data_19746 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 19746 _Entry.PDB_ID 2MJY 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 19746 _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 LYS HA H 2 5.347 5.347 4.748 0.599 19746 2 1 1 . 1 1 2 2 LYS H H 2 8.293 8.293 7.651 0.642 19746 3 1 1 . 1 1 3 3 CYS HA H 3 4.901 4.901 4.550 0.351 19746 4 1 1 . 1 1 3 3 CYS H H 3 8.348 8.348 8.698 -0.350 19746 5 1 1 . 1 1 4 4 TYR HA H 4 4.541 4.541 4.568 -0.027 19746 6 1 1 . 1 1 4 4 TYR H H 4 9.500 9.500 8.430 1.070 19746 7 1 1 . 1 1 5 5 GLN HA H 5 4.328 4.328 4.352 -0.024 19746 8 1 1 . 1 1 5 5 GLN H H 5 9.293 9.293 8.042 1.251 19746 9 1 1 . 1 1 6 6 HIS HA H 6 4.432 4.432 4.696 -0.264 19746 10 1 1 . 1 1 6 6 HIS H H 6 8.622 8.622 7.947 0.675 19746 11 1 1 . 1 1 7 7 GLY H H 7 8.394 8.394 8.724 -0.330 19746 12 1 1 . 1 1 8 8 LYS HA H 8 4.746 4.746 4.646 0.100 19746 13 1 1 . 1 1 8 8 LYS H H 8 7.667 7.667 7.800 -0.133 19746 14 1 1 . 1 1 9 9 VAL HA H 9 3.808 3.808 3.363 0.445 19746 15 1 1 . 1 1 9 9 VAL H H 9 8.452 8.452 8.347 0.105 19746 16 1 1 . 1 1 10 10 VAL HA H 10 4.578 4.578 4.674 -0.096 19746 17 1 1 . 1 1 10 10 VAL H H 10 8.907 8.907 8.795 0.112 19746 18 1 1 . 1 1 11 11 THR HA H 11 4.395 4.395 4.365 0.030 19746 19 1 1 . 1 1 11 11 THR H H 11 8.441 8.441 8.312 0.129 19746 20 1 1 . 1 1 12 12 CYS HA H 12 4.635 4.635 4.310 0.325 19746 21 1 1 . 1 1 12 12 CYS H H 12 8.864 8.864 8.926 -0.062 19746 22 1 1 . 1 1 13 13 HIS HA H 13 3.989 3.989 4.570 -0.581 19746 23 1 1 . 1 1 13 13 HIS H H 13 9.706 9.706 8.136 1.570 19746 24 1 1 . 1 1 14 14 ARG HA H 14 4.384 4.384 3.863 0.521 19746 25 1 1 . 1 1 14 14 ARG H H 14 8.791 8.791 8.484 0.307 19746 26 1 1 . 1 1 15 15 ASP HA H 15 4.544 4.544 4.391 0.153 19746 27 1 1 . 1 1 15 15 ASP H H 15 7.956 7.956 8.557 -0.601 19746 28 1 1 . 1 1 16 16 MET HA H 16 4.348 4.348 4.391 -0.043 19746 29 1 1 . 1 1 16 16 MET H H 16 8.064 8.064 7.997 0.067 19746 30 1 1 . 1 1 17 17 LYS HA H 17 4.249 4.249 4.296 -0.047 19746 31 1 1 . 1 1 17 17 LYS H H 17 7.659 7.659 8.148 -0.489 19746 32 1 1 . 1 1 18 18 PHE HA H 18 5.046 5.046 4.984 0.062 19746 33 1 1 . 1 1 18 18 PHE H H 18 8.218 8.218 7.661 0.557 19746 34 1 1 . 1 1 19 19 CYS HA H 19 5.956 5.956 4.804 1.152 19746 35 1 1 . 1 1 19 19 CYS H H 19 9.289 9.289 8.843 0.446 19746 36 1 1 . 1 1 20 20 TYR HA H 20 6.157 6.157 5.111 1.046 19746 37 1 1 . 1 1 20 20 TYR H H 20 8.847 8.847 9.005 -0.158 19746 38 1 1 . 1 1 21 21 HIS HA H 21 5.154 5.154 4.778 0.376 19746 39 1 1 . 1 1 21 21 HIS H H 21 8.688 8.688 8.815 -0.127 19746 40 1 1 . 1 1 22 22 ASN HA H 22 5.767 5.767 4.956 0.811 19746 41 1 1 . 1 1 22 22 ASN H H 22 9.679 9.679 8.232 1.447 19746 42 1 1 . 1 1 23 23 THR HA H 23 4.536 4.536 4.991 -0.455 19746 43 1 1 . 1 1 23 23 THR H H 23 8.501 8.501 8.619 -0.118 19746 44 1 1 . 1 1 24 24 GLY H H 24 8.549 8.549 7.587 0.962 19746 45 1 1 . 1 1 25 25 MET HA H 25 4.791 4.791 4.352 0.439 19746 46 1 1 . 1 1 25 25 MET H H 25 8.306 8.306 8.200 0.106 19746 47 1 1 . 1 1 30 30 LEU HA H 30 4.376 4.376 4.496 -0.120 19746 48 1 1 . 1 1 30 30 LEU H H 30 7.637 7.637 7.128 0.509 19746 49 1 1 . 1 1 31 31 LYS HA H 31 4.244 4.244 4.256 -0.012 19746 50 1 1 . 1 1 31 31 LYS H H 31 8.000 8.000 8.507 -0.507 19746 51 1 1 . 1 1 32 32 LEU HA H 32 4.431 4.431 3.986 0.445 19746 52 1 1 . 1 1 32 32 LEU H H 32 7.945 7.945 7.483 0.462 19746 53 1 1 . 1 1 33 33 ILE HA H 33 4.396 4.396 4.480 -0.084 19746 54 1 1 . 1 1 33 33 ILE H H 33 8.204 8.204 8.031 0.173 19746 55 1 1 . 1 1 34 34 LEU HA H 34 4.750 4.750 4.636 0.114 19746 56 1 1 . 1 1 34 34 LEU H H 34 9.084 9.084 9.281 -0.197 19746 57 1 1 . 1 1 35 35 GLN HA H 35 4.524 4.524 4.518 0.006 19746 58 1 1 . 1 1 35 35 GLN H H 35 8.010 8.010 7.924 0.086 19746 59 1 1 . 1 1 36 36 GLY H H 36 6.153 6.153 7.712 -1.559 19746 60 1 1 . 1 1 37 37 CYS HA H 37 5.810 5.810 5.454 0.356 19746 61 1 1 . 1 1 37 37 CYS H H 37 8.431 8.431 8.489 -0.058 19746 62 1 1 . 1 1 38 38 SER HA H 38 4.932 4.932 4.939 -0.007 19746 63 1 1 . 1 1 38 38 SER H H 38 9.681 9.681 8.784 0.897 19746 64 1 1 . 1 1 39 39 SER HA H 39 4.673 4.673 4.352 0.321 19746 65 1 1 . 1 1 39 39 SER H H 39 9.087 9.087 8.854 0.233 19746 66 1 1 . 1 1 41 41 CYS HA H 41 4.265 4.265 4.556 -0.291 19746 67 1 1 . 1 1 41 41 CYS H H 41 7.898 7.898 8.790 -0.892 19746 68 1 1 . 1 1 42 42 SER HA H 42 4.580 4.580 4.509 0.071 19746 69 1 1 . 1 1 42 42 SER H H 42 8.385 8.385 8.492 -0.107 19746 70 1 1 . 1 1 43 43 GLU HA H 43 4.615 4.615 4.112 0.503 19746 71 1 1 . 1 1 43 43 GLU H H 43 8.790 8.790 8.562 0.228 19746 72 1 1 . 1 1 44 44 THR HA H 44 4.721 4.721 4.659 0.062 19746 73 1 1 . 1 1 44 44 THR H H 44 8.954 8.954 8.655 0.299 19746 74 1 1 . 1 1 45 45 GLU HA H 45 4.056 4.056 4.208 -0.152 19746 75 1 1 . 1 1 45 45 GLU H H 45 8.903 8.903 8.878 0.025 19746 76 1 1 . 1 1 46 46 ASN HA H 46 4.847 4.847 4.696 0.151 19746 77 1 1 . 1 1 46 46 ASN H H 46 7.957 7.957 8.139 -0.182 19746 78 1 1 . 1 1 47 47 ASN HA H 47 5.360 5.360 4.993 0.367 19746 79 1 1 . 1 1 47 47 ASN H H 47 7.729 7.729 8.328 -0.599 19746 80 1 1 . 1 1 48 48 LYS HA H 48 4.782 4.782 4.512 0.270 19746 81 1 1 . 1 1 48 48 LYS H H 48 8.600 8.600 8.281 0.319 19746 82 1 1 . 1 1 49 49 CYS HA H 49 5.517 5.517 5.220 0.297 19746 83 1 1 . 1 1 49 49 CYS H H 49 9.048 9.048 8.265 0.783 19746 84 1 1 . 1 1 50 50 CYS HA H 50 5.216 5.216 4.725 0.491 19746 85 1 1 . 1 1 50 50 CYS H H 50 9.342 9.342 9.312 0.030 19746 86 1 1 . 1 1 51 51 SER HA H 51 4.948 4.948 4.962 -0.014 19746 87 1 1 . 1 1 51 51 SER H H 51 9.182 9.182 9.065 0.117 19746 88 1 1 . 1 1 52 52 THR HA H 52 4.639 4.639 4.688 -0.049 19746 89 1 1 . 1 1 52 52 THR H H 52 7.570 7.570 7.650 -0.080 19746 90 1 1 . 1 1 53 53 ASP HA H 53 4.608 4.608 4.832 -0.224 19746 91 1 1 . 1 1 53 53 ASP H H 53 7.844 7.844 8.426 -0.582 19746 92 1 1 . 1 1 54 54 ARG HA H 54 4.182 4.182 3.836 0.346 19746 93 1 1 . 1 1 54 54 ARG H H 54 8.146 8.146 8.387 -0.241 19746 94 1 1 . 1 1 55 55 CYS HA H 55 4.526 4.526 4.390 0.136 19746 95 1 1 . 1 1 55 55 CYS H H 55 7.899 7.899 8.023 -0.124 19746 96 1 1 . 1 1 56 56 ASN HA H 56 4.687 4.687 4.871 -0.184 19746 97 1 1 . 1 1 56 56 ASN H H 56 8.751 8.751 8.548 0.203 19746 98 1 2 . 1 1 2 2 LYS HA H 2 5.347 5.347 4.770 0.577 19746 99 1 2 . 1 1 2 2 LYS H H 2 8.293 8.293 7.547 0.746 19746 100 1 2 . 1 1 3 3 CYS HA H 3 4.901 4.901 4.657 0.244 19746 101 1 2 . 1 1 3 3 CYS H H 3 8.348 8.348 8.800 -0.452 19746 102 1 2 . 1 1 4 4 TYR HA H 4 4.541 4.541 5.214 -0.673 19746 103 1 2 . 1 1 4 4 TYR H H 4 9.500 9.500 8.019 1.481 19746 104 1 2 . 1 1 5 5 GLN HA H 5 4.328 4.328 4.231 0.097 19746 105 1 2 . 1 1 5 5 GLN H H 5 9.293 9.293 7.885 1.408 19746 106 1 2 . 1 1 6 6 HIS HA H 6 4.432 4.432 4.787 -0.355 19746 107 1 2 . 1 1 6 6 HIS H H 6 8.622 8.622 7.779 0.843 19746 108 1 2 . 1 1 7 7 GLY H H 7 8.394 8.394 8.787 -0.393 19746 109 1 2 . 1 1 8 8 LYS HA H 8 4.746 4.746 4.967 -0.221 19746 110 1 2 . 1 1 8 8 LYS H H 8 7.667 7.667 7.722 -0.055 19746 111 1 2 . 1 1 9 9 VAL HA H 9 3.808 3.808 4.051 -0.243 19746 112 1 2 . 1 1 9 9 VAL H H 9 8.452 8.452 8.514 -0.062 19746 113 1 2 . 1 1 10 10 VAL HA H 10 4.578 4.578 4.516 0.062 19746 114 1 2 . 1 1 10 10 VAL H H 10 8.907 8.907 8.960 -0.053 19746 115 1 2 . 1 1 11 11 THR HA H 11 4.395 4.395 4.407 -0.012 19746 116 1 2 . 1 1 11 11 THR H H 11 8.441 8.441 8.289 0.152 19746 117 1 2 . 1 1 12 12 CYS HA H 12 4.635 4.635 4.151 0.484 19746 118 1 2 . 1 1 12 12 CYS H H 12 8.864 8.864 8.540 0.324 19746 119 1 2 . 1 1 13 13 HIS HA H 13 3.989 3.989 4.242 -0.253 19746 120 1 2 . 1 1 13 13 HIS H H 13 9.706 9.706 8.613 1.093 19746 121 1 2 . 1 1 14 14 ARG HA H 14 4.384 4.384 4.143 0.241 19746 122 1 2 . 1 1 14 14 ARG H H 14 8.791 8.791 8.782 0.009 19746 123 1 2 . 1 1 15 15 ASP HA H 15 4.544 4.544 4.496 0.048 19746 124 1 2 . 1 1 15 15 ASP H H 15 7.956 7.956 8.312 -0.356 19746 125 1 2 . 1 1 16 16 MET HA H 16 4.348 4.348 4.342 0.006 19746 126 1 2 . 1 1 16 16 MET H H 16 8.064 8.064 8.131 -0.067 19746 127 1 2 . 1 1 17 17 LYS HA H 17 4.249 4.249 4.248 0.001 19746 128 1 2 . 1 1 17 17 LYS H H 17 7.659 7.659 8.333 -0.674 19746 129 1 2 . 1 1 18 18 PHE HA H 18 5.046 5.046 4.860 0.186 19746 130 1 2 . 1 1 18 18 PHE H H 18 8.218 8.218 7.348 0.870 19746 131 1 2 . 1 1 19 19 CYS HA H 19 5.956 5.956 4.860 1.096 19746 132 1 2 . 1 1 19 19 CYS H H 19 9.289 9.289 9.263 0.026 19746 133 1 2 . 1 1 20 20 TYR HA H 20 6.157 6.157 5.548 0.609 19746 134 1 2 . 1 1 20 20 TYR H H 20 8.847 8.847 9.210 -0.363 19746 135 1 2 . 1 1 21 21 HIS HA H 21 5.154 5.154 4.937 0.217 19746 136 1 2 . 1 1 21 21 HIS H H 21 8.688 8.688 8.686 0.002 19746 137 1 2 . 1 1 22 22 ASN HA H 22 5.767 5.767 5.198 0.569 19746 138 1 2 . 1 1 22 22 ASN H H 22 9.679 9.679 9.037 0.642 19746 139 1 2 . 1 1 23 23 THR HA H 23 4.536 4.536 4.742 -0.206 19746 140 1 2 . 1 1 23 23 THR H H 23 8.501 8.501 8.833 -0.332 19746 141 1 2 . 1 1 24 24 GLY H H 24 8.549 8.549 7.521 1.028 19746 142 1 2 . 1 1 25 25 MET HA H 25 4.791 4.791 4.525 0.266 19746 143 1 2 . 1 1 25 25 MET H H 25 8.306 8.306 8.293 0.013 19746 144 1 2 . 1 1 30 30 LEU HA H 30 4.376 4.376 4.509 -0.133 19746 145 1 2 . 1 1 30 30 LEU H H 30 7.637 7.637 7.697 -0.060 19746 146 1 2 . 1 1 31 31 LYS HA H 31 4.244 4.244 4.313 -0.069 19746 147 1 2 . 1 1 31 31 LYS H H 31 8.000 8.000 8.478 -0.478 19746 148 1 2 . 1 1 32 32 LEU HA H 32 4.431 4.431 3.983 0.448 19746 149 1 2 . 1 1 32 32 LEU H H 32 7.945 7.945 7.237 0.708 19746 150 1 2 . 1 1 33 33 ILE HA H 33 4.396 4.396 4.370 0.026 19746 151 1 2 . 1 1 33 33 ILE H H 33 8.204 8.204 7.953 0.251 19746 152 1 2 . 1 1 34 34 LEU HA H 34 4.750 4.750 4.542 0.208 19746 153 1 2 . 1 1 34 34 LEU H H 34 9.084 9.084 7.843 1.241 19746 154 1 2 . 1 1 35 35 GLN HA H 35 4.524 4.524 4.185 0.339 19746 155 1 2 . 1 1 35 35 GLN H H 35 8.010 8.010 7.628 0.382 19746 156 1 2 . 1 1 36 36 GLY H H 36 6.153 6.153 7.145 -0.992 19746 157 1 2 . 1 1 37 37 CYS HA H 37 5.810 5.810 5.501 0.309 19746 158 1 2 . 1 1 37 37 CYS H H 37 8.431 8.431 8.720 -0.289 19746 159 1 2 . 1 1 38 38 SER HA H 38 4.932 4.932 4.719 0.213 19746 160 1 2 . 1 1 38 38 SER H H 38 9.681 9.681 8.889 0.792 19746 161 1 2 . 1 1 39 39 SER HA H 39 4.673 4.673 4.717 -0.044 19746 162 1 2 . 1 1 39 39 SER H H 39 9.087 9.087 8.858 0.229 19746 163 1 2 . 1 1 41 41 CYS HA H 41 4.265 4.265 4.411 -0.146 19746 164 1 2 . 1 1 41 41 CYS H H 41 7.898 7.898 8.634 -0.736 19746 165 1 2 . 1 1 42 42 SER HA H 42 4.580 4.580 4.450 0.130 19746 166 1 2 . 1 1 42 42 SER H H 42 8.385 8.385 8.656 -0.271 19746 167 1 2 . 1 1 43 43 GLU HA H 43 4.615 4.615 4.027 0.588 19746 168 1 2 . 1 1 43 43 GLU H H 43 8.790 8.790 8.286 0.504 19746 169 1 2 . 1 1 44 44 THR HA H 44 4.721 4.721 4.577 0.144 19746 170 1 2 . 1 1 44 44 THR H H 44 8.954 8.954 8.546 0.408 19746 171 1 2 . 1 1 45 45 GLU HA H 45 4.056 4.056 4.001 0.055 19746 172 1 2 . 1 1 45 45 GLU H H 45 8.903 8.903 8.918 -0.015 19746 173 1 2 . 1 1 46 46 ASN HA H 46 4.847 4.847 4.629 0.218 19746 174 1 2 . 1 1 46 46 ASN H H 46 7.957 7.957 8.094 -0.137 19746 175 1 2 . 1 1 47 47 ASN HA H 47 5.360 5.360 5.112 0.248 19746 176 1 2 . 1 1 47 47 ASN H H 47 7.729 7.729 8.033 -0.304 19746 177 1 2 . 1 1 48 48 LYS HA H 48 4.782 4.782 4.775 0.007 19746 178 1 2 . 1 1 48 48 LYS H H 48 8.600 8.600 7.969 0.631 19746 179 1 2 . 1 1 49 49 CYS HA H 49 5.517 5.517 5.622 -0.105 19746 180 1 2 . 1 1 49 49 CYS H H 49 9.048 9.048 8.094 0.954 19746 181 1 2 . 1 1 50 50 CYS HA H 50 5.216 5.216 4.987 0.229 19746 182 1 2 . 1 1 50 50 CYS H H 50 9.342 9.342 9.530 -0.188 19746 183 1 2 . 1 1 51 51 SER HA H 51 4.948 4.948 4.808 0.140 19746 184 1 2 . 1 1 51 51 SER H H 51 9.182 9.182 8.824 0.358 19746 185 1 2 . 1 1 52 52 THR HA H 52 4.639 4.639 4.469 0.170 19746 186 1 2 . 1 1 52 52 THR H H 52 7.570 7.570 7.924 -0.354 19746 187 1 2 . 1 1 53 53 ASP HA H 53 4.608 4.608 4.128 0.480 19746 188 1 2 . 1 1 53 53 ASP H H 53 7.844 7.844 7.997 -0.153 19746 189 1 2 . 1 1 54 54 ARG HA H 54 4.182 4.182 3.696 0.486 19746 190 1 2 . 1 1 54 54 ARG H H 54 8.146 8.146 8.670 -0.524 19746 191 1 2 . 1 1 55 55 CYS HA H 55 4.526 4.526 4.496 0.030 19746 192 1 2 . 1 1 55 55 CYS H H 55 7.899 7.899 8.122 -0.223 19746 193 1 2 . 1 1 56 56 ASN HA H 56 4.687 4.687 4.640 0.047 19746 194 1 2 . 1 1 56 56 ASN H H 56 8.751 8.751 8.556 0.195 19746 195 1 3 . 1 1 2 2 LYS HA H 2 5.347 5.347 4.601 0.746 19746 196 1 3 . 1 1 2 2 LYS H H 2 8.293 8.293 7.450 0.843 19746 197 1 3 . 1 1 3 3 CYS HA H 3 4.901 4.901 4.597 0.304 19746 198 1 3 . 1 1 3 3 CYS H H 3 8.348 8.348 8.346 0.002 19746 199 1 3 . 1 1 4 4 TYR HA H 4 4.541 4.541 4.779 -0.238 19746 200 1 3 . 1 1 4 4 TYR H H 4 9.500 9.500 8.744 0.756 19746 201 1 3 . 1 1 5 5 GLN HA H 5 4.328 4.328 4.195 0.133 19746 202 1 3 . 1 1 5 5 GLN H H 5 9.293 9.293 8.347 0.946 19746 203 1 3 . 1 1 6 6 HIS HA H 6 4.432 4.432 4.832 -0.400 19746 204 1 3 . 1 1 6 6 HIS H H 6 8.622 8.622 7.830 0.792 19746 205 1 3 . 1 1 7 7 GLY H H 7 8.394 8.394 8.452 -0.058 19746 206 1 3 . 1 1 8 8 LYS HA H 8 4.746 4.746 4.821 -0.075 19746 207 1 3 . 1 1 8 8 LYS H H 8 7.667 7.667 7.795 -0.128 19746 208 1 3 . 1 1 9 9 VAL HA H 9 3.808 3.808 3.506 0.302 19746 209 1 3 . 1 1 9 9 VAL H H 9 8.452 8.452 8.412 0.040 19746 210 1 3 . 1 1 10 10 VAL HA H 10 4.578 4.578 4.607 -0.029 19746 211 1 3 . 1 1 10 10 VAL H H 10 8.907 8.907 8.791 0.116 19746 212 1 3 . 1 1 11 11 THR HA H 11 4.395 4.395 4.295 0.100 19746 213 1 3 . 1 1 11 11 THR H H 11 8.441 8.441 8.307 0.134 19746 214 1 3 . 1 1 12 12 CYS HA H 12 4.635 4.635 4.400 0.235 19746 215 1 3 . 1 1 12 12 CYS H H 12 8.864 8.864 8.754 0.110 19746 216 1 3 . 1 1 13 13 HIS HA H 13 3.989 3.989 4.633 -0.644 19746 217 1 3 . 1 1 13 13 HIS H H 13 9.706 9.706 8.188 1.518 19746 218 1 3 . 1 1 14 14 ARG HA H 14 4.384 4.384 3.790 0.594 19746 219 1 3 . 1 1 14 14 ARG H H 14 8.791 8.791 8.372 0.419 19746 220 1 3 . 1 1 15 15 ASP HA H 15 4.544 4.544 4.208 0.336 19746 221 1 3 . 1 1 15 15 ASP H H 15 7.956 7.956 7.984 -0.028 19746 222 1 3 . 1 1 16 16 MET HA H 16 4.348 4.348 4.287 0.061 19746 223 1 3 . 1 1 16 16 MET H H 16 8.064 8.064 8.087 -0.023 19746 224 1 3 . 1 1 17 17 LYS HA H 17 4.249 4.249 4.356 -0.107 19746 225 1 3 . 1 1 17 17 LYS H H 17 7.659 7.659 8.187 -0.528 19746 226 1 3 . 1 1 18 18 PHE HA H 18 5.046 5.046 4.866 0.180 19746 227 1 3 . 1 1 18 18 PHE H H 18 8.218 8.218 7.839 0.379 19746 228 1 3 . 1 1 19 19 CYS HA H 19 5.956 5.956 4.729 1.227 19746 229 1 3 . 1 1 19 19 CYS H H 19 9.289 9.289 9.229 0.060 19746 230 1 3 . 1 1 20 20 TYR HA H 20 6.157 6.157 5.311 0.846 19746 231 1 3 . 1 1 20 20 TYR H H 20 8.847 8.847 8.354 0.493 19746 232 1 3 . 1 1 21 21 HIS HA H 21 5.154 5.154 4.868 0.286 19746 233 1 3 . 1 1 21 21 HIS H H 21 8.688 8.688 8.612 0.076 19746 234 1 3 . 1 1 22 22 ASN HA H 22 5.767 5.767 5.116 0.651 19746 235 1 3 . 1 1 22 22 ASN H H 22 9.679 9.679 8.325 1.354 19746 236 1 3 . 1 1 23 23 THR HA H 23 4.536 4.536 4.574 -0.038 19746 237 1 3 . 1 1 23 23 THR H H 23 8.501 8.501 8.703 -0.202 19746 238 1 3 . 1 1 24 24 GLY H H 24 8.549 8.549 7.654 0.895 19746 239 1 3 . 1 1 25 25 MET HA H 25 4.791 4.791 4.379 0.412 19746 240 1 3 . 1 1 25 25 MET H H 25 8.306 8.306 8.151 0.155 19746 241 1 3 . 1 1 30 30 LEU HA H 30 4.376 4.376 4.075 0.301 19746 242 1 3 . 1 1 30 30 LEU H H 30 7.637 7.637 7.739 -0.102 19746 243 1 3 . 1 1 31 31 LYS HA H 31 4.244 4.244 4.387 -0.143 19746 244 1 3 . 1 1 31 31 LYS H H 31 8.000 8.000 8.340 -0.340 19746 245 1 3 . 1 1 32 32 LEU HA H 32 4.431 4.431 4.520 -0.089 19746 246 1 3 . 1 1 32 32 LEU H H 32 7.945 7.945 7.738 0.207 19746 247 1 3 . 1 1 33 33 ILE HA H 33 4.396 4.396 4.286 0.110 19746 248 1 3 . 1 1 33 33 ILE H H 33 8.204 8.204 8.480 -0.276 19746 249 1 3 . 1 1 34 34 LEU HA H 34 4.750 4.750 4.728 0.022 19746 250 1 3 . 1 1 34 34 LEU H H 34 9.084 9.084 8.593 0.491 19746 251 1 3 . 1 1 35 35 GLN HA H 35 4.524 4.524 4.671 -0.147 19746 252 1 3 . 1 1 35 35 GLN H H 35 8.010 8.010 7.807 0.203 19746 253 1 3 . 1 1 36 36 GLY H H 36 6.153 6.153 7.417 -1.264 19746 254 1 3 . 1 1 37 37 CYS HA H 37 5.810 5.810 5.067 0.743 19746 255 1 3 . 1 1 37 37 CYS H H 37 8.431 8.431 8.241 0.190 19746 256 1 3 . 1 1 38 38 SER HA H 38 4.932 4.932 4.820 0.112 19746 257 1 3 . 1 1 38 38 SER H H 38 9.681 9.681 8.977 0.704 19746 258 1 3 . 1 1 39 39 SER HA H 39 4.673 4.673 4.697 -0.024 19746 259 1 3 . 1 1 39 39 SER H H 39 9.087 9.087 8.959 0.128 19746 260 1 3 . 1 1 41 41 CYS HA H 41 4.265 4.265 4.630 -0.365 19746 261 1 3 . 1 1 41 41 CYS H H 41 7.898 7.898 8.394 -0.496 19746 262 1 3 . 1 1 42 42 SER HA H 42 4.580 4.580 4.487 0.093 19746 263 1 3 . 1 1 42 42 SER H H 42 8.385 8.385 8.487 -0.102 19746 264 1 3 . 1 1 43 43 GLU HA H 43 4.615 4.615 4.152 0.463 19746 265 1 3 . 1 1 43 43 GLU H H 43 8.790 8.790 8.560 0.230 19746 266 1 3 . 1 1 44 44 THR HA H 44 4.721 4.721 4.569 0.152 19746 267 1 3 . 1 1 44 44 THR H H 44 8.954 8.954 8.327 0.627 19746 268 1 3 . 1 1 45 45 GLU HA H 45 4.056 4.056 4.092 -0.036 19746 269 1 3 . 1 1 45 45 GLU H H 45 8.903 8.903 8.824 0.079 19746 270 1 3 . 1 1 46 46 ASN HA H 46 4.847 4.847 4.689 0.158 19746 271 1 3 . 1 1 46 46 ASN H H 46 7.957 7.957 8.173 -0.216 19746 272 1 3 . 