NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
26319 | 2ki8 | 16267 | cing | 1-original | 4 | MR format | nomenclature mapping |
#Orientation Magnitude Rhombicity ORI residue number 1 5.50 0.52 158 # First atom Second atom RDC Error Weight Orientation 24 LEU H 24 LEU N -2.742 1.500 1.000 1 25 GLU H 25 GLU N -8.083 1.500 1.000 1 26 VAL H 26 VAL N -7.021 1.500 1.000 1 28 VAL H 28 VAL N -4.436 1.500 1.000 1 29 ILE H 29 ILE N -0.606 1.500 1.000 1 30 SER H 30 SER N 9.039 1.500 1.000 1 31 GLY H 31 GLY N 9.364 1.500 1.000 1 45 THR H 45 THR N 8.923 1.500 1.000 1 49 PHE H 49 PHE N 0.032 1.500 1.000 1 50 ASN H 50 ASN N -1.404 1.500 1.000 1 51 ALA H 51 ALA N -7.648 1.500 1.000 1 52 VAL H 52 VAL N 6.347 1.500 1.000 1 53 ASN H 53 ASN N -1.087 1.500 1.000 1 54 TYR H 54 TYR N 7.776 1.500 1.000 1 55 ALA H 55 ALA N 7.242 1.500 1.000 1 56 GLU H 56 GLU N 0.891 1.500 1.000 1 57 ILE H 57 ILE N 3.405 1.500 1.000 1 58 ASN H 58 ASN N -4.259 1.500 1.000 1 59 GLU H 59 GLU N 4.665 1.500 1.000 1 60 GLU H 60 GLU N 9.215 1.500 1.000 1 61 ASP H 61 ASP N 5.306 1.500 1.000 1 62 TRP H 62 TRP N 7.689 1.500 1.000 1 63 ASN H 63 ASN N 10.936 1.500 1.000 1 64 ALA H 64 ALA N 9.609 1.500 1.000 1 65 LEU H 65 LEU N 6.145 1.500 1.000 1 66 GLY H 66 GLY N 5.684 1.500 1.000 1 67 LEU H 67 LEU N 11.177 1.500 1.000 1 68 GLN H 68 GLN N -7.450 1.500 1.000 1 69 GLU H 69 GLU N -9.700 1.500 1.000 1 70 GLY H 70 GLY N 11.991 1.500 1.000 1 71 ASP H 71 ASP N -6.163 1.500 1.000 1 72 ARG H 72 ARG N 6.621 1.500 1.000 1 73 VAL H 73 VAL N -2.879 1.500 1.000 1 74 LYS H 74 LYS N -7.100 1.500 1.000 1 75 VAL H 75 VAL N -4.452 1.500 1.000 1 76 LYS H 76 LYS N -8.862 1.500 1.000 1 77 THR H 77 THR N -3.112 1.500 1.000 1 78 GLU H 78 GLU N 4.417 1.500 1.000 1 79 PHE H 79 PHE N -7.969 1.500 1.000 1 80 GLY H 80 GLY N -7.233 1.500 1.000 1 81 GLU H 81 GLU N -6.622 1.500 1.000 1 82 VAL H 82 VAL N -6.601 1.500 1.000 1 83 VAL H 83 VAL N -7.267 1.500 1.000 1 84 VAL H 84 VAL N -4.832 1.500 1.000 1 85 PHE H 85 PHE N -2.192 1.500 1.000 1 87 LYS H 87 LYS N 3.117 1.500 1.000 1 88 LYS H 88 LYS N 4.856 1.500 1.000 1 89 GLY H 89 GLY N -1.162 1.500 1.000 1 91 VAL H 91 VAL N 4.300 1.500 1.000 1 93 LYS H 93 LYS N -4.577 1.500 1.000 1 94 GLY H 94 GLY N 9.848 1.500 1.000 1 95 MET H 95 MET N -7.757 1.500 1.000 1 96 ILE H 96 ILE N -4.150 1.500 1.000 1 98 ILE H 98 ILE N 7.149 1.500 1.000 1 100 MET H 100 MET N 4.567 1.500 1.000 1 101 GLY H 101 GLY N 0.212 1.500 1.000 1 103 TYR H 103 TYR N -0.976 1.500 1.000 1 105 ASN H 105 ASN N 0.206 1.500 1.000 1 106 MET H 106 MET N -4.802 1.500 1.000 1 121 LYS H 121 LYS N -2.966 1.500 1.000 1 122 GLY H 122 GLY N -1.536 1.500 1.000 1 123 VAL H 123 VAL N 1.333 1.500 1.000 1 124 LYS H 124 LYS N -0.545 1.500 1.000 1 125 GLY H 125 GLY N -8.613 1.500 1.000 1 126 THR H 126 THR N -7.292 1.500 1.000 1 127 VAL H 127 VAL N -5.764 1.500 1.000 1 129 LYS H 129 LYS N -6.090 1.500 