data_17765 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 17765 _Entry.PDB_ID 2LFN 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 17765 _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 2 2 ALA HA H 2 4.562 4.562 4.615 -0.053 17765 2 1 1 . 1 1 2 2 ALA H H 2 8.617 8.617 8.416 0.201 17765 3 1 1 . 1 1 3 3 THR HA H 3 4.394 4.394 4.322 0.072 17765 4 1 1 . 1 1 3 3 THR H H 3 8.142 8.142 7.730 0.412 17765 5 1 1 . 1 1 4 4 THR HA H 4 4.615 4.615 4.655 -0.040 17765 6 1 1 . 1 1 4 4 THR H H 4 8.659 8.659 8.374 0.285 17765 7 1 1 . 1 1 5 5 ILE HA H 5 3.832 3.832 4.100 -0.268 17765 8 1 1 . 1 1 5 5 ILE H H 5 8.634 8.634 9.118 -0.484 17765 9 1 1 . 1 1 6 6 GLY H H 6 8.828 8.828 7.874 0.954 17765 10 1 1 . 1 1 7 7 PRO HA H 7 4.254 4.254 4.351 -0.097 17765 11 1 1 . 1 1 8 8 ASN HA H 8 4.846 4.846 4.719 0.127 17765 12 1 1 . 1 1 8 8 ASN H H 8 8.536 8.536 8.509 0.027 17765 13 1 1 . 1 1 9 9 THR HA H 9 3.758 3.758 4.167 -0.409 17765 14 1 1 . 1 1 9 9 THR H H 9 7.559 7.559 7.670 -0.111 17765 15 1 1 . 1 1 10 10 CYS HA H 10 4.897 4.897 4.784 0.113 17765 16 1 1 . 1 1 10 10 CYS H H 10 8.554 8.554 8.386 0.168 17765 17 1 1 . 1 1 11 11 SER HA H 11 4.441 4.441 4.884 -0.443 17765 18 1 1 . 1 1 11 11 SER H H 11 8.488 8.488 8.626 -0.138 17765 19 1 1 . 1 1 12 12 ILE HA H 12 4.126 4.126 3.958 0.168 17765 20 1 1 . 1 1 12 12 ILE H H 12 7.392 7.392 7.805 -0.413 17765 21 1 1 . 1 1 13 13 ASP HA H 13 4.361 4.361 4.302 0.059 17765 22 1 1 . 1 1 13 13 ASP H H 13 8.694 8.694 7.926 0.768 17765 23 1 1 . 1 1 14 14 ASP HA H 14 4.373 4.373 4.146 0.227 17765 24 1 1 . 1 1 14 14 ASP H H 14 8.640 8.640 8.166 0.474 17765 25 1 1 . 1 1 15 15 TYR HA H 15 4.639 4.639 5.009 -0.370 17765 26 1 1 . 1 1 15 15 TYR H H 15 7.970 7.970 7.736 0.234 17765 27 1 1 . 1 1 16 16 LYS HA H 16 4.794 4.794 5.037 -0.243 17765 28 1 1 . 1 1 16 16 LYS H H 16 8.655 8.655 9.288 -0.633 17765 29 1 1 . 1 1 17 17 PRO HA H 17 5.205 5.205 4.521 0.684 17765 30 1 1 . 1 1 18 18 TYR HA H 18 4.653 4.653 4.840 -0.187 17765 31 1 1 . 1 1 18 18 TYR H H 18 9.475 9.475 9.185 0.290 17765 32 1 1 . 1 1 19 19 CYS HA H 19 5.358 5.358 5.030 0.328 17765 33 1 1 . 1 1 19 19 CYS H H 19 9.004 9.004 9.085 -0.081 17765 34 1 1 . 1 1 20 20 CYS HA H 20 5.597 5.597 4.620 0.977 17765 35 1 1 . 1 1 20 20 CYS H H 20 9.838 9.838 8.931 0.907 17765 36 1 1 . 1 1 21 21 GLN HA H 21 4.620 4.620 4.372 0.248 17765 37 1 1 . 1 1 21 21 GLN H H 21 8.900 8.900 8.683 0.217 17765 38 1 1 . 1 1 22 22 SER HA H 22 4.461 4.461 4.297 0.164 17765 39 1 1 . 1 1 22 22 SER H H 22 8.529 8.529 8.108 0.421 17765 40 1 1 . 1 1 23 23 MET HA H 23 4.632 4.632 4.667 -0.035 17765 41 1 1 . 1 1 23 23 MET H H 23 8.566 8.566 8.176 0.390 17765 42 1 1 . 1 1 24 24 SER HA H 24 4.254 4.254 4.334 -0.080 17765 43 1 1 . 1 1 24 24 SER H H 24 8.534 8.534 8.408 0.126 17765 44 1 1 . 1 1 25 25 GLY H H 25 8.729 8.729 8.659 0.070 17765 45 1 1 . 1 1 26 26 SER HA H 26 4.575 4.575 4.723 -0.148 17765 46 1 1 . 1 1 26 26 SER H H 26 7.873 7.873 8.180 -0.307 17765 47 1 1 . 1 1 27 27 ALA HA H 27 4.487 4.487 4.246 0.241 17765 48 1 1 . 1 1 27 27 ALA H H 27 8.435 8.435 8.337 0.098 17765 49 1 1 . 1 1 28 28 SER HA H 28 4.650 4.650 4.550 0.100 17765 50 1 1 . 1 1 28 28 SER H H 28 8.134 8.134 7.539 0.595 17765 51 1 1 . 1 1 29 29 LEU HA H 29 4.635 4.635 4.488 0.147 17765 52 1 1 . 1 1 29 29 LEU H H 29 8.763 8.763 8.109 0.654 17765 53 1 1 . 1 1 30 30 GLY H H 30 8.580 8.580 8.607 -0.027 17765 54 1 1 . 1 1 31 31 CYS HA H 31 5.662 5.662 4.824 0.838 17765 55 1 1 . 1 1 31 31 CYS H H 31 8.786 8.786 8.456 0.330 17765 56 1 1 . 1 1 32 32 VAL HA H 32 4.724 4.724 4.301 0.423 17765 57 1 1 . 1 1 32 32 VAL H H 32 8.361 8.361 8.298 0.063 17765 58 1 1 . 1 1 33 33 VAL HA H 33 3.370 3.370 3.709 -0.339 17765 59 1 1 . 1 1 33 33 VAL H H 33 8.635 8.635 8.540 0.095 17765 60 1 1 . 1 1 34 34 GLY H H 34 8.088 8.088 8.555 -0.467 17765 61 1 1 . 1 1 35 35 VAL HA H 35 3.925 3.925 4.015 -0.090 17765 62 1 1 . 1 1 35 35 VAL H H 35 7.785 7.785 7.964 -0.179 17765 63 1 1 . 1 1 36 36 ILE HA H 36 3.360 3.360 4.034 -0.674 17765 64 1 1 . 1 1 36 36 ILE H H 36 8.614 8.614 8.629 -0.015 17765 65 1 1 . 1 1 37 37 GLY H H 37 9.037 9.037 9.069 -0.032 17765 66 1 1 . 1 1 38 38 SER HA H 38 4.495 4.495 4.570 -0.075 17765 67 1 1 . 1 1 38 38 SER H H 38 8.150 8.150 8.154 -0.004 17765 68 1 1 . 1 1 39 39 GLN HA H 39 4.825 4.825 5.146 -0.321 17765 69 1 1 . 1 1 39 39 GLN H H 39 8.429 8.429 8.434 -0.005 17765 70 1 1 . 1 1 40 40 CYS HA H 40 4.987 4.987 4.863 0.124 17765 71 1 1 . 1 1 40 40 CYS H H 40 8.974 8.974 8.570 0.404 17765 72 1 1 . 1 1 41 41 GLY H H 41 9.375 9.375 8.848 0.527 17765 73 1 1 . 1 1 42 42 ALA HA H 42 4.658 4.658 4.430 0.228 17765 74 1 1 . 1 1 42 42 ALA H H 42 7.131 7.131 7.798 -0.667 17765 75 1 1 . 1 1 43 43 SER HA H 43 4.748 4.748 4.516 0.232 17765 76 1 1 . 1 1 43 43 SER H H 43 8.325 8.325 8.160 0.165 17765 77 1 1 . 1 1 44 44 VAL HA H 44 4.652 4.652 4.501 0.151 17765 78 1 1 . 1 1 44 44 VAL H H 44 8.784 8.784 8.109 0.675 17765 79 1 1 . 1 1 45 45 LYS HA H 45 4.821 4.821 4.643 0.178 17765 80 1 1 . 1 1 45 45 LYS H H 45 9.015 9.015 9.203 -0.188 17765 81 1 1 . 1 1 46 46 CYS HA H 46 5.493 5.493 5.187 0.306 17765 82 1 1 . 1 1 46 46 CYS H H 46 8.943 8.943 8.787 0.156 17765 83 1 1 . 1 1 47 47 CYS HA H 47 5.677 5.677 4.915 0.762 17765 84 1 1 . 1 1 47 47 CYS H H 47 9.513 9.513 8.548 0.965 17765 85 1 1 . 1 1 48 48 LYS HA H 48 4.020 4.020 4.650 -0.630 17765 86 1 1 . 1 1 48 48 LYS H H 48 8.226 8.226 8.956 -0.730 17765 87 1 1 . 1 1 49 49 ASP HA H 49 4.570 4.570 4.881 -0.311 17765 88 1 1 . 1 1 49 49 ASP H H 49 8.375 8.375 8.334 0.041 17765 89 1 1 . 1 1 50 50 ASP HA H 50 4.719 4.719 4.348 0.371 17765 90 1 1 . 1 1 50 50 ASP H H 50 8.306 8.306 8.457 -0.151 17765 91 1 1 . 1 1 51 51 VAL HA H 51 4.196 4.196 4.259 -0.063 17765 92 1 1 . 1 1 51 51 VAL H H 51 7.790 7.790 7.909 -0.119 17765 93 1 1 . 1 1 52 52 THR HA H 52 4.322 4.322 4.467 -0.145 17765 94 1 1 . 1 1 52 52 THR H H 52 8.194 8.194 8.632 -0.438 17765 95 1 1 . 1 1 53 53 ASN HA H 53 4.777 4.777 4.854 -0.077 17765 96 1 1 . 1 1 53 53 ASN H H 53 8.364 8.364 7.926 0.438 17765 97 1 1 . 1 1 54 54 THR HA H 54 4.340 4.340 4.042 0.298 17765 98 1 1 . 1 1 54 54 THR H H 54 8.201 8.201 8.767 -0.566 17765 99 1 1 . 1 1 55 55 GLY H H 55 8.354 8.354 8.263 0.091 17765 100 1 1 . 1 1 56 56 ASN HA H 56 4.729 4.729 4.731 -0.002 17765 101 1 1 . 1 1 56 56 ASN H H 56 8.397 8.397 8.644 -0.247 17765 102 1 1 . 1 1 57 57 SER HA H 57 4.485 4.485 4.468 0.017 17765 103 1 1 . 1 1 57 57 SER H H 57 8.205 8.205 8.098 0.107 17765 104 1 1 . 1 1 58 58 GLY H H 58 8.144 8.144 8.024 0.120 17765 105 1 1 . 1 1 59 59 LEU HA H 59 4.485 4.485 4.454 0.031 17765 106 1 1 . 1 1 59 59 LEU H H 59 8.460 8.460 7.956 0.504 17765 107 1 1 . 1 1 60 60 ILE HA H 60 4.794 4.794 4.176 0.618 17765 108 1 1 . 1 1 60 60 ILE H H 60 8.195 8.195 8.199 -0.004 17765 109 1 1 . 1 1 61 61 ILE HA H 61 4.151 4.151 4.091 0.060 17765 110 1 1 . 1 1 61 61 ILE H H 61 8.802 8.802 7.611 1.191 17765 111 1 1 . 1 1 62 62 ASN HA H 62 4.617 4.617 4.506 0.111 17765 112 1 1 . 1 1 62 62 ASN H H 62 8.607 8.607 9.506 -0.899 17765 113 1 1 . 1 1 63 63 ALA HA H 63 3.772 3.772 3.862 -0.090 17765 114 1 1 . 1 1 63 63 ALA H H 63 8.735 8.735 8.335 0.400 17765 115 1 1 . 1 1 64 64 ALA HA H 64 4.211 4.211 4.451 -0.240 17765 116 1 1 . 1 1 64 64 ALA H H 64 8.354 8.354 8.218 0.136 17765 117 1 1 . 1 1 65 65 ASN HA H 65 4.849 4.849 4.971 -0.122 17765 118 1 1 . 1 1 65 65 ASN H H 65 8.151 8.151 8.437 -0.286 17765 119 1 1 . 1 1 66 66 CYS HA H 66 5.624 5.624 5.004 0.620 17765 120 1 1 . 1 1 66 66 CYS H H 66 7.698 7.698 7.802 -0.104 17765 121 1 1 . 1 1 67 67 VAL HA H 67 4.248 4.248 3.986 0.262 17765 122 1 1 . 1 1 67 67 VAL H H 67 8.742 8.742 8.145 0.597 17765 123 1 2 . 1 1 2 2 ALA HA H 2 4.562 4.562 4.928 -0.366 17765 124 1 2 . 1 1 2 2 ALA H H 2 8.617 8.617 8.073 0.544 17765 125 1 2 . 1 1 3 3 THR HA H 3 4.394 4.394 4.453 -0.059 17765 126 1 2 . 1 1 3 3 THR H H 3 8.142 8.142 8.370 -0.228 17765 127 1 2 . 1 1 4 4 THR HA H 4 4.615 4.615 4.860 -0.245 17765 128 1 2 . 1 1 4 4 THR H H 4 8.659 8.659 8.599 0.060 17765 129 1 2 . 1 1 5 5 ILE HA H 5 3.832 3.832 4.369 -0.537 17765 130 1 2 . 1 1 5 5 ILE H H 5 8.634 8.634 9.119 -0.485 17765 131 1 2 . 1 1 6 6 GLY H H 6 8.828 8.828 8.385 0.443 17765 132 1 2 . 1 1 7 7 PRO HA H 7 4.254 4.254 4.178 0.076 17765 133 1 2 . 1 1 8 8 ASN HA H 8 4.846 4.846 4.802 0.044 17765 134 1 2 . 1 1 8 8 ASN H H 8 8.536 8.536 8.304 0.232 17765 135 1 2 . 1 1 9 9 THR HA H 9 3.758 3.758 4.469 -0.711 17765 136 1 2 . 1 1 9 9 THR H H 9 7.559 7.559 7.632 -0.073 17765 137 1 2 . 1 1 10 10 CYS HA H 10 4.897 4.897 4.867 0.030 17765 138 1 2 . 1 1 10 10 CYS H H 10 8.554 8.554 8.323 0.231 17765 139 1 2 . 1 1 11 11 SER HA H 11 4.441 4.441 4.756 -0.315 17765 140 1 2 . 1 1 11 11 SER H H 11 8.488 8.488 8.754 -0.266 17765 141 1 2 . 1 1 12 12 ILE HA H 12 4.126 4.126 4.159 -0.033 17765 142 1 2 . 1 1 12 12 ILE H H 12 7.392 7.392 7.960 -0.568 17765 143 1 2 . 1 1 13 13 ASP HA H 13 4.361 4.361 4.632 -0.271 17765 144 1 2 . 1 1 13 13 ASP H H 13 8.694 8.694 7.792 0.902 17765 145 1 2 . 1 1 14 14 ASP HA H 14 4.373 4.373 4.602 -0.229 17765 146 1 2 . 1 1 14 14 ASP H H 14 8.640 8.640 8.512 0.128 17765 147 1 2 . 1 1 15 15 TYR HA H 15 4.639 4.639 4.801 -0.162 17765 148 1 2 . 1 1 15 15 TYR H H 15 7.970 7.970 7.756 0.214 17765 149 1 2 . 1 1 16 16 LYS HA H 16 4.794 4.794 4.685 0.109 17765 150 1 2 . 1 1 16 16 LYS H H 16 8.655 8.655 8.150 0.505 17765 151 1 2 . 1 1 17 17 PRO HA H 17 5.205 5.205 4.588 0.617 17765 152 1 2 . 1 1 18 18 TYR HA H 18 4.653 4.653 5.255 -0.602 17765 153 1 2 . 1 1 18 18 TYR H H 18 9.475 9.475 9.362 0.113 17765 154 1 2 . 1 1 19 19 CYS HA H 19 5.358 5.358 4.724 0.634 17765 155 1 2 . 1 1 19 19 CYS H H 19 9.004 9.004 9.278 -0.274 17765 156 1 2 . 1 1 20 20 CYS HA H 20 5.597 5.597 4.658 0.939 17765 157 1 2 . 1 1 20 20 CYS H H 20 9.838 9.838 9.209 0.629 17765 158 1 2 . 1 1 21 21 GLN HA H 21 4.620 4.620 4.595 0.025 17765 159 1 2 . 1 1 21 21 GLN H H 21 8.900 8.900 8.163 0.737 17765 160 1 2 . 1 1 22 22 SER HA H 22 4.461 4.461 4.458 0.003 17765 161 1 2 . 1 1 22 22 SER H H 22 8.529 8.529 8.618 -0.089 17765 162 1 2 . 1 1 23 23 MET HA H 23 4.632 4.632 4.786 -0.154 17765 163 1 2 . 1 1 23 23 MET H H 23 8.566 8.566 7.581 0.985 17765 164 1 2 . 1 1 24 24 SER HA H 24 4.254 4.254 4.313 -0.059 17765 165 1 2 . 1 1 24 24 SER H H 24 8.534 8.534 8.652 -0.118 17765 166 1 2 . 1 1 25 25 GLY H H 25 8.729 8.729 8.236 0.493 17765 167 1 2 . 1 1 26 26 SER HA H 26 4.575 4.575 4.373 0.202 17765 168 1 2 . 1 1 26 26 SER H H 26 7.873 7.873 7.897 -0.024 17765 169 1 2 . 1 1 27 27 ALA HA H 27 4.487 4.487 4.424 0.063 17765 170 1 2 . 1 1 27 27 ALA H H 27 8.435 8.435 8.051 0.384 17765 171 1 2 . 1 1 28 28 SER HA H 28 4.650 4.650 4.353 0.297 17765 172 1 2 . 1 1 28 28 SER H H 28 8.134 8.134 7.512 0.622 17765 173 1 2 . 1 1 29 29 LEU HA H 29 4.635 4.635 4.396 0.239 17765 174 1 2 . 1 1 29 29 LEU H H 29 8.763 8.763 8.371 0.392 17765 175 1 2 . 1 1 30 30 GLY H H 30 8.580 8.580 8.111 0.469 17765 176 1 2 . 1 1 31 31 CYS HA H 31 5.662 5.662 4.940 0.722 17765 177 1 2 . 1 1 31 31 CYS H H 31 8.786 8.786 8.305 0.481 17765 178 1 2 . 1 1 32 32 VAL HA H 32 4.724 4.724 5.218 -0.494 17765 179 1 2 . 1 1 32 32 VAL H H 32 8.361 8.361 8.442 -0.081 17765 180 1 2 . 1 1 33 33 VAL HA H 33 3.370 3.370 3.623 -0.253 17765 181 1 2 . 1 1 33 33 VAL H H 33 8.635 8.635 7.838 0.797 17765 182 1 2 . 1 1 34 34 GLY H H 34 8.088 8.088 8.219 -0.131 17765 183 1 2 . 1 1 35 35 VAL HA H 35 3.925 3.925 3.994 -0.069 17765 184 1 2 . 1 1 35 35 VAL H H 35 7.785 7.785 8.187 -0.402 17765 185 1 2 . 1 1 36 36 ILE HA H 36 3.360 3.360 3.751 -0.391 17765 186 1 2 . 1 1 36 36 ILE H H 36 8.614 8.614 8.441 0.173 17765 187 1 2 . 1 1 37 37 GLY H H 37 9.037 9.037 8.996 0.041 17765 188 1 2 . 1 1 38 38 SER HA H 38 4.495 4.495 4.777 -0.282 17765 189 1 2 . 1 1 38 38 SER H H 38 8.150 8.150 7.875 0.275 17765 190 1 2 . 1 1 39 39 GLN HA H 39 4.825 4.825 5.011 -0.186 17765 191 1 2 . 1 1 39 39 GLN H H 39 8.429 8.429 8.466 -0.037 17765 192 1 2 . 1 1 40 40 CYS HA H 40 4.987 4.987 4.781 0.206 17765 193 1 2 . 1 1 40 40 CYS H H 40 8.974 8.974 9.156 -0.182 17765 194 1 2 . 1 1 41 41 GLY H H 41 9.375 9.375 8.918 0.457 17765 195 1 2 . 1 1 42 42 ALA HA H 42 4.658 4.658 4.905 -0.247 17765 196 1 2 . 1 1 42 42 ALA H H 42 7.131 7.131 7.208 -0.077 17765 197 1 2 . 1 1 43 43 SER HA H 43 4.748 4.748 4.471 0.277 17765 198 1 2 . 1 1 43 43 SER H H 43 8.325 8.325 8.156 0.169 17765 199 1 2 . 1 1 44 44 VAL HA H 44 4.652 4.652 4.371 0.281 17765 200 1 2 . 1 1 44 44 VAL H H 44 8.784 8.784 7.800 0.984 17765 201 1 2 . 1 1 45 45 LYS HA H 45 4.821 4.821 4.657 0.164 17765 202 1 2 . 1 1 45 45 LYS H H 45 9.015 9.015 9.148 -0.133 17765 203 1 2 . 1 1 46 46 CYS HA H 46 5.493 5.493 5.339 0.154 17765 204 1 2 . 1 1 46 46 CYS H H 46 8.943 8.943 8.461 0.482 17765 205 1 2 . 1 1 47 47 CYS HA H 47 5.677 5.677 5.476 0.201 17765 206 1 2 . 1 1 47 47 CYS H H 47 9.513 9.513 9.345 0.168 17765 207 1 2 . 1 1 48 48 LYS HA H 48 4.020 4.020 4.672 -0.652 17765 208 1 2 . 1 1 48 48 LYS H H 48 8.226 8.226 8.929 -0.703 17765 209 1 2 . 1 1 49 49 ASP HA H 49 4.570 4.570 4.542 0.028 17765 210 1 2 . 1 1 49 49 ASP H H 49 8.375 8.375 8.356 0.019 17765 211 1 2 . 1 1 50 50 ASP HA H 50 4.719 4.719 4.704 0.015 17765 212 1 2 . 1 1 50 50 ASP H H 50 8.306 8.306 8.625 -0.319 17765 213 1 2 . 1 1 51 51 VAL HA H 51 4.196 4.196 4.375 -0.179 17765 214 1 2 . 1 1 51 51 VAL H H 51 7.790 7.790 8.269 -0.479 17765 215 1 2 . 1 1 52 52 THR HA H 52 4.322 4.322 4.034 0.288 17765 216 1 2 . 1 1 52 52 THR H H 52 8.194 8.194 8.609 -0.415 17765 217 1 2 . 1 1 53 53 ASN HA H 53 4.777 4.777 4.829 -0.052 17765 218 1 2 . 1 1 53 53 ASN H H 53 8.364 8.364 7.738 0.626 17765 219 1 2 . 1 1 54 54 THR HA H 54 4.340 4.340 4.288 0.052 17765 220 1 2 . 1 1 54 54 THR H H 54 8.201 8.201 8.362 -0.161 17765 221 1 2 . 1 1 55 55 GLY H H 55 8.354 8.354 7.929 0.425 17765 222 1 2 . 1 1 56 56 ASN HA H 56 4.729 4.729 4.734 -0.005 17765 223 1 2 . 1 1 56 56 ASN H H 56 8.397 8.397 7.826 0.571 17765 224 1 2 . 1 1 57 57 SER HA H 57 4.485 4.485 4.658 -0.173 17765 225 1 2 . 1 1 57 57 SER H H 57 8.205 8.205 8.447 -0.242 17765 226 1 2 . 1 1 58 58 GLY H H 58 8.144 8.144 8.252 -0.108 17765 227 1 2 . 1 1 59 59 LEU HA H 59 4.485 4.485 4.489 -0.004 17765 228 1 2 . 1 1 59 59 LEU H H 59 8.460 8.460 8.482 -0.022 17765 229 1 2 . 1 1 60 60 ILE HA H 60 4.794 4.794 4.400 0.394 17765 230 1 2 . 1 1 60 60 ILE H H 60 8.195 8.195 8.283 -0.088 17765 231 1 2 . 1 1 61 61 ILE HA H 61 4.151 4.151 4.209 -0.058 17765 232 1 2 . 1 1 61 61 ILE H H 61 8.802 8.802 8.200 0.602 17765 233 1 2 . 1 1 62 62 ASN HA H 62 4.617 4.617 4.729 -0.112 17765 234 1 2 . 1 1 62 62 ASN H H 62 8.607 8.607 8.783 -0.176 17765 235 1 2 . 1 1 63 63 ALA HA H 63 3.772 3.772 3.767 0.005 17765 236 1 2 . 1 1 63 63 ALA H H 63 8.735 8.735 8.459 0.276 17765 237 1 2 . 1 1 64 64 ALA HA H 64 4.211 4.211 4.031 0.180 17765 238 1 2 . 1 1 64 64 ALA H H 64 8.354 8.354 8.180 0.174 17765 239 1 2 . 1 1 65 65 ASN HA H 65 4.849 4.849 4.816 0.033 17765 240 1 2 . 1 1 65 65 ASN H H 65 8.151 8.151 8.127 0.024 17765 241 1 2 . 1 1 66 66 CYS HA H 66 5.624 5.624 4.968 0.656 17765 242 1 2 . 1 1 66 66 CYS H H 66 7.698 7.698 7.767 -0.069 17765 243 1 2 . 1 1 67 67 VAL HA H 67 4.248 4.248 4.444 -0.196 17765 244 1 2 . 1 1 67 67 VAL H H 67 8.742 8.742 8.477 0.265 17765 245 1 3 . 1 1 2 2 ALA HA H 2 4.562 4.562 4.536 0.026 17765 246 1 3 . 1 1 2 2 ALA H H 2 8.617 8.617 8.283 0.334 17765 247 1 3 . 1 1 3 3 THR HA H 3 4.394 4.394 4.250 0.144 17765 248 1 3 . 1 1 3 3 THR H H 3 8.142 8.142 7.890 0.252 17765 249 1 3 . 1 1 4 4 THR HA H 4 4.615 4.615 4.736 -0.121 17765 250 1 3 . 1 1 4 4 THR H H 4 8.659 8.659 8.620 0.039 17765 251 1 3 . 1 1 5 5 ILE HA H 5 3.832 3.832 4.301 -0.469 17765 252 1 3 . 1 1 5 5 ILE H H 5 8.634 8.634 9.062 -0.428 17765 253 1 3 . 1 1 6 6 GLY H H 6 8.828 8.828 8.527 0.301 17765 254 1 3 . 1 1 7 7 PRO HA H 7 4.254 4.254 4.427 -0.173 17765 255 1 3 . 1 1 8 8 ASN HA H 8 4.846 4.846 4.896 -0.050 17765 256 1 3 . 1 1 8 8 ASN H H 8 8.536 8.536 8.419 0.117 17765 257 1 3 . 1 1 9 9 THR HA H 9 3.758 3.758 4.248 -0.490 17765 258 1 3 . 1 1 9 9 THR H H 9 7.559 7.559 8.085 -0.526 17765 259 1 3 . 1 1 10 10 CYS HA H 10 4.897 4.897 4.589 0.308 17765 260 1 3 . 1 1 10 10 CYS H H 10 8.554 8.554 7.702 0.852 17765 261 1 3 . 1 1 11 11 SER HA H 11 4.441 4.441 4.770 -0.329 17765 262 1 3 . 1 1 11 11 SER H H 11 8.488 8.488 8.780 -0.292 17765 263 1 3 . 1 1 12 12 ILE HA H 12 4.126 4.126 4.174 -0.048 17765 264 1 3 . 1 1 12 12 ILE H H 12 7.392 7.392 8.052 -0.660 17765 265 1 3 . 1 1 13 13 ASP HA H 13 4.361 4.361 4.668 -0.307 17765 266 1 3 . 1 1 13 13 ASP H H 13 8.694 8.694 8.026 0.668 17765 267 1 3 . 1 1 14 14 ASP HA H 14 4.373 4.373 4.600 -0.227 17765 268 1 3 . 1 1 14 14 ASP H H 14 8.640 8.640 8.525 0.115 17765 269 1 3 . 1 1 15 15 TYR HA H 15 4.639 4.639 4.769 -0.130 17765 270 1 3 . 1 1 15 15 TYR H H 15 7.970 7.970 7.579 0.391 17765 271 1 3 . 1 1 16 16 LYS HA H 16 4.794 4.794 4.589 0.205 17765 272 1 3 . 1 1 16 16 LYS H H 16 8.655 8.655 7.886 0.769 17765 273 1 3 . 1 1 17 17 PRO HA H 17 5.205 5.205 4.526 0.679 17765 274 1 3 . 1 1 18 18 TYR HA H 18 4.653 4.653 5.003 -0.350 17765 275 1 3 . 1 1 18 18 TYR H H 18 9.475 9.475 9.107 0.368 17765 276 1 3 . 1 1 19 19 CYS HA H 19 5.358 5.358 4.630 0.728 17765 277 1 3 . 1 1 19 19 CYS H H 19 9.004 9.004 9.285 -0.281 17765 278 1 3 . 1 1 20 20 CYS HA H 20 5.597 5.597 4.525 1.072 17765 279 1 3 . 1 1 20 20 CYS H H 20 9.838 9.838 9.028 0.810 17765 280 1 3 . 1 1 21 21 GLN HA H 21 4.620 4.620 4.342 0.278 17765 281 1 3 . 1 1 21 21 GLN H H 21 8.900 8.900 8.119 0.781 17765 282 1 3 . 1 1 22 22 SER HA H 22 4.461 4.461 4.318 0.143 17765 283 1 3 . 1 1 22 22 SER H H 22 8.529 8.529 8.257 0.272 17765 284 1 3 . 1 1 23 23 MET HA H 23 4.632 4.632 4.568 0.064 17765 285 1 3 . 1 1 23 23 MET H H 23 8.566 8.566 8.182 0.384 17765 286 1 3 . 1 1 24 24 SER HA H 24 4.254 4.254 4.461 -0.207 17765 287 1 3 . 1 1 24 24 SER H H 24 8.534 8.534 8.835 -0.301 17765 288 1 3 . 1 1 25 25 GLY H H 25 8.729 8.729 8.463 0.266 17765 289 1 3 . 1 1 26 26 SER HA H 26 4.575 4.575 4.655 -0.080 17765 290 1 3 . 1 1 26 26 SER H H 26 7.873 7.873 7.952 -0.079 17765 291 1 3 . 1 1 27 27 ALA HA H 27 4.487 4.487 4.274 0.213 17765 292 1 3 . 1 1 27 27 ALA H H 27 8.435 8.435 8.414 0.021 17765 293 1 3 . 1 1 28 28 SER HA H 28 4.650 4.650 4.340 0.310 17765 294 1 3 . 1 1 28 28 SER H H 28 8.134 8.134 7.577 0.557 17765 295 1 3 . 1 1 29 29 LEU HA H 29 4.635 4.635 4.784 -0.149 17765 296 1 3 . 1 1 29 29 LEU H H 29 8.763 8.763 8.389 0.374 17765 297 1 3 . 1 1 30 30 GLY H H 30 8.580 8.580 8.840 -0.260 17765 298 1 3 . 1 1 31 31 CYS HA H 31 5.662 5.662 4.834 0.828 17765 299 1 3 . 1 1 31 31 CYS H H 31 8.786 8.786 7.832 0.954 17765 300 1 3 . 1 1 32 32 VAL HA H 32 4.724 4.724 4.301 0.423 17765 301 1 3 . 1 1 32 32 VAL H H 32 8.361 8.361 7.984 0.378 17765 302 1 3 . 1 1 33 33 VAL HA H 33 3.370 3.370 3.392 -0.022 17765 303 1 3 . 1 1 33 33 VAL H H 33 8.635 8.635 8.650 -0.015 17765 304 1 3 . 1 1 34 34 GLY H H 34 8.088 8.088 8.244 -0.156 17765 305 1 3 . 1 1 35 35 VAL HA H 35 3.925 3.925 4.029 -0.104 17765 306 1 3 . 1 1 35 35 VAL H H 35 7.785 7.785 8.187 -0.402 17765 307 1 3 . 1 1 36 36 ILE HA H 36 3.360 3.360 3.974 -0.614 17765 308 1 3 . 1 1 36 36 ILE H H 36 8.614 8.614 8.560 0.054 17765 309 1 3 . 1 1 37 37 GLY H H 37 9.037 9.037 9.013 0.024 17765 310 1 3 . 1 1 38 38 SER HA H 38 4.495 4.495 4.750 -0.255 17765 311 1 3 . 1 1 38 38 SER H H 38 8.150 8.150 7.971 0.179 17765 312 1 3 . 1 1 39 39 GLN HA H 39 4.825 4.825 5.383 -0.558 17765 313 1 3 . 1 1 39 39 GLN H H 39 8.429 8.429 8.380 0.049 17765 314 1 3 . 1 1 40 40 CYS HA H 40 4.987 4.987 4.698 0.289 17765 315 1 3 . 1 1 40 40 CYS H H 40 8.974 8.974 8.557 0.417 17765 316 1 3 . 1 1 41 41 GLY H H 41 9.375 9.375 8.918 0.457 17765 317 1 3 . 1 1 42 42 ALA HA H 42 4.658 4.658 4.423 0.235 17765 318 1 3 . 1 1 42 42 ALA H H 42 7.131 7.131 7.487 -0.356 17765 319 1 3 . 1 1 43 43 SER HA H 43 4.748 4.748 4.471 0.277 17765 320 1 3 . 1 1 43 43 SER H H 43 8.325 8.325 8.440 -0.115 17765 321 1 3 . 1 1 44 44 VAL HA H 44 4.652 4.652 4.538 0.114 17765 322 1 3 . 1 1 44 44 VAL H H 44 8.784 8.784 8.040 0.744 17765 323 1 3 . 1 1 45 45 LYS HA H 45 4.821 4.821 4.694 0.127 17765 324 1 3 . 1 1 45 45 LYS H H 45 9.015 9.015 8.315 0.700 17765 325 1 3 . 1 1 46 46 CYS HA H 46 5.493 5.493 5.328 0.165 17765 326 1 3 . 1 1 46 46 CYS H H 46 8.943 8.943 8.618 0.325 17765 327 1 3 . 1 1 47 47 CYS HA H 47 5.677 5.677 5.418 0.259 17765 328 1 3 . 1 1 47 47 CYS H H 47 9.513 9.513 9.005 0.508 17765 329 1 3 . 1 1 48 48 LYS HA H 48 4.020 4.020 4.156 -0.136 17765 330 1 3 . 1 1 48 48 LYS H H 48 8.226 8.226 8.893 -0.667 17765 331 1 3 . 1 1 49 49 ASP HA H 49 4.570 4.570 4.706 -0.136 17765 332 1 3 . 1 1 49 49 ASP H H 49 8.375 8.375 8.377 -0.002 17765 333 1 3 . 1 1 50 50 ASP HA H 50 4.719 4.719 4.634 0.085 17765 334 1 3 . 1 1 50 50 ASP H H 50 8.306 8.306 7.831 0.475 17765 335 1 3 . 1 1 51 51 VAL HA H 51 4.196 4.196 4.135 0.061 17765 336 1 3 . 1 1 51 51 VAL H H 51 7.790 7.790 8.021 -0.231 17765 337 1 3 . 1 1 52 52 THR HA H 52 4.322 4.322 4.415 -0.093 17765 338 1 3 . 1 1 52 52 THR H H 52 8.194 8.194 7.920 0.274 17765 339 1 3 . 1 1 53 53 ASN HA H 53 4.777 4.777 4.599 0.178 17765 340 1 3 . 