1 1 47 47 ASN HA H 47 5.360 5.360 4.998 0.362 19746 273 1 3 . 1 1 47 47 ASN H H 47 7.729 7.729 7.740 -0.011 19746 274 1 3 . 1 1 48 48 LYS HA H 48 4.782 4.782 4.641 0.141 19746 275 1 3 . 1 1 48 48 LYS H H 48 8.600 8.600 7.919 0.681 19746 276 1 3 . 1 1 49 49 CYS HA H 49 5.517 5.517 5.683 -0.166 19746 277 1 3 . 1 1 49 49 CYS H H 49 9.048 9.048 8.521 0.527 19746 278 1 3 . 1 1 50 50 CYS HA H 50 5.216 5.216 5.022 0.194 19746 279 1 3 . 1 1 50 50 CYS H H 50 9.342 9.342 9.476 -0.134 19746 280 1 3 . 1 1 51 51 SER HA H 51 4.948 4.948 4.669 0.279 19746 281 1 3 . 1 1 51 51 SER H H 51 9.182 9.182 8.685 0.497 19746 282 1 3 . 1 1 52 52 THR HA H 52 4.639 4.639 4.486 0.153 19746 283 1 3 . 1 1 52 52 THR H H 52 7.570 7.570 8.052 -0.482 19746 284 1 3 . 1 1 53 53 ASP HA H 53 4.608 4.608 4.313 0.295 19746 285 1 3 . 1 1 53 53 ASP H H 53 7.844 7.844 7.943 -0.099 19746 286 1 3 . 1 1 54 54 ARG HA H 54 4.182 4.182 3.686 0.496 19746 287 1 3 . 1 1 54 54 ARG H H 54 8.146 8.146 8.301 -0.155 19746 288 1 3 . 1 1 55 55 CYS HA H 55 4.526 4.526 4.401 0.125 19746 289 1 3 . 1 1 55 55 CYS H H 55 7.899 7.899 8.173 -0.274 19746 290 1 3 . 1 1 56 56 ASN HA H 56 4.687 4.687 4.720 -0.033 19746 291 1 3 . 1 1 56 56 ASN H H 56 8.751 8.751 8.267 0.484 19746 292 1 4 . 1 1 2 2 LYS HA H 2 5.347 5.347 4.534 0.813 19746 293 1 4 . 1 1 2 2 LYS H H 2 8.293 8.293 7.565 0.728 19746 294 1 4 . 1 1 3 3 CYS HA H 3 4.901 4.901 4.584 0.317 19746 295 1 4 . 1 1 3 3 CYS H H 3 8.348 8.348 8.176 0.172 19746 296 1 4 . 1 1 4 4 TYR HA H 4 4.541 4.541 4.670 -0.129 19746 297 1 4 . 1 1 4 4 TYR H H 4 9.500 9.500 8.680 0.820 19746 298 1 4 . 1 1 5 5 GLN HA H 5 4.328 4.328 4.194 0.134 19746 299 1 4 . 1 1 5 5 GLN H H 5 9.293 9.293 7.919 1.374 19746 300 1 4 . 1 1 6 6 HIS HA H 6 4.432 4.432 4.785 -0.353 19746 301 1 4 . 1 1 6 6 HIS H H 6 8.622 8.622 7.583 1.039 19746 302 1 4 . 1 1 7 7 GLY H H 7 8.394 8.394 8.662 -0.268 19746 303 1 4 . 1 1 8 8 LYS HA H 8 4.746 4.746 4.912 -0.166 19746 304 1 4 . 1 1 8 8 LYS H H 8 7.667 7.667 7.781 -0.114 19746 305 1 4 . 1 1 9 9 VAL HA H 9 3.808 3.808 3.560 0.248 19746 306 1 4 . 1 1 9 9 VAL H H 9 8.452 8.452 8.382 0.070 19746 307 1 4 . 1 1 10 10 VAL HA H 10 4.578 4.578 4.493 0.085 19746 308 1 4 . 1 1 10 10 VAL H H 10 8.907 8.907 8.571 0.336 19746 309 1 4 . 1 1 11 11 THR HA H 11 4.395 4.395 4.254 0.141 19746 310 1 4 . 1 1 11 11 THR H H 11 8.441 8.441 8.382 0.059 19746 311 1 4 . 1 1 12 12 CYS HA H 12 4.635 4.635 3.979 0.656 19746 312 1 4 . 1 1 12 12 CYS H H 12 8.864 8.864 8.396 0.468 19746 313 1 4 . 1 1 13 13 HIS HA H 13 3.989 3.989 4.500 -0.511 19746 314 1 4 . 1 1 13 13 HIS H H 13 9.706 9.706 7.740 1.966 19746 315 1 4 . 1 1 14 14 ARG HA H 14 4.384 4.384 3.947 0.437 19746 316 1 4 . 1 1 14 14 ARG H H 14 8.791 8.791 8.830 -0.039 19746 317 1 4 . 1 1 15 15 ASP HA H 15 4.544 4.544 4.548 -0.004 19746 318 1 4 . 1 1 15 15 ASP H H 15 7.956 7.956 8.268 -0.312 19746 319 1 4 . 1 1 16 16 MET HA H 16 4.348 4.348 4.420 -0.072 19746 320 1 4 . 1 1 16 16 MET H H 16 8.064 8.064 8.342 -0.278 19746 321 1 4 . 1 1 17 17 LYS HA H 17 4.249 4.249 4.432 -0.183 19746 322 1 4 . 1 1 17 17 LYS H H 17 7.659 7.659 8.846 -1.187 19746 323 1 4 . 1 1 18 18 PHE HA H 18 5.046 5.046 4.968 0.078 19746 324 1 4 . 1 1 18 18 PHE H H 18 8.218 8.218 7.774 0.444 19746 325 1 4 . 1 1 19 19 CYS HA H 19 5.956 5.956 5.105 0.851 19746 326 1 4 . 1 1 19 19 CYS H H 19 9.289 9.289 9.375 -0.086 19746 327 1 4 . 1 1 20 20 TYR HA H 20 6.157 6.157 5.481 0.676 19746 328 1 4 . 1 1 20 20 TYR H H 20 8.847 8.847 9.365 -0.518 19746 329 1 4 . 1 1 21 21 HIS HA H 21 5.154 5.154 4.732 0.422 19746 330 1 4 . 1 1 21 21 HIS H H 21 8.688 8.688 8.519 0.169 19746 331 1 4 . 1 1 22 22 ASN HA H 22 5.767 5.767 5.123 0.644 19746 332 1 4 . 1 1 22 22 ASN H H 22 9.679 9.679 8.108 1.571 19746 333 1 4 . 1 1 23 23 THR HA H 23 4.536 4.536 4.570 -0.034 19746 334 1 4 . 1 1 23 23 THR H H 23 8.501 8.501 8.771 -0.270 19746 335 1 4 . 1 1 24 24 GLY H H 24 8.549 8.549 7.632 0.917 19746 336 1 4 . 1 1 25 25 MET HA H 25 4.791 4.791 4.886 -0.095 19746 337 1 4 . 1 1 25 25 MET H H 25 8.306 8.306 8.106 0.200 19746 338 1 4 . 1 1 30 30 LEU HA H 30 4.376 4.376 4.084 0.292 19746 339 1 4 . 1 1 30 30 LEU H H 30 7.637 7.637 8.544 -0.907 19746 340 1 4 . 1 1 31 31 LYS HA H 31 4.244 4.244 4.495 -0.251 19746 341 1 4 . 1 1 31 31 LYS H H 31 8.000 8.000 8.407 -0.407 19746 342 1 4 . 1 1 32 32 LEU HA H 32 4.431 4.431 4.681 -0.250 19746 343 1 4 . 1 1 32 32 LEU H H 32 7.945 7.945 7.751 0.194 19746 344 1 4 . 1 1 33 33 ILE HA H 33 4.396 4.396 3.858 0.538 19746 345 1 4 . 1 1 33 33 ILE H H 33 8.204 8.204 8.617 -0.413 19746 346 1 4 . 1 1 34 34 LEU HA H 34 4.750 4.750 4.503 0.247 19746 347 1 4 . 1 1 34 34 LEU H H 34 9.084 9.084 8.638 0.446 19746 348 1 4 . 1 1 35 35 GLN HA H 35 4.524 4.524 4.267 0.257 19746 349 1 4 . 1 1 35 35 GLN H H 35 8.010 8.010 7.233 0.777 19746 350 1 4 . 1 1 36 36 GLY H H 36 6.153 6.153 7.191 -1.038 19746 351 1 4 . 1 1 37 37 CYS HA H 37 5.810 5.810 5.490 0.320 19746 352 1 4 . 1 1 37 37 CYS H H 37 8.431 8.431 8.464 -0.033 19746 353 1 4 . 1 1 38 38 SER HA H 38 4.932 4.932 4.751 0.181 19746 354 1 4 . 1 1 38 38 SER H H 38 9.681 9.681 9.320 0.361 19746 355 1 4 . 1 1 39 39 SER HA H 39 4.673 4.673 4.727 -0.054 19746 356 1 4 . 1 1 39 39 SER H H 39 9.087 9.087 8.509 0.578 19746 357 1 4 . 1 1 41 41 CYS HA H 41 4.265 4.265 4.137 0.128 19746 358 1 4 . 1 1 41 41 CYS H H 41 7.898 7.898 7.974 -0.076 19746 359 1 4 . 1 1 42 42 SER HA H 42 4.580 4.580 4.570 0.010 19746 360 1 4 . 1 1 42 42 SER H H 42 8.385 8.385 8.621 -0.236 19746 361 1 4 . 1 1 43 43 GLU HA H 43 4.615 4.615 4.102 0.513 19746 362 1 4 . 1 1 43 43 GLU H H 43 8.790 8.790 8.639 0.151 19746 363 1 4 . 1 1 44 44 THR HA H 44 4.721 4.721 4.715 0.006 19746 364 1 4 . 1 1 44 44 THR H H 44 8.954 8.954 8.618 0.336 19746 365 1 4 . 1 1 45 45 GLU HA H 45 4.056 4.056 4.132 -0.076 19746 366 1 4 . 1 1 45 45 GLU H H 45 8.903 8.903 8.691 0.212 19746 367 1 4 . 1 1 46 46 ASN HA H 46 4.847 4.847 4.759 0.088 19746 368 1 4 . 1 1 46 46 ASN H H 46 7.957 7.957 8.165 -0.208 19746 369 1 4 . 1 1 47 47 ASN HA H 47 5.360 5.360 5.053 0.307 19746 370 1 4 . 1 1 47 47 ASN H H 47 7.729 7.729 8.161 -0.432 19746 371 1 4 . 1 1 48 48 LYS HA H 48 4.782 4.782 4.627 0.155 19746 372 1 4 . 1 1 48 48 LYS H H 48 8.600 8.600 7.766 0.834 19746 373 1 4 . 1 1 49 49 CYS HA H 49 5.517 5.517 5.723 -0.206 19746 374 1 4 . 1 1 49 49 CYS H H 49 9.048 9.048 8.544 0.504 19746 375 1 4 . 1 1 50 50 CYS HA H 50 5.216 5.216 4.887 0.329 19746 376 1 4 . 1 1 50 50 CYS H H 50 9.342 9.342 9.416 -0.074 19746 377 1 4 . 1 1 51 51 SER HA H 51 4.948 4.948 4.467 0.481 19746 378 1 4 . 1 1 51 51 SER H H 51 9.182 9.182 8.476 0.706 19746 379 1 4 . 1 1 52 52 THR HA H 52 4.639 4.639 4.556 0.083 19746 380 1 4 . 1 1 52 52 THR H H 52 7.570 7.570 7.591 -0.021 19746 381 1 4 . 1 1 53 53 ASP HA H 53 4.608 4.608 5.171 -0.563 19746 382 1 4 . 1 1 53 53 ASP H H 53 7.844 7.844 8.307 -0.463 19746 383 1 4 . 1 1 54 54 ARG HA H 54 4.182 4.182 3.660 0.522 19746 384 1 4 . 1 1 54 54 ARG H H 54 8.146 8.146 8.239 -0.093 19746 385 1 4 . 1 1 55 55 CYS HA H 55 4.526 4.526 4.522 0.004 19746 386 1 4 . 1 1 55 55 CYS H H 55 7.899 7.899 7.995 -0.096 19746 387 1 4 . 1 1 56 56 ASN HA H 56 4.687 4.687 4.904 -0.217 19746 388 1 4 . 1 1 56 56 ASN H H 56 8.751 8.751 8.333 0.418 19746 389 1 5 . 1 1 2 2 LYS HA H 2 5.347 5.347 4.889 0.458 19746 390 1 5 . 1 1 2 2 LYS H H 2 8.293 8.293 7.914 0.379 19746 391 1 5 . 1 1 3 3 CYS HA H 3 4.901 4.901 4.666 0.235 19746 392 1 5 . 1 1 3 3 CYS H H 3 8.348 8.348 8.600 -0.252 19746 393 1 5 . 1 1 4 4 TYR HA H 4 4.541 4.541 5.011 -0.470 19746 394 1 5 . 1 1 4 4 TYR H H 4 9.500 9.500 8.427 1.073 19746 395 1 5 . 1 1 5 5 GLN HA H 5 4.328 4.328 4.320 0.008 19746 396 1 5 . 1 1 5 5 GLN H H 5 9.293 9.293 8.170 1.123 19746 397 1 5 . 1 1 6 6 HIS HA H 6 4.432 4.432 4.742 -0.310 19746 398 1 5 . 1 1 6 6 HIS H H 6 8.622 8.622 7.737 0.885 19746 399 1 5 . 1 1 7 7 GLY H H 7 8.394 8.394 8.676 -0.282 19746 400 1 5 . 1 1 8 8 LYS HA H 8 4.746 4.746 4.877 -0.131 19746 401 1 5 . 1 1 8 8 LYS H H 8 7.667 7.667 7.915 -0.248 19746 402 1 5 . 1 1 9 9 VAL HA H 9 3.808 3.808 3.724 0.084 19746 403 1 5 . 1 1 9 9 VAL H H 9 8.452 8.452 8.359 0.093 19746 404 1 5 . 1 1 10 10 VAL HA H 10 4.578 4.578 4.561 0.017 19746 405 1 5 . 1 1 10 10 VAL H H 10 8.907 8.907 8.778 0.129 19746 406 1 5 . 1 1 11 11 THR HA H 11 4.395 4.395 4.464 -0.069 19746 407 1 5 . 1 1 11 11 THR H H 11 8.441 8.441 8.285 0.156 19746 408 1 5 . 1 1 12 12 CYS HA H 12 4.635 4.635 4.238 0.397 19746 409 1 5 . 1 1 12 12 CYS H H 12 8.864 8.864 8.448 0.416 19746 410 1 5 . 1 1 13 13 HIS HA H 13 3.989 3.989 4.365 -0.376 19746 411 1 5 . 1 1 13 13 HIS H H 13 9.706 9.706 8.471 1.235 19746 412 1 5 . 1 1 14 14 ARG HA H 14 4.384 4.384 4.098 0.286 19746 413 1 5 . 1 1 14 14 ARG H H 14 8.791 8.791 8.588 0.203 19746 414 1 5 . 1 1 15 15 ASP HA H 15 4.544 4.544 4.479 0.065 19746 415 1 5 . 1 1 15 15 ASP H H 15 7.956 7.956 8.508 -0.552 19746 416 1 5 . 1 1 16 16 MET HA H 16 4.348 4.348 4.209 0.139 19746 417 1 5 . 1 1 16 16 MET H H 16 8.064 8.064 8.049 0.015 19746 418 1 5 . 1 1 17 17 LYS HA H 17 4.249 4.249 4.363 -0.114 19746 419 1 5 . 1 1 17 17 LYS H H 17 7.659 7.659 8.129 -0.470 19746 420 1 5 . 1 1 18 18 PHE HA H 18 5.046 5.046 5.088 -0.042 19746 421 1 5 . 1 1 18 18 PHE H H 18 8.218 8.218 8.025 0.193 19746 422 1 5 . 1 1 19 19 CYS HA H 19 5.956 5.956 4.926 1.030 19746 423 1 5 . 1 1 19 19 CYS H H 19 9.289 9.289 9.037 0.252 19746 424 1 5 . 1 1 20 20 TYR HA H 20 6.157 6.157 5.119 1.038 19746 425 1 5 . 1 1 20 20 TYR H H 20 8.847 8.847 8.981 -0.134 19746 426 1 5 . 1 1 21 21 HIS HA H 21 5.154 5.154 4.872 0.282 19746 427 1 5 . 1 1 21 21 HIS H H 21 8.688 8.688 8.517 0.171 19746 428 1 5 . 1 1 22 22 ASN HA H 22 5.767 5.767 5.120 0.647 19746 429 1 5 . 1 1 22 22 ASN H H 22 9.679 9.679 8.390 1.288 19746 430 1 5 . 1 1 23 23 THR HA H 23 4.536 4.536 4.508 0.028 19746 431 1 5 . 1 1 23 23 THR H H 23 8.501 8.501 8.960 -0.459 19746 432 1 5 . 1 1 24 24 GLY H H 24 8.549 8.549 7.635 0.914 19746 433 1 5 . 1 1 25 25 MET HA H 25 4.791 4.791 4.894 -0.103 19746 434 1 5 . 1 1 25 25 MET H H 25 8.306 8.306 8.437 -0.131 19746 435 1 5 . 1 1 30 30 LEU HA H 30 4.376 4.376 4.495 -0.119 19746 436 1 5 . 1 1 30 30 LEU H H 30 7.637 7.637 8.201 -0.564 19746 437 1 5 . 1 1 31 31 LYS HA H 31 4.244 4.244 4.242 0.002 19746 438 1 5 . 1 1 31 31 LYS H H 31 8.000 8.000 8.376 -0.376 19746 439 1 5 . 1 1 32 32 LEU HA H 32 4.431 4.431 4.451 -0.020 19746 440 1 5 . 1 1 32 32 LEU H H 32 7.945 7.945 7.942 0.003 19746 441 1 5 . 1 1 33 33 ILE HA H 33 4.396 4.396 4.305 0.091 19746 442 1 5 . 1 1 33 33 ILE H H 33 8.204 8.204 8.328 -0.124 19746 443 1 5 . 1 1 34 34 LEU HA H 34 4.750 4.750 4.698 0.052 19746 444 1 5 . 1 1 34 34 LEU H H 34 9.084 9.084 8.699 0.385 19746 445 1 5 . 1 1 35 35 GLN HA H 35 4.524 4.524 5.092 -0.568 19746 446 1 5 . 1 1 35 35 GLN H H 35 8.010 8.010 7.955 0.055 19746 447 1 5 . 1 1 36 36 GLY H H 36 6.153 6.153 6.952 -0.799 19746 448 1 5 . 1 1 37 37 CYS HA H 37 5.810 5.810 5.528 0.282 19746 449 1 5 . 1 1 37 37 CYS H H 37 8.431 8.431 8.652 -0.221 19746 450 1 5 . 1 1 38 38 SER HA H 38 4.932 4.932 4.870 0.062 19746 451 1 5 . 1 1 38 38 SER H H 38 9.681 9.681 8.993 0.688 19746 452 1 5 . 1 1 39 39 SER HA H 39 4.673 4.673 4.749 -0.076 19746 453 1 5 . 1 1 39 39 SER H H 39 9.087 9.087 8.721 0.366 19746 454 1 5 . 1 1 41 41 CYS HA H 41 4.265 4.265 4.279 -0.014 19746 455 1 5 . 1 1 41 41 CYS H H 41 7.898 7.898 7.845 0.053 19746 456 1 5 . 1 1 42 42 SER HA H 42 4.580 4.580 4.475 0.105 19746 457 1 5 . 1 1 42 42 SER H H 42 8.385 8.385 8.622 -0.237 19746 458 1 5 . 1 1 43 43 GLU HA H 43 4.615 4.615 4.075 0.540 19746 459 1 5 . 1 1 43 43 GLU H H 43 8.790 8.790 8.438 0.352 19746 460 1 5 . 1 1 44 44 THR HA H 44 4.721 4.721 4.576 0.145 19746 461 1 5 . 1 1 44 44 THR H H 44 8.954 8.954 8.418 0.536 19746 462 1 5 . 1 1 45 45 GLU HA H 45 4.056 4.056 3.886 0.170 19746 463 1 5 . 1 1 45 45 GLU H H 45 8.903 8.903 8.847 0.056 19746 464 1 5 . 1 1 46 46 ASN HA H 46 4.847 4.847 4.509 0.338 19746 465 1 5 . 1 1 46 46 ASN H H 46 7.957 7.957 8.228 -0.271 19746 466 1 5 . 1 1 47 47 ASN HA H 47 5.360 5.360 5.182 0.178 19746 467 1 5 . 1 1 47 47 ASN H H 47 7.729 7.729 7.598 0.131 19746 468 1 5 . 1 1 48 48 LYS HA H 48 4.782 4.782 4.514 0.268 19746 469 1 5 . 1 1 48 48 LYS H H 48 8.600 8.600 8.271 0.329 19746 470 1 5 . 1 1 49 49 CYS HA H 49 5.517 5.517 5.054 0.463 19746 471 1 5 . 1 1 49 49 CYS H H 49 9.048 9.048 8.501 0.547 19746 472 1 5 . 1 1 50 50 CYS HA H 50 5.216 5.216 4.884 0.332 19746 473 1 5 . 1 1 50 50 CYS H H 50 9.342 9.342 9.486 -0.144 19746 474 1 5 . 1 1 51 51 SER HA H 51 4.948 4.948 4.732 0.216 19746 475 1 5 . 1 1 51 51 SER H H 51 9.182 9.182 8.872 0.310 19746 476 1 5 . 1 1 52 52 THR HA H 52 4.639 4.639 4.569 0.070 19746 477 1 5 . 1 1 52 52 THR H H 52 7.570 7.570 7.479 0.091 19746 478 1 5 . 1 1 53 53 ASP HA H 53 4.608 4.608 4.719 -0.111 19746 479 1 5 . 1 1 53 53 ASP H H 53 7.844 7.844 8.328 -0.484 19746 480 1 5 . 1 1 54 54 ARG HA H 54 4.182 4.182 3.700 0.482 19746 481 1 5 . 1 1 54 54 ARG H H 54 8.146 8.146 8.568 -0.422 19746 482 1 5 . 1 1 55 55 CYS HA H 55 4.526 4.526 4.217 0.309 19746 483 1 5 . 1 1 55 55 CYS H H 55 7.899 7.899 7.896 0.003 19746 484 1 5 . 1 1 56 56 ASN HA H 56 4.687 4.687 4.407 0.281 19746 485 1 5 . 1 1 56 56 ASN H H 56 8.751 8.751 8.339 0.412 19746 486 1 6 . 1 1 2 2 LYS HA H 2 5.347 5.347 4.632 0.715 19746 487 1 6 . 1 1 2 2 LYS H H 2 8.293 8.293 7.808 0.485 19746 488 1 6 . 1 1 3 3 CYS HA H 3 4.901 4.901 4.761 0.140 19746 489 1 6 . 1 1 3 3 CYS H H 3 8.348 8.348 8.341 0.007 19746 490 1 6 . 1 1 4 4 TYR HA H 4 4.541 4.541 4.389 0.152 19746 491 1 6 . 1 1 4 4 TYR H H 4 9.500 9.500 8.825 0.675 19746 492 1 6 . 1 1 5 5 GLN HA H 5 4.328 4.328 4.330 -0.002 19746 493 1 6 . 1 1 5 5 GLN H H 5 9.293 9.293 7.870 1.423 19746 494 1 6 . 1 1 6 6 HIS HA H 6 4.432 4.432 4.770 -0.338 19746 495 1 6 . 1 1 6 6 HIS H H 6 8.622 8.622 8.042 0.580 19746 496 1 6 . 1 1 7 7 GLY H H 7 8.394 8.394 8.629 -0.235 19746 497 1 6 . 1 1 8 8 LYS HA H 8 4.746 4.746 4.825 -0.079 19746 498 1 6 . 1 1 8 8 LYS H H 8 7.667 7.667 7.900 -0.233 19746 499 1 6 . 1 1 9 9 VAL HA H 9 3.808 3.808 3.436 0.372 19746 500 1 6 . 1 1 9 9 VAL H H 9 8.452 8.452 8.208 0.244 19746 501 1 6 . 1 1 10 10 VAL HA H 10 4.578 4.578 4.521 0.057 19746 502 1 6 . 1 1 10 10 VAL H H 10 8.907 8.907 7.998 0.909 19746 503 1 6 . 1 1 11 11 THR HA H 11 4.395 4.395 4.424 -0.029 19746 504 1 6 . 1 1 11 11 THR H H 11 8.441 8.441 8.271 0.170 19746 505 1 6 . 1 1 12 12 CYS HA H 12 4.635 4.635 4.292 0.343 19746 506 1 6 . 1 1 12 12 CYS H H 12 8.864 8.864 8.557 0.307 19746 507 1 6 . 1 1 13 13 HIS HA H 13 3.989 3.989 4.430 -0.441 19746 508 1 6 . 1 1 13 13 HIS H H 13 9.706 9.706 9.158 0.548 19746 509 1 6 . 1 1 14 14 ARG HA H 14 4.384 4.384 4.240 0.144 19746 510 1 6 . 1 1 14 14 ARG H H 14 8.791 8.791 8.669 0.122 19746 511 1 6 . 1 1 15 15 ASP HA H 15 4.544 4.544 4.591 -0.047 19746 512 1 6 . 1 1 15 15 ASP H H 15 7.956 7.956 8.323 -0.367 19746 513 1 6 . 1 1 16 16 MET HA H 16 4.348 4.348 4.402 -0.054 19746 514 1 6 . 1 1 16 16 MET H H 16 8.064 8.064 8.405 -0.341 19746 515 1 6 . 1 1 17 17 LYS HA H 17 4.249 4.249 4.377 -0.128 19746 516 1 6 . 1 1 17 17 LYS H H 17 7.659 7.659 8.800 -1.141 19746 517 1 6 . 1 1 18 18 PHE HA H 18 5.046 5.046 5.119 -0.073 19746 518 1 6 . 1 1 18 18 PHE H H 18 8.218 8.218 7.725 0.493 19746 519 1 6 . 1 1 19 19 CYS HA H 19 5.956 5.956 5.148 0.808 19746 520 1 6 . 1 1 19 19 CYS H H 19 9.289 9.289 8.876 0.413 19746 521 1 6 . 1 1 20 20 TYR HA H 20 6.157 6.157 4.957 1.200 19746 522 1 6 . 1 1 20 20 TYR H H 20 8.847 8.847 9.234 -0.387 19746 523 1 6 . 1 1 21 21 HIS HA H 21 5.154 5.154 4.730 0.424 19746 524 1 6 . 1 1 21 21 HIS H H 21 8.688 8.688 8.076 0.612 19746 525 1 6 . 1 1 22 22 ASN HA H 22 5.767 5.767 5.512 0.255 19746 526 1 6 . 1 1 22 22 ASN H H 22 9.679 9.679 9.037 0.642 19746 527 1 6 . 1 1 23 23 THR HA H 23 4.536 4.536 4.663 -0.127 19746 528 1 6 . 1 1 23 23 THR H H 23 8.501 8.501 9.116 -0.615 19746 529 1 6 . 1 1 24 24 GLY H H 24 8.549 8.549 9.162 -0.613 19746 530 1 6 . 1 1 25 25 MET HA H 25 4.791 4.791 4.953 -0.162 19746 531 1 6 . 1 1 25 25 MET H H 25 8.306 8.306 8.163 0.143 19746 532 1 6 . 1 1 30 30 LEU HA H 30 4.376 4.376 4.429 -0.053 19746 533 1 6 . 1 1 30 30 LEU H H 30 7.637 7.637 8.410 -0.773 19746 534 1 6 . 1 1 31 31 LYS HA H 31 4.244 4.244 4.534 -0.290 19746 535 1 6 . 1 1 31 31 LYS H H 31 8.000 8.000 8.104 -0.104 19746 536 1 6 . 1 1 32 32 LEU HA H 32 4.431 4.431 4.545 -0.114 19746 537 1 6 . 1 1 32 32 LEU H H 32 7.945 7.945 8.218 -0.273 19746 538 1 6 . 1 1 33 33 ILE HA H 33 4.396 4.396 3.954 0.442 19746 539 1 6 . 1 1 33 33 ILE H H 33 8.204 8.204 8.462 -0.258 19746 540 1 6 . 1 1 34 34 LEU HA H 34 4.750 4.750 4.637 0.113 19746 541 1 6 . 1 1 34 34 LEU H H 34 9.084 9.084 8.431 0.653 19746 542 1 6 . 1 1 35 35 GLN HA H 35 4.524 4.524 4.458 0.066 19746 543 1 6 . 1 1 35 35 GLN H H 35 8.010 8.010 7.755 0.255 19746 544 1 6 . 1 1 36 36 GLY H H 36 6.153 6.153 7.189 -1.036 19746 545 1 6 . 