 0.747 19163 102 1 17 "Average Difference" HN 62 0.504 0.060 0.504 19163 103 1 18 "Average Difference" N 62 2.488 0.951 2.318 19163 104 1 18 "Average Difference" HA 68 0.286 0.101 0.269 19163 105 1 18 "Average Difference" C 66 0.891 -0.075 0.895 19163 106 1 18 "Average Difference" CA 66 0.842 0.092 0.843 19163 107 1 18 "Average Difference" CB 63 0.753 -0.133 0.747 19163 108 1 18 "Average Difference" HN 62 0.539 0.046 0.541 19163 109 1 19 "Average Difference" N 62 2.447 0.685 2.368 19163 110 1 19 "Average Difference" HA 68 0.359 0.113 0.343 19163 111 1 19 "Average Difference" C 66 0.838 -0.030 0.844 19163 112 1 19 "Average Difference" CA 66 0.925 0.048 0.931 19163 113 1 19 "Average Difference" CB 63 0.826 -0.197 0.808 19163 114 1 19 "Average Difference" HN 62 0.502 0.053 0.504 19163 115 1 20 "Average Difference" N 62 2.521 0.921 2.366 19163 116 1 20 "Average Difference" HA 68 0.354 0.125 0.334 19163 117 1 20 "Average Difference" C 66 0.823 -0.005 0.829 19163 118 1 20 "Average Difference" CA 66 0.973 0.107 0.974 19163 119 1 20 "Average Difference" CB 63 0.718 -0.184 0.700 19163 120 1 20 "Average Difference" HN 62 0.595 0.080 0.595 19163 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 19163 _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 11 11 MET HA H 11 4.346 4.346 4.526 -0.180 19163 2 1 . 1 1 11 11 MET C C 11 175.801 175.801 175.632 0.169 19163 3 1 . 1 1 11 11 MET CA C 11 55.614 55.614 54.696 0.918 19163 4 1 . 1 1 11 11 MET CB C 11 32.925 32.925 33.482 -0.557 19163 5 1 . 1 1 12 12 VAL N N 12 121.226 121.226 122.827 -1.601 19163 6 1 . 1 1 12 12 VAL HA H 12 4.026 4.026 4.145 -0.119 19163 7 1 . 1 1 12 12 VAL C C 12 175.701 175.701 175.436 0.265 19163 8 1 . 1 1 12 12 VAL CA C 12 62.188 62.188 62.225 -0.037 19163 9 1 . 1 1 12 12 VAL CB C 12 32.882 32.882 31.737 1.145 19163 10 1 . 1 1 12 12 VAL H H 12 7.988 7.988 8.434 -0.446 19163 11 1 . 1 1 13 13 LYS N N 13 125.255 125.255 128.032 -2.777 19163 12 1 . 1 1 13 13 LYS HA H 13 4.211 4.211 4.462 -0.251 19163 13 1 . 1 1 13 13 LYS C C 13 176.121 176.121 175.605 0.516 19163 14 1 . 1 1 13 13 LYS CA C 13 56.355 56.355 55.731 0.624 19163 15 1 . 1 1 13 13 LYS CB C 13 33.019 33.019 32.887 0.132 19163 16 1 . 1 1 13 13 LYS H H 13 8.281 8.281 8.503 -0.222 19163 17 1 . 1 1 14 14 GLU N N 14 123.004 123.004 122.318 0.686 19163 18 1 . 1 1 14 14 GLU HA H 14 4.305 4.305 4.072 0.233 19163 19 1 . 1 1 14 14 GLU C C 14 176.107 176.107 175.280 0.827 19163 20 1 . 1 1 14 14 GLU CA C 14 56.343 56.343 56.521 -0.178 19163 21 1 . 1 1 14 14 GLU CB C 14 30.534 30.534 29.514 1.021 19163 22 1 . 1 1 14 14 GLU H H 14 8.424 8.424 8.636 -0.212 19163 23 1 . 1 1 15 15 THR N N 15 115.895 115.895 116.586 -0.691 19163 24 1 . 1 1 15 15 THR HA H 15 4.538 4.538 4.467 0.071 19163 25 1 . 1 1 15 15 THR C C 15 175.233 175.233 174.288 0.945 19163 26 1 . 1 1 15 15 THR CA C 15 61.981 61.981 62.515 -0.534 19163 27 1 . 1 1 15 15 THR CB C 15 69.865 69.865 69.232 0.633 19163 28 1 . 1 1 15 15 THR H H 15 8.335 8.335 8.188 0.148 19163 29 1 . 1 1 16 16 THR N N 16 116.992 116.992 119.066 -2.074 19163 30 1 . 1 1 16 16 THR HA H 16 4.366 4.366 4.434 -0.068 19163 31 1 . 1 1 16 16 THR C C 16 176.090 176.090 175.237 0.853 19163 32 1 . 