1 1 53 53 ASN H H 53 8.364 8.364 9.230 -0.866 17765 341 1 3 . 1 1 54 54 THR HA H 54 4.340 4.340 4.421 -0.081 17765 342 1 3 . 1 1 54 54 THR H H 54 8.201 8.201 8.503 -0.302 17765 343 1 3 . 1 1 55 55 GLY H H 55 8.354 8.354 8.095 0.259 17765 344 1 3 . 1 1 56 56 ASN HA H 56 4.729 4.729 4.857 -0.128 17765 345 1 3 . 1 1 56 56 ASN H H 56 8.397 8.397 8.260 0.137 17765 346 1 3 . 1 1 57 57 SER HA H 57 4.485 4.485 4.524 -0.039 17765 347 1 3 . 1 1 57 57 SER H H 57 8.205 8.205 8.735 -0.530 17765 348 1 3 . 1 1 58 58 GLY H H 58 8.144 8.144 8.250 -0.106 17765 349 1 3 . 1 1 59 59 LEU HA H 59 4.485 4.485 4.469 0.016 17765 350 1 3 . 1 1 59 59 LEU H H 59 8.460 8.460 8.401 0.059 17765 351 1 3 . 1 1 60 60 ILE HA H 60 4.794 4.794 4.178 0.616 17765 352 1 3 . 1 1 60 60 ILE H H 60 8.195 8.195 7.861 0.334 17765 353 1 3 . 1 1 61 61 ILE HA H 61 4.151 4.151 4.192 -0.041 17765 354 1 3 . 1 1 61 61 ILE H H 61 8.802 8.802 8.896 -0.094 17765 355 1 3 . 1 1 62 62 ASN HA H 62 4.617 4.617 4.568 0.049 17765 356 1 3 . 1 1 62 62 ASN H H 62 8.607 8.607 8.792 -0.185 17765 357 1 3 . 1 1 63 63 ALA HA H 63 3.772 3.772 4.258 -0.486 17765 358 1 3 . 1 1 63 63 ALA H H 63 8.735 8.735 8.840 -0.105 17765 359 1 3 . 1 1 64 64 ALA HA H 64 4.211 4.211 4.402 -0.191 17765 360 1 3 . 1 1 64 64 ALA H H 64 8.354 8.354 7.979 0.375 17765 361 1 3 . 1 1 65 65 ASN HA H 65 4.849 4.849 5.052 -0.203 17765 362 1 3 . 1 1 65 65 ASN H H 65 8.151 8.151 8.246 -0.095 17765 363 1 3 . 1 1 66 66 CYS HA H 66 5.624 5.624 5.453 0.171 17765 364 1 3 . 1 1 66 66 CYS H H 66 7.698 7.698 7.541 0.157 17765 365 1 3 . 1 1 67 67 VAL HA H 67 4.248 4.248 4.591 -0.343 17765 366 1 3 . 1 1 67 67 VAL H H 67 8.742 8.742 8.761 -0.019 17765 367 1 4 . 1 1 2 2 ALA HA H 2 4.562 4.562 4.579 -0.017 17765 368 1 4 . 1 1 2 2 ALA H H 2 8.617 8.617 8.285 0.332 17765 369 1 4 . 1 1 3 3 THR HA H 3 4.394 4.394 4.327 0.067 17765 370 1 4 . 1 1 3 3 THR H H 3 8.142 8.142 8.135 0.007 17765 371 1 4 . 1 1 4 4 THR HA H 4 4.615 4.615 4.746 -0.131 17765 372 1 4 . 1 1 4 4 THR H H 4 8.659 8.659 8.550 0.109 17765 373 1 4 . 1 1 5 5 ILE HA H 5 3.832 3.832 4.231 -0.399 17765 374 1 4 . 1 1 5 5 ILE H H 5 8.634 8.634 9.151 -0.517 17765 375 1 4 . 1 1 6 6 GLY H H 6 8.828 8.828 8.136 0.692 17765 376 1 4 . 1 1 7 7 PRO HA H 7 4.254 4.254 4.321 -0.067 17765 377 1 4 . 1 1 8 8 ASN HA H 8 4.846 4.846 4.799 0.047 17765 378 1 4 . 1 1 8 8 ASN H H 8 8.536 8.536 8.493 0.043 17765 379 1 4 . 1 1 9 9 THR HA H 9 3.758 3.758 4.085 -0.327 17765 380 1 4 . 1 1 9 9 THR H H 9 7.559 7.559 7.714 -0.155 17765 381 1 4 . 1 1 10 10 CYS HA H 10 4.897 4.897 4.690 0.207 17765 382 1 4 . 1 1 10 10 CYS H H 10 8.554 8.554 8.446 0.108 17765 383 1 4 . 1 1 11 11 SER HA H 11 4.441 4.441 4.669 -0.228 17765 384 1 4 . 1 1 11 11 SER H H 11 8.488 8.488 8.742 -0.254 17765 385 1 4 . 1 1 12 12 ILE HA H 12 4.126 4.126 4.149 -0.023 17765 386 1 4 . 1 1 12 12 ILE H H 12 7.392 7.392 8.115 -0.723 17765 387 1 4 . 1 1 13 13 ASP HA H 13 4.361 4.361 4.607 -0.246 17765 388 1 4 . 1 1 13 13 ASP H H 13 8.694 8.694 7.823 0.871 17765 389 1 4 . 1 1 14 14 ASP HA H 14 4.373 4.373 4.542 -0.169 17765 390 1 4 . 1 1 14 14 ASP H H 14 8.640 8.640 8.462 0.178 17765 391 1 4 . 1 1 15 15 TYR HA H 15 4.639 4.639 4.814 -0.175 17765 392 1 4 . 1 1 15 15 TYR H H 15 7.970 7.970 7.638 0.332 17765 393 1 4 . 1 1 16 16 LYS HA H 16 4.794 4.794 4.700 0.094 17765 394 1 4 . 1 1 16 16 LYS H H 16 8.655 8.655 7.885 0.770 17765 395 1 4 . 1 1 17 17 PRO HA H 17 5.205 5.205 4.676 0.529 17765 396 1 4 . 1 1 18 18 TYR HA H 18 4.653 4.653 5.084 -0.431 17765 397 1 4 . 1 1 18 18 TYR H H 18 9.475 9.475 9.155 0.320 17765 398 1 4 . 1 1 19 19 CYS HA H 19 5.358 5.358 5.158 0.200 17765 399 1 4 . 1 1 19 19 CYS H H 19 9.004 9.004 9.352 -0.348 17765 400 1 4 . 1 1 20 20 CYS HA H 20 5.597 5.597 4.639 0.958 17765 401 1 4 . 1 1 20 20 CYS H H 20 9.838 9.838 8.924 0.914 17765 402 1 4 . 1 1 21 21 GLN HA H 21 4.620 4.620 4.268 0.352 17765 403 1 4 . 1 1 21 21 GLN H H 21 8.900 8.900 8.575 0.325 17765 404 1 4 . 1 1 22 22 SER HA H 22 4.461 4.461 4.708 -0.247 17765 405 1 4 . 1 1 22 22 SER H H 22 8.529 8.529 8.340 0.189 17765 406 1 4 . 1 1 23 23 MET HA H 23 4.632 4.632 4.535 0.097 17765 407 1 4 . 1 1 23 23 MET H H 23 8.566 8.566 9.013 -0.447 17765 408 1 4 . 1 1 24 24 SER HA H 24 4.254 4.254 4.625 -0.371 17765 409 1 4 . 1 1 24 24 SER H H 24 8.534 8.534 8.374 0.160 17765 410 1 4 . 1 1 25 25 GLY H H 25 8.729 8.729 8.088 0.641 17765 411 1 4 . 1 1 26 26 SER HA H 26 4.575 4.575 4.500 0.075 17765 412 1 4 . 1 1 26 26 SER H H 26 7.873 7.873 8.729 -0.856 17765 413 1 4 . 1 1 27 27 ALA HA H 27 4.487 4.487 4.527 -0.040 17765 414 1 4 . 1 1 27 27 ALA H H 27 8.435 8.435 7.665 0.770 17765 415 1 4 . 1 1 28 28 SER HA H 28 4.650 4.650 4.489 0.161 17765 416 1 4 . 1 1 28 28 SER H H 28 8.134 8.134 8.167 -0.033 17765 417 1 4 . 1 1 29 29 LEU HA H 29 4.635 4.635 4.487 0.148 17765 418 1 4 . 1 1 29 29 LEU H H 29 8.763 8.763 7.979 0.784 17765 419 1 4 . 1 1 30 30 GLY H H 30 8.580 8.580 8.121 0.459 17765 420 1 4 . 1 1 31 31 CYS HA H 31 5.662 5.662 5.144 0.518 17765 421 1 4 . 1 1 31 31 CYS H H 31 8.786 8.786 8.378 0.408 17765 422 1 4 . 1 1 32 32 VAL HA H 32 4.724 4.724 4.665 0.059 17765 423 1 4 . 1 1 32 32 VAL H H 32 8.361 8.361 8.206 0.155 17765 424 1 4 . 1 1 33 33 VAL HA H 33 3.370 3.370 3.669 -0.299 17765 425 1 4 . 1 1 33 33 VAL H H 33 8.635 8.635 8.490 0.145 17765 426 1 4 . 1 1 34 34 GLY H H 34 8.088 8.088 8.326 -0.238 17765 427 1 4 . 1 1 35 35 VAL HA H 35 3.925 3.925 4.022 -0.097 17765 428 1 4 . 1 1 35 35 VAL H H 35 7.785 7.785 7.854 -0.069 17765 429 1 4 . 1 1 36 36 ILE HA H 36 3.360 3.360 3.889 -0.529 17765 430 1 4 . 1 1 36 36 ILE H H 36 8.614 8.614 8.538 0.076 17765 431 1 4 . 1 1 37 37 GLY H H 37 9.037 9.037 9.140 -0.103 17765 432 1 4 . 1 1 38 38 SER HA H 38 4.495 4.495 4.877 -0.382 17765 433 1 4 . 1 1 38 38 SER H H 38 8.150 8.150 8.039 0.111 17765 434 1 4 . 1 1 39 39 GLN HA H 39 4.825 4.825 4.938 -0.113 17765 435 1 4 . 1 1 39 39 GLN H H 39 8.429 8.429 8.351 0.078 17765 436 1 4 . 1 1 40 40 CYS HA H 40 4.987 4.987 4.375 0.612 17765 437 1 4 . 1 1 40 40 CYS H H 40 8.974 8.974 8.891 0.083 17765 438 1 4 . 1 1 41 41 GLY H H 41 9.375 9.375 8.411 0.964 17765 439 1 4 . 1 1 42 42 ALA HA H 42 4.658 4.658 4.584 0.074 17765 440 1 4 . 1 1 42 42 ALA H H 42 7.131 7.131 7.362 -0.231 17765 441 1 4 . 1 1 43 43 SER HA H 43 4.748 4.748 4.394 0.354 17765 442 1 4 . 1 1 43 43 SER H H 43 8.325 8.325 8.388 -0.063 17765 443 1 4 . 1 1 44 44 VAL HA H 44 4.652 4.652 4.520 0.132 17765 444 1 4 . 1 1 44 44 VAL H H 44 8.784 8.784 8.399 0.385 17765 445 1 4 . 1 1 45 45 LYS HA H 45 4.821 4.821 4.761 0.060 17765 446 1 4 . 1 1 45 45 LYS H H 45 9.015 9.015 9.210 -0.195 17765 447 1 4 . 1 1 46 46 CYS HA H 46 5.493 5.493 5.449 0.044 17765 448 1 4 . 1 1 46 46 CYS H H 46 8.943 8.943 8.648 0.295 17765 449 1 4 . 1 1 47 47 CYS HA H 47 5.677 5.677 4.991 0.686 17765 450 1 4 . 1 1 47 47 CYS H H 47 9.513 9.513 8.595 0.918 17765 451 1 4 . 1 1 48 48 LYS HA H 48 4.020 4.020 5.054 -1.034 17765 452 1 4 . 1 1 48 48 LYS H H 48 8.226 8.226 8.669 -0.443 17765 453 1 4 . 1 1 49 49 ASP HA H 49 4.570 4.570 4.521 0.049 17765 454 1 4 . 1 1 49 49 ASP H H 49 8.375 8.375 8.579 -0.204 17765 455 1 4 . 1 1 50 50 ASP HA H 50 4.719 4.719 4.246 0.473 17765 456 1 4 . 1 1 50 50 ASP H H 50 8.306 8.306 8.413 -0.107 17765 457 1 4 . 1 1 51 51 VAL HA H 51 4.196 4.196 4.026 0.170 17765 458 1 4 . 1 1 51 51 VAL H H 51 7.790 7.790 8.195 -0.405 17765 459 1 4 . 1 1 52 52 THR HA H 52 4.322 4.322 4.408 -0.086 17765 460 1 4 . 1 1 52 52 THR H H 52 8.194 8.194 8.728 -0.534 17765 461 1 4 . 1 1 53 53 ASN HA H 53 4.777 4.777 4.902 -0.125 17765 462 1 4 . 1 1 53 53 ASN H H 53 8.364 8.364 7.567 0.797 17765 463 1 4 . 1 1 54 54 THR HA H 54 4.340 4.340 4.351 -0.011 17765 464 1 4 . 1 1 54 54 THR H H 54 8.201 8.201 8.345 -0.144 17765 465 1 4 . 1 1 55 55 GLY H H 55 8.354 8.354 8.347 0.007 17765 466 1 4 . 1 1 56 56 ASN HA H 56 4.729 4.729 4.682 0.047 17765 467 1 4 . 1 1 56 56 ASN H H 56 8.397 8.397 9.042 -0.645 17765 468 1 4 . 1 1 57 57 SER HA H 57 4.485 4.485 4.451 0.034 17765 469 1 4 . 1 1 57 57 SER H H 57 8.205 8.205 8.149 0.056 17765 470 1 4 . 1 1 58 58 GLY H H 58 8.144 8.144 7.731 0.413 17765 471 1 4 . 1 1 59 59 LEU HA H 59 4.485 4.485 4.633 -0.148 17765 472 1 4 . 1 1 59 59 LEU H H 59 8.460 8.460 8.268 0.192 17765 473 1 4 . 1 1 60 60 ILE HA H 60 4.794 4.794 4.173 0.622 17765 474 1 4 . 1 1 60 60 ILE H H 60 8.195 8.195 8.232 -0.037 17765 475 1 4 . 1 1 61 61 ILE HA H 61 4.151 4.151 4.037 0.114 17765 476 1 4 . 1 1 61 61 ILE H H 61 8.802 8.802 8.007 0.795 17765 477 1 4 . 1 1 62 62 ASN HA H 62 4.617 4.617 4.538 0.079 17765 478 1 4 . 1 1 62 62 ASN H H 62 8.607 8.607 9.721 -1.114 17765 479 1 4 . 1 1 63 63 ALA HA H 63 3.772 3.772 3.931 -0.159 17765 480 1 4 . 1 1 63 63 ALA H H 63 8.735 8.735 8.180 0.555 17765 481 1 4 . 1 1 64 64 ALA HA H 64 4.211 4.211 4.232 -0.021 17765 482 1 4 . 1 1 64 64 ALA H H 64 8.354 8.354 7.900 0.454 17765 483 1 4 . 1 1 65 65 ASN HA H 65 4.849 4.849 4.959 -0.110 17765 484 1 4 . 1 1 65 65 ASN H H 65 8.151 8.151 9.255 -1.104 17765 485 1 4 . 1 1 66 66 CYS HA H 66 5.624 5.624 4.853 0.771 17765 486 1 4 . 1 1 66 66 CYS H H 66 7.698 7.698 7.569 0.129 17765 487 1 4 . 1 1 67 67 VAL HA H 67 4.248 4.248 4.518 -0.270 17765 488 1 4 . 1 1 67 67 VAL H H 67 8.742 8.742 7.928 0.814 17765 489 1 5 . 1 1 2 2 ALA HA H 2 4.562 4.562 5.417 -0.855 17765 490 1 5 . 1 1 2 2 ALA H H 2 8.617 8.617 8.601 0.016 17765 491 1 5 . 1 1 3 3 THR HA H 3 4.394 4.394 4.683 -0.289 17765 492 1 5 . 1 1 3 3 THR H H 3 8.142 8.142 8.249 -0.107 17765 493 1 5 . 1 1 4 4 THR HA H 4 4.615 4.615 4.371 0.244 17765 494 1 5 . 1 1 4 4 THR H H 4 8.659 8.659 8.599 0.060 17765 495 1 5 . 1 1 5 5 ILE HA H 5 3.832 3.832 4.302 -0.470 17765 496 1 5 . 1 1 5 5 ILE H H 5 8.634 8.634 8.586 0.048 17765 497 1 5 . 1 1 6 6 GLY H H 6 8.828 8.828 8.246 0.582 17765 498 1 5 . 1 1 7 7 PRO HA H 7 4.254 4.254 4.310 -0.056 17765 499 1 5 . 1 1 8 8 ASN HA H 8 4.846 4.846 5.032 -0.186 17765 500 1 5 . 1 1 8 8 ASN H H 8 8.536 8.536 7.986 0.550 17765 501 1 5 . 1 1 9 9 THR HA H 9 3.758 3.758 4.114 -0.356 17765 502 1 5 . 1 1 9 9 THR H H 9 7.559 7.559 8.073 -0.514 17765 503 1 5 . 1 1 10 10 CYS HA H 10 4.897 4.897 4.765 0.132 17765 504 1 5 . 1 1 10 10 CYS H H 10 8.554 8.554 8.448 0.106 17765 505 1 5 . 1 1 11 11 SER HA H 11 4.441 4.441 4.709 -0.268 17765 506 1 5 . 1 1 11 11 SER H H 11 8.488 8.488 8.748 -0.260 17765 507 1 5 . 1 1 12 12 ILE HA H 12 4.126 4.126 4.580 -0.454 17765 508 1 5 . 1 1 12 12 ILE H H 12 7.392 7.392 7.644 -0.252 17765 509 1 5 . 1 1 13 13 ASP HA H 13 4.361 4.361 4.582 -0.221 17765 510 1 5 . 1 1 13 13 ASP H H 13 8.694 8.694 8.265 0.429 17765 511 1 5 . 1 1 14 14 ASP HA H 14 4.373 4.373 4.162 0.211 17765 512 1 5 . 1 1 14 14 ASP H H 14 8.640 8.640 8.040 0.600 17765 513 1 5 . 1 1 15 15 TYR HA H 15 4.639 4.639 4.956 -0.317 17765 514 1 5 . 1 1 15 15 TYR H H 15 7.970 7.970 7.671 0.299 17765 515 1 5 . 1 1 16 16 LYS HA H 16 4.794 4.794 5.004 -0.210 17765 516 1 5 . 1 1 16 16 LYS H H 16 8.655 8.655 9.455 -0.800 17765 517 1 5 . 1 1 17 17 PRO HA H 17 5.205 5.205 4.531 0.674 17765 518 1 5 . 1 1 18 18 TYR HA H 18 4.653 4.653 5.044 -0.391 17765 519 1 5 . 1 1 18 18 TYR H H 18 9.475 9.475 9.114 0.361 17765 520 1 5 . 1 1 19 19 CYS HA H 19 5.358 5.358 4.890 0.468 17765 521 1 5 . 1 1 19 19 CYS H H 19 9.004 9.004 9.195 -0.191 17765 522 1 5 . 1 1 20 20 CYS HA H 20 5.597 5.597 4.593 1.004 17765 523 1 5 . 1 1 20 20 CYS H H 20 9.838 9.838 9.041 0.797 17765 524 1 5 . 1 1 21 21 GLN HA H 21 4.620 4.620 4.612 0.008 17765 525 1 5 . 1 1 21 21 GLN H H 21 8.900 8.900 8.500 0.400 17765 526 1 5 . 1 1 22 22 SER HA H 22 4.461 4.461 4.438 0.023 17765 527 1 5 . 1 1 22 22 SER H H 22 8.529 8.529 8.400 0.129 17765 528 1 5 . 1 1 23 23 MET HA H 23 4.632 4.632 4.826 -0.194 17765 529 1 5 . 1 1 23 23 MET H H 23 8.566 8.566 8.598 -0.032 17765 530 1 5 . 1 1 24 24 SER HA H 24 4.254 4.254 4.391 -0.137 17765 531 1 5 . 1 1 24 24 SER H H 24 8.534 8.534 8.163 0.371 17765 532 1 5 . 1 1 25 25 GLY H H 25 8.729 8.729 8.701 0.028 17765 533 1 5 . 1 1 26 26 SER HA H 26 4.575 4.575 4.603 -0.028 17765 534 1 5 . 1 1 26 26 SER H H 26 7.873 7.873 7.722 0.151 17765 535 1 5 . 1 1 27 27 ALA HA H 27 4.487 4.487 4.517 -0.030 17765 536 1 5 . 1 1 27 27 ALA H H 27 8.435 8.435 8.741 -0.306 17765 537 1 5 . 1 1 28 28 SER HA H 28 4.650 4.650 4.564 0.086 17765 538 1 5 . 1 1 28 28 SER H H 28 8.134 8.134 7.493 0.641 17765 539 1 5 . 1 1 29 29 LEU HA H 29 4.635 4.635 4.392 0.243 17765 540 1 5 . 1 1 29 29 LEU H H 29 8.763 8.763 8.963 -0.200 17765 541 1 5 . 1 1 30 30 GLY H H 30 8.580 8.580 8.303 0.277 17765 542 1 5 . 1 1 31 31 CYS HA H 31 5.662 5.662 4.727 0.935 17765 543 1 5 . 1 1 31 31 CYS H H 31 8.786 8.786 8.127 0.659 17765 544 1 5 . 1 1 32 32 VAL HA H 32 4.724 4.724 4.380 0.344 17765 545 1 5 . 1 1 32 32 VAL H H 32 8.361 8.361 8.067 0.294 17765 546 1 5 . 1 1 33 33 VAL HA H 33 3.370 3.370 3.235 0.135 17765 547 1 5 . 1 1 33 33 VAL H H 33 8.635 8.635 8.369 0.266 17765 548 1 5 . 1 1 34 34 GLY H H 34 8.088 8.088 8.227 -0.139 17765 549 1 5 . 1 1 35 35 VAL HA H 35 3.925 3.925 3.943 -0.018 17765 550 1 5 . 1 1 35 35 VAL H H 35 7.785 7.785 8.184 -0.399 17765 551 1 5 . 1 1 36 36 ILE HA H 36 3.360 3.360 3.787 -0.427 17765 552 1 5 . 1 1 36 36 ILE H H 36 8.614 8.614 8.360 0.254 17765 553 1 5 . 1 1 37 37 GLY H H 37 9.037 9.037 8.846 0.191 17765 554 1 5 . 1 1 38 38 SER HA H 38 4.495 4.495 4.873 -0.378 17765 555 1 5 . 1 1 38 38 SER H H 38 8.150 8.150 8.126 0.024 17765 556 1 5 . 1 1 39 39 GLN HA H 39 4.825 4.825 4.971 -0.146 17765 557 1 5 . 1 1 39 39 GLN H H 39 8.429 8.429 8.350 0.079 17765 558 1 5 . 1 1 40 40 CYS HA H 40 4.987 4.987 4.563 0.424 17765 559 1 5 . 1 1 40 40 CYS H H 40 8.974 8.974 8.922 0.052 17765 560 1 5 . 1 1 41 41 GLY H H 41 9.375 9.375 8.918 0.457 17765 561 1 5 . 1 1 42 42 ALA HA H 42 4.658 4.658 4.499 0.159 17765 562 1 5 . 1 1 42 42 ALA H H 42 7.131 7.131 7.291 -0.160 17765 563 1 5 . 1 1 43 43 SER HA H 43 4.748 4.748 4.310 0.438 17765 564 1 5 . 1 1 43 43 SER H H 43 8.325 8.325 8.275 0.050 17765 565 1 5 . 1 1 44 44 VAL HA H 44 4.652 4.652 4.243 0.409 17765 566 1 5 . 1 1 44 44 VAL H H 44 8.784 8.784 8.356 0.428 17765 567 1 5 . 1 1 45 45 LYS HA H 45 4.821 4.821 4.646 0.175 17765 568 1 5 . 1 1 45 45 LYS H H 45 9.015 9.015 9.011 0.004 17765 569 1 5 . 1 1 46 46 CYS HA H 46 5.493 5.493 5.223 0.270 17765 570 1 5 . 1 1 46 46 CYS H H 46 8.943 8.943 8.905 0.038 17765 571 1 5 . 1 1 47 47 CYS HA H 47 5.677 5.677 5.108 0.569 17765 572 1 5 . 1 1 47 47 CYS H H 47 9.513 9.513 8.957 0.556 17765 573 1 5 . 1 1 48 48 LYS HA H 48 4.020 4.020 4.700 -0.680 17765 574 1 5 . 1 1 48 48 LYS H H 48 8.226 8.226 8.250 -0.024 17765 575 1 5 . 1 1 49 49 ASP HA H 49 4.570 4.570 4.650 -0.080 17765 576 1 5 . 1 1 49 49 ASP H H 49 8.375 8.375 8.493 -0.118 17765 577 1 5 . 1 1 50 50 ASP HA H 50 4.719 4.719 4.784 -0.065 17765 578 1 5 . 1 1 50 50 ASP H H 50 8.306 8.306 8.411 -0.105 17765 579 1 5 . 1 1 51 51 VAL HA H 51 4.196 4.196 4.334 -0.138 17765 580 1 5 . 1 1 51 51 VAL H H 51 7.790 7.790 7.940 -0.150 17765 581 1 5 . 1 1 52 52 THR HA H 52 4.322 4.322 4.439 -0.117 17765 582 1 5 . 1 1 52 52 THR H H 52 8.194 8.194 8.809 -0.615 17765 583 1 5 . 1 1 53 53 ASN HA H 53 4.777 4.777 4.504 0.273 17765 584 1 5 . 1 1 53 53 ASN H H 53 8.364 8.364 9.381 -1.017 17765 585 1 5 . 1 1 54 54 THR HA H 54 4.340 4.340 4.232 0.108 17765 586 1 5 . 1 1 54 54 THR H H 54 8.201 8.201 7.925 0.276 17765 587 1 5 . 1 1 55 55 GLY H H 55 8.354 8.354 8.433 -0.079 17765 588 1 5 . 1 1 56 56 ASN HA H 56 4.729 4.729 4.761 -0.032 17765 589 1 5 . 1 1 56 56 ASN H H 56 8.397 8.397 8.258 0.139 17765 590 1 5 . 1 1 57 57 SER HA H 57 4.485 4.485 4.499 -0.014 17765 591 1 5 . 1 1 57 57 SER H H 57 8.205 8.205 8.610 -0.405 17765 592 1 5 . 1 1 58 58 GLY H H 58 8.144 8.144 8.478 -0.334 17765 593 1 5 . 1 1 59 59 LEU HA H 59 4.485 4.485 4.494 -0.009 17765 594 1 5 . 1 1 59 59 LEU H H 59 8.460 8.460 7.841 0.619 17765 595 1 5 . 1 1 60 60 ILE HA H 60 4.794 4.794 4.604 0.190 17765 596 1 5 . 1 1 60 60 ILE H H 60 8.195 8.195 8.353 -0.158 17765 597 1 5 . 1 1 61 61 ILE HA H 61 4.151 4.151 4.216 -0.065 17765 598 1 5 . 1 1 61 61 ILE H H 61 8.802 8.802 8.407 0.395 17765 599 1 5 . 1 1 62 62 ASN HA H 62 4.617 4.617 4.656 -0.039 17765 600 1 5 . 1 1 62 62 ASN H H 62 8.607 8.607 9.086 -0.479 17765 601 1 5 . 1 1 63 63 ALA HA H 63 3.772 3.772 3.811 -0.039 17765 602 1 5 . 1 1 63 63 ALA H H 63 8.735 8.735 8.747 -0.012 17765 603 1 5 . 1 1 64 64 ALA HA H 64 4.211 4.211 4.220 -0.009 17765 604 1 5 . 1 1 64 64 ALA H H 64 8.354 8.354 8.128 0.226 17765 605 1 5 . 1 1 65 65 ASN HA H 65 4.849 4.849 4.894 -0.045 17765 606 1 5 . 1 1 65 65 ASN H H 65 8.151 8.151 8.567 -0.416 17765 607 1 5 . 1 1 66 66 CYS HA H 66 5.624 5.624 4.884 0.740 17765 608 1 5 . 1 1 66 66 CYS H H 66 7.698 7.698 7.687 0.011 17765 609 1 5 . 1 1 67 67 VAL HA H 67 4.248 4.248 4.279 -0.031 17765 610 1 5 . 1 1 67 67 VAL H H 67 8.742 8.742 7.963 0.779 17765 611 1 6 . 1 1 2 2 ALA HA H 2 4.562 4.562 5.107 -0.545 17765 612 1 6 . 1 1 2 2 ALA H H 2 8.617 8.617 8.288 0.329 17765 613 1 6 . 1 1 3 3 THR HA H 3 4.394 4.394 4.638 -0.244 17765 614 1 6 . 1 1 3 3 THR H H 3 8.142 8.142 8.005 0.137 17765 615 1 6 . 1 1 4 4 THR HA H 4 4.615 4.615 4.550 0.065 17765 616 1 6 . 1 1 4 4 THR H H 4 8.659 8.659 8.515 0.144 17765 617 1 6 . 1 1 5 5 ILE HA H 5 3.832 3.832 4.210 -0.378 17765 618 1 6 . 1 1 5 5 ILE H H 5 8.634 8.634 8.927 -0.293 17765 619 1 6 . 1 1 6 6 GLY H H 6 8.828 8.828 8.422 0.406 17765 620 1 6 . 1 1 7 7 PRO HA H 7 4.254 4.254 4.087 0.167 17765 621 1 6 . 1 1 8 8 ASN HA H 8 4.846 4.846 4.690 0.156 17765 622 1 6 . 1 1 8 8 ASN H H 8 8.536 8.536 8.397 0.139 17765 623 1 6 . 1 1 9 9 THR HA H 9 3.758 3.758 4.245 -0.487 17765 624 1 6 . 1 1 9 9 THR H H 9 7.559 7.559 7.966 -0.407 17765 625 1 6 . 1 1 10 10 CYS HA H 10 4.897 4.897 4.848 0.049 17765 626 1 6 . 1 1 10 10 CYS H H 10 8.554 8.554 8.051 0.503 17765 627 1 6 . 1 1 11 11 SER HA H 11 4.441 4.441 4.735 -0.294 17765 628 1 6 . 1 1 11 11 SER H H 11 8.488 8.488 8.655 -0.167 17765 629 1 6 . 1 1 12 12 ILE HA H 12 4.126 4.126 4.214 -0.088 17765 630 1 6 . 1 1 12 12 ILE H H 12 7.392 7.392 7.833 -0.441 17765 631 1 6 . 1 1 13 13 ASP HA H 13 4.361 4.361 4.755 -0.394 17765 632 1 6 . 1 1 13 13 ASP H H 13 8.694 8.694 8.095 0.599 17765 633 1 6 . 1 1 14 14 ASP HA H 14 4.373 4.373 4.295 0.078 17765 634 1 6 . 1 1 14 14 ASP H H 14 8.640 8.640 7.932 0.708 17765 635 1 6 . 1 1 15 15 TYR HA H 15 4.639 4.639 4.754 -0.115 17765 636 1 6 . 1 1 15 15 TYR H H 15 7.970 7.970 8.120 -0.150 17765 637 1 6 . 1 1 16 16 LYS HA H 16 4.794 4.794 5.011 -0.217 17765 638 1 6 . 1 1 16 16 LYS H H 16 8.655 8.655 8.932 -0.277 17765 639 1 6 . 1 1 17 17 PRO HA H 17 5.205 5.205 4.705 0.500 17765 640 1 6 . 1 1 18 18 TYR HA H 18 4.653 4.653 5.082 -0.429 17765 641 1 6 . 1 1 18 18 TYR H H 18 9.475 9.475 9.297 0.178 17765 642 1 6 . 1 1 19 19 CYS HA H 19 5.358 5.358 4.945 0.413 17765 643 1 6 . 1 1 19 19 CYS H H 19 9.004 9.004 9.168 -0.164 17765 644 1 6 . 1 1 20 20 CYS HA H 20 5.597 5.597 4.401 1.196 17765 645 1 6 . 1 1 20 20 CYS H H 20 9.838 9.838 8.868 0.970 17765 646 1 6 . 1 1 21 21 GLN HA H 21 4.620 4.620 4.402 0.218 17765 647 1 6 . 1 1 21 21 GLN H H 21 8.900 8.900 8.186 0.714 17765 648 1 6 . 1 1 22 22 SER HA H 22 4.461 4.461 4.757 -0.296 17765 649 1 6 . 1 1 22 22 SER H H 22 8.529 8.529 8.389 0.141 17765 650 1 6 . 1 1 23 23 MET HA H 23 4.632 4.632 4.903 -0.271 17765 651 1 6 . 1 1 23 23 MET H H 23 8.566 8.566 8.420 0.146 17765 652 1 6 . 1 1 24 24 SER HA H 24 4.254 4.254 4.247 0.007 17765 653 1 6 . 1 1 24 24 SER H H 24 8.534 8.534 8.576 -0.042 17765 654 1 6 . 1 1 25 25 GLY H H 25 8.729 8.729 8.295 0.434 17765 655 1 6 . 1 1 26 26 SER HA H 26 4.575 4.575 4.657 -0.082 17765 656 1 6 . 1 1 26 26 SER H H 26 7.873 7.873 7.587 0.286 17765 657 1 6 . 1 1 27 27 ALA HA H 27 4.487 4.487 4.268 0.219 17765 658 1 6 . 1 1 27 27 ALA H H 27 8.435 8.435 8.423 0.012 17765 659 1 6 . 1 1 28 28 SER HA H 28 4.650 4.650 4.426 0.224 17765 660 1 6 . 1 1 28 28 SER H H 28 8.134 8.134 7.728 0.406 17765 661 1 6 . 1 1 29 29 LEU HA H 29 4.635 4.635 4.361 0.274 17765 662 1 6 . 1 1 29 29 LEU H H 29 8.763 8.763 8.616 0.147 17765 663 1 6 . 1 1 30 30 GLY H H 30 8.580 8.580 8.129 0.451 17765 664 1 6 . 1 1 31 31 CYS HA H 31 5.662 5.662 4.919 0.743 17765 665 1 6 . 1 1 31 31 CYS H H 31 8.786 8.786 7.794 0.992 17765 666 1 6 . 1 1 32 32 VAL HA H 32 4.724 4.724 4.584 0.140 17765 667 1 6 . 1 1 32 32 VAL H H 32 8.361 8.361 7.951 0.410 17765 668 1 6 . 1 1 33 33 VAL HA H 33 3.370 3.370 3.434 -0.064 17765 669 1 6 . 1 1 33 33 VAL H H 33 8.635 8.635 8.360 0.275 17765 670 1 6 . 1 1 34 34 GLY H H 34 8.088 8.088 8.268 -0.180 17765 671 1 6 . 1 1 35 35 VAL HA H 35 3.925 3.925 4.016 -0.091 17765 672 1 6 . 1 1 35 35 VAL H H 35 7.785 7.785 7.836 -0.051 17765 673 1 6 . 1 1 36 36 ILE HA H 36 3.360 3.360 3.785 -0.425 17765 674 1 6 . 1 1 36 36 ILE H H 36 8.614 8.614 8.602 0.012 17765 675 1 6 . 1 1 37 37 GLY H H 37 9.037 9.037 8.400 0.637 17765 676 1 6 . 1 1 38 38 SER HA H 38 4.495 4.495 4.772 -0.277 17765 677 1 6 . 1 1 38 38 SER H H 38 8.150 8.150 7.858 0.292 17765 678 1 6 . 1 1 39 39 GLN HA H 39 4.825 4.825 5.096 -0.271 17765 679 1 6 . 