1 1 37 37 CYS HA H 37 5.810 5.810 5.583 0.227 19746 546 1 6 . 1 1 37 37 CYS H H 37 8.431 8.431 8.722 -0.291 19746 547 1 6 . 1 1 38 38 SER HA H 38 4.932 4.932 4.765 0.167 19746 548 1 6 . 1 1 38 38 SER H H 38 9.681 9.681 8.992 0.689 19746 549 1 6 . 1 1 39 39 SER HA H 39 4.673 4.673 4.481 0.192 19746 550 1 6 . 1 1 39 39 SER H H 39 9.087 9.087 8.779 0.308 19746 551 1 6 . 1 1 41 41 CYS HA H 41 4.265 4.265 4.269 -0.004 19746 552 1 6 . 1 1 41 41 CYS H H 41 7.898 7.898 7.753 0.145 19746 553 1 6 . 1 1 42 42 SER HA H 42 4.580 4.580 4.407 0.173 19746 554 1 6 . 1 1 42 42 SER H H 42 8.385 8.385 8.423 -0.038 19746 555 1 6 . 1 1 43 43 GLU HA H 43 4.615 4.615 3.893 0.722 19746 556 1 6 . 1 1 43 43 GLU H H 43 8.790 8.790 8.081 0.710 19746 557 1 6 . 1 1 44 44 THR HA H 44 4.721 4.721 4.587 0.134 19746 558 1 6 . 1 1 44 44 THR H H 44 8.954 8.954 8.576 0.378 19746 559 1 6 . 1 1 45 45 GLU HA H 45 4.056 4.056 3.877 0.179 19746 560 1 6 . 1 1 45 45 GLU H H 45 8.903 8.903 8.677 0.226 19746 561 1 6 . 1 1 46 46 ASN HA H 46 4.847 4.847 4.610 0.237 19746 562 1 6 . 1 1 46 46 ASN H H 46 7.957 7.957 8.099 -0.142 19746 563 1 6 . 1 1 47 47 ASN HA H 47 5.360 5.360 5.517 -0.157 19746 564 1 6 . 1 1 47 47 ASN H H 47 7.729 7.729 7.926 -0.197 19746 565 1 6 . 1 1 48 48 LYS HA H 48 4.782 4.782 4.472 0.310 19746 566 1 6 . 1 1 48 48 LYS H H 48 8.600 8.600 8.404 0.196 19746 567 1 6 . 1 1 49 49 CYS HA H 49 5.517 5.517 4.777 0.740 19746 568 1 6 . 1 1 49 49 CYS H H 49 9.048 9.048 8.006 1.042 19746 569 1 6 . 1 1 50 50 CYS HA H 50 5.216 5.216 4.973 0.243 19746 570 1 6 . 1 1 50 50 CYS H H 50 9.342 9.342 9.426 -0.084 19746 571 1 6 . 1 1 51 51 SER HA H 51 4.948 4.948 4.589 0.359 19746 572 1 6 . 1 1 51 51 SER H H 51 9.182 9.182 9.014 0.168 19746 573 1 6 . 1 1 52 52 THR HA H 52 4.639 4.639 4.463 0.176 19746 574 1 6 . 1 1 52 52 THR H H 52 7.570 7.570 7.896 -0.326 19746 575 1 6 . 1 1 53 53 ASP HA H 53 4.608 4.608 4.189 0.419 19746 576 1 6 . 1 1 53 53 ASP H H 53 7.844 7.844 7.975 -0.131 19746 577 1 6 . 1 1 54 54 ARG HA H 54 4.182 4.182 3.700 0.482 19746 578 1 6 . 1 1 54 54 ARG H H 54 8.146 8.146 8.555 -0.409 19746 579 1 6 . 1 1 55 55 CYS HA H 55 4.526 4.526 4.306 0.220 19746 580 1 6 . 1 1 55 55 CYS H H 55 7.899 7.899 8.479 -0.580 19746 581 1 6 . 1 1 56 56 ASN HA H 56 4.687 4.687 4.003 0.684 19746 582 1 6 . 1 1 56 56 ASN H H 56 8.751 8.751 8.252 0.499 19746 583 1 7 . 1 1 2 2 LYS HA H 2 5.347 5.347 4.961 0.386 19746 584 1 7 . 1 1 2 2 LYS H H 2 8.293 8.293 7.401 0.892 19746 585 1 7 . 1 1 3 3 CYS HA H 3 4.901 4.901 4.703 0.198 19746 586 1 7 . 1 1 3 3 CYS H H 3 8.348 8.348 8.841 -0.493 19746 587 1 7 . 1 1 4 4 TYR HA H 4 4.541 4.541 5.232 -0.691 19746 588 1 7 . 1 1 4 4 TYR H H 4 9.500 9.500 8.338 1.162 19746 589 1 7 . 1 1 5 5 GLN HA H 5 4.328 4.328 4.398 -0.070 19746 590 1 7 . 1 1 5 5 GLN H H 5 9.293 9.293 8.160 1.133 19746 591 1 7 . 1 1 6 6 HIS HA H 6 4.432 4.432 4.703 -0.271 19746 592 1 7 . 1 1 6 6 HIS H H 6 8.622 8.622 8.336 0.286 19746 593 1 7 . 1 1 7 7 GLY H H 7 8.394 8.394 8.637 -0.243 19746 594 1 7 . 1 1 8 8 LYS HA H 8 4.746 4.746 4.679 0.067 19746 595 1 7 . 1 1 8 8 LYS H H 8 7.667 7.667 7.968 -0.301 19746 596 1 7 . 1 1 9 9 VAL HA H 9 3.808 3.808 4.057 -0.249 19746 597 1 7 . 1 1 9 9 VAL H H 9 8.452 8.452 8.279 0.173 19746 598 1 7 . 1 1 10 10 VAL HA H 10 4.578 4.578 4.472 0.106 19746 599 1 7 . 1 1 10 10 VAL H H 10 8.907 8.907 8.801 0.106 19746 600 1 7 . 1 1 11 11 THR HA H 11 4.395 4.395 4.626 -0.231 19746 601 1 7 . 1 1 11 11 THR H H 11 8.441 8.441 8.337 0.104 19746 602 1 7 . 1 1 12 12 CYS HA H 12 4.635 4.635 4.224 0.411 19746 603 1 7 . 1 1 12 12 CYS H H 12 8.864 8.864 8.173 0.691 19746 604 1 7 . 1 1 13 13 HIS HA H 13 3.989 3.989 4.744 -0.755 19746 605 1 7 . 1 1 13 13 HIS H H 13 9.706 9.706 8.354 1.352 19746 606 1 7 . 1 1 14 14 ARG HA H 14 4.384 4.384 3.860 0.524 19746 607 1 7 . 1 1 14 14 ARG H H 14 8.791 8.791 8.265 0.526 19746 608 1 7 . 1 1 15 15 ASP HA H 15 4.544 4.544 4.479 0.065 19746 609 1 7 . 1 1 15 15 ASP H H 15 7.956 7.956 7.836 0.120 19746 610 1 7 . 1 1 16 16 MET HA H 16 4.348 4.348 4.209 0.139 19746 611 1 7 . 1 1 16 16 MET H H 16 8.064 8.064 7.701 0.363 19746 612 1 7 . 1 1 17 17 LYS HA H 17 4.249 4.249 4.342 -0.093 19746 613 1 7 . 1 1 17 17 LYS H H 17 7.659 7.659 8.106 -0.447 19746 614 1 7 . 1 1 18 18 PHE HA H 18 5.046 5.046 5.042 0.004 19746 615 1 7 . 1 1 18 18 PHE H H 18 8.218 8.218 7.549 0.669 19746 616 1 7 . 1 1 19 19 CYS HA H 19 5.956 5.956 4.958 0.998 19746 617 1 7 . 1 1 19 19 CYS H H 19 9.289 9.289 9.457 -0.168 19746 618 1 7 . 1 1 20 20 TYR HA H 20 6.157 6.157 5.604 0.553 19746 619 1 7 . 1 1 20 20 TYR H H 20 8.847 8.847 9.275 -0.428 19746 620 1 7 . 1 1 21 21 HIS HA H 21 5.154 5.154 4.769 0.385 19746 621 1 7 . 1 1 21 21 HIS H H 21 8.688 8.688 8.689 -0.001 19746 622 1 7 . 1 1 22 22 ASN HA H 22 5.767 5.767 5.232 0.535 19746 623 1 7 . 1 1 22 22 ASN H H 22 9.679 9.679 9.212 0.467 19746 624 1 7 . 1 1 23 23 THR HA H 23 4.536 4.536 4.721 -0.185 19746 625 1 7 . 1 1 23 23 THR H H 23 8.501 8.501 8.690 -0.189 19746 626 1 7 . 1 1 24 24 GLY H H 24 8.549 8.549 8.587 -0.038 19746 627 1 7 . 1 1 25 25 MET HA H 25 4.791 4.791 4.121 0.670 19746 628 1 7 . 1 1 25 25 MET H H 25 8.306 8.306 8.198 0.108 19746 629 1 7 . 1 1 30 30 LEU HA H 30 4.376 4.376 4.550 -0.174 19746 630 1 7 . 1 1 30 30 LEU H H 30 7.637 7.637 7.783 -0.146 19746 631 1 7 . 1 1 31 31 LYS HA H 31 4.244 4.244 4.197 0.048 19746 632 1 7 . 1 1 31 31 LYS H H 31 8.000 8.000 8.003 -0.003 19746 633 1 7 . 1 1 32 32 LEU HA H 32 4.431 4.431 4.297 0.134 19746 634 1 7 . 1 1 32 32 LEU H H 32 7.945 7.945 7.927 0.018 19746 635 1 7 . 1 1 33 33 ILE HA H 33 4.396 4.396 4.103 0.293 19746 636 1 7 . 1 1 33 33 ILE H H 33 8.204 8.204 8.458 -0.254 19746 637 1 7 . 1 1 34 34 LEU HA H 34 4.750 4.750 4.641 0.109 19746 638 1 7 . 1 1 34 34 LEU H H 34 9.084 9.084 8.878 0.206 19746 639 1 7 . 1 1 35 35 GLN HA H 35 4.524 4.524 4.328 0.196 19746 640 1 7 . 1 1 35 35 GLN H H 35 8.010 8.010 8.024 -0.014 19746 641 1 7 . 1 1 36 36 GLY H H 36 6.153 6.153 6.541 -0.388 19746 642 1 7 . 1 1 37 37 CYS HA H 37 5.810 5.810 5.522 0.288 19746 643 1 7 . 1 1 37 37 CYS H H 37 8.431 8.431 8.300 0.131 19746 644 1 7 . 1 1 38 38 SER HA H 38 4.932 4.932 4.803 0.129 19746 645 1 7 . 1 1 38 38 SER H H 38 9.681 9.681 8.915 0.766 19746 646 1 7 . 1 1 39 39 SER HA H 39 4.673 4.673 4.522 0.151 19746 647 1 7 . 1 1 39 39 SER H H 39 9.087 9.087 8.856 0.231 19746 648 1 7 . 1 1 41 41 CYS HA H 41 4.265 4.265 4.520 -0.255 19746 649 1 7 . 1 1 41 41 CYS H H 41 7.898 7.898 8.901 -1.003 19746 650 1 7 . 1 1 42 42 SER HA H 42 4.580 4.580 4.568 0.012 19746 651 1 7 . 1 1 42 42 SER H H 42 8.385 8.385 8.629 -0.244 19746 652 1 7 . 1 1 43 43 GLU HA H 43 4.615 4.615 4.068 0.547 19746 653 1 7 . 1 1 43 43 GLU H H 43 8.790 8.790 8.565 0.225 19746 654 1 7 . 1 1 44 44 THR HA H 44 4.721 4.721 4.599 0.121 19746 655 1 7 . 1 1 44 44 THR H H 44 8.954 8.954 8.647 0.307 19746 656 1 7 . 1 1 45 45 GLU HA H 45 4.056 4.056 3.935 0.121 19746 657 1 7 . 1 1 45 45 GLU H H 45 8.903 8.903 8.837 0.066 19746 658 1 7 . 1 1 46 46 ASN HA H 46 4.847 4.847 4.599 0.248 19746 659 1 7 . 1 1 46 46 ASN H H 46 7.957 7.957 8.008 -0.051 19746 660 1 7 . 1 1 47 47 ASN HA H 47 5.360 5.360 4.940 0.420 19746 661 1 7 . 1 1 47 47 ASN H H 47 7.729 7.729 8.194 -0.465 19746 662 1 7 . 1 1 48 48 LYS HA H 48 4.782 4.782 4.884 -0.102 19746 663 1 7 . 1 1 48 48 LYS H H 48 8.600 8.600 7.847 0.753 19746 664 1 7 . 1 1 49 49 CYS HA H 49 5.517 5.517 5.679 -0.162 19746 665 1 7 . 1 1 49 49 CYS H H 49 9.048 9.048 8.468 0.580 19746 666 1 7 . 1 1 50 50 CYS HA H 50 5.216 5.216 4.990 0.226 19746 667 1 7 . 1 1 50 50 CYS H H 50 9.342 9.342 9.492 -0.150 19746 668 1 7 . 1 1 51 51 SER HA H 51 4.948 4.948 5.106 -0.158 19746 669 1 7 . 1 1 51 51 SER H H 51 9.182 9.182 8.856 0.326 19746 670 1 7 . 1 1 52 52 THR HA H 52 4.639 4.639 4.645 -0.006 19746 671 1 7 . 1 1 52 52 THR H H 52 7.570 7.570 7.574 -0.004 19746 672 1 7 . 1 1 53 53 ASP HA H 53 4.608 4.608 5.357 -0.749 19746 673 1 7 . 1 1 53 53 ASP H H 53 7.844 7.844 8.416 -0.572 19746 674 1 7 . 1 1 54 54 ARG HA H 54 4.182 4.182 4.072 0.110 19746 675 1 7 . 1 1 54 54 ARG H H 54 8.146 8.146 8.275 -0.129 19746 676 1 7 . 1 1 55 55 CYS HA H 55 4.526 4.526 4.617 -0.091 19746 677 1 7 . 1 1 55 55 CYS H H 55 7.899 7.899 8.477 -0.578 19746 678 1 7 . 1 1 56 56 ASN HA H 56 4.687 4.687 4.411 0.276 19746 679 1 7 . 1 1 56 56 ASN H H 56 8.751 8.751 8.689 0.062 19746 680 1 8 . 1 1 2 2 LYS HA H 2 5.347 5.347 4.808 0.539 19746 681 1 8 . 1 1 2 2 LYS H H 2 8.293 8.293 7.806 0.487 19746 682 1 8 . 1 1 3 3 CYS HA H 3 4.901 4.901 4.621 0.280 19746 683 1 8 . 1 1 3 3 CYS H H 3 8.348 8.348 8.427 -0.079 19746 684 1 8 . 1 1 4 4 TYR HA H 4 4.541 4.541 4.473 0.068 19746 685 1 8 . 1 1 4 4 TYR H H 4 9.500 9.500 8.325 1.175 19746 686 1 8 . 1 1 5 5 GLN HA H 5 4.328 4.328 4.383 -0.055 19746 687 1 8 . 1 1 5 5 GLN H H 5 9.293 9.293 8.106 1.187 19746 688 1 8 . 1 1 6 6 HIS HA H 6 4.432 4.432 4.762 -0.330 19746 689 1 8 . 1 1 6 6 HIS H H 6 8.622 8.622 8.078 0.544 19746 690 1 8 . 1 1 7 7 GLY H H 7 8.394 8.394 8.660 -0.266 19746 691 1 8 . 1 1 8 8 LYS HA H 8 4.746 4.746 4.835 -0.089 19746 692 1 8 . 1 1 8 8 LYS H H 8 7.667 7.667 7.858 -0.191 19746 693 1 8 . 1 1 9 9 VAL HA H 9 3.808 3.808 3.402 0.406 19746 694 1 8 . 1 1 9 9 VAL H H 9 8.452 8.452 8.345 0.107 19746 695 1 8 . 1 1 10 10 VAL HA H 10 4.578 4.578 4.504 0.074 19746 696 1 8 . 1 1 10 10 VAL H H 10 8.907 8.907 8.620 0.287 19746 697 1 8 . 1 1 11 11 THR HA H 11 4.395 4.395 4.378 0.017 19746 698 1 8 . 1 1 11 11 THR H H 11 8.441 8.441 8.337 0.104 19746 699 1 8 . 1 1 12 12 CYS HA H 12 4.635 4.635 3.944 0.691 19746 700 1 8 . 1 1 12 12 CYS H H 12 8.864 8.864 7.937 0.927 19746 701 1 8 . 1 1 13 13 HIS HA H 13 3.989 3.989 4.326 -0.337 19746 702 1 8 . 1 1 13 13 HIS H H 13 9.706 9.706 8.154 1.552 19746 703 1 8 . 1 1 14 14 ARG HA H 14 4.384 4.384 4.114 0.270 19746 704 1 8 . 1 1 14 14 ARG H H 14 8.791 8.791 8.690 0.101 19746 705 1 8 . 1 1 15 15 ASP HA H 15 4.544 4.544 4.541 0.003 19746 706 1 8 . 1 1 15 15 ASP H H 15 7.956 7.956 8.216 -0.260 19746 707 1 8 . 1 1 16 16 MET HA H 16 4.348 4.348 4.368 -0.020 19746 708 1 8 . 1 1 16 16 MET H H 16 8.064 8.064 8.296 -0.232 19746 709 1 8 . 1 1 17 17 LYS HA H 17 4.249 4.249 4.189 0.060 19746 710 1 8 . 1 1 17 17 LYS H H 17 7.659 7.659 8.336 -0.677 19746 711 1 8 . 1 1 18 18 PHE HA H 18 5.046 5.046 4.910 0.136 19746 712 1 8 . 1 1 18 18 PHE H H 18 8.218 8.218 7.285 0.933 19746 713 1 8 . 1 1 19 19 CYS HA H 19 5.956 5.956 5.006 0.950 19746 714 1 8 . 1 1 19 19 CYS H H 19 9.289 9.289 8.950 0.339 19746 715 1 8 . 1 1 20 20 TYR HA H 20 6.157 6.157 5.623 0.534 19746 716 1 8 . 1 1 20 20 TYR H H 20 8.847 8.847 8.983 -0.136 19746 717 1 8 . 1 1 21 21 HIS HA H 21 5.154 5.154 4.829 0.325 19746 718 1 8 . 1 1 21 21 HIS H H 21 8.688 8.688 8.707 -0.019 19746 719 1 8 . 1 1 22 22 ASN HA H 22 5.767 5.767 5.079 0.688 19746 720 1 8 . 1 1 22 22 ASN H H 22 9.679 9.679 8.378 1.301 19746 721 1 8 . 1 1 23 23 THR HA H 23 4.536 4.536 4.474 0.062 19746 722 1 8 . 1 1 23 23 THR H H 23 8.501 8.501 9.208 -0.707 19746 723 1 8 . 1 1 24 24 GLY H H 24 8.549 8.549 8.754 -0.205 19746 724 1 8 . 1 1 25 25 MET HA H 25 4.791 4.791 4.053 0.738 19746 725 1 8 . 1 1 25 25 MET H H 25 8.306 8.306 8.249 0.057 19746 726 1 8 . 1 1 30 30 LEU HA H 30 4.376 4.376 4.589 -0.213 19746 727 1 8 . 1 1 30 30 LEU H H 30 7.637 7.637 8.226 -0.589 19746 728 1 8 . 1 1 31 31 LYS HA H 31 4.244 4.244 4.342 -0.098 19746 729 1 8 . 1 1 31 31 LYS H H 31 8.000 8.000 8.230 -0.230 19746 730 1 8 . 1 1 32 32 LEU HA H 32 4.431 4.431 4.138 0.293 19746 731 1 8 . 1 1 32 32 LEU H H 32 7.945 7.945 7.605 0.340 19746 732 1 8 . 1 1 33 33 ILE HA H 33 4.396 4.396 3.714 0.682 19746 733 1 8 . 1 1 33 33 ILE H H 33 8.204 8.204 8.014 0.190 19746 734 1 8 . 1 1 34 34 LEU HA H 34 4.750 4.750 4.544 0.206 19746 735 1 8 . 1 1 34 34 LEU H H 34 9.084 9.084 7.935 1.149 19746 736 1 8 . 1 1 35 35 GLN HA H 35 4.524 4.524 4.311 0.213 19746 737 1 8 . 1 1 35 35 GLN H H 35 8.010 8.010 7.574 0.436 19746 738 1 8 . 1 1 36 36 GLY H H 36 6.153 6.153 7.368 -1.215 19746 739 1 8 . 1 1 37 37 CYS HA H 37 5.810 5.810 5.569 0.241 19746 740 1 8 . 1 1 37 37 CYS H H 37 8.431 8.431 8.812 -0.381 19746 741 1 8 . 1 1 38 38 SER HA H 38 4.932 4.932 4.720 0.212 19746 742 1 8 . 1 1 38 38 SER H H 38 9.681 9.681 9.052 0.629 19746 743 1 8 . 1 1 39 39 SER HA H 39 4.673 4.673 4.567 0.106 19746 744 1 8 . 1 1 39 39 SER H H 39 9.087 9.087 9.081 0.006 19746 745 1 8 . 1 1 41 41 CYS HA H 41 4.265 4.265 4.171 0.094 19746 746 1 8 . 1 1 41 41 CYS H H 41 7.898 7.898 8.038 -0.140 19746 747 1 8 . 1 1 42 42 SER HA H 42 4.580 4.580 4.447 0.133 19746 748 1 8 . 1 1 42 42 SER H H 42 8.385 8.385 8.477 -0.092 19746 749 1 8 . 1 1 43 43 GLU HA H 43 4.615 4.615 4.124 0.491 19746 750 1 8 . 1 1 43 43 GLU H H 43 8.790 8.790 8.243 0.547 19746 751 1 8 . 1 1 44 44 THR HA H 44 4.721 4.721 4.464 0.257 19746 752 1 8 . 1 1 44 44 THR H H 44 8.954 8.954 8.444 0.510 19746 753 1 8 . 1 1 45 45 GLU HA H 45 4.056 4.056 3.935 0.121 19746 754 1 8 . 1 1 45 45 GLU H H 45 8.903 8.903 8.802 0.101 19746 755 1 8 . 1 1 46 46 ASN HA H 46 4.847 4.847 4.558 0.289 19746 756 1 8 . 1 1 46 46 ASN H H 46 7.957 7.957 8.225 -0.268 19746 757 1 8 . 1 1 47 47 ASN HA H 47 5.360 5.360 4.996 0.364 19746 758 1 8 . 1 1 47 47 ASN H H 47 7.729 7.729 7.367 0.362 19746 759 1 8 . 1 1 48 48 LYS HA H 48 4.782 4.782 4.793 -0.011 19746 760 1 8 . 1 1 48 48 LYS H H 48 8.600 8.600 7.922 0.678 19746 761 1 8 . 1 1 49 49 CYS HA H 49 5.517 5.517 5.426 0.091 19746 762 1 8 . 1 1 49 49 CYS H H 49 9.048 9.048 8.667 0.381 19746 763 1 8 . 1 1 50 50 CYS HA H 50 5.216 5.216 4.818 0.398 19746 764 1 8 . 1 1 50 50 CYS H H 50 9.342 9.342 9.446 -0.104 19746 765 1 8 . 1 1 51 51 SER HA H 51 4.948 4.948 4.818 0.130 19746 766 1 8 . 1 1 51 51 SER H H 51 9.182 9.182 8.877 0.305 19746 767 1 8 . 1 1 52 52 THR HA H 52 4.639 4.639 4.592 0.047 19746 768 1 8 . 1 1 52 52 THR H H 52 7.570 7.570 7.446 0.124 19746 769 1 8 . 1 1 53 53 ASP HA H 53 4.608 4.608 4.699 -0.091 19746 770 1 8 . 1 1 53 53 ASP H H 53 7.844 7.844 8.591 -0.747 19746 771 1 8 . 1 1 54 54 ARG HA H 54 4.182 4.182 3.831 0.351 19746 772 1 8 . 1 1 54 54 ARG H H 54 8.146 8.146 8.566 -0.420 19746 773 1 8 . 1 1 55 55 CYS HA H 55 4.526 4.526 4.207 0.319 19746 774 1 8 . 1 1 55 55 CYS H H 55 7.899 7.899 8.191 -0.292 19746 775 1 8 . 1 1 56 56 ASN HA H 56 4.687 4.687 4.420 0.267 19746 776 1 8 . 1 1 56 56 ASN H H 56 8.751 8.751 8.234 0.517 19746 777 1 9 . 1 1 2 2 LYS HA H 2 5.347 5.347 4.521 0.826 19746 778 1 9 . 1 1 2 2 LYS H H 2 8.293 8.293 7.970 0.323 19746 779 1 9 . 1 1 3 3 CYS HA H 3 4.901 4.901 4.469 0.432 19746 780 1 9 . 1 1 3 3 CYS H H 3 8.348 8.348 8.428 -0.080 19746 781 1 9 . 1 1 4 4 TYR HA H 4 4.541 4.541 4.868 -0.327 19746 782 1 9 . 1 1 4 4 TYR H H 4 9.500 9.500 8.469 1.031 19746 783 1 9 . 1 1 5 5 GLN HA H 5 4.328 4.328 4.212 0.116 19746 784 1 9 . 1 1 5 5 GLN H H 5 9.293 9.293 7.876 1.417 19746 785 1 9 . 1 1 6 6 HIS HA H 6 4.432 4.432 4.757 -0.325 19746 786 1 9 . 1 1 6 6 HIS H H 6 8.622 8.622 7.679 0.943 19746 787 1 9 . 1 1 7 7 GLY H H 7 8.394 8.394 8.753 -0.359 19746 788 1 9 . 1 1 8 8 LYS HA H 8 4.746 4.746 4.901 -0.155 19746 789 1 9 . 1 1 8 8 LYS H H 8 7.667 7.667 7.827 -0.160 19746 790 1 9 . 1 1 9 9 VAL HA H 9 3.808 3.808 3.733 0.075 19746 791 1 9 . 1 1 9 9 VAL H H 9 8.452 8.452 8.292 0.160 19746 792 1 9 . 1 1 10 10 VAL HA H 10 4.578 4.578 4.521 0.057 19746 793 1 9 . 1 1 10 10 VAL H H 10 8.907 8.907 8.813 0.094 19746 794 1 9 . 1 1 11 11 THR HA H 11 4.395 4.395 4.286 0.109 19746 795 1 9 . 1 1 11 11 THR H H 11 8.441 8.441 8.338 0.103 19746 796 1 9 . 1 1 12 12 CYS HA H 12 4.635 4.635 4.490 0.145 19746 797 1 9 . 1 1 12 12 CYS H H 12 8.864 8.864 8.479 0.385 19746 798 1 9 . 1 1 13 13 HIS HA H 13 3.989 3.989 4.453 -0.464 19746 799 1 9 . 1 1 13 13 HIS H H 13 9.706 9.706 8.669 1.037 19746 800 1 9 . 1 1 14 14 ARG HA H 14 4.384 4.384 4.031 0.353 19746 801 1 9 . 1 1 14 14 ARG H H 14 8.791 8.791 8.090 0.701 19746 802 1 9 . 1 1 15 15 ASP HA H 15 4.544 4.544 4.495 0.049 19746 803 1 9 . 1 1 15 15 ASP H H 15 7.956 7.956 7.797 0.159 19746 804 1 9 . 1 1 16 16 MET HA H 16 4.348 4.348 4.585 -0.237 19746 805 1 9 . 1 1 16 16 MET H H 16 8.064 8.064 8.186 -0.122 19746 806 1 9 . 1 1 17 17 LYS HA H 17 4.249 4.249 4.455 -0.206 19746 807 1 9 . 1 1 17 17 LYS H H 17 7.659 7.659 8.551 -0.892 19746 808 1 9 . 1 1 18 18 PHE HA H 18 5.046 5.046 4.969 0.077 19746 809 1 9 . 1 1 18 18 PHE H H 18 8.218 8.218 7.775 0.443 19746 810 1 9 . 1 1 19 19 CYS HA H 19 5.956 5.956 5.248 0.708 19746 811 1 9 . 1 1 19 19 CYS H H 19 9.289 9.289 8.752 0.537 19746 812 1 9 . 1 1 20 20 TYR HA H 20 6.157 6.157 5.173 0.984 19746 813 1 9 . 1 1 20 20 TYR H H 20 8.847 8.847 9.327 -0.480 19746 814 1 9 . 1 1 21 21 HIS HA H 21 5.154 5.154 4.692 0.462 19746 815 1 9 . 1 1 21 21 HIS H H 21 8.688 8.688 8.533 0.155 19746 816 1 9 . 1 1 22 22 ASN HA H 22 5.767 5.767 5.229 0.538 19746 817 1 9 . 1 1 22 22 ASN H H 22 9.679 9.679 8.114 1.565 19746 818 1 9 . 