1 1 16 16 THR CA C 16 62.172 62.172 59.672 2.500 19163 33 1 . 1 1 16 16 THR CB C 16 71.997 71.997 70.508 1.489 19163 34 1 . 1 1 16 16 THR H H 16 8.798 8.798 8.128 0.670 19163 35 1 . 1 1 17 17 TYR N N 17 117.617 117.617 120.322 -2.705 19163 36 1 . 1 1 17 17 TYR HA H 17 4.329 4.329 4.257 0.072 19163 37 1 . 1 1 17 17 TYR C C 17 177.105 177.105 177.951 -0.846 19163 38 1 . 1 1 17 17 TYR CA C 17 57.577 57.577 61.973 -4.396 19163 39 1 . 1 1 17 17 TYR CB C 17 37.113 37.113 37.971 -0.858 19163 40 1 . 1 1 17 17 TYR H H 17 8.292 8.292 8.908 -0.616 19163 41 1 . 1 1 18 18 TYR N N 18 115.048 115.048 117.653 -2.605 19163 42 1 . 1 1 18 18 TYR HA H 18 3.775 3.775 4.268 -0.493 19163 43 1 . 1 1 18 18 TYR C C 18 177.771 177.771 177.795 -0.024 19163 44 1 . 1 1 18 18 TYR CA C 18 61.430 61.430 61.483 -0.053 19163 45 1 . 1 1 18 18 TYR CB C 18 36.495 36.495 37.513 -1.018 19163 46 1 . 1 1 18 18 TYR H H 18 7.047 7.047 8.145 -1.098 19163 47 1 . 1 1 19 19 ASP N N 19 119.520 119.520 119.515 0.005 19163 48 1 . 1 1 19 19 ASP HA H 19 4.406 4.406 4.438 -0.032 19163 49 1 . 1 1 19 19 ASP C C 19 180.128 180.128 178.577 1.551 19163 50 1 . 1 1 19 19 ASP CA C 19 57.475 57.475 57.369 0.106 19163 51 1 . 1 1 19 19 ASP CB C 19 40.659 40.659 40.682 -0.023 19163 52 1 . 1 1 19 19 ASP H H 19 7.685 7.685 8.235 -0.550 19163 53 1 . 1 1 20 20 VAL N N 20 119.772 119.772 119.334 0.438 19163 54 1 . 1 1 20 20 VAL HA H 20 3.608 3.608 3.744 -0.136 19163 55 1 . 1 1 20 20 VAL C C 20 177.026 177.026 177.413 -0.387 19163 56 1 . 1 1 20 20 VAL CA C 20 65.840 65.840 65.802 0.038 19163 57 1 . 1 1 20 20 VAL CB C 20 31.530 31.530 31.820 -0.290 19163 58 1 . 1 1 20 20 VAL H H 20 8.004 8.004 8.313 -0.309 19163 59 1 . 1 1 21 21 LEU N N 21 115.252 115.252 116.592 -1.340 19163 60 1 . 1 1 21 21 LEU HA H 21 4.281 4.281 4.352 -0.071 19163 61 1 . 1 1 21 21 LEU C C 21 175.757 175.757 177.077 -1.320 19163 62 1 . 1 1 21 21 LEU CA C 21 54.554 54.554 54.654 -0.100 19163 63 1 . 1 1 21 21 LEU CB C 21 42.869 42.869 41.997 0.872 19163 64 1 . 1 1 21 21 LEU H H 21 6.847 6.847 7.678 -0.831 19163 65 1 . 1 1 22 22 GLY N N 22 108.227 108.227 107.318 0.909 19163 66 1 . 1 1 22 22 GLY C C 22 175.361 175.361 174.221 1.140 19163 67 1 . 1 1 22 22 GLY CA C 22 46.574 46.574 45.745 0.829 19163 68 1 . 1 1 22 22 GLY H H 22 7.874 7.874 7.440 0.434 19163 69 1 . 1 1 23 23 VAL N N 23 110.675 110.675 118.806 -8.131 19163 70 1 . 1 1 23 23 VAL HA H 23 4.767 4.767 4.428 0.339 19163 71 1 . 1 1 23 23 VAL C C 23 174.674 174.674 174.548 0.126 19163 72 1 . 1 1 23 23 VAL CA C 23 58.349 58.349 59.867 -1.518 19163 73 1 . 1 1 23 23 VAL CB C 23 34.938 34.938 35.233 -0.295 19163 74 1 . 1 1 23 23 VAL H H 23 7.815 7.815 8.095 -0.280 19163 75 1 . 1 1 24 24 LYS N N 24 119.948 119.948 123.587 -3.640 19163 76 1 . 1 1 24 24 LYS HA H 24 4.488 4.488 4.721 -0.233 19163 77 1 . 1 1 24 24 LYS C C 24 175.442 175.442 176.012 -0.570 19163 78 1 . 1 1 24 24 LYS CA C 24 54.001 54.001 54.111 -0.110 19163 79 1 . 1 1 24 24 LYS CB C 24 32.197 32.197 31.912 0.285 19163 80 1 . 1 1 24 24 LYS H H 24 8.329 8.329 8.344 -0.015 19163 81 1 . 1 1 25 25 PRO HA H 25 2.421 2.421 4.345 -1.924 19163 82 1 . 1 1 25 25 PRO C C 25 175.635 175.635 176.461 -0.826 19163 83 1 . 