data_19765 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 19765 _Entry.PDB_ID 2MKB 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 19765 _Entity_delta_chem_shifts.ID 1 loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Conformer_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 1 . 1 1 2 2 ALA HA H 2 4.491 4.491 4.597 -0.106 19765 2 1 1 . 1 1 2 2 ALA H H 2 8.753 8.753 8.617 0.136 19765 3 1 1 . 1 1 3 3 TRP HA H 3 4.704 4.704 4.638 0.066 19765 4 1 1 . 1 1 3 3 TRP H H 3 8.325 8.325 8.828 -0.503 19765 5 1 1 . 1 1 4 4 TYR HA H 4 4.486 4.486 5.167 -0.681 19765 6 1 1 . 1 1 4 4 TYR H H 4 7.159 7.159 7.864 -0.705 19765 7 1 1 . 1 1 5 5 SER HA H 5 4.275 4.275 4.133 0.142 19765 8 1 1 . 1 1 5 5 SER H H 5 7.889 7.889 7.966 -0.077 19765 9 1 1 . 1 1 6 6 HIS HA H 6 4.526 4.526 4.305 0.221 19765 10 1 1 . 1 1 6 6 HIS H H 6 8.380 8.380 8.010 0.370 19765 11 1 1 . 1 1 7 7 TYR HA H 7 4.416 4.416 4.230 0.186 19765 12 1 1 . 1 1 7 7 TYR H H 7 7.851 7.851 7.910 -0.059 19765 13 1 1 . 1 1 8 8 VAL HA H 8 3.897 3.897 3.877 0.020 19765 14 1 1 . 1 1 8 8 VAL H H 8 7.692 7.692 7.644 0.048 19765 15 1 1 . 1 1 9 9 LEU HA H 9 4.277 4.277 4.186 0.091 19765 16 1 1 . 1 1 9 9 LEU H H 9 7.758 7.758 7.379 0.379 19765 17 1 1 . 1 1 10 10 LYS HA H 10 4.029 4.029 3.991 0.038 19765 18 1 1 . 1 1 10 10 LYS H H 10 7.706 7.706 8.496 -0.790 19765 19 1 1 . 1 1 11 11 PHE HA H 11 4.302 4.302 4.183 0.119 19765 20 1 1 . 1 1 11 11 PHE H H 11 7.846 7.846 8.515 -0.669 19765 21 1 1 . 1 1 12 12 PHE HA H 12 4.251 4.251 4.167 0.084 19765 22 1 1 . 1 1 12 12 PHE H H 12 8.361 8.361 8.066 0.295 19765 23 1 1 . 1 1 13 13 LEU HA H 13 4.168 4.168 4.145 0.023 19765 24 1 1 . 1 1 13 13 LEU H H 13 8.496 8.496 8.335 0.161 19765 25 1 1 . 1 1 14 14 LEU HA H 14 4.207 4.207 3.989 0.218 19765 26 1 1 . 1 1 14 14 LEU H H 14 8.054 8.054 7.569 0.485 19765 27 1 1 . 1 1 15 15 VAL HA H 15 3.634 3.634 3.497 0.137 19765 28 1 1 . 1 1 15 15 VAL H H 15 8.012 8.012 7.670 0.342 19765 29 1 1 . 1 1 16 16 PHE HA H 16 4.592 4.592 4.097 0.495 19765 30 1 1 . 1 1 16 16 PHE H H 16 8.478 8.478 8.838 -0.360 19765 31 1 1 . 1 1 17 17 GLY H H 17 8.130 8.130 8.209 -0.079 19765 32 1 1 . 1 1 18 18 GLU HA H 18 4.322 4.322 4.019 0.303 19765 33 1 1 . 1 1 18 18 GLU H H 18 8.322 8.322 7.732 0.590 19765 34 1 1 . 1 1 19 19 ASN HA H 19 4.793 4.793 4.496 0.297 19765 35 1 1 . 1 1 19 19 ASN H H 19 8.131 8.131 7.700 0.431 19765 36 1 1 . 1 1 20 20 GLY H H 20 8.215 8.215 7.482 0.733 19765 37 1 1 . 1 1 21 21 VAL HA H 21 3.923 3.923 3.735 0.188 19765 38 1 1 . 1 1 21 21 VAL H H 21 7.762 7.762 8.352 -0.590 19765 39 1 1 . 1 1 22 22 PHE HA H 22 4.476 4.476 4.530 -0.054 19765 40 1 1 . 1 1 22 22 PHE H H 22 7.814 7.814 8.016 -0.202 19765 41 1 1 . 1 1 23 23 PHE HA H 23 4.499 4.499 4.675 -0.176 19765 42 1 1 . 1 1 23 23 PHE H H 23 7.706 7.706 7.686 0.020 19765 43 1 1 . 1 1 24 24 TYR HA H 24 4.370 4.370 4.634 -0.264 19765 44 1 1 . 1 1 24 24 TYR H H 24 7.647 7.647 8.231 -0.584 19765 45 1 2 . 1 1 2 2 ALA HA H 2 4.491 4.491 4.437 0.054 19765 46 1 2 . 1 1 2 2 ALA H H 2 8.753 8.753 8.179 0.574 19765 47 1 2 . 1 1 3 3 TRP HA H 3 4.704 4.704 4.342 0.362 19765 48 1 2 . 1 1 3 3 TRP H H 3 8.325 8.325 8.427 -0.102 19765 49 1 2 . 1 1 4 4 TYR HA H 4 4.486 4.486 4.063 0.423 19765 50 1 2 . 1 1 4 4 TYR H H 4 7.159 7.159 7.880 -0.721 19765 51 1 2 . 1 1 5 5 SER HA H 5 4.275 4.275 4.346 -0.071 19765 52 1 2 . 1 1 5 5 SER H H 5 7.889 7.889 8.050 -0.161 19765 53 1 2 . 1 1 6 6 HIS HA H 6 4.526 4.526 4.597 -0.071 19765 54 1 2 . 1 1 6 6 HIS H H 6 8.380 8.380 8.272 0.108 19765 55 1 2 . 1 1 7 7 TYR HA H 7 4.416 4.416 4.185 0.231 19765 56 1 2 . 1 1 7 7 TYR H H 7 7.851 7.851 7.609 0.242 19765 57 1 2 . 1 1 8 8 VAL HA H 8 3.897 3.897 3.859 0.038 19765 58 1 2 . 1 1 8 8 VAL H H 8 7.692 7.692 7.940 -0.248 19765 59 1 2 . 1 1 9 9 LEU HA H 9 4.277 4.277 4.144 0.133 19765 60 1 2 . 1 1 9 9 LEU H H 9 7.758 7.758 7.460 0.298 19765 61 1 2 . 1 1 10 10 LYS HA H 10 4.029 4.029 4.112 -0.083 19765 62 1 2 . 1 1 10 10 LYS H H 10 7.706 7.706 7.914 -0.208 19765 63 1 2 . 1 1 11 11 PHE HA H 11 4.302 4.302 4.208 0.094 19765 64 1 2 . 1 1 11 11 PHE H H 11 7.846 7.846 8.289 -0.443 19765 65 1 2 . 1 1 12 12 PHE HA H 12 4.251 4.251 4.177 0.074 19765 66 1 2 . 1 1 12 12 PHE H H 12 8.361 8.361 8.159 0.202 19765 67 1 2 . 1 1 13 13 LEU HA H 13 4.168 4.168 4.171 -0.003 19765 68 1 2 . 1 1 13 13 LEU H H 13 8.496 8.496 7.951 0.545 19765 69 1 2 . 1 1 14 14 LEU HA H 14 4.207 4.207 4.043 0.164 19765 70 1 2 . 1 1 14 14 LEU H H 14 8.054 8.054 8.234 -0.180 19765 71 1 2 . 1 1 15 15 VAL HA H 15 3.634 3.634 3.361 0.273 19765 72 1 2 . 1 1 15 15 VAL H H 15 8.012 8.012 8.207 -0.195 19765 73 1 2 . 1 1 16 16 PHE HA H 16 4.592 4.592 4.093 0.499 19765 74 1 2 . 1 1 16 16 PHE H H 16 8.478 8.478 8.675 -0.197 19765 75 1 2 . 1 1 17 17 GLY H H 17 8.130 8.130 8.311 -0.181 19765 76 1 2 . 1 1 18 18 GLU HA H 18 4.322 4.322 4.143 0.179 19765 77 1 2 . 1 1 18 18 GLU H H 18 8.322 8.322 7.812 0.510 19765 78 1 2 . 1 1 19 19 ASN HA H 19 4.793 4.793 4.768 0.025 19765 79 1 2 . 1 1 19 19 ASN H H 19 8.131 8.131 8.014 0.117 19765 80 1 2 . 1 1 20 20 GLY H H 20 8.215 8.215 7.714 0.501 19765 81 1 2 . 1 1 21 21 VAL HA H 21 3.923 3.923 3.967 -0.044 19765 82 1 2 . 1 1 21 21 VAL H H 21 7.762 7.762 8.606 -0.844 19765 83 1 2 . 1 1 22 22 PHE HA H 22 4.476 4.476 4.509 -0.033 19765 84 1 2 . 1 1 22 22 PHE H H 22 7.814 7.814 8.307 -0.493 19765 85 1 2 . 1 1 23 23 PHE HA H 23 4.499 4.499 4.722 -0.223 19765 86 1 2 . 1 1 23 23 PHE H H 23 7.706 7.706 7.733 -0.027 19765 87 1 2 . 1 1 24 24 TYR HA H 24 4.370 4.370 4.714 -0.344 19765 88 1 2 . 1 1 24 24 TYR H H 24 7.647 7.647 8.278 -0.631 19765 89 1 3 . 1 1 2 2 ALA HA H 2 4.491 4.491 4.660 -0.169 19765 90 1 3 . 1 1 2 2 ALA H H 2 8.753 8.753 8.494 0.259 19765 91 1 3 . 1 1 3 3 TRP HA H 3 4.704 4.704 4.381 0.323 19765 92 1 3 . 1 1 3 3 TRP H H 3 8.325 8.325 8.394 -0.069 19765 93 1 3 . 1 1 4 4 TYR HA H 4 4.486 4.486 5.182 -0.696 19765 94 1 3 . 1 1 4 4 TYR H H 4 7.159 7.159 7.947 -0.788 19765 95 1 3 . 1 1 5 5 SER HA H 5 4.275 4.275 3.823 0.452 19765 96 1 3 . 1 1 5 5 SER H H 5 7.889 7.889 8.363 -0.474 19765 97 1 3 . 1 1 6 6 HIS HA H 6 4.526 4.526 4.374 0.152 19765 98 1 3 . 1 1 6 6 HIS H H 6 8.380 8.380 8.469 -0.089 19765 99 1 3 . 1 1 7 7 TYR HA H 7 4.416 4.416 4.261 0.155 19765 100 1 3 . 1 1 7 7 TYR H H 7 7.851 7.851 7.729 0.122 19765 101 1 3 . 1 1 8 8 VAL HA H 8 3.897 3.897 3.855 0.042 19765 102 1 3 . 1 1 8 8 VAL H H 8 7.692 7.692 7.728 -0.036 19765 103 1 3 . 1 1 9 9 LEU HA H 9 4.277 4.277 4.145 0.132 19765 104 1 3 . 1 1 9 9 LEU H H 9 7.758 7.758 7.435 0.323 19765 105 1 3 . 1 1 10 10 LYS HA H 10 4.029 4.029 3.918 0.111 19765 106 1 3 . 1 1 10 10 LYS H H 10 7.706 7.706 8.134 -0.428 19765 107 1 3 . 1 1 11 11 PHE HA H 11 4.302 4.302 4.202 0.100 19765 108 1 3 . 1 1 11 11 PHE H H 11 7.846 7.846 8.519 -0.673 19765 109 1 3 . 1 1 12 12 PHE HA H 12 4.251 4.251 4.159 0.092 19765 110 1 3 . 1 1 12 12 PHE H H 12 8.361 8.361 8.239 0.122 19765 111 1 3 . 1 1 13 13 LEU HA H 13 4.168 4.168 4.013 0.155 19765 112 1 3 . 1 1 13 13 LEU H H 13 8.496 8.496 8.356 0.140 19765 113 1 3 . 1 1 14 14 LEU HA H 14 4.207 4.207 4.016 0.191 19765 114 1 3 . 1 1 14 14 LEU H H 14 8.054 8.054 7.462 0.592 19765 115 1 3 . 1 1 15 15 VAL HA H 15 3.634 3.634 3.748 -0.114 19765 116 1 3 . 1 1 15 15 VAL H H 15 8.012 8.012 7.125 0.887 19765 117 1 3 . 1 1 16 16 PHE HA H 16 4.592 4.592 4.044 0.548 19765 118 1 3 . 1 1 16 16 PHE H H 16 8.478 8.478 8.407 0.071 19765 119 1 3 . 1 1 17 17 GLY H H 17 8.130 8.130 7.621 0.509 19765 120 1 3 . 1 1 18 18 GLU HA H 18 4.322 4.322 4.037 0.285 19765 121 1 3 . 1 1 18 18 GLU H H 18 8.322 8.322 7.705 0.617 19765 122 1 3 . 1 1 19 19 ASN HA H 19 4.793 4.793 4.436 0.357 19765 123 1 3 . 1 1 19 19 ASN H H 19 8.131 8.131 7.667 0.464 19765 124 1 3 . 1 1 20 20 GLY H H 20 8.215 8.215 7.837 0.378 19765 125 1 3 . 1 1 21 21 VAL HA H 21 3.923 3.923 3.904 0.019 19765 126 1 3 . 1 1 21 21 VAL H H 21 7.762 7.762 8.642 -0.880 19765 127 1 3 . 1 1 22 22 PHE HA H 22 4.476 4.476 4.411 0.065 19765 128 1 3 . 1 1 22 22 PHE H H 22 7.814 7.814 8.729 -0.915 19765 129 1 3 . 1 1 23 23 PHE HA H 23 4.499 4.499 4.555 -0.056 19765 130 1 3 . 1 1 23 23 PHE H H 23 7.706 7.706 7.851 -0.145 19765 131 1 3 . 1 1 24 24 TYR HA H 24 4.370 4.370 4.658 -0.288 19765 132 1 3 . 1 1 24 24 TYR H H 24 7.647 7.647 7.504 0.143 19765 133 1 4 . 1 1 2 2 ALA HA H 2 4.491 4.491 4.171 0.320 19765 134 1 4 . 1 1 2 2 ALA H H 2 8.753 8.753 8.986 -0.233 19765 135 1 4 . 1 1 3 3 TRP HA H 3 4.704 4.704 4.448 0.256 19765 136 1 4 . 1 1 3 3 TRP H H 3 8.325 8.325 8.451 -0.126 19765 137 1 4 . 1 1 4 4 TYR HA H 4 4.486 4.486 4.887 -0.401 19765 138 1 4 . 1 1 4 4 TYR H H 4 7.159 7.159 8.103 -0.944 19765 139 1 4 . 1 1 5 5 SER HA H 5 4.275 4.275 4.658 -0.383 19765 140 1 4 . 1 1 5 5 SER H H 5 7.889 7.889 8.281 -0.392 19765 141 1 4 . 1 1 6 6 HIS HA H 6 4.526 4.526 4.424 0.102 19765 142 1 4 . 1 1 6 6 HIS H H 6 8.380 8.380 8.127 0.253 19765 143 1 4 . 1 1 7 7 TYR HA H 7 4.416 4.416 4.070 0.346 19765 144 1 4 . 1 1 7 7 TYR H H 7 7.851 7.851 7.957 -0.106 19765 145 1 4 . 1 1 8 8 VAL HA H 8 3.897 3.897 4.009 -0.112 19765 146 1 4 . 1 1 8 8 VAL H H 8 7.692 7.692 8.012 -0.320 19765 147 1 4 . 1 1 9 9 LEU HA H 9 4.277 4.277 4.049 0.228 19765 148 1 4 . 1 1 9 9 LEU H H 9 7.758 7.758 7.327 0.431 19765 149 1 4 . 1 1 10 10 LYS HA H 10 4.029 4.029 3.907 0.122 19765 150 1 4 . 1 1 10 10 LYS H H 10 7.706 7.706 8.235 -0.529 19765 151 1 4 . 1 1 11 11 PHE HA H 11 4.302 4.302 4.208 0.094 19765 152 1 4 . 1 1 11 11 PHE H H 11 7.846 7.846 8.610 -0.764 19765 153 1 4 . 1 1 12 12 PHE HA H 12 4.251 4.251 4.011 0.240 19765 154 1 4 . 1 1 12 12 PHE H H 12 8.361 8.361 7.924 0.437 19765 155 1 4 . 1 1 13 13 LEU HA H 13 4.168 4.168 4.079 0.089 19765 156 1 4 . 1 1 13 13 LEU H H 13 8.496 8.496 7.777 0.720 19765 157 1 4 . 1 1 14 14 LEU HA H 14 4.207 4.207 3.942 0.265 19765 158 1 4 . 1 1 14 14 LEU H H 14 8.054 8.054 7.707 0.347 19765 159 1 4 . 1 1 15 15 VAL HA H 15 3.634 3.634 3.397 0.237 19765 160 1 4 . 1 1 15 15 VAL H H 15 8.012 8.012 7.654 0.358 19765 161 1 4 . 1 1 16 16 PHE HA H 16 4.592 4.592 4.161 0.431 19765 162 1 4 . 1 1 16 16 PHE H H 16 8.478 8.478 8.655 -0.177 19765 163 1 4 . 1 1 17 17 GLY H H 17 8.130 8.130 8.316 -0.186 19765 164 1 4 . 1 1 18 18 GLU HA H 18 4.322 4.322 4.043 0.279 19765 165 1 4 . 1 1 18 18 GLU H H 18 8.322 8.322 8.037 0.285 19765 166 1 4 . 1 1 19 19 ASN HA H 19 4.793 4.793 4.929 -0.136 19765 167 1 4 . 1 1 19 19 ASN H H 19 8.131 8.131 7.744 0.387 19765 168 1 4 . 1 1 20 20 GLY H H 20 8.215 8.215 7.648 0.567 19765 169 1 4 . 1 1 21 21 VAL HA H 21 3.923 3.923 4.015 -0.092 19765 170 1 4 . 1 1 21 21 VAL H H 21 7.762 7.762 8.322 -0.560 19765 171 1 4 . 1 1 22 22 PHE HA H 22 4.476 4.476 4.034 0.442 19765 172 1 4 . 1 1 22 22 PHE H H 22 7.814 7.814 7.574 0.240 19765 173 1 4 . 1 1 23 23 PHE HA H 23 4.499 4.499 4.508 -0.009 19765 174 1 4 . 1 1 23 23 PHE H H 23 7.706 7.706 7.611 0.095 19765 175 1 4 . 1 1 24 24 TYR HA H 24 4.370 4.370 4.100 0.270 19765 176 1 4 . 1 1 24 24 TYR H H 24 7.647 7.647 8.712 -1.065 19765 177 1 5 . 1 1 2 2 ALA HA H 2 4.491 4.491 4.720 -0.229 19765 178 1 5 . 1 1 2 2 ALA H H 2 8.753 8.753 8.821 -0.068 19765 179 1 5 . 1 1 3 3 TRP HA H 3 4.704 4.704 4.800 -0.096 19765 180 1 5 . 