1 1 23 23 THR HA H 23 4.536 4.536 4.788 -0.252 19746 819 1 9 . 1 1 23 23 THR H H 23 8.501 8.501 8.741 -0.240 19746 820 1 9 . 1 1 24 24 GLY H H 24 8.549 8.549 7.515 1.034 19746 821 1 9 . 1 1 25 25 MET HA H 25 4.791 4.791 4.174 0.617 19746 822 1 9 . 1 1 25 25 MET H H 25 8.306 8.306 8.234 0.072 19746 823 1 9 . 1 1 30 30 LEU HA H 30 4.376 4.376 4.134 0.242 19746 824 1 9 . 1 1 30 30 LEU H H 30 7.637 7.637 8.445 -0.808 19746 825 1 9 . 1 1 31 31 LYS HA H 31 4.244 4.244 4.489 -0.245 19746 826 1 9 . 1 1 31 31 LYS H H 31 8.000 8.000 8.463 -0.463 19746 827 1 9 . 1 1 32 32 LEU HA H 32 4.431 4.431 4.135 0.296 19746 828 1 9 . 1 1 32 32 LEU H H 32 7.945 7.945 7.820 0.125 19746 829 1 9 . 1 1 33 33 ILE HA H 33 4.396 4.396 4.220 0.176 19746 830 1 9 . 1 1 33 33 ILE H H 33 8.204 8.204 8.317 -0.113 19746 831 1 9 . 1 1 34 34 LEU HA H 34 4.750 4.750 4.783 -0.033 19746 832 1 9 . 1 1 34 34 LEU H H 34 9.084 9.084 8.879 0.205 19746 833 1 9 . 1 1 35 35 GLN HA H 35 4.524 4.524 4.483 0.041 19746 834 1 9 . 1 1 35 35 GLN H H 35 8.010 8.010 7.960 0.050 19746 835 1 9 . 1 1 36 36 GLY H H 36 6.153 6.153 7.399 -1.246 19746 836 1 9 . 1 1 37 37 CYS HA H 37 5.810 5.810 5.767 0.043 19746 837 1 9 . 1 1 37 37 CYS H H 37 8.431 8.431 8.571 -0.140 19746 838 1 9 . 1 1 38 38 SER HA H 38 4.932 4.932 4.713 0.219 19746 839 1 9 . 1 1 38 38 SER H H 38 9.681 9.681 9.017 0.664 19746 840 1 9 . 1 1 39 39 SER HA H 39 4.673 4.673 4.624 0.049 19746 841 1 9 . 1 1 39 39 SER H H 39 9.087 9.087 8.772 0.315 19746 842 1 9 . 1 1 41 41 CYS HA H 41 4.265 4.265 4.136 0.129 19746 843 1 9 . 1 1 41 41 CYS H H 41 7.898 7.898 8.196 -0.298 19746 844 1 9 . 1 1 42 42 SER HA H 42 4.580 4.580 4.363 0.217 19746 845 1 9 . 1 1 42 42 SER H H 42 8.385 8.385 8.774 -0.389 19746 846 1 9 . 1 1 43 43 GLU HA H 43 4.615 4.615 4.252 0.363 19746 847 1 9 . 1 1 43 43 GLU H H 43 8.790 8.790 8.120 0.670 19746 848 1 9 . 1 1 44 44 THR HA H 44 4.721 4.721 4.497 0.224 19746 849 1 9 . 1 1 44 44 THR H H 44 8.954 8.954 8.697 0.257 19746 850 1 9 . 1 1 45 45 GLU HA H 45 4.056 4.056 4.255 -0.199 19746 851 1 9 . 1 1 45 45 GLU H H 45 8.903 8.903 8.487 0.416 19746 852 1 9 . 1 1 46 46 ASN HA H 46 4.847 4.847 4.728 0.119 19746 853 1 9 . 1 1 46 46 ASN H H 46 7.957 7.957 8.366 -0.409 19746 854 1 9 . 1 1 47 47 ASN HA H 47 5.360 5.360 4.992 0.368 19746 855 1 9 . 1 1 47 47 ASN H H 47 7.729 7.729 8.211 -0.482 19746 856 1 9 . 1 1 48 48 LYS HA H 48 4.782 4.782 4.696 0.086 19746 857 1 9 . 1 1 48 48 LYS H H 48 8.600 8.600 7.760 0.840 19746 858 1 9 . 1 1 49 49 CYS HA H 49 5.517 5.517 5.331 0.186 19746 859 1 9 . 1 1 49 49 CYS H H 49 9.048 9.048 8.451 0.597 19746 860 1 9 . 1 1 50 50 CYS HA H 50 5.216 5.216 4.839 0.377 19746 861 1 9 . 1 1 50 50 CYS H H 50 9.342 9.342 9.390 -0.048 19746 862 1 9 . 1 1 51 51 SER HA H 51 4.948 4.948 4.518 0.430 19746 863 1 9 . 1 1 51 51 SER H H 51 9.182 9.182 8.741 0.441 19746 864 1 9 . 1 1 52 52 THR HA H 52 4.639 4.639 4.438 0.201 19746 865 1 9 . 1 1 52 52 THR H H 52 7.570 7.570 7.698 -0.128 19746 866 1 9 . 1 1 53 53 ASP HA H 53 4.608 4.608 4.347 0.261 19746 867 1 9 . 1 1 53 53 ASP H H 53 7.844 7.844 7.770 0.074 19746 868 1 9 . 1 1 54 54 ARG HA H 54 4.182 4.182 3.693 0.489 19746 869 1 9 . 1 1 54 54 ARG H H 54 8.146 8.146 8.379 -0.233 19746 870 1 9 . 1 1 55 55 CYS HA H 55 4.526 4.526 4.454 0.072 19746 871 1 9 . 1 1 55 55 CYS H H 55 7.899 7.899 8.064 -0.165 19746 872 1 9 . 1 1 56 56 ASN HA H 56 4.687 4.687 4.523 0.164 19746 873 1 9 . 1 1 56 56 ASN H H 56 8.751 8.751 8.391 0.360 19746 874 1 10 . 1 1 2 2 LYS HA H 2 5.347 5.347 5.141 0.206 19746 875 1 10 . 1 1 2 2 LYS H H 2 8.293 8.293 7.552 0.741 19746 876 1 10 . 1 1 3 3 CYS HA H 3 4.901 4.901 4.672 0.229 19746 877 1 10 . 1 1 3 3 CYS H H 3 8.348 8.348 8.874 -0.526 19746 878 1 10 . 1 1 4 4 TYR HA H 4 4.541 4.541 4.564 -0.023 19746 879 1 10 . 1 1 4 4 TYR H H 4 9.500 9.500 8.587 0.913 19746 880 1 10 . 1 1 5 5 GLN HA H 5 4.328 4.328 4.440 -0.112 19746 881 1 10 . 1 1 5 5 GLN H H 5 9.293 9.293 8.180 1.113 19746 882 1 10 . 1 1 6 6 HIS HA H 6 4.432 4.432 4.641 -0.209 19746 883 1 10 . 1 1 6 6 HIS H H 6 8.622 8.622 8.358 0.264 19746 884 1 10 . 1 1 7 7 GLY H H 7 8.394 8.394 8.385 0.009 19746 885 1 10 . 1 1 8 8 LYS HA H 8 4.746 4.746 4.510 0.236 19746 886 1 10 . 1 1 8 8 LYS H H 8 7.667 7.667 7.932 -0.265 19746 887 1 10 . 1 1 9 9 VAL HA H 9 3.808 3.808 3.441 0.367 19746 888 1 10 . 1 1 9 9 VAL H H 9 8.452 8.452 8.495 -0.043 19746 889 1 10 . 1 1 10 10 VAL HA H 10 4.578 4.578 4.240 0.338 19746 890 1 10 . 1 1 10 10 VAL H H 10 8.907 8.907 8.321 0.586 19746 891 1 10 . 1 1 11 11 THR HA H 11 4.395 4.395 4.469 -0.074 19746 892 1 10 . 1 1 11 11 THR H H 11 8.441 8.441 8.347 0.094 19746 893 1 10 . 1 1 12 12 CYS HA H 12 4.635 4.635 4.247 0.388 19746 894 1 10 . 1 1 12 12 CYS H H 12 8.864 8.864 7.864 1.000 19746 895 1 10 . 1 1 13 13 HIS HA H 13 3.989 3.989 4.669 -0.680 19746 896 1 10 . 1 1 13 13 HIS H H 13 9.706 9.706 8.287 1.419 19746 897 1 10 . 1 1 14 14 ARG HA H 14 4.384 4.384 3.816 0.568 19746 898 1 10 . 1 1 14 14 ARG H H 14 8.791 8.791 8.109 0.682 19746 899 1 10 . 1 1 15 15 ASP HA H 15 4.544 4.544 4.585 -0.041 19746 900 1 10 . 1 1 15 15 ASP H H 15 7.956 7.956 8.095 -0.139 19746 901 1 10 . 1 1 16 16 MET HA H 16 4.348 4.348 4.458 -0.110 19746 902 1 10 . 1 1 16 16 MET H H 16 8.064 8.064 7.876 0.188 19746 903 1 10 . 1 1 17 17 LYS HA H 17 4.249 4.249 4.424 -0.175 19746 904 1 10 . 1 1 17 17 LYS H H 17 7.659 7.659 8.224 -0.565 19746 905 1 10 . 1 1 18 18 PHE HA H 18 5.046 5.046 4.893 0.153 19746 906 1 10 . 1 1 18 18 PHE H H 18 8.218 8.218 8.326 -0.108 19746 907 1 10 . 1 1 19 19 CYS HA H 19 5.956 5.956 5.073 0.883 19746 908 1 10 . 1 1 19 19 CYS H H 19 9.289 9.289 9.009 0.280 19746 909 1 10 . 1 1 20 20 TYR HA H 20 6.157 6.157 5.366 0.791 19746 910 1 10 . 1 1 20 20 TYR H H 20 8.847 8.847 8.835 0.012 19746 911 1 10 . 1 1 21 21 HIS HA H 21 5.154 5.154 4.875 0.279 19746 912 1 10 . 1 1 21 21 HIS H H 21 8.688 8.688 8.445 0.243 19746 913 1 10 . 1 1 22 22 ASN HA H 22 5.767 5.767 4.728 1.039 19746 914 1 10 . 1 1 22 22 ASN H H 22 9.679 9.679 8.370 1.309 19746 915 1 10 . 1 1 23 23 THR HA H 23 4.536 4.536 4.694 -0.158 19746 916 1 10 . 1 1 23 23 THR H H 23 8.501 8.501 9.178 -0.677 19746 917 1 10 . 1 1 24 24 GLY H H 24 8.549 8.549 8.663 -0.114 19746 918 1 10 . 1 1 25 25 MET HA H 25 4.791 4.791 4.768 0.023 19746 919 1 10 . 1 1 25 25 MET H H 25 8.306 8.306 8.113 0.193 19746 920 1 10 . 1 1 30 30 LEU HA H 30 4.376 4.376 4.513 -0.137 19746 921 1 10 . 1 1 30 30 LEU H H 30 7.637 7.637 7.653 -0.016 19746 922 1 10 . 1 1 31 31 LYS HA H 31 4.244 4.244 4.014 0.230 19746 923 1 10 . 1 1 31 31 LYS H H 31 8.000 8.000 8.455 -0.455 19746 924 1 10 . 1 1 32 32 LEU HA H 32 4.431 4.431 4.291 0.140 19746 925 1 10 . 1 1 32 32 LEU H H 32 7.945 7.945 8.235 -0.290 19746 926 1 10 . 1 1 33 33 ILE HA H 33 4.396 4.396 4.295 0.101 19746 927 1 10 . 1 1 33 33 ILE H H 33 8.204 8.204 7.342 0.862 19746 928 1 10 . 1 1 34 34 LEU HA H 34 4.750 4.750 4.617 0.133 19746 929 1 10 . 1 1 34 34 LEU H H 34 9.084 9.084 8.660 0.424 19746 930 1 10 . 1 1 35 35 GLN HA H 35 4.524 4.524 4.920 -0.396 19746 931 1 10 . 1 1 35 35 GLN H H 35 8.010 8.010 7.911 0.099 19746 932 1 10 . 1 1 36 36 GLY H H 36 6.153 6.153 6.899 -0.746 19746 933 1 10 . 1 1 37 37 CYS HA H 37 5.810 5.810 5.424 0.386 19746 934 1 10 . 1 1 37 37 CYS H H 37 8.431 8.431 8.407 0.024 19746 935 1 10 . 1 1 38 38 SER HA H 38 4.932 4.932 4.797 0.135 19746 936 1 10 . 1 1 38 38 SER H H 38 9.681 9.681 8.997 0.684 19746 937 1 10 . 1 1 39 39 SER HA H 39 4.673 4.673 4.909 -0.236 19746 938 1 10 . 1 1 39 39 SER H H 39 9.087 9.087 9.080 0.007 19746 939 1 10 . 1 1 41 41 CYS HA H 41 4.265 4.265 4.477 -0.212 19746 940 1 10 . 1 1 41 41 CYS H H 41 7.898 7.898 8.126 -0.228 19746 941 1 10 . 1 1 42 42 SER HA H 42 4.580 4.580 4.495 0.085 19746 942 1 10 . 1 1 42 42 SER H H 42 8.385 8.385 8.467 -0.082 19746 943 1 10 . 1 1 43 43 GLU HA H 43 4.615 4.615 4.203 0.412 19746 944 1 10 . 1 1 43 43 GLU H H 43 8.790 8.790 8.305 0.485 19746 945 1 10 . 1 1 44 44 THR HA H 44 4.721 4.721 4.389 0.332 19746 946 1 10 . 1 1 44 44 THR H H 44 8.954 8.954 8.549 0.405 19746 947 1 10 . 1 1 45 45 GLU HA H 45 4.056 4.056 3.881 0.175 19746 948 1 10 . 1 1 45 45 GLU H H 45 8.903 8.903 8.879 0.024 19746 949 1 10 . 1 1 46 46 ASN HA H 46 4.847 4.847 4.669 0.178 19746 950 1 10 . 1 1 46 46 ASN H H 46 7.957 7.957 8.267 -0.310 19746 951 1 10 . 1 1 47 47 ASN HA H 47 5.360 5.360 5.012 0.348 19746 952 1 10 . 1 1 47 47 ASN H H 47 7.729 7.729 8.261 -0.532 19746 953 1 10 . 1 1 48 48 LYS HA H 48 4.782 4.782 4.723 0.059 19746 954 1 10 . 1 1 48 48 LYS H H 48 8.600 8.600 7.918 0.682 19746 955 1 10 . 1 1 49 49 CYS HA H 49 5.517 5.517 5.504 0.013 19746 956 1 10 . 1 1 49 49 CYS H H 49 9.048 9.048 8.576 0.472 19746 957 1 10 . 1 1 50 50 CYS HA H 50 5.216 5.216 4.728 0.488 19746 958 1 10 . 1 1 50 50 CYS H H 50 9.342 9.342 9.289 0.053 19746 959 1 10 . 1 1 51 51 SER HA H 51 4.948 4.948 4.598 0.350 19746 960 1 10 . 1 1 51 51 SER H H 51 9.182 9.182 8.789 0.393 19746 961 1 10 . 1 1 52 52 THR HA H 52 4.639 4.639 4.520 0.119 19746 962 1 10 . 1 1 52 52 THR H H 52 7.570 7.570 7.659 -0.089 19746 963 1 10 . 1 1 53 53 ASP HA H 53 4.608 4.608 4.897 -0.289 19746 964 1 10 . 1 1 53 53 ASP H H 53 7.844 7.844 8.287 -0.443 19746 965 1 10 . 1 1 54 54 ARG HA H 54 4.182 4.182 3.831 0.351 19746 966 1 10 . 1 1 54 54 ARG H H 54 8.146 8.146 8.268 -0.122 19746 967 1 10 . 1 1 55 55 CYS HA H 55 4.526 4.526 4.427 0.099 19746 968 1 10 . 1 1 55 55 CYS H H 55 7.899 7.899 8.673 -0.774 19746 969 1 10 . 1 1 56 56 ASN HA H 56 4.687 4.687 4.956 -0.269 19746 970 1 10 . 1 1 56 56 ASN H H 56 8.751 8.751 8.525 0.226 19746 971 1 11 . 1 1 2 2 LYS HA H 2 5.347 5.347 5.283 0.064 19746 972 1 11 . 1 1 2 2 LYS H H 2 8.293 8.293 7.559 0.734 19746 973 1 11 . 1 1 3 3 CYS HA H 3 4.901 4.901 4.759 0.142 19746 974 1 11 . 1 1 3 3 CYS H H 3 8.348 8.348 8.923 -0.575 19746 975 1 11 . 1 1 4 4 TYR HA H 4 4.541 4.541 5.198 -0.657 19746 976 1 11 . 1 1 4 4 TYR H H 4 9.500 9.500 8.669 0.831 19746 977 1 11 . 1 1 5 5 GLN HA H 5 4.328 4.328 4.177 0.151 19746 978 1 11 . 1 1 5 5 GLN H H 5 9.293 9.293 8.249 1.044 19746 979 1 11 . 1 1 6 6 HIS HA H 6 4.432 4.432 4.721 -0.289 19746 980 1 11 . 1 1 6 6 HIS H H 6 8.622 8.622 8.039 0.583 19746 981 1 11 . 1 1 7 7 GLY H H 7 8.394 8.394 8.672 -0.278 19746 982 1 11 . 1 1 8 8 LYS HA H 8 4.746 4.746 4.723 0.023 19746 983 1 11 . 1 1 8 8 LYS H H 8 7.667 7.667 7.760 -0.093 19746 984 1 11 . 1 1 9 9 VAL HA H 9 3.808 3.808 4.126 -0.318 19746 985 1 11 . 1 1 9 9 VAL H H 9 8.452 8.452 8.227 0.225 19746 986 1 11 . 1 1 10 10 VAL HA H 10 4.578 4.578 4.449 0.129 19746 987 1 11 . 1 1 10 10 VAL H H 10 8.907 8.907 8.705 0.202 19746 988 1 11 . 1 1 11 11 THR HA H 11 4.395 4.395 4.615 -0.220 19746 989 1 11 . 1 1 11 11 THR H H 11 8.441 8.441 8.218 0.223 19746 990 1 11 . 1 1 12 12 CYS HA H 12 4.635 4.635 4.236 0.399 19746 991 1 11 . 1 1 12 12 CYS H H 12 8.864 8.864 8.223 0.641 19746 992 1 11 . 1 1 13 13 HIS HA H 13 3.989 3.989 4.693 -0.704 19746 993 1 11 . 1 1 13 13 HIS H H 13 9.706 9.706 8.416 1.290 19746 994 1 11 . 1 1 14 14 ARG HA H 14 4.384 4.384 3.927 0.457 19746 995 1 11 . 1 1 14 14 ARG H H 14 8.791 8.791 8.606 0.185 19746 996 1 11 . 1 1 15 15 ASP HA H 15 4.544 4.544 4.460 0.084 19746 997 1 11 . 1 1 15 15 ASP H H 15 7.956 7.956 7.825 0.131 19746 998 1 11 . 1 1 16 16 MET HA H 16 4.348 4.348 4.479 -0.131 19746 999 1 11 . 1 1 16 16 MET H H 16 8.064 8.064 7.711 0.353 19746 1000 1 11 . 1 1 17 17 LYS HA H 17 4.249 4.249 4.391 -0.142 19746 1001 1 11 . 1 1 17 17 LYS H H 17 7.659 7.659 8.459 -0.800 19746 1002 1 11 . 1 1 18 18 PHE HA H 18 5.046 5.046 4.879 0.167 19746 1003 1 11 . 1 1 18 18 PHE H H 18 8.218 8.218 7.739 0.479 19746 1004 1 11 . 1 1 19 19 CYS HA H 19 5.956 5.956 4.839 1.117 19746 1005 1 11 . 1 1 19 19 CYS H H 19 9.289 9.289 9.493 -0.204 19746 1006 1 11 . 1 1 20 20 TYR HA H 20 6.157 6.157 5.059 1.098 19746 1007 1 11 . 1 1 20 20 TYR H H 20 8.847 8.847 8.889 -0.042 19746 1008 1 11 . 1 1 21 21 HIS HA H 21 5.154 5.154 4.883 0.271 19746 1009 1 11 . 1 1 21 21 HIS H H 21 8.688 8.688 8.606 0.082 19746 1010 1 11 . 1 1 22 22 ASN HA H 22 5.767 5.767 4.920 0.847 19746 1011 1 11 . 1 1 22 22 ASN H H 22 9.679 9.679 8.357 1.322 19746 1012 1 11 . 1 1 23 23 THR HA H 23 4.536 4.536 4.611 -0.075 19746 1013 1 11 . 1 1 23 23 THR H H 23 8.501 8.501 8.878 -0.377 19746 1014 1 11 . 1 1 24 24 GLY H H 24 8.549 8.549 8.358 0.191 19746 1015 1 11 . 1 1 25 25 MET HA H 25 4.791 4.791 4.592 0.199 19746 1016 1 11 . 1 1 25 25 MET H H 25 8.306 8.306 8.289 0.017 19746 1017 1 11 . 1 1 30 30 LEU HA H 30 4.376 4.376 4.467 -0.091 19746 1018 1 11 . 1 1 30 30 LEU H H 30 7.637 7.637 7.842 -0.205 19746 1019 1 11 . 1 1 31 31 LYS HA H 31 4.244 4.244 4.371 -0.127 19746 1020 1 11 . 1 1 31 31 LYS H H 31 8.000 8.000 8.289 -0.289 19746 1021 1 11 . 1 1 32 32 LEU HA H 32 4.431 4.431 4.381 0.050 19746 1022 1 11 . 1 1 32 32 LEU H H 32 7.945 7.945 8.062 -0.117 19746 1023 1 11 . 1 1 33 33 ILE HA H 33 4.396 4.396 4.330 0.066 19746 1024 1 11 . 1 1 33 33 ILE H H 33 8.204 8.204 7.583 0.621 19746 1025 1 11 . 1 1 34 34 LEU HA H 34 4.750 4.750 4.671 0.079 19746 1026 1 11 . 1 1 34 34 LEU H H 34 9.084 9.084 8.711 0.373 19746 1027 1 11 . 1 1 35 35 GLN HA H 35 4.524 4.524 4.625 -0.101 19746 1028 1 11 . 1 1 35 35 GLN H H 35 8.010 8.010 7.950 0.060 19746 1029 1 11 . 1 1 36 36 GLY H H 36 6.153 6.153 7.219 -1.066 19746 1030 1 11 . 1 1 37 37 CYS HA H 37 5.810 5.810 5.363 0.447 19746 1031 1 11 . 1 1 37 37 CYS H H 37 8.431 8.431 8.691 -0.260 19746 1032 1 11 . 1 1 38 38 SER HA H 38 4.932 4.932 4.731 0.201 19746 1033 1 11 . 1 1 38 38 SER H H 38 9.681 9.681 9.092 0.589 19746 1034 1 11 . 1 1 39 39 SER HA H 39 4.673 4.673 4.845 -0.172 19746 1035 1 11 . 1 1 39 39 SER H H 39 9.087 9.087 8.678 0.409 19746 1036 1 11 . 1 1 41 41 CYS HA H 41 4.265 4.265 4.306 -0.041 19746 1037 1 11 . 1 1 41 41 CYS H H 41 7.898 7.898 8.144 -0.246 19746 1038 1 11 . 1 1 42 42 SER HA H 42 4.580 4.580 4.359 0.221 19746 1039 1 11 . 1 1 42 42 SER H H 42 8.385 8.385 8.370 0.015 19746 1040 1 11 . 1 1 43 43 GLU HA H 43 4.615 4.615 4.136 0.479 19746 1041 1 11 . 1 1 43 43 GLU H H 43 8.790 8.790 7.974 0.816 19746 1042 1 11 . 1 1 44 44 THR HA H 44 4.721 4.721 4.547 0.174 19746 1043 1 11 . 1 1 44 44 THR H H 44 8.954 8.954 8.636 0.318 19746 1044 1 11 . 1 1 45 45 GLU HA H 45 4.056 4.056 4.125 -0.069 19746 1045 1 11 . 1 1 45 45 GLU H H 45 8.903 8.903 8.801 0.102 19746 1046 1 11 . 1 1 46 46 ASN HA H 46 4.847 4.847 4.756 0.091 19746 1047 1 11 . 1 1 46 46 ASN H H 46 7.957 7.957 8.207 -0.250 19746 1048 1 11 . 1 1 47 47 ASN HA H 47 5.360 5.360 5.047 0.313 19746 1049 1 11 . 1 1 47 47 ASN H H 47 7.729 7.729 7.850 -0.121 19746 1050 1 11 . 1 1 48 48 LYS HA H 48 4.782 4.782 4.637 0.145 19746 1051 1 11 . 1 1 48 48 LYS H H 48 8.600 8.600 7.868 0.732 19746 1052 1 11 . 1 1 49 49 CYS HA H 49 5.517 5.517 5.435 0.082 19746 1053 1 11 . 1 1 49 49 CYS H H 49 9.048 9.048 8.380 0.668 19746 1054 1 11 . 1 1 50 50 CYS HA H 50 5.216 5.216 5.033 0.183 19746 1055 1 11 . 1 1 50 50 CYS H H 50 9.342 9.342 9.552 -0.210 19746 1056 1 11 . 1 1 51 51 SER HA H 51 4.948 4.948 4.702 0.246 19746 1057 1 11 . 1 1 51 51 SER H H 51 9.182 9.182 8.758 0.424 19746 1058 1 11 . 1 1 52 52 THR HA H 52 4.639 4.639 4.536 0.103 19746 1059 1 11 . 1 1 52 52 THR H H 52 7.570 7.570 7.827 -0.257 19746 1060 1 11 . 1 1 53 53 ASP HA H 53 4.608 4.608 4.388 0.220 19746 1061 1 11 . 1 1 53 53 ASP H H 53 7.844 7.844 8.041 -0.197 19746 1062 1 11 . 1 1 54 54 ARG HA H 54 4.182 4.182 3.853 0.329 19746 1063 1 11 . 1 1 54 54 ARG H H 54 8.146 8.146 8.684 -0.538 19746 1064 1 11 . 1 1 55 55 CYS HA H 55 4.526 4.526 4.396 0.130 19746 1065 1 11 . 1 1 55 55 CYS H H 55 7.899 7.899 8.464 -0.565 19746 1066 1 11 . 1 1 56 56 ASN HA H 56 4.687 4.687 4.829 -0.142 19746 1067 1 11 . 1 1 56 56 ASN H H 56 8.751 8.751 8.496 0.255 19746 1068 1 12 . 1 1 2 2 LYS HA H 2 5.347 5.347 4.721 0.626 19746 1069 1 12 . 1 1 2 2 LYS H H 2 8.293 8.293 7.990 0.303 19746 1070 1 12 . 1 1 3 3 CYS HA H 3 4.901 4.901 4.597 0.304 19746 1071 1 12 . 1 1 3 3 CYS H H 3 8.348 8.348 8.797 -0.449 19746 1072 1 12 . 1 1 4 4 TYR HA H 4 4.541 4.541 4.698 -0.157 19746 1073 1 12 . 1 1 4 4 TYR H H 4 9.500 9.500 8.559 0.941 19746 1074 1 12 . 1 1 5 5 GLN HA H 5 4.328 4.328 4.386 -0.058 19746 1075 1 12 . 1 1 5 5 GLN H H 5 9.293 9.293 8.003 1.290 19746 1076 1 12 . 1 1 6 6 HIS HA H 6 4.432 4.432 4.794 -0.362 19746 1077 1 12 . 1 1 6 6 HIS H H 6 8.622 8.622 7.907 0.715 19746 1078 1 12 . 1 1 7 7 GLY H H 7 8.394 8.394 8.783 -0.389 19746 1079 1 12 . 1 1 8 8 LYS HA H 8 4.746 4.746 4.890 -0.144 19746 1080 1 12 . 1 1 8 8 LYS H H 8 7.667 7.667 7.823 -0.156 19746 1081 1 12 . 1 1 9 9 VAL HA H 9 3.808 3.808 3.436 0.372 19746 1082 1 12 . 1 1 9 9 VAL H H 9 8.452 8.452 8.541 -0.089 19746 1083 1 12 . 1 1 10 10 VAL HA H 10 4.578 4.578 4.586 -0.008 19746 1084 1 12 . 1 1 10 10 VAL H H 10 8.907 8.907 8.644 0.263 19746 1085 1 12 . 1 1 11 11 THR HA H 11 4.395 4.395 4.494 -0.099 19746 1086 1 12 . 