1 1 25 25 PRO CA C 25 63.362 63.362 64.819 -1.457 19163 84 1 . 1 1 25 25 PRO CB C 25 31.839 31.839 31.824 0.015 19163 85 1 . 1 1 26 26 ASN N N 26 111.739 111.739 113.863 -2.124 19163 86 1 . 1 1 26 26 ASN HA H 26 4.518 4.518 4.768 -0.250 19163 87 1 . 1 1 26 26 ASN C C 26 175.820 175.820 174.784 1.036 19163 88 1 . 1 1 26 26 ASN CA C 26 51.525 51.525 51.805 -0.280 19163 89 1 . 1 1 26 26 ASN CB C 26 36.829 36.829 37.881 -1.052 19163 90 1 . 1 1 26 26 ASN H H 26 7.138 7.138 8.194 -1.056 19163 91 1 . 1 1 27 27 ALA N N 27 122.829 122.829 124.387 -1.558 19163 92 1 . 1 1 27 27 ALA HA H 27 4.325 4.325 4.478 -0.153 19163 93 1 . 1 1 27 27 ALA C C 27 178.726 178.726 177.112 1.614 19163 94 1 . 1 1 27 27 ALA CA C 27 52.961 52.961 52.279 0.682 19163 95 1 . 1 1 27 27 ALA CB C 27 19.159 19.159 19.778 -0.619 19163 96 1 . 1 1 27 27 ALA H H 27 7.637 7.637 7.564 0.073 19163 97 1 . 1 1 28 28 THR N N 28 113.468 113.468 114.021 -0.553 19163 98 1 . 1 1 28 28 THR HA H 28 4.493 4.493 4.407 0.086 19163 99 1 . 1 1 28 28 THR C C 28 175.641 175.641 175.771 -0.130 19163 100 1 . 1 1 28 28 THR CA C 28 60.592 60.592 60.916 -0.324 19163 101 1 . 1 1 28 28 THR CB C 28 71.304 71.304 70.542 0.762 19163 102 1 . 1 1 28 28 THR H H 28 8.829 8.829 8.062 0.767 19163 103 1 . 1 1 29 29 GLN N N 29 119.445 119.445 121.981 -2.536 19163 104 1 . 1 1 29 29 GLN HA H 29 4.035 4.035 3.927 0.108 19163 105 1 . 1 1 29 29 GLN C C 29 179.117 179.117 178.431 0.686 19163 106 1 . 1 1 29 29 GLN CA C 29 59.435 59.435 60.051 -0.616 19163 107 1 . 1 1 29 29 GLN CB C 29 27.851 27.851 28.443 -0.592 19163 108 1 . 1 1 29 29 GLN H H 29 9.015 9.015 8.824 0.191 19163 109 1 . 1 1 30 30 GLU N N 30 119.343 119.343 118.923 0.420 19163 110 1 . 1 1 30 30 GLU HA H 30 4.059 4.059 4.081 -0.022 19163 111 1 . 1 1 30 30 GLU C C 30 179.097 179.097 178.626 0.471 19163 112 1 . 1 1 30 30 GLU CA C 30 59.847 59.847 59.465 0.382 19163 113 1 . 1 1 30 30 GLU CB C 30 29.356 29.356 29.252 0.104 19163 114 1 . 1 1 30 30 GLU H H 30 8.549 8.549 8.618 -0.069 19163 115 1 . 1 1 31 31 GLU N N 31 120.562 120.562 120.635 -0.073 19163 116 1 . 1 1 31 31 GLU HA H 31 3.906 3.906 4.106 -0.200 19163 117 1 . 1 1 31 31 GLU C C 31 180.405 180.405 179.102 1.303 19163 118 1 . 1 1 31 31 GLU CA C 31 59.592 59.592 59.205 0.387 19163 119 1 . 1 1 31 31 GLU CB C 31 29.989 29.989 29.414 0.575 19163 120 1 . 1 1 31 31 GLU H H 31 7.768 7.768 8.148 -0.380 19163 121 1 . 1 1 32 32 LEU N N 32 120.518 120.518 120.168 0.350 19163 122 1 . 1 1 32 32 LEU HA H 32 3.963 3.963 4.015 -0.052 19163 123 1 . 1 1 32 32 LEU C C 32 177.873 177.873 179.148 -1.275 19163 124 1 . 1 1 32 32 LEU CA C 32 58.593 58.593 57.842 0.751 19163 125 1 . 1 1 32 32 LEU CB C 32 42.556 42.556 41.181 1.375 19163 126 1 . 1 1 32 32 LEU H H 32 8.475 8.475 8.628 -0.153 19163 127 1 . 1 1 33 33 LYS N N 33 119.091 119.091 119.294 -0.203 19163 128 1 . 1 1 33 33 LYS HA H 33 4.000 4.000 4.202 -0.202 19163 129 1 . 1 1 33 33 LYS C C 33 178.701 178.701 178.978 -0.277 19163 130 1 . 1 1 33 33 LYS CA C 33 60.274 60.274 59.973 0.301 19163 131 1 . 1 1 33 33 LYS CB C 33 32.656 32.656 32.286 0.370 19163 132 1 . 1 1 33 33 LYS H H 33 8.077 8.077 7.791 0.286 19163 133 1 . 