1 1 3 3 TRP H H 3 8.325 8.325 8.874 -0.549 19765 181 1 5 . 1 1 4 4 TYR HA H 4 4.486 4.486 4.959 -0.473 19765 182 1 5 . 1 1 4 4 TYR H H 4 7.159 7.159 7.420 -0.261 19765 183 1 5 . 1 1 5 5 SER HA H 5 4.275 4.275 4.437 -0.162 19765 184 1 5 . 1 1 5 5 SER H H 5 7.889 7.889 8.198 -0.309 19765 185 1 5 . 1 1 6 6 HIS HA H 6 4.526 4.526 4.409 0.117 19765 186 1 5 . 1 1 6 6 HIS H H 6 8.380 8.380 8.174 0.206 19765 187 1 5 . 1 1 7 7 TYR HA H 7 4.416 4.416 4.338 0.078 19765 188 1 5 . 1 1 7 7 TYR H H 7 7.851 7.851 8.470 -0.619 19765 189 1 5 . 1 1 8 8 VAL HA H 8 3.897 3.897 3.927 -0.030 19765 190 1 5 . 1 1 8 8 VAL H H 8 7.692 7.692 8.188 -0.496 19765 191 1 5 . 1 1 9 9 LEU HA H 9 4.277 4.277 4.036 0.241 19765 192 1 5 . 1 1 9 9 LEU H H 9 7.758 7.758 7.487 0.271 19765 193 1 5 . 1 1 10 10 LYS HA H 10 4.029 4.029 4.012 0.017 19765 194 1 5 . 1 1 10 10 LYS H H 10 7.706 7.706 8.279 -0.573 19765 195 1 5 . 1 1 11 11 PHE HA H 11 4.302 4.302 4.238 0.064 19765 196 1 5 . 1 1 11 11 PHE H H 11 7.846 7.846 8.131 -0.285 19765 197 1 5 . 1 1 12 12 PHE HA H 12 4.251 4.251 4.043 0.208 19765 198 1 5 . 1 1 12 12 PHE H H 12 8.361 8.361 7.996 0.365 19765 199 1 5 . 1 1 13 13 LEU HA H 13 4.168 4.168 4.081 0.087 19765 200 1 5 . 1 1 13 13 LEU H H 13 8.496 8.496 8.272 0.224 19765 201 1 5 . 1 1 14 14 LEU HA H 14 4.207 4.207 4.095 0.112 19765 202 1 5 . 1 1 14 14 LEU H H 14 8.054 8.054 7.579 0.475 19765 203 1 5 . 1 1 15 15 VAL HA H 15 3.634 3.634 3.764 -0.130 19765 204 1 5 . 1 1 15 15 VAL H H 15 8.012 8.012 7.619 0.393 19765 205 1 5 . 1 1 16 16 PHE HA H 16 4.592 4.592 4.202 0.390 19765 206 1 5 . 1 1 16 16 PHE H H 16 8.478 8.478 8.340 0.138 19765 207 1 5 . 1 1 17 17 GLY H H 17 8.130 8.130 7.772 0.358 19765 208 1 5 . 1 1 18 18 GLU HA H 18 4.322 4.322 4.070 0.252 19765 209 1 5 . 1 1 18 18 GLU H H 18 8.322 8.322 7.904 0.418 19765 210 1 5 . 1 1 19 19 ASN HA H 19 4.793 4.793 4.262 0.531 19765 211 1 5 . 1 1 19 19 ASN H H 19 8.131 8.131 7.427 0.704 19765 212 1 5 . 1 1 20 20 GLY H H 20 8.215 8.215 7.493 0.722 19765 213 1 5 . 1 1 21 21 VAL HA H 21 3.923 3.923 3.820 0.103 19765 214 1 5 . 1 1 21 21 VAL H H 21 7.762 7.762 8.617 -0.855 19765 215 1 5 . 1 1 22 22 PHE HA H 22 4.476 4.476 4.241 0.235 19765 216 1 5 . 1 1 22 22 PHE H H 22 7.814 7.814 8.051 -0.237 19765 217 1 5 . 1 1 23 23 PHE HA H 23 4.499 4.499 4.173 0.326 19765 218 1 5 . 1 1 23 23 PHE H H 23 7.706 7.706 7.170 0.536 19765 219 1 5 . 1 1 24 24 TYR HA H 24 4.370 4.370 3.970 0.400 19765 220 1 5 . 1 1 24 24 TYR H H 24 7.647 7.647 7.610 0.037 19765 221 1 6 . 1 1 2 2 ALA HA H 2 4.491 4.491 4.738 -0.247 19765 222 1 6 . 1 1 2 2 ALA H H 2 8.753 8.753 7.951 0.802 19765 223 1 6 . 1 1 3 3 TRP HA H 3 4.704 4.704 4.518 0.186 19765 224 1 6 . 1 1 3 3 TRP H H 3 8.325 8.325 9.000 -0.675 19765 225 1 6 . 1 1 4 4 TYR HA H 4 4.486 4.486 5.068 -0.582 19765 226 1 6 . 1 1 4 4 TYR H H 4 7.159 7.159 7.765 -0.606 19765 227 1 6 . 1 1 5 5 SER HA H 5 4.275 4.275 4.348 -0.073 19765 228 1 6 . 1 1 5 5 SER H H 5 7.889 7.889 8.033 -0.144 19765 229 1 6 . 1 1 6 6 HIS HA H 6 4.526 4.526 4.605 -0.079 19765 230 1 6 . 1 1 6 6 HIS H H 6 8.380 8.380 8.103 0.277 19765 231 1 6 . 1 1 7 7 TYR HA H 7 4.416 4.416 4.399 0.017 19765 232 1 6 . 1 1 7 7 TYR H H 7 7.851 7.851 8.390 -0.539 19765 233 1 6 . 1 1 8 8 VAL HA H 8 3.897 3.897 3.946 -0.049 19765 234 1 6 . 1 1 8 8 VAL H H 8 7.692 7.692 8.155 -0.463 19765 235 1 6 . 1 1 9 9 LEU HA H 9 4.277 4.277 4.056 0.221 19765 236 1 6 . 1 1 9 9 LEU H H 9 7.758 7.758 7.744 0.014 19765 237 1 6 . 1 1 10 10 LYS HA H 10 4.029 4.029 4.073 -0.044 19765 238 1 6 . 1 1 10 10 LYS H H 10 7.706 7.706 8.022 -0.316 19765 239 1 6 . 1 1 11 11 PHE HA H 11 4.302 4.302 4.189 0.113 19765 240 1 6 . 1 1 11 11 PHE H H 11 7.846 7.846 8.663 -0.817 19765 241 1 6 . 1 1 12 12 PHE HA H 12 4.251 4.251 4.205 0.046 19765 242 1 6 . 1 1 12 12 PHE H H 12 8.361 8.361 8.131 0.230 19765 243 1 6 . 1 1 13 13 LEU HA H 13 4.168 4.168 4.138 0.030 19765 244 1 6 . 1 1 13 13 LEU H H 13 8.496 8.496 7.932 0.564 19765 245 1 6 . 1 1 14 14 LEU HA H 14 4.207 4.207 4.142 0.065 19765 246 1 6 . 1 1 14 14 LEU H H 14 8.054 8.054 8.135 -0.081 19765 247 1 6 . 1 1 15 15 VAL HA H 15 3.634 3.634 3.718 -0.084 19765 248 1 6 . 1 1 15 15 VAL H H 15 8.012 8.012 7.213 0.799 19765 249 1 6 . 1 1 16 16 PHE HA H 16 4.592 4.592 4.189 0.403 19765 250 1 6 . 1 1 16 16 PHE H H 16 8.478 8.478 8.620 -0.142 19765 251 1 6 . 1 1 17 17 GLY H H 17 8.130 8.130 7.656 0.474 19765 252 1 6 . 1 1 18 18 GLU HA H 18 4.322 4.322 4.225 0.097 19765 253 1 6 . 1 1 18 18 GLU H H 18 8.322 8.322 7.991 0.331 19765 254 1 6 . 1 1 19 19 ASN HA H 19 4.793 4.793 4.550 0.243 19765 255 1 6 . 1 1 19 19 ASN H H 19 8.131 8.131 7.908 0.223 19765 256 1 6 . 1 1 20 20 GLY H H 20 8.215 8.215 7.760 0.455 19765 257 1 6 . 1 1 21 21 VAL HA H 21 3.923 3.923 3.871 0.052 19765 258 1 6 . 1 1 21 21 VAL H H 21 7.762 7.762 8.678 -0.916 19765 259 1 6 . 1 1 22 22 PHE HA H 22 4.476 4.476 4.389 0.087 19765 260 1 6 . 1 1 22 22 PHE H H 22 7.814 7.814 8.646 -0.832 19765 261 1 6 . 1 1 23 23 PHE HA H 23 4.499 4.499 4.663 -0.164 19765 262 1 6 . 1 1 23 23 PHE H H 23 7.706 7.706 7.634 0.072 19765 263 1 6 . 1 1 24 24 TYR HA H 24 4.370 4.370 4.697 -0.327 19765 264 1 6 . 1 1 24 24 TYR H H 24 7.647 7.647 7.531 0.116 19765 265 1 7 . 1 1 2 2 ALA HA H 2 4.491 4.491 4.635 -0.144 19765 266 1 7 . 1 1 2 2 ALA H H 2 8.753 8.753 8.389 0.364 19765 267 1 7 . 1 1 3 3 TRP HA H 3 4.704 4.704 4.976 -0.272 19765 268 1 7 . 1 1 3 3 TRP H H 3 8.325 8.325 8.821 -0.496 19765 269 1 7 . 1 1 4 4 TYR HA H 4 4.486 4.486 5.123 -0.637 19765 270 1 7 . 1 1 4 4 TYR H H 4 7.159 7.159 7.865 -0.707 19765 271 1 7 . 1 1 5 5 SER HA H 5 4.275 4.275 4.509 -0.234 19765 272 1 7 . 1 1 5 5 SER H H 5 7.889 7.889 8.465 -0.576 19765 273 1 7 . 1 1 6 6 HIS HA H 6 4.526 4.526 4.567 -0.041 19765 274 1 7 . 1 1 6 6 HIS H H 6 8.380 8.380 8.563 -0.183 19765 275 1 7 . 1 1 7 7 TYR HA H 7 4.416 4.416 4.410 0.006 19765 276 1 7 . 1 1 7 7 TYR H H 7 7.851 7.851 8.341 -0.490 19765 277 1 7 . 1 1 8 8 VAL HA H 8 3.897 3.897 3.942 -0.045 19765 278 1 7 . 1 1 8 8 VAL H H 8 7.692 7.692 8.137 -0.445 19765 279 1 7 . 1 1 9 9 LEU HA H 9 4.277 4.277 4.080 0.197 19765 280 1 7 . 1 1 9 9 LEU H H 9 7.758 7.758 7.593 0.165 19765 281 1 7 . 1 1 10 10 LYS HA H 10 4.029 4.029 4.070 -0.041 19765 282 1 7 . 1 1 10 10 LYS H H 10 7.706 7.706 8.135 -0.429 19765 283 1 7 . 1 1 11 11 PHE HA H 11 4.302 4.302 4.199 0.103 19765 284 1 7 . 1 1 11 11 PHE H H 11 7.846 7.846 8.827 -0.981 19765 285 1 7 . 1 1 12 12 PHE HA H 12 4.251 4.251 4.194 0.057 19765 286 1 7 . 1 1 12 12 PHE H H 12 8.361 8.361 8.158 0.203 19765 287 1 7 . 1 1 13 13 LEU HA H 13 4.168 4.168 4.165 0.003 19765 288 1 7 . 1 1 13 13 LEU H H 13 8.496 8.496 7.928 0.568 19765 289 1 7 . 1 1 14 14 LEU HA H 14 4.207 4.207 4.009 0.198 19765 290 1 7 . 1 1 14 14 LEU H H 14 8.054 8.054 7.601 0.453 19765 291 1 7 . 1 1 15 15 VAL HA H 15 3.634 3.634 3.370 0.264 19765 292 1 7 . 1 1 15 15 VAL H H 15 8.012 8.012 7.719 0.293 19765 293 1 7 . 1 1 16 16 PHE HA H 16 4.592 4.592 4.143 0.449 19765 294 1 7 . 1 1 16 16 PHE H H 16 8.478 8.478 8.759 -0.281 19765 295 1 7 . 1 1 17 17 GLY H H 17 8.130 8.130 8.283 -0.153 19765 296 1 7 . 1 1 18 18 GLU HA H 18 4.322 4.322 4.144 0.178 19765 297 1 7 . 1 1 18 18 GLU H H 18 8.322 8.322 8.040 0.282 19765 298 1 7 . 1 1 19 19 ASN HA H 19 4.793 4.793 4.658 0.135 19765 299 1 7 . 1 1 19 19 ASN H H 19 8.131 8.131 7.713 0.418 19765 300 1 7 . 1 1 20 20 GLY H H 20 8.215 8.215 7.434 0.781 19765 301 1 7 . 1 1 21 21 VAL HA H 21 3.923 3.923 4.158 -0.235 19765 302 1 7 . 1 1 21 21 VAL H H 21 7.762 7.762 8.225 -0.463 19765 303 1 7 . 1 1 22 22 PHE HA H 22 4.476 4.476 4.520 -0.044 19765 304 1 7 . 1 1 22 22 PHE H H 22 7.814 7.814 7.780 0.034 19765 305 1 7 . 1 1 23 23 PHE HA H 23 4.499 4.499 4.623 -0.124 19765 306 1 7 . 1 1 23 23 PHE H H 23 7.706 7.706 7.511 0.195 19765 307 1 7 . 1 1 24 24 TYR HA H 24 4.370 4.370 4.662 -0.292 19765 308 1 7 . 1 1 24 24 TYR H H 24 7.647 7.647 8.178 -0.531 19765 309 1 8 . 1 1 2 2 ALA HA H 2 4.491 4.491 4.252 0.239 19765 310 1 8 . 1 1 2 2 ALA H H 2 8.753 8.753 8.486 0.267 19765 311 1 8 . 1 1 3 3 TRP HA H 3 4.704 4.704 4.854 -0.150 19765 312 1 8 . 1 1 3 3 TRP H H 3 8.325 8.325 7.767 0.558 19765 313 1 8 . 1 1 4 4 TYR HA H 4 4.486 4.486 5.045 -0.559 19765 314 1 8 . 1 1 4 4 TYR H H 4 7.159 7.159 7.348 -0.189 19765 315 1 8 . 1 1 5 5 SER HA H 5 4.275 4.275 4.052 0.223 19765 316 1 8 . 1 1 5 5 SER H H 5 7.889 7.889 8.303 -0.414 19765 317 1 8 . 1 1 6 6 HIS HA H 6 4.526 4.526 4.398 0.128 19765 318 1 8 . 1 1 6 6 HIS H H 6 8.380 8.380 8.312 0.068 19765 319 1 8 . 1 1 7 7 TYR HA H 7 4.416 4.416 4.230 0.186 19765 320 1 8 . 1 1 7 7 TYR H H 7 7.851 7.851 7.996 -0.145 19765 321 1 8 . 1 1 8 8 VAL HA H 8 3.897 3.897 3.912 -0.015 19765 322 1 8 . 1 1 8 8 VAL H H 8 7.692 7.692 7.646 0.046 19765 323 1 8 . 1 1 9 9 LEU HA H 9 4.277 4.277 4.147 0.130 19765 324 1 8 . 1 1 9 9 LEU H H 9 7.758 7.758 7.483 0.275 19765 325 1 8 . 1 1 10 10 LYS HA H 10 4.029 4.029 3.925 0.104 19765 326 1 8 . 1 1 10 10 LYS H H 10 7.706 7.706 8.116 -0.410 19765 327 1 8 . 1 1 11 11 PHE HA H 11 4.302 4.302 4.148 0.154 19765 328 1 8 . 1 1 11 11 PHE H H 11 7.846 7.846 8.030 -0.184 19765 329 1 8 . 1 1 12 12 PHE HA H 12 4.251 4.251 4.264 -0.013 19765 330 1 8 . 1 1 12 12 PHE H H 12 8.361 8.361 8.125 0.236 19765 331 1 8 . 1 1 13 13 LEU HA H 13 4.168 4.168 4.226 -0.058 19765 332 1 8 . 1 1 13 13 LEU H H 13 8.496 8.496 8.291 0.205 19765 333 1 8 . 1 1 14 14 LEU HA H 14 4.207 4.207 4.070 0.137 19765 334 1 8 . 1 1 14 14 LEU H H 14 8.054 8.054 7.919 0.135 19765 335 1 8 . 1 1 15 15 VAL HA H 15 3.634 3.634 3.833 -0.199 19765 336 1 8 . 1 1 15 15 VAL H H 15 8.012 8.012 8.130 -0.118 19765 337 1 8 . 1 1 16 16 PHE HA H 16 4.592 4.592 4.288 0.304 19765 338 1 8 . 1 1 16 16 PHE H H 16 8.478 8.478 8.180 0.298 19765 339 1 8 . 1 1 17 17 GLY H H 17 8.130 8.130 8.289 -0.159 19765 340 1 8 . 1 1 18 18 GLU HA H 18 4.322 4.322 3.884 0.438 19765 341 1 8 . 1 1 18 18 GLU H H 18 8.322 8.322 7.946 0.376 19765 342 1 8 . 1 1 19 19 ASN HA H 19 4.793 4.793 4.445 0.348 19765 343 1 8 . 1 1 19 19 ASN H H 19 8.131 8.131 7.636 0.495 19765 344 1 8 . 1 1 20 20 GLY H H 20 8.215 8.215 7.770 0.445 19765 345 1 8 . 1 1 21 21 VAL HA H 21 3.923 3.923 3.836 0.087 19765 346 1 8 . 1 1 21 21 VAL H H 21 7.762 7.762 8.055 -0.293 19765 347 1 8 . 1 1 22 22 PHE HA H 22 4.476 4.476 4.198 0.278 19765 348 1 8 . 1 1 22 22 PHE H H 22 7.814 7.814 7.617 0.197 19765 349 1 8 . 1 1 23 23 PHE HA H 23 4.499 4.499 4.117 0.382 19765 350 1 8 . 1 1 23 23 PHE H H 23 7.706 7.706 7.811 -0.105 19765 351 1 8 . 1 1 24 24 TYR HA H 24 4.370 4.370 4.646 -0.276 19765 352 1 8 . 1 1 24 24 TYR H H 24 7.647 7.647 7.758 -0.111 19765 353 1 9 . 1 1 2 2 ALA HA H 2 4.491 4.491 4.333 0.158 19765 354 1 9 . 1 1 2 2 ALA H H 2 8.753 8.753 8.349 0.404 19765 355 1 9 . 1 1 3 3 TRP HA H 3 4.704 4.704 4.782 -0.078 19765 356 1 9 . 1 1 3 3 TRP H H 3 8.325 8.325 8.490 -0.165 19765 357 1 9 . 1 1 4 4 TYR HA H 4 4.486 4.486 4.988 -0.502 19765 358 1 9 . 1 1 4 4 TYR H H 4 7.159 7.159 7.912 -0.753 19765 359 1 9 . 1 1 5 5 SER HA H 5 4.275 4.275 4.586 -0.311 19765 360 1 9 . 1 1 5 5 SER H H 5 7.889 7.889 8.290 -0.401 19765 361 1 9 . 1 1 6 6 HIS HA H 6 4.526 4.526 4.399 0.127 19765 362 1 9 . 1 1 6 6 HIS H H 6 8.380 8.380 8.473 -0.093 19765 363 1 9 . 