1.000 1 130 THR H 130 THR N -0.657 1.500 1.000 1 131 ASP H 131 ASP N -2.029 1.500 1.000 1 132 GLU H 132 GLU N 5.284 1.500 1.000 1 133 LYS H 133 LYS N -2.235 1.500 1.000 1 134 VAL H 134 VAL N -1.899 1.500 1.000 1 135 LEU H 135 LEU N 8.034 1.500 1.000 1 137 VAL H 137 VAL N -3.796 1.500 1.000 1 138 LYS H 138 LYS N -2.040 1.500 1.000 1 139 GLU H 139 GLU N -9.628 1.500 1.000 1 140 LEU H 140 LEU N -4.847 1.500 1.000 1 141 LEU H 141 LEU N -1.087 1.500 1.000 1 142 GLU H 142 GLU N -4.304 1.500 1.000 1 143 ALA H 143 ALA N -5.404 1.500 1.000 1 144 ILE H 144 ILE N -0.348 1.500 1.000 1 Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 H1 MET 1 -23.260 -7.652 57.778 2 H2 MET 1 H2 MET 1 -24.239 -8.988 57.437 3 H3 MET 1 H3 MET 1 -23.214 -8.363 56.249 4 HA MET 1 HA MET 1 -21.274 -8.971 57.563 5 HB2 MET 1 HB2 MET 1 -23.357 -10.209 59.382 6 HB3 MET 1 HB3 MET 1 -21.629 -10.504 59.506 7 HG2 MET 1 HG2 MET 1 -21.241 -8.166 60.027 8 HG3 MET 1 HG3 MET 1 -22.959 -7.819 59.828 9 HE1 MET 1 HE1 MET 1 -24.850 -8.655 61.480 10 HE2 MET 1 HE2 MET 1 -24.558 -9.754 62.828 11 HE3 MET 1 HE3 MET 1 -24.357 -10.322 61.170 12 H GLY 2 H GLY 2 -20.583 -11.415 57.865 13 HA2 GLY 2 HA2 GLY 2 -20.632 -13.622 57.137 14 HA3 GLY 2 HA3 GLY 2 -22.190 -13.322 56.388 15 H SER 3 H SER 3 -19.138 -14.205 55.703 16 HA SER 3 HA SER 3 -19.481 -13.662 52.887 17 HB2 SER 3 HB2 SER 3 -17.282 -12.568 52.568 18 HB3 SER 3 HB3 SER 3 -18.362 -11.586 53.555 19 HG SER 3 HG SER 3 -17.136 -11.913 55.273 20 H SER 4 H SER 4 -18.675 -15.289 51.692 21 HA SER 4 HA SER 4 -16.408 -16.873 52.482 22 HB2 SER 4 HB2 SER 4 -17.633 -19.031 52.662 23 HB3 SER 4 HB3 SER 4 -18.085 -17.906 53.943 24 HG SER 4 HG SER 4 -20.044 -17.724 53.125 25 H HIS 5 H HIS 5 -15.461 -17.732 50.701 26 HA HIS 5 HA HIS 5 -16.897 -18.655 48.416 27 HB2 HIS 5 HB2 HIS 5 -16.068 -16.960 46.796 28 HB3 HIS 5 HB3 HIS 5 -17.204 -16.294 47.963 29 HD1 HIS 5 HD1 HIS 5 -16.338 -14.510 49.571 30 HD2 HIS 5 HD2 HIS 5 -13.401 -16.035 47.061 31 HE1 HIS 5 HE1 HIS 5 -14.361 -12.992 49.850 32 HE2 HIS 5 HE2 HIS 5 -12.548 -14.034 48.458 33 H HIS 6 H HIS 6 -15.265 -18.920 46.472 34 HA HIS 6 HA HIS 6 -12.644 -19.757 47.559 35 HB2 HIS 6 HB2 HIS 6 -14.313 -21.082 45.406 36 HB3 HIS 6 HB3 HIS 6 -12.654 -21.532 45.789 37 HD1 HIS 6 HD1 HIS 6 -12.260 -22.944 47.878 38 HD2 HIS 6 HD2 HIS 6 -16.232 -21.832 47.358 39 HE1 HIS 6 HE1 HIS 6 -13.563 -24.306 49.533 40 HE2 HIS 6 HE2 HIS 6 -15.944 -23.539 49.281 41 H HIS 7 H HIS 7 -10.823 -19.168 46.453 42 HA HIS 7 HA HIS 7 -11.184 -17.653 43.937 43 HB2 HIS 7 HB2 HIS 7 -10.658 -16.180 45.863 44 HB3 HIS 7 HB3 HIS 7 -9.181 -17.095 46.144 45 HD1 HIS 7 HD1 HIS 7 -10.760 -14.874 43.515 46 HD2 HIS 7 HD2 HIS 7 -7.012 -16.216 44.714 47 HE1 HIS 7 HE1 HIS 7 -9.110 -13.591 42.125 48 HE2 HIS 7 HE2 HIS 7 -6.860 -14.503 42.781 49 H HIS 8 H HIS 8 -10.108 -18.436 42.240 50 HA HIS 8 HA HIS 8 -8.066 -20.496 42.622 51 HB2 HIS 8 