1 1 34 34 LYS N N 34 118.527 118.527 119.701 -1.174 19163 134 1 . 1 1 34 34 LYS HA H 34 3.890 3.890 4.034 -0.144 19163 135 1 . 1 1 34 34 LYS C C 34 179.172 179.172 178.818 0.354 19163 136 1 . 1 1 34 34 LYS CA C 34 59.927 59.927 59.383 0.544 19163 137 1 . 1 1 34 34 LYS CB C 34 32.869 32.869 32.359 0.510 19163 138 1 . 1 1 34 34 LYS H H 34 7.986 7.986 8.065 -0.079 19163 139 1 . 1 1 35 35 ALA N N 35 122.190 122.190 122.265 -0.076 19163 140 1 . 1 1 35 35 ALA HA H 35 4.116 4.116 4.042 0.074 19163 141 1 . 1 1 35 35 ALA C C 35 179.982 179.982 178.979 1.003 19163 142 1 . 1 1 35 35 ALA CA C 35 55.157 55.157 55.270 -0.113 19163 143 1 . 1 1 35 35 ALA CB C 35 18.773 18.773 18.297 0.476 19163 144 1 . 1 1 35 35 ALA H H 35 7.917 7.917 8.300 -0.383 19163 145 1 . 1 1 36 36 TYR N N 36 117.701 117.701 120.369 -2.668 19163 146 1 . 1 1 36 36 TYR HA H 36 3.818 3.818 4.014 -0.196 19163 147 1 . 1 1 36 36 TYR C C 36 176.344 176.344 177.535 -1.191 19163 148 1 . 1 1 36 36 TYR CA C 36 61.468 61.468 61.412 0.056 19163 149 1 . 1 1 36 36 TYR CB C 36 38.890 38.890 38.251 0.639 19163 150 1 . 1 1 36 36 TYR H H 36 8.402 8.402 7.859 0.543 19163 151 1 . 1 1 37 37 ARG N N 37 117.423 117.423 118.949 -1.526 19163 152 1 . 1 1 37 37 ARG HA H 37 3.481 3.481 3.690 -0.209 19163 153 1 . 1 1 37 37 ARG C C 37 178.825 178.825 178.270 0.555 19163 154 1 . 1 1 37 37 ARG CA C 37 59.397 59.397 59.714 -0.318 19163 155 1 . 1 1 37 37 ARG CB C 37 29.710 29.710 30.041 -0.331 19163 156 1 . 1 1 37 37 ARG H H 37 8.264 8.264 8.345 -0.081 19163 157 1 . 1 1 38 38 LYS N N 38 117.247 117.247 120.050 -2.803 19163 158 1 . 1 1 38 38 LYS HA H 38 3.905 3.905 4.023 -0.118 19163 159 1 . 1 1 38 38 LYS C C 38 179.444 179.444 179.132 0.312 19163 160 1 . 1 1 38 38 LYS CA C 38 59.450 59.450 59.493 -0.043 19163 161 1 . 1 1 38 38 LYS CB C 38 32.609 32.609 32.342 0.267 19163 162 1 . 1 1 38 38 LYS H H 38 7.444 7.444 7.819 -0.375 19163 163 1 . 1 1 39 39 LEU N N 39 119.901 119.901 119.324 0.577 19163 164 1 . 1 1 39 39 LEU HA H 39 4.020 4.020 4.135 -0.115 19163 165 1 . 1 1 39 39 LEU C C 39 178.801 178.801 178.826 -0.025 19163 166 1 . 1 1 39 39 LEU CA C 39 57.409 57.409 57.662 -0.253 19163 167 1 . 1 1 39 39 LEU CB C 39 42.388 42.388 41.654 0.734 19163 168 1 . 1 1 39 39 LEU H H 39 7.707 7.707 8.107 -0.400 19163 169 1 . 1 1 40 40 ALA N N 40 122.772 122.772 122.014 0.758 19163 170 1 . 1 1 40 40 ALA HA H 40 3.849 3.849 4.045 -0.196 19163 171 1 . 1 1 40 40 ALA C C 40 179.446 179.446 179.331 0.115 19163 172 1 . 1 1 40 40 ALA CA C 40 55.109 55.109 55.072 0.037 19163 173 1 . 1 1 40 40 ALA CB C 40 17.116 17.116 18.085 -0.969 19163 174 1 . 1 1 40 40 ALA H H 40 8.931 8.931 8.187 0.744 19163 175 1 . 1 1 41 41 LEU N N 41 115.299 115.299 117.006 -1.707 19163 176 1 . 1 1 41 41 LEU HA H 41 3.977 3.977 3.883 0.094 19163 177 1 . 1 1 41 41 LEU C C 41 178.216 178.216 179.036 -0.820 19163 178 1 . 1 1 41 41 LEU CA C 41 57.088 57.088 57.200 -0.112 19163 179 1 . 1 1 41 41 LEU CB C 41 42.162 42.162 41.701 0.461 19163 180 1 . 1 1 41 41 LEU H H 41 7.133 7.133 7.553 -0.420 19163 181 1 . 1 1 42 42 LYS N N 42 116.812 116.812 117.838 -1.026 19163 182 1 . 1 1 42 42 LYS HA H 42 3.925 3.925 3.997 -0.072 19163 183 1 . 