1 1 39 39 GLN H H 39 8.429 8.429 8.349 0.080 17765 680 1 6 . 1 1 40 40 CYS HA H 40 4.987 4.987 4.669 0.318 17765 681 1 6 . 1 1 40 40 CYS H H 40 8.974 8.974 8.519 0.455 17765 682 1 6 . 1 1 41 41 GLY H H 41 9.375 9.375 8.638 0.737 17765 683 1 6 . 1 1 42 42 ALA HA H 42 4.658 4.658 4.560 0.098 17765 684 1 6 . 1 1 42 42 ALA H H 42 7.131 7.131 8.725 -1.594 17765 685 1 6 . 1 1 43 43 SER HA H 43 4.748 4.748 4.719 0.029 17765 686 1 6 . 1 1 43 43 SER H H 43 8.325 8.325 8.034 0.291 17765 687 1 6 . 1 1 44 44 VAL HA H 44 4.652 4.652 4.451 0.201 17765 688 1 6 . 1 1 44 44 VAL H H 44 8.784 8.784 8.650 0.134 17765 689 1 6 . 1 1 45 45 LYS HA H 45 4.821 4.821 4.684 0.137 17765 690 1 6 . 1 1 45 45 LYS H H 45 9.015 9.015 9.168 -0.153 17765 691 1 6 . 1 1 46 46 CYS HA H 46 5.493 5.493 5.548 -0.055 17765 692 1 6 . 1 1 46 46 CYS H H 46 8.943 8.943 8.804 0.139 17765 693 1 6 . 1 1 47 47 CYS HA H 47 5.677 5.677 4.947 0.730 17765 694 1 6 . 1 1 47 47 CYS H H 47 9.513 9.513 9.236 0.277 17765 695 1 6 . 1 1 48 48 LYS HA H 48 4.020 4.020 4.899 -0.879 17765 696 1 6 . 1 1 48 48 LYS H H 48 8.226 8.226 8.349 -0.123 17765 697 1 6 . 1 1 49 49 ASP HA H 49 4.570 4.570 4.715 -0.145 17765 698 1 6 . 1 1 49 49 ASP H H 49 8.375 8.375 8.467 -0.092 17765 699 1 6 . 1 1 50 50 ASP HA H 50 4.719 4.719 4.510 0.209 17765 700 1 6 . 1 1 50 50 ASP H H 50 8.306 8.306 8.149 0.157 17765 701 1 6 . 1 1 51 51 VAL HA H 51 4.196 4.196 4.467 -0.271 17765 702 1 6 . 1 1 51 51 VAL H H 51 7.790 7.790 7.874 -0.084 17765 703 1 6 . 1 1 52 52 THR HA H 52 4.322 4.322 4.338 -0.016 17765 704 1 6 . 1 1 52 52 THR H H 52 8.194 8.194 7.858 0.336 17765 705 1 6 . 1 1 53 53 ASN HA H 53 4.777 4.777 4.518 0.259 17765 706 1 6 . 1 1 53 53 ASN H H 53 8.364 8.364 7.924 0.440 17765 707 1 6 . 1 1 54 54 THR HA H 54 4.340 4.340 4.311 0.029 17765 708 1 6 . 1 1 54 54 THR H H 54 8.201 8.201 7.783 0.418 17765 709 1 6 . 1 1 55 55 GLY H H 55 8.354 8.354 8.307 0.047 17765 710 1 6 . 1 1 56 56 ASN HA H 56 4.729 4.729 4.258 0.471 17765 711 1 6 . 1 1 56 56 ASN H H 56 8.397 8.397 8.634 -0.237 17765 712 1 6 . 1 1 57 57 SER HA H 57 4.485 4.485 4.709 -0.224 17765 713 1 6 . 1 1 57 57 SER H H 57 8.205 8.205 8.275 -0.070 17765 714 1 6 . 1 1 58 58 GLY H H 58 8.144 8.144 7.354 0.790 17765 715 1 6 . 1 1 59 59 LEU HA H 59 4.485 4.485 4.839 -0.354 17765 716 1 6 . 1 1 59 59 LEU H H 59 8.460 8.460 8.480 -0.020 17765 717 1 6 . 1 1 60 60 ILE HA H 60 4.794 4.794 4.389 0.405 17765 718 1 6 . 1 1 60 60 ILE H H 60 8.195 8.195 8.302 -0.107 17765 719 1 6 . 1 1 61 61 ILE HA H 61 4.151 4.151 3.800 0.351 17765 720 1 6 . 1 1 61 61 ILE H H 61 8.802 8.802 7.977 0.825 17765 721 1 6 . 1 1 62 62 ASN HA H 62 4.617 4.617 4.601 0.016 17765 722 1 6 . 1 1 62 62 ASN H H 62 8.607 8.607 8.568 0.039 17765 723 1 6 . 1 1 63 63 ALA HA H 63 3.772 3.772 3.789 -0.017 17765 724 1 6 . 1 1 63 63 ALA H H 63 8.735 8.735 8.010 0.725 17765 725 1 6 . 1 1 64 64 ALA HA H 64 4.211 4.211 4.230 -0.019 17765 726 1 6 . 1 1 64 64 ALA H H 64 8.354 8.354 8.116 0.238 17765 727 1 6 . 1 1 65 65 ASN HA H 65 4.849 4.849 4.767 0.082 17765 728 1 6 . 1 1 65 65 ASN H H 65 8.151 8.151 8.212 -0.061 17765 729 1 6 . 1 1 66 66 CYS HA H 66 5.624 5.624 4.969 0.655 17765 730 1 6 . 1 1 66 66 CYS H H 66 7.698 7.698 7.514 0.184 17765 731 1 6 . 1 1 67 67 VAL HA H 67 4.248 4.248 3.918 0.330 17765 732 1 6 . 1 1 67 67 VAL H H 67 8.742 8.742 8.228 0.514 17765 733 1 7 . 1 1 2 2 ALA HA H 2 4.562 4.562 4.568 -0.006 17765 734 1 7 . 1 1 2 2 ALA H H 2 8.617 8.617 8.392 0.225 17765 735 1 7 . 1 1 3 3 THR HA H 3 4.394 4.394 4.433 -0.039 17765 736 1 7 . 1 1 3 3 THR H H 3 8.142 8.142 8.739 -0.597 17765 737 1 7 . 1 1 4 4 THR HA H 4 4.615 4.615 4.583 0.032 17765 738 1 7 . 1 1 4 4 THR H H 4 8.659 8.659 8.704 -0.045 17765 739 1 7 . 1 1 5 5 ILE HA H 5 3.832 3.832 4.142 -0.310 17765 740 1 7 . 1 1 5 5 ILE H H 5 8.634 8.634 8.880 -0.246 17765 741 1 7 . 1 1 6 6 GLY H H 6 8.828 8.828 8.547 0.281 17765 742 1 7 . 1 1 7 7 PRO HA H 7 4.254 4.254 4.391 -0.137 17765 743 1 7 . 1 1 8 8 ASN HA H 8 4.846 4.846 4.883 -0.037 17765 744 1 7 . 1 1 8 8 ASN H H 8 8.536 8.536 8.391 0.145 17765 745 1 7 . 1 1 9 9 THR HA H 9 3.758 3.758 4.245 -0.487 17765 746 1 7 . 1 1 9 9 THR H H 9 7.559 7.559 7.802 -0.243 17765 747 1 7 . 1 1 10 10 CYS HA H 10 4.897 4.897 4.729 0.168 17765 748 1 7 . 1 1 10 10 CYS H H 10 8.554 8.554 8.274 0.280 17765 749 1 7 . 1 1 11 11 SER HA H 11 4.441 4.441 4.642 -0.201 17765 750 1 7 . 1 1 11 11 SER H H 11 8.488 8.488 8.708 -0.220 17765 751 1 7 . 1 1 12 12 ILE HA H 12 4.126 4.126 4.186 -0.060 17765 752 1 7 . 1 1 12 12 ILE H H 12 7.392 7.392 8.180 -0.788 17765 753 1 7 . 1 1 13 13 ASP HA H 13 4.361 4.361 4.677 -0.316 17765 754 1 7 . 1 1 13 13 ASP H H 13 8.694 8.694 7.996 0.698 17765 755 1 7 . 1 1 14 14 ASP HA H 14 4.373 4.373 4.635 -0.262 17765 756 1 7 . 1 1 14 14 ASP H H 14 8.640 8.640 8.436 0.204 17765 757 1 7 . 1 1 15 15 TYR HA H 15 4.639 4.639 4.618 0.021 17765 758 1 7 . 1 1 15 15 TYR H H 15 7.970 7.970 7.550 0.420 17765 759 1 7 . 1 1 16 16 LYS HA H 16 4.794 4.794 4.955 -0.161 17765 760 1 7 . 1 1 16 16 LYS H H 16 8.655 8.655 9.032 -0.377 17765 761 1 7 . 1 1 17 17 PRO HA H 17 5.205 5.205 4.813 0.392 17765 762 1 7 . 1 1 18 18 TYR HA H 18 4.653 4.653 5.044 -0.391 17765 763 1 7 . 1 1 18 18 TYR H H 18 9.475 9.475 9.155 0.320 17765 764 1 7 . 1 1 19 19 CYS HA H 19 5.358 5.358 4.964 0.394 17765 765 1 7 . 1 1 19 19 CYS H H 19 9.004 9.004 9.134 -0.130 17765 766 1 7 . 1 1 20 20 CYS HA H 20 5.597 5.597 4.753 0.844 17765 767 1 7 . 1 1 20 20 CYS H H 20 9.838 9.838 9.237 0.601 17765 768 1 7 . 1 1 21 21 GLN HA H 21 4.620 4.620 4.472 0.148 17765 769 1 7 . 1 1 21 21 GLN H H 21 8.900 8.900 9.245 -0.345 17765 770 1 7 . 1 1 22 22 SER HA H 22 4.461 4.461 4.515 -0.054 17765 771 1 7 . 1 1 22 22 SER H H 22 8.529 8.529 8.216 0.313 17765 772 1 7 . 1 1 23 23 MET HA H 23 4.632 4.632 4.939 -0.307 17765 773 1 7 . 1 1 23 23 MET H H 23 8.566 8.566 8.035 0.531 17765 774 1 7 . 1 1 24 24 SER HA H 24 4.254 4.254 4.496 -0.242 17765 775 1 7 . 1 1 24 24 SER H H 24 8.534 8.534 8.215 0.319 17765 776 1 7 . 1 1 25 25 GLY H H 25 8.729 8.729 8.298 0.431 17765 777 1 7 . 1 1 26 26 SER HA H 26 4.575 4.575 4.604 -0.029 17765 778 1 7 . 1 1 26 26 SER H H 26 7.873 7.873 7.483 0.390 17765 779 1 7 . 1 1 27 27 ALA HA H 27 4.487 4.487 4.485 0.002 17765 780 1 7 . 1 1 27 27 ALA H H 27 8.435 8.435 8.620 -0.185 17765 781 1 7 . 1 1 28 28 SER HA H 28 4.650 4.650 4.567 0.083 17765 782 1 7 . 1 1 28 28 SER H H 28 8.134 8.134 7.479 0.655 17765 783 1 7 . 1 1 29 29 LEU HA H 29 4.635 4.635 4.365 0.270 17765 784 1 7 . 1 1 29 29 LEU H H 29 8.763 8.763 9.113 -0.350 17765 785 1 7 . 1 1 30 30 GLY H H 30 8.580 8.580 8.203 0.377 17765 786 1 7 . 1 1 31 31 CYS HA H 31 5.662 5.662 5.198 0.464 17765 787 1 7 . 1 1 31 31 CYS H H 31 8.786 8.786 8.017 0.769 17765 788 1 7 . 1 1 32 32 VAL HA H 32 4.724 4.724 4.354 0.370 17765 789 1 7 . 1 1 32 32 VAL H H 32 8.361 8.361 8.567 -0.206 17765 790 1 7 . 1 1 33 33 VAL HA H 33 3.370 3.370 3.164 0.206 17765 791 1 7 . 1 1 33 33 VAL H H 33 8.635 8.635 8.626 0.009 17765 792 1 7 . 1 1 34 34 GLY H H 34 8.088 8.088 7.897 0.191 17765 793 1 7 . 1 1 35 35 VAL HA H 35 3.925 3.925 3.961 -0.036 17765 794 1 7 . 1 1 35 35 VAL H H 35 7.785 7.785 7.675 0.110 17765 795 1 7 . 1 1 36 36 ILE HA H 36 3.360 3.360 3.946 -0.586 17765 796 1 7 . 1 1 36 36 ILE H H 36 8.614 8.614 8.542 0.072 17765 797 1 7 . 1 1 37 37 GLY H H 37 9.037 9.037 8.811 0.226 17765 798 1 7 . 1 1 38 38 SER HA H 38 4.495 4.495 4.472 0.023 17765 799 1 7 . 1 1 38 38 SER H H 38 8.150 8.150 8.039 0.111 17765 800 1 7 . 1 1 39 39 GLN HA H 39 4.825 4.825 4.583 0.242 17765 801 1 7 . 1 1 39 39 GLN H H 39 8.429 8.429 8.739 -0.310 17765 802 1 7 . 1 1 40 40 CYS HA H 40 4.987 4.987 4.467 0.520 17765 803 1 7 . 1 1 40 40 CYS H H 40 8.974 8.974 8.813 0.161 17765 804 1 7 . 1 1 41 41 GLY H H 41 9.375 9.375 9.025 0.350 17765 805 1 7 . 1 1 42 42 ALA HA H 42 4.658 4.658 4.818 -0.160 17765 806 1 7 . 1 1 42 42 ALA H H 42 7.131 7.131 7.360 -0.229 17765 807 1 7 . 1 1 43 43 SER HA H 43 4.748 4.748 4.639 0.109 17765 808 1 7 . 1 1 43 43 SER H H 43 8.325 8.325 8.041 0.284 17765 809 1 7 . 1 1 44 44 VAL HA H 44 4.652 4.652 4.028 0.624 17765 810 1 7 . 1 1 44 44 VAL H H 44 8.784 8.784 8.344 0.440 17765 811 1 7 . 1 1 45 45 LYS HA H 45 4.821 4.821 4.476 0.345 17765 812 1 7 . 1 1 45 45 LYS H H 45 9.015 9.015 8.535 0.480 17765 813 1 7 . 1 1 46 46 CYS HA H 46 5.493 5.493 5.446 0.047 17765 814 1 7 . 1 1 46 46 CYS H H 46 8.943 8.943 8.470 0.473 17765 815 1 7 . 1 1 47 47 CYS HA H 47 5.677 5.677 5.253 0.424 17765 816 1 7 . 1 1 47 47 CYS H H 47 9.513 9.513 9.402 0.111 17765 817 1 7 . 1 1 48 48 LYS HA H 48 4.020 4.020 4.866 -0.846 17765 818 1 7 . 1 1 48 48 LYS H H 48 8.226 8.226 8.828 -0.602 17765 819 1 7 . 1 1 49 49 ASP HA H 49 4.570 4.570 4.755 -0.185 17765 820 1 7 . 1 1 49 49 ASP H H 49 8.375 8.375 8.228 0.147 17765 821 1 7 . 1 1 50 50 ASP HA H 50 4.719 4.719 4.397 0.322 17765 822 1 7 . 1 1 50 50 ASP H H 50 8.306 8.306 8.766 -0.460 17765 823 1 7 . 1 1 51 51 VAL HA H 51 4.196 4.196 4.261 -0.065 17765 824 1 7 . 1 1 51 51 VAL H H 51 7.790 7.790 7.867 -0.077 17765 825 1 7 . 1 1 52 52 THR HA H 52 4.322 4.322 4.512 -0.190 17765 826 1 7 . 1 1 52 52 THR H H 52 8.194 8.194 8.008 0.186 17765 827 1 7 . 1 1 53 53 ASN HA H 53 4.777 4.777 4.514 0.263 17765 828 1 7 . 1 1 53 53 ASN H H 53 8.364 8.364 8.849 -0.485 17765 829 1 7 . 1 1 54 54 THR HA H 54 4.340 4.340 4.305 0.035 17765 830 1 7 . 1 1 54 54 THR H H 54 8.201 8.201 8.314 -0.113 17765 831 1 7 . 1 1 55 55 GLY H H 55 8.354 8.354 8.411 -0.057 17765 832 1 7 . 1 1 56 56 ASN HA H 56 4.729 4.729 4.355 0.374 17765 833 1 7 . 1 1 56 56 ASN H H 56 8.397 8.397 7.806 0.591 17765 834 1 7 . 1 1 57 57 SER HA H 57 4.485 4.485 4.527 -0.042 17765 835 1 7 . 1 1 57 57 SER H H 57 8.205 8.205 8.473 -0.268 17765 836 1 7 . 1 1 58 58 GLY H H 58 8.144 8.144 7.969 0.175 17765 837 1 7 . 1 1 59 59 LEU HA H 59 4.485 4.485 4.463 0.022 17765 838 1 7 . 1 1 59 59 LEU H H 59 8.460 8.460 8.425 0.035 17765 839 1 7 . 1 1 60 60 ILE HA H 60 4.794 4.794 4.195 0.599 17765 840 1 7 . 1 1 60 60 ILE H H 60 8.195 8.195 7.755 0.440 17765 841 1 7 . 1 1 61 61 ILE HA H 61 4.151 4.151 4.041 0.110 17765 842 1 7 . 1 1 61 61 ILE H H 61 8.802 8.802 8.584 0.218 17765 843 1 7 . 1 1 62 62 ASN HA H 62 4.617 4.617 4.613 0.004 17765 844 1 7 . 1 1 62 62 ASN H H 62 8.607 8.607 8.472 0.135 17765 845 1 7 . 1 1 63 63 ALA HA H 63 3.772 3.772 4.358 -0.586 17765 846 1 7 . 1 1 63 63 ALA H H 63 8.735 8.735 8.762 -0.027 17765 847 1 7 . 1 1 64 64 ALA HA H 64 4.211 4.211 4.450 -0.239 17765 848 1 7 . 1 1 64 64 ALA H H 64 8.354 8.354 7.611 0.743 17765 849 1 7 . 1 1 65 65 ASN HA H 65 4.849 4.849 5.084 -0.235 17765 850 1 7 . 1 1 65 65 ASN H H 65 8.151 8.151 8.004 0.147 17765 851 1 7 . 1 1 66 66 CYS HA H 66 5.624 5.624 5.400 0.224 17765 852 1 7 . 1 1 66 66 CYS H H 66 7.698 7.698 7.752 -0.054 17765 853 1 7 . 1 1 67 67 VAL HA H 67 4.248 4.248 3.930 0.318 17765 854 1 7 . 1 1 67 67 VAL H H 67 8.742 8.742 8.130 0.612 17765 855 1 8 . 1 1 2 2 ALA HA H 2 4.562 4.562 5.401 -0.839 17765 856 1 8 . 1 1 2 2 ALA H H 2 8.617 8.617 7.787 0.830 17765 857 1 8 . 1 1 3 3 THR HA H 3 4.394 4.394 4.595 -0.201 17765 858 1 8 . 1 1 3 3 THR H H 3 8.142 8.142 8.154 -0.012 17765 859 1 8 . 1 1 4 4 THR HA H 4 4.615 4.615 4.803 -0.188 17765 860 1 8 . 1 1 4 4 THR H H 4 8.659 8.659 8.573 0.086 17765 861 1 8 . 1 1 5 5 ILE HA H 5 3.832 3.832 4.206 -0.374 17765 862 1 8 . 1 1 5 5 ILE H H 5 8.634 8.634 9.042 -0.408 17765 863 1 8 . 1 1 6 6 GLY H H 6 8.828 8.828 8.511 0.317 17765 864 1 8 . 1 1 7 7 PRO HA H 7 4.254 4.254 4.312 -0.058 17765 865 1 8 . 1 1 8 8 ASN HA H 8 4.846 4.846 4.829 0.017 17765 866 1 8 . 1 1 8 8 ASN H H 8 8.536 8.536 7.911 0.625 17765 867 1 8 . 1 1 9 9 THR HA H 9 3.758 3.758 4.202 -0.444 17765 868 1 8 . 1 1 9 9 THR H H 9 7.559 7.559 7.728 -0.169 17765 869 1 8 . 1 1 10 10 CYS HA H 10 4.897 4.897 4.725 0.172 17765 870 1 8 . 1 1 10 10 CYS H H 10 8.554 8.554 7.963 0.591 17765 871 1 8 . 1 1 11 11 SER HA H 11 4.441 4.441 4.729 -0.288 17765 872 1 8 . 1 1 11 11 SER H H 11 8.488 8.488 8.751 -0.263 17765 873 1 8 . 1 1 12 12 ILE HA H 12 4.126 4.126 4.151 -0.025 17765 874 1 8 . 1 1 12 12 ILE H H 12 7.392 7.392 7.887 -0.495 17765 875 1 8 . 1 1 13 13 ASP HA H 13 4.361 4.361 4.518 -0.157 17765 876 1 8 . 1 1 13 13 ASP H H 13 8.694 8.694 7.733 0.961 17765 877 1 8 . 1 1 14 14 ASP HA H 14 4.373 4.373 4.546 -0.173 17765 878 1 8 . 1 1 14 14 ASP H H 14 8.640 8.640 8.431 0.209 17765 879 1 8 . 1 1 15 15 TYR HA H 15 4.639 4.639 4.716 -0.077 17765 880 1 8 . 1 1 15 15 TYR H H 15 7.970 7.970 7.560 0.410 17765 881 1 8 . 1 1 16 16 LYS HA H 16 4.794 4.794 4.659 0.135 17765 882 1 8 . 1 1 16 16 LYS H H 16 8.655 8.655 7.848 0.807 17765 883 1 8 . 1 1 17 17 PRO HA H 17 5.205 5.205 4.703 0.502 17765 884 1 8 . 1 1 18 18 TYR HA H 18 4.653 4.653 5.015 -0.362 17765 885 1 8 . 1 1 18 18 TYR H H 18 9.475 9.475 9.241 0.234 17765 886 1 8 . 1 1 19 19 CYS HA H 19 5.358 5.358 4.792 0.566 17765 887 1 8 . 1 1 19 19 CYS H H 19 9.004 9.004 9.252 -0.248 17765 888 1 8 . 1 1 20 20 CYS HA H 20 5.597 5.597 4.591 1.006 17765 889 1 8 . 1 1 20 20 CYS H H 20 9.838 9.838 8.944 0.894 17765 890 1 8 . 1 1 21 21 GLN HA H 21 4.620 4.620 4.179 0.441 17765 891 1 8 . 1 1 21 21 GLN H H 21 8.900 8.900 8.369 0.531 17765 892 1 8 . 1 1 22 22 SER HA H 22 4.461 4.461 4.265 0.196 17765 893 1 8 . 1 1 22 22 SER H H 22 8.529 8.529 8.643 -0.114 17765 894 1 8 . 1 1 23 23 MET HA H 23 4.632 4.632 4.563 0.069 17765 895 1 8 . 1 1 23 23 MET H H 23 8.566 8.566 8.585 -0.019 17765 896 1 8 . 1 1 24 24 SER HA H 24 4.254 4.254 4.711 -0.457 17765 897 1 8 . 1 1 24 24 SER H H 24 8.534 8.534 8.975 -0.441 17765 898 1 8 . 1 1 25 25 GLY H H 25 8.729 8.729 8.772 -0.043 17765 899 1 8 . 1 1 26 26 SER HA H 26 4.575 4.575 4.373 0.202 17765 900 1 8 . 1 1 26 26 SER H H 26 7.873 7.873 7.734 0.139 17765 901 1 8 . 1 1 27 27 ALA HA H 27 4.487 4.487 4.328 0.159 17765 902 1 8 . 1 1 27 27 ALA H H 27 8.435 8.435 8.717 -0.282 17765 903 1 8 . 1 1 28 28 SER HA H 28 4.650 4.650 5.287 -0.637 17765 904 1 8 . 1 1 28 28 SER H H 28 8.134 8.134 7.599 0.535 17765 905 1 8 . 1 1 29 29 LEU HA H 29 4.635 4.635 4.619 0.016 17765 906 1 8 . 1 1 29 29 LEU H H 29 8.763 8.763 8.955 -0.192 17765 907 1 8 . 1 1 30 30 GLY H H 30 8.580 8.580 8.614 -0.034 17765 908 1 8 . 1 1 31 31 CYS HA H 31 5.662 5.662 4.681 0.981 17765 909 1 8 . 1 1 31 31 CYS H H 31 8.786 8.786 8.049 0.737 17765 910 1 8 . 1 1 32 32 VAL HA H 32 4.724 4.724 4.626 0.098 17765 911 1 8 . 1 1 32 32 VAL H H 32 8.361 8.361 8.127 0.234 17765 912 1 8 . 1 1 33 33 VAL HA H 33 3.370 3.370 3.819 -0.449 17765 913 1 8 . 1 1 33 33 VAL H H 33 8.635 8.635 8.702 -0.067 17765 914 1 8 . 1 1 34 34 GLY H H 34 8.088 8.088 8.268 -0.180 17765 915 1 8 . 1 1 35 35 VAL HA H 35 3.925 3.925 3.968 -0.043 17765 916 1 8 . 1 1 35 35 VAL H H 35 7.785 7.785 8.062 -0.277 17765 917 1 8 . 1 1 36 36 ILE HA H 36 3.360 3.360 3.960 -0.600 17765 918 1 8 . 1 1 36 36 ILE H H 36 8.614 8.614 8.687 -0.073 17765 919 1 8 . 1 1 37 37 GLY H H 37 9.037 9.037 8.478 0.559 17765 920 1 8 . 1 1 38 38 SER HA H 38 4.495 4.495 4.783 -0.288 17765 921 1 8 . 1 1 38 38 SER H H 38 8.150 8.150 8.001 0.149 17765 922 1 8 . 1 1 39 39 GLN HA H 39 4.825 4.825 5.041 -0.216 17765 923 1 8 . 1 1 39 39 GLN H H 39 8.429 8.429 8.411 0.018 17765 924 1 8 . 1 1 40 40 CYS HA H 40 4.987 4.987 4.538 0.449 17765 925 1 8 . 1 1 40 40 CYS H H 40 8.974 8.974 8.783 0.191 17765 926 1 8 . 1 1 41 41 GLY H H 41 9.375 9.375 8.887 0.488 17765 927 1 8 . 1 1 42 42 ALA HA H 42 4.658 4.658 4.603 0.055 17765 928 1 8 . 1 1 42 42 ALA H H 42 7.131 7.131 7.295 -0.164 17765 929 1 8 . 1 1 43 43 SER HA H 43 4.748 4.748 4.500 0.248 17765 930 1 8 . 1 1 43 43 SER H H 43 8.325 8.325 8.326 -0.001 17765 931 1 8 . 1 1 44 44 VAL HA H 44 4.652 4.652 4.537 0.116 17765 932 1 8 . 1 1 44 44 VAL H H 44 8.784 8.784 7.980 0.804 17765 933 1 8 . 1 1 45 45 LYS HA H 45 4.821 4.821 4.686 0.135 17765 934 1 8 . 1 1 45 45 LYS H H 45 9.015 9.015 9.224 -0.209 17765 935 1 8 . 1 1 46 46 CYS HA H 46 5.493 5.493 5.426 0.067 17765 936 1 8 . 1 1 46 46 CYS H H 46 8.943 8.943 8.581 0.362 17765 937 1 8 . 1 1 47 47 CYS HA H 47 5.677 5.677 4.877 0.800 17765 938 1 8 . 1 1 47 47 CYS H H 47 9.513 9.513 8.807 0.706 17765 939 1 8 . 1 1 48 48 LYS HA H 48 4.020 4.020 5.323 -1.303 17765 940 1 8 . 1 1 48 48 LYS H H 48 8.226 8.226 8.874 -0.648 17765 941 1 8 . 1 1 49 49 ASP HA H 49 4.570 4.570 4.810 -0.240 17765 942 1 8 . 1 1 49 49 ASP H H 49 8.375 8.375 8.785 -0.410 17765 943 1 8 . 1 1 50 50 ASP HA H 50 4.719 4.719 4.504 0.215 17765 944 1 8 . 1 1 50 50 ASP H H 50 8.306 8.306 8.227 0.079 17765 945 1 8 . 1 1 51 51 VAL HA H 51 4.196 4.196 4.432 -0.236 17765 946 1 8 . 1 1 51 51 VAL H H 51 7.790 7.790 7.634 0.156 17765 947 1 8 . 1 1 52 52 THR HA H 52 4.322 4.322 4.460 -0.138 17765 948 1 8 . 1 1 52 52 THR H H 52 8.194 8.194 8.381 -0.187 17765 949 1 8 . 1 1 53 53 ASN HA H 53 4.777 4.777 4.964 -0.187 17765 950 1 8 . 1 1 53 53 ASN H H 53 8.364 8.364 8.141 0.223 17765 951 1 8 . 1 1 54 54 THR HA H 54 4.340 4.340 4.311 0.029 17765 952 1 8 . 1 1 54 54 THR H H 54 8.201 8.201 8.351 -0.149 17765 953 1 8 . 1 1 55 55 GLY H H 55 8.354 8.354 8.507 -0.153 17765 954 1 8 . 1 1 56 56 ASN HA H 56 4.729 4.729 4.970 -0.241 17765 955 1 8 . 1 1 56 56 ASN H H 56 8.397 8.397 8.444 -0.047 17765 956 1 8 . 1 1 57 57 SER HA H 57 4.485 4.485 4.700 -0.215 17765 957 1 8 . 1 1 57 57 SER H H 57 8.205 8.205 7.730 0.475 17765 958 1 8 . 1 1 58 58 GLY H H 58 8.144 8.144 8.404 -0.260 17765 959 1 8 . 1 1 59 59 LEU HA H 59 4.485 4.485 4.411 0.074 17765 960 1 8 . 1 1 59 59 LEU H H 59 8.460 8.460 8.036 0.424 17765 961 1 8 . 1 1 60 60 ILE HA H 60 4.794 4.794 4.380 0.414 17765 962 1 8 . 1 1 60 60 ILE H H 60 8.195 8.195 7.670 0.525 17765 963 1 8 . 1 1 61 61 ILE HA H 61 4.151 4.151 4.037 0.114 17765 964 1 8 . 1 1 61 61 ILE H H 61 8.802 8.802 7.593 1.209 17765 965 1 8 . 1 1 62 62 ASN HA H 62 4.617 4.617 4.718 -0.101 17765 966 1 8 . 1 1 62 62 ASN H H 62 8.607 8.607 8.548 0.059 17765 967 1 8 . 1 1 63 63 ALA HA H 63 3.772 3.772 4.054 -0.282 17765 968 1 8 . 1 1 63 63 ALA H H 63 8.735 8.735 9.175 -0.440 17765 969 1 8 . 1 1 64 64 ALA HA H 64 4.211 4.211 4.203 0.008 17765 970 1 8 . 1 1 64 64 ALA H H 64 8.354 8.354 8.283 0.071 17765 971 1 8 . 1 1 65 65 ASN HA H 65 4.849 4.849 4.796 0.053 17765 972 1 8 . 1 1 65 65 ASN H H 65 8.151 8.151 7.871 0.280 17765 973 1 8 . 1 1 66 66 CYS HA H 66 5.624 5.624 4.380 1.244 17765 974 1 8 . 1 1 66 66 CYS H H 66 7.698 7.698 7.193 0.505 17765 975 1 8 . 1 1 67 67 VAL HA H 67 4.248 4.248 3.576 0.672 17765 976 1 8 . 1 1 67 67 VAL H H 67 8.742 8.742 7.938 0.804 17765 977 1 9 . 1 1 2 2 ALA HA H 2 4.562 4.562 4.625 -0.063 17765 978 1 9 . 1 1 2 2 ALA H H 2 8.617 8.617 7.799 0.818 17765 979 1 9 . 1 1 3 3 THR HA H 3 4.394 4.394 4.264 0.130 17765 980 1 9 . 1 1 3 3 THR H H 3 8.142 8.142 7.761 0.381 17765 981 1 9 . 1 1 4 4 THR HA H 4 4.615 4.615 4.724 -0.109 17765 982 1 9 . 1 1 4 4 THR H H 4 8.659 8.659 8.478 0.181 17765 983 1 9 . 1 1 5 5 ILE HA H 5 3.832 3.832 4.311 -0.479 17765 984 1 9 . 1 1 5 5 ILE H H 5 8.634 8.634 9.090 -0.456 17765 985 1 9 . 1 1 6 6 GLY H H 6 8.828 8.828 8.457 0.371 17765 986 1 9 . 1 1 7 7 PRO HA H 7 4.254 4.254 4.316 -0.062 17765 987 1 9 . 1 1 8 8 ASN HA H 8 4.846 4.846 4.612 0.234 17765 988 1 9 . 1 1 8 8 ASN H H 8 8.536 8.536 8.231 0.305 17765 989 1 9 . 1 1 9 9 THR HA H 9 3.758 3.758 4.170 -0.412 17765 990 1 9 . 1 1 9 9 THR H H 9 7.559 7.559 8.018 -0.459 17765 991 1 9 . 1 1 10 10 CYS HA H 10 4.897 4.897 4.815 0.082 17765 992 1 9 . 1 1 10 10 CYS H H 10 8.554 8.554 7.653 0.901 17765 993 1 9 . 1 1 11 11 SER HA H 11 4.441 4.441 4.940 -0.499 17765 994 1 9 . 1 1 11 11 SER H H 11 8.488 8.488 8.672 -0.184 17765 995 1 9 . 1 1 12 12 ILE HA H 12 4.126 4.126 4.174 -0.048 17765 996 1 9 . 1 1 12 12 ILE H H 12 7.392 7.392 7.818 -0.426 17765 997 1 9 . 1 1 13 13 ASP HA H 13 4.361 4.361 4.630 -0.269 17765 998 1 9 . 1 1 13 13 ASP H H 13 8.694 8.694 8.617 0.077 17765 999 1 9 . 1 1 14 14 ASP HA H 14 4.373 4.373 4.212 0.161 17765 1000 1 9 . 1 1 14 14 ASP H H 14 8.640 8.640 8.054 0.586 17765 1001 1 9 . 1 1 15 15 TYR HA H 15 4.639 4.639 5.179 -0.540 17765 1002 1 9 . 1 1 15 15 TYR H H 15 7.970 7.970 7.760 0.210 17765 1003 1 9 . 1 1 16 16 LYS HA H 16 4.794 4.794 5.273 -0.479 17765 1004 1 9 . 1 1 16 16 LYS H H 16 8.655 8.655 8.896 -0.241 17765 1005 1 9 . 1 1 17 17 PRO HA H 17 5.205 5.205 4.727 0.478 17765 1006 1 9 . 1 1 18 18 TYR HA H 18 4.653 4.653 5.297 -0.644 17765 1007 1 9 . 1 1 18 18 TYR H H 18 9.475 9.475 9.161 0.314 17765 1008 1 9 . 1 1 19 19 CYS HA H 19 5.358 5.358 5.002 0.356 17765 1009 1 9 . 1 1 19 19 CYS H H 19 9.004 9.004 9.292 -0.288 17765 1010 1 9 . 1 1 20 20 CYS HA H 20 5.597 5.597 4.705 0.892 17765 1011 1 9 . 1 1 20 20 CYS H H 20 9.838 9.838 9.232 0.606 17765 1012 1 9 . 1 1 21 21 GLN HA H 21 4.620 4.620 4.406 0.214 17765 1013 1 9 . 1 1 21 21 GLN H H 21 8.900 8.900 8.872 0.028 17765 1014 1 9 . 1 1 22 22 SER HA H 22 4.461 4.461 4.362 0.099 17765 1015 1 9 . 1 1 22 22 SER H H 22 8.529 8.529 8.016 0.513 17765 1016 1 9 . 1 1 23 23 MET HA H 23 4.632 4.632 4.389 0.243 17765 1017 1 9 . 1 1 23 23 MET H H 23 8.566 8.566 8.869 -0.303 17765 1018 1 9 . 1 1 24 24 SER HA H 24 4.254 4.254 4.566 -0.312 17765 1019 1 9 . 