1 1 7 7 TYR HA H 7 4.416 4.416 4.036 0.380 19765 364 1 9 . 1 1 7 7 TYR H H 7 7.851 7.851 8.268 -0.417 19765 365 1 9 . 1 1 8 8 VAL HA H 8 3.897 3.897 3.870 0.027 19765 366 1 9 . 1 1 8 8 VAL H H 8 7.692 7.692 8.007 -0.315 19765 367 1 9 . 1 1 9 9 LEU HA H 9 4.277 4.277 3.936 0.341 19765 368 1 9 . 1 1 9 9 LEU H H 9 7.758 7.758 7.400 0.358 19765 369 1 9 . 1 1 10 10 LYS HA H 10 4.029 4.029 3.957 0.072 19765 370 1 9 . 1 1 10 10 LYS H H 10 7.706 7.706 8.182 -0.476 19765 371 1 9 . 1 1 11 11 PHE HA H 11 4.302 4.302 4.241 0.061 19765 372 1 9 . 1 1 11 11 PHE H H 11 7.846 7.846 8.133 -0.287 19765 373 1 9 . 1 1 12 12 PHE HA H 12 4.251 4.251 3.874 0.377 19765 374 1 9 . 1 1 12 12 PHE H H 12 8.361 8.361 8.168 0.193 19765 375 1 9 . 1 1 13 13 LEU HA H 13 4.168 4.168 4.076 0.092 19765 376 1 9 . 1 1 13 13 LEU H H 13 8.496 8.496 8.045 0.451 19765 377 1 9 . 1 1 14 14 LEU HA H 14 4.207 4.207 4.059 0.148 19765 378 1 9 . 1 1 14 14 LEU H H 14 8.054 8.054 7.948 0.106 19765 379 1 9 . 1 1 15 15 VAL HA H 15 3.634 3.634 3.495 0.139 19765 380 1 9 . 1 1 15 15 VAL H H 15 8.012 8.012 7.598 0.414 19765 381 1 9 . 1 1 16 16 PHE HA H 16 4.592 4.592 4.170 0.422 19765 382 1 9 . 1 1 16 16 PHE H H 16 8.478 8.478 7.969 0.509 19765 383 1 9 . 1 1 17 17 GLY H H 17 8.130 8.130 8.845 -0.715 19765 384 1 9 . 1 1 18 18 GLU HA H 18 4.322 4.322 4.091 0.231 19765 385 1 9 . 1 1 18 18 GLU H H 18 8.322 8.322 7.998 0.324 19765 386 1 9 . 1 1 19 19 ASN HA H 19 4.793 4.793 4.451 0.342 19765 387 1 9 . 1 1 19 19 ASN H H 19 8.131 8.131 7.736 0.395 19765 388 1 9 . 1 1 20 20 GLY H H 20 8.215 8.215 7.364 0.851 19765 389 1 9 . 1 1 21 21 VAL HA H 21 3.923 3.923 3.779 0.144 19765 390 1 9 . 1 1 21 21 VAL H H 21 7.762 7.762 8.519 -0.757 19765 391 1 9 . 1 1 22 22 PHE HA H 22 4.476 4.476 4.428 0.048 19765 392 1 9 . 1 1 22 22 PHE H H 22 7.814 7.814 8.367 -0.553 19765 393 1 9 . 1 1 23 23 PHE HA H 23 4.499 4.499 4.659 -0.160 19765 394 1 9 . 1 1 23 23 PHE H H 23 7.706 7.706 7.798 -0.092 19765 395 1 9 . 1 1 24 24 TYR HA H 24 4.370 4.370 4.605 -0.235 19765 396 1 9 . 1 1 24 24 TYR H H 24 7.647 7.647 7.908 -0.261 19765 397 1 10 . 1 1 2 2 ALA HA H 2 4.491 4.491 4.495 -0.004 19765 398 1 10 . 1 1 2 2 ALA H H 2 8.753 8.753 8.241 0.512 19765 399 1 10 . 1 1 3 3 TRP HA H 3 4.704 4.704 4.201 0.503 19765 400 1 10 . 1 1 3 3 TRP H H 3 8.325 8.325 8.570 -0.245 19765 401 1 10 . 1 1 4 4 TYR HA H 4 4.486 4.486 4.727 -0.241 19765 402 1 10 . 1 1 4 4 TYR H H 4 7.159 7.159 7.939 -0.780 19765 403 1 10 . 1 1 5 5 SER HA H 5 4.275 4.275 4.355 -0.080 19765 404 1 10 . 1 1 5 5 SER H H 5 7.889 7.889 7.936 -0.047 19765 405 1 10 . 1 1 6 6 HIS HA H 6 4.526 4.526 4.670 -0.144 19765 406 1 10 . 1 1 6 6 HIS H H 6 8.380 8.380 8.287 0.093 19765 407 1 10 . 1 1 7 7 TYR HA H 7 4.416 4.416 4.331 0.085 19765 408 1 10 . 1 1 7 7 TYR H H 7 7.851 7.851 7.913 -0.062 19765 409 1 10 . 1 1 8 8 VAL HA H 8 3.897 3.897 3.938 -0.041 19765 410 1 10 . 1 1 8 8 VAL H H 8 7.692 7.692 8.245 -0.553 19765 411 1 10 . 1 1 9 9 LEU HA H 9 4.277 4.277 4.062 0.215 19765 412 1 10 . 1 1 9 9 LEU H H 9 7.758 7.758 7.671 0.087 19765 413 1 10 . 1 1 10 10 LYS HA H 10 4.029 4.029 3.997 0.032 19765 414 1 10 . 1 1 10 10 LYS H H 10 7.706 7.706 7.818 -0.112 19765 415 1 10 . 1 1 11 11 PHE HA H 11 4.302 4.302 4.215 0.087 19765 416 1 10 . 1 1 11 11 PHE H H 11 7.846 7.846 8.248 -0.402 19765 417 1 10 . 1 1 12 12 PHE HA H 12 4.251 4.251 3.959 0.292 19765 418 1 10 . 1 1 12 12 PHE H H 12 8.361 8.361 8.148 0.213 19765 419 1 10 . 1 1 13 13 LEU HA H 13 4.168 4.168 4.081 0.087 19765 420 1 10 . 1 1 13 13 LEU H H 13 8.496 8.496 8.242 0.254 19765 421 1 10 . 1 1 14 14 LEU HA H 14 4.207 4.207 3.983 0.224 19765 422 1 10 . 1 1 14 14 LEU H H 14 8.054 8.054 8.129 -0.075 19765 423 1 10 . 1 1 15 15 VAL HA H 15 3.634 3.634 3.827 -0.193 19765 424 1 10 . 1 1 15 15 VAL H H 15 8.012 8.012 7.579 0.433 19765 425 1 10 . 1 1 16 16 PHE HA H 16 4.592 4.592 4.138 0.454 19765 426 1 10 . 1 1 16 16 PHE H H 16 8.478 8.478 8.367 0.111 19765 427 1 10 . 1 1 17 17 GLY H H 17 8.130 8.130 8.715 -0.585 19765 428 1 10 . 1 1 18 18 GLU HA H 18 4.322 4.322 3.922 0.400 19765 429 1 10 . 1 1 18 18 GLU H H 18 8.322 8.322 7.745 0.577 19765 430 1 10 . 1 1 19 19 ASN HA H 19 4.793 4.793 4.460 0.333 19765 431 1 10 . 1 1 19 19 ASN H H 19 8.131 8.131 7.803 0.328 19765 432 1 10 . 1 1 20 20 GLY H H 20 8.215 8.215 7.741 0.474 19765 433 1 10 . 1 1 21 21 VAL HA H 21 3.923 3.923 3.911 0.012 19765 434 1 10 . 1 1 21 21 VAL H H 21 7.762 7.762 8.100 -0.338 19765 435 1 10 . 1 1 22 22 PHE HA H 22 4.476 4.476 4.266 0.210 19765 436 1 10 . 1 1 22 22 PHE H H 22 7.814 7.814 7.926 -0.112 19765 437 1 10 . 1 1 23 23 PHE HA H 23 4.499 4.499 4.655 -0.156 19765 438 1 10 . 1 1 23 23 PHE H H 23 7.706 7.706 7.722 -0.016 19765 439 1 10 . 1 1 24 24 TYR HA H 24 4.370 4.370 4.647 -0.277 19765 440 1 10 . 1 1 24 24 TYR H H 24 7.647 7.647 7.457 0.190 19765 441 1 11 . 1 1 2 2 ALA HA H 2 4.491 4.491 3.684 0.807 19765 442 1 11 . 1 1 2 2 ALA H H 2 8.753 8.753 7.827 0.926 19765 443 1 11 . 1 1 3 3 TRP HA H 3 4.704 4.704 4.827 -0.123 19765 444 1 11 . 1 1 3 3 TRP H H 3 8.325 8.325 8.575 -0.250 19765 445 1 11 . 1 1 4 4 TYR HA H 4 4.486 4.486 4.832 -0.346 19765 446 1 11 . 1 1 4 4 TYR H H 4 7.159 7.159 8.175 -1.016 19765 447 1 11 . 1 1 5 5 SER HA H 5 4.275 4.275 4.297 -0.022 19765 448 1 11 . 1 1 5 5 SER H H 5 7.889 7.889 8.072 -0.183 19765 449 1 11 . 1 1 6 6 HIS HA H 6 4.526 4.526 4.601 -0.075 19765 450 1 11 . 1 1 6 6 HIS H H 6 8.380 8.380 7.890 0.490 19765 451 1 11 . 1 1 7 7 TYR HA H 7 4.416 4.416 4.320 0.096 19765 452 1 11 . 1 1 7 7 TYR H H 7 7.851 7.851 8.025 -0.174 19765 453 1 11 . 1 1 8 8 VAL HA H 8 3.897 3.897 3.994 -0.097 19765 454 1 11 . 1 1 8 8 VAL H H 8 7.692 7.692 8.247 -0.555 19765 455 1 11 . 1 1 9 9 LEU HA H 9 4.277 4.277 4.123 0.154 19765 456 1 11 . 1 1 9 9 LEU H H 9 7.758 7.758 7.273 0.485 19765 457 1 11 . 1 1 10 10 LYS HA H 10 4.029 4.029 4.130 -0.101 19765 458 1 11 . 1 1 10 10 LYS H H 10 7.706 7.706 7.794 -0.088 19765 459 1 11 . 1 1 11 11 PHE HA H 11 4.302 4.302 4.217 0.085 19765 460 1 11 . 1 1 11 11 PHE H H 11 7.846 7.846 8.637 -0.791 19765 461 1 11 . 1 1 12 12 PHE HA H 12 4.251 4.251 3.857 0.394 19765 462 1 11 . 1 1 12 12 PHE H H 12 8.361 8.361 8.213 0.148 19765 463 1 11 . 1 1 13 13 LEU HA H 13 4.168 4.168 4.085 0.083 19765 464 1 11 . 1 1 13 13 LEU H H 13 8.496 8.496 7.601 0.895 19765 465 1 11 . 1 1 14 14 LEU HA H 14 4.207 4.207 4.045 0.162 19765 466 1 11 . 1 1 14 14 LEU H H 14 8.054 8.054 7.861 0.193 19765 467 1 11 . 1 1 15 15 VAL HA H 15 3.634 3.634 3.525 0.109 19765 468 1 11 . 1 1 15 15 VAL H H 15 8.012 8.012 7.816 0.196 19765 469 1 11 . 1 1 16 16 PHE HA H 16 4.592 4.592 4.169 0.423 19765 470 1 11 . 1 1 16 16 PHE H H 16 8.478 8.478 8.072 0.406 19765 471 1 11 . 1 1 17 17 GLY H H 17 8.130 8.130 8.302 -0.172 19765 472 1 11 . 1 1 18 18 GLU HA H 18 4.322 4.322 4.097 0.225 19765 473 1 11 . 1 1 18 18 GLU H H 18 8.322 8.322 8.096 0.226 19765 474 1 11 . 1 1 19 19 ASN HA H 19 4.793 4.793 4.465 0.328 19765 475 1 11 . 1 1 19 19 ASN H H 19 8.131 8.131 7.730 0.401 19765 476 1 11 . 1 1 20 20 GLY H H 20 8.215 8.215 7.442 0.773 19765 477 1 11 . 1 1 21 21 VAL HA H 21 3.923 3.923 3.877 0.046 19765 478 1 11 . 1 1 21 21 VAL H H 21 7.762 7.762 8.564 -0.802 19765 479 1 11 . 1 1 22 22 PHE HA H 22 4.476 4.476 4.430 0.046 19765 480 1 11 . 1 1 22 22 PHE H H 22 7.814 7.814 7.870 -0.056 19765 481 1 11 . 1 1 23 23 PHE HA H 23 4.499 4.499 4.747 -0.248 19765 482 1 11 . 1 1 23 23 PHE H H 23 7.706 7.706 8.035 -0.329 19765 483 1 11 . 1 1 24 24 TYR HA H 24 4.370 4.370 4.643 -0.273 19765 484 1 11 . 1 1 24 24 TYR H H 24 7.647 7.647 7.693 -0.046 19765 485 1 12 . 1 1 2 2 ALA HA H 2 4.491 4.491 4.488 0.003 19765 486 1 12 . 1 1 2 2 ALA H H 2 8.753 8.753 8.484 0.269 19765 487 1 12 . 1 1 3 3 TRP HA H 3 4.704 4.704 4.729 -0.025 19765 488 1 12 . 1 1 3 3 TRP H H 3 8.325 8.325 8.881 -0.556 19765 489 1 12 . 1 1 4 4 TYR HA H 4 4.486 4.486 4.816 -0.330 19765 490 1 12 . 1 1 4 4 TYR H H 4 7.159 7.159 7.895 -0.736 19765 491 1 12 . 1 1 5 5 SER HA H 5 4.275 4.275 4.384 -0.109 19765 492 1 12 . 1 1 5 5 SER H H 5 7.889 7.889 8.462 -0.573 19765 493 1 12 . 1 1 6 6 HIS HA H 6 4.526 4.526 4.435 0.091 19765 494 1 12 . 1 1 6 6 HIS H H 6 8.380 8.380 8.404 -0.024 19765 495 1 12 . 1 1 7 7 TYR HA H 7 4.416 4.416 4.196 0.220 19765 496 1 12 . 1 1 7 7 TYR H H 7 7.851 7.851 8.312 -0.461 19765 497 1 12 . 1 1 8 8 VAL HA H 8 3.897 3.897 3.843 0.054 19765 498 1 12 . 1 1 8 8 VAL H H 8 7.692 7.692 7.872 -0.180 19765 499 1 12 . 1 1 9 9 LEU HA H 9 4.277 4.277 4.241 0.036 19765 500 1 12 . 1 1 9 9 LEU H H 9 7.758 7.758 7.401 0.357 19765 501 1 12 . 1 1 10 10 LYS HA H 10 4.029 4.029 4.228 -0.199 19765 502 1 12 . 1 1 10 10 LYS H H 10 7.706 7.706 8.058 -0.352 19765 503 1 12 . 1 1 11 11 PHE HA H 11 4.302 4.302 4.302 0.000 19765 504 1 12 . 1 1 11 11 PHE H H 11 7.846 7.846 8.789 -0.943 19765 505 1 12 . 1 1 12 12 PHE HA H 12 4.251 4.251 4.170 0.081 19765 506 1 12 . 1 1 12 12 PHE H H 12 8.361 8.361 8.117 0.244 19765 507 1 12 . 1 1 13 13 LEU HA H 13 4.168 4.168 3.956 0.212 19765 508 1 12 . 1 1 13 13 LEU H H 13 8.496 8.496 7.790 0.706 19765 509 1 12 . 1 1 14 14 LEU HA H 14 4.207 4.207 3.912 0.295 19765 510 1 12 . 1 1 14 14 LEU H H 14 8.054 8.054 7.306 0.748 19765 511 1 12 . 1 1 15 15 VAL HA H 15 3.634 3.634 3.493 0.141 19765 512 1 12 . 1 1 15 15 VAL H H 15 8.012 8.012 7.842 0.170 19765 513 1 12 . 1 1 16 16 PHE HA H 16 4.592 4.592 3.996 0.596 19765 514 1 12 . 1 1 16 16 PHE H H 16 8.478 8.478 8.651 -0.173 19765 515 1 12 . 1 1 17 17 GLY H H 17 8.130 8.130 8.170 -0.040 19765 516 1 12 . 1 1 18 18 GLU HA H 18 4.322 4.322 4.086 0.236 19765 517 1 12 . 1 1 18 18 GLU H H 18 8.322 8.322 8.022 0.300 19765 518 1 12 . 1 1 19 19 ASN HA H 19 4.793 4.793 4.700 0.093 19765 519 1 12 . 1 1 19 19 ASN H H 19 8.131 8.131 7.862 0.269 19765 520 1 12 . 1 1 20 20 GLY H H 20 8.215 8.215 7.748 0.467 19765 521 1 12 . 1 1 21 21 VAL HA H 21 3.923 3.923 4.020 -0.097 19765 522 1 12 . 1 1 21 21 VAL H H 21 7.762 7.762 8.553 -0.791 19765 523 1 12 . 1 1 22 22 PHE HA H 22 4.476 4.476 4.123 0.353 19765 524 1 12 . 1 1 22 22 PHE H H 22 7.814 7.814 7.919 -0.105 19765 525 1 12 . 1 1 23 23 PHE HA H 23 4.499 4.499 4.623 -0.124 19765 526 1 12 . 1 1 23 23 PHE H H 23 7.706 7.706 7.706 0.000 19765 527 1 12 . 1 1 24 24 TYR HA H 24 4.370 4.370 4.621 -0.251 19765 528 1 12 . 1 1 24 24 TYR H H 24 7.647 7.647 7.582 0.065 19765 529 1 13 . 1 1 2 2 ALA HA H 2 4.491 4.491 4.452 0.039 19765 530 1 13 . 1 1 2 2 ALA H H 2 8.753 8.753 7.791 0.962 19765 531 1 13 . 1 1 3 3 TRP HA H 3 4.704 4.704 4.417 0.287 19765 532 1 13 . 1 1 3 3 TRP H H 3 8.325 8.325 8.565 -0.240 19765 533 1 13 . 1 1 4 4 TYR HA H 4 4.486 4.486 4.479 0.007 19765 534 1 13 . 1 1 4 4 TYR H H 4 7.159 7.159 8.921 -1.762 19765 535 1 13 . 1 1 5 5 SER HA H 5 4.275 4.275 3.562 0.713 19765 536 1 13 . 1 1 5 5 SER H H 5 7.889 7.889 8.435 -0.546 19765 537 1 13 . 1 1 6 6 HIS HA H 6 4.526 4.526 4.564 -0.038 19765 538 1 13 . 1 1 6 6 HIS H H 6 8.380 8.380 7.339 1.041 19765 539 1 13 . 1 1 7 7 TYR HA H 7 4.416 4.416 4.322 0.094 19765 540 1 13 . 1 1 7 7 TYR H H 7 7.851 7.851 8.226 -0.375 19765 541 1 13 . 1 1 8 8 VAL HA H 8 3.897 3.897 3.941 -0.044 19765 542 1 13 . 1 1 8 8 VAL H H 8 7.692 7.692 7.607 0.085 19765 543 1 13 . 