1 1 42 42 LYS C C 42 177.560 177.560 177.971 -0.412 19163 184 1 . 1 1 42 42 LYS CA C 42 57.885 57.885 58.061 -0.176 19163 185 1 . 1 1 42 42 LYS CB C 42 33.427 33.427 32.673 0.754 19163 186 1 . 1 1 42 42 LYS H H 42 7.038 7.038 7.431 -0.393 19163 187 1 . 1 1 43 43 TYR N N 43 114.022 114.022 115.112 -1.090 19163 188 1 . 1 1 43 43 TYR HA H 43 4.665 4.665 4.570 0.095 19163 189 1 . 1 1 43 43 TYR C C 43 173.741 173.741 174.317 -0.576 19163 190 1 . 1 1 43 43 TYR CA C 43 56.928 56.928 56.588 0.340 19163 191 1 . 1 1 43 43 TYR CB C 43 39.579 39.579 37.681 1.898 19163 192 1 . 1 1 43 43 TYR H H 43 7.683 7.683 8.130 -0.447 19163 193 1 . 1 1 44 44 HIS N N 44 120.947 120.947 121.648 -0.701 19163 194 1 . 1 1 44 44 HIS HA H 44 3.697 3.697 4.211 -0.514 19163 195 1 . 1 1 44 44 HIS C C 44 174.925 174.925 174.692 0.233 19163 196 1 . 1 1 44 44 HIS CA C 44 56.229 56.229 55.478 0.751 19163 197 1 . 1 1 44 44 HIS CB C 44 30.852 30.852 30.401 0.451 19163 198 1 . 1 1 44 44 HIS H H 44 7.814 7.814 7.551 0.263 19163 199 1 . 1 1 45 45 PRO HA H 45 4.131 4.131 4.394 -0.263 19163 200 1 . 1 1 45 45 PRO C C 45 177.269 177.269 177.530 -0.261 19163 201 1 . 1 1 45 45 PRO CA C 45 64.723 64.723 64.978 -0.255 19163 202 1 . 1 1 45 45 PRO CB C 45 32.070 32.070 31.840 0.230 19163 203 1 . 1 1 46 46 ASP N N 46 119.127 119.127 116.676 2.451 19163 204 1 . 1 1 46 46 ASP HA H 46 4.375 4.375 4.423 -0.048 19163 205 1 . 1 1 46 46 ASP C C 46 177.284 177.284 177.107 0.177 19163 206 1 . 1 1 46 46 ASP CA C 46 56.020 56.020 56.153 -0.133 19163 207 1 . 1 1 46 46 ASP CB C 46 40.221 40.221 40.538 -0.317 19163 208 1 . 1 1 46 46 ASP H H 46 10.040 10.040 7.948 2.092 19163 209 1 . 1 1 47 47 LYS N N 47 117.416 117.416 118.344 -0.928 19163 210 1 . 1 1 47 47 LYS HA H 47 4.315 4.315 4.303 0.012 19163 211 1 . 1 1 47 47 LYS C C 47 176.355 176.355 176.494 -0.139 19163 212 1 . 1 1 47 47 LYS CA C 47 55.880 55.880 57.088 -1.208 19163 213 1 . 1 1 47 47 LYS CB C 47 33.778 33.778 34.457 -0.679 19163 214 1 . 1 1 47 47 LYS H H 47 7.826 7.826 7.543 0.283 19163 215 1 . 1 1 48 48 ASN N N 48 116.573 116.573 118.411 -1.838 19163 216 1 . 1 1 48 48 ASN HA H 48 5.021 5.021 5.158 -0.137 19163 217 1 . 1 1 48 48 ASN C C 48 172.992 172.992 173.766 -0.774 19163 218 1 . 1 1 48 48 ASN CA C 48 50.467 50.467 50.880 -0.413 19163 219 1 . 1 1 48 48 ASN CB C 48 39.284 39.284 39.472 -0.189 19163 220 1 . 1 1 48 48 ASN H H 48 7.956 7.956 8.301 -0.344 19163 221 1 . 1 1 49 49 PRO HA H 49 4.448 4.448 4.409 0.039 19163 222 1 . 1 1 49 49 PRO C C 49 178.030 178.030 177.813 0.217 19163 223 1 . 1 1 49 49 PRO CA C 49 64.468 64.468 64.869 -0.401 19163 224 1 . 1 1 49 49 PRO CB C 49 32.173 32.173 32.051 0.122 19163 225 1 . 1 1 50 50 ASN N N 50 115.567 115.567 115.874 -0.307 19163 226 1 . 1 1 50 50 ASN HA H 50 4.748 4.748 4.559 0.189 19163 227 1 . 1 1 50 50 ASN C C 50 176.443 176.443 176.404 0.039 19163 228 1 . 1 1 50 50 ASN CA C 50 54.677 54.677 55.283 -0.606 19163 229 1 . 1 1 50 50 ASN CB C 50 39.014 39.014 37.762 1.252 19163 230 1 . 1 1 50 50 ASN H H 50 8.398 8.398 8.665 -0.267 19163 231 1 . 1 1 51 51 GLU N N 51 119.270 119.270 118.676 0.594 19163 232 1 . 1 1 51 51 GLU HA H 51 4.797 4.797 4.521 0.276 19163 233 1 . 