1 1 24 24 SER H H 24 8.534 8.534 7.758 0.776 17765 1020 1 9 . 1 1 25 25 GLY H H 25 8.729 8.729 8.388 0.341 17765 1021 1 9 . 1 1 26 26 SER HA H 26 4.575 4.575 4.694 -0.119 17765 1022 1 9 . 1 1 26 26 SER H H 26 7.873 7.873 7.881 -0.008 17765 1023 1 9 . 1 1 27 27 ALA HA H 27 4.487 4.487 4.261 0.226 17765 1024 1 9 . 1 1 27 27 ALA H H 27 8.435 8.435 8.578 -0.143 17765 1025 1 9 . 1 1 28 28 SER HA H 28 4.650 4.650 4.602 0.048 17765 1026 1 9 . 1 1 28 28 SER H H 28 8.134 8.134 7.948 0.186 17765 1027 1 9 . 1 1 29 29 LEU HA H 29 4.635 4.635 4.570 0.065 17765 1028 1 9 . 1 1 29 29 LEU H H 29 8.763 8.763 8.162 0.601 17765 1029 1 9 . 1 1 30 30 GLY H H 30 8.580 8.580 8.373 0.207 17765 1030 1 9 . 1 1 31 31 CYS HA H 31 5.662 5.662 5.415 0.247 17765 1031 1 9 . 1 1 31 31 CYS H H 31 8.786 8.786 8.636 0.150 17765 1032 1 9 . 1 1 32 32 VAL HA H 32 4.724 4.724 4.769 -0.045 17765 1033 1 9 . 1 1 32 32 VAL H H 32 8.361 8.361 8.332 0.029 17765 1034 1 9 . 1 1 33 33 VAL HA H 33 3.370 3.370 3.603 -0.233 17765 1035 1 9 . 1 1 33 33 VAL H H 33 8.635 8.635 8.497 0.138 17765 1036 1 9 . 1 1 34 34 GLY H H 34 8.088 8.088 8.349 -0.261 17765 1037 1 9 . 1 1 35 35 VAL HA H 35 3.925 3.925 3.990 -0.065 17765 1038 1 9 . 1 1 35 35 VAL H H 35 7.785 7.785 7.695 0.090 17765 1039 1 9 . 1 1 36 36 ILE HA H 36 3.360 3.360 3.860 -0.500 17765 1040 1 9 . 1 1 36 36 ILE H H 36 8.614 8.614 8.512 0.102 17765 1041 1 9 . 1 1 37 37 GLY H H 37 9.037 9.037 8.708 0.329 17765 1042 1 9 . 1 1 38 38 SER HA H 38 4.495 4.495 4.846 -0.351 17765 1043 1 9 . 1 1 38 38 SER H H 38 8.150 8.150 7.808 0.342 17765 1044 1 9 . 1 1 39 39 GLN HA H 39 4.825 4.825 4.938 -0.113 17765 1045 1 9 . 1 1 39 39 GLN H H 39 8.429 8.429 8.420 0.009 17765 1046 1 9 . 1 1 40 40 CYS HA H 40 4.987 4.987 4.731 0.256 17765 1047 1 9 . 1 1 40 40 CYS H H 40 8.974 8.974 8.736 0.238 17765 1048 1 9 . 1 1 41 41 GLY H H 41 9.375 9.375 8.863 0.512 17765 1049 1 9 . 1 1 42 42 ALA HA H 42 4.658 4.658 4.597 0.061 17765 1050 1 9 . 1 1 42 42 ALA H H 42 7.131 7.131 7.236 -0.105 17765 1051 1 9 . 1 1 43 43 SER HA H 43 4.748 4.748 4.369 0.379 17765 1052 1 9 . 1 1 43 43 SER H H 43 8.325 8.325 8.163 0.162 17765 1053 1 9 . 1 1 44 44 VAL HA H 44 4.652 4.652 4.483 0.169 17765 1054 1 9 . 1 1 44 44 VAL H H 44 8.784 8.784 8.590 0.194 17765 1055 1 9 . 1 1 45 45 LYS HA H 45 4.821 4.821 4.667 0.154 17765 1056 1 9 . 1 1 45 45 LYS H H 45 9.015 9.015 9.132 -0.117 17765 1057 1 9 . 1 1 46 46 CYS HA H 46 5.493 5.493 5.290 0.203 17765 1058 1 9 . 1 1 46 46 CYS H H 46 8.943 8.943 8.679 0.264 17765 1059 1 9 . 1 1 47 47 CYS HA H 47 5.677 5.677 5.562 0.115 17765 1060 1 9 . 1 1 47 47 CYS H H 47 9.513 9.513 8.754 0.759 17765 1061 1 9 . 1 1 48 48 LYS HA H 48 4.020 4.020 4.519 -0.499 17765 1062 1 9 . 1 1 48 48 LYS H H 48 8.226 8.226 8.876 -0.650 17765 1063 1 9 . 1 1 49 49 ASP HA H 49 4.570 4.570 4.805 -0.235 17765 1064 1 9 . 1 1 49 49 ASP H H 49 8.375 8.375 8.314 0.061 17765 1065 1 9 . 1 1 50 50 ASP HA H 50 4.719 4.719 4.707 0.012 17765 1066 1 9 . 1 1 50 50 ASP H H 50 8.306 8.306 7.501 0.805 17765 1067 1 9 . 1 1 51 51 VAL HA H 51 4.196 4.196 4.473 -0.277 17765 1068 1 9 . 1 1 51 51 VAL H H 51 7.790 7.790 8.187 -0.397 17765 1069 1 9 . 1 1 52 52 THR HA H 52 4.322 4.322 4.474 -0.152 17765 1070 1 9 . 1 1 52 52 THR H H 52 8.194 8.194 8.506 -0.312 17765 1071 1 9 . 1 1 53 53 ASN HA H 53 4.777 4.777 4.811 -0.034 17765 1072 1 9 . 1 1 53 53 ASN H H 53 8.364 8.364 8.336 0.028 17765 1073 1 9 . 1 1 54 54 THR HA H 54 4.340 4.340 4.547 -0.207 17765 1074 1 9 . 1 1 54 54 THR H H 54 8.201 8.201 7.378 0.823 17765 1075 1 9 . 1 1 55 55 GLY H H 55 8.354 8.354 8.757 -0.403 17765 1076 1 9 . 1 1 56 56 ASN HA H 56 4.729 4.729 4.808 -0.079 17765 1077 1 9 . 1 1 56 56 ASN H H 56 8.397 8.397 7.861 0.536 17765 1078 1 9 . 1 1 57 57 SER HA H 57 4.485 4.485 4.462 0.023 17765 1079 1 9 . 1 1 57 57 SER H H 57 8.205 8.205 8.505 -0.300 17765 1080 1 9 . 1 1 58 58 GLY H H 58 8.144 8.144 8.238 -0.094 17765 1081 1 9 . 1 1 59 59 LEU HA H 59 4.485 4.485 4.427 0.058 17765 1082 1 9 . 1 1 59 59 LEU H H 59 8.460 8.460 8.147 0.313 17765 1083 1 9 . 1 1 60 60 ILE HA H 60 4.794 4.794 4.332 0.462 17765 1084 1 9 . 1 1 60 60 ILE H H 60 8.195 8.195 8.153 0.042 17765 1085 1 9 . 1 1 61 61 ILE HA H 61 4.151 4.151 4.124 0.027 17765 1086 1 9 . 1 1 61 61 ILE H H 61 8.802 8.802 8.748 0.054 17765 1087 1 9 . 1 1 62 62 ASN HA H 62 4.617 4.617 4.715 -0.098 17765 1088 1 9 . 1 1 62 62 ASN H H 62 8.607 8.607 8.673 -0.066 17765 1089 1 9 . 1 1 63 63 ALA HA H 63 3.772 3.772 3.812 -0.040 17765 1090 1 9 . 1 1 63 63 ALA H H 63 8.735 8.735 8.484 0.251 17765 1091 1 9 . 1 1 64 64 ALA HA H 64 4.211 4.211 4.052 0.159 17765 1092 1 9 . 1 1 64 64 ALA H H 64 8.354 8.354 8.044 0.310 17765 1093 1 9 . 1 1 65 65 ASN HA H 65 4.849 4.849 4.751 0.098 17765 1094 1 9 . 1 1 65 65 ASN H H 65 8.151 8.151 8.068 0.083 17765 1095 1 9 . 1 1 66 66 CYS HA H 66 5.624 5.624 5.456 0.168 17765 1096 1 9 . 1 1 66 66 CYS H H 66 7.698 7.698 7.599 0.099 17765 1097 1 9 . 1 1 67 67 VAL HA H 67 4.248 4.248 4.111 0.137 17765 1098 1 9 . 1 1 67 67 VAL H H 67 8.742 8.742 8.379 0.363 17765 1099 1 10 . 1 1 2 2 ALA HA H 2 4.562 4.562 4.525 0.037 17765 1100 1 10 . 1 1 2 2 ALA H H 2 8.617 8.617 8.213 0.404 17765 1101 1 10 . 1 1 3 3 THR HA H 3 4.394 4.394 4.320 0.074 17765 1102 1 10 . 1 1 3 3 THR H H 3 8.142 8.142 8.126 0.016 17765 1103 1 10 . 1 1 4 4 THR HA H 4 4.615 4.615 4.343 0.272 17765 1104 1 10 . 1 1 4 4 THR H H 4 8.659 8.659 8.669 -0.010 17765 1105 1 10 . 1 1 5 5 ILE HA H 5 3.832 3.832 4.226 -0.394 17765 1106 1 10 . 1 1 5 5 ILE H H 5 8.634 8.634 8.556 0.078 17765 1107 1 10 . 1 1 6 6 GLY H H 6 8.828 8.828 8.302 0.526 17765 1108 1 10 . 1 1 7 7 PRO HA H 7 4.254 4.254 4.231 0.023 17765 1109 1 10 . 1 1 8 8 ASN HA H 8 4.846 4.846 4.641 0.205 17765 1110 1 10 . 1 1 8 8 ASN H H 8 8.536 8.536 8.472 0.064 17765 1111 1 10 . 1 1 9 9 THR HA H 9 3.758 3.758 4.241 -0.483 17765 1112 1 10 . 1 1 9 9 THR H H 9 7.559 7.559 7.586 -0.027 17765 1113 1 10 . 1 1 10 10 CYS HA H 10 4.897 4.897 4.679 0.218 17765 1114 1 10 . 1 1 10 10 CYS H H 10 8.554 8.554 8.321 0.233 17765 1115 1 10 . 1 1 11 11 SER HA H 11 4.441 4.441 4.593 -0.152 17765 1116 1 10 . 1 1 11 11 SER H H 11 8.488 8.488 8.754 -0.266 17765 1117 1 10 . 1 1 12 12 ILE HA H 12 4.126 4.126 4.355 -0.229 17765 1118 1 10 . 1 1 12 12 ILE H H 12 7.392 7.392 7.791 -0.399 17765 1119 1 10 . 1 1 13 13 ASP HA H 13 4.361 4.361 4.478 -0.117 17765 1120 1 10 . 1 1 13 13 ASP H H 13 8.694 8.694 8.087 0.607 17765 1121 1 10 . 1 1 14 14 ASP HA H 14 4.373 4.373 4.128 0.245 17765 1122 1 10 . 1 1 14 14 ASP H H 14 8.640 8.640 7.842 0.798 17765 1123 1 10 . 1 1 15 15 TYR HA H 15 4.639 4.639 4.895 -0.256 17765 1124 1 10 . 1 1 15 15 TYR H H 15 7.970 7.970 7.622 0.348 17765 1125 1 10 . 1 1 16 16 LYS HA H 16 4.794 4.794 4.858 -0.064 17765 1126 1 10 . 1 1 16 16 LYS H H 16 8.655 8.655 9.006 -0.351 17765 1127 1 10 . 1 1 17 17 PRO HA H 17 5.205 5.205 4.323 0.882 17765 1128 1 10 . 1 1 18 18 TYR HA H 18 4.653 4.653 5.162 -0.509 17765 1129 1 10 . 1 1 18 18 TYR H H 18 9.475 9.475 8.584 0.891 17765 1130 1 10 . 1 1 19 19 CYS HA H 19 5.358 5.358 5.444 -0.086 17765 1131 1 10 . 1 1 19 19 CYS H H 19 9.004 9.004 9.063 -0.059 17765 1132 1 10 . 1 1 20 20 CYS HA H 20 5.597 5.597 4.683 0.914 17765 1133 1 10 . 1 1 20 20 CYS H H 20 9.838 9.838 8.433 1.405 17765 1134 1 10 . 1 1 21 21 GLN HA H 21 4.620 4.620 4.351 0.269 17765 1135 1 10 . 1 1 21 21 GLN H H 21 8.900 8.900 8.448 0.452 17765 1136 1 10 . 1 1 22 22 SER HA H 22 4.461 4.461 4.009 0.452 17765 1137 1 10 . 1 1 22 22 SER H H 22 8.529 8.529 8.663 -0.134 17765 1138 1 10 . 1 1 23 23 MET HA H 23 4.632 4.632 4.611 0.021 17765 1139 1 10 . 1 1 23 23 MET H H 23 8.566 8.566 8.134 0.432 17765 1140 1 10 . 1 1 24 24 SER HA H 24 4.254 4.254 4.434 -0.180 17765 1141 1 10 . 1 1 24 24 SER H H 24 8.534 8.534 8.620 -0.086 17765 1142 1 10 . 1 1 25 25 GLY H H 25 8.729 8.729 8.341 0.388 17765 1143 1 10 . 1 1 26 26 SER HA H 26 4.575 4.575 4.627 -0.052 17765 1144 1 10 . 1 1 26 26 SER H H 26 7.873 7.873 7.671 0.202 17765 1145 1 10 . 1 1 27 27 ALA HA H 27 4.487 4.487 4.337 0.150 17765 1146 1 10 . 1 1 27 27 ALA H H 27 8.435 8.435 8.269 0.166 17765 1147 1 10 . 1 1 28 28 SER HA H 28 4.650 4.650 4.939 -0.289 17765 1148 1 10 . 1 1 28 28 SER H H 28 8.134 8.134 7.743 0.391 17765 1149 1 10 . 1 1 29 29 LEU HA H 29 4.635 4.635 4.698 -0.063 17765 1150 1 10 . 1 1 29 29 LEU H H 29 8.763 8.763 8.928 -0.165 17765 1151 1 10 . 1 1 30 30 GLY H H 30 8.580 8.580 8.629 -0.049 17765 1152 1 10 . 1 1 31 31 CYS HA H 31 5.662 5.662 4.830 0.832 17765 1153 1 10 . 1 1 31 31 CYS H H 31 8.786 8.786 8.181 0.605 17765 1154 1 10 . 1 1 32 32 VAL HA H 32 4.724 4.724 4.482 0.242 17765 1155 1 10 . 1 1 32 32 VAL H H 32 8.361 8.361 8.631 -0.270 17765 1156 1 10 . 1 1 33 33 VAL HA H 33 3.370 3.370 3.909 -0.539 17765 1157 1 10 . 1 1 33 33 VAL H H 33 8.635 8.635 8.171 0.464 17765 1158 1 10 . 1 1 34 34 GLY H H 34 8.088 8.088 8.203 -0.115 17765 1159 1 10 . 1 1 35 35 VAL HA H 35 3.925 3.925 4.104 -0.179 17765 1160 1 10 . 1 1 35 35 VAL H H 35 7.785 7.785 7.671 0.114 17765 1161 1 10 . 1 1 36 36 ILE HA H 36 3.360 3.360 3.905 -0.545 17765 1162 1 10 . 1 1 36 36 ILE H H 36 8.614 8.614 8.566 0.048 17765 1163 1 10 . 1 1 37 37 GLY H H 37 9.037 9.037 8.381 0.656 17765 1164 1 10 . 1 1 38 38 SER HA H 38 4.495 4.495 4.399 0.096 17765 1165 1 10 . 1 1 38 38 SER H H 38 8.150 8.150 8.161 -0.011 17765 1166 1 10 . 1 1 39 39 GLN HA H 39 4.825 4.825 4.856 -0.031 17765 1167 1 10 . 1 1 39 39 GLN H H 39 8.429 8.429 8.578 -0.149 17765 1168 1 10 . 1 1 40 40 CYS HA H 40 4.987 4.987 4.478 0.509 17765 1169 1 10 . 1 1 40 40 CYS H H 40 8.974 8.974 8.754 0.220 17765 1170 1 10 . 1 1 41 41 GLY H H 41 9.375 9.375 8.608 0.767 17765 1171 1 10 . 1 1 42 42 ALA HA H 42 4.658 4.658 4.445 0.213 17765 1172 1 10 . 1 1 42 42 ALA H H 42 7.131 7.131 8.018 -0.887 17765 1173 1 10 . 1 1 43 43 SER HA H 43 4.748 4.748 4.609 0.139 17765 1174 1 10 . 1 1 43 43 SER H H 43 8.325 8.325 8.293 0.032 17765 1175 1 10 . 1 1 44 44 VAL HA H 44 4.652 4.652 4.267 0.385 17765 1176 1 10 . 1 1 44 44 VAL H H 44 8.784 8.784 8.504 0.280 17765 1177 1 10 . 1 1 45 45 LYS HA H 45 4.821 4.821 4.668 0.153 17765 1178 1 10 . 1 1 45 45 LYS H H 45 9.015 9.015 9.222 -0.207 17765 1179 1 10 . 1 1 46 46 CYS HA H 46 5.493 5.493 5.351 0.142 17765 1180 1 10 . 1 1 46 46 CYS H H 46 8.943 8.943 8.783 0.160 17765 1181 1 10 . 1 1 47 47 CYS HA H 47 5.677 5.677 5.396 0.281 17765 1182 1 10 . 1 1 47 47 CYS H H 47 9.513 9.513 8.695 0.818 17765 1183 1 10 . 1 1 48 48 LYS HA H 48 4.020 4.020 5.086 -1.066 17765 1184 1 10 . 1 1 48 48 LYS H H 48 8.226 8.226 8.626 -0.400 17765 1185 1 10 . 1 1 49 49 ASP HA H 49 4.570 4.570 4.281 0.289 17765 1186 1 10 . 1 1 49 49 ASP H H 49 8.375 8.375 8.957 -0.582 17765 1187 1 10 . 1 1 50 50 ASP HA H 50 4.719 4.719 4.683 0.036 17765 1188 1 10 . 1 1 50 50 ASP H H 50 8.306 8.306 8.322 -0.016 17765 1189 1 10 . 1 1 51 51 VAL HA H 51 4.196 4.196 4.086 0.110 17765 1190 1 10 . 1 1 51 51 VAL H H 51 7.790 7.790 8.558 -0.768 17765 1191 1 10 . 1 1 52 52 THR HA H 52 4.322 4.322 4.233 0.089 17765 1192 1 10 . 1 1 52 52 THR H H 52 8.194 8.194 8.493 -0.299 17765 1193 1 10 . 1 1 53 53 ASN HA H 53 4.777 4.777 4.688 0.089 17765 1194 1 10 . 1 1 53 53 ASN H H 53 8.364 8.364 8.054 0.310 17765 1195 1 10 . 1 1 54 54 THR HA H 54 4.340 4.340 4.345 -0.005 17765 1196 1 10 . 1 1 54 54 THR H H 54 8.201 8.201 8.635 -0.434 17765 1197 1 10 . 1 1 55 55 GLY H H 55 8.354 8.354 8.332 0.022 17765 1198 1 10 . 1 1 56 56 ASN HA H 56 4.729 4.729 4.726 0.003 17765 1199 1 10 . 1 1 56 56 ASN H H 56 8.397 8.397 7.566 0.831 17765 1200 1 10 . 1 1 57 57 SER HA H 57 4.485 4.485 4.457 0.028 17765 1201 1 10 . 1 1 57 57 SER H H 57 8.205 8.205 8.488 -0.283 17765 1202 1 10 . 1 1 58 58 GLY H H 58 8.144 8.144 7.860 0.284 17765 1203 1 10 . 1 1 59 59 LEU HA H 59 4.485 4.485 4.759 -0.274 17765 1204 1 10 . 1 1 59 59 LEU H H 59 8.460 8.460 8.807 -0.347 17765 1205 1 10 . 1 1 60 60 ILE HA H 60 4.794 4.794 4.311 0.483 17765 1206 1 10 . 1 1 60 60 ILE H H 60 8.195 8.195 8.496 -0.301 17765 1207 1 10 . 1 1 61 61 ILE HA H 61 4.151 4.151 4.054 0.097 17765 1208 1 10 . 1 1 61 61 ILE H H 61 8.802 8.802 7.788 1.014 17765 1209 1 10 . 1 1 62 62 ASN HA H 62 4.617 4.617 5.217 -0.600 17765 1210 1 10 . 1 1 62 62 ASN H H 62 8.607 8.607 8.364 0.243 17765 1211 1 10 . 1 1 63 63 ALA HA H 63 3.772 3.772 4.170 -0.398 17765 1212 1 10 . 1 1 63 63 ALA H H 63 8.735 8.735 8.073 0.662 17765 1213 1 10 . 1 1 64 64 ALA HA H 64 4.211 4.211 4.324 -0.113 17765 1214 1 10 . 1 1 64 64 ALA H H 64 8.354 8.354 7.956 0.398 17765 1215 1 10 . 1 1 65 65 ASN HA H 65 4.849 4.849 4.831 0.018 17765 1216 1 10 . 1 1 65 65 ASN H H 65 8.151 8.151 8.618 -0.467 17765 1217 1 10 . 1 1 66 66 CYS HA H 66 5.624 5.624 4.905 0.719 17765 1218 1 10 . 1 1 66 66 CYS H H 66 7.698 7.698 7.753 -0.055 17765 1219 1 10 . 1 1 67 67 VAL HA H 67 4.248 4.248 3.700 0.548 17765 1220 1 10 . 1 1 67 67 VAL H H 67 8.742 8.742 8.071 0.671 17765 1221 1 11 . 1 1 2 2 ALA HA H 2 4.562 4.562 4.870 -0.308 17765 1222 1 11 . 1 1 2 2 ALA H H 2 8.617 8.617 7.932 0.685 17765 1223 1 11 . 1 1 3 3 THR HA H 3 4.394 4.394 4.679 -0.285 17765 1224 1 11 . 1 1 3 3 THR H H 3 8.142 8.142 8.506 -0.364 17765 1225 1 11 . 1 1 4 4 THR HA H 4 4.615 4.615 4.734 -0.119 17765 1226 1 11 . 1 1 4 4 THR H H 4 8.659 8.659 8.484 0.175 17765 1227 1 11 . 1 1 5 5 ILE HA H 5 3.832 3.832 4.648 -0.816 17765 1228 1 11 . 1 1 5 5 ILE H H 5 8.634 8.634 8.876 -0.242 17765 1229 1 11 . 1 1 6 6 GLY H H 6 8.828 8.828 7.752 1.076 17765 1230 1 11 . 1 1 7 7 PRO HA H 7 4.254 4.254 4.412 -0.158 17765 1231 1 11 . 1 1 8 8 ASN HA H 8 4.846 4.846 4.843 0.003 17765 1232 1 11 . 1 1 8 8 ASN H H 8 8.536 8.536 8.359 0.177 17765 1233 1 11 . 1 1 9 9 THR HA H 9 3.758 3.758 4.138 -0.380 17765 1234 1 11 . 1 1 9 9 THR H H 9 7.559 7.559 7.607 -0.048 17765 1235 1 11 . 1 1 10 10 CYS HA H 10 4.897 4.897 4.766 0.131 17765 1236 1 11 . 1 1 10 10 CYS H H 10 8.554 8.554 7.968 0.586 17765 1237 1 11 . 1 1 11 11 SER HA H 11 4.441 4.441 4.838 -0.397 17765 1238 1 11 . 1 1 11 11 SER H H 11 8.488 8.488 8.695 -0.207 17765 1239 1 11 . 1 1 12 12 ILE HA H 12 4.126 4.126 4.361 -0.235 17765 1240 1 11 . 1 1 12 12 ILE H H 12 7.392 7.392 7.865 -0.473 17765 1241 1 11 . 1 1 13 13 ASP HA H 13 4.361 4.361 4.596 -0.235 17765 1242 1 11 . 1 1 13 13 ASP H H 13 8.694 8.694 8.390 0.304 17765 1243 1 11 . 1 1 14 14 ASP HA H 14 4.373 4.373 4.157 0.216 17765 1244 1 11 . 1 1 14 14 ASP H H 14 8.640 8.640 7.948 0.692 17765 1245 1 11 . 1 1 15 15 TYR HA H 15 4.639 4.639 4.824 -0.185 17765 1246 1 11 . 1 1 15 15 TYR H H 15 7.970 7.970 7.805 0.165 17765 1247 1 11 . 1 1 16 16 LYS HA H 16 4.794 4.794 4.890 -0.096 17765 1248 1 11 . 1 1 16 16 LYS H H 16 8.655 8.655 8.237 0.418 17765 1249 1 11 . 1 1 17 17 PRO HA H 17 5.205 5.205 4.565 0.640 17765 1250 1 11 . 1 1 18 18 TYR HA H 18 4.653 4.653 5.227 -0.574 17765 1251 1 11 . 1 1 18 18 TYR H H 18 9.475 9.475 8.857 0.618 17765 1252 1 11 . 1 1 19 19 CYS HA H 19 5.358 5.358 4.832 0.526 17765 1253 1 11 . 1 1 19 19 CYS H H 19 9.004 9.004 9.398 -0.394 17765 1254 1 11 . 1 1 20 20 CYS HA H 20 5.597 5.597 4.793 0.804 17765 1255 1 11 . 1 1 20 20 CYS H H 20 9.838 9.838 9.249 0.589 17765 1256 1 11 . 1 1 21 21 GLN HA H 21 4.620 4.620 4.413 0.207 17765 1257 1 11 . 1 1 21 21 GLN H H 21 8.900 8.900 8.774 0.126 17765 1258 1 11 . 1 1 22 22 SER HA H 22 4.461 4.461 4.022 0.439 17765 1259 1 11 . 1 1 22 22 SER H H 22 8.529 8.529 7.703 0.826 17765 1260 1 11 . 1 1 23 23 MET HA H 23 4.632 4.632 4.801 -0.169 17765 1261 1 11 . 1 1 23 23 MET H H 23 8.566 8.566 8.017 0.549 17765 1262 1 11 . 1 1 24 24 SER HA H 24 4.254 4.254 4.331 -0.077 17765 1263 1 11 . 1 1 24 24 SER H H 24 8.534 8.534 8.398 0.136 17765 1264 1 11 . 1 1 25 25 GLY H H 25 8.729 8.729 8.118 0.611 17765 1265 1 11 . 1 1 26 26 SER HA H 26 4.575 4.575 4.702 -0.127 17765 1266 1 11 . 1 1 26 26 SER H H 26 7.873 7.873 8.158 -0.285 17765 1267 1 11 . 1 1 27 27 ALA HA H 27 4.487 4.487 4.368 0.119 17765 1268 1 11 . 1 1 27 27 ALA H H 27 8.435 8.435 8.428 0.007 17765 1269 1 11 . 1 1 28 28 SER HA H 28 4.650 4.650 4.659 -0.009 17765 1270 1 11 . 1 1 28 28 SER H H 28 8.134 8.134 7.982 0.152 17765 1271 1 11 . 1 1 29 29 LEU HA H 29 4.635 4.635 4.508 0.127 17765 1272 1 11 . 1 1 29 29 LEU H H 29 8.763 8.763 8.073 0.690 17765 1273 1 11 . 1 1 30 30 GLY H H 30 8.580 8.580 8.432 0.148 17765 1274 1 11 . 1 1 31 31 CYS HA H 31 5.662 5.662 5.004 0.658 17765 1275 1 11 . 1 1 31 31 CYS H H 31 8.786 8.786 8.527 0.259 17765 1276 1 11 . 1 1 32 32 VAL HA H 32 4.724 4.724 4.584 0.140 17765 1277 1 11 . 1 1 32 32 VAL H H 32 8.361 8.361 8.880 -0.519 17765 1278 1 11 . 1 1 33 33 VAL HA H 33 3.370 3.370 3.905 -0.535 17765 1279 1 11 . 1 1 33 33 VAL H H 33 8.635 8.635 8.469 0.166 17765 1280 1 11 . 1 1 34 34 GLY H H 34 8.088 8.088 8.349 -0.261 17765 1281 1 11 . 1 1 35 35 VAL HA H 35 3.925 3.925 4.044 -0.119 17765 1282 1 11 . 1 1 35 35 VAL H H 35 7.785 7.785 8.381 -0.596 17765 1283 1 11 . 1 1 36 36 ILE HA H 36 3.360 3.360 3.785 -0.425 17765 1284 1 11 . 1 1 36 36 ILE H H 36 8.614 8.614 8.617 -0.003 17765 1285 1 11 . 1 1 37 37 GLY H H 37 9.037 9.037 9.073 -0.036 17765 1286 1 11 . 1 1 38 38 SER HA H 38 4.495 4.495 4.635 -0.140 17765 1287 1 11 . 1 1 38 38 SER H H 38 8.150 8.150 7.825 0.325 17765 1288 1 11 . 1 1 39 39 GLN HA H 39 4.825 4.825 4.992 -0.167 17765 1289 1 11 . 1 1 39 39 GLN H H 39 8.429 8.429 8.464 -0.035 17765 1290 1 11 . 1 1 40 40 CYS HA H 40 4.987 4.987 4.592 0.395 17765 1291 1 11 . 1 1 40 40 CYS H H 40 8.974 8.974 8.485 0.489 17765 1292 1 11 . 1 1 41 41 GLY H H 41 9.375 9.375 8.928 0.447 17765 1293 1 11 . 1 1 42 42 ALA HA H 42 4.658 4.658 4.605 0.053 17765 1294 1 11 . 1 1 42 42 ALA H H 42 7.131 7.131 7.592 -0.461 17765 1295 1 11 . 1 1 43 43 SER HA H 43 4.748 4.748 4.583 0.165 17765 1296 1 11 . 1 1 43 43 SER H H 43 8.325 8.325 8.249 0.076 17765 1297 1 11 . 1 1 44 44 VAL HA H 44 4.652 4.652 4.537 0.115 17765 1298 1 11 . 1 1 44 44 VAL H H 44 8.784 8.784 7.897 0.887 17765 1299 1 11 . 1 1 45 45 LYS HA H 45 4.821 4.821 4.777 0.044 17765 1300 1 11 . 1 1 45 45 LYS H H 45 9.015 9.015 9.196 -0.181 17765 1301 1 11 . 1 1 46 46 CYS HA H 46 5.493 5.493 5.260 0.233 17765 1302 1 11 . 1 1 46 46 CYS H H 46 8.943 8.943 8.511 0.432 17765 1303 1 11 . 1 1 47 47 CYS HA H 47 5.677 5.677 5.343 0.334 17765 1304 1 11 . 1 1 47 47 CYS H H 47 9.513 9.513 8.902 0.611 17765 1305 1 11 . 1 1 48 48 LYS HA H 48 4.020 4.020 4.449 -0.429 17765 1306 1 11 . 1 1 48 48 LYS H H 48 8.226 8.226 8.822 -0.596 17765 1307 1 11 . 1 1 49 49 ASP HA H 49 4.570 4.570 4.767 -0.197 17765 1308 1 11 . 1 1 49 49 ASP H H 49 8.375 8.375 8.281 0.094 17765 1309 1 11 . 1 1 50 50 ASP HA H 50 4.719 4.719 4.642 0.077 17765 1310 1 11 . 1 1 50 50 ASP H H 50 8.306 8.306 8.420 -0.114 17765 1311 1 11 . 1 1 51 51 VAL HA H 51 4.196 4.196 4.101 0.095 17765 1312 1 11 . 1 1 51 51 VAL H H 51 7.790 7.790 8.318 -0.528 17765 1313 1 11 . 1 1 52 52 THR HA H 52 4.322 4.322 4.519 -0.197 17765 1314 1 11 . 1 1 52 52 THR H H 52 8.194 8.194 8.575 -0.381 17765 1315 1 11 . 1 1 53 53 ASN HA H 53 4.777 4.777 4.946 -0.169 17765 1316 1 11 . 1 1 53 53 ASN H H 53 8.364 8.364 7.758 0.606 17765 1317 1 11 . 1 1 54 54 THR HA H 54 4.340 4.340 4.649 -0.309 17765 1318 1 11 . 1 1 54 54 THR H H 54 8.201 8.201 8.343 -0.142 17765 1319 1 11 . 1 1 55 55 GLY H H 55 8.354 8.354 8.498 -0.144 17765 1320 1 11 . 1 1 56 56 ASN HA H 56 4.729 4.729 5.055 -0.326 17765 1321 1 11 . 1 1 56 56 ASN H H 56 8.397 8.397 7.822 0.575 17765 1322 1 11 . 1 1 57 57 SER HA H 57 4.485 4.485 4.482 0.003 17765 1323 1 11 . 1 1 57 57 SER H H 57 8.205 8.205 8.422 -0.217 17765 1324 1 11 . 1 1 58 58 GLY H H 58 8.144 8.144 7.462 0.682 17765 1325 1 11 . 1 1 59 59 LEU HA H 59 4.485 4.485 4.624 -0.139 17765 1326 1 11 . 1 1 59 59 LEU H H 59 8.460 8.460 8.685 -0.225 17765 1327 1 11 . 1 1 60 60 ILE HA H 60 4.794 4.794 4.236 0.558 17765 1328 1 11 . 1 1 60 60 ILE H H 60 8.195 8.195 8.511 -0.316 17765 1329 1 11 . 1 1 61 61 ILE HA H 61 4.151 4.151 4.066 0.085 17765 1330 1 11 . 1 1 61 61 ILE H H 61 8.802 8.802 8.748 0.054 17765 1331 1 11 . 1 1 62 62 ASN HA H 62 4.617 4.617 4.660 -0.043 17765 1332 1 11 . 1 1 62 62 ASN H H 62 8.607 8.607 8.862 -0.255 17765 1333 1 11 . 1 1 63 63 ALA HA H 63 3.772 3.772 3.787 -0.015 17765 1334 1 11 . 1 1 63 63 ALA H H 63 8.735 8.735 8.058 0.677 17765 1335 1 11 . 1 1 64 64 ALA HA H 64 4.211 4.211 4.189 0.022 17765 1336 1 11 . 1 1 64 64 ALA H H 64 8.354 8.354 8.126 0.228 17765 1337 1 11 . 1 1 65 65 ASN HA H 65 4.849 4.849 4.898 -0.049 17765 1338 1 11 . 1 1 65 65 ASN H H 65 8.151 8.151 8.316 -0.165 17765 1339 1 11 . 1 1 66 66 CYS HA H 66 5.624 5.624 5.280 0.344 17765 1340 1 11 . 1 1 66 66 CYS H H 66 7.698 7.698 7.814 -0.116 17765 1341 1 11 . 1 1 67 67 VAL HA H 67 4.248 4.248 4.240 0.008 17765 1342 1 11 . 1 1 67 67 VAL H H 67 8.742 8.742 8.869 -0.127 17765 1343 1 12 . 1 1 2 2 ALA HA H 2 4.562 4.562 4.894 -0.332 17765 1344 1 12 . 1 1 2 2 ALA H H 2 8.617 8.617 8.053 0.564 17765 1345 1 12 . 1 1 3 3 THR HA H 3 4.394 4.394 4.217 0.177 17765 1346 1 12 . 1 1 3 3 THR H H 3 8.142 8.142 8.084 0.058 17765 1347 1 12 . 1 1 4 4 THR HA H 4 4.615 4.615 4.667 -0.052 17765 1348 1 12 . 1 1 4 4 THR H H 4 8.659 8.659 8.440 0.219 17765 1349 1 12 . 1 1 5 5 ILE HA H 5 3.832 3.832 4.139 -0.307 17765 1350 1 12 . 