1 1 9 9 LEU HA H 9 4.277 4.277 4.127 0.150 19765 544 1 13 . 1 1 9 9 LEU H H 9 7.758 7.758 7.572 0.186 19765 545 1 13 . 1 1 10 10 LYS HA H 10 4.029 4.029 3.984 0.045 19765 546 1 13 . 1 1 10 10 LYS H H 10 7.706 7.706 7.931 -0.225 19765 547 1 13 . 1 1 11 11 PHE HA H 11 4.302 4.302 4.178 0.124 19765 548 1 13 . 1 1 11 11 PHE H H 11 7.846 7.846 7.931 -0.085 19765 549 1 13 . 1 1 12 12 PHE HA H 12 4.251 4.251 4.118 0.133 19765 550 1 13 . 1 1 12 12 PHE H H 12 8.361 8.361 8.138 0.223 19765 551 1 13 . 1 1 13 13 LEU HA H 13 4.168 4.168 4.289 -0.121 19765 552 1 13 . 1 1 13 13 LEU H H 13 8.496 8.496 8.567 -0.071 19765 553 1 13 . 1 1 14 14 LEU HA H 14 4.207 4.207 3.931 0.276 19765 554 1 13 . 1 1 14 14 LEU H H 14 8.054 8.054 7.736 0.318 19765 555 1 13 . 1 1 15 15 VAL HA H 15 3.634 3.634 3.348 0.286 19765 556 1 13 . 1 1 15 15 VAL H H 15 8.012 8.012 7.434 0.578 19765 557 1 13 . 1 1 16 16 PHE HA H 16 4.592 4.592 4.142 0.450 19765 558 1 13 . 1 1 16 16 PHE H H 16 8.478 8.478 8.220 0.258 19765 559 1 13 . 1 1 17 17 GLY H H 17 8.130 8.130 8.154 -0.024 19765 560 1 13 . 1 1 18 18 GLU HA H 18 4.322 4.322 4.183 0.139 19765 561 1 13 . 1 1 18 18 GLU H H 18 8.322 8.322 7.990 0.332 19765 562 1 13 . 1 1 19 19 ASN HA H 19 4.793 4.793 4.762 0.031 19765 563 1 13 . 1 1 19 19 ASN H H 19 8.131 8.131 8.443 -0.312 19765 564 1 13 . 1 1 20 20 GLY H H 20 8.215 8.215 7.976 0.239 19765 565 1 13 . 1 1 21 21 VAL HA H 21 3.923 3.923 4.099 -0.176 19765 566 1 13 . 1 1 21 21 VAL H H 21 7.762 7.762 8.703 -0.941 19765 567 1 13 . 1 1 22 22 PHE HA H 22 4.476 4.476 4.239 0.237 19765 568 1 13 . 1 1 22 22 PHE H H 22 7.814 7.814 7.881 -0.067 19765 569 1 13 . 1 1 23 23 PHE HA H 23 4.499 4.499 4.565 -0.066 19765 570 1 13 . 1 1 23 23 PHE H H 23 7.706 7.706 7.871 -0.165 19765 571 1 13 . 1 1 24 24 TYR HA H 24 4.370 4.370 4.616 -0.246 19765 572 1 13 . 1 1 24 24 TYR H H 24 7.647 7.647 7.582 0.065 19765 573 1 14 . 1 1 2 2 ALA HA H 2 4.491 4.491 4.589 -0.098 19765 574 1 14 . 1 1 2 2 ALA H H 2 8.753 8.753 8.244 0.509 19765 575 1 14 . 1 1 3 3 TRP HA H 3 4.704 4.704 4.702 0.002 19765 576 1 14 . 1 1 3 3 TRP H H 3 8.325 8.325 8.504 -0.179 19765 577 1 14 . 1 1 4 4 TYR HA H 4 4.486 4.486 3.605 0.881 19765 578 1 14 . 1 1 4 4 TYR H H 4 7.159 7.159 8.456 -1.297 19765 579 1 14 . 1 1 5 5 SER HA H 5 4.275 4.275 3.870 0.405 19765 580 1 14 . 1 1 5 5 SER H H 5 7.889 7.889 8.287 -0.398 19765 581 1 14 . 1 1 6 6 HIS HA H 6 4.526 4.526 4.454 0.072 19765 582 1 14 . 1 1 6 6 HIS H H 6 8.380 8.380 8.266 0.114 19765 583 1 14 . 1 1 7 7 TYR HA H 7 4.416 4.416 4.022 0.394 19765 584 1 14 . 1 1 7 7 TYR H H 7 7.851 7.851 8.173 -0.322 19765 585 1 14 . 1 1 8 8 VAL HA H 8 3.897 3.897 3.659 0.238 19765 586 1 14 . 1 1 8 8 VAL H H 8 7.692 7.692 7.159 0.533 19765 587 1 14 . 1 1 9 9 LEU HA H 9 4.277 4.277 3.877 0.400 19765 588 1 14 . 1 1 9 9 LEU H H 9 7.758 7.758 7.242 0.516 19765 589 1 14 . 1 1 10 10 LYS HA H 10 4.029 4.029 3.798 0.231 19765 590 1 14 . 1 1 10 10 LYS H H 10 7.706 7.706 8.009 -0.303 19765 591 1 14 . 1 1 11 11 PHE HA H 11 4.302 4.302 4.213 0.089 19765 592 1 14 . 1 1 11 11 PHE H H 11 7.846 7.846 7.960 -0.114 19765 593 1 14 . 1 1 12 12 PHE HA H 12 4.251 4.251 4.251 -0.000 19765 594 1 14 . 1 1 12 12 PHE H H 12 8.361 8.361 8.219 0.142 19765 595 1 14 . 1 1 13 13 LEU HA H 13 4.168 4.168 4.028 0.140 19765 596 1 14 . 1 1 13 13 LEU H H 13 8.496 8.496 8.514 -0.018 19765 597 1 14 . 1 1 14 14 LEU HA H 14 4.207 4.207 3.918 0.289 19765 598 1 14 . 1 1 14 14 LEU H H 14 8.054 8.054 7.516 0.538 19765 599 1 14 . 1 1 15 15 VAL HA H 15 3.634 3.634 3.532 0.102 19765 600 1 14 . 1 1 15 15 VAL H H 15 8.012 8.012 7.679 0.333 19765 601 1 14 . 1 1 16 16 PHE HA H 16 4.592 4.592 4.097 0.495 19765 602 1 14 . 1 1 16 16 PHE H H 16 8.478 8.478 8.695 -0.217 19765 603 1 14 . 1 1 17 17 GLY H H 17 8.130 8.130 8.249 -0.119 19765 604 1 14 . 1 1 18 18 GLU HA H 18 4.322 4.322 4.031 0.291 19765 605 1 14 . 1 1 18 18 GLU H H 18 8.322 8.322 7.699 0.623 19765 606 1 14 . 1 1 19 19 ASN HA H 19 4.793 4.793 4.516 0.277 19765 607 1 14 . 1 1 19 19 ASN H H 19 8.131 8.131 7.917 0.214 19765 608 1 14 . 1 1 20 20 GLY H H 20 8.215 8.215 8.104 0.111 19765 609 1 14 . 1 1 21 21 VAL HA H 21 3.923 3.923 3.709 0.214 19765 610 1 14 . 1 1 21 21 VAL H H 21 7.762 7.762 8.245 -0.483 19765 611 1 14 . 1 1 22 22 PHE HA H 22 4.476 4.476 4.321 0.155 19765 612 1 14 . 1 1 22 22 PHE H H 22 7.814 7.814 7.720 0.094 19765 613 1 14 . 1 1 23 23 PHE HA H 23 4.499 4.499 4.410 0.089 19765 614 1 14 . 1 1 23 23 PHE H H 23 7.706 7.706 7.769 -0.063 19765 615 1 14 . 1 1 24 24 TYR HA H 24 4.370 4.370 4.574 -0.204 19765 616 1 14 . 1 1 24 24 TYR H H 24 7.647 7.647 7.316 0.331 19765 617 1 15 . 1 1 2 2 ALA HA H 2 4.491 4.491 4.518 -0.027 19765 618 1 15 . 1 1 2 2 ALA H H 2 8.753 8.753 8.478 0.275 19765 619 1 15 . 1 1 3 3 TRP HA H 3 4.704 4.704 4.732 -0.028 19765 620 1 15 . 1 1 3 3 TRP H H 3 8.325 8.325 8.903 -0.578 19765 621 1 15 . 1 1 4 4 TYR HA H 4 4.486 4.486 4.836 -0.350 19765 622 1 15 . 1 1 4 4 TYR H H 4 7.159 7.159 7.691 -0.532 19765 623 1 15 . 1 1 5 5 SER HA H 5 4.275 4.275 4.482 -0.207 19765 624 1 15 . 1 1 5 5 SER H H 5 7.889 7.889 8.088 -0.199 19765 625 1 15 . 1 1 6 6 HIS HA H 6 4.526 4.526 4.592 -0.066 19765 626 1 15 . 1 1 6 6 HIS H H 6 8.380 8.380 7.920 0.460 19765 627 1 15 . 1 1 7 7 TYR HA H 7 4.416 4.416 4.331 0.085 19765 628 1 15 . 1 1 7 7 TYR H H 7 7.851 7.851 8.199 -0.348 19765 629 1 15 . 1 1 8 8 VAL HA H 8 3.897 3.897 3.878 0.019 19765 630 1 15 . 1 1 8 8 VAL H H 8 7.692 7.692 8.182 -0.490 19765 631 1 15 . 1 1 9 9 LEU HA H 9 4.277 4.277 4.108 0.169 19765 632 1 15 . 1 1 9 9 LEU H H 9 7.758 7.758 7.242 0.516 19765 633 1 15 . 1 1 10 10 LYS HA H 10 4.029 4.029 4.024 0.005 19765 634 1 15 . 1 1 10 10 LYS H H 10 7.706 7.706 7.997 -0.291 19765 635 1 15 . 1 1 11 11 PHE HA H 11 4.302 4.302 4.170 0.132 19765 636 1 15 . 1 1 11 11 PHE H H 11 7.846 7.846 8.488 -0.642 19765 637 1 15 . 1 1 12 12 PHE HA H 12 4.251 4.251 4.099 0.152 19765 638 1 15 . 1 1 12 12 PHE H H 12 8.361 8.361 7.970 0.391 19765 639 1 15 . 1 1 13 13 LEU HA H 13 4.168 4.168 4.186 -0.018 19765 640 1 15 . 1 1 13 13 LEU H H 13 8.496 8.496 8.067 0.429 19765 641 1 15 . 1 1 14 14 LEU HA H 14 4.207 4.207 3.970 0.237 19765 642 1 15 . 1 1 14 14 LEU H H 14 8.054 8.054 8.390 -0.336 19765 643 1 15 . 1 1 15 15 VAL HA H 15 3.634 3.634 3.400 0.234 19765 644 1 15 . 1 1 15 15 VAL H H 15 8.012 8.012 7.856 0.156 19765 645 1 15 . 1 1 16 16 PHE HA H 16 4.592 4.592 4.200 0.392 19765 646 1 15 . 1 1 16 16 PHE H H 16 8.478 8.478 7.871 0.607 19765 647 1 15 . 1 1 17 17 GLY H H 17 8.130 8.130 8.497 -0.367 19765 648 1 15 . 1 1 18 18 GLU HA H 18 4.322 4.322 3.740 0.582 19765 649 1 15 . 1 1 18 18 GLU H H 18 8.322 8.322 8.187 0.135 19765 650 1 15 . 1 1 19 19 ASN HA H 19 4.793 4.793 4.535 0.258 19765 651 1 15 . 1 1 19 19 ASN H H 19 8.131 8.131 7.571 0.560 19765 652 1 15 . 1 1 20 20 GLY H H 20 8.215 8.215 7.525 0.690 19765 653 1 15 . 1 1 21 21 VAL HA H 21 3.923 3.923 3.417 0.506 19765 654 1 15 . 1 1 21 21 VAL H H 21 7.762 7.762 8.059 -0.297 19765 655 1 15 . 1 1 22 22 PHE HA H 22 4.476 4.476 4.753 -0.277 19765 656 1 15 . 1 1 22 22 PHE H H 22 7.814 7.814 7.549 0.265 19765 657 1 15 . 1 1 23 23 PHE HA H 23 4.499 4.499 4.673 -0.174 19765 658 1 15 . 1 1 23 23 PHE H H 23 7.706 7.706 7.981 -0.275 19765 659 1 15 . 1 1 24 24 TYR HA H 24 4.370 4.370 4.782 -0.412 19765 660 1 15 . 1 1 24 24 TYR H H 24 7.647 7.647 8.344 -0.697 19765 661 1 16 . 1 1 2 2 ALA HA H 2 4.491 4.491 4.726 -0.235 19765 662 1 16 . 1 1 2 2 ALA H H 2 8.753 8.753 8.517 0.236 19765 663 1 16 . 1 1 3 3 TRP HA H 3 4.704 4.704 4.717 -0.013 19765 664 1 16 . 1 1 3 3 TRP H H 3 8.325 8.325 8.636 -0.311 19765 665 1 16 . 1 1 4 4 TYR HA H 4 4.486 4.486 4.780 -0.294 19765 666 1 16 . 1 1 4 4 TYR H H 4 7.159 7.159 8.377 -1.218 19765 667 1 16 . 1 1 5 5 SER HA H 5 4.275 4.275 3.912 0.363 19765 668 1 16 . 1 1 5 5 SER H H 5 7.889 7.889 7.948 -0.059 19765 669 1 16 . 1 1 6 6 HIS HA H 6 4.526 4.526 4.392 0.134 19765 670 1 16 . 1 1 6 6 HIS H H 6 8.380 8.380 7.534 0.846 19765 671 1 16 . 1 1 7 7 TYR HA H 7 4.416 4.416 4.144 0.272 19765 672 1 16 . 1 1 7 7 TYR H H 7 7.851 7.851 7.812 0.039 19765 673 1 16 . 1 1 8 8 VAL HA H 8 3.897 3.897 3.824 0.073 19765 674 1 16 . 1 1 8 8 VAL H H 8 7.692 7.692 7.881 -0.189 19765 675 1 16 . 1 1 9 9 LEU HA H 9 4.277 4.277 3.928 0.349 19765 676 1 16 . 1 1 9 9 LEU H H 9 7.758 7.758 7.499 0.259 19765 677 1 16 . 1 1 10 10 LYS HA H 10 4.029 4.029 3.870 0.159 19765 678 1 16 . 1 1 10 10 LYS H H 10 7.706 7.706 7.800 -0.094 19765 679 1 16 . 1 1 11 11 PHE HA H 11 4.302 4.302 4.138 0.164 19765 680 1 16 . 1 1 11 11 PHE H H 11 7.846 7.846 8.224 -0.378 19765 681 1 16 . 1 1 12 12 PHE HA H 12 4.251 4.251 4.012 0.239 19765 682 1 16 . 1 1 12 12 PHE H H 12 8.361 8.361 8.086 0.275 19765 683 1 16 . 1 1 13 13 LEU HA H 13 4.168 4.168 4.085 0.083 19765 684 1 16 . 1 1 13 13 LEU H H 13 8.496 8.496 7.977 0.519 19765 685 1 16 . 1 1 14 14 LEU HA H 14 4.207 4.207 3.927 0.280 19765 686 1 16 . 1 1 14 14 LEU H H 14 8.054 8.054 8.083 -0.029 19765 687 1 16 . 1 1 15 15 VAL HA H 15 3.634 3.634 3.423 0.211 19765 688 1 16 . 1 1 15 15 VAL H H 15 8.012 8.012 7.530 0.482 19765 689 1 16 . 1 1 16 16 PHE HA H 16 4.592 4.592 4.197 0.395 19765 690 1 16 . 1 1 16 16 PHE H H 16 8.478 8.478 8.527 -0.049 19765 691 1 16 . 1 1 17 17 GLY H H 17 8.130 8.130 8.781 -0.651 19765 692 1 16 . 1 1 18 18 GLU HA H 18 4.322 4.322 4.067 0.255 19765 693 1 16 . 1 1 18 18 GLU H H 18 8.322 8.322 7.771 0.551 19765 694 1 16 . 1 1 19 19 ASN HA H 19 4.793 4.793 4.456 0.337 19765 695 1 16 . 1 1 19 19 ASN H H 19 8.131 8.131 7.658 0.473 19765 696 1 16 . 1 1 20 20 GLY H H 20 8.215 8.215 7.785 0.430 19765 697 1 16 . 1 1 21 21 VAL HA H 21 3.923 3.923 3.775 0.148 19765 698 1 16 . 1 1 21 21 VAL H H 21 7.762 7.762 8.486 -0.724 19765 699 1 16 . 1 1 22 22 PHE HA H 22 4.476 4.476 4.245 0.231 19765 700 1 16 . 1 1 22 22 PHE H H 22 7.814 7.814 8.267 -0.453 19765 701 1 16 . 1 1 23 23 PHE HA H 23 4.499 4.499 4.558 -0.059 19765 702 1 16 . 1 1 23 23 PHE H H 23 7.706 7.706 7.832 -0.126 19765 703 1 16 . 1 1 24 24 TYR HA H 24 4.370 4.370 4.645 -0.275 19765 704 1 16 . 1 1 24 24 TYR H H 24 7.647 7.647 7.796 -0.149 19765 705 1 17 . 1 1 2 2 ALA HA H 2 4.491 4.491 4.067 0.424 19765 706 1 17 . 1 1 2 2 ALA H H 2 8.753 8.753 8.678 0.075 19765 707 1 17 . 1 1 3 3 TRP HA H 3 4.704 4.704 4.576 0.128 19765 708 1 17 . 1 1 3 3 TRP H H 3 8.325 8.325 8.381 -0.056 19765 709 1 17 . 1 1 4 4 TYR HA H 4 4.486 4.486 4.732 -0.246 19765 710 1 17 . 1 1 4 4 TYR H H 4 7.159 7.159 8.480 -1.321 19765 711 1 17 . 1 1 5 5 SER HA H 5 4.275 4.275 3.913 0.362 19765 712 1 17 . 1 1 5 5 SER H H 5 7.889 7.889 7.779 0.110 19765 713 1 17 . 1 1 6 6 HIS HA H 6 4.526 4.526 4.375 0.151 19765 714 1 17 . 1 1 6 6 HIS H H 6 8.380 8.380 7.589 0.791 19765 715 1 17 . 1 1 7 7 TYR HA H 7 4.416 4.416 4.387 0.029 19765 716 1 17 . 1 1 7 7 TYR H H 7 7.851 7.851 7.692 0.159 19765 717 1 17 . 1 1 8 8 VAL HA H 8 3.897 3.897 3.928 -0.031 19765 718 1 17 . 1 1 8 8 VAL H H 8 7.692 7.692 8.021 -0.329 19765 719 1 17 . 1 1 9 9 LEU HA H 9 4.277 4.277 4.062 0.215 19765 720 1 17 . 1 1 9 9 LEU H H 9 7.758 7.758 7.451 0.307 19765 721 1 17 . 1 1 10 10 LYS HA H 10 4.029 4.029 4.011 0.017 19765 722 1 17 . 1 1 10 10 LYS H H 10 7.706 7.706 7.947 -0.241 19765 723 1 17 . 