1 1 51 51 GLU C C 51 176.922 176.922 177.854 -0.932 19163 234 1 . 1 1 51 51 GLU CA C 51 55.916 55.916 56.361 -0.445 19163 235 1 . 1 1 51 51 GLU CB C 51 29.200 29.200 29.415 -0.215 19163 236 1 . 1 1 51 51 GLU H H 51 7.485 7.485 7.774 -0.289 19163 237 1 . 1 1 52 52 GLY N N 52 107.541 107.541 108.547 -1.006 19163 238 1 . 1 1 52 52 GLY C C 52 176.755 176.755 175.663 1.092 19163 239 1 . 1 1 52 52 GLY CA C 52 47.914 47.914 46.972 0.942 19163 240 1 . 1 1 52 52 GLY H H 52 8.092 8.092 7.742 0.350 19163 241 1 . 1 1 53 53 GLU N N 53 121.603 121.603 120.887 0.716 19163 242 1 . 1 1 53 53 GLU HA H 53 4.065 4.065 4.076 -0.011 19163 243 1 . 1 1 53 53 GLU C C 53 179.052 179.052 178.793 0.259 19163 244 1 . 1 1 53 53 GLU CA C 53 59.280 59.280 59.421 -0.141 19163 245 1 . 1 1 53 53 GLU CB C 53 28.968 28.968 29.297 -0.329 19163 246 1 . 1 1 53 53 GLU H H 53 8.496 8.496 8.153 0.343 19163 247 1 . 1 1 54 54 LYS N N 54 120.837 120.837 119.008 1.829 19163 248 1 . 1 1 54 54 LYS HA H 54 3.923 3.923 4.091 -0.168 19163 249 1 . 1 1 54 54 LYS C C 54 179.058 179.058 178.975 0.083 19163 250 1 . 1 1 54 54 LYS CA C 54 58.800 58.800 58.736 0.064 19163 251 1 . 1 1 54 54 LYS CB C 54 31.551 31.551 32.158 -0.607 19163 252 1 . 1 1 54 54 LYS H H 54 7.857 7.857 7.548 0.309 19163 253 1 . 1 1 55 55 PHE N N 55 118.608 118.608 120.828 -2.220 19163 254 1 . 1 1 55 55 PHE HA H 55 4.021 4.021 4.146 -0.125 19163 255 1 . 1 1 55 55 PHE C C 55 178.001 178.001 176.904 1.097 19163 256 1 . 1 1 55 55 PHE CA C 55 61.911 61.911 60.921 0.990 19163 257 1 . 1 1 55 55 PHE CB C 55 38.553 38.553 39.048 -0.495 19163 258 1 . 1 1 55 55 PHE H H 55 8.382 8.382 8.069 0.313 19163 259 1 . 1 1 56 56 LYS N N 56 120.898 120.898 119.425 1.473 19163 260 1 . 1 1 56 56 LYS HA H 56 3.828 3.828 3.877 -0.049 19163 261 1 . 1 1 56 56 LYS C C 56 178.817 178.817 178.792 0.025 19163 262 1 . 1 1 56 56 LYS CA C 56 59.877 59.877 60.076 -0.199 19163 263 1 . 1 1 56 56 LYS CB C 56 32.133 32.133 31.961 0.172 19163 264 1 . 1 1 56 56 LYS H H 56 8.111 8.111 7.952 0.159 19163 265 1 . 1 1 57 57 GLN N N 57 118.600 118.600 118.384 0.216 19163 266 1 . 1 1 57 57 GLN HA H 57 4.009 4.009 4.072 -0.063 19163 267 1 . 1 1 57 57 GLN C C 57 179.333 179.333 178.583 0.750 19163 268 1 . 1 1 57 57 GLN CA C 57 59.109 59.109 58.748 0.361 19163 269 1 . 1 1 57 57 GLN CB C 57 28.595 28.595 28.653 -0.058 19163 270 1 . 1 1 57 57 GLN H H 57 7.613 7.613 7.572 0.041 19163 271 1 . 1 1 58 58 ILE N N 58 118.709 118.709 120.611 -1.902 19163 272 1 . 1 1 58 58 ILE HA H 58 3.559 3.559 3.583 -0.024 19163 273 1 . 1 1 58 58 ILE C C 58 177.152 177.152 178.019 -0.867 19163 274 1 . 1 1 58 58 ILE CA C 58 65.068 65.068 65.491 -0.423 19163 275 1 . 1 1 58 58 ILE CB C 58 38.381 38.381 37.602 0.779 19163 276 1 . 1 1 58 58 ILE H H 58 8.011 8.011 7.515 0.496 19163 277 1 . 1 1 59 59 SER N N 59 116.112 116.112 115.303 0.809 19163 278 1 . 1 1 59 59 SER HA H 59 3.948 3.948 3.983 -0.035 19163 279 1 . 1 1 59 59 SER C C 59 175.949 175.949 176.917 -0.968 19163 280 1 . 1 1 59 59 SER CA C 59 62.315 62.315 62.049 0.266 19163 281 1 . 1 1 59 59 SER H H 59 8.030 8.030 8.194 -0.164 19163 282 1 . 1 1 60 60 GLN N N 60 122.099 122.099 120.916 1.182 19163 283 1 . 1 1 60 60 GLN HA H 60 3.801 3.801 3.970 -0.169 19163 284 1 . 