1 1 11 11 THR H H 11 8.441 8.441 8.177 0.264 19746 1087 1 12 . 1 1 12 12 CYS HA H 12 4.635 4.635 4.053 0.582 19746 1088 1 12 . 1 1 12 12 CYS H H 12 8.864 8.864 8.229 0.635 19746 1089 1 12 . 1 1 13 13 HIS HA H 13 3.989 3.989 4.251 -0.262 19746 1090 1 12 . 1 1 13 13 HIS H H 13 9.706 9.706 8.530 1.176 19746 1091 1 12 . 1 1 14 14 ARG HA H 14 4.384 4.384 4.085 0.299 19746 1092 1 12 . 1 1 14 14 ARG H H 14 8.791 8.791 8.509 0.282 19746 1093 1 12 . 1 1 15 15 ASP HA H 15 4.544 4.544 4.609 -0.065 19746 1094 1 12 . 1 1 15 15 ASP H H 15 7.956 7.956 8.267 -0.311 19746 1095 1 12 . 1 1 16 16 MET HA H 16 4.348 4.348 4.478 -0.130 19746 1096 1 12 . 1 1 16 16 MET H H 16 8.064 8.064 8.070 -0.006 19746 1097 1 12 . 1 1 17 17 LYS HA H 17 4.249 4.249 4.354 -0.105 19746 1098 1 12 . 1 1 17 17 LYS H H 17 7.659 7.659 8.489 -0.830 19746 1099 1 12 . 1 1 18 18 PHE HA H 18 5.046 5.046 5.200 -0.154 19746 1100 1 12 . 1 1 18 18 PHE H H 18 8.218 8.218 7.722 0.496 19746 1101 1 12 . 1 1 19 19 CYS HA H 19 5.956 5.956 5.300 0.656 19746 1102 1 12 . 1 1 19 19 CYS H H 19 9.289 9.289 9.336 -0.047 19746 1103 1 12 . 1 1 20 20 TYR HA H 20 6.157 6.157 5.213 0.944 19746 1104 1 12 . 1 1 20 20 TYR H H 20 8.847 8.847 9.096 -0.249 19746 1105 1 12 . 1 1 21 21 HIS HA H 21 5.154 5.154 5.031 0.123 19746 1106 1 12 . 1 1 21 21 HIS H H 21 8.688 8.688 7.747 0.941 19746 1107 1 12 . 1 1 22 22 ASN HA H 22 5.767 5.767 5.086 0.681 19746 1108 1 12 . 1 1 22 22 ASN H H 22 9.679 9.679 7.980 1.699 19746 1109 1 12 . 1 1 23 23 THR HA H 23 4.536 4.536 4.621 -0.085 19746 1110 1 12 . 1 1 23 23 THR H H 23 8.501 8.501 8.993 -0.492 19746 1111 1 12 . 1 1 24 24 GLY H H 24 8.549 8.549 7.732 0.817 19746 1112 1 12 . 1 1 25 25 MET HA H 25 4.791 4.791 4.915 -0.124 19746 1113 1 12 . 1 1 25 25 MET H H 25 8.306 8.306 8.328 -0.022 19746 1114 1 12 . 1 1 30 30 LEU HA H 30 4.376 4.376 3.824 0.552 19746 1115 1 12 . 1 1 30 30 LEU H H 30 7.637 7.637 8.465 -0.828 19746 1116 1 12 . 1 1 31 31 LYS HA H 31 4.244 4.244 4.276 -0.032 19746 1117 1 12 . 1 1 31 31 LYS H H 31 8.000 8.000 8.021 -0.021 19746 1118 1 12 . 1 1 32 32 LEU HA H 32 4.431 4.431 4.423 0.008 19746 1119 1 12 . 1 1 32 32 LEU H H 32 7.945 7.945 7.675 0.270 19746 1120 1 12 . 1 1 33 33 ILE HA H 33 4.396 4.396 3.929 0.467 19746 1121 1 12 . 1 1 33 33 ILE H H 33 8.204 8.204 7.810 0.394 19746 1122 1 12 . 1 1 34 34 LEU HA H 34 4.750 4.750 4.711 0.039 19746 1123 1 12 . 1 1 34 34 LEU H H 34 9.084 9.084 8.459 0.625 19746 1124 1 12 . 1 1 35 35 GLN HA H 35 4.524 4.524 4.662 -0.138 19746 1125 1 12 . 1 1 35 35 GLN H H 35 8.010 8.010 8.082 -0.072 19746 1126 1 12 . 1 1 36 36 GLY H H 36 6.153 6.153 7.173 -1.020 19746 1127 1 12 . 1 1 37 37 CYS HA H 37 5.810 5.810 5.716 0.094 19746 1128 1 12 . 1 1 37 37 CYS H H 37 8.431 8.431 8.817 -0.386 19746 1129 1 12 . 1 1 38 38 SER HA H 38 4.932 4.932 4.904 0.028 19746 1130 1 12 . 1 1 38 38 SER H H 38 9.681 9.681 8.979 0.702 19746 1131 1 12 . 1 1 39 39 SER HA H 39 4.673 4.673 4.890 -0.217 19746 1132 1 12 . 1 1 39 39 SER H H 39 9.087 9.087 8.724 0.363 19746 1133 1 12 . 1 1 41 41 CYS HA H 41 4.265 4.265 4.155 0.110 19746 1134 1 12 . 1 1 41 41 CYS H H 41 7.898 7.898 7.604 0.294 19746 1135 1 12 . 1 1 42 42 SER HA H 42 4.580 4.580 4.474 0.106 19746 1136 1 12 . 1 1 42 42 SER H H 42 8.385 8.385 8.606 -0.221 19746 1137 1 12 . 1 1 43 43 GLU HA H 43 4.615 4.615 4.058 0.557 19746 1138 1 12 . 1 1 43 43 GLU H H 43 8.790 8.790 7.822 0.968 19746 1139 1 12 . 1 1 44 44 THR HA H 44 4.721 4.721 4.487 0.234 19746 1140 1 12 . 1 1 44 44 THR H H 44 8.954 8.954 8.541 0.413 19746 1141 1 12 . 1 1 45 45 GLU HA H 45 4.056 4.056 4.125 -0.069 19746 1142 1 12 . 1 1 45 45 GLU H H 45 8.903 8.903 8.659 0.244 19746 1143 1 12 . 1 1 46 46 ASN HA H 46 4.847 4.847 4.582 0.265 19746 1144 1 12 . 1 1 46 46 ASN H H 46 7.957 7.957 8.309 -0.352 19746 1145 1 12 . 1 1 47 47 ASN HA H 47 5.360 5.360 5.210 0.150 19746 1146 1 12 . 1 1 47 47 ASN H H 47 7.729 7.729 7.729 -0.000 19746 1147 1 12 . 1 1 48 48 LYS HA H 48 4.782 4.782 4.590 0.192 19746 1148 1 12 . 1 1 48 48 LYS H H 48 8.600 8.600 7.801 0.799 19746 1149 1 12 . 1 1 49 49 CYS HA H 49 5.517 5.517 5.392 0.125 19746 1150 1 12 . 1 1 49 49 CYS H H 49 9.048 9.048 8.169 0.879 19746 1151 1 12 . 1 1 50 50 CYS HA H 50 5.216 5.216 4.988 0.228 19746 1152 1 12 . 1 1 50 50 CYS H H 50 9.342 9.342 9.426 -0.084 19746 1153 1 12 . 1 1 51 51 SER HA H 51 4.948 4.948 4.798 0.150 19746 1154 1 12 . 1 1 51 51 SER H H 51 9.182 9.182 8.916 0.266 19746 1155 1 12 . 1 1 52 52 THR HA H 52 4.639 4.639 4.492 0.147 19746 1156 1 12 . 1 1 52 52 THR H H 52 7.570 7.570 7.334 0.236 19746 1157 1 12 . 1 1 53 53 ASP HA H 53 4.608 4.608 4.836 -0.228 19746 1158 1 12 . 1 1 53 53 ASP H H 53 7.844 7.844 8.359 -0.515 19746 1159 1 12 . 1 1 54 54 ARG HA H 54 4.182 4.182 3.703 0.479 19746 1160 1 12 . 1 1 54 54 ARG H H 54 8.146 8.146 8.583 -0.437 19746 1161 1 12 . 1 1 55 55 CYS HA H 55 4.526 4.526 4.284 0.242 19746 1162 1 12 . 1 1 55 55 CYS H H 55 7.899 7.899 8.430 -0.531 19746 1163 1 12 . 1 1 56 56 ASN HA H 56 4.687 4.687 4.263 0.424 19746 1164 1 12 . 1 1 56 56 ASN H H 56 8.751 8.751 8.284 0.467 19746 1165 1 13 . 1 1 2 2 LYS HA H 2 5.347 5.347 4.794 0.553 19746 1166 1 13 . 1 1 2 2 LYS H H 2 8.293 8.293 7.979 0.314 19746 1167 1 13 . 1 1 3 3 CYS HA H 3 4.901 4.901 4.528 0.373 19746 1168 1 13 . 1 1 3 3 CYS H H 3 8.348 8.348 8.497 -0.149 19746 1169 1 13 . 1 1 4 4 TYR HA H 4 4.541 4.541 4.441 0.100 19746 1170 1 13 . 1 1 4 4 TYR H H 4 9.500 9.500 8.606 0.894 19746 1171 1 13 . 1 1 5 5 GLN HA H 5 4.328 4.328 4.179 0.149 19746 1172 1 13 . 1 1 5 5 GLN H H 5 9.293 9.293 7.800 1.493 19746 1173 1 13 . 1 1 6 6 HIS HA H 6 4.432 4.432 4.676 -0.244 19746 1174 1 13 . 1 1 6 6 HIS H H 6 8.622 8.622 8.199 0.423 19746 1175 1 13 . 1 1 7 7 GLY H H 7 8.394 8.394 8.196 0.198 19746 1176 1 13 . 1 1 8 8 LYS HA H 8 4.746 4.746 4.795 -0.049 19746 1177 1 13 . 1 1 8 8 LYS H H 8 7.667 7.667 7.888 -0.221 19746 1178 1 13 . 1 1 9 9 VAL HA H 9 3.808 3.808 3.468 0.340 19746 1179 1 13 . 1 1 9 9 VAL H H 9 8.452 8.452 8.445 0.007 19746 1180 1 13 . 1 1 10 10 VAL HA H 10 4.578 4.578 4.574 0.004 19746 1181 1 13 . 1 1 10 10 VAL H H 10 8.907 8.907 8.763 0.144 19746 1182 1 13 . 1 1 11 11 THR HA H 11 4.395 4.395 4.508 -0.113 19746 1183 1 13 . 1 1 11 11 THR H H 11 8.441 8.441 8.291 0.150 19746 1184 1 13 . 1 1 12 12 CYS HA H 12 4.635 4.635 4.433 0.202 19746 1185 1 13 . 1 1 12 12 CYS H H 12 8.864 8.864 8.351 0.513 19746 1186 1 13 . 1 1 13 13 HIS HA H 13 3.989 3.989 4.462 -0.473 19746 1187 1 13 . 1 1 13 13 HIS H H 13 9.706 9.706 8.766 0.940 19746 1188 1 13 . 1 1 14 14 ARG HA H 14 4.384 4.384 4.279 0.105 19746 1189 1 13 . 1 1 14 14 ARG H H 14 8.791 8.791 8.484 0.307 19746 1190 1 13 . 1 1 15 15 ASP HA H 15 4.544 4.544 4.724 -0.180 19746 1191 1 13 . 1 1 15 15 ASP H H 15 7.956 7.956 8.474 -0.518 19746 1192 1 13 . 1 1 16 16 MET HA H 16 4.348 4.348 4.689 -0.341 19746 1193 1 13 . 1 1 16 16 MET H H 16 8.064 8.064 7.919 0.145 19746 1194 1 13 . 1 1 17 17 LYS HA H 17 4.249 4.249 4.409 -0.160 19746 1195 1 13 . 1 1 17 17 LYS H H 17 7.659 7.659 8.343 -0.684 19746 1196 1 13 . 1 1 18 18 PHE HA H 18 5.046 5.046 5.054 -0.008 19746 1197 1 13 . 1 1 18 18 PHE H H 18 8.218 8.218 7.865 0.353 19746 1198 1 13 . 1 1 19 19 CYS HA H 19 5.956 5.956 4.782 1.174 19746 1199 1 13 . 1 1 19 19 CYS H H 19 9.289 9.289 8.765 0.524 19746 1200 1 13 . 1 1 20 20 TYR HA H 20 6.157 6.157 5.662 0.495 19746 1201 1 13 . 1 1 20 20 TYR H H 20 8.847 8.847 8.842 0.005 19746 1202 1 13 . 1 1 21 21 HIS HA H 21 5.154 5.154 4.947 0.207 19746 1203 1 13 . 1 1 21 21 HIS H H 21 8.688 8.688 8.765 -0.077 19746 1204 1 13 . 1 1 22 22 ASN HA H 22 5.767 5.767 4.852 0.915 19746 1205 1 13 . 1 1 22 22 ASN H H 22 9.679 9.679 8.972 0.707 19746 1206 1 13 . 1 1 23 23 THR HA H 23 4.536 4.536 4.731 -0.195 19746 1207 1 13 . 1 1 23 23 THR H H 23 8.501 8.501 9.008 -0.507 19746 1208 1 13 . 1 1 24 24 GLY H H 24 8.549 8.549 7.583 0.966 19746 1209 1 13 . 1 1 25 25 MET HA H 25 4.791 4.791 4.494 0.297 19746 1210 1 13 . 1 1 25 25 MET H H 25 8.306 8.306 8.335 -0.029 19746 1211 1 13 . 1 1 30 30 LEU HA H 30 4.376 4.376 4.073 0.303 19746 1212 1 13 . 1 1 30 30 LEU H H 30 7.637 7.637 7.972 -0.335 19746 1213 1 13 . 1 1 31 31 LYS HA H 31 4.244 4.244 4.455 -0.211 19746 1214 1 13 . 1 1 31 31 LYS H H 31 8.000 8.000 8.902 -0.902 19746 1215 1 13 . 1 1 32 32 LEU HA H 32 4.431 4.431 4.600 -0.169 19746 1216 1 13 . 1 1 32 32 LEU H H 32 7.945 7.945 8.068 -0.123 19746 1217 1 13 . 1 1 33 33 ILE HA H 33 4.396 4.396 4.406 -0.010 19746 1218 1 13 . 1 1 33 33 ILE H H 33 8.204 8.204 8.263 -0.059 19746 1219 1 13 . 1 1 34 34 LEU HA H 34 4.750 4.750 4.620 0.130 19746 1220 1 13 . 1 1 34 34 LEU H H 34 9.084 9.084 8.558 0.526 19746 1221 1 13 . 1 1 35 35 GLN HA H 35 4.524 4.524 4.110 0.414 19746 1222 1 13 . 1 1 35 35 GLN H H 35 8.010 8.010 7.576 0.434 19746 1223 1 13 . 1 1 36 36 GLY H H 36 6.153 6.153 6.970 -0.817 19746 1224 1 13 . 1 1 37 37 CYS HA H 37 5.810 5.810 5.311 0.499 19746 1225 1 13 . 1 1 37 37 CYS H H 37 8.431 8.431 8.388 0.043 19746 1226 1 13 . 1 1 38 38 SER HA H 38 4.932 4.932 4.974 -0.042 19746 1227 1 13 . 1 1 38 38 SER H H 38 9.681 9.681 9.072 0.609 19746 1228 1 13 . 1 1 39 39 SER HA H 39 4.673 4.673 4.807 -0.134 19746 1229 1 13 . 1 1 39 39 SER H H 39 9.087 9.087 8.799 0.288 19746 1230 1 13 . 1 1 41 41 CYS HA H 41 4.265 4.265 4.204 0.061 19746 1231 1 13 . 1 1 41 41 CYS H H 41 7.898 7.898 8.130 -0.232 19746 1232 1 13 . 1 1 42 42 SER HA H 42 4.580 4.580 4.409 0.171 19746 1233 1 13 . 1 1 42 42 SER H H 42 8.385 8.385 8.434 -0.049 19746 1234 1 13 . 1 1 43 43 GLU HA H 43 4.615 4.615 4.079 0.536 19746 1235 1 13 . 1 1 43 43 GLU H H 43 8.790 8.790 7.884 0.906 19746 1236 1 13 . 1 1 44 44 THR HA H 44 4.721 4.721 4.497 0.224 19746 1237 1 13 . 1 1 44 44 THR H H 44 8.954 8.954 8.784 0.170 19746 1238 1 13 . 1 1 45 45 GLU HA H 45 4.056 4.056 4.146 -0.090 19746 1239 1 13 . 1 1 45 45 GLU H H 45 8.903 8.903 8.783 0.120 19746 1240 1 13 . 1 1 46 46 ASN HA H 46 4.847 4.847 4.629 0.218 19746 1241 1 13 . 1 1 46 46 ASN H H 46 7.957 7.957 8.340 -0.383 19746 1242 1 13 . 1 1 47 47 ASN HA H 47 5.360 5.360 5.018 0.342 19746 1243 1 13 . 1 1 47 47 ASN H H 47 7.729 7.729 7.751 -0.022 19746 1244 1 13 . 1 1 48 48 LYS HA H 48 4.782 4.782 5.082 -0.300 19746 1245 1 13 . 1 1 48 48 LYS H H 48 8.600 8.600 7.915 0.685 19746 1246 1 13 . 1 1 49 49 CYS HA H 49 5.517 5.517 5.589 -0.072 19746 1247 1 13 . 1 1 49 49 CYS H H 49 9.048 9.048 9.713 -0.665 19746 1248 1 13 . 1 1 50 50 CYS HA H 50 5.216 5.216 4.922 0.294 19746 1249 1 13 . 1 1 50 50 CYS H H 50 9.342 9.342 9.453 -0.111 19746 1250 1 13 . 1 1 51 51 SER HA H 51 4.948 4.948 4.803 0.145 19746 1251 1 13 . 1 1 51 51 SER H H 51 9.182 9.182 8.837 0.345 19746 1252 1 13 . 1 1 52 52 THR HA H 52 4.639 4.639 4.466 0.173 19746 1253 1 13 . 1 1 52 52 THR H H 52 7.570 7.570 7.223 0.347 19746 1254 1 13 . 1 1 53 53 ASP HA H 53 4.608 4.608 4.827 -0.219 19746 1255 1 13 . 1 1 53 53 ASP H H 53 7.844 7.844 8.292 -0.448 19746 1256 1 13 . 1 1 54 54 ARG HA H 54 4.182 4.182 3.625 0.557 19746 1257 1 13 . 1 1 54 54 ARG H H 54 8.146 8.146 8.735 -0.589 19746 1258 1 13 . 1 1 55 55 CYS HA H 55 4.526 4.526 4.729 -0.203 19746 1259 1 13 . 1 1 55 55 CYS H H 55 7.899 7.899 8.308 -0.409 19746 1260 1 13 . 1 1 56 56 ASN HA H 56 4.687 4.687 4.413 0.274 19746 1261 1 13 . 1 1 56 56 ASN H H 56 8.751 8.751 8.560 0.191 19746 1262 1 14 . 1 1 2 2 LYS HA H 2 5.347 5.347 4.628 0.719 19746 1263 1 14 . 1 1 2 2 LYS H H 2 8.293 8.293 8.025 0.268 19746 1264 1 14 . 1 1 3 3 CYS HA H 3 4.901 4.901 4.479 0.422 19746 1265 1 14 . 1 1 3 3 CYS H H 3 8.348 8.348 8.493 -0.145 19746 1266 1 14 . 1 1 4 4 TYR HA H 4 4.541 4.541 4.543 -0.002 19746 1267 1 14 . 1 1 4 4 TYR H H 4 9.500 9.500 8.873 0.627 19746 1268 1 14 . 1 1 5 5 GLN HA H 5 4.328 4.328 4.211 0.117 19746 1269 1 14 . 1 1 5 5 GLN H H 5 9.293 9.293 7.955 1.338 19746 1270 1 14 . 1 1 6 6 HIS HA H 6 4.432 4.432 4.847 -0.415 19746 1271 1 14 . 1 1 6 6 HIS H H 6 8.622 8.622 7.574 1.048 19746 1272 1 14 . 1 1 7 7 GLY H H 7 8.394 8.394 8.706 -0.312 19746 1273 1 14 . 1 1 8 8 LYS HA H 8 4.746 4.746 4.837 -0.091 19746 1274 1 14 . 1 1 8 8 LYS H H 8 7.667 7.667 7.761 -0.094 19746 1275 1 14 . 1 1 9 9 VAL HA H 9 3.808 3.808 3.578 0.230 19746 1276 1 14 . 1 1 9 9 VAL H H 9 8.452 8.452 8.412 0.040 19746 1277 1 14 . 1 1 10 10 VAL HA H 10 4.578 4.578 4.550 0.028 19746 1278 1 14 . 1 1 10 10 VAL H H 10 8.907 8.907 8.672 0.235 19746 1279 1 14 . 1 1 11 11 THR HA H 11 4.395 4.395 4.427 -0.032 19746 1280 1 14 . 1 1 11 11 THR H H 11 8.441 8.441 8.381 0.060 19746 1281 1 14 . 1 1 12 12 CYS HA H 12 4.635 4.635 4.137 0.498 19746 1282 1 14 . 1 1 12 12 CYS H H 12 8.864 8.864 8.138 0.726 19746 1283 1 14 . 1 1 13 13 HIS HA H 13 3.989 3.989 4.393 -0.404 19746 1284 1 14 . 1 1 13 13 HIS H H 13 9.706 9.706 8.478 1.228 19746 1285 1 14 . 1 1 14 14 ARG HA H 14 4.384 4.384 3.978 0.406 19746 1286 1 14 . 1 1 14 14 ARG H H 14 8.791 8.791 7.814 0.977 19746 1287 1 14 . 1 1 15 15 ASP HA H 15 4.544 4.544 4.531 0.013 19746 1288 1 14 . 1 1 15 15 ASP H H 15 7.956 7.956 7.741 0.215 19746 1289 1 14 . 1 1 16 16 MET HA H 16 4.348 4.348 4.432 -0.084 19746 1290 1 14 . 1 1 16 16 MET H H 16 8.064 8.064 8.167 -0.103 19746 1291 1 14 . 1 1 17 17 LYS HA H 17 4.249 4.249 4.257 -0.008 19746 1292 1 14 . 1 1 17 17 LYS H H 17 7.659 7.659 8.520 -0.861 19746 1293 1 14 . 1 1 18 18 PHE HA H 18 5.046 5.046 4.837 0.209 19746 1294 1 14 . 1 1 18 18 PHE H H 18 8.218 8.218 7.368 0.850 19746 1295 1 14 . 1 1 19 19 CYS HA H 19 5.956 5.956 5.005 0.951 19746 1296 1 14 . 1 1 19 19 CYS H H 19 9.289 9.289 8.906 0.383 19746 1297 1 14 . 1 1 20 20 TYR HA H 20 6.157 6.157 5.513 0.644 19746 1298 1 14 . 1 1 20 20 TYR H H 20 8.847 8.847 9.030 -0.183 19746 1299 1 14 . 1 1 21 21 HIS HA H 21 5.154 5.154 4.809 0.345 19746 1300 1 14 . 1 1 21 21 HIS H H 21 8.688 8.688 8.448 0.240 19746 1301 1 14 . 1 1 22 22 ASN HA H 22 5.767 5.767 5.175 0.592 19746 1302 1 14 . 1 1 22 22 ASN H H 22 9.679 9.679 8.103 1.576 19746 1303 1 14 . 1 1 23 23 THR HA H 23 4.536 4.536 4.518 0.018 19746 1304 1 14 . 1 1 23 23 THR H H 23 8.501 8.501 8.616 -0.115 19746 1305 1 14 . 1 1 24 24 GLY H H 24 8.549 8.549 7.455 1.094 19746 1306 1 14 . 1 1 25 25 MET HA H 25 4.791 4.791 4.819 -0.028 19746 1307 1 14 . 1 1 25 25 MET H H 25 8.306 8.306 8.391 -0.085 19746 1308 1 14 . 1 1 30 30 LEU HA H 30 4.376 4.376 4.066 0.310 19746 1309 1 14 . 1 1 30 30 LEU H H 30 7.637 7.637 7.899 -0.262 19746 1310 1 14 . 1 1 31 31 LYS HA H 31 4.244 4.244 4.429 -0.185 19746 1311 1 14 . 1 1 31 31 LYS H H 31 8.000 8.000 8.288 -0.288 19746 1312 1 14 . 1 1 32 32 LEU HA H 32 4.431 4.431 4.334 0.097 19746 1313 1 14 . 1 1 32 32 LEU H H 32 7.945 7.945 8.432 -0.487 19746 1314 1 14 . 1 1 33 33 ILE HA H 33 4.396 4.396 4.186 0.210 19746 1315 1 14 . 1 1 33 33 ILE H H 33 8.204 8.204 8.335 -0.131 19746 1316 1 14 . 1 1 34 34 LEU HA H 34 4.750 4.750 4.675 0.075 19746 1317 1 14 . 1 1 34 34 LEU H H 34 9.084 9.084 8.621 0.463 19746 1318 1 14 . 1 1 35 35 GLN HA H 35 4.524 4.524 4.380 0.144 19746 1319 1 14 . 1 1 35 35 GLN H H 35 8.010 8.010 7.733 0.277 19746 1320 1 14 . 1 1 36 36 GLY H H 36 6.153 6.153 7.248 -1.095 19746 1321 1 14 . 1 1 37 37 CYS HA H 37 5.810 5.810 5.411 0.399 19746 1322 1 14 . 1 1 37 37 CYS H H 37 8.431 8.431 8.614 -0.183 19746 1323 1 14 . 1 1 38 38 SER HA H 38 4.932 4.932 4.752 0.180 19746 1324 1 14 . 1 1 38 38 SER H H 38 9.681 9.681 9.294 0.387 19746 1325 1 14 . 1 1 39 39 SER HA H 39 4.673 4.673 4.920 -0.247 19746 1326 1 14 . 1 1 39 39 SER H H 39 9.087 9.087 8.808 0.279 19746 1327 1 14 . 1 1 41 41 CYS HA H 41 4.265 4.265 4.280 -0.015 19746 1328 1 14 . 1 1 41 41 CYS H H 41 7.898 7.898 8.052 -0.154 19746 1329 1 14 . 1 1 42 42 SER HA H 42 4.580 4.580 4.421 0.159 19746 1330 1 14 . 1 1 42 42 SER H H 42 8.385 8.385 8.418 -0.033 19746 1331 1 14 . 1 1 43 43 GLU HA H 43 4.615 4.615 4.167 0.448 19746 1332 1 14 . 1 1 43 43 GLU H H 43 8.790 8.790 8.555 0.235 19746 1333 1 14 . 1 1 44 44 THR HA H 44 4.721 4.721 4.546 0.175 19746 1334 1 14 . 1 1 44 44 THR H H 44 8.954 8.954 8.634 0.320 19746 1335 1 14 . 1 1 45 45 GLU HA H 45 4.056 4.056 4.285 -0.229 19746 1336 1 14 . 1 1 45 45 GLU H H 45 8.903 8.903 8.632 0.271 19746 1337 1 14 . 1 1 46 46 ASN HA H 46 4.847 4.847 4.664 0.183 19746 1338 1 14 . 1 1 46 46 ASN H H 46 7.957 7.957 8.038 -0.081 19746 1339 1 14 . 1 1 47 47 ASN HA H 47 5.360 5.360 5.301 0.059 19746 1340 1 14 . 1 1 47 47 ASN H H 47 7.729 7.729 8.039 -0.310 19746 1341 1 14 . 1 1 48 48 LYS HA H 48 4.782 4.782 4.717 0.065 19746 1342 1 14 . 1 1 48 48 LYS H H 48 8.600 8.600 7.852 0.748 19746 1343 1 14 . 1 1 49 49 CYS HA H 49 5.517 5.517 5.641 -0.124 19746 1344 1 14 . 1 1 49 49 CYS H H 49 9.048 9.048 8.513 0.535 19746 1345 1 14 . 1 1 50 50 CYS HA H 50 5.216 5.216 4.772 0.444 19746 1346 1 14 . 1 1 50 50 CYS H H 50 9.342 9.342 9.394 -0.052 19746 1347 1 14 . 1 1 51 51 SER HA H 51 4.948 4.948 4.699 0.249 19746 1348 1 14 . 1 1 51 51 SER H H 51 9.182 9.182 9.000 0.182 19746 1349 1 14 . 1 1 52 52 THR HA H 52 4.639 4.639 4.554 0.085 19746 1350 1 14 . 