1 1 11 11 PHE HA H 11 4.302 4.302 4.191 0.111 19765 724 1 17 . 1 1 11 11 PHE H H 11 7.846 7.846 8.489 -0.643 19765 725 1 17 . 1 1 12 12 PHE HA H 12 4.251 4.251 4.260 -0.009 19765 726 1 17 . 1 1 12 12 PHE H H 12 8.361 8.361 8.585 -0.224 19765 727 1 17 . 1 1 13 13 LEU HA H 13 4.168 4.168 3.953 0.215 19765 728 1 17 . 1 1 13 13 LEU H H 13 8.496 8.496 8.309 0.187 19765 729 1 17 . 1 1 14 14 LEU HA H 14 4.207 4.207 4.123 0.084 19765 730 1 17 . 1 1 14 14 LEU H H 14 8.054 8.054 7.751 0.303 19765 731 1 17 . 1 1 15 15 VAL HA H 15 3.634 3.634 3.361 0.273 19765 732 1 17 . 1 1 15 15 VAL H H 15 8.012 8.012 8.399 -0.387 19765 733 1 17 . 1 1 16 16 PHE HA H 16 4.592 4.592 4.034 0.558 19765 734 1 17 . 1 1 16 16 PHE H H 16 8.478 8.478 8.072 0.406 19765 735 1 17 . 1 1 17 17 GLY H H 17 8.130 8.130 7.640 0.490 19765 736 1 17 . 1 1 18 18 GLU HA H 18 4.322 4.322 3.906 0.416 19765 737 1 17 . 1 1 18 18 GLU H H 18 8.322 8.322 8.225 0.097 19765 738 1 17 . 1 1 19 19 ASN HA H 19 4.793 4.793 4.429 0.364 19765 739 1 17 . 1 1 19 19 ASN H H 19 8.131 8.131 8.082 0.049 19765 740 1 17 . 1 1 20 20 GLY H H 20 8.215 8.215 7.736 0.479 19765 741 1 17 . 1 1 21 21 VAL HA H 21 3.923 3.923 3.839 0.084 19765 742 1 17 . 1 1 21 21 VAL H H 21 7.762 7.762 8.157 -0.395 19765 743 1 17 . 1 1 22 22 PHE HA H 22 4.476 4.476 4.029 0.447 19765 744 1 17 . 1 1 22 22 PHE H H 22 7.814 7.814 8.288 -0.474 19765 745 1 17 . 1 1 23 23 PHE HA H 23 4.499 4.499 4.665 -0.166 19765 746 1 17 . 1 1 23 23 PHE H H 23 7.706 7.706 8.354 -0.648 19765 747 1 17 . 1 1 24 24 TYR HA H 24 4.370 4.370 4.248 0.122 19765 748 1 17 . 1 1 24 24 TYR H H 24 7.647 7.647 8.500 -0.853 19765 749 1 18 . 1 1 2 2 ALA HA H 2 4.491 4.491 4.474 0.017 19765 750 1 18 . 1 1 2 2 ALA H H 2 8.753 8.753 8.563 0.190 19765 751 1 18 . 1 1 3 3 TRP HA H 3 4.704 4.704 4.698 0.006 19765 752 1 18 . 1 1 3 3 TRP H H 3 8.325 8.325 8.705 -0.380 19765 753 1 18 . 1 1 4 4 TYR HA H 4 4.486 4.486 4.826 -0.340 19765 754 1 18 . 1 1 4 4 TYR H H 4 7.159 7.159 7.196 -0.037 19765 755 1 18 . 1 1 5 5 SER HA H 5 4.275 4.275 3.890 0.385 19765 756 1 18 . 1 1 5 5 SER H H 5 7.889 7.889 8.120 -0.231 19765 757 1 18 . 1 1 6 6 HIS HA H 6 4.526 4.526 4.313 0.213 19765 758 1 18 . 1 1 6 6 HIS H H 6 8.380 8.380 8.085 0.295 19765 759 1 18 . 1 1 7 7 TYR HA H 7 4.416 4.416 4.332 0.084 19765 760 1 18 . 1 1 7 7 TYR H H 7 7.851 7.851 8.053 -0.202 19765 761 1 18 . 1 1 8 8 VAL HA H 8 3.897 3.897 3.839 0.058 19765 762 1 18 . 1 1 8 8 VAL H H 8 7.692 7.692 7.900 -0.208 19765 763 1 18 . 1 1 9 9 LEU HA H 9 4.277 4.277 3.969 0.308 19765 764 1 18 . 1 1 9 9 LEU H H 9 7.758 7.758 7.407 0.351 19765 765 1 18 . 1 1 10 10 LYS HA H 10 4.029 4.029 4.009 0.020 19765 766 1 18 . 1 1 10 10 LYS H H 10 7.706 7.706 7.711 -0.005 19765 767 1 18 . 1 1 11 11 PHE HA H 11 4.302 4.302 4.251 0.051 19765 768 1 18 . 1 1 11 11 PHE H H 11 7.846 7.846 8.085 -0.239 19765 769 1 18 . 1 1 12 12 PHE HA H 12 4.251 4.251 4.145 0.106 19765 770 1 18 . 1 1 12 12 PHE H H 12 8.361 8.361 8.218 0.143 19765 771 1 18 . 1 1 13 13 LEU HA H 13 4.168 4.168 4.157 0.011 19765 772 1 18 . 1 1 13 13 LEU H H 13 8.496 8.496 8.234 0.262 19765 773 1 18 . 1 1 14 14 LEU HA H 14 4.207 4.207 4.463 -0.256 19765 774 1 18 . 1 1 14 14 LEU H H 14 8.054 8.054 7.616 0.438 19765 775 1 18 . 1 1 15 15 VAL HA H 15 3.634 3.634 3.753 -0.119 19765 776 1 18 . 1 1 15 15 VAL H H 15 8.012 8.012 6.933 1.079 19765 777 1 18 . 1 1 16 16 PHE HA H 16 4.592 4.592 4.280 0.312 19765 778 1 18 . 1 1 16 16 PHE H H 16 8.478 8.478 8.534 -0.056 19765 779 1 18 . 1 1 17 17 GLY H H 17 8.130 8.130 7.810 0.320 19765 780 1 18 . 1 1 18 18 GLU HA H 18 4.322 4.322 4.202 0.120 19765 781 1 18 . 1 1 18 18 GLU H H 18 8.322 8.322 7.978 0.344 19765 782 1 18 . 1 1 19 19 ASN HA H 19 4.793 4.793 4.684 0.109 19765 783 1 18 . 1 1 19 19 ASN H H 19 8.131 8.131 7.588 0.543 19765 784 1 18 . 1 1 20 20 GLY H H 20 8.215 8.215 7.566 0.649 19765 785 1 18 . 1 1 21 21 VAL HA H 21 3.923 3.923 4.205 -0.282 19765 786 1 18 . 1 1 21 21 VAL H H 21 7.762 7.762 8.309 -0.547 19765 787 1 18 . 1 1 22 22 PHE HA H 22 4.476 4.476 4.581 -0.105 19765 788 1 18 . 1 1 22 22 PHE H H 22 7.814 7.814 7.769 0.045 19765 789 1 18 . 1 1 23 23 PHE HA H 23 4.499 4.499 4.725 -0.226 19765 790 1 18 . 1 1 23 23 PHE H H 23 7.706 7.706 7.803 -0.097 19765 791 1 18 . 1 1 24 24 TYR HA H 24 4.370 4.370 4.582 -0.212 19765 792 1 18 . 1 1 24 24 TYR H H 24 7.647 7.647 7.906 -0.259 19765 793 1 19 . 1 1 2 2 ALA HA H 2 4.491 4.491 4.047 0.444 19765 794 1 19 . 1 1 2 2 ALA H H 2 8.753 8.753 7.889 0.864 19765 795 1 19 . 1 1 3 3 TRP HA H 3 4.704 4.704 4.819 -0.115 19765 796 1 19 . 1 1 3 3 TRP H H 3 8.325 8.325 8.594 -0.269 19765 797 1 19 . 1 1 4 4 TYR HA H 4 4.486 4.486 4.929 -0.443 19765 798 1 19 . 1 1 4 4 TYR H H 4 7.159 7.159 7.113 0.046 19765 799 1 19 . 1 1 5 5 SER HA H 5 4.275 4.275 4.420 -0.145 19765 800 1 19 . 1 1 5 5 SER H H 5 7.889 7.889 7.984 -0.095 19765 801 1 19 . 1 1 6 6 HIS HA H 6 4.526 4.526 4.457 0.069 19765 802 1 19 . 1 1 6 6 HIS H H 6 8.380 8.380 7.663 0.717 19765 803 1 19 . 1 1 7 7 TYR HA H 7 4.416 4.416 4.316 0.100 19765 804 1 19 . 1 1 7 7 TYR H H 7 7.851 7.851 8.386 -0.535 19765 805 1 19 . 1 1 8 8 VAL HA H 8 3.897 3.897 3.874 0.023 19765 806 1 19 . 1 1 8 8 VAL H H 8 7.692 7.692 8.143 -0.451 19765 807 1 19 . 1 1 9 9 LEU HA H 9 4.277 4.277 4.040 0.237 19765 808 1 19 . 1 1 9 9 LEU H H 9 7.758 7.758 7.743 0.015 19765 809 1 19 . 1 1 10 10 LYS HA H 10 4.029 4.029 3.995 0.034 19765 810 1 19 . 1 1 10 10 LYS H H 10 7.706 7.706 7.966 -0.260 19765 811 1 19 . 1 1 11 11 PHE HA H 11 4.302 4.302 4.244 0.058 19765 812 1 19 . 1 1 11 11 PHE H H 11 7.846 7.846 8.086 -0.240 19765 813 1 19 . 1 1 12 12 PHE HA H 12 4.251 4.251 4.136 0.115 19765 814 1 19 . 1 1 12 12 PHE H H 12 8.361 8.361 8.182 0.179 19765 815 1 19 . 1 1 13 13 LEU HA H 13 4.168 4.168 4.138 0.030 19765 816 1 19 . 1 1 13 13 LEU H H 13 8.496 8.496 8.792 -0.296 19765 817 1 19 . 1 1 14 14 LEU HA H 14 4.207 4.207 3.998 0.209 19765 818 1 19 . 1 1 14 14 LEU H H 14 8.054 8.054 8.051 0.003 19765 819 1 19 . 1 1 15 15 VAL HA H 15 3.634 3.634 3.456 0.178 19765 820 1 19 . 1 1 15 15 VAL H H 15 8.012 8.012 7.484 0.528 19765 821 1 19 . 1 1 16 16 PHE HA H 16 4.592 4.592 4.297 0.295 19765 822 1 19 . 1 1 16 16 PHE H H 16 8.478 8.478 8.651 -0.173 19765 823 1 19 . 1 1 17 17 GLY H H 17 8.130 8.130 8.334 -0.204 19765 824 1 19 . 1 1 18 18 GLU HA H 18 4.322 4.322 4.199 0.123 19765 825 1 19 . 1 1 18 18 GLU H H 18 8.322 8.322 7.587 0.735 19765 826 1 19 . 1 1 19 19 ASN HA H 19 4.793 4.793 4.565 0.228 19765 827 1 19 . 1 1 19 19 ASN H H 19 8.131 8.131 7.906 0.225 19765 828 1 19 . 1 1 20 20 GLY H H 20 8.215 8.215 7.765 0.450 19765 829 1 19 . 1 1 21 21 VAL HA H 21 3.923 3.923 4.110 -0.187 19765 830 1 19 . 1 1 21 21 VAL H H 21 7.762 7.762 8.031 -0.269 19765 831 1 19 . 1 1 22 22 PHE HA H 22 4.476 4.476 4.270 0.206 19765 832 1 19 . 1 1 22 22 PHE H H 22 7.814 7.814 7.565 0.249 19765 833 1 19 . 1 1 23 23 PHE HA H 23 4.499 4.499 4.472 0.027 19765 834 1 19 . 1 1 23 23 PHE H H 23 7.706 7.706 8.506 -0.800 19765 835 1 19 . 1 1 24 24 TYR HA H 24 4.370 4.370 4.542 -0.172 19765 836 1 19 . 1 1 24 24 TYR H H 24 7.647 7.647 7.569 0.078 19765 837 1 20 . 1 1 2 2 ALA HA H 2 4.491 4.491 4.080 0.411 19765 838 1 20 . 1 1 2 2 ALA H H 2 8.753 8.753 7.257 1.496 19765 839 1 20 . 1 1 3 3 TRP HA H 3 4.704 4.704 4.861 -0.157 19765 840 1 20 . 1 1 3 3 TRP H H 3 8.325 8.325 8.120 0.205 19765 841 1 20 . 1 1 4 4 TYR HA H 4 4.486 4.486 5.047 -0.561 19765 842 1 20 . 1 1 4 4 TYR H H 4 7.159 7.159 7.544 -0.385 19765 843 1 20 . 1 1 5 5 SER HA H 5 4.275 4.275 3.875 0.400 19765 844 1 20 . 1 1 5 5 SER H H 5 7.889 7.889 8.290 -0.401 19765 845 1 20 . 1 1 6 6 HIS HA H 6 4.526 4.526 4.490 0.036 19765 846 1 20 . 1 1 6 6 HIS H H 6 8.380 8.380 8.543 -0.163 19765 847 1 20 . 1 1 7 7 TYR HA H 7 4.416 4.416 4.271 0.145 19765 848 1 20 . 1 1 7 7 TYR H H 7 7.851 7.851 8.167 -0.316 19765 849 1 20 . 1 1 8 8 VAL HA H 8 3.897 3.897 3.887 0.010 19765 850 1 20 . 1 1 8 8 VAL H H 8 7.692 7.692 8.770 -1.078 19765 851 1 20 . 1 1 9 9 LEU HA H 9 4.277 4.277 4.211 0.066 19765 852 1 20 . 1 1 9 9 LEU H H 9 7.758 7.758 7.579 0.179 19765 853 1 20 . 1 1 10 10 LYS HA H 10 4.029 4.029 3.977 0.052 19765 854 1 20 . 1 1 10 10 LYS H H 10 7.706 7.706 7.790 -0.084 19765 855 1 20 . 1 1 11 11 PHE HA H 11 4.302 4.302 4.228 0.074 19765 856 1 20 . 1 1 11 11 PHE H H 11 7.846 7.846 8.112 -0.266 19765 857 1 20 . 1 1 12 12 PHE HA H 12 4.251 4.251 4.189 0.062 19765 858 1 20 . 1 1 12 12 PHE H H 12 8.361 8.361 8.483 -0.122 19765 859 1 20 . 1 1 13 13 LEU HA H 13 4.168 4.168 3.986 0.182 19765 860 1 20 . 1 1 13 13 LEU H H 13 8.496 8.496 8.395 0.101 19765 861 1 20 . 1 1 14 14 LEU HA H 14 4.207 4.207 4.053 0.154 19765 862 1 20 . 1 1 14 14 LEU H H 14 8.054 8.054 7.541 0.513 19765 863 1 20 . 1 1 15 15 VAL HA H 15 3.634 3.634 3.738 -0.104 19765 864 1 20 . 1 1 15 15 VAL H H 15 8.012 8.012 7.122 0.890 19765 865 1 20 . 1 1 16 16 PHE HA H 16 4.592 4.592 4.070 0.522 19765 866 1 20 . 1 1 16 16 PHE H H 16 8.478 8.478 8.340 0.138 19765 867 1 20 . 1 1 17 17 GLY H H 17 8.130 8.130 7.484 0.646 19765 868 1 20 . 1 1 18 18 GLU HA H 18 4.322 4.322 3.988 0.334 19765 869 1 20 . 1 1 18 18 GLU H H 18 8.322 8.322 7.772 0.550 19765 870 1 20 . 1 1 19 19 ASN HA H 19 4.793 4.793 4.486 0.307 19765 871 1 20 . 1 1 19 19 ASN H H 19 8.131 8.131 7.820 0.311 19765 872 1 20 . 1 1 20 20 GLY H H 20 8.215 8.215 7.200 1.015 19765 873 1 20 . 1 1 21 21 VAL HA H 21 3.923 3.923 3.656 0.267 19765 874 1 20 . 1 1 21 21 VAL H H 21 7.762 7.762 8.324 -0.562 19765 875 1 20 . 1 1 22 22 PHE HA H 22 4.476 4.476 4.005 0.471 19765 876 1 20 . 1 1 22 22 PHE H H 22 7.814 7.814 8.263 -0.449 19765 877 1 20 . 1 1 23 23 PHE HA H 23 4.499 4.499 4.530 -0.031 19765 878 1 20 . 1 1 23 23 PHE H H 23 7.706 7.706 7.661 0.045 19765 879 1 20 . 1 1 24 24 TYR HA H 24 4.370 4.370 4.126 0.244 19765 880 1 20 . 1 1 24 24 TYR H H 24 7.647 7.647 8.356 -0.709 19765 881 1 21 . 1 1 2 2 ALA HA H 2 4.491 4.491 4.129 0.362 19765 882 1 21 . 1 1 2 2 ALA H H 2 8.753 8.753 8.052 0.701 19765 883 1 21 . 1 1 3 3 TRP HA H 3 4.704 4.704 4.847 -0.143 19765 884 1 21 . 1 1 3 3 TRP H H 3 8.325 8.325 8.389 -0.064 19765 885 1 21 . 1 1 4 4 TYR HA H 4 4.486 4.486 4.560 -0.074 19765 886 1 21 . 1 1 4 4 TYR H H 4 7.159 7.159 8.330 -1.171 19765 887 1 21 . 1 1 5 5 SER HA H 5 4.275 4.275 4.229 0.046 19765 888 1 21 . 1 1 5 5 SER H H 5 7.889 7.889 7.188 0.701 19765 889 1 21 . 1 1 6 6 HIS HA H 6 4.526 4.526 4.570 -0.044 19765 890 1 21 . 1 1 6 6 HIS H H 6 8.380 8.380 7.608 0.772 19765 891 1 21 . 1 1 7 7 TYR HA H 7 4.416 4.416 4.094 0.322 19765 892 1 21 . 1 1 7 7 TYR H H 7 7.851 7.851 8.336 -0.485 19765 893 1 21 . 1 1 8 8 VAL HA H 8 3.897 3.897 3.598 0.299 19765 894 1 21 . 1 1 8 8 VAL H H 8 7.692 7.692 7.666 0.026 19765 895 1 21 . 1 1 9 9 LEU HA H 9 4.277 4.277 3.981 0.296 19765 896 1 21 . 1 1 9 9 LEU H H 9 7.758 7.758 7.269 0.489 19765 897 1 21 . 1 1 10 10 LYS HA H 10 4.029 4.029 3.882 0.147 19765 898 1 21 . 1 1 10 10 LYS H H 10 7.706 7.706 7.499 0.207 19765 899 1 21 . 1 1 11 11 PHE HA H 11 4.302 4.302 4.121 0.181 19765 900 1 21 . 1 1 11 11 PHE H H 11 7.846 7.846 8.590 -0.744 19765 901 1 21 . 1 1 12 12 PHE HA H 12 4.251 4.251 4.216 0.035 19765 902 1 21 . 1 1 12 12 PHE H H 12 8.361 8.361 8.088 0.273 19765 903 1 21 . 