1 1 5 5 ILE H H 5 8.634 8.634 8.721 -0.087 17765 1351 1 12 . 1 1 6 6 GLY H H 6 8.828 8.828 8.284 0.544 17765 1352 1 12 . 1 1 7 7 PRO HA H 7 4.254 4.254 4.382 -0.128 17765 1353 1 12 . 1 1 8 8 ASN HA H 8 4.846 4.846 4.620 0.226 17765 1354 1 12 . 1 1 8 8 ASN H H 8 8.536 8.536 8.307 0.229 17765 1355 1 12 . 1 1 9 9 THR HA H 9 3.758 3.758 4.188 -0.430 17765 1356 1 12 . 1 1 9 9 THR H H 9 7.559 7.559 7.775 -0.216 17765 1357 1 12 . 1 1 10 10 CYS HA H 10 4.897 4.897 4.675 0.222 17765 1358 1 12 . 1 1 10 10 CYS H H 10 8.554 8.554 8.385 0.169 17765 1359 1 12 . 1 1 11 11 SER HA H 11 4.441 4.441 4.775 -0.334 17765 1360 1 12 . 1 1 11 11 SER H H 11 8.488 8.488 8.899 -0.411 17765 1361 1 12 . 1 1 12 12 ILE HA H 12 4.126 4.126 4.510 -0.384 17765 1362 1 12 . 1 1 12 12 ILE H H 12 7.392 7.392 7.787 -0.395 17765 1363 1 12 . 1 1 13 13 ASP HA H 13 4.361 4.361 4.593 -0.232 17765 1364 1 12 . 1 1 13 13 ASP H H 13 8.694 8.694 8.587 0.107 17765 1365 1 12 . 1 1 14 14 ASP HA H 14 4.373 4.373 4.188 0.185 17765 1366 1 12 . 1 1 14 14 ASP H H 14 8.640 8.640 8.246 0.394 17765 1367 1 12 . 1 1 15 15 TYR HA H 15 4.639 4.639 4.661 -0.022 17765 1368 1 12 . 1 1 15 15 TYR H H 15 7.970 7.970 7.992 -0.022 17765 1369 1 12 . 1 1 16 16 LYS HA H 16 4.794 4.794 4.882 -0.088 17765 1370 1 12 . 1 1 16 16 LYS H H 16 8.655 8.655 9.101 -0.446 17765 1371 1 12 . 1 1 17 17 PRO HA H 17 5.205 5.205 4.409 0.796 17765 1372 1 12 . 1 1 18 18 TYR HA H 18 4.653 4.653 5.193 -0.540 17765 1373 1 12 . 1 1 18 18 TYR H H 18 9.475 9.475 8.533 0.942 17765 1374 1 12 . 1 1 19 19 CYS HA H 19 5.358 5.358 5.264 0.094 17765 1375 1 12 . 1 1 19 19 CYS H H 19 9.004 9.004 9.212 -0.208 17765 1376 1 12 . 1 1 20 20 CYS HA H 20 5.597 5.597 4.539 1.058 17765 1377 1 12 . 1 1 20 20 CYS H H 20 9.838 9.838 8.857 0.981 17765 1378 1 12 . 1 1 21 21 GLN HA H 21 4.620 4.620 4.620 -0.001 17765 1379 1 12 . 1 1 21 21 GLN H H 21 8.900 8.900 8.777 0.123 17765 1380 1 12 . 1 1 22 22 SER HA H 22 4.461 4.461 4.677 -0.216 17765 1381 1 12 . 1 1 22 22 SER H H 22 8.529 8.529 8.751 -0.222 17765 1382 1 12 . 1 1 23 23 MET HA H 23 4.632 4.632 4.358 0.274 17765 1383 1 12 . 1 1 23 23 MET H H 23 8.566 8.566 8.758 -0.192 17765 1384 1 12 . 1 1 24 24 SER HA H 24 4.254 4.254 4.533 -0.279 17765 1385 1 12 . 1 1 24 24 SER H H 24 8.534 8.534 7.890 0.644 17765 1386 1 12 . 1 1 25 25 GLY H H 25 8.729 8.729 8.418 0.311 17765 1387 1 12 . 1 1 26 26 SER HA H 26 4.575 4.575 4.623 -0.048 17765 1388 1 12 . 1 1 26 26 SER H H 26 7.873 7.873 7.671 0.202 17765 1389 1 12 . 1 1 27 27 ALA HA H 27 4.487 4.487 4.398 0.089 17765 1390 1 12 . 1 1 27 27 ALA H H 27 8.435 8.435 8.421 0.014 17765 1391 1 12 . 1 1 28 28 SER HA H 28 4.650 4.650 4.424 0.226 17765 1392 1 12 . 1 1 28 28 SER H H 28 8.134 8.134 7.820 0.314 17765 1393 1 12 . 1 1 29 29 LEU HA H 29 4.635 4.635 4.632 0.003 17765 1394 1 12 . 1 1 29 29 LEU H H 29 8.763 8.763 7.957 0.806 17765 1395 1 12 . 1 1 30 30 GLY H H 30 8.580 8.580 8.311 0.269 17765 1396 1 12 . 1 1 31 31 CYS HA H 31 5.662 5.662 4.643 1.019 17765 1397 1 12 . 1 1 31 31 CYS H H 31 8.786 8.786 8.191 0.595 17765 1398 1 12 . 1 1 32 32 VAL HA H 32 4.724 4.724 4.369 0.355 17765 1399 1 12 . 1 1 32 32 VAL H H 32 8.361 8.361 7.685 0.676 17765 1400 1 12 . 1 1 33 33 VAL HA H 33 3.370 3.370 4.136 -0.766 17765 1401 1 12 . 1 1 33 33 VAL H H 33 8.635 8.635 8.659 -0.024 17765 1402 1 12 . 1 1 34 34 GLY H H 34 8.088 8.088 8.564 -0.476 17765 1403 1 12 . 1 1 35 35 VAL HA H 35 3.925 3.925 3.989 -0.064 17765 1404 1 12 . 1 1 35 35 VAL H H 35 7.785 7.785 7.923 -0.138 17765 1405 1 12 . 1 1 36 36 ILE HA H 36 3.360 3.360 4.124 -0.764 17765 1406 1 12 . 1 1 36 36 ILE H H 36 8.614 8.614 8.552 0.062 17765 1407 1 12 . 1 1 37 37 GLY H H 37 9.037 9.037 8.629 0.408 17765 1408 1 12 . 1 1 38 38 SER HA H 38 4.495 4.495 4.857 -0.362 17765 1409 1 12 . 1 1 38 38 SER H H 38 8.150 8.150 7.800 0.350 17765 1410 1 12 . 1 1 39 39 GLN HA H 39 4.825 4.825 5.157 -0.332 17765 1411 1 12 . 1 1 39 39 GLN H H 39 8.429 8.429 8.407 0.022 17765 1412 1 12 . 1 1 40 40 CYS HA H 40 4.987 4.987 4.636 0.351 17765 1413 1 12 . 1 1 40 40 CYS H H 40 8.974 8.974 8.613 0.361 17765 1414 1 12 . 1 1 41 41 GLY H H 41 9.375 9.375 8.817 0.558 17765 1415 1 12 . 1 1 42 42 ALA HA H 42 4.658 4.658 4.500 0.158 17765 1416 1 12 . 1 1 42 42 ALA H H 42 7.131 7.131 7.602 -0.471 17765 1417 1 12 . 1 1 43 43 SER HA H 43 4.748 4.748 4.698 0.050 17765 1418 1 12 . 1 1 43 43 SER H H 43 8.325 8.325 8.035 0.290 17765 1419 1 12 . 1 1 44 44 VAL HA H 44 4.652 4.652 3.898 0.754 17765 1420 1 12 . 1 1 44 44 VAL H H 44 8.784 8.784 8.800 -0.016 17765 1421 1 12 . 1 1 45 45 LYS HA H 45 4.821 4.821 4.688 0.133 17765 1422 1 12 . 1 1 45 45 LYS H H 45 9.015 9.015 9.033 -0.018 17765 1423 1 12 . 1 1 46 46 CYS HA H 46 5.493 5.493 4.864 0.629 17765 1424 1 12 . 1 1 46 46 CYS H H 46 8.943 8.943 8.930 0.013 17765 1425 1 12 . 1 1 47 47 CYS HA H 47 5.677 5.677 5.223 0.454 17765 1426 1 12 . 1 1 47 47 CYS H H 47 9.513 9.513 8.555 0.958 17765 1427 1 12 . 1 1 48 48 LYS HA H 48 4.020 4.020 4.451 -0.431 17765 1428 1 12 . 1 1 48 48 LYS H H 48 8.226 8.226 8.622 -0.396 17765 1429 1 12 . 1 1 49 49 ASP HA H 49 4.570 4.570 4.619 -0.049 17765 1430 1 12 . 1 1 49 49 ASP H H 49 8.375 8.375 8.544 -0.169 17765 1431 1 12 . 1 1 50 50 ASP HA H 50 4.719 4.719 4.775 -0.056 17765 1432 1 12 . 1 1 50 50 ASP H H 50 8.306 8.306 8.177 0.129 17765 1433 1 12 . 1 1 51 51 VAL HA H 51 4.196 4.196 4.365 -0.169 17765 1434 1 12 . 1 1 51 51 VAL H H 51 7.790 7.790 7.498 0.292 17765 1435 1 12 . 1 1 52 52 THR HA H 52 4.322 4.322 4.281 0.041 17765 1436 1 12 . 1 1 52 52 THR H H 52 8.194 8.194 8.125 0.069 17765 1437 1 12 . 1 1 53 53 ASN HA H 53 4.777 4.777 4.803 -0.026 17765 1438 1 12 . 1 1 53 53 ASN H H 53 8.364 8.364 8.243 0.121 17765 1439 1 12 . 1 1 54 54 THR HA H 54 4.340 4.340 4.370 -0.030 17765 1440 1 12 . 1 1 54 54 THR H H 54 8.201 8.201 7.420 0.781 17765 1441 1 12 . 1 1 55 55 GLY H H 55 8.354 8.354 8.992 -0.638 17765 1442 1 12 . 1 1 56 56 ASN HA H 56 4.729 4.729 4.752 -0.023 17765 1443 1 12 . 1 1 56 56 ASN H H 56 8.397 8.397 7.681 0.716 17765 1444 1 12 . 1 1 57 57 SER HA H 57 4.485 4.485 4.491 -0.006 17765 1445 1 12 . 1 1 57 57 SER H H 57 8.205 8.205 8.557 -0.352 17765 1446 1 12 . 1 1 58 58 GLY H H 58 8.144 8.144 8.363 -0.219 17765 1447 1 12 . 1 1 59 59 LEU HA H 59 4.485 4.485 4.345 0.140 17765 1448 1 12 . 1 1 59 59 LEU H H 59 8.460 8.460 7.766 0.694 17765 1449 1 12 . 1 1 60 60 ILE HA H 60 4.794 4.794 4.404 0.390 17765 1450 1 12 . 1 1 60 60 ILE H H 60 8.195 8.195 7.729 0.466 17765 1451 1 12 . 1 1 61 61 ILE HA H 61 4.151 4.151 4.262 -0.111 17765 1452 1 12 . 1 1 61 61 ILE H H 61 8.802 8.802 8.822 -0.020 17765 1453 1 12 . 1 1 62 62 ASN HA H 62 4.617 4.617 4.571 0.046 17765 1454 1 12 . 1 1 62 62 ASN H H 62 8.607 8.607 9.010 -0.403 17765 1455 1 12 . 1 1 63 63 ALA HA H 63 3.772 3.772 3.817 -0.045 17765 1456 1 12 . 1 1 63 63 ALA H H 63 8.735 8.735 8.405 0.330 17765 1457 1 12 . 1 1 64 64 ALA HA H 64 4.211 4.211 4.066 0.145 17765 1458 1 12 . 1 1 64 64 ALA H H 64 8.354 8.354 8.171 0.183 17765 1459 1 12 . 1 1 65 65 ASN HA H 65 4.849 4.849 4.678 0.171 17765 1460 1 12 . 1 1 65 65 ASN H H 65 8.151 8.151 8.169 -0.018 17765 1461 1 12 . 1 1 66 66 CYS HA H 66 5.624 5.624 4.809 0.815 17765 1462 1 12 . 1 1 66 66 CYS H H 66 7.698 7.698 7.554 0.144 17765 1463 1 12 . 1 1 67 67 VAL HA H 67 4.248 4.248 4.321 -0.073 17765 1464 1 12 . 1 1 67 67 VAL H H 67 8.742 8.742 8.376 0.366 17765 1465 1 13 . 1 1 2 2 ALA HA H 2 4.562 4.562 4.747 -0.185 17765 1466 1 13 . 1 1 2 2 ALA H H 2 8.617 8.617 8.248 0.369 17765 1467 1 13 . 1 1 3 3 THR HA H 3 4.394 4.394 4.347 0.047 17765 1468 1 13 . 1 1 3 3 THR H H 3 8.142 8.142 7.998 0.144 17765 1469 1 13 . 1 1 4 4 THR HA H 4 4.615 4.615 4.702 -0.087 17765 1470 1 13 . 1 1 4 4 THR H H 4 8.659 8.659 8.623 0.036 17765 1471 1 13 . 1 1 5 5 ILE HA H 5 3.832 3.832 4.320 -0.488 17765 1472 1 13 . 1 1 5 5 ILE H H 5 8.634 8.634 9.170 -0.536 17765 1473 1 13 . 1 1 6 6 GLY H H 6 8.828 8.828 8.560 0.268 17765 1474 1 13 . 1 1 7 7 PRO HA H 7 4.254 4.254 4.172 0.082 17765 1475 1 13 . 1 1 8 8 ASN HA H 8 4.846 4.846 4.712 0.134 17765 1476 1 13 . 1 1 8 8 ASN H H 8 8.536 8.536 8.484 0.052 17765 1477 1 13 . 1 1 9 9 THR HA H 9 3.758 3.758 4.339 -0.581 17765 1478 1 13 . 1 1 9 9 THR H H 9 7.559 7.559 7.650 -0.091 17765 1479 1 13 . 1 1 10 10 CYS HA H 10 4.897 4.897 4.770 0.127 17765 1480 1 13 . 1 1 10 10 CYS H H 10 8.554 8.554 7.879 0.675 17765 1481 1 13 . 1 1 11 11 SER HA H 11 4.441 4.441 4.774 -0.333 17765 1482 1 13 . 1 1 11 11 SER H H 11 8.488 8.488 8.538 -0.050 17765 1483 1 13 . 1 1 12 12 ILE HA H 12 4.126 4.126 4.135 -0.009 17765 1484 1 13 . 1 1 12 12 ILE H H 12 7.392 7.392 8.091 -0.699 17765 1485 1 13 . 1 1 13 13 ASP HA H 13 4.361 4.361 4.516 -0.155 17765 1486 1 13 . 1 1 13 13 ASP H H 13 8.694 8.694 7.897 0.797 17765 1487 1 13 . 1 1 14 14 ASP HA H 14 4.373 4.373 4.553 -0.180 17765 1488 1 13 . 1 1 14 14 ASP H H 14 8.640 8.640 8.405 0.235 17765 1489 1 13 . 1 1 15 15 TYR HA H 15 4.639 4.639 4.928 -0.289 17765 1490 1 13 . 1 1 15 15 TYR H H 15 7.970 7.970 8.017 -0.047 17765 1491 1 13 . 1 1 16 16 LYS HA H 16 4.794 4.794 4.878 -0.084 17765 1492 1 13 . 1 1 16 16 LYS H H 16 8.655 8.655 9.131 -0.476 17765 1493 1 13 . 1 1 17 17 PRO HA H 17 5.205 5.205 4.650 0.555 17765 1494 1 13 . 1 1 18 18 TYR HA H 18 4.653 4.653 5.252 -0.599 17765 1495 1 13 . 1 1 18 18 TYR H H 18 9.475 9.475 9.217 0.258 17765 1496 1 13 . 1 1 19 19 CYS HA H 19 5.358 5.358 4.818 0.540 17765 1497 1 13 . 1 1 19 19 CYS H H 19 9.004 9.004 9.250 -0.246 17765 1498 1 13 . 1 1 20 20 CYS HA H 20 5.597 5.597 4.846 0.751 17765 1499 1 13 . 1 1 20 20 CYS H H 20 9.838 9.838 9.325 0.513 17765 1500 1 13 . 1 1 21 21 GLN HA H 21 4.620 4.620 4.685 -0.065 17765 1501 1 13 . 1 1 21 21 GLN H H 21 8.900 8.900 8.420 0.480 17765 1502 1 13 . 1 1 22 22 SER HA H 22 4.461 4.461 4.203 0.258 17765 1503 1 13 . 1 1 22 22 SER H H 22 8.529 8.529 8.871 -0.342 17765 1504 1 13 . 1 1 23 23 MET HA H 23 4.632 4.632 5.084 -0.452 17765 1505 1 13 . 1 1 23 23 MET H H 23 8.566 8.566 7.703 0.863 17765 1506 1 13 . 1 1 24 24 SER HA H 24 4.254 4.254 4.502 -0.248 17765 1507 1 13 . 1 1 24 24 SER H H 24 8.534 8.534 8.805 -0.271 17765 1508 1 13 . 1 1 25 25 GLY H H 25 8.729 8.729 8.669 0.060 17765 1509 1 13 . 1 1 26 26 SER HA H 26 4.575 4.575 4.595 -0.020 17765 1510 1 13 . 1 1 26 26 SER H H 26 7.873 7.873 7.600 0.273 17765 1511 1 13 . 1 1 27 27 ALA HA H 27 4.487 4.487 4.583 -0.096 17765 1512 1 13 . 1 1 27 27 ALA H H 27 8.435 8.435 8.310 0.125 17765 1513 1 13 . 1 1 28 28 SER HA H 28 4.650 4.650 4.537 0.113 17765 1514 1 13 . 1 1 28 28 SER H H 28 8.134 8.134 7.665 0.469 17765 1515 1 13 . 1 1 29 29 LEU HA H 29 4.635 4.635 4.509 0.126 17765 1516 1 13 . 1 1 29 29 LEU H H 29 8.763 8.763 8.741 0.022 17765 1517 1 13 . 1 1 30 30 GLY H H 30 8.580 8.580 8.940 -0.360 17765 1518 1 13 . 1 1 31 31 CYS HA H 31 5.662 5.662 4.616 1.046 17765 1519 1 13 . 1 1 31 31 CYS H H 31 8.786 8.786 7.904 0.882 17765 1520 1 13 . 1 1 32 32 VAL HA H 32 4.724 4.724 4.545 0.179 17765 1521 1 13 . 1 1 32 32 VAL H H 32 8.361 8.361 8.704 -0.343 17765 1522 1 13 . 1 1 33 33 VAL HA H 33 3.370 3.370 3.622 -0.252 17765 1523 1 13 . 1 1 33 33 VAL H H 33 8.635 8.635 8.514 0.121 17765 1524 1 13 . 1 1 34 34 GLY H H 34 8.088 8.088 8.235 -0.147 17765 1525 1 13 . 1 1 35 35 VAL HA H 35 3.925 3.925 3.981 -0.056 17765 1526 1 13 . 1 1 35 35 VAL H H 35 7.785 7.785 7.873 -0.088 17765 1527 1 13 . 1 1 36 36 ILE HA H 36 3.360 3.360 3.817 -0.457 17765 1528 1 13 . 1 1 36 36 ILE H H 36 8.614 8.614 8.559 0.055 17765 1529 1 13 . 1 1 37 37 GLY H H 37 9.037 9.037 8.999 0.038 17765 1530 1 13 . 1 1 38 38 SER HA H 38 4.495 4.495 4.828 -0.333 17765 1531 1 13 . 1 1 38 38 SER H H 38 8.150 8.150 7.948 0.202 17765 1532 1 13 . 1 1 39 39 GLN HA H 39 4.825 4.825 4.814 0.011 17765 1533 1 13 . 1 1 39 39 GLN H H 39 8.429 8.429 8.498 -0.069 17765 1534 1 13 . 1 1 40 40 CYS HA H 40 4.987 4.987 4.789 0.198 17765 1535 1 13 . 1 1 40 40 CYS H H 40 8.974 8.974 9.156 -0.182 17765 1536 1 13 . 1 1 41 41 GLY H H 41 9.375 9.375 8.880 0.495 17765 1537 1 13 . 1 1 42 42 ALA HA H 42 4.658 4.658 4.576 0.082 17765 1538 1 13 . 1 1 42 42 ALA H H 42 7.131 7.131 7.234 -0.103 17765 1539 1 13 . 1 1 43 43 SER HA H 43 4.748 4.748 4.375 0.373 17765 1540 1 13 . 1 1 43 43 SER H H 43 8.325 8.325 8.350 -0.025 17765 1541 1 13 . 1 1 44 44 VAL HA H 44 4.652 4.652 4.184 0.468 17765 1542 1 13 . 1 1 44 44 VAL H H 44 8.784 8.784 8.311 0.473 17765 1543 1 13 . 1 1 45 45 LYS HA H 45 4.821 4.821 4.609 0.212 17765 1544 1 13 . 1 1 45 45 LYS H H 45 9.015 9.015 9.217 -0.202 17765 1545 1 13 . 1 1 46 46 CYS HA H 46 5.493 5.493 5.439 0.054 17765 1546 1 13 . 1 1 46 46 CYS H H 46 8.943 8.943 8.607 0.336 17765 1547 1 13 . 1 1 47 47 CYS HA H 47 5.677 5.677 5.569 0.108 17765 1548 1 13 . 1 1 47 47 CYS H H 47 9.513 9.513 8.881 0.632 17765 1549 1 13 . 1 1 48 48 LYS HA H 48 4.020 4.020 5.478 -1.458 17765 1550 1 13 . 1 1 48 48 LYS H H 48 8.226 8.226 8.569 -0.343 17765 1551 1 13 . 1 1 49 49 ASP HA H 49 4.570 4.570 4.635 -0.065 17765 1552 1 13 . 1 1 49 49 ASP H H 49 8.375 8.375 8.844 -0.469 17765 1553 1 13 . 1 1 50 50 ASP HA H 50 4.719 4.719 4.703 0.016 17765 1554 1 13 . 1 1 50 50 ASP H H 50 8.306 8.306 8.139 0.167 17765 1555 1 13 . 1 1 51 51 VAL HA H 51 4.196 4.196 4.310 -0.114 17765 1556 1 13 . 1 1 51 51 VAL H H 51 7.790 7.790 7.559 0.231 17765 1557 1 13 . 1 1 52 52 THR HA H 52 4.322 4.322 4.358 -0.036 17765 1558 1 13 . 1 1 52 52 THR H H 52 8.194 8.194 8.539 -0.345 17765 1559 1 13 . 1 1 53 53 ASN HA H 53 4.777 4.777 4.476 0.301 17765 1560 1 13 . 1 1 53 53 ASN H H 53 8.364 8.364 8.567 -0.203 17765 1561 1 13 . 1 1 54 54 THR HA H 54 4.340 4.340 4.404 -0.064 17765 1562 1 13 . 1 1 54 54 THR H H 54 8.201 8.201 8.309 -0.108 17765 1563 1 13 . 1 1 55 55 GLY H H 55 8.354 8.354 8.043 0.311 17765 1564 1 13 . 1 1 56 56 ASN HA H 56 4.729 4.729 4.423 0.306 17765 1565 1 13 . 1 1 56 56 ASN H H 56 8.397 8.397 8.375 0.022 17765 1566 1 13 . 1 1 57 57 SER HA H 57 4.485 4.485 4.460 0.025 17765 1567 1 13 . 1 1 57 57 SER H H 57 8.205 8.205 7.720 0.485 17765 1568 1 13 . 1 1 58 58 GLY H H 58 8.144 8.144 7.352 0.792 17765 1569 1 13 . 1 1 59 59 LEU HA H 59 4.485 4.485 4.648 -0.163 17765 1570 1 13 . 1 1 59 59 LEU H H 59 8.460 8.460 8.569 -0.109 17765 1571 1 13 . 1 1 60 60 ILE HA H 60 4.794 4.794 4.145 0.649 17765 1572 1 13 . 1 1 60 60 ILE H H 60 8.195 8.195 8.117 0.078 17765 1573 1 13 . 1 1 61 61 ILE HA H 61 4.151 4.151 4.347 -0.196 17765 1574 1 13 . 1 1 61 61 ILE H H 61 8.802 8.802 7.806 0.996 17765 1575 1 13 . 1 1 62 62 ASN HA H 62 4.617 4.617 4.646 -0.029 17765 1576 1 13 . 1 1 62 62 ASN H H 62 8.607 8.607 8.842 -0.235 17765 1577 1 13 . 1 1 63 63 ALA HA H 63 3.772 3.772 4.220 -0.448 17765 1578 1 13 . 1 1 63 63 ALA H H 63 8.735 8.735 8.552 0.183 17765 1579 1 13 . 1 1 64 64 ALA HA H 64 4.211 4.211 4.466 -0.255 17765 1580 1 13 . 1 1 64 64 ALA H H 64 8.354 8.354 7.787 0.567 17765 1581 1 13 . 1 1 65 65 ASN HA H 65 4.849 4.849 4.850 -0.001 17765 1582 1 13 . 1 1 65 65 ASN H H 65 8.151 8.151 8.365 -0.214 17765 1583 1 13 . 1 1 66 66 CYS HA H 66 5.624 5.624 5.074 0.550 17765 1584 1 13 . 1 1 66 66 CYS H H 66 7.698 7.698 7.675 0.024 17765 1585 1 13 . 1 1 67 67 VAL HA H 67 4.248 4.248 3.784 0.464 17765 1586 1 13 . 1 1 67 67 VAL H H 67 8.742 8.742 8.214 0.528 17765 1587 1 14 . 1 1 2 2 ALA HA H 2 4.562 4.562 5.120 -0.558 17765 1588 1 14 . 1 1 2 2 ALA H H 2 8.617 8.617 7.962 0.655 17765 1589 1 14 . 1 1 3 3 THR HA H 3 4.394 4.394 4.501 -0.107 17765 1590 1 14 . 1 1 3 3 THR H H 3 8.142 8.142 8.381 -0.239 17765 1591 1 14 . 1 1 4 4 THR HA H 4 4.615 4.615 4.669 -0.054 17765 1592 1 14 . 1 1 4 4 THR H H 4 8.659 8.659 8.453 0.206 17765 1593 1 14 . 1 1 5 5 ILE HA H 5 3.832 3.832 4.174 -0.342 17765 1594 1 14 . 1 1 5 5 ILE H H 5 8.634 8.634 9.029 -0.395 17765 1595 1 14 . 1 1 6 6 GLY H H 6 8.828 8.828 8.405 0.423 17765 1596 1 14 . 1 1 7 7 PRO HA H 7 4.254 4.254 4.186 0.068 17765 1597 1 14 . 1 1 8 8 ASN HA H 8 4.846 4.846 4.647 0.199 17765 1598 1 14 . 1 1 8 8 ASN H H 8 8.536 8.536 8.400 0.136 17765 1599 1 14 . 1 1 9 9 THR HA H 9 3.758 3.758 4.232 -0.474 17765 1600 1 14 . 1 1 9 9 THR H H 9 7.559 7.559 7.775 -0.216 17765 1601 1 14 . 1 1 10 10 CYS HA H 10 4.897 4.897 4.825 0.072 17765 1602 1 14 . 1 1 10 10 CYS H H 10 8.554 8.554 7.795 0.759 17765 1603 1 14 . 1 1 11 11 SER HA H 11 4.441 4.441 4.675 -0.234 17765 1604 1 14 . 1 1 11 11 SER H H 11 8.488 8.488 8.691 -0.203 17765 1605 1 14 . 1 1 12 12 ILE HA H 12 4.126 4.126 4.111 0.015 17765 1606 1 14 . 1 1 12 12 ILE H H 12 7.392 7.392 8.033 -0.641 17765 1607 1 14 . 1 1 13 13 ASP HA H 13 4.361 4.361 4.563 -0.202 17765 1608 1 14 . 1 1 13 13 ASP H H 13 8.694 8.694 7.623 1.071 17765 1609 1 14 . 1 1 14 14 ASP HA H 14 4.373 4.373 4.550 -0.177 17765 1610 1 14 . 1 1 14 14 ASP H H 14 8.640 8.640 8.420 0.220 17765 1611 1 14 . 1 1 15 15 TYR HA H 15 4.639 4.639 4.715 -0.076 17765 1612 1 14 . 1 1 15 15 TYR H H 15 7.970 7.970 7.634 0.336 17765 1613 1 14 . 1 1 16 16 LYS HA H 16 4.794 4.794 4.807 -0.013 17765 1614 1 14 . 1 1 16 16 LYS H H 16 8.655 8.655 8.798 -0.143 17765 1615 1 14 . 1 1 17 17 PRO HA H 17 5.205 5.205 4.849 0.356 17765 1616 1 14 . 1 1 18 18 TYR HA H 18 4.653 4.653 5.009 -0.356 17765 1617 1 14 . 1 1 18 18 TYR H H 18 9.475 9.475 9.236 0.239 17765 1618 1 14 . 1 1 19 19 CYS HA H 19 5.358 5.358 4.772 0.586 17765 1619 1 14 . 1 1 19 19 CYS H H 19 9.004 9.004 9.175 -0.171 17765 1620 1 14 . 1 1 20 20 CYS HA H 20 5.597 5.597 4.476 1.121 17765 1621 1 14 . 1 1 20 20 CYS H H 20 9.838 9.838 9.139 0.699 17765 1622 1 14 . 1 1 21 21 GLN HA H 21 4.620 4.620 4.301 0.319 17765 1623 1 14 . 1 1 21 21 GLN H H 21 8.900 8.900 8.540 0.360 17765 1624 1 14 . 1 1 22 22 SER HA H 22 4.461 4.461 4.406 0.055 17765 1625 1 14 . 1 1 22 22 SER H H 22 8.529 8.529 8.839 -0.310 17765 1626 1 14 . 1 1 23 23 MET HA H 23 4.632 4.632 4.414 0.218 17765 1627 1 14 . 1 1 23 23 MET H H 23 8.566 8.566 8.059 0.507 17765 1628 1 14 . 1 1 24 24 SER HA H 24 4.254 4.254 4.219 0.035 17765 1629 1 14 . 1 1 24 24 SER H H 24 8.534 8.534 8.186 0.348 17765 1630 1 14 . 1 1 25 25 GLY H H 25 8.729 8.729 8.066 0.663 17765 1631 1 14 . 1 1 26 26 SER HA H 26 4.575 4.575 4.378 0.197 17765 1632 1 14 . 1 1 26 26 SER H H 26 7.873 7.873 8.057 -0.184 17765 1633 1 14 . 1 1 27 27 ALA HA H 27 4.487 4.487 4.290 0.197 17765 1634 1 14 . 1 1 27 27 ALA H H 27 8.435 8.435 8.426 0.009 17765 1635 1 14 . 1 1 28 28 SER HA H 28 4.650 4.650 4.477 0.173 17765 1636 1 14 . 1 1 28 28 SER H H 28 8.134 8.134 7.579 0.555 17765 1637 1 14 . 1 1 29 29 LEU HA H 29 4.635 4.635 4.617 0.018 17765 1638 1 14 . 1 1 29 29 LEU H H 29 8.763 8.763 7.809 0.954 17765 1639 1 14 . 1 1 30 30 GLY H H 30 8.580 8.580 8.133 0.447 17765 1640 1 14 . 1 1 31 31 CYS HA H 31 5.662 5.662 4.597 1.065 17765 1641 1 14 . 1 1 31 31 CYS H H 31 8.786 8.786 7.623 1.163 17765 1642 1 14 . 1 1 32 32 VAL HA H 32 4.724 4.724 4.453 0.271 17765 1643 1 14 . 1 1 32 32 VAL H H 32 8.361 8.361 7.869 0.492 17765 1644 1 14 . 1 1 33 33 VAL HA H 33 3.370 3.370 3.880 -0.510 17765 1645 1 14 . 1 1 33 33 VAL H H 33 8.635 8.635 8.735 -0.100 17765 1646 1 14 . 1 1 34 34 GLY H H 34 8.088 8.088 8.645 -0.556 17765 1647 1 14 . 1 1 35 35 VAL HA H 35 3.925 3.925 4.004 -0.079 17765 1648 1 14 . 1 1 35 35 VAL H H 35 7.785 7.785 7.624 0.161 17765 1649 1 14 . 1 1 36 36 ILE HA H 36 3.360 3.360 3.892 -0.532 17765 1650 1 14 . 1 1 36 36 ILE H H 36 8.614 8.614 8.335 0.279 17765 1651 1 14 . 1 1 37 37 GLY H H 37 9.037 9.037 8.862 0.175 17765 1652 1 14 . 1 1 38 38 SER HA H 38 4.495 4.495 4.853 -0.358 17765 1653 1 14 . 1 1 38 38 SER H H 38 8.150 8.150 7.986 0.164 17765 1654 1 14 . 1 1 39 39 GLN HA H 39 4.825 4.825 5.513 -0.688 17765 1655 1 14 . 1 1 39 39 GLN H H 39 8.429 8.429 8.381 0.048 17765 1656 1 14 . 1 1 40 40 CYS HA H 40 4.987 4.987 4.752 0.235 17765 1657 1 14 . 1 1 40 40 CYS H H 40 8.974 8.974 8.525 0.449 17765 1658 1 14 . 1 1 41 41 GLY H H 41 9.375 9.375 8.804 0.571 17765 1659 1 14 . 1 1 42 42 ALA HA H 42 4.658 4.658 4.705 -0.047 17765 1660 1 14 . 1 1 42 42 ALA H H 42 7.131 7.131 7.377 -0.246 17765 1661 1 14 . 1 1 43 43 SER HA H 43 4.748 4.748 4.480 0.268 17765 1662 1 14 . 1 1 43 43 SER H H 43 8.325 8.325 8.381 -0.056 17765 1663 1 14 . 1 1 44 44 VAL HA H 44 4.652 4.652 4.502 0.150 17765 1664 1 14 . 1 1 44 44 VAL H H 44 8.784 8.784 7.921 0.863 17765 1665 1 14 . 1 1 45 45 LYS HA H 45 4.821 4.821 4.642 0.179 17765 1666 1 14 . 1 1 45 45 LYS H H 45 9.015 9.015 9.144 -0.129 17765 1667 1 14 . 1 1 46 46 CYS HA H 46 5.493 5.493 5.673 -0.180 17765 1668 1 14 . 1 1 46 46 CYS H H 46 8.943 8.943 8.522 0.421 17765 1669 1 14 . 1 1 47 47 CYS HA H 47 5.677 5.677 5.000 0.677 17765 1670 1 14 . 1 1 47 47 CYS H H 47 9.513 9.513 9.009 0.504 17765 1671 1 14 . 1 1 48 48 LYS HA H 48 4.020 4.020 4.768 -0.748 17765 1672 1 14 . 1 1 48 48 LYS H H 48 8.226 8.226 8.092 0.134 17765 1673 1 14 . 1 1 49 49 ASP HA H 49 4.570 4.570 4.601 -0.031 17765 1674 1 14 . 1 1 49 49 ASP H H 49 8.375 8.375 8.699 -0.324 17765 1675 1 14 . 1 1 50 50 ASP HA H 50 4.719 4.719 4.548 0.171 17765 1676 1 14 . 1 1 50 50 ASP H H 50 8.306 8.306 8.295 0.011 17765 1677 1 14 . 1 1 51 51 VAL HA H 51 4.196 4.196 4.263 -0.067 17765 1678 1 14 . 1 1 51 51 VAL H H 51 7.790 7.790 8.230 -0.441 17765 1679 1 14 . 