1 1 52 52 THR H H 52 7.570 7.570 7.592 -0.022 19746 1351 1 14 . 1 1 53 53 ASP HA H 53 4.608 4.608 4.645 -0.037 19746 1352 1 14 . 1 1 53 53 ASP H H 53 7.844 7.844 8.292 -0.448 19746 1353 1 14 . 1 1 54 54 ARG HA H 54 4.182 4.182 3.699 0.483 19746 1354 1 14 . 1 1 54 54 ARG H H 54 8.146 8.146 8.447 -0.301 19746 1355 1 14 . 1 1 55 55 CYS HA H 55 4.526 4.526 4.354 0.172 19746 1356 1 14 . 1 1 55 55 CYS H H 55 7.899 7.899 8.489 -0.590 19746 1357 1 14 . 1 1 56 56 ASN HA H 56 4.687 4.687 4.646 0.041 19746 1358 1 14 . 1 1 56 56 ASN H H 56 8.751 8.751 7.850 0.901 19746 1359 1 15 . 1 1 2 2 LYS HA H 2 5.347 5.347 4.478 0.869 19746 1360 1 15 . 1 1 2 2 LYS H H 2 8.293 8.293 7.413 0.880 19746 1361 1 15 . 1 1 3 3 CYS HA H 3 4.901 4.901 4.597 0.304 19746 1362 1 15 . 1 1 3 3 CYS H H 3 8.348 8.348 8.684 -0.336 19746 1363 1 15 . 1 1 4 4 TYR HA H 4 4.541 4.541 4.616 -0.075 19746 1364 1 15 . 1 1 4 4 TYR H H 4 9.500 9.500 8.866 0.634 19746 1365 1 15 . 1 1 5 5 GLN HA H 5 4.328 4.328 4.213 0.115 19746 1366 1 15 . 1 1 5 5 GLN H H 5 9.293 9.293 8.108 1.185 19746 1367 1 15 . 1 1 6 6 HIS HA H 6 4.432 4.432 4.738 -0.306 19746 1368 1 15 . 1 1 6 6 HIS H H 6 8.622 8.622 7.942 0.680 19746 1369 1 15 . 1 1 7 7 GLY H H 7 8.394 8.394 8.734 -0.340 19746 1370 1 15 . 1 1 8 8 LYS HA H 8 4.746 4.746 4.595 0.151 19746 1371 1 15 . 1 1 8 8 LYS H H 8 7.667 7.667 7.812 -0.145 19746 1372 1 15 . 1 1 9 9 VAL HA H 9 3.808 3.808 3.378 0.430 19746 1373 1 15 . 1 1 9 9 VAL H H 9 8.452 8.452 8.141 0.311 19746 1374 1 15 . 1 1 10 10 VAL HA H 10 4.578 4.578 4.657 -0.079 19746 1375 1 15 . 1 1 10 10 VAL H H 10 8.907 8.907 8.933 -0.026 19746 1376 1 15 . 1 1 11 11 THR HA H 11 4.395 4.395 4.384 0.011 19746 1377 1 15 . 1 1 11 11 THR H H 11 8.441 8.441 8.357 0.084 19746 1378 1 15 . 1 1 12 12 CYS HA H 12 4.635 4.635 4.259 0.376 19746 1379 1 15 . 1 1 12 12 CYS H H 12 8.864 8.864 8.827 0.037 19746 1380 1 15 . 1 1 13 13 HIS HA H 13 3.989 3.989 4.706 -0.717 19746 1381 1 15 . 1 1 13 13 HIS H H 13 9.706 9.706 8.415 1.291 19746 1382 1 15 . 1 1 14 14 ARG HA H 14 4.384 4.384 4.053 0.331 19746 1383 1 15 . 1 1 14 14 ARG H H 14 8.791 8.791 9.117 -0.326 19746 1384 1 15 . 1 1 15 15 ASP HA H 15 4.544 4.544 4.300 0.244 19746 1385 1 15 . 1 1 15 15 ASP H H 15 7.956 7.956 8.486 -0.530 19746 1386 1 15 . 1 1 16 16 MET HA H 16 4.348 4.348 4.411 -0.063 19746 1387 1 15 . 1 1 16 16 MET H H 16 8.064 8.064 8.062 0.002 19746 1388 1 15 . 1 1 17 17 LYS HA H 17 4.249 4.249 4.283 -0.034 19746 1389 1 15 . 1 1 17 17 LYS H H 17 7.659 7.659 8.156 -0.497 19746 1390 1 15 . 1 1 18 18 PHE HA H 18 5.046 5.046 4.890 0.156 19746 1391 1 15 . 1 1 18 18 PHE H H 18 8.218 8.218 7.574 0.644 19746 1392 1 15 . 1 1 19 19 CYS HA H 19 5.956 5.956 4.999 0.957 19746 1393 1 15 . 1 1 19 19 CYS H H 19 9.289 9.289 8.860 0.429 19746 1394 1 15 . 1 1 20 20 TYR HA H 20 6.157 6.157 5.330 0.827 19746 1395 1 15 . 1 1 20 20 TYR H H 20 8.847 8.847 8.974 -0.127 19746 1396 1 15 . 1 1 21 21 HIS HA H 21 5.154 5.154 4.732 0.422 19746 1397 1 15 . 1 1 21 21 HIS H H 21 8.688 8.688 8.437 0.251 19746 1398 1 15 . 1 1 22 22 ASN HA H 22 5.767 5.767 4.715 1.052 19746 1399 1 15 . 1 1 22 22 ASN H H 22 9.679 9.679 8.678 1.001 19746 1400 1 15 . 1 1 23 23 THR HA H 23 4.536 4.536 4.637 -0.101 19746 1401 1 15 . 1 1 23 23 THR H H 23 8.501 8.501 8.956 -0.455 19746 1402 1 15 . 1 1 24 24 GLY H H 24 8.549 8.549 7.882 0.667 19746 1403 1 15 . 1 1 25 25 MET HA H 25 4.791 4.791 4.728 0.063 19746 1404 1 15 . 1 1 25 25 MET H H 25 8.306 8.306 8.288 0.018 19746 1405 1 15 . 1 1 30 30 LEU HA H 30 4.376 4.376 4.696 -0.320 19746 1406 1 15 . 1 1 30 30 LEU H H 30 7.637 7.637 8.127 -0.490 19746 1407 1 15 . 1 1 31 31 LYS HA H 31 4.244 4.244 3.877 0.367 19746 1408 1 15 . 1 1 31 31 LYS H H 31 8.000 8.000 8.644 -0.644 19746 1409 1 15 . 1 1 32 32 LEU HA H 32 4.431 4.431 4.529 -0.098 19746 1410 1 15 . 1 1 32 32 LEU H H 32 7.945 7.945 8.481 -0.536 19746 1411 1 15 . 1 1 33 33 ILE HA H 33 4.396 4.396 4.361 0.035 19746 1412 1 15 . 1 1 33 33 ILE H H 33 8.204 8.204 8.457 -0.253 19746 1413 1 15 . 1 1 34 34 LEU HA H 34 4.750 4.750 4.661 0.089 19746 1414 1 15 . 1 1 34 34 LEU H H 34 9.084 9.084 8.413 0.671 19746 1415 1 15 . 1 1 35 35 GLN HA H 35 4.524 4.524 4.653 -0.129 19746 1416 1 15 . 1 1 35 35 GLN H H 35 8.010 8.010 7.713 0.297 19746 1417 1 15 . 1 1 36 36 GLY H H 36 6.153 6.153 7.392 -1.239 19746 1418 1 15 . 1 1 37 37 CYS HA H 37 5.810 5.810 5.448 0.362 19746 1419 1 15 . 1 1 37 37 CYS H H 37 8.431 8.431 8.369 0.062 19746 1420 1 15 . 1 1 38 38 SER HA H 38 4.932 4.932 4.848 0.084 19746 1421 1 15 . 1 1 38 38 SER H H 38 9.681 9.681 9.051 0.630 19746 1422 1 15 . 1 1 39 39 SER HA H 39 4.673 4.673 4.511 0.162 19746 1423 1 15 . 1 1 39 39 SER H H 39 9.087 9.087 8.943 0.144 19746 1424 1 15 . 1 1 41 41 CYS HA H 41 4.265 4.265 4.625 -0.360 19746 1425 1 15 . 1 1 41 41 CYS H H 41 7.898 7.898 8.593 -0.695 19746 1426 1 15 . 1 1 42 42 SER HA H 42 4.580 4.580 4.512 0.068 19746 1427 1 15 . 1 1 42 42 SER H H 42 8.385 8.385 8.505 -0.120 19746 1428 1 15 . 1 1 43 43 GLU HA H 43 4.615 4.615 4.192 0.423 19746 1429 1 15 . 1 1 43 43 GLU H H 43 8.790 8.790 8.750 0.040 19746 1430 1 15 . 1 1 44 44 THR HA H 44 4.721 4.721 4.590 0.131 19746 1431 1 15 . 1 1 44 44 THR H H 44 8.954 8.954 8.205 0.749 19746 1432 1 15 . 1 1 45 45 GLU HA H 45 4.056 4.056 3.937 0.119 19746 1433 1 15 . 1 1 45 45 GLU H H 45 8.903 8.903 8.892 0.011 19746 1434 1 15 . 1 1 46 46 ASN HA H 46 4.847 4.847 4.607 0.240 19746 1435 1 15 . 1 1 46 46 ASN H H 46 7.957 7.957 8.147 -0.190 19746 1436 1 15 . 1 1 47 47 ASN HA H 47 5.360 5.360 4.965 0.395 19746 1437 1 15 . 1 1 47 47 ASN H H 47 7.729 7.729 8.184 -0.455 19746 1438 1 15 . 1 1 48 48 LYS HA H 48 4.782 4.782 4.444 0.338 19746 1439 1 15 . 1 1 48 48 LYS H H 48 8.600 8.600 7.933 0.667 19746 1440 1 15 . 1 1 49 49 CYS HA H 49 5.517 5.517 5.572 -0.055 19746 1441 1 15 . 1 1 49 49 CYS H H 49 9.048 9.048 8.463 0.585 19746 1442 1 15 . 1 1 50 50 CYS HA H 50 5.216 5.216 4.931 0.285 19746 1443 1 15 . 1 1 50 50 CYS H H 50 9.342 9.342 9.418 -0.076 19746 1444 1 15 . 1 1 51 51 SER HA H 51 4.948 4.948 4.919 0.029 19746 1445 1 15 . 1 1 51 51 SER H H 51 9.182 9.182 8.608 0.574 19746 1446 1 15 . 1 1 52 52 THR HA H 52 4.639 4.639 4.603 0.036 19746 1447 1 15 . 1 1 52 52 THR H H 52 7.570 7.570 7.892 -0.322 19746 1448 1 15 . 1 1 53 53 ASP HA H 53 4.608 4.608 4.834 -0.226 19746 1449 1 15 . 1 1 53 53 ASP H H 53 7.844 7.844 8.463 -0.619 19746 1450 1 15 . 1 1 54 54 ARG HA H 54 4.182 4.182 3.852 0.330 19746 1451 1 15 . 1 1 54 54 ARG H H 54 8.146 8.146 8.268 -0.122 19746 1452 1 15 . 1 1 55 55 CYS HA H 55 4.526 4.526 4.443 0.083 19746 1453 1 15 . 1 1 55 55 CYS H H 55 7.899 7.899 8.214 -0.315 19746 1454 1 15 . 1 1 56 56 ASN HA H 56 4.687 4.687 4.513 0.174 19746 1455 1 15 . 1 1 56 56 ASN H H 56 8.751 8.751 8.106 0.645 19746 1456 1 16 . 1 1 2 2 LYS HA H 2 5.347 5.347 4.972 0.375 19746 1457 1 16 . 1 1 2 2 LYS H H 2 8.293 8.293 8.079 0.214 19746 1458 1 16 . 1 1 3 3 CYS HA H 3 4.901 4.901 4.596 0.305 19746 1459 1 16 . 1 1 3 3 CYS H H 3 8.348 8.348 8.942 -0.594 19746 1460 1 16 . 1 1 4 4 TYR HA H 4 4.541 4.541 5.207 -0.666 19746 1461 1 16 . 1 1 4 4 TYR H H 4 9.500 9.500 8.950 0.550 19746 1462 1 16 . 1 1 5 5 GLN HA H 5 4.328 4.328 4.406 -0.078 19746 1463 1 16 . 1 1 5 5 GLN H H 5 9.293 9.293 8.438 0.855 19746 1464 1 16 . 1 1 6 6 HIS HA H 6 4.432 4.432 4.677 -0.245 19746 1465 1 16 . 1 1 6 6 HIS H H 6 8.622 8.622 7.528 1.094 19746 1466 1 16 . 1 1 7 7 GLY H H 7 8.394 8.394 8.731 -0.337 19746 1467 1 16 . 1 1 8 8 LYS HA H 8 4.746 4.746 4.928 -0.182 19746 1468 1 16 . 1 1 8 8 LYS H H 8 7.667 7.667 7.848 -0.181 19746 1469 1 16 . 1 1 9 9 VAL HA H 9 3.808 3.808 3.808 -0.000 19746 1470 1 16 . 1 1 9 9 VAL H H 9 8.452 8.452 8.459 -0.007 19746 1471 1 16 . 1 1 10 10 VAL HA H 10 4.578 4.578 4.570 0.008 19746 1472 1 16 . 1 1 10 10 VAL H H 10 8.907 8.907 8.795 0.112 19746 1473 1 16 . 1 1 11 11 THR HA H 11 4.395 4.395 4.689 -0.294 19746 1474 1 16 . 1 1 11 11 THR H H 11 8.441 8.441 8.315 0.126 19746 1475 1 16 . 1 1 12 12 CYS HA H 12 4.635 4.635 4.300 0.335 19746 1476 1 16 . 1 1 12 12 CYS H H 12 8.864 8.864 8.341 0.523 19746 1477 1 16 . 1 1 13 13 HIS HA H 13 3.989 3.989 4.557 -0.568 19746 1478 1 16 . 1 1 13 13 HIS H H 13 9.706 9.706 8.546 1.160 19746 1479 1 16 . 1 1 14 14 ARG HA H 14 4.384 4.384 3.961 0.423 19746 1480 1 16 . 1 1 14 14 ARG H H 14 8.791 8.791 8.911 -0.120 19746 1481 1 16 . 1 1 15 15 ASP HA H 15 4.544 4.544 4.659 -0.115 19746 1482 1 16 . 1 1 15 15 ASP H H 15 7.956 7.956 8.538 -0.582 19746 1483 1 16 . 1 1 16 16 MET HA H 16 4.348 4.348 4.324 0.024 19746 1484 1 16 . 1 1 16 16 MET H H 16 8.064 8.064 8.027 0.037 19746 1485 1 16 . 1 1 17 17 LYS HA H 17 4.249 4.249 4.371 -0.122 19746 1486 1 16 . 1 1 17 17 LYS H H 17 7.659 7.659 8.653 -0.994 19746 1487 1 16 . 1 1 18 18 PHE HA H 18 5.046 5.046 4.824 0.222 19746 1488 1 16 . 1 1 18 18 PHE H H 18 8.218 8.218 7.822 0.396 19746 1489 1 16 . 1 1 19 19 CYS HA H 19 5.956 5.956 5.109 0.847 19746 1490 1 16 . 1 1 19 19 CYS H H 19 9.289 9.289 9.431 -0.142 19746 1491 1 16 . 1 1 20 20 TYR HA H 20 6.157 6.157 5.047 1.110 19746 1492 1 16 . 1 1 20 20 TYR H H 20 8.847 8.847 9.156 -0.309 19746 1493 1 16 . 1 1 21 21 HIS HA H 21 5.154 5.154 4.851 0.303 19746 1494 1 16 . 1 1 21 21 HIS H H 21 8.688 8.688 8.858 -0.170 19746 1495 1 16 . 1 1 22 22 ASN HA H 22 5.767 5.767 5.150 0.617 19746 1496 1 16 . 1 1 22 22 ASN H H 22 9.679 9.679 8.943 0.736 19746 1497 1 16 . 1 1 23 23 THR HA H 23 4.536 4.536 4.355 0.181 19746 1498 1 16 . 1 1 23 23 THR H H 23 8.501 8.501 8.881 -0.380 19746 1499 1 16 . 1 1 24 24 GLY H H 24 8.549 8.549 7.378 1.171 19746 1500 1 16 . 1 1 25 25 MET HA H 25 4.791 4.791 4.740 0.051 19746 1501 1 16 . 1 1 25 25 MET H H 25 8.306 8.306 8.410 -0.104 19746 1502 1 16 . 1 1 30 30 LEU HA H 30 4.376 4.376 4.442 -0.066 19746 1503 1 16 . 1 1 30 30 LEU H H 30 7.637 7.637 7.770 -0.133 19746 1504 1 16 . 1 1 31 31 LYS HA H 31 4.244 4.244 4.090 0.154 19746 1505 1 16 . 1 1 31 31 LYS H H 31 8.000 8.000 8.471 -0.471 19746 1506 1 16 . 1 1 32 32 LEU HA H 32 4.431 4.431 4.819 -0.388 19746 1507 1 16 . 1 1 32 32 LEU H H 32 7.945 7.945 7.626 0.319 19746 1508 1 16 . 1 1 33 33 ILE HA H 33 4.396 4.396 3.903 0.493 19746 1509 1 16 . 1 1 33 33 ILE H H 33 8.204 8.204 8.153 0.051 19746 1510 1 16 . 1 1 34 34 LEU HA H 34 4.750 4.750 4.652 0.098 19746 1511 1 16 . 1 1 34 34 LEU H H 34 9.084 9.084 8.839 0.245 19746 1512 1 16 . 1 1 35 35 GLN HA H 35 4.524 4.524 4.168 0.356 19746 1513 1 16 . 1 1 35 35 GLN H H 35 8.010 8.010 8.104 -0.094 19746 1514 1 16 . 1 1 36 36 GLY H H 36 6.153 6.153 7.151 -0.998 19746 1515 1 16 . 1 1 37 37 CYS HA H 37 5.810 5.810 5.505 0.305 19746 1516 1 16 . 1 1 37 37 CYS H H 37 8.431 8.431 8.670 -0.239 19746 1517 1 16 . 1 1 38 38 SER HA H 38 4.932 4.932 4.860 0.072 19746 1518 1 16 . 1 1 38 38 SER H H 38 9.681 9.681 9.049 0.632 19746 1519 1 16 . 1 1 39 39 SER HA H 39 4.673 4.673 4.644 0.029 19746 1520 1 16 . 1 1 39 39 SER H H 39 9.087 9.087 8.674 0.413 19746 1521 1 16 . 1 1 41 41 CYS HA H 41 4.265 4.265 4.110 0.155 19746 1522 1 16 . 1 1 41 41 CYS H H 41 7.898 7.898 7.926 -0.028 19746 1523 1 16 . 1 1 42 42 SER HA H 42 4.580 4.580 4.490 0.090 19746 1524 1 16 . 1 1 42 42 SER H H 42 8.385 8.385 8.574 -0.189 19746 1525 1 16 . 1 1 43 43 GLU HA H 43 4.615 4.615 3.956 0.659 19746 1526 1 16 . 1 1 43 43 GLU H H 43 8.790 8.790 8.280 0.510 19746 1527 1 16 . 1 1 44 44 THR HA H 44 4.721 4.721 4.582 0.139 19746 1528 1 16 . 1 1 44 44 THR H H 44 8.954 8.954 8.473 0.481 19746 1529 1 16 . 1 1 45 45 GLU HA H 45 4.056 4.056 4.104 -0.048 19746 1530 1 16 . 1 1 45 45 GLU H H 45 8.903 8.903 8.788 0.115 19746 1531 1 16 . 1 1 46 46 ASN HA H 46 4.847 4.847 4.613 0.234 19746 1532 1 16 . 1 1 46 46 ASN H H 46 7.957 7.957 7.967 -0.010 19746 1533 1 16 . 1 1 47 47 ASN HA H 47 5.360 5.360 4.925 0.435 19746 1534 1 16 . 1 1 47 47 ASN H H 47 7.729 7.729 8.193 -0.464 19746 1535 1 16 . 1 1 48 48 LYS HA H 48 4.782 4.782 4.593 0.189 19746 1536 1 16 . 1 1 48 48 LYS H H 48 8.600 8.600 7.717 0.883 19746 1537 1 16 . 1 1 49 49 CYS HA H 49 5.517 5.517 4.977 0.540 19746 1538 1 16 . 1 1 49 49 CYS H H 49 9.048 9.048 8.295 0.753 19746 1539 1 16 . 1 1 50 50 CYS HA H 50 5.216 5.216 5.041 0.175 19746 1540 1 16 . 1 1 50 50 CYS H H 50 9.342 9.342 9.399 -0.057 19746 1541 1 16 . 1 1 51 51 SER HA H 51 4.948 4.948 4.489 0.459 19746 1542 1 16 . 1 1 51 51 SER H H 51 9.182 9.182 8.635 0.547 19746 1543 1 16 . 1 1 52 52 THR HA H 52 4.639 4.639 4.415 0.224 19746 1544 1 16 . 1 1 52 52 THR H H 52 7.570 7.570 7.629 -0.059 19746 1545 1 16 . 1 1 53 53 ASP HA H 53 4.608 4.608 4.380 0.228 19746 1546 1 16 . 1 1 53 53 ASP H H 53 7.844 7.844 7.707 0.137 19746 1547 1 16 . 1 1 54 54 ARG HA H 54 4.182 4.182 3.786 0.396 19746 1548 1 16 . 1 1 54 54 ARG H H 54 8.146 8.146 8.280 -0.134 19746 1549 1 16 . 1 1 55 55 CYS HA H 55 4.526 4.526 4.498 0.028 19746 1550 1 16 . 1 1 55 55 CYS H H 55 7.899 7.899 8.272 -0.373 19746 1551 1 16 . 1 1 56 56 ASN HA H 56 4.687 4.687 4.402 0.285 19746 1552 1 16 . 1 1 56 56 ASN H H 56 8.751 8.751 8.482 0.269 19746 1553 1 17 . 1 1 2 2 LYS HA H 2 5.347 5.347 4.808 0.539 19746 1554 1 17 . 1 1 2 2 LYS H H 2 8.293 8.293 7.391 0.902 19746 1555 1 17 . 1 1 3 3 CYS HA H 3 4.901 4.901 4.607 0.294 19746 1556 1 17 . 1 1 3 3 CYS H H 3 8.348 8.348 8.781 -0.433 19746 1557 1 17 . 1 1 4 4 TYR HA H 4 4.541 4.541 4.572 -0.031 19746 1558 1 17 . 1 1 4 4 TYR H H 4 9.500 9.500 8.495 1.005 19746 1559 1 17 . 1 1 5 5 GLN HA H 5 4.328 4.328 4.453 -0.125 19746 1560 1 17 . 1 1 5 5 GLN H H 5 9.293 9.293 7.963 1.330 19746 1561 1 17 . 1 1 6 6 HIS HA H 6 4.432 4.432 4.712 -0.280 19746 1562 1 17 . 1 1 6 6 HIS H H 6 8.622 8.622 7.704 0.918 19746 1563 1 17 . 1 1 7 7 GLY H H 7 8.394 8.394 8.710 -0.316 19746 1564 1 17 . 1 1 8 8 LYS HA H 8 4.746 4.746 4.817 -0.071 19746 1565 1 17 . 1 1 8 8 LYS H H 8 7.667 7.667 7.860 -0.193 19746 1566 1 17 . 1 1 9 9 VAL HA H 9 3.808 3.808 3.508 0.300 19746 1567 1 17 . 1 1 9 9 VAL H H 9 8.452 8.452 8.492 -0.040 19746 1568 1 17 . 1 1 10 10 VAL HA H 10 4.578 4.578 4.684 -0.106 19746 1569 1 17 . 1 1 10 10 VAL H H 10 8.907 8.907 8.691 0.216 19746 1570 1 17 . 1 1 11 11 THR HA H 11 4.395 4.395 4.632 -0.237 19746 1571 1 17 . 1 1 11 11 THR H H 11 8.441 8.441 8.249 0.192 19746 1572 1 17 . 1 1 12 12 CYS HA H 12 4.635 4.635 4.365 0.270 19746 1573 1 17 . 1 1 12 12 CYS H H 12 8.864 8.864 8.555 0.309 19746 1574 1 17 . 1 1 13 13 HIS HA H 13 3.989 3.989 4.498 -0.509 19746 1575 1 17 . 1 1 13 13 HIS H H 13 9.706 9.706 8.488 1.218 19746 1576 1 17 . 1 1 14 14 ARG HA H 14 4.384 4.384 4.362 0.022 19746 1577 1 17 . 1 1 14 14 ARG H H 14 8.791 8.791 8.665 0.126 19746 1578 1 17 . 1 1 15 15 ASP HA H 15 4.544 4.544 4.694 -0.150 19746 1579 1 17 . 1 1 15 15 ASP H H 15 7.956 7.956 8.310 -0.354 19746 1580 1 17 . 1 1 16 16 MET HA H 16 4.348 4.348 4.459 -0.111 19746 1581 1 17 . 1 1 16 16 MET H H 16 8.064 8.064 8.178 -0.114 19746 1582 1 17 . 1 1 17 17 LYS HA H 17 4.249 4.249 4.355 -0.106 19746 1583 1 17 . 1 1 17 17 LYS H H 17 7.659 7.659 8.184 -0.525 19746 1584 1 17 . 1 1 18 18 PHE HA H 18 5.046 5.046 4.913 0.133 19746 1585 1 17 . 1 1 18 18 PHE H H 18 8.218 8.218 7.899 0.319 19746 1586 1 17 . 1 1 19 19 CYS HA H 19 5.956 5.956 5.211 0.745 19746 1587 1 17 . 1 1 19 19 CYS H H 19 9.289 9.289 9.272 0.017 19746 1588 1 17 . 1 1 20 20 TYR HA H 20 6.157 6.157 5.025 1.132 19746 1589 1 17 . 1 1 20 20 TYR H H 20 8.847 8.847 9.177 -0.330 19746 1590 1 17 . 1 1 21 21 HIS HA H 21 5.154 5.154 4.737 0.417 19746 1591 1 17 . 1 1 21 21 HIS H H 21 8.688 8.688 8.817 -0.129 19746 1592 1 17 . 1 1 22 22 ASN HA H 22 5.767 5.767 5.140 0.627 19746 1593 1 17 . 1 1 22 22 ASN H H 22 9.679 9.679 8.620 1.059 19746 1594 1 17 . 1 1 23 23 THR HA H 23 4.536 4.536 4.453 0.083 19746 1595 1 17 . 1 1 23 23 THR H H 23 8.501 8.501 8.911 -0.410 19746 1596 1 17 . 1 1 24 24 GLY H H 24 8.549 8.549 7.548 1.001 19746 1597 1 17 . 1 1 25 25 MET HA H 25 4.791 4.791 4.768 0.023 19746 1598 1 17 . 1 1 25 25 MET H H 25 8.306 8.306 7.881 0.425 19746 1599 1 17 . 1 1 30 30 LEU HA H 30 4.376 4.376 4.707 -0.331 19746 1600 1 17 . 1 1 30 30 LEU H H 30 7.637 7.637 7.673 -0.036 19746 1601 1 17 . 1 1 31 31 LYS HA H 31 4.244 4.244 4.834 -0.590 19746 1602 1 17 . 1 1 31 31 LYS H H 31 8.000 8.000 8.539 -0.539 19746 1603 1 17 . 1 1 32 32 LEU HA H 32 4.431 4.431 4.210 0.221 19746 1604 1 17 . 1 1 32 32 LEU H H 32 7.945 7.945 8.624 -0.679 19746 1605 1 17 . 1 1 33 33 ILE HA H 33 4.396 4.396 3.918 0.478 19746 1606 1 17 . 1 1 33 33 ILE H H 33 8.204 8.204 7.944 0.260 19746 1607 1 17 . 1 1 34 34 LEU HA H 34 4.750 4.750 4.612 0.138 19746 1608 1 17 . 1 1 34 34 LEU H H 34 9.084 9.084 8.256 0.828 19746 1609 1 17 . 1 1 35 35 GLN HA H 35 4.524 4.524 4.295 0.229 19746 1610 1 17 . 1 1 35 35 GLN H H 35 8.010 8.010 7.858 0.152 19746 1611 1 17 . 1 1 36 36 GLY H H 36 6.153 6.153 7.259 -1.106 19746 1612 1 17 . 1 1 37 37 CYS HA H 37 5.810 5.810 5.757 0.053 19746 1613 1 17 . 1 1 37 37 CYS H H 37 8.431 8.431 8.567 -0.136 19746 1614 1 17 . 