1 1 13 13 LEU HA H 13 4.168 4.168 4.024 0.144 19765 904 1 21 . 1 1 13 13 LEU H H 13 8.496 8.496 7.980 0.516 19765 905 1 21 . 1 1 14 14 LEU HA H 14 4.207 4.207 4.008 0.199 19765 906 1 21 . 1 1 14 14 LEU H H 14 8.054 8.054 7.411 0.643 19765 907 1 21 . 1 1 15 15 VAL HA H 15 3.634 3.634 3.547 0.087 19765 908 1 21 . 1 1 15 15 VAL H H 15 8.012 8.012 8.281 -0.269 19765 909 1 21 . 1 1 16 16 PHE HA H 16 4.592 4.592 4.261 0.331 19765 910 1 21 . 1 1 16 16 PHE H H 16 8.478 8.478 8.421 0.057 19765 911 1 21 . 1 1 17 17 GLY H H 17 8.130 8.130 7.723 0.407 19765 912 1 21 . 1 1 18 18 GLU HA H 18 4.322 4.322 4.370 -0.048 19765 913 1 21 . 1 1 18 18 GLU H H 18 8.322 8.322 7.723 0.599 19765 914 1 21 . 1 1 19 19 ASN HA H 19 4.793 4.793 4.588 0.205 19765 915 1 21 . 1 1 19 19 ASN H H 19 8.131 8.131 7.586 0.545 19765 916 1 21 . 1 1 20 20 GLY H H 20 8.215 8.215 7.619 0.596 19765 917 1 21 . 1 1 21 21 VAL HA H 21 3.923 3.923 4.045 -0.122 19765 918 1 21 . 1 1 21 21 VAL H H 21 7.762 7.762 8.254 -0.492 19765 919 1 21 . 1 1 22 22 PHE HA H 22 4.476 4.476 4.487 -0.011 19765 920 1 21 . 1 1 22 22 PHE H H 22 7.814 7.814 7.478 0.336 19765 921 1 21 . 1 1 23 23 PHE HA H 23 4.499 4.499 4.626 -0.127 19765 922 1 21 . 1 1 23 23 PHE H H 23 7.706 7.706 7.872 -0.166 19765 923 1 21 . 1 1 24 24 TYR HA H 24 4.370 4.370 4.554 -0.184 19765 924 1 21 . 1 1 24 24 TYR H H 24 7.647 7.647 7.684 -0.037 19765 925 1 22 . 1 1 2 2 ALA HA H 2 4.491 4.491 4.603 -0.112 19765 926 1 22 . 1 1 2 2 ALA H H 2 8.753 8.753 8.482 0.271 19765 927 1 22 . 1 1 3 3 TRP HA H 3 4.704 4.704 4.635 0.069 19765 928 1 22 . 1 1 3 3 TRP H H 3 8.325 8.325 9.016 -0.691 19765 929 1 22 . 1 1 4 4 TYR HA H 4 4.486 4.486 5.045 -0.559 19765 930 1 22 . 1 1 4 4 TYR H H 4 7.159 7.159 7.427 -0.268 19765 931 1 22 . 1 1 5 5 SER HA H 5 4.275 4.275 4.449 -0.174 19765 932 1 22 . 1 1 5 5 SER H H 5 7.889 7.889 7.810 0.079 19765 933 1 22 . 1 1 6 6 HIS HA H 6 4.526 4.526 4.316 0.210 19765 934 1 22 . 1 1 6 6 HIS H H 6 8.380 8.380 8.452 -0.072 19765 935 1 22 . 1 1 7 7 TYR HA H 7 4.416 4.416 4.296 0.120 19765 936 1 22 . 1 1 7 7 TYR H H 7 7.851 7.851 8.071 -0.220 19765 937 1 22 . 1 1 8 8 VAL HA H 8 3.897 3.897 3.951 -0.054 19765 938 1 22 . 1 1 8 8 VAL H H 8 7.692 7.692 7.982 -0.290 19765 939 1 22 . 1 1 9 9 LEU HA H 9 4.277 4.277 4.102 0.175 19765 940 1 22 . 1 1 9 9 LEU H H 9 7.758 7.758 7.381 0.377 19765 941 1 22 . 1 1 10 10 LYS HA H 10 4.029 4.029 4.002 0.027 19765 942 1 22 . 1 1 10 10 LYS H H 10 7.706 7.706 8.337 -0.631 19765 943 1 22 . 1 1 11 11 PHE HA H 11 4.302 4.302 4.237 0.065 19765 944 1 22 . 1 1 11 11 PHE H H 11 7.846 7.846 8.535 -0.689 19765 945 1 22 . 1 1 12 12 PHE HA H 12 4.251 4.251 4.094 0.157 19765 946 1 22 . 1 1 12 12 PHE H H 12 8.361 8.361 8.067 0.294 19765 947 1 22 . 1 1 13 13 LEU HA H 13 4.168 4.168 3.977 0.191 19765 948 1 22 . 1 1 13 13 LEU H H 13 8.496 8.496 8.267 0.229 19765 949 1 22 . 1 1 14 14 LEU HA H 14 4.207 4.207 3.969 0.238 19765 950 1 22 . 1 1 14 14 LEU H H 14 8.054 8.054 8.092 -0.038 19765 951 1 22 . 1 1 15 15 VAL HA H 15 3.634 3.634 3.358 0.276 19765 952 1 22 . 1 1 15 15 VAL H H 15 8.012 8.012 7.775 0.237 19765 953 1 22 . 1 1 16 16 PHE HA H 16 4.592 4.592 4.001 0.591 19765 954 1 22 . 1 1 16 16 PHE H H 16 8.478 8.478 7.965 0.513 19765 955 1 22 . 1 1 17 17 GLY H H 17 8.130 8.130 8.216 -0.086 19765 956 1 22 . 1 1 18 18 GLU HA H 18 4.322 4.322 3.994 0.328 19765 957 1 22 . 1 1 18 18 GLU H H 18 8.322 8.322 7.864 0.458 19765 958 1 22 . 1 1 19 19 ASN HA H 19 4.793 4.793 4.460 0.333 19765 959 1 22 . 1 1 19 19 ASN H H 19 8.131 8.131 8.608 -0.477 19765 960 1 22 . 1 1 20 20 GLY H H 20 8.215 8.215 8.144 0.071 19765 961 1 22 . 1 1 21 21 VAL HA H 21 3.923 3.923 4.014 -0.091 19765 962 1 22 . 1 1 21 21 VAL H H 21 7.762 7.762 8.217 -0.455 19765 963 1 22 . 1 1 22 22 PHE HA H 22 4.476 4.476 4.049 0.427 19765 964 1 22 . 1 1 22 22 PHE H H 22 7.814 7.814 8.477 -0.663 19765 965 1 22 . 1 1 23 23 PHE HA H 23 4.499 4.499 4.503 -0.004 19765 966 1 22 . 1 1 23 23 PHE H H 23 7.706 7.706 7.685 0.021 19765 967 1 22 . 1 1 24 24 TYR HA H 24 4.370 4.370 4.141 0.229 19765 968 1 22 . 1 1 24 24 TYR H H 24 7.647 7.647 8.135 -0.488 19765 969 1 23 . 1 1 2 2 ALA HA H 2 4.491 4.491 4.726 -0.235 19765 970 1 23 . 1 1 2 2 ALA H H 2 8.753 8.753 8.467 0.286 19765 971 1 23 . 1 1 3 3 TRP HA H 3 4.704 4.704 4.705 -0.001 19765 972 1 23 . 1 1 3 3 TRP H H 3 8.325 8.325 8.756 -0.431 19765 973 1 23 . 1 1 4 4 TYR HA H 4 4.486 4.486 5.108 -0.622 19765 974 1 23 . 1 1 4 4 TYR H H 4 7.159 7.159 7.360 -0.201 19765 975 1 23 . 1 1 5 5 SER HA H 5 4.275 4.275 3.880 0.395 19765 976 1 23 . 1 1 5 5 SER H H 5 7.889 7.889 8.351 -0.462 19765 977 1 23 . 1 1 6 6 HIS HA H 6 4.526 4.526 4.506 0.020 19765 978 1 23 . 1 1 6 6 HIS H H 6 8.380 8.380 8.694 -0.314 19765 979 1 23 . 1 1 7 7 TYR HA H 7 4.416 4.416 4.360 0.056 19765 980 1 23 . 1 1 7 7 TYR H H 7 7.851 7.851 8.138 -0.287 19765 981 1 23 . 1 1 8 8 VAL HA H 8 3.897 3.897 3.939 -0.042 19765 982 1 23 . 1 1 8 8 VAL H H 8 7.692 7.692 8.842 -1.150 19765 983 1 23 . 1 1 9 9 LEU HA H 9 4.277 4.277 4.024 0.253 19765 984 1 23 . 1 1 9 9 LEU H H 9 7.758 7.758 7.491 0.267 19765 985 1 23 . 1 1 10 10 LYS HA H 10 4.029 4.029 4.061 -0.032 19765 986 1 23 . 1 1 10 10 LYS H H 10 7.706 7.706 7.879 -0.173 19765 987 1 23 . 1 1 11 11 PHE HA H 11 4.302 4.302 4.268 0.034 19765 988 1 23 . 1 1 11 11 PHE H H 11 7.846 7.846 8.134 -0.288 19765 989 1 23 . 1 1 12 12 PHE HA H 12 4.251 4.251 4.196 0.055 19765 990 1 23 . 1 1 12 12 PHE H H 12 8.361 8.361 8.366 -0.005 19765 991 1 23 . 1 1 13 13 LEU HA H 13 4.168 4.168 4.015 0.153 19765 992 1 23 . 1 1 13 13 LEU H H 13 8.496 8.496 8.083 0.413 19765 993 1 23 . 1 1 14 14 LEU HA H 14 4.207 4.207 3.947 0.260 19765 994 1 23 . 1 1 14 14 LEU H H 14 8.054 8.054 7.784 0.270 19765 995 1 23 . 1 1 15 15 VAL HA H 15 3.634 3.634 3.511 0.123 19765 996 1 23 . 1 1 15 15 VAL H H 15 8.012 8.012 7.947 0.065 19765 997 1 23 . 1 1 16 16 PHE HA H 16 4.592 4.592 4.096 0.496 19765 998 1 23 . 1 1 16 16 PHE H H 16 8.478 8.478 8.946 -0.468 19765 999 1 23 . 1 1 17 17 GLY H H 17 8.130 8.130 8.118 0.012 19765 1000 1 23 . 1 1 18 18 GLU HA H 18 4.322 4.322 4.019 0.303 19765 1001 1 23 . 1 1 18 18 GLU H H 18 8.322 8.322 7.777 0.545 19765 1002 1 23 . 1 1 19 19 ASN HA H 19 4.793 4.793 3.841 0.952 19765 1003 1 23 . 1 1 19 19 ASN H H 19 8.131 8.131 8.376 -0.245 19765 1004 1 23 . 1 1 20 20 GLY H H 20 8.215 8.215 7.201 1.014 19765 1005 1 23 . 1 1 21 21 VAL HA H 21 3.923 3.923 3.715 0.208 19765 1006 1 23 . 1 1 21 21 VAL H H 21 7.762 7.762 7.981 -0.219 19765 1007 1 23 . 1 1 22 22 PHE HA H 22 4.476 4.476 4.665 -0.189 19765 1008 1 23 . 1 1 22 22 PHE H H 22 7.814 7.814 6.957 0.857 19765 1009 1 23 . 1 1 23 23 PHE HA H 23 4.499 4.499 4.711 -0.212 19765 1010 1 23 . 1 1 23 23 PHE H H 23 7.706 7.706 7.311 0.395 19765 1011 1 23 . 1 1 24 24 TYR HA H 24 4.370 4.370 4.478 -0.108 19765 1012 1 23 . 1 1 24 24 TYR H H 24 7.647 7.647 7.930 -0.283 19765 1013 1 24 . 1 1 2 2 ALA HA H 2 4.491 4.491 4.574 -0.083 19765 1014 1 24 . 1 1 2 2 ALA H H 2 8.753 8.753 7.855 0.898 19765 1015 1 24 . 1 1 3 3 TRP HA H 3 4.704 4.704 4.739 -0.035 19765 1016 1 24 . 1 1 3 3 TRP H H 3 8.325 8.325 8.932 -0.607 19765 1017 1 24 . 1 1 4 4 TYR HA H 4 4.486 4.486 4.875 -0.389 19765 1018 1 24 . 1 1 4 4 TYR H H 4 7.159 7.159 8.175 -1.016 19765 1019 1 24 . 1 1 5 5 SER HA H 5 4.275 4.275 4.438 -0.163 19765 1020 1 24 . 1 1 5 5 SER H H 5 7.889 7.889 8.436 -0.547 19765 1021 1 24 . 1 1 6 6 HIS HA H 6 4.526 4.526 4.462 0.064 19765 1022 1 24 . 1 1 6 6 HIS H H 6 8.380 8.380 8.426 -0.046 19765 1023 1 24 . 1 1 7 7 TYR HA H 7 4.416 4.416 3.991 0.425 19765 1024 1 24 . 1 1 7 7 TYR H H 7 7.851 7.851 7.937 -0.086 19765 1025 1 24 . 1 1 8 8 VAL HA H 8 3.897 3.897 3.839 0.058 19765 1026 1 24 . 1 1 8 8 VAL H H 8 7.692 7.692 7.576 0.116 19765 1027 1 24 . 1 1 9 9 LEU HA H 9 4.277 4.277 4.122 0.155 19765 1028 1 24 . 1 1 9 9 LEU H H 9 7.758 7.758 7.690 0.068 19765 1029 1 24 . 1 1 10 10 LYS HA H 10 4.029 4.029 3.930 0.099 19765 1030 1 24 . 1 1 10 10 LYS H H 10 7.706 7.706 7.789 -0.083 19765 1031 1 24 . 1 1 11 11 PHE HA H 11 4.302 4.302 4.233 0.069 19765 1032 1 24 . 1 1 11 11 PHE H H 11 7.846 7.846 7.901 -0.055 19765 1033 1 24 . 1 1 12 12 PHE HA H 12 4.251 4.251 4.139 0.112 19765 1034 1 24 . 1 1 12 12 PHE H H 12 8.361 8.361 8.421 -0.060 19765 1035 1 24 . 1 1 13 13 LEU HA H 13 4.168 4.168 3.985 0.183 19765 1036 1 24 . 1 1 13 13 LEU H H 13 8.496 8.496 8.540 -0.044 19765 1037 1 24 . 1 1 14 14 LEU HA H 14 4.207 4.207 4.023 0.184 19765 1038 1 24 . 1 1 14 14 LEU H H 14 8.054 8.054 7.427 0.627 19765 1039 1 24 . 1 1 15 15 VAL HA H 15 3.634 3.634 3.716 -0.082 19765 1040 1 24 . 1 1 15 15 VAL H H 15 8.012 8.012 7.179 0.833 19765 1041 1 24 . 1 1 16 16 PHE HA H 16 4.592 4.592 3.978 0.614 19765 1042 1 24 . 1 1 16 16 PHE H H 16 8.478 8.478 8.183 0.295 19765 1043 1 24 . 1 1 17 17 GLY H H 17 8.130 8.130 7.586 0.544 19765 1044 1 24 . 1 1 18 18 GLU HA H 18 4.322 4.322 3.975 0.347 19765 1045 1 24 . 1 1 18 18 GLU H H 18 8.322 8.322 7.863 0.459 19765 1046 1 24 . 1 1 19 19 ASN HA H 19 4.793 4.793 4.533 0.260 19765 1047 1 24 . 1 1 19 19 ASN H H 19 8.131 8.131 7.993 0.138 19765 1048 1 24 . 1 1 20 20 GLY H H 20 8.215 8.215 7.213 1.002 19765 1049 1 24 . 1 1 21 21 VAL HA H 21 3.923 3.923 3.844 0.079 19765 1050 1 24 . 1 1 21 21 VAL H H 21 7.762 7.762 8.122 -0.360 19765 1051 1 24 . 1 1 22 22 PHE HA H 22 4.476 4.476 4.443 0.033 19765 1052 1 24 . 1 1 22 22 PHE H H 22 7.814 7.814 8.097 -0.283 19765 1053 1 24 . 1 1 23 23 PHE HA H 23 4.499 4.499 4.640 -0.141 19765 1054 1 24 . 1 1 23 23 PHE H H 23 7.706 7.706 7.573 0.133 19765 1055 1 24 . 1 1 24 24 TYR HA H 24 4.370 4.370 4.574 -0.204 19765 1056 1 24 . 1 1 24 24 TYR H H 24 7.647 7.647 8.126 -0.479 19765 1057 1 25 . 1 1 2 2 ALA HA H 2 4.491 4.491 4.457 0.034 19765 1058 1 25 . 1 1 2 2 ALA H H 2 8.753 8.753 7.335 1.418 19765 1059 1 25 . 1 1 3 3 TRP HA H 3 4.704 4.704 4.733 -0.029 19765 1060 1 25 . 1 1 3 3 TRP H H 3 8.325 8.325 7.449 0.876 19765 1061 1 25 . 1 1 4 4 TYR HA H 4 4.486 4.486 4.507 -0.021 19765 1062 1 25 . 1 1 4 4 TYR H H 4 7.159 7.159 8.657 -1.498 19765 1063 1 25 . 1 1 5 5 SER HA H 5 4.275 4.275 4.487 -0.212 19765 1064 1 25 . 1 1 5 5 SER H H 5 7.889 7.889 8.378 -0.489 19765 1065 1 25 . 1 1 6 6 HIS HA H 6 4.526 4.526 4.479 0.047 19765 1066 1 25 . 1 1 6 6 HIS H H 6 8.380 8.380 8.430 -0.050 19765 1067 1 25 . 1 1 7 7 TYR HA H 7 4.416 4.416 4.349 0.067 19765 1068 1 25 . 1 1 7 7 TYR H H 7 7.851 7.851 8.377 -0.526 19765 1069 1 25 . 1 1 8 8 VAL HA H 8 3.897 3.897 4.012 -0.115 19765 1070 1 25 . 1 1 8 8 VAL H H 8 7.692 7.692 8.490 -0.798 19765 1071 1 25 . 1 1 9 9 LEU HA H 9 4.277 4.277 4.107 0.170 19765 1072 1 25 . 1 1 9 9 LEU H H 9 7.758 7.758 7.481 0.277 19765 1073 1 25 . 1 1 10 10 LYS HA H 10 4.029 4.029 4.067 -0.038 19765 1074 1 25 . 1 1 10 10 LYS H H 10 7.706 7.706 7.855 -0.149 19765 1075 1 25 . 1 1 11 11 PHE HA H 11 4.302 4.302 4.211 0.091 19765 1076 1 25 . 1 1 11 11 PHE H H 11 7.846 7.846 8.244 -0.398 19765 1077 1 25 . 1 1 12 12 PHE HA H 12 4.251 4.251 4.147 0.104 19765 1078 1 25 . 1 1 12 12 PHE H H 12 8.361 8.361 8.299 0.062 19765 1079 1 25 . 1 1 13 13 LEU HA H 13 4.168 4.168 4.133 0.035 19765 1080 1 25 . 1 1 13 13 LEU H H 13 8.496 8.496 7.893 0.603 19765 1081 1 25 . 