1 1 60 60 GLN C C 60 176.942 176.942 178.224 -1.282 19163 285 1 . 1 1 60 60 GLN CA C 60 58.762 58.762 58.774 -0.012 19163 286 1 . 1 1 60 60 GLN CB C 60 28.498 28.498 28.687 -0.189 19163 287 1 . 1 1 60 60 GLN H H 60 7.933 7.933 7.670 0.263 19163 288 1 . 1 1 61 61 ALA N N 61 119.367 119.367 122.419 -3.052 19163 289 1 . 1 1 61 61 ALA HA H 61 2.636 2.636 3.811 -1.175 19163 290 1 . 1 1 61 61 ALA C C 61 178.507 178.507 179.170 -0.663 19163 291 1 . 1 1 61 61 ALA CA C 61 54.126 54.126 54.961 -0.835 19163 292 1 . 1 1 61 61 ALA CB C 61 18.462 18.462 18.359 0.103 19163 293 1 . 1 1 61 61 ALA H H 61 7.354 7.354 7.873 -0.519 19163 294 1 . 1 1 62 62 TYR N N 62 115.613 115.613 119.951 -4.338 19163 295 1 . 1 1 62 62 TYR HA H 62 3.633 3.633 3.920 -0.287 19163 296 1 . 1 1 62 62 TYR C C 62 177.421 177.421 177.426 -0.005 19163 297 1 . 1 1 62 62 TYR CA C 62 61.676 61.676 61.088 0.588 19163 298 1 . 1 1 62 62 TYR CB C 62 39.162 39.162 38.020 1.142 19163 299 1 . 1 1 62 62 TYR H H 62 7.994 7.994 8.568 -0.574 19163 300 1 . 1 1 63 63 GLU N N 63 121.396 121.396 119.609 1.788 19163 301 1 . 1 1 63 63 GLU HA H 63 3.347 3.347 3.650 -0.303 19163 302 1 . 1 1 63 63 GLU C C 63 177.687 177.687 178.777 -1.090 19163 303 1 . 1 1 63 63 GLU CA C 63 59.562 59.562 59.187 0.375 19163 304 1 . 1 1 63 63 GLU CB C 63 29.115 29.115 29.223 -0.108 19163 305 1 . 1 1 63 63 GLU H H 63 8.151 8.151 7.912 0.239 19163 306 1 . 1 1 64 64 VAL N N 64 115.850 115.850 118.580 -2.730 19163 307 1 . 1 1 64 64 VAL HA H 64 3.377 3.377 3.708 -0.331 19163 308 1 . 1 1 64 64 VAL C C 64 175.925 175.925 177.413 -1.488 19163 309 1 . 1 1 64 64 VAL CA C 64 65.806 65.806 65.081 0.725 19163 310 1 . 1 1 64 64 VAL CB C 64 31.786 31.786 31.682 0.104 19163 311 1 . 1 1 64 64 VAL H H 64 6.814 6.814 7.236 -0.422 19163 312 1 . 1 1 65 65 LEU N N 65 111.438 111.438 120.207 -8.769 19163 313 1 . 1 1 65 65 LEU HA H 65 3.569 3.569 3.907 -0.338 19163 314 1 . 1 1 65 65 LEU C C 65 177.124 177.124 178.598 -1.474 19163 315 1 . 1 1 65 65 LEU CA C 65 56.645 56.645 57.343 -0.698 19163 316 1 . 1 1 65 65 LEU CB C 65 42.589 42.589 40.951 1.638 19163 317 1 . 1 1 65 65 LEU H H 65 7.398 7.398 8.342 -0.944 19163 318 1 . 1 1 66 66 SER N N 66 108.642 108.642 111.051 -2.409 19163 319 1 . 1 1 66 66 SER HA H 66 4.028 4.028 4.085 -0.057 19163 320 1 . 1 1 66 66 SER C C 66 173.286 173.286 174.002 -0.716 19163 321 1 . 1 1 66 66 SER CA C 66 59.232 59.232 59.854 -0.622 19163 322 1 . 1 1 66 66 SER CB C 66 63.066 63.066 63.018 0.048 19163 323 1 . 1 1 66 66 SER H H 66 7.700 7.700 7.613 0.087 19163 324 1 . 1 1 67 67 ASP N N 67 124.276 124.276 121.251 3.025 19163 325 1 . 1 1 67 67 ASP HA H 67 4.668 4.668 4.715 -0.047 19163 326 1 . 1 1 67 67 ASP C C 67 174.913 174.913 175.460 -0.547 19163 327 1 . 1 1 67 67 ASP CA C 67 52.487 52.487 52.989 -0.502 19163 328 1 . 1 1 67 67 ASP CB C 67 43.218 43.218 42.528 0.690 19163 329 1 . 1 1 67 67 ASP H H 67 6.879 6.879 7.239 -0.360 19163 330 1 . 1 1 68 68 ALA N N 68 127.326 127.326 130.247 -2.921 19163 331 1 . 1 1 68 68 ALA HA H 68 3.853 3.853 3.909 -0.056 19163 332 1 . 1 1 68 68 ALA C C 68 180.336 180.336 178.796 1.540 19163 333 1 . 1 1 68 68 ALA CA C 68 55.912 55.912 55.469 0.443 19163 334 1 . 