1 1 38 38 SER HA H 38 4.932 4.932 4.796 0.136 19746 1615 1 17 . 1 1 38 38 SER H H 38 9.681 9.681 9.167 0.514 19746 1616 1 17 . 1 1 39 39 SER HA H 39 4.673 4.673 4.931 -0.258 19746 1617 1 17 . 1 1 39 39 SER H H 39 9.087 9.087 8.618 0.469 19746 1618 1 17 . 1 1 41 41 CYS HA H 41 4.265 4.265 4.104 0.161 19746 1619 1 17 . 1 1 41 41 CYS H H 41 7.898 7.898 8.070 -0.172 19746 1620 1 17 . 1 1 42 42 SER HA H 42 4.580 4.580 4.430 0.150 19746 1621 1 17 . 1 1 42 42 SER H H 42 8.385 8.385 8.528 -0.143 19746 1622 1 17 . 1 1 43 43 GLU HA H 43 4.615 4.615 3.927 0.688 19746 1623 1 17 . 1 1 43 43 GLU H H 43 8.790 8.790 8.009 0.781 19746 1624 1 17 . 1 1 44 44 THR HA H 44 4.721 4.721 4.486 0.235 19746 1625 1 17 . 1 1 44 44 THR H H 44 8.954 8.954 8.378 0.576 19746 1626 1 17 . 1 1 45 45 GLU HA H 45 4.056 4.056 4.014 0.042 19746 1627 1 17 . 1 1 45 45 GLU H H 45 8.903 8.903 8.713 0.190 19746 1628 1 17 . 1 1 46 46 ASN HA H 46 4.847 4.847 4.527 0.320 19746 1629 1 17 . 1 1 46 46 ASN H H 46 7.957 7.957 8.312 -0.355 19746 1630 1 17 . 1 1 47 47 ASN HA H 47 5.360 5.360 5.077 0.283 19746 1631 1 17 . 1 1 47 47 ASN H H 47 7.729 7.729 8.064 -0.335 19746 1632 1 17 . 1 1 48 48 LYS HA H 48 4.782 4.782 4.548 0.234 19746 1633 1 17 . 1 1 48 48 LYS H H 48 8.600 8.600 7.751 0.849 19746 1634 1 17 . 1 1 49 49 CYS HA H 49 5.517 5.517 4.932 0.585 19746 1635 1 17 . 1 1 49 49 CYS H H 49 9.048 9.048 8.437 0.611 19746 1636 1 17 . 1 1 50 50 CYS HA H 50 5.216 5.216 4.883 0.333 19746 1637 1 17 . 1 1 50 50 CYS H H 50 9.342 9.342 9.404 -0.062 19746 1638 1 17 . 1 1 51 51 SER HA H 51 4.948 4.948 4.670 0.278 19746 1639 1 17 . 1 1 51 51 SER H H 51 9.182 9.182 8.507 0.675 19746 1640 1 17 . 1 1 52 52 THR HA H 52 4.639 4.639 3.818 0.821 19746 1641 1 17 . 1 1 52 52 THR H H 52 7.570 7.570 7.690 -0.120 19746 1642 1 17 . 1 1 53 53 ASP HA H 53 4.608 4.608 4.247 0.361 19746 1643 1 17 . 1 1 53 53 ASP H H 53 7.844 7.844 8.426 -0.582 19746 1644 1 17 . 1 1 54 54 ARG HA H 54 4.182 4.182 3.605 0.577 19746 1645 1 17 . 1 1 54 54 ARG H H 54 8.146 8.146 7.989 0.157 19746 1646 1 17 . 1 1 55 55 CYS HA H 55 4.526 4.526 4.294 0.232 19746 1647 1 17 . 1 1 55 55 CYS H H 55 7.899 7.899 8.526 -0.627 19746 1648 1 17 . 1 1 56 56 ASN HA H 56 4.687 4.687 4.581 0.106 19746 1649 1 17 . 1 1 56 56 ASN H H 56 8.751 8.751 8.572 0.179 19746 1650 1 18 . 1 1 2 2 LYS HA H 2 5.347 5.347 4.873 0.474 19746 1651 1 18 . 1 1 2 2 LYS H H 2 8.293 8.293 7.415 0.878 19746 1652 1 18 . 1 1 3 3 CYS HA H 3 4.901 4.901 4.764 0.137 19746 1653 1 18 . 1 1 3 3 CYS H H 3 8.348 8.348 8.640 -0.292 19746 1654 1 18 . 1 1 4 4 TYR HA H 4 4.541 4.541 5.115 -0.574 19746 1655 1 18 . 1 1 4 4 TYR H H 4 9.500 9.500 8.931 0.569 19746 1656 1 18 . 1 1 5 5 GLN HA H 5 4.328 4.328 4.453 -0.125 19746 1657 1 18 . 1 1 5 5 GLN H H 5 9.293 9.293 7.850 1.443 19746 1658 1 18 . 1 1 6 6 HIS HA H 6 4.432 4.432 4.777 -0.345 19746 1659 1 18 . 1 1 6 6 HIS H H 6 8.622 8.622 7.721 0.901 19746 1660 1 18 . 1 1 7 7 GLY H H 7 8.394 8.394 8.747 -0.353 19746 1661 1 18 . 1 1 8 8 LYS HA H 8 4.746 4.746 4.877 -0.131 19746 1662 1 18 . 1 1 8 8 LYS H H 8 7.667 7.667 7.695 -0.028 19746 1663 1 18 . 1 1 9 9 VAL HA H 9 3.808 3.808 3.736 0.072 19746 1664 1 18 . 1 1 9 9 VAL H H 9 8.452 8.452 8.322 0.130 19746 1665 1 18 . 1 1 10 10 VAL HA H 10 4.578 4.578 4.538 0.040 19746 1666 1 18 . 1 1 10 10 VAL H H 10 8.907 8.907 8.669 0.238 19746 1667 1 18 . 1 1 11 11 THR HA H 11 4.395 4.395 4.650 -0.255 19746 1668 1 18 . 1 1 11 11 THR H H 11 8.441 8.441 8.252 0.189 19746 1669 1 18 . 1 1 12 12 CYS HA H 12 4.635 4.635 4.142 0.493 19746 1670 1 18 . 1 1 12 12 CYS H H 12 8.864 8.864 8.301 0.563 19746 1671 1 18 . 1 1 13 13 HIS HA H 13 3.989 3.989 4.452 -0.463 19746 1672 1 18 . 1 1 13 13 HIS H H 13 9.706 9.706 8.488 1.218 19746 1673 1 18 . 1 1 14 14 ARG HA H 14 4.384 4.384 4.193 0.191 19746 1674 1 18 . 1 1 14 14 ARG H H 14 8.791 8.791 8.659 0.132 19746 1675 1 18 . 1 1 15 15 ASP HA H 15 4.544 4.544 4.566 -0.022 19746 1676 1 18 . 1 1 15 15 ASP H H 15 7.956 7.956 8.347 -0.391 19746 1677 1 18 . 1 1 16 16 MET HA H 16 4.348 4.348 4.459 -0.111 19746 1678 1 18 . 1 1 16 16 MET H H 16 8.064 8.064 8.210 -0.146 19746 1679 1 18 . 1 1 17 17 LYS HA H 17 4.249 4.249 4.322 -0.073 19746 1680 1 18 . 1 1 17 17 LYS H H 17 7.659 7.659 8.811 -1.152 19746 1681 1 18 . 1 1 18 18 PHE HA H 18 5.046 5.046 4.973 0.073 19746 1682 1 18 . 1 1 18 18 PHE H H 18 8.218 8.218 7.955 0.263 19746 1683 1 18 . 1 1 19 19 CYS HA H 19 5.956 5.956 5.173 0.783 19746 1684 1 18 . 1 1 19 19 CYS H H 19 9.289 9.289 8.923 0.366 19746 1685 1 18 . 1 1 20 20 TYR HA H 20 6.157 6.157 5.576 0.581 19746 1686 1 18 . 1 1 20 20 TYR H H 20 8.847 8.847 9.449 -0.602 19746 1687 1 18 . 1 1 21 21 HIS HA H 21 5.154 5.154 4.739 0.415 19746 1688 1 18 . 1 1 21 21 HIS H H 21 8.688 8.688 8.713 -0.025 19746 1689 1 18 . 1 1 22 22 ASN HA H 22 5.767 5.767 5.289 0.478 19746 1690 1 18 . 1 1 22 22 ASN H H 22 9.679 9.679 8.325 1.354 19746 1691 1 18 . 1 1 23 23 THR HA H 23 4.536 4.536 4.476 0.060 19746 1692 1 18 . 1 1 23 23 THR H H 23 8.501 8.501 9.156 -0.655 19746 1693 1 18 . 1 1 24 24 GLY H H 24 8.549 8.549 8.764 -0.215 19746 1694 1 18 . 1 1 25 25 MET HA H 25 4.791 4.791 4.871 -0.080 19746 1695 1 18 . 1 1 25 25 MET H H 25 8.306 8.306 8.435 -0.129 19746 1696 1 18 . 1 1 30 30 LEU HA H 30 4.376 4.376 4.636 -0.260 19746 1697 1 18 . 1 1 30 30 LEU H H 30 7.637 7.637 8.324 -0.687 19746 1698 1 18 . 1 1 31 31 LYS HA H 31 4.244 4.244 4.306 -0.062 19746 1699 1 18 . 1 1 31 31 LYS H H 31 8.000 8.000 8.760 -0.760 19746 1700 1 18 . 1 1 32 32 LEU HA H 32 4.431 4.431 3.886 0.545 19746 1701 1 18 . 1 1 32 32 LEU H H 32 7.945 7.945 7.589 0.356 19746 1702 1 18 . 1 1 33 33 ILE HA H 33 4.396 4.396 4.052 0.344 19746 1703 1 18 . 1 1 33 33 ILE H H 33 8.204 8.204 8.126 0.078 19746 1704 1 18 . 1 1 34 34 LEU HA H 34 4.750 4.750 4.697 0.053 19746 1705 1 18 . 1 1 34 34 LEU H H 34 9.084 9.084 8.879 0.205 19746 1706 1 18 . 1 1 35 35 GLN HA H 35 4.524 4.524 4.770 -0.246 19746 1707 1 18 . 1 1 35 35 GLN H H 35 8.010 8.010 7.879 0.131 19746 1708 1 18 . 1 1 36 36 GLY H H 36 6.153 6.153 7.462 -1.309 19746 1709 1 18 . 1 1 37 37 CYS HA H 37 5.810 5.810 5.626 0.184 19746 1710 1 18 . 1 1 37 37 CYS H H 37 8.431 8.431 8.682 -0.251 19746 1711 1 18 . 1 1 38 38 SER HA H 38 4.932 4.932 4.634 0.298 19746 1712 1 18 . 1 1 38 38 SER H H 38 9.681 9.681 9.168 0.513 19746 1713 1 18 . 1 1 39 39 SER HA H 39 4.673 4.673 4.690 -0.017 19746 1714 1 18 . 1 1 39 39 SER H H 39 9.087 9.087 8.359 0.728 19746 1715 1 18 . 1 1 41 41 CYS HA H 41 4.265 4.265 4.260 0.005 19746 1716 1 18 . 1 1 41 41 CYS H H 41 7.898 7.898 7.879 0.019 19746 1717 1 18 . 1 1 42 42 SER HA H 42 4.580 4.580 4.454 0.126 19746 1718 1 18 . 1 1 42 42 SER H H 42 8.385 8.385 8.627 -0.242 19746 1719 1 18 . 1 1 43 43 GLU HA H 43 4.615 4.615 4.063 0.552 19746 1720 1 18 . 1 1 43 43 GLU H H 43 8.790 8.790 8.408 0.382 19746 1721 1 18 . 1 1 44 44 THR HA H 44 4.721 4.721 4.608 0.113 19746 1722 1 18 . 1 1 44 44 THR H H 44 8.954 8.954 8.748 0.206 19746 1723 1 18 . 1 1 45 45 GLU HA H 45 4.056 4.056 4.152 -0.096 19746 1724 1 18 . 1 1 45 45 GLU H H 45 8.903 8.903 8.803 0.100 19746 1725 1 18 . 1 1 46 46 ASN HA H 46 4.847 4.847 4.645 0.202 19746 1726 1 18 . 1 1 46 46 ASN H H 46 7.957 7.957 8.161 -0.204 19746 1727 1 18 . 1 1 47 47 ASN HA H 47 5.360 5.360 5.086 0.274 19746 1728 1 18 . 1 1 47 47 ASN H H 47 7.729 7.729 8.042 -0.313 19746 1729 1 18 . 1 1 48 48 LYS HA H 48 4.782 4.782 4.802 -0.020 19746 1730 1 18 . 1 1 48 48 LYS H H 48 8.600 8.600 7.934 0.666 19746 1731 1 18 . 1 1 49 49 CYS HA H 49 5.517 5.517 5.354 0.163 19746 1732 1 18 . 1 1 49 49 CYS H H 49 9.048 9.048 8.465 0.583 19746 1733 1 18 . 1 1 50 50 CYS HA H 50 5.216 5.216 4.942 0.274 19746 1734 1 18 . 1 1 50 50 CYS H H 50 9.342 9.342 9.329 0.013 19746 1735 1 18 . 1 1 51 51 SER HA H 51 4.948 4.948 4.581 0.367 19746 1736 1 18 . 1 1 51 51 SER H H 51 9.182 9.182 8.604 0.578 19746 1737 1 18 . 1 1 52 52 THR HA H 52 4.639 4.639 4.563 0.076 19746 1738 1 18 . 1 1 52 52 THR H H 52 7.570 7.570 7.638 -0.068 19746 1739 1 18 . 1 1 53 53 ASP HA H 53 4.608 4.608 4.700 -0.092 19746 1740 1 18 . 1 1 53 53 ASP H H 53 7.844 7.844 8.360 -0.516 19746 1741 1 18 . 1 1 54 54 ARG HA H 54 4.182 4.182 3.886 0.296 19746 1742 1 18 . 1 1 54 54 ARG H H 54 8.146 8.146 8.490 -0.344 19746 1743 1 18 . 1 1 55 55 CYS HA H 55 4.526 4.526 4.420 0.106 19746 1744 1 18 . 1 1 55 55 CYS H H 55 7.899 7.899 8.334 -0.435 19746 1745 1 18 . 1 1 56 56 ASN HA H 56 4.687 4.687 4.709 -0.022 19746 1746 1 18 . 1 1 56 56 ASN H H 56 8.751 8.751 8.240 0.511 19746 1747 1 19 . 1 1 2 2 LYS HA H 2 5.347 5.347 4.554 0.793 19746 1748 1 19 . 1 1 2 2 LYS H H 2 8.293 8.293 7.461 0.832 19746 1749 1 19 . 1 1 3 3 CYS HA H 3 4.901 4.901 4.631 0.270 19746 1750 1 19 . 1 1 3 3 CYS H H 3 8.348 8.348 8.660 -0.312 19746 1751 1 19 . 1 1 4 4 TYR HA H 4 4.541 4.541 4.719 -0.178 19746 1752 1 19 . 1 1 4 4 TYR H H 4 9.500 9.500 8.495 1.005 19746 1753 1 19 . 1 1 5 5 GLN HA H 5 4.328 4.328 4.225 0.103 19746 1754 1 19 . 1 1 5 5 GLN H H 5 9.293 9.293 8.286 1.007 19746 1755 1 19 . 1 1 6 6 HIS HA H 6 4.432 4.432 4.767 -0.335 19746 1756 1 19 . 1 1 6 6 HIS H H 6 8.622 8.622 7.676 0.946 19746 1757 1 19 . 1 1 7 7 GLY H H 7 8.394 8.394 8.395 -0.001 19746 1758 1 19 . 1 1 8 8 LYS HA H 8 4.746 4.746 4.731 0.015 19746 1759 1 19 . 1 1 8 8 LYS H H 8 7.667 7.667 7.796 -0.129 19746 1760 1 19 . 1 1 9 9 VAL HA H 9 3.808 3.808 3.507 0.301 19746 1761 1 19 . 1 1 9 9 VAL H H 9 8.452 8.452 8.274 0.178 19746 1762 1 19 . 1 1 10 10 VAL HA H 10 4.578 4.578 4.631 -0.053 19746 1763 1 19 . 1 1 10 10 VAL H H 10 8.907 8.907 8.570 0.337 19746 1764 1 19 . 1 1 11 11 THR HA H 11 4.395 4.395 4.438 -0.043 19746 1765 1 19 . 1 1 11 11 THR H H 11 8.441 8.441 8.135 0.306 19746 1766 1 19 . 1 1 12 12 CYS HA H 12 4.635 4.635 4.110 0.525 19746 1767 1 19 . 1 1 12 12 CYS H H 12 8.864 8.864 8.168 0.696 19746 1768 1 19 . 1 1 13 13 HIS HA H 13 3.989 3.989 4.324 -0.335 19746 1769 1 19 . 1 1 13 13 HIS H H 13 9.706 9.706 7.339 2.367 19746 1770 1 19 . 1 1 14 14 ARG HA H 14 4.384 4.384 4.227 0.157 19746 1771 1 19 . 1 1 14 14 ARG H H 14 8.791 8.791 8.854 -0.063 19746 1772 1 19 . 1 1 15 15 ASP HA H 15 4.544 4.544 4.782 -0.238 19746 1773 1 19 . 1 1 15 15 ASP H H 15 7.956 7.956 8.133 -0.177 19746 1774 1 19 . 1 1 16 16 MET HA H 16 4.348 4.348 4.632 -0.284 19746 1775 1 19 . 1 1 16 16 MET H H 16 8.064 8.064 7.554 0.510 19746 1776 1 19 . 1 1 17 17 LYS HA H 17 4.249 4.249 4.448 -0.199 19746 1777 1 19 . 1 1 17 17 LYS H H 17 7.659 7.659 8.646 -0.987 19746 1778 1 19 . 1 1 18 18 PHE HA H 18 5.046 5.046 4.725 0.321 19746 1779 1 19 . 1 1 18 18 PHE H H 18 8.218 8.218 8.002 0.216 19746 1780 1 19 . 1 1 19 19 CYS HA H 19 5.956 5.956 4.777 1.179 19746 1781 1 19 . 1 1 19 19 CYS H H 19 9.289 9.289 8.830 0.459 19746 1782 1 19 . 1 1 20 20 TYR HA H 20 6.157 6.157 5.624 0.533 19746 1783 1 19 . 1 1 20 20 TYR H H 20 8.847 8.847 8.833 0.014 19746 1784 1 19 . 1 1 21 21 HIS HA H 21 5.154 5.154 5.145 0.009 19746 1785 1 19 . 1 1 21 21 HIS H H 21 8.688 8.688 8.697 -0.009 19746 1786 1 19 . 1 1 22 22 ASN HA H 22 5.767 5.767 5.088 0.679 19746 1787 1 19 . 1 1 22 22 ASN H H 22 9.679 9.679 8.618 1.061 19746 1788 1 19 . 1 1 23 23 THR HA H 23 4.536 4.536 4.517 0.019 19746 1789 1 19 . 1 1 23 23 THR H H 23 8.501 8.501 9.228 -0.727 19746 1790 1 19 . 1 1 24 24 GLY H H 24 8.549 8.549 8.647 -0.098 19746 1791 1 19 . 1 1 25 25 MET HA H 25 4.791 4.791 4.678 0.113 19746 1792 1 19 . 1 1 25 25 MET H H 25 8.306 8.306 8.247 0.059 19746 1793 1 19 . 1 1 30 30 LEU HA H 30 4.376 4.376 4.045 0.331 19746 1794 1 19 . 1 1 30 30 LEU H H 30 7.637 7.637 7.582 0.055 19746 1795 1 19 . 1 1 31 31 LYS HA H 31 4.244 4.244 4.483 -0.239 19746 1796 1 19 . 1 1 31 31 LYS H H 31 8.000 8.000 8.218 -0.218 19746 1797 1 19 . 1 1 32 32 LEU HA H 32 4.431 4.431 4.168 0.263 19746 1798 1 19 . 1 1 32 32 LEU H H 32 7.945 7.945 7.784 0.161 19746 1799 1 19 . 1 1 33 33 ILE HA H 33 4.396 4.396 4.053 0.343 19746 1800 1 19 . 1 1 33 33 ILE H H 33 8.204 8.204 8.214 -0.010 19746 1801 1 19 . 1 1 34 34 LEU HA H 34 4.750 4.750 4.689 0.061 19746 1802 1 19 . 1 1 34 34 LEU H H 34 9.084 9.084 8.559 0.525 19746 1803 1 19 . 1 1 35 35 GLN HA H 35 4.524 4.524 4.647 -0.123 19746 1804 1 19 . 1 1 35 35 GLN H H 35 8.010 8.010 7.959 0.051 19746 1805 1 19 . 1 1 36 36 GLY H H 36 6.153 6.153 7.421 -1.268 19746 1806 1 19 . 1 1 37 37 CYS HA H 37 5.810 5.810 5.413 0.397 19746 1807 1 19 . 1 1 37 37 CYS H H 37 8.431 8.431 8.526 -0.095 19746 1808 1 19 . 1 1 38 38 SER HA H 38 4.932 4.932 4.921 0.011 19746 1809 1 19 . 1 1 38 38 SER H H 38 9.681 9.681 8.929 0.752 19746 1810 1 19 . 1 1 39 39 SER HA H 39 4.673 4.673 4.631 0.042 19746 1811 1 19 . 1 1 39 39 SER H H 39 9.087 9.087 8.709 0.378 19746 1812 1 19 . 1 1 41 41 CYS HA H 41 4.265 4.265 4.533 -0.268 19746 1813 1 19 . 1 1 41 41 CYS H H 41 7.898 7.898 8.344 -0.446 19746 1814 1 19 . 1 1 42 42 SER HA H 42 4.580 4.580 4.552 0.028 19746 1815 1 19 . 1 1 42 42 SER H H 42 8.385 8.385 8.428 -0.043 19746 1816 1 19 . 1 1 43 43 GLU HA H 43 4.615 4.615 4.268 0.347 19746 1817 1 19 . 1 1 43 43 GLU H H 43 8.790 8.790 8.342 0.448 19746 1818 1 19 . 1 1 44 44 THR HA H 44 4.721 4.721 4.456 0.265 19746 1819 1 19 . 1 1 44 44 THR H H 44 8.954 8.954 8.500 0.454 19746 1820 1 19 . 1 1 45 45 GLU HA H 45 4.056 4.056 3.908 0.148 19746 1821 1 19 . 1 1 45 45 GLU H H 45 8.903 8.903 8.868 0.035 19746 1822 1 19 . 1 1 46 46 ASN HA H 46 4.847 4.847 4.618 0.229 19746 1823 1 19 . 1 1 46 46 ASN H H 46 7.957 7.957 8.101 -0.144 19746 1824 1 19 . 1 1 47 47 ASN HA H 47 5.360 5.360 5.029 0.331 19746 1825 1 19 . 1 1 47 47 ASN H H 47 7.729 7.729 7.940 -0.211 19746 1826 1 19 . 1 1 48 48 LYS HA H 48 4.782 4.782 4.825 -0.043 19746 1827 1 19 . 1 1 48 48 LYS H H 48 8.600 8.600 7.897 0.703 19746 1828 1 19 . 1 1 49 49 CYS HA H 49 5.517 5.517 5.538 -0.021 19746 1829 1 19 . 1 1 49 49 CYS H H 49 9.048 9.048 8.721 0.327 19746 1830 1 19 . 1 1 50 50 CYS HA H 50 5.216 5.216 4.928 0.288 19746 1831 1 19 . 1 1 50 50 CYS H H 50 9.342 9.342 9.429 -0.087 19746 1832 1 19 . 1 1 51 51 SER HA H 51 4.948 4.948 4.683 0.265 19746 1833 1 19 . 1 1 51 51 SER H H 51 9.182 9.182 8.962 0.220 19746 1834 1 19 . 1 1 52 52 THR HA H 52 4.639 4.639 4.530 0.109 19746 1835 1 19 . 1 1 52 52 THR H H 52 7.570 7.570 7.793 -0.223 19746 1836 1 19 . 1 1 53 53 ASP HA H 53 4.608 4.608 4.241 0.367 19746 1837 1 19 . 1 1 53 53 ASP H H 53 7.844 7.844 7.772 0.072 19746 1838 1 19 . 1 1 54 54 ARG HA H 54 4.182 4.182 3.716 0.466 19746 1839 1 19 . 1 1 54 54 ARG H H 54 8.146 8.146 8.292 -0.146 19746 1840 1 19 . 1 1 55 55 CYS HA H 55 4.526 4.526 4.403 0.123 19746 1841 1 19 . 1 1 55 55 CYS H H 55 7.899 7.899 8.434 -0.535 19746 1842 1 19 . 1 1 56 56 ASN HA H 56 4.687 4.687 4.576 0.111 19746 1843 1 19 . 1 1 56 56 ASN H H 56 8.751 8.751 8.526 0.225 19746 1844 1 20 . 1 1 2 2 LYS HA H 2 5.347 5.347 4.669 0.678 19746 1845 1 20 . 1 1 2 2 LYS H H 2 8.293 8.293 7.584 0.709 19746 1846 1 20 . 1 1 3 3 CYS HA H 3 4.901 4.901 4.662 0.239 19746 1847 1 20 . 1 1 3 3 CYS H H 3 8.348 8.348 8.714 -0.366 19746 1848 1 20 . 1 1 4 4 TYR HA H 4 4.541 4.541 4.859 -0.318 19746 1849 1 20 . 1 1 4 4 TYR H H 4 9.500 9.500 8.559 0.941 19746 1850 1 20 . 1 1 5 5 GLN HA H 5 4.328 4.328 4.177 0.151 19746 1851 1 20 . 1 1 5 5 GLN H H 5 9.293 9.293 8.057 1.236 19746 1852 1 20 . 1 1 6 6 HIS HA H 6 4.432 4.432 4.749 -0.317 19746 1853 1 20 . 1 1 6 6 HIS H H 6 8.622 8.622 7.643 0.979 19746 1854 1 20 . 1 1 7 7 GLY H H 7 8.394 8.394 8.798 -0.404 19746 1855 1 20 . 1 1 8 8 LYS HA H 8 4.746 4.746 4.772 -0.026 19746 1856 1 20 . 1 1 8 8 LYS H H 8 7.667 7.667 7.802 -0.135 19746 1857 1 20 . 1 1 9 9 VAL HA H 9 3.808 3.808 3.507 0.301 19746 1858 1 20 . 1 1 9 9 VAL H H 9 8.452 8.452 8.398 0.054 19746 1859 1 20 . 1 1 10 10 VAL HA H 10 4.578 4.578 4.649 -0.071 19746 1860 1 20 . 1 1 10 10 VAL H H 10 8.907 8.907 9.022 -0.115 19746 1861 1 20 . 1 1 11 11 THR HA H 11 4.395 4.395 4.545 -0.150 19746 1862 1 20 . 1 1 11 11 THR H H 11 8.441 8.441 8.327 0.114 19746 1863 1 20 . 1 1 12 12 CYS HA H 12 4.635 4.635 4.310 0.325 19746 1864 1 20 . 1 1 12 12 CYS H H 12 8.864 8.864 8.520 0.344 19746 1865 1 20 . 1 1 13 13 HIS HA H 13 3.989 3.989 4.486 -0.497 19746 1866 1 20 . 1 1 13 13 HIS H H 13 9.706 9.706 8.401 1.305 19746 1867 1 20 . 1 1 14 14 ARG HA H 14 4.384 4.384 3.962 0.422 19746 1868 1 20 . 1 1 14 14 ARG H H 14 8.791 8.791 8.158 0.633 19746 1869 1 20 . 1 1 15 15 ASP HA H 15 4.544 4.544 4.371 0.173 19746 1870 1 20 . 1 1 15 15 ASP H H 15 7.956 7.956 8.117 -0.161 19746 1871 1 20 . 1 1 16 16 MET HA H 16 4.348 4.348 4.272 0.076 19746 1872 1 20 . 1 1 16 16 MET H H 16 8.064 8.064 7.975 0.089 19746 1873 1 20 . 1 1 17 17 LYS HA H 17 4.249 4.249 4.329 -0.080 19746 1874 1 20 . 1 1 17 17 LYS H H 17 7.659 7.659 7.965 -0.306 19746 1875 1 20 . 1 1 18 18 PHE HA H 18 5.046 5.046 5.087 -0.041 19746 1876 1 20 . 1 1 18 18 PHE H H 18 8.218 8.218 7.458 0.760 19746 1877 1 20 . 1 1 19 19 CYS HA H 19 5.956 5.956 4.981 0.975 19746 1878 1 20 . 1 1 19 19 CYS H H 19 9.289 9.289 8.831 0.458 19746 1879 1 20 . 