1 1 14 14 LEU HA H 14 4.207 4.207 4.104 0.103 19765 1082 1 25 . 1 1 14 14 LEU H H 14 8.054 8.054 7.553 0.501 19765 1083 1 25 . 1 1 15 15 VAL HA H 15 3.634 3.634 3.400 0.234 19765 1084 1 25 . 1 1 15 15 VAL H H 15 8.012 8.012 8.225 -0.213 19765 1085 1 25 . 1 1 16 16 PHE HA H 16 4.592 4.592 4.182 0.410 19765 1086 1 25 . 1 1 16 16 PHE H H 16 8.478 8.478 8.260 0.218 19765 1087 1 25 . 1 1 17 17 GLY H H 17 8.130 8.130 7.470 0.660 19765 1088 1 25 . 1 1 18 18 GLU HA H 18 4.322 4.322 4.281 0.041 19765 1089 1 25 . 1 1 18 18 GLU H H 18 8.322 8.322 8.076 0.246 19765 1090 1 25 . 1 1 19 19 ASN HA H 19 4.793 4.793 4.455 0.338 19765 1091 1 25 . 1 1 19 19 ASN H H 19 8.131 8.131 7.583 0.548 19765 1092 1 25 . 1 1 20 20 GLY H H 20 8.215 8.215 7.571 0.644 19765 1093 1 25 . 1 1 21 21 VAL HA H 21 3.923 3.923 4.169 -0.246 19765 1094 1 25 . 1 1 21 21 VAL H H 21 7.762 7.762 8.509 -0.747 19765 1095 1 25 . 1 1 22 22 PHE HA H 22 4.476 4.476 4.541 -0.065 19765 1096 1 25 . 1 1 22 22 PHE H H 22 7.814 7.814 7.690 0.124 19765 1097 1 25 . 1 1 23 23 PHE HA H 23 4.499 4.499 4.594 -0.095 19765 1098 1 25 . 1 1 23 23 PHE H H 23 7.706 7.706 7.745 -0.039 19765 1099 1 25 . 1 1 24 24 TYR HA H 24 4.370 4.370 4.646 -0.276 19765 1100 1 25 . 1 1 24 24 TYR H H 24 7.647 7.647 8.348 -0.701 19765 1101 1 26 . 1 1 2 2 ALA HA H 2 4.491 4.491 4.803 -0.312 19765 1102 1 26 . 1 1 2 2 ALA H H 2 8.753 8.753 8.209 0.544 19765 1103 1 26 . 1 1 3 3 TRP HA H 3 4.704 4.704 4.371 0.333 19765 1104 1 26 . 1 1 3 3 TRP H H 3 8.325 8.325 8.023 0.302 19765 1105 1 26 . 1 1 4 4 TYR HA H 4 4.486 4.486 4.431 0.055 19765 1106 1 26 . 1 1 4 4 TYR H H 4 7.159 7.159 8.415 -1.256 19765 1107 1 26 . 1 1 5 5 SER HA H 5 4.275 4.275 3.937 0.338 19765 1108 1 26 . 1 1 5 5 SER H H 5 7.889 7.889 8.276 -0.387 19765 1109 1 26 . 1 1 6 6 HIS HA H 6 4.526 4.526 4.512 0.014 19765 1110 1 26 . 1 1 6 6 HIS H H 6 8.380 8.380 8.129 0.251 19765 1111 1 26 . 1 1 7 7 TYR HA H 7 4.416 4.416 4.358 0.058 19765 1112 1 26 . 1 1 7 7 TYR H H 7 7.851 7.851 7.436 0.415 19765 1113 1 26 . 1 1 8 8 VAL HA H 8 3.897 3.897 3.869 0.028 19765 1114 1 26 . 1 1 8 8 VAL H H 8 7.692 7.692 7.876 -0.184 19765 1115 1 26 . 1 1 9 9 LEU HA H 9 4.277 4.277 3.978 0.299 19765 1116 1 26 . 1 1 9 9 LEU H H 9 7.758 7.758 7.627 0.131 19765 1117 1 26 . 1 1 10 10 LYS HA H 10 4.029 4.029 4.041 -0.012 19765 1118 1 26 . 1 1 10 10 LYS H H 10 7.706 7.706 7.865 -0.159 19765 1119 1 26 . 1 1 11 11 PHE HA H 11 4.302 4.302 4.192 0.110 19765 1120 1 26 . 1 1 11 11 PHE H H 11 7.846 7.846 8.730 -0.884 19765 1121 1 26 . 1 1 12 12 PHE HA H 12 4.251 4.251 4.242 0.009 19765 1122 1 26 . 1 1 12 12 PHE H H 12 8.361 8.361 8.314 0.047 19765 1123 1 26 . 1 1 13 13 LEU HA H 13 4.168 4.168 4.236 -0.068 19765 1124 1 26 . 1 1 13 13 LEU H H 13 8.496 8.496 8.059 0.437 19765 1125 1 26 . 1 1 14 14 LEU HA H 14 4.207 4.207 4.055 0.152 19765 1126 1 26 . 1 1 14 14 LEU H H 14 8.054 8.054 7.963 0.091 19765 1127 1 26 . 1 1 15 15 VAL HA H 15 3.634 3.634 3.760 -0.126 19765 1128 1 26 . 1 1 15 15 VAL H H 15 8.012 8.012 7.296 0.716 19765 1129 1 26 . 1 1 16 16 PHE HA H 16 4.592 4.592 4.140 0.452 19765 1130 1 26 . 1 1 16 16 PHE H H 16 8.478 8.478 8.778 -0.300 19765 1131 1 26 . 1 1 17 17 GLY H H 17 8.130 8.130 8.073 0.057 19765 1132 1 26 . 1 1 18 18 GLU HA H 18 4.322 4.322 4.180 0.142 19765 1133 1 26 . 1 1 18 18 GLU H H 18 8.322 8.322 7.794 0.528 19765 1134 1 26 . 1 1 19 19 ASN HA H 19 4.793 4.793 4.561 0.232 19765 1135 1 26 . 1 1 19 19 ASN H H 19 8.131 8.131 7.469 0.662 19765 1136 1 26 . 1 1 20 20 GLY H H 20 8.215 8.215 7.687 0.528 19765 1137 1 26 . 1 1 21 21 VAL HA H 21 3.923 3.923 3.803 0.120 19765 1138 1 26 . 1 1 21 21 VAL H H 21 7.762 7.762 8.293 -0.531 19765 1139 1 26 . 1 1 22 22 PHE HA H 22 4.476 4.476 4.279 0.197 19765 1140 1 26 . 1 1 22 22 PHE H H 22 7.814 7.814 7.748 0.066 19765 1141 1 26 . 1 1 23 23 PHE HA H 23 4.499 4.499 4.595 -0.096 19765 1142 1 26 . 1 1 23 23 PHE H H 23 7.706 7.706 7.955 -0.249 19765 1143 1 26 . 1 1 24 24 TYR HA H 24 4.370 4.370 4.693 -0.323 19765 1144 1 26 . 1 1 24 24 TYR H H 24 7.647 7.647 7.629 0.018 19765 1145 1 27 . 1 1 2 2 ALA HA H 2 4.491 4.491 4.333 0.158 19765 1146 1 27 . 1 1 2 2 ALA H H 2 8.753 8.753 6.935 1.818 19765 1147 1 27 . 1 1 3 3 TRP HA H 3 4.704 4.704 4.263 0.441 19765 1148 1 27 . 1 1 3 3 TRP H H 3 8.325 8.325 8.466 -0.141 19765 1149 1 27 . 1 1 4 4 TYR HA H 4 4.486 4.486 4.113 0.373 19765 1150 1 27 . 1 1 4 4 TYR H H 4 7.159 7.159 8.493 -1.334 19765 1151 1 27 . 1 1 5 5 SER HA H 5 4.275 4.275 4.440 -0.165 19765 1152 1 27 . 1 1 5 5 SER H H 5 7.889 7.889 8.180 -0.291 19765 1153 1 27 . 1 1 6 6 HIS HA H 6 4.526 4.526 4.606 -0.080 19765 1154 1 27 . 1 1 6 6 HIS H H 6 8.380 8.380 8.010 0.370 19765 1155 1 27 . 1 1 7 7 TYR HA H 7 4.416 4.416 4.330 0.086 19765 1156 1 27 . 1 1 7 7 TYR H H 7 7.851 7.851 8.550 -0.699 19765 1157 1 27 . 1 1 8 8 VAL HA H 8 3.897 3.897 3.912 -0.015 19765 1158 1 27 . 1 1 8 8 VAL H H 8 7.692 7.692 8.060 -0.368 19765 1159 1 27 . 1 1 9 9 LEU HA H 9 4.277 4.277 4.098 0.179 19765 1160 1 27 . 1 1 9 9 LEU H H 9 7.758 7.758 7.281 0.477 19765 1161 1 27 . 1 1 10 10 LYS HA H 10 4.029 4.029 4.029 0.000 19765 1162 1 27 . 1 1 10 10 LYS H H 10 7.706 7.706 7.721 -0.015 19765 1163 1 27 . 1 1 11 11 PHE HA H 11 4.302 4.302 4.187 0.115 19765 1164 1 27 . 1 1 11 11 PHE H H 11 7.846 7.846 8.744 -0.898 19765 1165 1 27 . 1 1 12 12 PHE HA H 12 4.251 4.251 4.238 0.013 19765 1166 1 27 . 1 1 12 12 PHE H H 12 8.361 8.361 8.753 -0.392 19765 1167 1 27 . 1 1 13 13 LEU HA H 13 4.168 4.168 3.739 0.429 19765 1168 1 27 . 1 1 13 13 LEU H H 13 8.496 8.496 7.851 0.645 19765 1169 1 27 . 1 1 14 14 LEU HA H 14 4.207 4.207 3.847 0.360 19765 1170 1 27 . 1 1 14 14 LEU H H 14 8.054 8.054 7.672 0.382 19765 1171 1 27 . 1 1 15 15 VAL HA H 15 3.634 3.634 3.470 0.164 19765 1172 1 27 . 1 1 15 15 VAL H H 15 8.012 8.012 7.754 0.258 19765 1173 1 27 . 1 1 16 16 PHE HA H 16 4.592 4.592 3.972 0.620 19765 1174 1 27 . 1 1 16 16 PHE H H 16 8.478 8.478 8.110 0.368 19765 1175 1 27 . 1 1 17 17 GLY H H 17 8.130 8.130 8.139 -0.009 19765 1176 1 27 . 1 1 18 18 GLU HA H 18 4.322 4.322 4.049 0.273 19765 1177 1 27 . 1 1 18 18 GLU H H 18 8.322 8.322 7.880 0.442 19765 1178 1 27 . 1 1 19 19 ASN HA H 19 4.793 4.793 4.497 0.296 19765 1179 1 27 . 1 1 19 19 ASN H H 19 8.131 8.131 7.801 0.330 19765 1180 1 27 . 1 1 20 20 GLY H H 20 8.215 8.215 7.651 0.564 19765 1181 1 27 . 1 1 21 21 VAL HA H 21 3.923 3.923 3.855 0.068 19765 1182 1 27 . 1 1 21 21 VAL H H 21 7.762 7.762 8.366 -0.604 19765 1183 1 27 . 1 1 22 22 PHE HA H 22 4.476 4.476 4.339 0.137 19765 1184 1 27 . 1 1 22 22 PHE H H 22 7.814 7.814 8.369 -0.555 19765 1185 1 27 . 1 1 23 23 PHE HA H 23 4.499 4.499 4.612 -0.113 19765 1186 1 27 . 1 1 23 23 PHE H H 23 7.706 7.706 7.539 0.167 19765 1187 1 27 . 1 1 24 24 TYR HA H 24 4.370 4.370 4.671 -0.301 19765 1188 1 27 . 1 1 24 24 TYR H H 24 7.647 7.647 7.749 -0.102 19765 1189 1 28 . 1 1 2 2 ALA HA H 2 4.491 4.491 4.600 -0.109 19765 1190 1 28 . 1 1 2 2 ALA H H 2 8.753 8.753 8.547 0.206 19765 1191 1 28 . 1 1 3 3 TRP HA H 3 4.704 4.704 4.376 0.328 19765 1192 1 28 . 1 1 3 3 TRP H H 3 8.325 8.325 8.247 0.078 19765 1193 1 28 . 1 1 4 4 TYR HA H 4 4.486 4.486 4.840 -0.354 19765 1194 1 28 . 1 1 4 4 TYR H H 4 7.159 7.159 8.324 -1.165 19765 1195 1 28 . 1 1 5 5 SER HA H 5 4.275 4.275 4.461 -0.186 19765 1196 1 28 . 1 1 5 5 SER H H 5 7.889 7.889 7.997 -0.108 19765 1197 1 28 . 1 1 6 6 HIS HA H 6 4.526 4.526 4.314 0.212 19765 1198 1 28 . 1 1 6 6 HIS H H 6 8.380 8.380 7.228 1.152 19765 1199 1 28 . 1 1 7 7 TYR HA H 7 4.416 4.416 4.272 0.144 19765 1200 1 28 . 1 1 7 7 TYR H H 7 7.851 7.851 7.870 -0.019 19765 1201 1 28 . 1 1 8 8 VAL HA H 8 3.897 3.897 3.894 0.003 19765 1202 1 28 . 1 1 8 8 VAL H H 8 7.692 7.692 8.025 -0.333 19765 1203 1 28 . 1 1 9 9 LEU HA H 9 4.277 4.277 4.032 0.245 19765 1204 1 28 . 1 1 9 9 LEU H H 9 7.758 7.758 7.150 0.608 19765 1205 1 28 . 1 1 10 10 LYS HA H 10 4.029 4.029 4.020 0.009 19765 1206 1 28 . 1 1 10 10 LYS H H 10 7.706 7.706 7.940 -0.234 19765 1207 1 28 . 1 1 11 11 PHE HA H 11 4.302 4.302 4.182 0.120 19765 1208 1 28 . 1 1 11 11 PHE H H 11 7.846 7.846 8.332 -0.486 19765 1209 1 28 . 1 1 12 12 PHE HA H 12 4.251 4.251 4.089 0.162 19765 1210 1 28 . 1 1 12 12 PHE H H 12 8.361 8.361 8.136 0.225 19765 1211 1 28 . 1 1 13 13 LEU HA H 13 4.168 4.168 4.155 0.013 19765 1212 1 28 . 1 1 13 13 LEU H H 13 8.496 8.496 7.827 0.669 19765 1213 1 28 . 1 1 14 14 LEU HA H 14 4.207 4.207 4.053 0.154 19765 1214 1 28 . 1 1 14 14 LEU H H 14 8.054 8.054 8.008 0.046 19765 1215 1 28 . 1 1 15 15 VAL HA H 15 3.634 3.634 3.803 -0.169 19765 1216 1 28 . 1 1 15 15 VAL H H 15 8.012 8.012 7.716 0.296 19765 1217 1 28 . 1 1 16 16 PHE HA H 16 4.592 4.592 4.189 0.403 19765 1218 1 28 . 1 1 16 16 PHE H H 16 8.478 8.478 8.087 0.391 19765 1219 1 28 . 1 1 17 17 GLY H H 17 8.130 8.130 8.050 0.080 19765 1220 1 28 . 1 1 18 18 GLU HA H 18 4.322 4.322 4.174 0.148 19765 1221 1 28 . 1 1 18 18 GLU H H 18 8.322 8.322 7.831 0.491 19765 1222 1 28 . 1 1 19 19 ASN HA H 19 4.793 4.793 4.448 0.345 19765 1223 1 28 . 1 1 19 19 ASN H H 19 8.131 8.131 7.859 0.272 19765 1224 1 28 . 1 1 20 20 GLY H H 20 8.215 8.215 7.611 0.604 19765 1225 1 28 . 1 1 21 21 VAL HA H 21 3.923 3.923 4.182 -0.259 19765 1226 1 28 . 1 1 21 21 VAL H H 21 7.762 7.762 8.457 -0.695 19765 1227 1 28 . 1 1 22 22 PHE HA H 22 4.476 4.476 4.669 -0.193 19765 1228 1 28 . 1 1 22 22 PHE H H 22 7.814 7.814 7.960 -0.146 19765 1229 1 28 . 1 1 23 23 PHE HA H 23 4.499 4.499 4.696 -0.197 19765 1230 1 28 . 1 1 23 23 PHE H H 23 7.706 7.706 7.852 -0.146 19765 1231 1 28 . 1 1 24 24 TYR HA H 24 4.370 4.370 4.617 -0.247 19765 1232 1 28 . 