1 1 52 52 THR HA H 52 4.322 4.322 4.298 0.024 17765 1680 1 14 . 1 1 52 52 THR H H 52 8.194 8.194 8.039 0.155 17765 1681 1 14 . 1 1 53 53 ASN HA H 53 4.777 4.777 4.551 0.226 17765 1682 1 14 . 1 1 53 53 ASN H H 53 8.364 8.364 8.257 0.107 17765 1683 1 14 . 1 1 54 54 THR HA H 54 4.340 4.340 4.365 -0.025 17765 1684 1 14 . 1 1 54 54 THR H H 54 8.201 8.201 8.271 -0.070 17765 1685 1 14 . 1 1 55 55 GLY H H 55 8.354 8.354 8.184 0.170 17765 1686 1 14 . 1 1 56 56 ASN HA H 56 4.729 4.729 4.965 -0.236 17765 1687 1 14 . 1 1 56 56 ASN H H 56 8.397 8.397 8.037 0.360 17765 1688 1 14 . 1 1 57 57 SER HA H 57 4.485 4.485 4.412 0.073 17765 1689 1 14 . 1 1 57 57 SER H H 57 8.205 8.205 8.331 -0.126 17765 1690 1 14 . 1 1 58 58 GLY H H 58 8.144 8.144 8.300 -0.156 17765 1691 1 14 . 1 1 59 59 LEU HA H 59 4.485 4.485 4.362 0.123 17765 1692 1 14 . 1 1 59 59 LEU H H 59 8.460 8.460 8.456 0.004 17765 1693 1 14 . 1 1 60 60 ILE HA H 60 4.794 4.794 4.596 0.198 17765 1694 1 14 . 1 1 60 60 ILE H H 60 8.195 8.195 8.231 -0.036 17765 1695 1 14 . 1 1 61 61 ILE HA H 61 4.151 4.151 4.534 -0.383 17765 1696 1 14 . 1 1 61 61 ILE H H 61 8.802 8.802 8.160 0.642 17765 1697 1 14 . 1 1 62 62 ASN HA H 62 4.617 4.617 4.793 -0.176 17765 1698 1 14 . 1 1 62 62 ASN H H 62 8.607 8.607 8.666 -0.059 17765 1699 1 14 . 1 1 63 63 ALA HA H 63 3.772 3.772 4.031 -0.259 17765 1700 1 14 . 1 1 63 63 ALA H H 63 8.735 8.735 8.630 0.105 17765 1701 1 14 . 1 1 64 64 ALA HA H 64 4.211 4.211 4.274 -0.063 17765 1702 1 14 . 1 1 64 64 ALA H H 64 8.354 8.354 8.032 0.322 17765 1703 1 14 . 1 1 65 65 ASN HA H 65 4.849 4.849 4.832 0.017 17765 1704 1 14 . 1 1 65 65 ASN H H 65 8.151 8.151 7.720 0.431 17765 1705 1 14 . 1 1 66 66 CYS HA H 66 5.624 5.624 4.723 0.901 17765 1706 1 14 . 1 1 66 66 CYS H H 66 7.698 7.698 7.211 0.487 17765 1707 1 14 . 1 1 67 67 VAL HA H 67 4.248 4.248 3.765 0.483 17765 1708 1 14 . 1 1 67 67 VAL H H 67 8.742 8.742 7.976 0.766 17765 1709 1 15 . 1 1 2 2 ALA HA H 2 4.562 4.562 4.759 -0.197 17765 1710 1 15 . 1 1 2 2 ALA H H 2 8.617 8.617 8.355 0.262 17765 1711 1 15 . 1 1 3 3 THR HA H 3 4.394 4.394 4.281 0.113 17765 1712 1 15 . 1 1 3 3 THR H H 3 8.142 8.142 8.043 0.099 17765 1713 1 15 . 1 1 4 4 THR HA H 4 4.615 4.615 4.600 0.015 17765 1714 1 15 . 1 1 4 4 THR H H 4 8.659 8.659 8.518 0.141 17765 1715 1 15 . 1 1 5 5 ILE HA H 5 3.832 3.832 4.263 -0.431 17765 1716 1 15 . 1 1 5 5 ILE H H 5 8.634 8.634 8.994 -0.360 17765 1717 1 15 . 1 1 6 6 GLY H H 6 8.828 8.828 8.360 0.468 17765 1718 1 15 . 1 1 7 7 PRO HA H 7 4.254 4.254 4.155 0.099 17765 1719 1 15 . 1 1 8 8 ASN HA H 8 4.846 4.846 4.636 0.210 17765 1720 1 15 . 1 1 8 8 ASN H H 8 8.536 8.536 8.362 0.174 17765 1721 1 15 . 1 1 9 9 THR HA H 9 3.758 3.758 4.253 -0.495 17765 1722 1 15 . 1 1 9 9 THR H H 9 7.559 7.559 7.993 -0.434 17765 1723 1 15 . 1 1 10 10 CYS HA H 10 4.897 4.897 4.648 0.249 17765 1724 1 15 . 1 1 10 10 CYS H H 10 8.554 8.554 8.488 0.066 17765 1725 1 15 . 1 1 11 11 SER HA H 11 4.441 4.441 4.652 -0.211 17765 1726 1 15 . 1 1 11 11 SER H H 11 8.488 8.488 8.873 -0.385 17765 1727 1 15 . 1 1 12 12 ILE HA H 12 4.126 4.126 4.148 -0.022 17765 1728 1 15 . 1 1 12 12 ILE H H 12 7.392 7.392 8.099 -0.707 17765 1729 1 15 . 1 1 13 13 ASP HA H 13 4.361 4.361 4.556 -0.195 17765 1730 1 15 . 1 1 13 13 ASP H H 13 8.694 8.694 7.765 0.929 17765 1731 1 15 . 1 1 14 14 ASP HA H 14 4.373 4.373 4.582 -0.209 17765 1732 1 15 . 1 1 14 14 ASP H H 14 8.640 8.640 8.284 0.356 17765 1733 1 15 . 1 1 15 15 TYR HA H 15 4.639 4.639 4.924 -0.285 17765 1734 1 15 . 1 1 15 15 TYR H H 15 7.970 7.970 7.158 0.812 17765 1735 1 15 . 1 1 16 16 LYS HA H 16 4.794 4.794 4.991 -0.197 17765 1736 1 15 . 1 1 16 16 LYS H H 16 8.655 8.655 9.311 -0.656 17765 1737 1 15 . 1 1 17 17 PRO HA H 17 5.205 5.205 4.473 0.732 17765 1738 1 15 . 1 1 18 18 TYR HA H 18 4.653 4.653 4.969 -0.316 17765 1739 1 15 . 1 1 18 18 TYR H H 18 9.475 9.475 9.119 0.356 17765 1740 1 15 . 1 1 19 19 CYS HA H 19 5.358 5.358 4.862 0.496 17765 1741 1 15 . 1 1 19 19 CYS H H 19 9.004 9.004 9.273 -0.269 17765 1742 1 15 . 1 1 20 20 CYS HA H 20 5.597 5.597 4.575 1.022 17765 1743 1 15 . 1 1 20 20 CYS H H 20 9.838 9.838 8.643 1.195 17765 1744 1 15 . 1 1 21 21 GLN HA H 21 4.620 4.620 4.286 0.334 17765 1745 1 15 . 1 1 21 21 GLN H H 21 8.900 8.900 8.506 0.394 17765 1746 1 15 . 1 1 22 22 SER HA H 22 4.461 4.461 4.648 -0.187 17765 1747 1 15 . 1 1 22 22 SER H H 22 8.529 8.529 8.185 0.344 17765 1748 1 15 . 1 1 23 23 MET HA H 23 4.632 4.632 4.795 -0.163 17765 1749 1 15 . 1 1 23 23 MET H H 23 8.566 8.566 8.780 -0.214 17765 1750 1 15 . 1 1 24 24 SER HA H 24 4.254 4.254 4.359 -0.105 17765 1751 1 15 . 1 1 24 24 SER H H 24 8.534 8.534 8.526 0.008 17765 1752 1 15 . 1 1 25 25 GLY H H 25 8.729 8.729 8.430 0.299 17765 1753 1 15 . 1 1 26 26 SER HA H 26 4.575 4.575 4.109 0.466 17765 1754 1 15 . 1 1 26 26 SER H H 26 7.873 7.873 8.400 -0.527 17765 1755 1 15 . 1 1 27 27 ALA HA H 27 4.487 4.487 4.240 0.247 17765 1756 1 15 . 1 1 27 27 ALA H H 27 8.435 8.435 8.516 -0.081 17765 1757 1 15 . 1 1 28 28 SER HA H 28 4.650 4.650 4.507 0.143 17765 1758 1 15 . 1 1 28 28 SER H H 28 8.134 8.134 7.872 0.262 17765 1759 1 15 . 1 1 29 29 LEU HA H 29 4.635 4.635 4.339 0.296 17765 1760 1 15 . 1 1 29 29 LEU H H 29 8.763 8.763 8.774 -0.011 17765 1761 1 15 . 1 1 30 30 GLY H H 30 8.580 8.580 8.599 -0.019 17765 1762 1 15 . 1 1 31 31 CYS HA H 31 5.662 5.662 4.673 0.989 17765 1763 1 15 . 1 1 31 31 CYS H H 31 8.786 8.786 8.313 0.473 17765 1764 1 15 . 1 1 32 32 VAL HA H 32 4.724 4.724 4.506 0.218 17765 1765 1 15 . 1 1 32 32 VAL H H 32 8.361 8.361 7.846 0.515 17765 1766 1 15 . 1 1 33 33 VAL HA H 33 3.370 3.370 3.770 -0.400 17765 1767 1 15 . 1 1 33 33 VAL H H 33 8.635 8.635 8.861 -0.226 17765 1768 1 15 . 1 1 34 34 GLY H H 34 8.088 8.088 8.381 -0.293 17765 1769 1 15 . 1 1 35 35 VAL HA H 35 3.925 3.925 4.069 -0.144 17765 1770 1 15 . 1 1 35 35 VAL H H 35 7.785 7.785 7.882 -0.097 17765 1771 1 15 . 1 1 36 36 ILE HA H 36 3.360 3.360 3.880 -0.520 17765 1772 1 15 . 1 1 36 36 ILE H H 36 8.614 8.614 8.428 0.186 17765 1773 1 15 . 1 1 37 37 GLY H H 37 9.037 9.037 9.083 -0.046 17765 1774 1 15 . 1 1 38 38 SER HA H 38 4.495 4.495 4.686 -0.191 17765 1775 1 15 . 1 1 38 38 SER H H 38 8.150 8.150 7.942 0.208 17765 1776 1 15 . 1 1 39 39 GLN HA H 39 4.825 4.825 4.931 -0.106 17765 1777 1 15 . 1 1 39 39 GLN H H 39 8.429 8.429 8.447 -0.018 17765 1778 1 15 . 1 1 40 40 CYS HA H 40 4.987 4.987 4.668 0.319 17765 1779 1 15 . 1 1 40 40 CYS H H 40 8.974 8.974 8.787 0.187 17765 1780 1 15 . 1 1 41 41 GLY H H 41 9.375 9.375 8.845 0.530 17765 1781 1 15 . 1 1 42 42 ALA HA H 42 4.658 4.658 4.571 0.087 17765 1782 1 15 . 1 1 42 42 ALA H H 42 7.131 7.131 7.420 -0.289 17765 1783 1 15 . 1 1 43 43 SER HA H 43 4.748 4.748 4.546 0.202 17765 1784 1 15 . 1 1 43 43 SER H H 43 8.325 8.325 8.404 -0.079 17765 1785 1 15 . 1 1 44 44 VAL HA H 44 4.652 4.652 4.165 0.487 17765 1786 1 15 . 1 1 44 44 VAL H H 44 8.784 8.784 8.545 0.239 17765 1787 1 15 . 1 1 45 45 LYS HA H 45 4.821 4.821 4.843 -0.022 17765 1788 1 15 . 1 1 45 45 LYS H H 45 9.015 9.015 8.976 0.039 17765 1789 1 15 . 1 1 46 46 CYS HA H 46 5.493 5.493 4.918 0.575 17765 1790 1 15 . 1 1 46 46 CYS H H 46 8.943 8.943 8.641 0.302 17765 1791 1 15 . 1 1 47 47 CYS HA H 47 5.677 5.677 4.952 0.725 17765 1792 1 15 . 1 1 47 47 CYS H H 47 9.513 9.513 8.263 1.250 17765 1793 1 15 . 1 1 48 48 LYS HA H 48 4.020 4.020 5.212 -1.192 17765 1794 1 15 . 1 1 48 48 LYS H H 48 8.226 8.226 8.270 -0.044 17765 1795 1 15 . 1 1 49 49 ASP HA H 49 4.570 4.570 4.461 0.109 17765 1796 1 15 . 1 1 49 49 ASP H H 49 8.375 8.375 8.492 -0.117 17765 1797 1 15 . 1 1 50 50 ASP HA H 50 4.719 4.719 4.370 0.349 17765 1798 1 15 . 1 1 50 50 ASP H H 50 8.306 8.306 8.402 -0.096 17765 1799 1 15 . 1 1 51 51 VAL HA H 51 4.196 4.196 4.053 0.143 17765 1800 1 15 . 1 1 51 51 VAL H H 51 7.790 7.790 8.012 -0.222 17765 1801 1 15 . 1 1 52 52 THR HA H 52 4.322 4.322 4.210 0.112 17765 1802 1 15 . 1 1 52 52 THR H H 52 8.194 8.194 8.718 -0.524 17765 1803 1 15 . 1 1 53 53 ASN HA H 53 4.777 4.777 5.012 -0.235 17765 1804 1 15 . 1 1 53 53 ASN H H 53 8.364 8.364 7.776 0.588 17765 1805 1 15 . 1 1 54 54 THR HA H 54 4.340 4.340 4.273 0.067 17765 1806 1 15 . 1 1 54 54 THR H H 54 8.201 8.201 8.428 -0.227 17765 1807 1 15 . 1 1 55 55 GLY H H 55 8.354 8.354 8.111 0.243 17765 1808 1 15 . 1 1 56 56 ASN HA H 56 4.729 4.729 4.689 0.040 17765 1809 1 15 . 1 1 56 56 ASN H H 56 8.397 8.397 8.480 -0.083 17765 1810 1 15 . 1 1 57 57 SER HA H 57 4.485 4.485 4.442 0.043 17765 1811 1 15 . 1 1 57 57 SER H H 57 8.205 8.205 8.119 0.086 17765 1812 1 15 . 1 1 58 58 GLY H H 58 8.144 8.144 8.139 0.005 17765 1813 1 15 . 1 1 59 59 LEU HA H 59 4.485 4.485 4.454 0.031 17765 1814 1 15 . 1 1 59 59 LEU H H 59 8.460 8.460 7.675 0.785 17765 1815 1 15 . 1 1 60 60 ILE HA H 60 4.794 4.794 4.316 0.478 17765 1816 1 15 . 1 1 60 60 ILE H H 60 8.195 8.195 8.483 -0.288 17765 1817 1 15 . 1 1 61 61 ILE HA H 61 4.151 4.151 4.226 -0.075 17765 1818 1 15 . 1 1 61 61 ILE H H 61 8.802 8.802 7.566 1.236 17765 1819 1 15 . 1 1 62 62 ASN HA H 62 4.617 4.617 4.263 0.354 17765 1820 1 15 . 1 1 62 62 ASN H H 62 8.607 8.607 8.266 0.341 17765 1821 1 15 . 1 1 63 63 ALA HA H 63 3.772 3.772 4.300 -0.528 17765 1822 1 15 . 1 1 63 63 ALA H H 63 8.735 8.735 8.249 0.486 17765 1823 1 15 . 1 1 64 64 ALA HA H 64 4.211 4.211 4.158 0.053 17765 1824 1 15 . 1 1 64 64 ALA H H 64 8.354 8.354 8.044 0.310 17765 1825 1 15 . 1 1 65 65 ASN HA H 65 4.849 4.849 4.863 -0.014 17765 1826 1 15 . 1 1 65 65 ASN H H 65 8.151 8.151 8.641 -0.490 17765 1827 1 15 . 1 1 66 66 CYS HA H 66 5.624 5.624 4.537 1.087 17765 1828 1 15 . 1 1 66 66 CYS H H 66 7.698 7.698 7.501 0.197 17765 1829 1 15 . 1 1 67 67 VAL HA H 67 4.248 4.248 4.103 0.145 17765 1830 1 15 . 1 1 67 67 VAL H H 67 8.742 8.742 7.949 0.793 17765 1831 1 16 . 1 1 2 2 ALA HA H 2 4.562 4.562 4.492 0.070 17765 1832 1 16 . 1 1 2 2 ALA H H 2 8.617 8.617 8.406 0.211 17765 1833 1 16 . 1 1 3 3 THR HA H 3 4.394 4.394 4.185 0.209 17765 1834 1 16 . 1 1 3 3 THR H H 3 8.142 8.142 7.937 0.205 17765 1835 1 16 . 1 1 4 4 THR HA H 4 4.615 4.615 4.573 0.042 17765 1836 1 16 . 1 1 4 4 THR H H 4 8.659 8.659 8.508 0.151 17765 1837 1 16 . 1 1 5 5 ILE HA H 5 3.832 3.832 4.226 -0.394 17765 1838 1 16 . 1 1 5 5 ILE H H 5 8.634 8.634 8.627 0.007 17765 1839 1 16 . 1 1 6 6 GLY H H 6 8.828 8.828 8.594 0.234 17765 1840 1 16 . 1 1 7 7 PRO HA H 7 4.254 4.254 4.195 0.059 17765 1841 1 16 . 1 1 8 8 ASN HA H 8 4.846 4.846 4.712 0.134 17765 1842 1 16 . 1 1 8 8 ASN H H 8 8.536 8.536 8.499 0.037 17765 1843 1 16 . 1 1 9 9 THR HA H 9 3.758 3.758 4.296 -0.538 17765 1844 1 16 . 1 1 9 9 THR H H 9 7.559 7.559 7.957 -0.398 17765 1845 1 16 . 1 1 10 10 CYS HA H 10 4.897 4.897 4.672 0.225 17765 1846 1 16 . 1 1 10 10 CYS H H 10 8.554 8.554 8.171 0.383 17765 1847 1 16 . 1 1 11 11 SER HA H 11 4.441 4.441 5.061 -0.620 17765 1848 1 16 . 1 1 11 11 SER H H 11 8.488 8.488 8.619 -0.131 17765 1849 1 16 . 1 1 12 12 ILE HA H 12 4.126 4.126 4.129 -0.003 17765 1850 1 16 . 1 1 12 12 ILE H H 12 7.392 7.392 7.839 -0.447 17765 1851 1 16 . 1 1 13 13 ASP HA H 13 4.361 4.361 4.481 -0.120 17765 1852 1 16 . 1 1 13 13 ASP H H 13 8.694 8.694 8.451 0.243 17765 1853 1 16 . 1 1 14 14 ASP HA H 14 4.373 4.373 4.173 0.200 17765 1854 1 16 . 1 1 14 14 ASP H H 14 8.640 8.640 8.151 0.489 17765 1855 1 16 . 1 1 15 15 TYR HA H 15 4.639 4.639 5.017 -0.378 17765 1856 1 16 . 1 1 15 15 TYR H H 15 7.970 7.970 7.876 0.094 17765 1857 1 16 . 1 1 16 16 LYS HA H 16 4.794 4.794 5.118 -0.324 17765 1858 1 16 . 1 1 16 16 LYS H H 16 8.655 8.655 9.143 -0.488 17765 1859 1 16 . 1 1 17 17 PRO HA H 17 5.205 5.205 4.694 0.511 17765 1860 1 16 . 1 1 18 18 TYR HA H 18 4.653 4.653 4.938 -0.285 17765 1861 1 16 . 1 1 18 18 TYR H H 18 9.475 9.475 9.308 0.167 17765 1862 1 16 . 1 1 19 19 CYS HA H 19 5.358 5.358 4.918 0.440 17765 1863 1 16 . 1 1 19 19 CYS H H 19 9.004 9.004 9.378 -0.374 17765 1864 1 16 . 1 1 20 20 CYS HA H 20 5.597 5.597 4.808 0.789 17765 1865 1 16 . 1 1 20 20 CYS H H 20 9.838 9.838 9.401 0.437 17765 1866 1 16 . 1 1 21 21 GLN HA H 21 4.620 4.620 4.198 0.422 17765 1867 1 16 . 1 1 21 21 GLN H H 21 8.900 8.900 8.661 0.239 17765 1868 1 16 . 1 1 22 22 SER HA H 22 4.461 4.461 4.464 -0.003 17765 1869 1 16 . 1 1 22 22 SER H H 22 8.529 8.529 8.644 -0.115 17765 1870 1 16 . 1 1 23 23 MET HA H 23 4.632 4.632 4.469 0.163 17765 1871 1 16 . 1 1 23 23 MET H H 23 8.566 8.566 8.201 0.365 17765 1872 1 16 . 1 1 24 24 SER HA H 24 4.254 4.254 4.254 -0.000 17765 1873 1 16 . 1 1 24 24 SER H H 24 8.534 8.534 8.336 0.198 17765 1874 1 16 . 1 1 25 25 GLY H H 25 8.729 8.729 8.419 0.310 17765 1875 1 16 . 1 1 26 26 SER HA H 26 4.575 4.575 4.481 0.094 17765 1876 1 16 . 1 1 26 26 SER H H 26 7.873 7.873 7.847 0.026 17765 1877 1 16 . 1 1 27 27 ALA HA H 27 4.487 4.487 4.421 0.066 17765 1878 1 16 . 1 1 27 27 ALA H H 27 8.435 8.435 8.516 -0.081 17765 1879 1 16 . 1 1 28 28 SER HA H 28 4.650 4.650 4.998 -0.348 17765 1880 1 16 . 1 1 28 28 SER H H 28 8.134 8.134 7.858 0.276 17765 1881 1 16 . 1 1 29 29 LEU HA H 29 4.635 4.635 4.596 0.039 17765 1882 1 16 . 1 1 29 29 LEU H H 29 8.763 8.763 8.538 0.225 17765 1883 1 16 . 1 1 30 30 GLY H H 30 8.580 8.580 8.633 -0.053 17765 1884 1 16 . 1 1 31 31 CYS HA H 31 5.662 5.662 5.107 0.555 17765 1885 1 16 . 1 1 31 31 CYS H H 31 8.786 8.786 8.699 0.087 17765 1886 1 16 . 1 1 32 32 VAL HA H 32 4.724 4.724 4.563 0.161 17765 1887 1 16 . 1 1 32 32 VAL H H 32 8.361 8.361 8.912 -0.551 17765 1888 1 16 . 1 1 33 33 VAL HA H 33 3.370 3.370 3.871 -0.501 17765 1889 1 16 . 1 1 33 33 VAL H H 33 8.635 8.635 8.723 -0.088 17765 1890 1 16 . 1 1 34 34 GLY H H 34 8.088 8.088 8.744 -0.656 17765 1891 1 16 . 1 1 35 35 VAL HA H 35 3.925 3.925 3.977 -0.052 17765 1892 1 16 . 1 1 35 35 VAL H H 35 7.785 7.785 7.667 0.118 17765 1893 1 16 . 1 1 36 36 ILE HA H 36 3.360 3.360 3.780 -0.420 17765 1894 1 16 . 1 1 36 36 ILE H H 36 8.614 8.614 8.266 0.348 17765 1895 1 16 . 1 1 37 37 GLY H H 37 9.037 9.037 9.002 0.035 17765 1896 1 16 . 1 1 38 38 SER HA H 38 4.495 4.495 4.579 -0.084 17765 1897 1 16 . 1 1 38 38 SER H H 38 8.150 8.150 7.755 0.395 17765 1898 1 16 . 1 1 39 39 GLN HA H 39 4.825 4.825 4.600 0.225 17765 1899 1 16 . 1 1 39 39 GLN H H 39 8.429 8.429 8.746 -0.317 17765 1900 1 16 . 1 1 40 40 CYS HA H 40 4.987 4.987 4.790 0.197 17765 1901 1 16 . 1 1 40 40 CYS H H 40 8.974 8.974 9.156 -0.182 17765 1902 1 16 . 1 1 41 41 GLY H H 41 9.375 9.375 8.800 0.575 17765 1903 1 16 . 1 1 42 42 ALA HA H 42 4.658 4.658 4.819 -0.161 17765 1904 1 16 . 1 1 42 42 ALA H H 42 7.131 7.131 7.458 -0.327 17765 1905 1 16 . 1 1 43 43 SER HA H 43 4.748 4.748 4.510 0.238 17765 1906 1 16 . 1 1 43 43 SER H H 43 8.325 8.325 8.446 -0.121 17765 1907 1 16 . 1 1 44 44 VAL HA H 44 4.652 4.652 4.562 0.090 17765 1908 1 16 . 1 1 44 44 VAL H H 44 8.784 8.784 8.419 0.365 17765 1909 1 16 . 1 1 45 45 LYS HA H 45 4.821 4.821 4.796 0.025 17765 1910 1 16 . 1 1 45 45 LYS H H 45 9.015 9.015 9.107 -0.092 17765 1911 1 16 . 1 1 46 46 CYS HA H 46 5.493 5.493 5.205 0.288 17765 1912 1 16 . 1 1 46 46 CYS H H 46 8.943 8.943 8.509 0.434 17765 1913 1 16 . 1 1 47 47 CYS HA H 47 5.677 5.677 5.367 0.310 17765 1914 1 16 . 1 1 47 47 CYS H H 47 9.513 9.513 8.615 0.898 17765 1915 1 16 . 1 1 48 48 LYS HA H 48 4.020 4.020 4.864 -0.844 17765 1916 1 16 . 1 1 48 48 LYS H H 48 8.226 8.226 8.350 -0.123 17765 1917 1 16 . 1 1 49 49 ASP HA H 49 4.570 4.570 4.671 -0.101 17765 1918 1 16 . 1 1 49 49 ASP H H 49 8.375 8.375 8.744 -0.369 17765 1919 1 16 . 1 1 50 50 ASP HA H 50 4.719 4.719 4.566 0.153 17765 1920 1 16 . 1 1 50 50 ASP H H 50 8.306 8.306 8.189 0.117 17765 1921 1 16 . 1 1 51 51 VAL HA H 51 4.196 4.196 4.527 -0.331 17765 1922 1 16 . 1 1 51 51 VAL H H 51 7.790 7.790 7.156 0.634 17765 1923 1 16 . 1 1 52 52 THR HA H 52 4.322 4.322 4.329 -0.007 17765 1924 1 16 . 1 1 52 52 THR H H 52 8.194 8.194 8.613 -0.419 17765 1925 1 16 . 1 1 53 53 ASN HA H 53 4.777 4.777 4.501 0.276 17765 1926 1 16 . 1 1 53 53 ASN H H 53 8.364 8.364 8.033 0.331 17765 1927 1 16 . 1 1 54 54 THR HA H 54 4.340 4.340 4.441 -0.101 17765 1928 1 16 . 1 1 54 54 THR H H 54 8.201 8.201 7.976 0.225 17765 1929 1 16 . 1 1 55 55 GLY H H 55 8.354 8.354 8.188 0.166 17765 1930 1 16 . 1 1 56 56 ASN HA H 56 4.729 4.729 4.563 0.166 17765 1931 1 16 . 1 1 56 56 ASN H H 56 8.397 8.397 8.174 0.223 17765 1932 1 16 . 1 1 57 57 SER HA H 57 4.485 4.485 4.542 -0.057 17765 1933 1 16 . 1 1 57 57 SER H H 57 8.205 8.205 8.460 -0.255 17765 1934 1 16 . 1 1 58 58 GLY H H 58 8.144 8.144 7.458 0.685 17765 1935 1 16 . 1 1 59 59 LEU HA H 59 4.485 4.485 4.756 -0.271 17765 1936 1 16 . 1 1 59 59 LEU H H 59 8.460 8.460 8.258 0.202 17765 1937 1 16 . 1 1 60 60 ILE HA H 60 4.794 4.794 4.463 0.331 17765 1938 1 16 . 1 1 60 60 ILE H H 60 8.195 8.195 8.491 -0.296 17765 1939 1 16 . 1 1 61 61 ILE HA H 61 4.151 4.151 4.244 -0.093 17765 1940 1 16 . 1 1 61 61 ILE H H 61 8.802 8.802 8.471 0.331 17765 1941 1 16 . 1 1 62 62 ASN HA H 62 4.617 4.617 4.982 -0.365 17765 1942 1 16 . 1 1 62 62 ASN H H 62 8.607 8.607 8.723 -0.116 17765 1943 1 16 . 1 1 63 63 ALA HA H 63 3.772 3.772 4.065 -0.293 17765 1944 1 16 . 1 1 63 63 ALA H H 63 8.735 8.735 8.886 -0.151 17765 1945 1 16 . 1 1 64 64 ALA HA H 64 4.211 4.211 4.072 0.139 17765 1946 1 16 . 1 1 64 64 ALA H H 64 8.354 8.354 8.429 -0.075 17765 1947 1 16 . 1 1 65 65 ASN HA H 65 4.849 4.849 4.868 -0.019 17765 1948 1 16 . 1 1 65 65 ASN H H 65 8.151 8.151 7.995 0.156 17765 1949 1 16 . 1 1 66 66 CYS HA H 66 5.624 5.624 4.940 0.684 17765 1950 1 16 . 1 1 66 66 CYS H H 66 7.698 7.698 7.606 0.092 17765 1951 1 16 . 1 1 67 67 VAL HA H 67 4.248 4.248 4.100 0.148 17765 1952 1 16 . 1 1 67 67 VAL H H 67 8.742 8.742 8.077 0.665 17765 1953 1 17 . 1 1 2 2 ALA HA H 2 4.562 4.562 4.659 -0.097 17765 1954 1 17 . 1 1 2 2 ALA H H 2 8.617 8.617 7.718 0.899 17765 1955 1 17 . 1 1 3 3 THR HA H 3 4.394 4.394 4.298 0.096 17765 1956 1 17 . 1 1 3 3 THR H H 3 8.142 8.142 8.333 -0.191 17765 1957 1 17 . 1 1 4 4 THR HA H 4 4.615 4.615 4.595 0.020 17765 1958 1 17 . 1 1 4 4 THR H H 4 8.659 8.659 8.507 0.152 17765 1959 1 17 . 1 1 5 5 ILE HA H 5 3.832 3.832 4.150 -0.318 17765 1960 1 17 . 1 1 5 5 ILE H H 5 8.634 8.634 9.128 -0.494 17765 1961 1 17 . 1 1 6 6 GLY H H 6 8.828 8.828 8.377 0.451 17765 1962 1 17 . 1 1 7 7 PRO HA H 7 4.254 4.254 4.084 0.170 17765 1963 1 17 . 1 1 8 8 ASN HA H 8 4.846 4.846 4.667 0.179 17765 1964 1 17 . 1 1 8 8 ASN H H 8 8.536 8.536 8.558 -0.022 17765 1965 1 17 . 1 1 9 9 THR HA H 9 3.758 3.758 4.403 -0.645 17765 1966 1 17 . 1 1 9 9 THR H H 9 7.559 7.559 7.843 -0.284 17765 1967 1 17 . 1 1 10 10 CYS HA H 10 4.897 4.897 4.755 0.142 17765 1968 1 17 . 1 1 10 10 CYS H H 10 8.554 8.554 7.878 0.676 17765 1969 1 17 . 1 1 11 11 SER HA H 11 4.441 4.441 4.907 -0.466 17765 1970 1 17 . 1 1 11 11 SER H H 11 8.488 8.488 8.820 -0.332 17765 1971 1 17 . 1 1 12 12 ILE HA H 12 4.126 4.126 4.301 -0.175 17765 1972 1 17 . 1 1 12 12 ILE H H 12 7.392 7.392 7.509 -0.117 17765 1973 1 17 . 1 1 13 13 ASP HA H 13 4.361 4.361 4.412 -0.051 17765 1974 1 17 . 1 1 13 13 ASP H H 13 8.694 8.694 8.111 0.583 17765 1975 1 17 . 1 1 14 14 ASP HA H 14 4.373 4.373 4.180 0.193 17765 1976 1 17 . 1 1 14 14 ASP H H 14 8.640 8.640 8.232 0.408 17765 1977 1 17 . 1 1 15 15 TYR HA H 15 4.639 4.639 4.964 -0.325 17765 1978 1 17 . 1 1 15 15 TYR H H 15 7.970 7.970 7.996 -0.026 17765 1979 1 17 . 1 1 16 16 LYS HA H 16 4.794 4.794 5.179 -0.385 17765 1980 1 17 . 1 1 16 16 LYS H H 16 8.655 8.655 8.491 0.164 17765 1981 1 17 . 1 1 17 17 PRO HA H 17 5.205 5.205 4.443 0.762 17765 1982 1 17 . 1 1 18 18 TYR HA H 18 4.653 4.653 5.148 -0.495 17765 1983 1 17 . 1 1 18 18 TYR H H 18 9.475 9.475 9.268 0.207 17765 1984 1 17 . 1 1 19 19 CYS HA H 19 5.358 5.358 4.884 0.474 17765 1985 1 17 . 1 1 19 19 CYS H H 19 9.004 9.004 9.269 -0.265 17765 1986 1 17 . 1 1 20 20 CYS HA H 20 5.597 5.597 4.643 0.954 17765 1987 1 17 . 1 1 20 20 CYS H H 20 9.838 9.838 8.777 1.061 17765 1988 1 17 . 1 1 21 21 GLN HA H 21 4.620 4.620 4.650 -0.030 17765 1989 1 17 . 1 1 21 21 GLN H H 21 8.900 8.900 8.164 0.736 17765 1990 1 17 . 1 1 22 22 SER HA H 22 4.461 4.461 4.153 0.308 17765 1991 1 17 . 1 1 22 22 SER H H 22 8.529 8.529 8.734 -0.205 17765 1992 1 17 . 1 1 23 23 MET HA H 23 4.632 4.632 4.523 0.109 17765 1993 1 17 . 1 1 23 23 MET H H 23 8.566 8.566 8.214 0.352 17765 1994 1 17 . 1 1 24 24 SER HA H 24 4.254 4.254 4.311 -0.057 17765 1995 1 17 . 1 1 24 24 SER H H 24 8.534 8.534 8.540 -0.006 17765 1996 1 17 . 1 1 25 25 GLY H H 25 8.729 8.729 8.712 0.017 17765 1997 1 17 . 1 1 26 26 SER HA H 26 4.575 4.575 3.940 0.635 17765 1998 1 17 . 1 1 26 26 SER H H 26 7.873 7.873 8.620 -0.747 17765 1999 1 17 . 1 1 27 27 ALA HA H 27 4.487 4.487 4.283 0.204 17765 2000 1 17 . 1 1 27 27 ALA H H 27 8.435 8.435 8.001 0.434 17765 2001 1 17 . 1 1 28 28 SER HA H 28 4.650 4.650 4.410 0.240 17765 2002 1 17 . 1 1 28 28 SER H H 28 8.134 8.134 7.619 0.515 17765 2003 1 17 . 1 1 29 29 LEU HA H 29 4.635 4.635 4.651 -0.016 17765 2004 1 17 . 1 1 29 29 LEU H H 29 8.763 8.763 7.730 1.033 17765 2005 1 17 . 1 1 30 30 GLY H H 30 8.580 8.580 8.404 0.176 17765 2006 1 17 . 1 1 31 31 CYS HA H 31 5.662 5.662 4.692 0.970 17765 2007 1 17 . 1 1 31 31 CYS H H 31 8.786 8.786 8.109 0.677 17765 2008 1 17 . 