1 1 20 20 TYR HA H 20 6.157 6.157 5.514 0.643 19746 1880 1 20 . 1 1 20 20 TYR H H 20 8.847 8.847 9.333 -0.486 19746 1881 1 20 . 1 1 21 21 HIS HA H 21 5.154 5.154 4.888 0.266 19746 1882 1 20 . 1 1 21 21 HIS H H 21 8.688 8.688 8.567 0.121 19746 1883 1 20 . 1 1 22 22 ASN HA H 22 5.767 5.767 5.444 0.323 19746 1884 1 20 . 1 1 22 22 ASN H H 22 9.679 9.679 8.926 0.753 19746 1885 1 20 . 1 1 23 23 THR HA H 23 4.536 4.536 4.727 -0.191 19746 1886 1 20 . 1 1 23 23 THR H H 23 8.501 8.501 8.802 -0.301 19746 1887 1 20 . 1 1 24 24 GLY H H 24 8.549 8.549 8.710 -0.161 19746 1888 1 20 . 1 1 25 25 MET HA H 25 4.791 4.791 4.349 0.442 19746 1889 1 20 . 1 1 25 25 MET H H 25 8.306 8.306 8.353 -0.047 19746 1890 1 20 . 1 1 30 30 LEU HA H 30 4.376 4.376 4.615 -0.239 19746 1891 1 20 . 1 1 30 30 LEU H H 30 7.637 7.637 7.598 0.039 19746 1892 1 20 . 1 1 31 31 LYS HA H 31 4.244 4.244 4.075 0.169 19746 1893 1 20 . 1 1 31 31 LYS H H 31 8.000 8.000 8.320 -0.320 19746 1894 1 20 . 1 1 32 32 LEU HA H 32 4.431 4.431 4.099 0.332 19746 1895 1 20 . 1 1 32 32 LEU H H 32 7.945 7.945 7.879 0.066 19746 1896 1 20 . 1 1 33 33 ILE HA H 33 4.396 4.396 4.274 0.122 19746 1897 1 20 . 1 1 33 33 ILE H H 33 8.204 8.204 8.100 0.104 19746 1898 1 20 . 1 1 34 34 LEU HA H 34 4.750 4.750 4.538 0.212 19746 1899 1 20 . 1 1 34 34 LEU H H 34 9.084 9.084 7.871 1.213 19746 1900 1 20 . 1 1 35 35 GLN HA H 35 4.524 4.524 4.077 0.447 19746 1901 1 20 . 1 1 35 35 GLN H H 35 8.010 8.010 7.316 0.694 19746 1902 1 20 . 1 1 36 36 GLY H H 36 6.153 6.153 7.218 -1.065 19746 1903 1 20 . 1 1 37 37 CYS HA H 37 5.810 5.810 5.586 0.224 19746 1904 1 20 . 1 1 37 37 CYS H H 37 8.431 8.431 8.548 -0.117 19746 1905 1 20 . 1 1 38 38 SER HA H 38 4.932 4.932 4.835 0.097 19746 1906 1 20 . 1 1 38 38 SER H H 38 9.681 9.681 9.038 0.643 19746 1907 1 20 . 1 1 39 39 SER HA H 39 4.673 4.673 4.407 0.266 19746 1908 1 20 . 1 1 39 39 SER H H 39 9.087 9.087 8.769 0.318 19746 1909 1 20 . 1 1 41 41 CYS HA H 41 4.265 4.265 4.379 -0.114 19746 1910 1 20 . 1 1 41 41 CYS H H 41 7.898 7.898 8.694 -0.796 19746 1911 1 20 . 1 1 42 42 SER HA H 42 4.580 4.580 4.481 0.099 19746 1912 1 20 . 1 1 42 42 SER H H 42 8.385 8.385 8.454 -0.069 19746 1913 1 20 . 1 1 43 43 GLU HA H 43 4.615 4.615 4.110 0.505 19746 1914 1 20 . 1 1 43 43 GLU H H 43 8.790 8.790 8.574 0.216 19746 1915 1 20 . 1 1 44 44 THR HA H 44 4.721 4.721 4.656 0.065 19746 1916 1 20 . 1 1 44 44 THR H H 44 8.954 8.954 8.626 0.328 19746 1917 1 20 . 1 1 45 45 GLU HA H 45 4.056 4.056 4.222 -0.166 19746 1918 1 20 . 1 1 45 45 GLU H H 45 8.903 8.903 8.677 0.226 19746 1919 1 20 . 1 1 46 46 ASN HA H 46 4.847 4.847 4.672 0.175 19746 1920 1 20 . 1 1 46 46 ASN H H 46 7.957 7.957 8.076 -0.119 19746 1921 1 20 . 1 1 47 47 ASN HA H 47 5.360 5.360 5.563 -0.203 19746 1922 1 20 . 1 1 47 47 ASN H H 47 7.729 7.729 7.858 -0.129 19746 1923 1 20 . 1 1 48 48 LYS HA H 48 4.782 4.782 4.760 0.022 19746 1924 1 20 . 1 1 48 48 LYS H H 48 8.600 8.600 8.752 -0.152 19746 1925 1 20 . 1 1 49 49 CYS HA H 49 5.517 5.517 5.836 -0.319 19746 1926 1 20 . 1 1 49 49 CYS H H 49 9.048 9.048 8.489 0.559 19746 1927 1 20 . 1 1 50 50 CYS HA H 50 5.216 5.216 4.946 0.270 19746 1928 1 20 . 1 1 50 50 CYS H H 50 9.342 9.342 9.446 -0.104 19746 1929 1 20 . 1 1 51 51 SER HA H 51 4.948 4.948 4.893 0.055 19746 1930 1 20 . 1 1 51 51 SER H H 51 9.182 9.182 8.674 0.508 19746 1931 1 20 . 1 1 52 52 THR HA H 52 4.639 4.639 4.610 0.029 19746 1932 1 20 . 1 1 52 52 THR H H 52 7.570 7.570 7.532 0.038 19746 1933 1 20 . 1 1 53 53 ASP HA H 53 4.608 4.608 4.667 -0.059 19746 1934 1 20 . 1 1 53 53 ASP H H 53 7.844 7.844 8.426 -0.582 19746 1935 1 20 . 1 1 54 54 ARG HA H 54 4.182 4.182 3.916 0.266 19746 1936 1 20 . 1 1 54 54 ARG H H 54 8.146 8.146 8.196 -0.050 19746 1937 1 20 . 1 1 55 55 CYS HA H 55 4.526 4.526 4.630 -0.104 19746 1938 1 20 . 1 1 55 55 CYS H H 55 7.899 7.899 8.026 -0.127 19746 1939 1 20 . 1 1 56 56 ASN HA H 56 4.687 4.687 4.424 0.263 19746 1940 1 20 . 1 1 56 56 ASN H H 56 8.751 8.751 8.888 -0.137 19746 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 19746 2 1 1 "Average Difference" HA 53 0.371 -0.165 0.335 19746 3 1 1 "Average Difference" C 0 0.000 0.000 0.000 19746 4 1 1 "Average Difference" CA 0 0.000 0.000 0.000 19746 5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 19746 6 1 1 "Average Difference" HN 50 0.587 -0.126 0.580 19746 7 1 2 "Average Difference" N 0 0.000 0.000 0.000 19746 8 1 2 "Average Difference" HA 53 0.343 -0.154 0.310 19746 9 1 2 "Average Difference" C 0 0.000 0.000 0.000 19746 10 1 2 "Average Difference" CA 0 0.000 0.000 0.000 19746 11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 19746 12 1 2 "Average Difference" HN 50 0.592 -0.155 0.578 19746 13 1 3 "Average Difference" N 0 0.000 0.000 0.000 19746 14 1 3 "Average Difference" HA 53 0.381 -0.190 0.334 19746 15 1 3 "Average Difference" C 0 0.000 0.000 0.000 19746 16 1 3 "Average Difference" CA 0 0.000 0.000 0.000 19746 17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 19746 18 1 3 "Average Difference" HN 50 0.524 -0.184 0.496 19746 19 1 4 "Average Difference" N 0 0.000 0.000 0.000 19746 20 1 4 "Average Difference" HA 53 0.350 -0.145 0.321 19746 21 1 4 "Average Difference" C 0 0.000 0.000 0.000 19746 22 1 4 "Average Difference" CA 0 0.000 0.000 0.000 19746 23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 19746 24 1 4 "Average Difference" HN 50 0.630 -0.166 0.614 19746 25 1 5 "Average Difference" N 0 0.000 0.000 0.000 19746 26 1 5 "Average Difference" HA 53 0.342 -0.142 0.314 19746 27 1 5 "Average Difference" C 0 0.000 0.000 0.000 19746 28 1 5 "Average Difference" CA 0 0.000 0.000 0.000 19746 29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 19746 30 1 5 "Average Difference" HN 50 0.496 -0.133 0.483 19746 31 1 6 "Average Difference" N 0 0.000 0.000 0.000 19746 32 1 6 "Average Difference" HA 53 0.369 -0.181 0.324 19746 33 1 6 "Average Difference" C 0 0.000 0.000 0.000 19746 34 1 6 "Average Difference" CA 0 0.000 0.000 0.000 19746 35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 19746 36 1 6 "Average Difference" HN 50 0.528 -0.089 0.526 19746 37 1 7 "Average Difference" N 0 0.000 0.000 0.000 19746 38 1 7 "Average Difference" HA 53 0.359 -0.089 0.351 19746 39 1 7 "Average Difference" C 0 0.000 0.000 0.000 19746 40 1 7 "Average Difference" CA 0 0.000 0.000 0.000 19746 41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 19746 42 1 7 "Average Difference" HN 50 0.488 -0.110 0.480 19746 43 1 8 "Average Difference" N 0 0.000 0.000 0.000 19746 44 1 8 "Average Difference" HA 53 0.351 -0.204 0.288 19746 45 1 8 "Average Difference" C 0 0.000 0.000 0.000 19746 46 1 8 "Average Difference" CA 0 0.000 0.000 0.000 19746 47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 19746 48 1 8 "Average Difference" HN 50 0.589 -0.162 0.572 19746 49 1 9 "Average Difference" N 0 0.000 0.000 0.000 19746 50 1 9 "Average Difference" HA 53 0.336 -0.166 0.295 19746 51 1 9 "Average Difference" C 0 0.000 0.000 0.000 19746 52 1 9 "Average Difference" CA 0 0.000 0.000 0.000 19746 53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 19746 54 1 9 "Average Difference" HN 50 0.583 -0.158 0.567 19746 55 1 10 "Average Difference" N 0 0.000 0.000 0.000 19746 56 1 10 "Average Difference" HA 53 0.340 -0.137 0.314 19746 57 1 10 "Average Difference" C 0 0.000 0.000 0.000 19746 58 1 10 "Average Difference" CA 0 0.000 0.000 0.000 19746 59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 19746 60 1 10 "Average Difference" HN 50 0.537 -0.147 0.522 19746 61 1 11 "Average Difference" N 0 0.000 0.000 0.000 19746 62 1 11 "Average Difference" HA 53 0.354 -0.126 0.334 19746 63 1 11 "Average Difference" C 0 0.000 0.000 0.000 19746 64 1 11 "Average Difference" CA 0 0.000 0.000 0.000 19746 65 1 11 "Average Difference" CB 0 0.000 0.000 0.000 19746 66 1 11 "Average Difference" HN 50 0.522 -0.145 0.506 19746 67 1 12 "Average Difference" N 0 0.000 0.000 0.000 19746 68 1 12 "Average Difference" HA 53 0.336 -0.145 0.306 19746 69 1 12 "Average Difference" C 0 0.000 0.000 0.000 19746 70 1 12 "Average Difference" CA 0 0.000 0.000 0.000 19746 71 1 12 "Average Difference" CB 0 0.000 0.000 0.000 19746 72 1 12 "Average Difference" HN 50 0.606 -0.185 0.583 19746 73 1 13 "Average Difference" N 0 0.000 0.000 0.000 19746 74 1 13 "Average Difference" HA 53 0.342 -0.132 0.319 19746 75 1 13 "Average Difference" C 0 0.000 0.000 0.000 19746 76 1 13 "Average Difference" CA 0 0.000 0.000 0.000 19746 77 1 13 "Average Difference" CB 0 0.000 0.000 0.000 19746 78 1 13 "Average Difference" HN 50 0.511 -0.108 0.505 19746 79 1 14 "Average Difference" N 0 0.000 0.000 0.000 19746 80 1 14 "Average Difference" HA 53 0.318 -0.157 0.280 19746 81 1 14 "Average Difference" C 0 0.000 0.000 0.000 19746 82 1 14 "Average Difference" CA 0 0.000 0.000 0.000 19746 83 1 14 "Average Difference" CB 0 0.000 0.000 0.000 19746 84 1 14 "Average Difference" HN 50 0.580 -0.183 0.556 19746 85 1 15 "Average Difference" N 0 0.000 0.000 0.000 19746 86 1 15 "Average Difference" HA 53 0.368 -0.150 0.340 19746 87 1 15 "Average Difference" C 0 0.000 0.000 0.000 19746 88 1 15 "Average Difference" CA 0 0.000 0.000 0.000 19746 89 1 15 "Average Difference" CB 0 0.000 0.000 0.000 19746 90 1 15 "Average Difference" HN 50 0.547 -0.087 0.546 19746 91 1 16 "Average Difference" N 0 0.000 0.000 0.000 19746 92 1 16 "Average Difference" HA 53 0.371 -0.173 0.332 19746 93 1 16 "Average Difference" C 0 0.000 0.000 0.000 19746 94 1 16 "Average Difference" CA 0 0.000 0.000 0.000 19746 95 1 16 "Average Difference" CB 0 0.000 0.000 0.000 19746 96 1 16 "Average Difference" HN 50 0.506 -0.103 0.501 19746 97 1 17 "Average Difference" N 0 0.000 0.000 0.000 19746 98 1 17 "Average Difference" HA 53 0.383 -0.191 0.335 19746 99 1 17 "Average Difference" C 0 0.000 0.000 0.000 19746 100 1 17 "Average Difference" CA 0 0.000 0.000 0.000 19746 101 1 17 "Average Difference" CB 0 0.000 0.000 0.000 19746 102 1 17 "Average Difference" HN 50 0.573 -0.151 0.559 19746 103 1 18 "Average Difference" N 0 0.000 0.000 0.000 19746 104 1 18 "Average Difference" HA 53 0.307 -0.110 0.289 19746 105 1 18 "Average Difference" C 0 0.000 0.000 0.000 19746 106 1 18 "Average Difference" CA 0 0.000 0.000 0.000 19746 107 1 18 "Average Difference" CB 0 0.000 0.000 0.000 19746 108 1 18 "Average Difference" HN 50 0.578 -0.084 0.577 19746 109 1 19 "Average Difference" N 0 0.000 0.000 0.000 19746 110 1 19 "Average Difference" HA 53 0.336 -0.156 0.300 19746 111 1 19 "Average Difference" C 0 0.000 0.000 0.000 19746 112 1 19 "Average Difference" CA 0 0.000 0.000 0.000 19746 113 1 19 "Average Difference" CB 0 0.000 0.000 0.000 19746 114 1 19 "Average Difference" HN 50 0.594 -0.169 0.576 19746 115 1 20 "Average Difference" N 0 0.000 0.000 0.000 19746 116 1 20 "Average Difference" HA 53 0.315 -0.109 0.299 19746 117 1 20 "Average Difference" C 0 0.000 0.000 0.000 19746 118 1 20 "Average Difference" CA 0 0.000 0.000 0.000 19746 119 1 20 "Average Difference" CB 0 0.000 0.000 0.000 19746 120 1 20 "Average Difference" HN 50 0.527 -0.144 0.512 19746 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 19746 _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 LYS HA H 2 5.347 5.347 4.769 0.578 19746 2 1 . 1 1 2 2 LYS H H 2 8.293 8.293 7.678 0.615 19746 3 1 . 1 1 3 3 CYS HA H 3 4.901 4.901 4.625 0.276 19746 4 1 . 1 1 3 3 CYS H H 3 8.348 8.348 8.633 -0.285 19746 5 1 . 1 1 4 4 TYR HA H 4 4.541 4.541 4.787 -0.246 19746 6 1 . 1 1 4 4 TYR H H 4 9.500 9.500 8.592 0.908 19746 7 1 . 1 1 5 5 GLN HA H 5 4.328 4.328 4.297 0.031 19746 8 1 . 1 1 5 5 GLN H H 5 9.293 9.293 8.063 1.230 19746 9 1 . 1 1 6 6 HIS HA H 6 4.432 4.432 4.747 -0.315 19746 10 1 . 1 1 6 6 HIS H H 6 8.622 8.622 7.865 0.757 19746 11 1 . 1 1 7 7 GLY H H 7 8.394 8.394 8.642 -0.248 19746 12 1 . 1 1 8 8 LYS HA H 8 4.746 4.746 4.797 -0.051 19746 13 1 . 1 1 8 8 LYS H H 8 7.667 7.667 7.827 -0.160 19746 14 1 . 1 1 9 9 VAL HA H 9 3.808 3.808 3.616 0.192 19746 15 1 . 1 1 9 9 VAL H H 9 8.452 8.452 8.367 0.085 19746 16 1 . 1 1 10 10 VAL HA H 10 4.578 4.578 4.550 0.028 19746 17 1 . 1 1 10 10 VAL H H 10 8.907 8.907 8.696 0.211 19746 18 1 . 1 1 11 11 THR HA H 11 4.395 4.395 4.468 -0.072 19746 19 1 . 1 1 11 11 THR H H 11 8.441 8.441 8.295 0.146 19746 20 1 . 1 1 12 12 CYS HA H 12 4.635 4.635 4.231 0.404 19746 21 1 . 1 1 12 12 CYS H H 12 8.864 8.864 8.386 0.478 19746 22 1 . 1 1 13 13 HIS HA H 13 3.989 3.989 4.488 -0.499 19746 23 1 . 1 1 13 13 HIS H H 13 9.706 9.706 8.382 1.324 19746 24 1 . 1 1 14 14 ARG HA H 14 4.384 4.384 4.046 0.338 19746 25 1 . 1 1 14 14 ARG H H 14 8.791 8.791 8.533 0.258 19746 26 1 . 1 1 15 15 ASP HA H 15 4.544 4.544 4.525 0.019 19746 27 1 . 1 1 15 15 ASP H H 15 7.956 7.956 8.207 -0.251 19746 28 1 . 1 1 16 16 MET HA H 16 4.348 4.348 4.415 -0.067 19746 29 1 . 1 1 16 16 MET H H 16 8.064 8.064 8.047 0.017 19746 30 1 . 1 1 17 17 LYS HA H 17 4.249 4.249 4.350 -0.101 19746 31 1 . 1 1 17 17 LYS H H 17 7.659 7.659 8.394 -0.735 19746 32 1 . 1 1 18 18 PHE HA H 18 5.046 5.046 4.954 0.092 19746 33 1 . 1 1 18 18 PHE H H 18 8.218 8.218 7.736 0.482 19746 34 1 . 1 1 19 19 CYS HA H 19 5.956 5.956 5.002 0.954 19746 35 1 . 1 1 19 19 CYS H H 19 9.289 9.289 9.072 0.217 19746 36 1 . 1 1 20 20 TYR HA H 20 6.157 6.157 5.343 0.814 19746 37 1 . 1 1 20 20 TYR H H 20 8.847 8.847 9.067 -0.220 19746 38 1 . 1 1 21 21 HIS HA H 21 5.154 5.154 4.842 0.312 19746 39 1 . 1 1 21 21 HIS H H 21 8.688 8.688 8.563 0.125 19746 40 1 . 1 1 22 22 ASN HA H 22 5.767 5.767 5.108 0.659 19746 41 1 . 1 1 22 22 ASN H H 22 9.679 9.679 8.536 1.143 19746 42 1 . 1 1 23 23 THR HA H 23 4.536 4.536 4.619 -0.083 19746 43 1 . 1 1 23 23 THR H H 23 8.501 8.501 8.912 -0.411 19746 44 1 . 1 1 24 24 GLY H H 24 8.549 8.549 8.038 0.511 19746 45 1 . 1 1 25 25 MET HA H 25 4.791 4.791 4.603 0.188 19746 46 1 . 1 1 25 25 MET H H 25 8.306 8.306 8.255 0.051 19746 47 1 . 1 1 30 30 LEU HA H 30 4.376 4.376 4.372 0.004 19746 48 1 . 1 1 30 30 LEU H H 30 7.637 7.637 7.954 -0.317 19746 49 1 . 1 1 31 31 LYS HA H 31 4.244 4.244 4.323 -0.079 19746 50 1 . 1 1 31 31 LYS H H 31 8.000 8.000 8.391 -0.391 19746 51 1 . 1 1 32 32 LEU HA H 32 4.431 4.431 4.324 0.107 19746 52 1 . 1 1 32 32 LEU H H 32 7.945 7.945 7.909 0.036 19746 53 1 . 1 1 33 33 ILE HA H 33 4.396 4.396 4.150 0.246 19746 54 1 . 1 1 33 33 ILE H H 33 8.204 8.204 8.149 0.055 19746 55 1 . 1 1 34 34 LEU HA H 34 4.750 4.750 4.643 0.107 19746 56 1 . 1 1 34 34 LEU H H 34 9.084 9.084 8.550 0.534 19746 57 1 . 1 1 35 35 GLN HA H 35 4.524 4.524 4.481 0.043 19746 58 1 . 1 1 35 35 GLN H H 35 8.010 8.010 7.797 0.213 19746 59 1 . 1 1 36 36 GLY H H 36 6.153 6.153 7.216 -1.063 19746 60 1 . 1 1 37 37 CYS HA H 37 5.810 5.810 5.502 0.308 19746 61 1 . 1 1 37 37 CYS H H 37 8.431 8.431 8.562 -0.132 19746 62 1 . 1 1 38 38 SER HA H 38 4.932 4.932 4.808 0.124 19746 63 1 . 1 1 38 38 SER H H 38 9.681 9.681 9.039 0.642 19746 64 1 . 1 1 39 39 SER HA H 39 4.673 4.673 4.681 -0.008 19746 65 1 . 1 1 39 39 SER H H 39 9.087 9.087 8.777 0.309 19746 66 1 . 1 1 41 41 CYS HA H 41 4.265 4.265 4.327 -0.062 19746 67 1 . 1 1 41 41 CYS H H 41 7.898 7.898 8.204 -0.306 19746 68 1 . 1 1 42 42 SER HA H 42 4.580 4.580 4.468 0.112 19746 69 1 . 1 1 42 42 SER H H 42 8.385 8.385 8.530 -0.145 19746 70 1 . 1 1 43 43 GLU HA H 43 4.615 4.615 4.098 0.517 19746 71 1 . 1 1 43 43 GLU H H 43 8.790 8.790 8.320 0.470 19746 72 1 . 1 1 44 44 THR HA H 44 4.721 4.721 4.554 0.167 19746 73 1 . 1 1 44 44 THR H H 44 8.954 8.954 8.550 0.404 19746 74 1 . 1 1 45 45 GLU HA H 45 4.056 4.056 4.061 -0.005 19746 75 1 . 1 1 45 45 GLU H H 45 8.903 8.903 8.773 0.130 19746 76 1 . 1 1 46 46 ASN HA H 46 4.847 4.847 4.638 0.209 19746 77 1 . 1 1 46 46 ASN H H 46 7.957 7.957 8.171 -0.214 19746 78 1 . 1 1 47 47 ASN HA H 47 5.360 5.360 5.101 0.259 19746 79 1 . 1 1 47 47 ASN H H 47 7.729 7.729 7.973 -0.244 19746 80 1 . 1 1 48 48 LYS HA H 48 4.782 4.782 4.682 0.100 19746 81 1 . 1 1 48 48 LYS H H 48 8.600 8.600 7.974 0.626 19746 82 1 . 1 1 49 49 CYS HA H 49 5.517 5.517 5.414 0.103 19746 83 1 . 1 1 49 49 CYS H H 49 9.048 9.048 8.487 0.561 19746 84 1 . 1 1 50 50 CYS HA H 50 5.216 5.216 4.912 0.304 19746 85 1 . 1 1 50 50 CYS H H 50 9.342 9.342 9.426 -0.084 19746 86 1 . 1 1 51 51 SER HA H 51 4.948 4.948 4.725 0.223 19746 87 1 . 1 1 51 51 SER H H 51 9.182 9.182 8.785 0.397 19746 88 1 . 1 1 52 52 THR HA H 52 4.639 4.639 4.501 0.138 19746 89 1 . 1 1 52 52 THR H H 52 7.570 7.570 7.656 -0.086 19746 90 1 . 1 1 53 53 ASP HA H 53 4.608 4.608 4.621 -0.013 19746 91 1 . 1 1 53 53 ASP H H 53 7.844 7.844 8.209 -0.365 19746 92 1 . 1 1 54 54 ARG HA H 54 4.182 4.182 3.767 0.415 19746 93 1 . 1 1 54 54 ARG H H 54 8.146 8.146 8.409 -0.263 19746 94 1 . 1 1 55 55 CYS HA H 55 4.526 4.526 4.424 0.102 19746 95 1 . 1 1 55 55 CYS H H 55 7.899 7.899 8.280 -0.380 19746 96 1 . 1 1 56 56 ASN HA H 56 4.687 4.687 4.561 0.127 19746 97 1 . 1 1 56 56 ASN H H 56 8.751 8.751 8.407 0.344 19746 stop_ save_