1 1 24 24 TYR H H 24 7.647 7.647 8.100 -0.453 19765 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 19765 2 1 1 "Average Difference" HA 25 0.262 -0.100 0.247 19765 3 1 1 "Average Difference" C 0 0.000 0.000 0.000 19765 4 1 1 "Average Difference" CA 0 0.000 0.000 0.000 19765 5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 19765 6 1 1 "Average Difference" HN 23 0.444 0.027 0.453 19765 7 1 2 "Average Difference" N 0 0.000 0.000 0.000 19765 8 1 2 "Average Difference" HA 25 0.233 -0.088 0.220 19765 9 1 2 "Average Difference" C 0 0.000 0.000 0.000 19765 10 1 2 "Average Difference" CA 0 0.000 0.000 0.000 19765 11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 19765 12 1 2 "Average Difference" HN 23 0.401 0.067 0.405 19765 13 1 3 "Average Difference" N 0 0.000 0.000 0.000 19765 14 1 3 "Average Difference" HA 25 0.289 -0.123 0.267 19765 15 1 3 "Average Difference" C 0 0.000 0.000 0.000 19765 16 1 3 "Average Difference" CA 0 0.000 0.000 0.000 19765 17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 19765 18 1 3 "Average Difference" HN 23 0.489 -0.006 0.500 19765 19 1 4 "Average Difference" N 0 0.000 0.000 0.000 19765 20 1 4 "Average Difference" HA 25 0.287 -0.115 0.268 19765 21 1 4 "Average Difference" C 0 0.000 0.000 0.000 19765 22 1 4 "Average Difference" CA 0 0.000 0.000 0.000 19765 23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 19765 24 1 4 "Average Difference" HN 23 0.486 0.056 0.494 19765 25 1 5 "Average Difference" N 0 0.000 0.000 0.000 19765 26 1 5 "Average Difference" HA 25 0.267 -0.096 0.254 19765 27 1 5 "Average Difference" C 0 0.000 0.000 0.000 19765 28 1 5 "Average Difference" CA 0 0.000 0.000 0.000 19765 29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 19765 30 1 5 "Average Difference" HN 23 0.447 -0.026 0.457 19765 31 1 6 "Average Difference" N 0 0.000 0.000 0.000 19765 32 1 6 "Average Difference" HA 25 0.211 -0.014 0.215 19765 33 1 6 "Average Difference" C 0 0.000 0.000 0.000 19765 34 1 6 "Average Difference" CA 0 0.000 0.000 0.000 19765 35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 19765 36 1 6 "Average Difference" HN 23 0.511 0.051 0.520 19765 37 1 7 "Average Difference" N 0 0.000 0.000 0.000 19765 38 1 7 "Average Difference" HA 25 0.255 -0.034 0.258 19765 39 1 7 "Average Difference" C 0 0.000 0.000 0.000 19765 40 1 7 "Average Difference" CA 0 0.000 0.000 0.000 19765 41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 19765 42 1 7 "Average Difference" HN 23 0.467 0.086 0.469 19765 43 1 8 "Average Difference" N 0 0.000 0.000 0.000 19765 44 1 8 "Average Difference" HA 25 0.256 -0.115 0.234 19765 45 1 8 "Average Difference" C 0 0.000 0.000 0.000 19765 46 1 8 "Average Difference" CA 0 0.000 0.000 0.000 19765 47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 19765 48 1 8 "Average Difference" HN 23 0.285 -0.064 0.284 19765 49 1 9 "Average Difference" N 0 0.000 0.000 0.000 19765 50 1 9 "Average Difference" HA 25 0.264 -0.120 0.240 19765 51 1 9 "Average Difference" C 0 0.000 0.000 0.000 19765 52 1 9 "Average Difference" CA 0 0.000 0.000 0.000 19765 53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 19765 54 1 9 "Average Difference" HN 23 0.455 0.056 0.462 19765 55 1 10 "Average Difference" N 0 0.000 0.000 0.000 19765 56 1 10 "Average Difference" HA 25 0.255 -0.123 0.228 19765 57 1 10 "Average Difference" C 0 0.000 0.000 0.000 19765 58 1 10 "Average Difference" CA 0 0.000 0.000 0.000 19765 59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 19765 60 1 10 "Average Difference" HN 23 0.356 0.002 0.364 19765 61 1 11 "Average Difference" N 0 0.000 0.000 0.000 19765 62 1 11 "Average Difference" HA 25 0.278 -0.104 0.263 19765 63 1 11 "Average Difference" C 0 0.000 0.000 0.000 19765 64 1 11 "Average Difference" CA 0 0.000 0.000 0.000 19765 65 1 11 "Average Difference" CB 0 0.000 0.000 0.000 19765 66 1 11 "Average Difference" HN 23 0.515 -0.029 0.525 19765 67 1 12 "Average Difference" N 0 0.000 0.000 0.000 19765 68 1 12 "Average Difference" HA 25 0.238 -0.085 0.226 19765 69 1 12 "Average Difference" C 0 0.000 0.000 0.000 19765 70 1 12 "Average Difference" CA 0 0.000 0.000 0.000 19765 71 1 12 "Average Difference" CB 0 0.000 0.000 0.000 19765 72 1 12 "Average Difference" HN 23 0.459 0.058 0.465 19765 73 1 13 "Average Difference" N 0 0.000 0.000 0.000 19765 74 1 13 "Average Difference" HA 25 0.252 -0.116 0.228 19765 75 1 13 "Average Difference" C 0 0.000 0.000 0.000 19765 76 1 13 "Average Difference" CA 0 0.000 0.000 0.000 19765 77 1 13 "Average Difference" CB 0 0.000 0.000 0.000 19765 78 1 13 "Average Difference" HN 23 0.569 0.023 0.582 19765 79 1 14 "Average Difference" N 0 0.000 0.000 0.000 19765 80 1 14 "Average Difference" HA 25 0.331 -0.244 0.229 19765 81 1 14 "Average Difference" C 0 0.000 0.000 0.000 19765 82 1 14 "Average Difference" CA 0 0.000 0.000 0.000 19765 83 1 14 "Average Difference" CB 0 0.000 0.000 0.000 19765 84 1 14 "Average Difference" HN 23 0.427 -0.024 0.436 19765 85 1 15 "Average Difference" N 0 0.000 0.000 0.000 19765 86 1 15 "Average Difference" HA 25 0.300 -0.112 0.284 19765 87 1 15 "Average Difference" C 0 0.000 0.000 0.000 19765 88 1 15 "Average Difference" CA 0 0.000 0.000 0.000 19765 89 1 15 "Average Difference" CB 0 0.000 0.000 0.000 19765 90 1 15 "Average Difference" HN 23 0.446 0.025 0.455 19765 91 1 16 "Average Difference" N 0 0.000 0.000 0.000 19765 92 1 16 "Average Difference" HA 25 0.253 -0.151 0.207 19765 93 1 16 "Average Difference" C 0 0.000 0.000 0.000 19765 94 1 16 "Average Difference" CA 0 0.000 0.000 0.000 19765 95 1 16 "Average Difference" CB 0 0.000 0.000 0.000 19765 96 1 16 "Average Difference" HN 23 0.471 0.014 0.481 19765 97 1 17 "Average Difference" N 0 0.000 0.000 0.000 19765 98 1 17 "Average Difference" HA 25 0.291 -0.203 0.214 19765 99 1 17 "Average Difference" C 0 0.000 0.000 0.000 19765 100 1 17 "Average Difference" CA 0 0.000 0.000 0.000 19765 101 1 17 "Average Difference" CB 0 0.000 0.000 0.000 19765 102 1 17 "Average Difference" HN 23 0.493 0.092 0.495 19765 103 1 18 "Average Difference" N 0 0.000 0.000 0.000 19765 104 1 18 "Average Difference" HA 25 0.227 -0.064 0.222 19765 105 1 18 "Average Difference" C 0 0.000 0.000 0.000 19765 106 1 18 "Average Difference" CA 0 0.000 0.000 0.000 19765 107 1 18 "Average Difference" CB 0 0.000 0.000 0.000 19765 108 1 18 "Average Difference" HN 23 0.382 -0.104 0.375 19765 109 1 19 "Average Difference" N 0 0.000 0.000 0.000 19765 110 1 19 "Average Difference" HA 25 0.247 -0.117 0.222 19765 111 1 19 "Average Difference" C 0 0.000 0.000 0.000 19765 112 1 19 "Average Difference" CA 0 0.000 0.000 0.000 19765 113 1 19 "Average Difference" CB 0 0.000 0.000 0.000 19765 114 1 19 "Average Difference" HN 23 0.417 -0.022 0.426 19765 115 1 20 "Average Difference" N 0 0.000 0.000 0.000 19765 116 1 20 "Average Difference" HA 25 0.282 -0.155 0.240 19765 117 1 20 "Average Difference" C 0 0.000 0.000 0.000 19765 118 1 20 "Average Difference" CA 0 0.000 0.000 0.000 19765 119 1 20 "Average Difference" CB 0 0.000 0.000 0.000 19765 120 1 20 "Average Difference" HN 23 0.588 -0.067 0.597 19765 121 1 21 "Average Difference" N 0 0.000 0.000 0.000 19765 122 1 21 "Average Difference" HA 25 0.202 -0.095 0.181 19765 123 1 21 "Average Difference" C 0 0.000 0.000 0.000 19765 124 1 21 "Average Difference" CA 0 0.000 0.000 0.000 19765 125 1 21 "Average Difference" CB 0 0.000 0.000 0.000 19765 126 1 21 "Average Difference" HN 23 0.528 -0.149 0.518 19765 127 1 22 "Average Difference" N 0 0.000 0.000 0.000 19765 128 1 22 "Average Difference" HA 25 0.273 -0.143 0.238 19765 129 1 22 "Average Difference" C 0 0.000 0.000 0.000 19765 130 1 22 "Average Difference" CA 0 0.000 0.000 0.000 19765 131 1 22 "Average Difference" CB 0 0.000 0.000 0.000 19765 132 1 22 "Average Difference" HN 23 0.394 0.110 0.387 19765 133 1 23 "Average Difference" N 0 0.000 0.000 0.000 19765 134 1 23 "Average Difference" HA 25 0.330 -0.127 0.311 19765 135 1 23 "Average Difference" C 0 0.000 0.000 0.000 19765 136 1 23 "Average Difference" CA 0 0.000 0.000 0.000 19765 137 1 23 "Average Difference" CB 0 0.000 0.000 0.000 19765 138 1 23 "Average Difference" HN 23 0.470 0.018 0.480 19765 139 1 24 "Average Difference" N 0 0.000 0.000 0.000 19765 140 1 24 "Average Difference" HA 25 0.257 -0.106 0.239 19765 141 1 24 "Average Difference" C 0 0.000 0.000 0.000 19765 142 1 24 "Average Difference" CA 0 0.000 0.000 0.000 19765 143 1 24 "Average Difference" CB 0 0.000 0.000 0.000 19765 144 1 24 "Average Difference" HN 23 0.498 -0.063 0.505 19765 145 1 25 "Average Difference" N 0 0.000 0.000 0.000 19765 146 1 25 "Average Difference" HA 25 0.190 -0.033 0.191 19765 147 1 25 "Average Difference" C 0 0.000 0.000 0.000 19765 148 1 25 "Average Difference" CA 0 0.000 0.000 0.000 19765 149 1 25 "Average Difference" CB 0 0.000 0.000 0.000 19765 150 1 25 "Average Difference" HN 23 0.640 -0.025 0.654 19765 151 1 26 "Average Difference" N 0 0.000 0.000 0.000 19765 152 1 26 "Average Difference" HA 25 0.227 -0.088 0.214 19765 153 1 26 "Average Difference" C 0 0.000 0.000 0.000 19765 154 1 26 "Average Difference" CA 0 0.000 0.000 0.000 19765 155 1 26 "Average Difference" CB 0 0.000 0.000 0.000 19765 156 1 26 "Average Difference" HN 23 0.483 -0.037 0.492 19765 157 1 27 "Average Difference" N 0 0.000 0.000 0.000 19765 158 1 27 "Average Difference" HA 25 0.282 -0.171 0.229 19765 159 1 27 "Average Difference" C 0 0.000 0.000 0.000 19765 160 1 27 "Average Difference" CA 0 0.000 0.000 0.000 19765 161 1 27 "Average Difference" CB 0 0.000 0.000 0.000 19765 162 1 27 "Average Difference" HN 23 0.634 -0.018 0.648 19765 163 1 28 "Average Difference" N 0 0.000 0.000 0.000 19765 164 1 28 "Average Difference" HA 25 0.220 -0.042 0.220 19765 165 1 28 "Average Difference" C 0 0.000 0.000 0.000 19765 166 1 28 "Average Difference" CA 0 0.000 0.000 0.000 19765 167 1 28 "Average Difference" CB 0 0.000 0.000 0.000 19765 168 1 28 "Average Difference" HN 23 0.497 -0.058 0.504 19765 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 19765 _Entity_delta_chem_shifts.ID 2 _Entity_delta_chem_shifts.Details ; This saveframe contains the averaged SPARTA chemical shift over all the models used. ; loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 . 1 1 2 2 ALA HA H 2 4.491 4.491 4.442 0.049 19765 2 1 . 1 1 2 2 ALA H H 2 8.753 8.753 8.219 0.534 19765 3 1 . 1 1 3 3 TRP HA H 3 4.704 4.704 4.632 0.072 19765 4 1 . 1 1 3 3 TRP H H 3 8.325 8.325 8.527 -0.202 19765 5 1 . 1 1 4 4 TYR HA H 4 4.486 4.486 4.770 -0.284 19765 6 1 . 1 1 4 4 TYR H H 4 7.159 7.159 7.967 -0.808 19765 7 1 . 1 1 5 5 SER HA H 5 4.275 4.275 4.220 0.055 19765 8 1 . 1 1 5 5 SER H H 5 7.889 7.889 8.142 -0.253 19765 9 1 . 1 1 6 6 HIS HA H 6 4.526 4.526 4.471 0.055 19765 10 1 . 1 1 6 6 HIS H H 6 8.380 8.380 8.107 0.273 19765 11 1 . 1 1 7 7 TYR HA H 7 4.416 4.416 4.256 0.160 19765 12 1 . 1 1 7 7 TYR H H 7 7.851 7.851 8.084 -0.233 19765 13 1 . 1 1 8 8 VAL HA H 8 3.897 3.897 3.886 0.011 19765 14 1 . 1 1 8 8 VAL H H 8 7.692 7.692 8.000 -0.308 19765 15 1 . 1 1 9 9 LEU HA H 9 4.277 4.277 4.070 0.207 19765 16 1 . 1 1 9 9 LEU H H 9 7.758 7.758 7.456 0.302 19765 17 1 . 1 1 10 10 LYS HA H 10 4.029 4.029 4.001 0.028 19765 18 1 . 1 1 10 10 LYS H H 10 7.706 7.706 7.972 -0.266 19765 19 1 . 1 1 11 11 PHE HA H 11 4.302 4.302 4.207 0.095 19765 20 1 . 1 1 11 11 PHE H H 11 7.846 7.846 8.356 -0.510 19765 21 1 . 1 1 12 12 PHE HA H 12 4.251 4.251 4.130 0.121 19765 22 1 . 1 1 12 12 PHE H H 12 8.361 8.361 8.206 0.155 19765 23 1 . 1 1 13 13 LEU HA H 13 4.168 4.168 4.082 0.086 19765 24 1 . 1 1 13 13 LEU H H 13 8.496 8.496 8.138 0.358 19765 25 1 . 1 1 14 14 LEU HA H 14 4.207 4.207 4.025 0.182 19765 26 1 . 1 1 14 14 LEU H H 14 8.054 8.054 7.787 0.267 19765 27 1 . 1 1 15 15 VAL HA H 15 3.634 3.634 3.557 0.077 19765 28 1 . 1 1 15 15 VAL H H 15 8.012 8.012 7.671 0.341 19765 29 1 . 1 1 16 16 PHE HA H 16 4.592 4.592 4.137 0.455 19765 30 1 . 1 1 16 16 PHE H H 16 8.478 8.478 8.400 0.078 19765 31 1 . 1 1 17 17 GLY H H 17 8.130 8.130 8.100 0.030 19765 32 1 . 1 1 18 18 GLU HA H 18 4.322 4.322 4.076 0.246 19765 33 1 . 1 1 18 18 GLU H H 18 8.322 8.322 7.894 0.428 19765 34 1 . 1 1 19 19 ASN HA H 19 4.793 4.793 4.516 0.277 19765 35 1 . 1 1 19 19 ASN H H 19 8.131 8.131 7.829 0.302 19765 36 1 . 1 1 20 20 GLY H H 20 8.215 8.215 7.635 0.580 19765 37 1 . 1 1 21 21 VAL HA H 21 3.923 3.923 3.905 0.018 19765 38 1 . 1 1 21 21 VAL H H 21 7.762 7.762 8.348 -0.586 19765 39 1 . 1 1 22 22 PHE HA H 22 4.476 4.476 4.357 0.119 19765 40 1 . 1 1 22 22 PHE H H 22 7.814 7.814 7.960 -0.146 19765 41 1 . 1 1 23 23 PHE HA H 23 4.499 4.499 4.582 -0.083 19765 42 1 . 1 1 23 23 PHE H H 23 7.706 7.706 7.771 -0.065 19765 43 1 . 1 1 24 24 TYR HA H 24 4.370 4.370 4.539 -0.169 19765 44 1 . 1 1 24 24 TYR H H 24 7.647 7.647 7.911 -0.264 19765 stop_ save_