1 1 68 68 ALA CB C 68 18.645 18.645 18.775 -0.130 19163 335 1 . 1 1 68 68 ALA H H 68 8.693 8.693 8.777 -0.084 19163 336 1 . 1 1 69 69 LYS N N 69 116.929 116.929 118.150 -1.221 19163 337 1 . 1 1 69 69 LYS HA H 69 4.162 4.162 4.029 0.133 19163 338 1 . 1 1 69 69 LYS C C 69 179.515 179.515 178.659 0.856 19163 339 1 . 1 1 69 69 LYS CA C 69 58.562 58.562 59.408 -0.846 19163 340 1 . 1 1 69 69 LYS CB C 69 31.840 31.840 32.235 -0.395 19163 341 1 . 1 1 69 69 LYS H H 69 7.950 7.950 8.098 -0.148 19163 342 1 . 1 1 70 70 LYS N N 70 121.286 121.286 119.051 2.235 19163 343 1 . 1 1 70 70 LYS HA H 70 3.960 3.960 3.968 -0.008 19163 344 1 . 1 1 70 70 LYS C C 70 179.938 179.938 179.011 0.927 19163 345 1 . 1 1 70 70 LYS CA C 70 60.066 60.066 59.557 0.509 19163 346 1 . 1 1 70 70 LYS CB C 70 32.695 32.695 32.264 0.431 19163 347 1 . 1 1 70 70 LYS H H 70 8.184 8.184 8.177 0.007 19163 348 1 . 1 1 71 71 ARG N N 71 122.794 122.794 119.805 2.989 19163 349 1 . 1 1 71 71 ARG HA H 71 3.668 3.668 3.919 -0.251 19163 350 1 . 1 1 71 71 ARG C C 71 177.356 177.356 178.131 -0.775 19163 351 1 . 1 1 71 71 ARG CA C 71 60.127 60.127 60.054 0.073 19163 352 1 . 1 1 71 71 ARG CB C 71 29.668 29.668 30.174 -0.506 19163 353 1 . 1 1 71 71 ARG H H 71 9.290 9.290 8.505 0.785 19163 354 1 . 1 1 72 72 GLU N N 72 118.390 118.390 119.661 -1.271 19163 355 1 . 1 1 72 72 GLU HA H 72 4.096 4.096 4.131 -0.035 19163 356 1 . 1 1 72 72 GLU C C 72 179.073 179.073 179.079 -0.006 19163 357 1 . 1 1 72 72 GLU CA C 72 59.456 59.456 59.294 0.162 19163 358 1 . 1 1 72 72 GLU CB C 72 29.615 29.615 29.536 0.079 19163 359 1 . 1 1 72 72 GLU H H 72 7.607 7.607 7.757 -0.150 19163 360 1 . 1 1 73 73 LEU N N 73 117.921 117.921 119.971 -2.050 19163 361 1 . 1 1 73 73 LEU HA H 73 4.032 4.032 3.990 0.042 19163 362 1 . 1 1 73 73 LEU C C 73 179.696 179.696 179.094 0.602 19163 363 1 . 1 1 73 73 LEU CA C 73 57.597 57.597 57.813 -0.216 19163 364 1 . 1 1 73 73 LEU CB C 73 41.815 41.815 41.706 0.109 19163 365 1 . 1 1 73 73 LEU H H 73 7.398 7.398 7.911 -0.513 19163 366 1 . 1 1 74 74 TYR N N 74 122.662 122.662 119.589 3.073 19163 367 1 . 1 1 74 74 TYR HA H 74 4.092 4.092 4.048 0.044 19163 368 1 . 1 1 74 74 TYR C C 74 178.166 178.166 177.967 0.199 19163 369 1 . 1 1 74 74 TYR CA C 74 61.458 61.458 61.428 0.030 19163 370 1 . 1 1 74 74 TYR CB C 74 38.778 38.778 38.467 0.311 19163 371 1 . 1 1 74 74 TYR H H 74 8.316 8.316 8.396 -0.080 19163 372 1 . 1 1 75 75 ASP N N 75 118.842 118.842 118.783 0.059 19163 373 1 . 1 1 75 75 ASP HA H 75 4.423 4.423 4.432 -0.009 19163 374 1 . 1 1 75 75 ASP C C 75 177.726 177.726 177.736 -0.010 19163 375 1 . 1 1 75 75 ASP CA C 75 56.177 56.177 56.770 -0.593 19163 376 1 . 1 1 75 75 ASP CB C 75 40.800 40.800 40.896 -0.096 19163 377 1 . 1 1 75 75 ASP H H 75 8.770 8.770 8.263 0.507 19163 378 1 . 1 1 76 76 LYS N N 76 118.955 118.955 118.359 0.596 19163 379 1 . 1 1 76 76 LYS HA H 76 4.130 4.130 4.248 -0.118 19163 380 1 . 1 1 76 76 LYS C C 76 177.006 177.006 177.092 -0.086 19163 381 1 . 1 1 76 76 LYS CA C 76 57.537 57.537 56.742 0.795 19163 382 1 . 1 1 76 76 LYS CB C 76 33.136 33.136 33.334 -0.198 19163 383 1 . 1 1 76 76 LYS H H 76 7.610 7.610 7.742 -0.133 19163 stop_ save_