1 1 32 32 VAL HA H 32 4.724 4.724 4.562 0.162 17765 2009 1 17 . 1 1 32 32 VAL H H 32 8.361 8.361 7.931 0.430 17765 2010 1 17 . 1 1 33 33 VAL HA H 33 3.370 3.370 3.562 -0.192 17765 2011 1 17 . 1 1 33 33 VAL H H 33 8.635 8.635 8.561 0.074 17765 2012 1 17 . 1 1 34 34 GLY H H 34 8.088 8.088 8.285 -0.197 17765 2013 1 17 . 1 1 35 35 VAL HA H 35 3.925 3.925 4.010 -0.085 17765 2014 1 17 . 1 1 35 35 VAL H H 35 7.785 7.785 8.185 -0.400 17765 2015 1 17 . 1 1 36 36 ILE HA H 36 3.360 3.360 3.834 -0.474 17765 2016 1 17 . 1 1 36 36 ILE H H 36 8.614 8.614 8.469 0.145 17765 2017 1 17 . 1 1 37 37 GLY H H 37 9.037 9.037 8.716 0.321 17765 2018 1 17 . 1 1 38 38 SER HA H 38 4.495 4.495 4.764 -0.269 17765 2019 1 17 . 1 1 38 38 SER H H 38 8.150 8.150 8.123 0.027 17765 2020 1 17 . 1 1 39 39 GLN HA H 39 4.825 4.825 4.845 -0.020 17765 2021 1 17 . 1 1 39 39 GLN H H 39 8.429 8.429 8.433 -0.004 17765 2022 1 17 . 1 1 40 40 CYS HA H 40 4.987 4.987 4.623 0.364 17765 2023 1 17 . 1 1 40 40 CYS H H 40 8.974 8.974 8.784 0.190 17765 2024 1 17 . 1 1 41 41 GLY H H 41 9.375 9.375 9.012 0.363 17765 2025 1 17 . 1 1 42 42 ALA HA H 42 4.658 4.658 4.398 0.260 17765 2026 1 17 . 1 1 42 42 ALA H H 42 7.131 7.131 8.420 -1.289 17765 2027 1 17 . 1 1 43 43 SER HA H 43 4.748 4.748 4.706 0.042 17765 2028 1 17 . 1 1 43 43 SER H H 43 8.325 8.325 7.895 0.430 17765 2029 1 17 . 1 1 44 44 VAL HA H 44 4.652 4.652 4.449 0.203 17765 2030 1 17 . 1 1 44 44 VAL H H 44 8.784 8.784 8.658 0.126 17765 2031 1 17 . 1 1 45 45 LYS HA H 45 4.821 4.821 4.726 0.095 17765 2032 1 17 . 1 1 45 45 LYS H H 45 9.015 9.015 9.199 -0.184 17765 2033 1 17 . 1 1 46 46 CYS HA H 46 5.493 5.493 5.188 0.305 17765 2034 1 17 . 1 1 46 46 CYS H H 46 8.943 8.943 8.559 0.384 17765 2035 1 17 . 1 1 47 47 CYS HA H 47 5.677 5.677 4.662 1.015 17765 2036 1 17 . 1 1 47 47 CYS H H 47 9.513 9.513 8.561 0.952 17765 2037 1 17 . 1 1 48 48 LYS HA H 48 4.020 4.020 4.875 -0.855 17765 2038 1 17 . 1 1 48 48 LYS H H 48 8.226 8.226 8.590 -0.364 17765 2039 1 17 . 1 1 49 49 ASP HA H 49 4.570 4.570 4.498 0.072 17765 2040 1 17 . 1 1 49 49 ASP H H 49 8.375 8.375 9.122 -0.747 17765 2041 1 17 . 1 1 50 50 ASP HA H 50 4.719 4.719 4.488 0.231 17765 2042 1 17 . 1 1 50 50 ASP H H 50 8.306 8.306 8.135 0.171 17765 2043 1 17 . 1 1 51 51 VAL HA H 51 4.196 4.196 4.000 0.196 17765 2044 1 17 . 1 1 51 51 VAL H H 51 7.790 7.790 8.053 -0.263 17765 2045 1 17 . 1 1 52 52 THR HA H 52 4.322 4.322 4.491 -0.169 17765 2046 1 17 . 1 1 52 52 THR H H 52 8.194 8.194 8.551 -0.357 17765 2047 1 17 . 1 1 53 53 ASN HA H 53 4.777 4.777 4.592 0.185 17765 2048 1 17 . 1 1 53 53 ASN H H 53 8.364 8.364 8.618 -0.254 17765 2049 1 17 . 1 1 54 54 THR HA H 54 4.340 4.340 4.406 -0.066 17765 2050 1 17 . 1 1 54 54 THR H H 54 8.201 8.201 7.637 0.564 17765 2051 1 17 . 1 1 55 55 GLY H H 55 8.354 8.354 8.316 0.038 17765 2052 1 17 . 1 1 56 56 ASN HA H 56 4.729 4.729 4.976 -0.247 17765 2053 1 17 . 1 1 56 56 ASN H H 56 8.397 8.397 8.792 -0.395 17765 2054 1 17 . 1 1 57 57 SER HA H 57 4.485 4.485 4.493 -0.008 17765 2055 1 17 . 1 1 57 57 SER H H 57 8.205 8.205 8.330 -0.125 17765 2056 1 17 . 1 1 58 58 GLY H H 58 8.144 8.144 7.671 0.473 17765 2057 1 17 . 1 1 59 59 LEU HA H 59 4.485 4.485 4.585 -0.100 17765 2058 1 17 . 1 1 59 59 LEU H H 59 8.460 8.460 8.318 0.142 17765 2059 1 17 . 1 1 60 60 ILE HA H 60 4.794 4.794 4.256 0.538 17765 2060 1 17 . 1 1 60 60 ILE H H 60 8.195 8.195 8.414 -0.219 17765 2061 1 17 . 1 1 61 61 ILE HA H 61 4.151 4.151 4.267 -0.116 17765 2062 1 17 . 1 1 61 61 ILE H H 61 8.802 8.802 7.726 1.076 17765 2063 1 17 . 1 1 62 62 ASN HA H 62 4.617 4.617 4.693 -0.076 17765 2064 1 17 . 1 1 62 62 ASN H H 62 8.607 8.607 8.643 -0.036 17765 2065 1 17 . 1 1 63 63 ALA HA H 63 3.772 3.772 4.050 -0.278 17765 2066 1 17 . 1 1 63 63 ALA H H 63 8.735 8.735 8.880 -0.145 17765 2067 1 17 . 1 1 64 64 ALA HA H 64 4.211 4.211 4.136 0.075 17765 2068 1 17 . 1 1 64 64 ALA H H 64 8.354 8.354 8.171 0.183 17765 2069 1 17 . 1 1 65 65 ASN HA H 65 4.849 4.849 4.793 0.056 17765 2070 1 17 . 1 1 65 65 ASN H H 65 8.151 8.151 7.814 0.337 17765 2071 1 17 . 1 1 66 66 CYS HA H 66 5.624 5.624 4.847 0.777 17765 2072 1 17 . 1 1 66 66 CYS H H 66 7.698 7.698 7.268 0.430 17765 2073 1 17 . 1 1 67 67 VAL HA H 67 4.248 4.248 4.129 0.119 17765 2074 1 17 . 1 1 67 67 VAL H H 67 8.742 8.742 8.095 0.647 17765 2075 1 18 . 1 1 2 2 ALA HA H 2 4.562 4.562 4.660 -0.098 17765 2076 1 18 . 1 1 2 2 ALA H H 2 8.617 8.617 8.100 0.517 17765 2077 1 18 . 1 1 3 3 THR HA H 3 4.394 4.394 4.401 -0.007 17765 2078 1 18 . 1 1 3 3 THR H H 3 8.142 8.142 8.452 -0.310 17765 2079 1 18 . 1 1 4 4 THR HA H 4 4.615 4.615 4.512 0.103 17765 2080 1 18 . 1 1 4 4 THR H H 4 8.659 8.659 8.702 -0.043 17765 2081 1 18 . 1 1 5 5 ILE HA H 5 3.832 3.832 4.294 -0.462 17765 2082 1 18 . 1 1 5 5 ILE H H 5 8.634 8.634 9.033 -0.399 17765 2083 1 18 . 1 1 6 6 GLY H H 6 8.828 8.828 8.473 0.355 17765 2084 1 18 . 1 1 7 7 PRO HA H 7 4.254 4.254 4.310 -0.056 17765 2085 1 18 . 1 1 8 8 ASN HA H 8 4.846 4.846 4.705 0.141 17765 2086 1 18 . 1 1 8 8 ASN H H 8 8.536 8.536 8.137 0.399 17765 2087 1 18 . 1 1 9 9 THR HA H 9 3.758 3.758 4.299 -0.541 17765 2088 1 18 . 1 1 9 9 THR H H 9 7.559 7.559 7.706 -0.147 17765 2089 1 18 . 1 1 10 10 CYS HA H 10 4.897 4.897 4.637 0.260 17765 2090 1 18 . 1 1 10 10 CYS H H 10 8.554 8.554 8.263 0.291 17765 2091 1 18 . 1 1 11 11 SER HA H 11 4.441 4.441 4.714 -0.273 17765 2092 1 18 . 1 1 11 11 SER H H 11 8.488 8.488 8.842 -0.354 17765 2093 1 18 . 1 1 12 12 ILE HA H 12 4.126 4.126 4.081 0.045 17765 2094 1 18 . 1 1 12 12 ILE H H 12 7.392 7.392 8.054 -0.662 17765 2095 1 18 . 1 1 13 13 ASP HA H 13 4.361 4.361 4.558 -0.197 17765 2096 1 18 . 1 1 13 13 ASP H H 13 8.694 8.694 7.676 1.018 17765 2097 1 18 . 1 1 14 14 ASP HA H 14 4.373 4.373 4.571 -0.198 17765 2098 1 18 . 1 1 14 14 ASP H H 14 8.640 8.640 8.361 0.279 17765 2099 1 18 . 1 1 15 15 TYR HA H 15 4.639 4.639 4.779 -0.140 17765 2100 1 18 . 1 1 15 15 TYR H H 15 7.970 7.970 7.712 0.258 17765 2101 1 18 . 1 1 16 16 LYS HA H 16 4.794 4.794 4.895 -0.101 17765 2102 1 18 . 1 1 16 16 LYS H H 16 8.655 8.655 8.838 -0.183 17765 2103 1 18 . 1 1 17 17 PRO HA H 17 5.205 5.205 4.427 0.778 17765 2104 1 18 . 1 1 18 18 TYR HA H 18 4.653 4.653 5.100 -0.447 17765 2105 1 18 . 1 1 18 18 TYR H H 18 9.475 9.475 8.946 0.529 17765 2106 1 18 . 1 1 19 19 CYS HA H 19 5.358 5.358 4.816 0.542 17765 2107 1 18 . 1 1 19 19 CYS H H 19 9.004 9.004 9.156 -0.152 17765 2108 1 18 . 1 1 20 20 CYS HA H 20 5.597 5.597 4.581 1.016 17765 2109 1 18 . 1 1 20 20 CYS H H 20 9.838 9.838 8.774 1.064 17765 2110 1 18 . 1 1 21 21 GLN HA H 21 4.620 4.620 4.290 0.330 17765 2111 1 18 . 1 1 21 21 GLN H H 21 8.900 8.900 8.548 0.352 17765 2112 1 18 . 1 1 22 22 SER HA H 22 4.461 4.461 3.832 0.629 17765 2113 1 18 . 1 1 22 22 SER H H 22 8.529 8.529 8.807 -0.278 17765 2114 1 18 . 1 1 23 23 MET HA H 23 4.632 4.632 4.544 0.088 17765 2115 1 18 . 1 1 23 23 MET H H 23 8.566 8.566 7.973 0.593 17765 2116 1 18 . 1 1 24 24 SER HA H 24 4.254 4.254 4.578 -0.324 17765 2117 1 18 . 1 1 24 24 SER H H 24 8.534 8.534 9.054 -0.520 17765 2118 1 18 . 1 1 25 25 GLY H H 25 8.729 8.729 8.343 0.386 17765 2119 1 18 . 1 1 26 26 SER HA H 26 4.575 4.575 4.624 -0.049 17765 2120 1 18 . 1 1 26 26 SER H H 26 7.873 7.873 7.845 0.028 17765 2121 1 18 . 1 1 27 27 ALA HA H 27 4.487 4.487 4.380 0.107 17765 2122 1 18 . 1 1 27 27 ALA H H 27 8.435 8.435 8.616 -0.181 17765 2123 1 18 . 1 1 28 28 SER HA H 28 4.650 4.650 4.598 0.052 17765 2124 1 18 . 1 1 28 28 SER H H 28 8.134 8.134 7.643 0.491 17765 2125 1 18 . 1 1 29 29 LEU HA H 29 4.635 4.635 4.679 -0.044 17765 2126 1 18 . 1 1 29 29 LEU H H 29 8.763 8.763 8.542 0.221 17765 2127 1 18 . 1 1 30 30 GLY H H 30 8.580 8.580 8.693 -0.113 17765 2128 1 18 . 1 1 31 31 CYS HA H 31 5.662 5.662 4.675 0.987 17765 2129 1 18 . 1 1 31 31 CYS H H 31 8.786 8.786 8.060 0.726 17765 2130 1 18 . 1 1 32 32 VAL HA H 32 4.724 4.724 4.491 0.233 17765 2131 1 18 . 1 1 32 32 VAL H H 32 8.361 8.361 7.836 0.525 17765 2132 1 18 . 1 1 33 33 VAL HA H 33 3.370 3.370 3.858 -0.488 17765 2133 1 18 . 1 1 33 33 VAL H H 33 8.635 8.635 8.497 0.138 17765 2134 1 18 . 1 1 34 34 GLY H H 34 8.088 8.088 8.393 -0.305 17765 2135 1 18 . 1 1 35 35 VAL HA H 35 3.925 3.925 4.113 -0.188 17765 2136 1 18 . 1 1 35 35 VAL H H 35 7.785 7.785 7.818 -0.033 17765 2137 1 18 . 1 1 36 36 ILE HA H 36 3.360 3.360 3.930 -0.570 17765 2138 1 18 . 1 1 36 36 ILE H H 36 8.614 8.614 8.601 0.013 17765 2139 1 18 . 1 1 37 37 GLY H H 37 9.037 9.037 9.250 -0.213 17765 2140 1 18 . 1 1 38 38 SER HA H 38 4.495 4.495 4.695 -0.200 17765 2141 1 18 . 1 1 38 38 SER H H 38 8.150 8.150 8.121 0.029 17765 2142 1 18 . 1 1 39 39 GLN HA H 39 4.825 4.825 4.562 0.263 17765 2143 1 18 . 1 1 39 39 GLN H H 39 8.429 8.429 8.626 -0.197 17765 2144 1 18 . 1 1 40 40 CYS HA H 40 4.987 4.987 4.572 0.415 17765 2145 1 18 . 1 1 40 40 CYS H H 40 8.974 8.974 8.986 -0.012 17765 2146 1 18 . 1 1 41 41 GLY H H 41 9.375 9.375 8.900 0.475 17765 2147 1 18 . 1 1 42 42 ALA HA H 42 4.658 4.658 4.595 0.063 17765 2148 1 18 . 1 1 42 42 ALA H H 42 7.131 7.131 7.336 -0.205 17765 2149 1 18 . 1 1 43 43 SER HA H 43 4.748 4.748 4.454 0.294 17765 2150 1 18 . 1 1 43 43 SER H H 43 8.325 8.325 8.462 -0.137 17765 2151 1 18 . 1 1 44 44 VAL HA H 44 4.652 4.652 3.982 0.670 17765 2152 1 18 . 1 1 44 44 VAL H H 44 8.784 8.784 8.607 0.177 17765 2153 1 18 . 1 1 45 45 LYS HA H 45 4.821 4.821 4.606 0.215 17765 2154 1 18 . 1 1 45 45 LYS H H 45 9.015 9.015 8.584 0.431 17765 2155 1 18 . 1 1 46 46 CYS HA H 46 5.493 5.493 4.971 0.522 17765 2156 1 18 . 1 1 46 46 CYS H H 46 8.943 8.943 8.997 -0.054 17765 2157 1 18 . 1 1 47 47 CYS HA H 47 5.677 5.677 4.797 0.880 17765 2158 1 18 . 1 1 47 47 CYS H H 47 9.513 9.513 8.577 0.936 17765 2159 1 18 . 1 1 48 48 LYS HA H 48 4.020 4.020 4.875 -0.855 17765 2160 1 18 . 1 1 48 48 LYS H H 48 8.226 8.226 8.787 -0.561 17765 2161 1 18 . 1 1 49 49 ASP HA H 49 4.570 4.570 4.614 -0.044 17765 2162 1 18 . 1 1 49 49 ASP H H 49 8.375 8.375 8.941 -0.566 17765 2163 1 18 . 1 1 50 50 ASP HA H 50 4.719 4.719 4.898 -0.179 17765 2164 1 18 . 1 1 50 50 ASP H H 50 8.306 8.306 7.982 0.324 17765 2165 1 18 . 1 1 51 51 VAL HA H 51 4.196 4.196 4.497 -0.301 17765 2166 1 18 . 1 1 51 51 VAL H H 51 7.790 7.790 8.310 -0.520 17765 2167 1 18 . 1 1 52 52 THR HA H 52 4.322 4.322 3.934 0.388 17765 2168 1 18 . 1 1 52 52 THR H H 52 8.194 8.194 8.370 -0.176 17765 2169 1 18 . 1 1 53 53 ASN HA H 53 4.777 4.777 4.907 -0.130 17765 2170 1 18 . 1 1 53 53 ASN H H 53 8.364 8.364 7.979 0.385 17765 2171 1 18 . 1 1 54 54 THR HA H 54 4.340 4.340 4.526 -0.186 17765 2172 1 18 . 1 1 54 54 THR H H 54 8.201 8.201 8.522 -0.321 17765 2173 1 18 . 1 1 55 55 GLY H H 55 8.354 8.354 8.311 0.043 17765 2174 1 18 . 1 1 56 56 ASN HA H 56 4.729 4.729 4.754 -0.025 17765 2175 1 18 . 1 1 56 56 ASN H H 56 8.397 8.397 8.488 -0.091 17765 2176 1 18 . 1 1 57 57 SER HA H 57 4.485 4.485 4.530 -0.045 17765 2177 1 18 . 1 1 57 57 SER H H 57 8.205 8.205 8.369 -0.164 17765 2178 1 18 . 1 1 58 58 GLY H H 58 8.144 8.144 7.917 0.227 17765 2179 1 18 . 1 1 59 59 LEU HA H 59 4.485 4.485 4.693 -0.208 17765 2180 1 18 . 1 1 59 59 LEU H H 59 8.460 8.460 7.992 0.468 17765 2181 1 18 . 1 1 60 60 ILE HA H 60 4.794 4.794 4.498 0.296 17765 2182 1 18 . 1 1 60 60 ILE H H 60 8.195 8.195 8.341 -0.146 17765 2183 1 18 . 1 1 61 61 ILE HA H 61 4.151 4.151 3.944 0.207 17765 2184 1 18 . 1 1 61 61 ILE H H 61 8.802 8.802 7.362 1.440 17765 2185 1 18 . 1 1 62 62 ASN HA H 62 4.617 4.617 4.571 0.046 17765 2186 1 18 . 1 1 62 62 ASN H H 62 8.607 8.607 8.962 -0.355 17765 2187 1 18 . 1 1 63 63 ALA HA H 63 3.772 3.772 3.807 -0.035 17765 2188 1 18 . 1 1 63 63 ALA H H 63 8.735 8.735 8.098 0.637 17765 2189 1 18 . 1 1 64 64 ALA HA H 64 4.211 4.211 4.229 -0.018 17765 2190 1 18 . 1 1 64 64 ALA H H 64 8.354 8.354 7.937 0.417 17765 2191 1 18 . 1 1 65 65 ASN HA H 65 4.849 4.849 4.895 -0.046 17765 2192 1 18 . 1 1 65 65 ASN H H 65 8.151 8.151 8.469 -0.318 17765 2193 1 18 . 1 1 66 66 CYS HA H 66 5.624 5.624 4.733 0.891 17765 2194 1 18 . 1 1 66 66 CYS H H 66 7.698 7.698 7.486 0.212 17765 2195 1 18 . 1 1 67 67 VAL HA H 67 4.248 4.248 3.996 0.252 17765 2196 1 18 . 1 1 67 67 VAL H H 67 8.742 8.742 8.118 0.624 17765 2197 1 19 . 1 1 2 2 ALA HA H 2 4.562 4.562 5.036 -0.474 17765 2198 1 19 . 1 1 2 2 ALA H H 2 8.617 8.617 8.315 0.302 17765 2199 1 19 . 1 1 3 3 THR HA H 3 4.394 4.394 4.538 -0.144 17765 2200 1 19 . 1 1 3 3 THR H H 3 8.142 8.142 8.238 -0.096 17765 2201 1 19 . 1 1 4 4 THR HA H 4 4.615 4.615 4.706 -0.091 17765 2202 1 19 . 1 1 4 4 THR H H 4 8.659 8.659 8.611 0.048 17765 2203 1 19 . 1 1 5 5 ILE HA H 5 3.832 3.832 4.184 -0.352 17765 2204 1 19 . 1 1 5 5 ILE H H 5 8.634 8.634 9.093 -0.459 17765 2205 1 19 . 1 1 6 6 GLY H H 6 8.828 8.828 8.244 0.584 17765 2206 1 19 . 1 1 7 7 PRO HA H 7 4.254 4.254 4.444 -0.190 17765 2207 1 19 . 1 1 8 8 ASN HA H 8 4.846 4.846 4.853 -0.007 17765 2208 1 19 . 1 1 8 8 ASN H H 8 8.536 8.536 8.428 0.108 17765 2209 1 19 . 1 1 9 9 THR HA H 9 3.758 3.758 4.278 -0.520 17765 2210 1 19 . 1 1 9 9 THR H H 9 7.559 7.559 7.897 -0.338 17765 2211 1 19 . 1 1 10 10 CYS HA H 10 4.897 4.897 4.765 0.132 17765 2212 1 19 . 1 1 10 10 CYS H H 10 8.554 8.554 8.439 0.115 17765 2213 1 19 . 1 1 11 11 SER HA H 11 4.441 4.441 4.690 -0.249 17765 2214 1 19 . 1 1 11 11 SER H H 11 8.488 8.488 8.809 -0.321 17765 2215 1 19 . 1 1 12 12 ILE HA H 12 4.126 4.126 4.205 -0.079 17765 2216 1 19 . 1 1 12 12 ILE H H 12 7.392 7.392 7.949 -0.557 17765 2217 1 19 . 1 1 13 13 ASP HA H 13 4.361 4.361 4.682 -0.321 17765 2218 1 19 . 1 1 13 13 ASP H H 13 8.694 8.694 8.109 0.585 17765 2219 1 19 . 1 1 14 14 ASP HA H 14 4.373 4.373 4.590 -0.217 17765 2220 1 19 . 1 1 14 14 ASP H H 14 8.640 8.640 8.396 0.244 17765 2221 1 19 . 1 1 15 15 TYR HA H 15 4.639 4.639 4.683 -0.044 17765 2222 1 19 . 1 1 15 15 TYR H H 15 7.970 7.970 7.511 0.459 17765 2223 1 19 . 1 1 16 16 LYS HA H 16 4.794 4.794 4.863 -0.069 17765 2224 1 19 . 1 1 16 16 LYS H H 16 8.655 8.655 8.428 0.227 17765 2225 1 19 . 1 1 17 17 PRO HA H 17 5.205 5.205 4.623 0.582 17765 2226 1 19 . 1 1 18 18 TYR HA H 18 4.653 4.653 5.138 -0.485 17765 2227 1 19 . 1 1 18 18 TYR H H 18 9.475 9.475 9.427 0.048 17765 2228 1 19 . 1 1 19 19 CYS HA H 19 5.358 5.358 4.968 0.390 17765 2229 1 19 . 1 1 19 19 CYS H H 19 9.004 9.004 9.281 -0.277 17765 2230 1 19 . 1 1 20 20 CYS HA H 20 5.597 5.597 5.049 0.548 17765 2231 1 19 . 1 1 20 20 CYS H H 20 9.838 9.838 9.235 0.603 17765 2232 1 19 . 1 1 21 21 GLN HA H 21 4.620 4.620 4.611 0.009 17765 2233 1 19 . 1 1 21 21 GLN H H 21 8.900 8.900 8.477 0.423 17765 2234 1 19 . 1 1 22 22 SER HA H 22 4.461 4.461 4.397 0.064 17765 2235 1 19 . 1 1 22 22 SER H H 22 8.529 8.529 8.307 0.222 17765 2236 1 19 . 1 1 23 23 MET HA H 23 4.632 4.632 4.712 -0.080 17765 2237 1 19 . 1 1 23 23 MET H H 23 8.566 8.566 8.121 0.445 17765 2238 1 19 . 1 1 24 24 SER HA H 24 4.254 4.254 4.291 -0.037 17765 2239 1 19 . 1 1 24 24 SER H H 24 8.534 8.534 8.812 -0.278 17765 2240 1 19 . 1 1 25 25 GLY H H 25 8.729 8.729 8.342 0.387 17765 2241 1 19 . 1 1 26 26 SER HA H 26 4.575 4.575 4.531 0.044 17765 2242 1 19 . 1 1 26 26 SER H H 26 7.873 7.873 7.895 -0.022 17765 2243 1 19 . 1 1 27 27 ALA HA H 27 4.487 4.487 4.325 0.162 17765 2244 1 19 . 1 1 27 27 ALA H H 27 8.435 8.435 8.604 -0.169 17765 2245 1 19 . 1 1 28 28 SER HA H 28 4.650 4.650 5.230 -0.580 17765 2246 1 19 . 1 1 28 28 SER H H 28 8.134 8.134 8.085 0.049 17765 2247 1 19 . 1 1 29 29 LEU HA H 29 4.635 4.635 4.778 -0.143 17765 2248 1 19 . 1 1 29 29 LEU H H 29 8.763 8.763 9.038 -0.275 17765 2249 1 19 . 1 1 30 30 GLY H H 30 8.580 8.580 8.509 0.071 17765 2250 1 19 . 1 1 31 31 CYS HA H 31 5.662 5.662 4.814 0.848 17765 2251 1 19 . 1 1 31 31 CYS H H 31 8.786 8.786 7.865 0.921 17765 2252 1 19 . 1 1 32 32 VAL HA H 32 4.724 4.724 4.717 0.007 17765 2253 1 19 . 1 1 32 32 VAL H H 32 8.361 8.361 8.764 -0.403 17765 2254 1 19 . 1 1 33 33 VAL HA H 33 3.370 3.370 3.456 -0.086 17765 2255 1 19 . 1 1 33 33 VAL H H 33 8.635 8.635 8.437 0.198 17765 2256 1 19 . 1 1 34 34 GLY H H 34 8.088 8.088 8.371 -0.283 17765 2257 1 19 . 1 1 35 35 VAL HA H 35 3.925 3.925 3.980 -0.055 17765 2258 1 19 . 1 1 35 35 VAL H H 35 7.785 7.785 8.195 -0.410 17765 2259 1 19 . 1 1 36 36 ILE HA H 36 3.360 3.360 3.866 -0.506 17765 2260 1 19 . 1 1 36 36 ILE H H 36 8.614 8.614 8.680 -0.066 17765 2261 1 19 . 1 1 37 37 GLY H H 37 9.037 9.037 9.034 0.003 17765 2262 1 19 . 1 1 38 38 SER HA H 38 4.495 4.495 4.831 -0.336 17765 2263 1 19 . 1 1 38 38 SER H H 38 8.150 8.150 7.846 0.304 17765 2264 1 19 . 1 1 39 39 GLN HA H 39 4.825 4.825 5.110 -0.285 17765 2265 1 19 . 1 1 39 39 GLN H H 39 8.429 8.429 8.531 -0.102 17765 2266 1 19 . 1 1 40 40 CYS HA H 40 4.987 4.987 5.007 -0.020 17765 2267 1 19 . 1 1 40 40 CYS H H 40 8.974 8.974 9.009 -0.035 17765 2268 1 19 . 1 1 41 41 GLY H H 41 9.375 9.375 8.934 0.441 17765 2269 1 19 . 1 1 42 42 ALA HA H 42 4.658 4.658 4.990 -0.332 17765 2270 1 19 . 1 1 42 42 ALA H H 42 7.131 7.131 7.523 -0.392 17765 2271 1 19 . 1 1 43 43 SER HA H 43 4.748 4.748 4.622 0.126 17765 2272 1 19 . 1 1 43 43 SER H H 43 8.325 8.325 8.343 -0.018 17765 2273 1 19 . 1 1 44 44 VAL HA H 44 4.652 4.652 4.411 0.241 17765 2274 1 19 . 1 1 44 44 VAL H H 44 8.784 8.784 8.632 0.152 17765 2275 1 19 . 1 1 45 45 LYS HA H 45 4.821 4.821 4.750 0.071 17765 2276 1 19 . 1 1 45 45 LYS H H 45 9.015 9.015 9.243 -0.228 17765 2277 1 19 . 1 1 46 46 CYS HA H 46 5.493 5.493 5.556 -0.063 17765 2278 1 19 . 1 1 46 46 CYS H H 46 8.943 8.943 8.759 0.184 17765 2279 1 19 . 1 1 47 47 CYS HA H 47 5.677 5.677 5.312 0.365 17765 2280 1 19 . 1 1 47 47 CYS H H 47 9.513 9.513 8.789 0.724 17765 2281 1 19 . 1 1 48 48 LYS HA H 48 4.020 4.020 4.586 -0.566 17765 2282 1 19 . 1 1 48 48 LYS H H 48 8.226 8.226 7.989 0.237 17765 2283 1 19 . 1 1 49 49 ASP HA H 49 4.570 4.570 4.318 0.252 17765 2284 1 19 . 1 1 49 49 ASP H H 49 8.375 8.375 8.552 -0.177 17765 2285 1 19 . 1 1 50 50 ASP HA H 50 4.719 4.719 4.553 0.166 17765 2286 1 19 . 1 1 50 50 ASP H H 50 8.306 8.306 8.171 0.135 17765 2287 1 19 . 1 1 51 51 VAL HA H 51 4.196 4.196 4.369 -0.173 17765 2288 1 19 . 1 1 51 51 VAL H H 51 7.790 7.790 8.040 -0.250 17765 2289 1 19 . 1 1 52 52 THR HA H 52 4.322 4.322 4.333 -0.011 17765 2290 1 19 . 1 1 52 52 THR H H 52 8.194 8.194 7.842 0.352 17765 2291 1 19 . 1 1 53 53 ASN HA H 53 4.777 4.777 4.360 0.417 17765 2292 1 19 . 1 1 53 53 ASN H H 53 8.364 8.364 8.215 0.149 17765 2293 1 19 . 1 1 54 54 THR HA H 54 4.340 4.340 4.449 -0.109 17765 2294 1 19 . 1 1 54 54 THR H H 54 8.201 8.201 8.115 0.086 17765 2295 1 19 . 1 1 55 55 GLY H H 55 8.354 8.354 8.334 0.020 17765 2296 1 19 . 1 1 56 56 ASN HA H 56 4.729 4.729 4.891 -0.162 17765 2297 1 19 . 1 1 56 56 ASN H H 56 8.397 8.397 8.485 -0.088 17765 2298 1 19 . 1 1 57 57 SER HA H 57 4.485 4.485 4.495 -0.010 17765 2299 1 19 . 1 1 57 57 SER H H 57 8.205 8.205 8.528 -0.323 17765 2300 1 19 . 1 1 58 58 GLY H H 58 8.144 8.144 7.882 0.262 17765 2301 1 19 . 1 1 59 59 LEU HA H 59 4.485 4.485 4.738 -0.253 17765 2302 1 19 . 1 1 59 59 LEU H H 59 8.460 8.460 8.588 -0.128 17765 2303 1 19 . 1 1 60 60 ILE HA H 60 4.794 4.794 4.451 0.343 17765 2304 1 19 . 1 1 60 60 ILE H H 60 8.195 8.195 8.370 -0.175 17765 2305 1 19 . 1 1 61 61 ILE HA H 61 4.151 4.151 4.507 -0.356 17765 2306 1 19 . 1 1 61 61 ILE H H 61 8.802 8.802 8.956 -0.154 17765 2307 1 19 . 1 1 62 62 ASN HA H 62 4.617 4.617 4.805 -0.188 17765 2308 1 19 . 1 1 62 62 ASN H H 62 8.607 8.607 8.765 -0.158 17765 2309 1 19 . 1 1 63 63 ALA HA H 63 3.772 3.772 4.355 -0.583 17765 2310 1 19 . 1 1 63 63 ALA H H 63 8.735 8.735 8.511 0.224 17765 2311 1 19 . 1 1 64 64 ALA HA H 64 4.211 4.211 3.930 0.281 17765 2312 1 19 . 1 1 64 64 ALA H H 64 8.354 8.354 8.423 -0.069 17765 2313 1 19 . 1 1 65 65 ASN HA H 65 4.849 4.849 4.936 -0.087 17765 2314 1 19 . 1 1 65 65 ASN H H 65 8.151 8.151 8.375 -0.224 17765 2315 1 19 . 1 1 66 66 CYS HA H 66 5.624 5.624 5.355 0.269 17765 2316 1 19 . 1 1 66 66 CYS H H 66 7.698 7.698 7.575 0.123 17765 2317 1 19 . 1 1 67 67 VAL HA H 67 4.248 4.248 4.724 -0.476 17765 2318 1 19 . 1 1 67 67 VAL H H 67 8.742 8.742 9.001 -0.259 17765 2319 1 20 . 1 1 2 2 ALA HA H 2 4.562 4.562 4.643 -0.081 17765 2320 1 20 . 1 1 2 2 ALA H H 2 8.617 8.617 8.613 0.004 17765 2321 1 20 . 1 1 3 3 THR HA H 3 4.394 4.394 4.378 0.016 17765 2322 1 20 . 1 1 3 3 THR H H 3 8.142 8.142 8.010 0.132 17765 2323 1 20 . 1 1 4 4 THR HA H 4 4.615 4.615 4.906 -0.291 17765 2324 1 20 . 1 1 4 4 THR H H 4 8.659 8.659 8.556 0.103 17765 2325 1 20 . 1 1 5 5 ILE HA H 5 3.832 3.832 4.349 -0.517 17765 2326 1 20 . 1 1 5 5 ILE H H 5 8.634 8.634 9.135 -0.501 17765 2327 1 20 . 1 1 6 6 GLY H H 6 8.828 8.828 8.151 0.677 17765 2328 1 20 . 1 1 7 7 PRO HA H 7 4.254 4.254 4.222 0.032 17765 2329 1 20 . 1 1 8 8 ASN HA H 8 4.846 4.846 4.643 0.203 17765 2330 1 20 . 1 1 8 8 ASN H H 8 8.536 8.536 8.417 0.119 17765 2331 1 20 . 1 1 9 9 THR HA H 9 3.758 3.758 4.441 -0.683 17765 2332 1 20 . 1 1 9 9 THR H H 9 7.559 7.559 7.935 -0.376 17765 2333 1 20 . 1 1 10 10 CYS HA H 10 4.897 4.897 4.752 0.145 17765 2334 1 20 . 1 1 10 10 CYS H H 10 8.554 8.554 8.346 0.208 17765 2335 1 20 . 1 1 11 11 SER HA H 11 4.441 4.441 4.718 -0.277 17765 2336 1 20 . 1 1 11 11 SER H H 11 8.488 8.488 8.651 -0.163 17765 2337 1 20 . 1 1 12 12 ILE HA H 12 4.126 4.126 4.258 -0.132 17765 2338 1 20 . 1 1 12 12 ILE H H 12 7.392 7.392 7.864 -0.472 17765 2339 1 20 . 1 1 13 13 ASP HA H 13 4.361 4.361 4.626 -0.265 17765 2340 1 20 . 1 1 13 13 ASP H H 13 8.694 8.694 7.994 0.700 17765 2341 1 20 . 1 1 14 14 ASP HA H 14 4.373 4.373 4.588 -0.215 17765 2342 1 20 . 1 1 14 14 ASP H H 14 8.640 8.640 8.345 0.295 17765 2343 1 20 . 1 1 15 15 TYR HA H 15 4.639 4.639 4.798 -0.159 17765 2344 1 20 . 1 1 15 15 TYR H H 15 7.970 7.970 7.477 0.493 17765 2345 1 20 . 1 1 16 16 LYS HA H 16 4.794 4.794 4.864 -0.070 17765 2346 1 20 . 1 1 16 16 LYS H H 16 8.655 8.655 9.051 -0.396 17765 2347 1 20 . 1 1 17 17 PRO HA H 17 5.205 5.205 4.543 0.662 17765 2348 1 20 . 1 1 18 18 TYR HA H 18 4.653 4.653 5.090 -0.437 17765 2349 1 20 . 1 1 18 18 TYR H H 18 9.475 9.475 9.255 0.220 17765 2350 1 20 . 1 1 19 19 CYS HA H 19 5.358 5.358 4.808 0.550 17765 2351 1 20 . 1 1 19 19 CYS H H 19 9.004 9.004 9.339 -0.335 17765 2352 1 20 . 1 1 20 20 CYS HA H 20 5.597 5.597 4.583 1.014 17765 2353 1 20 . 1 1 20 20 CYS H H 20 9.838 9.838 9.058 0.780 17765 2354 1 20 . 1 1 21 21 GLN HA H 21 4.620 4.620 4.430 0.190 17765 2355 1 20 . 1 1 21 21 GLN H H 21 8.900 8.900 8.296 0.604 17765 2356 1 20 . 1 1 22 22 SER HA H 22 4.461 4.461 4.739 -0.278 17765 2357 1 20 . 1 1 22 22 SER H H 22 8.529 8.529 7.954 0.575 17765 2358 1 20 . 1 1 23 23 MET HA H 23 4.632 4.632 4.583 0.049 17765 2359 1 20 . 1 1 23 23 MET H H 23 8.566 8.566 8.539 0.027 17765 2360 1 20 . 1 1 24 24 SER HA H 24 4.254 4.254 4.343 -0.089 17765 2361 1 20 . 1 1 24 24 SER H H 24 8.534 8.534 8.614 -0.080 17765 2362 1 20 . 1 1 25 25 GLY H H 25 8.729 8.729 8.189 0.540 17765 2363 1 20 . 1 1 26 26 SER HA H 26 4.575 4.575 4.728 -0.153 17765 2364 1 20 . 1 1 26 26 SER H H 26 7.873 7.873 7.602 0.271 17765 2365 1 20 . 1 1 27 27 ALA HA H 27 4.487 4.487 4.477 0.010 17765 2366 1 20 . 1 1 27 27 ALA H H 27 8.435 8.435 8.238 0.197 17765 2367 1 20 . 1 1 28 28 SER HA H 28 4.650 4.650 4.149 0.501 17765 2368 1 20 . 1 1 28 28 SER H H 28 8.134 8.134 8.850 -0.716 17765 2369 1 20 . 1 1 29 29 LEU HA H 29 4.635 4.635 4.222 0.413 17765 2370 1 20 . 1 1 29 29 LEU H H 29 8.763 8.763 8.821 -0.058 17765 2371 1 20 . 1 1 30 30 GLY H H 30 8.580 8.580 9.088 -0.508 17765 2372 1 20 . 1 1 31 31 CYS HA H 31 5.662 5.662 5.059 0.603 17765 2373 1 20 . 1 1 31 31 CYS H H 31 8.786 8.786 8.004 0.782 17765 2374 1 20 . 1 1 32 32 VAL HA H 32 4.724 4.724 4.368 0.356 17765 2375 1 20 . 1 1 32 32 VAL H H 32 8.361 8.361 8.039 0.322 17765 2376 1 20 . 1 1 33 33 VAL HA H 33 3.370 3.370 3.685 -0.315 17765 2377 1 20 . 1 1 33 33 VAL H H 33 8.635 8.635 8.592 0.043 17765 2378 1 20 . 1 1 34 34 GLY H H 34 8.088 8.088 8.231 -0.143 17765 2379 1 20 . 1 1 35 35 VAL HA H 35 3.925 3.925 3.972 -0.047 17765 2380 1 20 . 1 1 35 35 VAL H H 35 7.785 7.785 7.900 -0.115 17765 2381 1 20 . 1 1 36 36 ILE HA H 36 3.360 3.360 3.985 -0.625 17765 2382 1 20 . 1 1 36 36 ILE H H 36 8.614 8.614 8.557 0.057 17765 2383 1 20 . 1 1 37 37 GLY H H 37 9.037 9.037 9.057 -0.020 17765 2384 1 20 . 1 1 38 38 SER HA H 38 4.495 4.495 4.802 -0.307 17765 2385 1 20 . 1 1 38 38 SER H H 38 8.150 8.150 7.787 0.363 17765 2386 1 20 . 1 1 39 39 GLN HA H 39 4.825 4.825 4.890 -0.065 17765 2387 1 20 . 1 1 39 39 GLN H H 39 8.429 8.429 8.465 -0.036 17765 2388 1 20 . 1 1 40 40 CYS HA H 40 4.987 4.987 4.689 0.298 17765 2389 1 20 . 1 1 40 40 CYS H H 40 8.974 8.974 8.993 -0.019 17765 2390 1 20 . 1 1 41 41 GLY H H 41 9.375 9.375 8.967 0.408 17765 2391 1 20 . 1 1 42 42 ALA HA H 42 4.658 4.658 4.559 0.100 17765 2392 1 20 . 1 1 42 42 ALA H H 42 7.131 7.131 7.329 -0.198 17765 2393 1 20 . 1 1 43 43 SER HA H 43 4.748 4.748 4.356 0.392 17765 2394 1 20 . 1 1 43 43 SER H H 43 8.325 8.325 8.373 -0.048 17765 2395 1 20 . 1 1 44 44 VAL HA H 44 4.652 4.652 4.449 0.203 17765 2396 1 20 . 1 1 44 44 VAL H H 44 8.784 8.784 8.198 0.586 17765 2397 1 20 . 1 1 45 45 LYS HA H 45 4.821 4.821 4.770 0.051 17765 2398 1 20 . 1 1 45 45 LYS H H 45 9.015 9.015 9.281 -0.266 17765 2399 1 20 . 1 1 46 46 CYS HA H 46 5.493 5.493 5.848 -0.355 17765 2400 1 20 . 1 1 46 46 CYS H H 46 8.943 8.943 8.066 0.877 17765 2401 1 20 . 1 1 47 47 CYS HA H 47 5.677 5.677 5.820 -0.143 17765 2402 1 20 . 1 1 47 47 CYS H H 47 9.513 9.513 9.211 0.302 17765 2403 1 20 . 1 1 48 48 LYS HA H 48 4.020 4.020 4.921 -0.901 17765 2404 1 20 . 1 1 48 48 LYS H H 48 8.226 8.226 8.823 -0.597 17765 2405 1 20 . 1 1 49 49 ASP HA H 49 4.570 4.570 4.720 -0.150 17765 2406 1 20 . 1 1 49 49 ASP H H 49 8.375 8.375 8.961 -0.586 17765 2407 1 20 . 1 1 50 50 ASP HA H 50 4.719 4.719 4.530 0.189 17765 2408 1 20 . 1 1 50 50 ASP H H 50 8.306 8.306 7.982 0.324 17765 2409 1 20 . 1 1 51 51 VAL HA H 51 4.196 4.196 4.110 0.086 17765 2410 1 20 . 1 1 51 51 VAL H H 51 7.790 7.790 7.802 -0.012 17765 2411 1 20 . 1 1 52 52 THR HA H 52 4.322 4.322 4.200 0.122 17765 2412 1 20 . 1 1 52 52 THR H H 52 8.194 8.194 8.329 -0.135 17765 2413 1 20 . 1 1 53 53 ASN HA H 53 4.777 4.777 4.810 -0.033 17765 2414 1 20 . 1 1 53 53 ASN H H 53 8.364 8.364 8.079 0.285 17765 2415 1 20 . 1 1 54 54 THR HA H 54 4.340 4.340 4.178 0.162 17765 2416 1 20 . 1 1 54 54 THR H H 54 8.201 8.201 7.849 0.352 17765 2417 1 20 . 1 1 55 55 GLY H H 55 8.354 8.354 8.336 0.018 17765 2418 1 20 . 1 1 56 56 ASN HA H 56 4.729 4.729 4.435 0.294 17765 2419 1 20 . 1 1 56 56 ASN H H 56 8.397 8.397 8.618 -0.221 17765 2420 1 20 . 1 1 57 57 SER HA H 57 4.485 4.485 4.454 0.031 17765 2421 1 20 . 1 1 57 57 SER H H 57 8.205 8.205 8.522 -0.317 17765 2422 1 20 . 1 1 58 58 GLY H H 58 8.144 8.144 7.713 0.431 17765 2423 1 20 . 1 1 59 59 LEU HA H 59 4.485 4.485 4.814 -0.329 17765 2424 1 20 . 1 1 59 59 LEU H H 59 8.460 8.460 8.036 0.424 17765 2425 1 20 . 1 1 60 60 ILE HA H 60 4.794 4.794 4.368 0.426 17765 2426 1 20 . 1 1 60 60 ILE H H 60 8.195 8.195 8.065 0.130 17765 2427 1 20 . 1 1 61 61 ILE HA H 61 4.151 4.151 3.980 0.171 17765 2428 1 20 . 1 1 61 61 ILE H H 61 8.802 8.802 7.707 1.095 17765 2429 1 20 . 1 1 62 62 ASN HA H 62 4.617 4.617 4.303 0.314 17765 2430 1 20 . 1 1 62 62 ASN H H 62 8.607 8.607 8.936 -0.329 17765 2431 1 20 . 1 1 63 63 ALA HA H 63 3.772 3.772 4.369 -0.597 17765 2432 1 20 . 1 1 63 63 ALA H H 63 8.735 8.735 7.671 1.064 17765 2433 1 20 . 1 1 64 64 ALA HA H 64 4.211 4.211 4.307 -0.096 17765 2434 1 20 . 1 1 64 64 ALA H H 64 8.354 8.354 8.179 0.175 17765 2435 1 20 . 1 1 65 65 ASN HA H 65 4.849 4.849 4.862 -0.013 17765 2436 1 20 . 1 1 65 65 ASN H H 65 8.151 8.151 8.120 0.031 17765 2437 1 20 . 1 1 66 66 CYS HA H 66 5.624 5.624 5.085 0.539 17765 2438 1 20 . 1 1 66 66 CYS H H 66 7.698 7.698 8.126 -0.428 17765 2439 1 20 . 1 1 67 67 VAL HA H 67 4.248 4.248 4.417 -0.169 17765 2440 1 20 . 1 1 67 67 VAL H H 67 8.742 8.742 7.654 1.088 17765 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 0 0.000 0.000 0.000 17765 2 1 1 "Average Difference" HA 74 0.359 -0.059 0.357 17765 3 1 1 "Average Difference" C 0 0.000 0.000 0.000 17765 4 1 1 "Average Difference" CA 0 0.000 0.000 0.000 17765 5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 17765 6 1 1 "Average Difference" HN 64 0.439 -0.109 0.429 17765 7 1 2 "Average Difference" N 0 0.000 0.000 0.000 17765 8 1 2 "Average Difference" HA 74 0.361 0.030 0.363 17765 9 1 2 "Average Difference" C 0 0.000 0.000 0.000 17765 10 1 2 "Average Difference" CA 0 0.000 0.000 0.000 17765 11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 17765 12 1 2 "Average Difference" HN 64 0.412 -0.143 0.389 17765 13 1 3 "Average Difference" N 0 0.000 0.000 0.000 17765 14 1 3 "Average Difference" HA 74 0.355 -0.005 0.358 17765 15 1 3 "Average Difference" C 0 0.000 0.000 0.000 17765 16 1 3 "Average Difference" CA 0 0.000 0.000 0.000 17765 17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 17765 18 1 3 "Average Difference" HN 64 0.417 -0.117 0.404 17765 19 1 4 "Average Difference" N 0 0.000 0.000 0.000 17765 20 1 4 "Average Difference" HA 74 0.367 -0.025 0.369 17765 21 1 4 "Average Difference" C 0 0.000 0.000 0.000 17765 22 1 4 "Average Difference" CA 0 0.000 0.000 0.000 17765 23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 17765 24 1 4 "Average Difference" HN 64 0.495 -0.107 0.487 17765 25 1 5 "Average Difference" N 0 0.000 0.000 0.000 17765 26 1 5 "Average Difference" HA 74 0.376 -0.024 0.377 17765 27 1 5 "Average Difference" C 0 0.000 0.000 0.000 17765 28 1 5 "Average Difference" CA 0 0.000 0.000 0.000 17765 29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 17765 30 1 5 "Average Difference" HN 64 0.379 -0.068 0.375 17765 31 1 6 "Average Difference" N 0 0.000 0.000 0.000 17765 32 1 6 "Average Difference" HA 74 0.380 0.008 0.382 17765 33 1 6 "Average Difference" C 0 0.000 0.000 0.000 17765 34 1 6 "Average Difference" CA 0 0.000 0.000 0.000 17765 35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 17765 36 1 6 "Average Difference" HN 64 0.438 -0.181 0.403 17765 37 1 7 "Average Difference" N 0 0.000 0.000 0.000 17765 38 1 7 "Average Difference" HA 74 0.350 -0.011 0.352 17765 39 1 7 "Average Difference" C 0 0.000 0.000 0.000 17765 40 1 7 "Average Difference" CA 0 0.000 0.000 0.000 17765 41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 17765 42 1 7 "Average Difference" HN 64 0.369 -0.109 0.355 17765 43 1 8 "Average Difference" N 0 0.000 0.000 0.000 17765 44 1 8 "Average Difference" HA 74 0.437 0.009 0.440 17765 45 1 8 "Average Difference" C 0 0.000 0.000 0.000 17765 46 1 8 "Average Difference" CA 0 0.000 0.000 0.000 17765 47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 17765 48 1 8 "Average Difference" HN 64 0.442 -0.160 0.415 17765 49 1 9 "Average Difference" N 0 0.000 0.000 0.000 17765 50 1 9 "Average Difference" HA 74 0.329 0.043 0.329 17765 51 1 9 "Average Difference" C 0 0.000 0.000 0.000 17765 52 1 9 "Average Difference" CA 0 0.000 0.000 0.000 17765 53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 17765 54 1 9 "Average Difference" HN 64 0.384 -0.145 0.358 17765 55 1 10 "Average Difference" N 0 0.000 0.000 0.000 17765 56 1 10 "Average Difference" HA 74 0.383 -0.010 0.385 17765 57 1 10 "Average Difference" C 0 0.000 0.000 0.000 17765 58 1 10 "Average Difference" CA 0 0.000 0.000 0.000 17765 59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 17765 60 1 10 "Average Difference" HN 64 0.465 -0.139 0.447 17765 61 1 11 "Average Difference" N 0 0.000 0.000 0.000 17765 62 1 11 "Average Difference" HA 74 0.346 0.025 0.347 17765 63 1 11 "Average Difference" C 0 0.000 0.000 0.000 17765 64 1 11 "Average Difference" CA 0 0.000 0.000 0.000 17765 65 1 11 "Average Difference" CB 0 0.000 0.000 0.000 17765 66 1 11 "Average Difference" HN 64 0.431 -0.123 0.417 17765 67 1 12 "Average Difference" N 0 0.000 0.000 0.000 17765 68 1 12 "Average Difference" HA 74 0.390 -0.012 0.392 17765 69 1 12 "Average Difference" C 0 0.000 0.000 0.000 17765 70 1 12 "Average Difference" CA 0 0.000 0.000 0.000 17765 71 1 12 "Average Difference" CB 0 0.000 0.000 0.000 17765 72 1 12 "Average Difference" HN 64 0.415 -0.155 0.388 17765 73 1 13 "Average Difference" N 0 0.000 0.000 0.000 17765 74 1 13 "Average Difference" HA 74 0.400 -0.016 0.402 17765 75 1 13 "Average Difference" C 0 0.000 0.000 0.000 17765 76 1 13 "Average Difference" CA 0 0.000 0.000 0.000 17765 77 1 13 "Average Difference" CB 0 0.000 0.000 0.000 17765 78 1 13 "Average Difference" HN 64 0.390 -0.109 0.378 17765 79 1 14 "Average Difference" N 0 0.000 0.000 0.000 17765 80 1 14 "Average Difference" HA 74 0.392 -0.003 0.395 17765 81 1 14 "Average Difference" C 0 0.000 0.000 0.000 17765 82 1 14 "Average Difference" CA 0 0.000 0.000 0.000 17765 83 1 14 "Average Difference" CB 0 0.000 0.000 0.000 17765 84 1 14 "Average Difference" HN 64 0.439 -0.199 0.394 17765 85 1 15 "Average Difference" N 0 0.000 0.000 0.000 17765 86 1 15 "Average Difference" HA 74 0.423 -0.069 0.420 17765 87 1 15 "Average Difference" C 0 0.000 0.000 0.000 17765 88 1 15 "Average Difference" CA 0 0.000 0.000 0.000 17765 89 1 15 "Average Difference" CB 0 0.000 0.000 0.000 17765 90 1 15 "Average Difference" HN 64 0.451 -0.131 0.435 17765 91 1 16 "Average Difference" N 0 0.000 0.000 0.000 17765 92 1 16 "Average Difference" HA 74 0.353 0.005 0.356 17765 93 1 16 "Average Difference" C 0 0.000 0.000 0.000 17765 94 1 16 "Average Difference" CA 0 0.000 0.000 0.000 17765 95 1 16 "Average Difference" CB 0 0.000 0.000 0.000 17765 96 1 16 "Average Difference" HN 64 0.333 -0.080 0.326 17765 97 1 17 "Average Difference" N 0 0.000 0.000 0.000 17765 98 1 17 "Average Difference" HA 74 0.396 -0.053 0.395 17765 99 1 17 "Average Difference" C 0 0.000 0.000 0.000 17765 100 1 17 "Average Difference" CA 0 0.000 0.000 0.000 17765 101 1 17 "Average Difference" CB 0 0.000 0.000 0.000 17765 102 1 17 "Average Difference" HN 64 0.474 -0.131 0.459 17765 103 1 18 "Average Difference" N 0 0.000 0.000 0.000 17765 104 1 18 "Average Difference" HA 74 0.412 -0.074 0.408 17765 105 1 18 "Average Difference" C 0 0.000 0.000 0.000 17765 106 1 18 "Average Difference" CA 0 0.000 0.000 0.000 17765 107 1 18 "Average Difference" CB 0 0.000 0.000 0.000 17765 108 1 18 "Average Difference" HN 64 0.446 -0.114 0.435 17765 109 1 19 "Average Difference" N 0 0.000 0.000 0.000 17765 110 1 19 "Average Difference" HA 74 0.346 0.071 0.341 17765 111 1 19 "Average Difference" C 0 0.000 0.000 0.000 17765 112 1 19 "Average Difference" CA 0 0.000 0.000 0.000 17765 113 1 19 "Average Difference" CB 0 0.000 0.000 0.000 17765 114 1 19 "Average Difference" HN 64 0.313 -0.042 0.312 17765 115 1 20 "Average Difference" N 0 0.000 0.000 0.000 17765 116 1 20 "Average Difference" HA 74 0.384 0.005 0.386 17765 117 1 20 "Average Difference" C 0 0.000 0.000 0.000 17765 118 1 20 "Average Difference" CA 0 0.000 0.000 0.000 17765 119 1 20 "Average Difference" CB 0 0.000 0.000 0.000 17765 120 1 20 "Average Difference" HN 64 0.443 -0.125 0.429 17765 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 17765 _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 2 2 ALA HA H 2 4.562 4.562 4.809 -0.247 17765 2 1 . 1 1 2 2 ALA H H 2 8.617 8.617 8.192 0.425 17765 3 1 . 1 1 3 3 THR HA H 3 4.394 4.394 4.405 -0.011 17765 4 1 . 1 1 3 3 THR H H 3 8.142 8.142 8.157 -0.015 17765 5 1 . 1 1 4 4 THR HA H 4 4.615 4.615 4.652 -0.037 17765 6 1 . 1 1 4 4 THR H H 4 8.659 8.659 8.554 0.105 17765 7 1 . 1 1 5 5 ILE HA H 5 3.832 3.832 4.257 -0.425 17765 8 1 . 1 1 5 5 ILE H H 5 8.634 8.634 8.967 -0.333 17765 9 1 . 1 1 6 6 GLY H H 6 8.828 8.828 8.330 0.498 17765 10 1 . 1 1 7 7 PRO HA H 7 4.254 4.254 4.274 -0.020 17765 11 1 . 1 1 8 8 ASN HA H 8 4.846 4.846 4.747 0.099 17765 12 1 . 1 1 8 8 ASN H H 8 8.536 8.536 8.353 0.183 17765 13 1 . 1 1 9 9 THR HA H 9 3.758 3.758 4.253 -0.495 17765 14 1 . 1 1 9 9 THR H H 9 7.559 7.559 7.821 -0.262 17765 15 1 . 1 1 10 10 CYS HA H 10 4.897 4.897 4.738 0.159 17765 16 1 . 1 1 10 10 CYS H H 10 8.554 8.554 8.159 0.395 17765 17 1 . 1 1 11 11 SER HA H 11 4.441 4.441 4.762 -0.321 17765 18 1 . 1 1 11 11 SER H H 11 8.488 8.488 8.731 -0.243 17765 19 1 . 1 1 12 12 ILE HA H 12 4.126 4.126 4.217 -0.091 17765 20 1 . 1 1 12 12 ILE H H 12 7.392 7.392 7.909 -0.517 17765 21 1 . 1 1 13 13 ASP HA H 13 4.361 4.361 4.572 -0.211 17765 22 1 . 1 1 13 13 ASP H H 13 8.694 8.694 8.048 0.646 17765 23 1 . 1 1 14 14 ASP HA H 14 4.373 4.373 4.400 -0.027 17765 24 1 . 1 1 14 14 ASP H H 14 8.640 8.640 8.259 0.381 17765 25 1 . 1 1 15 15 TYR HA H 15 4.639 4.639 4.840 -0.201 17765 26 1 . 1 1 15 15 TYR H H 15 7.970 7.970 7.708 0.262 17765 27 1 . 1 1 16 16 LYS HA H 16 4.794 4.794 4.907 -0.113 17765 28 1 . 1 1 16 16 LYS H H 16 8.655 8.655 8.745 -0.090 17765 29 1 . 1 1 17 17 PRO HA H 17 5.205 5.205 4.589 0.616 17765 30 1 . 1 1 18 18 TYR HA H 18 4.653 4.653 5.094 -0.442 17765 31 1 . 1 1 18 18 TYR H H 18 9.475 9.475 9.126 0.349 17765 32 1 . 1 1 19 19 CYS HA H 19 5.358 5.358 4.926 0.432 17765 33 1 . 1 1 19 19 CYS H H 19 9.004 9.004 9.242 -0.238 17765 34 1 . 1 1 20 20 CYS HA H 20 5.597 5.597 4.653 0.944 17765 35 1 . 1 1 20 20 CYS H H 20 9.838 9.838 9.015 0.823 17765 36 1 . 1 1 21 21 GLN HA H 21 4.620 4.620 4.424 0.196 17765 37 1 . 1 1 21 21 GLN H H 21 8.900 8.900 8.516 0.384 17765 38 1 . 1 1 22 22 SER HA H 22 4.461 4.461 4.383 0.078 17765 39 1 . 1 1 22 22 SER H H 22 8.529 8.529 8.422 0.107 17765 40 1 . 1 1 23 23 MET HA H 23 4.632 4.632 4.653 -0.022 17765 41 1 . 1 1 23 23 MET H H 23 8.566 8.566 8.298 0.268 17765 42 1 . 1 1 24 24 SER HA H 24 4.254 4.254 4.415 -0.161 17765 43 1 . 1 1 24 24 SER H H 24 8.534 8.534 8.487 0.047 17765 44 1 . 1 1 25 25 GLY H H 25 8.729 8.729 8.397 0.332 17765 45 1 . 1 1 26 26 SER HA H 26 4.575 4.575 4.526 0.049 17765 46 1 . 1 1 26 26 SER H H 26 7.873 7.873 7.927 -0.054 17765 47 1 . 1 1 27 27 ALA HA H 27 4.487 4.487 4.372 0.115 17765 48 1 . 1 1 27 27 ALA H H 27 8.435 8.435 8.395 0.040 17765 49 1 . 1 1 28 28 SER HA H 28 4.650 4.650 4.605 0.045 17765 50 1 . 1 1 28 28 SER H H 28 8.134 8.134 7.788 0.346 17765 51 1 . 1 1 29 29 LEU HA H 29 4.635 4.635 4.535 0.100 17765 52 1 . 1 1 29 29 LEU H H 29 8.763 8.763 8.480 0.283 17765 53 1 . 1 1 30 30 GLY H H 30 8.580 8.580 8.484 0.096 17765 54 1 . 1 1 31 31 CYS HA H 31 5.662 5.662 4.870 0.792 17765 55 1 . 1 1 31 31 CYS H H 31 8.786 8.786 8.154 0.632 17765 56 1 . 1 1 32 32 VAL HA H 32 4.724 4.724 4.542 0.182 17765 57 1 . 1 1 32 32 VAL H H 32 8.361 8.361 8.254 0.107 17765 58 1 . 1 1 33 33 VAL HA H 33 3.370 3.370 3.665 -0.295 17765 59 1 . 1 1 33 33 VAL H H 33 8.635 8.635 8.515 0.120 17765 60 1 . 1 1 34 34 GLY H H 34 8.088 8.088 8.338 -0.250 17765 61 1 . 1 1 35 35 VAL HA H 35 3.925 3.925 4.009 -0.084 17765 62 1 . 1 1 35 35 VAL H H 35 7.785 7.785 7.938 -0.153 17765 63 1 . 1 1 36 36 ILE HA H 36 3.360 3.360 3.889 -0.529 17765 64 1 . 1 1 36 36 ILE H H 36 8.614 8.614 8.525 0.089 17765 65 1 . 1 1 37 37 GLY H H 37 9.037 9.037 8.877 0.160 17765 66 1 . 1 1 38 38 SER HA H 38 4.495 4.495 4.732 -0.237 17765 67 1 . 1 1 38 38 SER H H 38 8.150 8.150 7.958 0.192 17765 68 1 . 1 1 39 39 GLN HA H 39 4.825 4.825 4.969 -0.144 17765 69 1 . 1 1 39 39 GLN H H 39 8.429 8.429 8.474 -0.045 17765 70 1 . 1 1 40 40 CYS HA H 40 4.987 4.987 4.664 0.323 17765 71 1 . 1 1 40 40 CYS H H 40 8.974 8.974 8.810 0.164 17765 72 1 . 1 1 41 41 GLY H H 41 9.375 9.375 8.846 0.529 17765 73 1 . 1 1 42 42 ALA HA H 42 4.658 4.658 4.609 0.049 17765 74 1 . 1 1 42 42 ALA H H 42 7.131 7.131 7.554 -0.423 17765 75 1 . 1 1 43 43 SER HA H 43 4.748 4.748 4.516 0.232 17765 76 1 . 1 1 43 43 SER H H 43 8.325 8.325 8.261 0.064 17765 77 1 . 1 1 44 44 VAL HA H 44 4.652 4.652 4.354 0.298 17765 78 1 . 1 1 44 44 VAL H H 44 8.784 8.784 8.338 0.446 17765 79 1 . 1 1 45 45 LYS HA H 45 4.821 4.821 4.689 0.132 17765 80 1 . 1 1 45 45 LYS H H 45 9.015 9.015 9.057 -0.042 17765 81 1 . 1 1 46 46 CYS HA H 46 5.493 5.493 5.325 0.168 17765 82 1 . 1 1 46 46 CYS H H 46 8.943 8.943 8.642 0.301 17765 83 1 . 1 1 47 47 CYS HA H 47 5.677 5.677 5.199 0.478 17765 84 1 . 1 1 47 47 CYS H H 47 9.513 9.513 8.835 0.678 17765 85 1 . 1 1 48 48 LYS HA H 48 4.020 4.020 4.820 -0.800 17765 86 1 . 1 1 48 48 LYS H H 48 8.226 8.226 8.608 -0.382 17765 87 1 . 1 1 49 49 ASP HA H 49 4.570 4.570 4.629 -0.058 17765 88 1 . 1 1 49 49 ASP H H 49 8.375 8.375 8.604 -0.228 17765 89 1 . 1 1 50 50 ASP HA H 50 4.719 4.719 4.580 0.140 17765 90 1 . 1 1 50 50 ASP H H 50 8.306 8.306 8.230 0.076 17765 91 1 . 1 1 51 51 VAL HA H 51 4.196 4.196 4.272 -0.076 17765 92 1 . 1 1 51 51 VAL H H 51 7.790 7.790 7.972 -0.182 17765 93 1 . 1 1 52 52 THR HA H 52 4.322 4.322 4.337 -0.015 17765 94 1 . 1 1 52 52 THR H H 52 8.194 8.194 8.382 -0.188 17765 95 1 . 1 1 53 53 ASN HA H 53 4.777 4.777 4.707 0.070 17765 96 1 . 1 1 53 53 ASN H H 53 8.364 8.364 8.234 0.130 17765 97 1 . 1 1 54 54 THR HA H 54 4.340 4.340 4.361 -0.021 17765 98 1 . 1 1 54 54 THR H H 54 8.201 8.201 8.162 0.039 17765 99 1 . 1 1 55 55 GLY H H 55 8.354 8.354 8.335 0.019 17765 100 1 . 1 1 56 56 ASN HA H 56 4.729 4.729 4.719 0.010 17765 101 1 . 1 1 56 56 ASN H H 56 8.397 8.397 8.265 0.132 17765 102 1 . 1 1 57 57 SER HA H 57 4.485 4.485 4.513 -0.028 17765 103 1 . 1 1 57 57 SER H H 57 8.205 8.205 8.343 -0.138 17765 104 1 . 1 1 58 58 GLY H H 58 8.144 8.144 7.941 0.203 17765 105 1 . 1 1 59 59 LEU HA H 59 4.485 4.485 4.573 -0.088 17765 106 1 . 1 1 59 59 LEU H H 59 8.460 8.460 8.259 0.201 17765 107 1 . 1 1 60 60 ILE HA H 60 4.794 4.794 4.344 0.451 17765 108 1 . 1 1 60 60 ILE H H 60 8.195 8.195 8.203 -0.008 17765 109 1 . 1 1 61 61 ILE HA H 61 4.151 4.151 4.159 -0.008 17765 110 1 . 1 1 61 61 ILE H H 61 8.802 8.802 8.157 0.645 17765 111 1 . 1 1 62 62 ASN HA H 62 4.617 4.617 4.657 -0.040 17765 112 1 . 1 1 62 62 ASN H H 62 8.607 8.607 8.809 -0.202 17765 113 1 . 1 1 63 63 ALA HA H 63 3.772 3.772 4.031 -0.259 17765 114 1 . 1 1 63 63 ALA H H 63 8.735 8.735 8.450 0.285 17765 115 1 . 1 1 64 64 ALA HA H 64 4.211 4.211 4.221 -0.010 17765 116 1 . 1 1 64 64 ALA H H 64 8.354 8.354 8.086 0.268 17765 117 1 . 1 1 65 65 ASN HA H 65 4.849 4.849 4.870 -0.021 17765 118 1 . 1 1 65 65 ASN H H 65 8.151 8.151 8.269 -0.118 17765 119 1 . 1 1 66 66 CYS HA H 66 5.624 5.624 4.983 0.641 17765 120 1 . 1 1 66 66 CYS H H 66 7.698 7.698 7.600 0.098 17765 121 1 . 1 1 67 67 VAL HA H 67 4.248 4.248 4.132 0.116 17765 122 1 . 1 1 67 67 VAL H H 67 8.742 8.742 8.217 0.525 17765 stop_ save_