HB2 HIS 8 -9.207 -19.419 40.029 52 HB3 HIS 8 HB3 HIS 8 -8.256 -20.886 40.233 53 HD1 HIS 8 HD1 HIS 8 -11.362 -20.369 39.222 54 HD2 HIS 8 HD2 HIS 8 -10.016 -22.243 42.677 55 HE1 HIS 8 HE1 HIS 8 -13.216 -21.904 39.913 56 HE2 HIS 8 HE2 HIS 8 -12.470 -22.850 42.120 57 H HIS 9 H HIS 9 -6.007 -20.406 41.547 58 HA HIS 9 HA HIS 9 -5.116 -17.710 40.728 59 HB2 HIS 9 HB2 HIS 9 -4.095 -18.396 42.892 60 HB3 HIS 9 HB3 HIS 9 -3.429 -19.825 42.111 61 HD1 HIS 9 HD1 HIS 9 -2.848 -16.204 42.613 62 HD2 HIS 9 HD2 HIS 9 -1.289 -19.271 40.279 63 HE1 HIS 9 HE1 HIS 9 -0.669 -15.333 41.726 64 HE2 HIS 9 HE2 HIS 9 0.196 -17.153 40.221 65 H HIS 10 H HIS 10 -5.527 -18.108 38.540 66 HA HIS 10 HA HIS 10 -4.095 -20.380 37.319 67 HB2 HIS 10 HB2 HIS 10 -6.498 -20.607 37.106 68 HB3 HIS 10 HB3 HIS 10 -6.629 -18.990 36.423 69 HD1 HIS 10 HD1 HIS 10 -4.713 -22.173 35.539 70 HD2 HIS 10 HD2 HIS 10 -6.846 -19.103 33.724 71 HE1 HIS 10 HE1 HIS 10 -4.694 -22.698 33.090 72 HE2 HIS 10 HE2 HIS 10 -6.100 -20.908 32.030 73 H SER 11 H SER 11 -2.617 -20.031 35.827 74 HA SER 11 HA SER 11 -2.607 -17.521 34.291 75 HB2 SER 11 HB2 SER 11 -0.175 -18.773 35.616 76 HB3 SER 11 HB3 SER 11 -0.119 -17.436 34.467 77 HG SER 11 HG SER 11 -0.558 -16.139 36.045 78 H SER 12 H SER 12 -0.590 -17.943 32.526 79 HA SER 12 HA SER 12 -0.828 -20.686 31.511 80 HB2 SER 12 HB2 SER 12 -2.716 -19.487 30.483 81 HB3 SER 12 HB3 SER 12 -1.606 -18.280 29.838 82 HG SER 12 HG SER 12 -1.235 -21.016 29.243 83 H GLY 13 H GLY 13 1.037 -21.426 30.733 84 HA2 GLY 13 HA2 GLY 13 3.252 -19.635 30.150 85 HA3 GLY 13 HA3 GLY 13 3.281 -21.393 30.101 86 H ARG 14 H ARG 14 3.197 -18.576 28.242 87 HA ARG 14 HA ARG 14 2.293 -20.046 25.839 88 HB2 ARG 14 HB2 ARG 14 1.945 -17.115 26.502 89 HB3 ARG 14 HB3 ARG 14 1.528 -17.844 24.957 90 HG2 ARG 14 HG2 ARG 14 0.298 -18.581 27.613 91 HG3 ARG 14 HG3 ARG 14 -0.417 -17.491 26.424 92 HD2 ARG 14 HD2 ARG 14 0.229 -20.410 26.003 93 HD3 ARG 14 HD3 ARG 14 -1.378 -19.725 26.244 94 HE ARG 14 HE ARG 14 0.000 -18.566 24.020 95 HH11 ARG 14 HH11 ARG 14 -1.945 -21.228 25.011 96 HH12 ARG 14 HH12 ARG 14 -2.474 -21.574 23.403 97 HH21 ARG 14 HH21 ARG 14 -0.674 -19.017 21.972 98 HH22 ARG 14 HH22 ARG 14 -1.792 -20.312 21.706 99 H GLU 15 H GLU 15 3.583 -20.046 24.083 100 HA GLU 15 HA GLU 15 6.174 -18.770 24.164 101 HB2 GLU 15 HB2 GLU 15 5.905 -21.010 23.178 102 HB3 GLU 15 HB3 GLU 15 4.819 -20.354 21.961 103 HG2 GLU 15 HG2 GLU 15 6.997 -20.693 20.995 104 HG3 GLU 15 HG3 GLU 15 6.660 -18.967 21.090 105 H ASN 16 H ASN 16 6.918 -17.096 22.842 106 HA ASN 16 HA ASN 16 5.166 -15.801 20.938 107 HB2 ASN 16 HB2 ASN 16 4.319 -14.930 23.103 108 HB3 ASN 16 HB3 ASN 16 5.926 -14.309 23.468 109 HD21 ASN 16 HD21 ASN 16 3.085 -13.931 21.529 110 HD22 ASN 16 HD22 ASN 16 3.457 -12.355 20.925 111 H LEU 17 H LEU 17 6.466 -15.209 19.316 112 HA LEU 17 HA LEU 17 9.237 -14.390 19.900 113 HB2 LEU 17 HB2 LEU 17 7.967 -15.433 17.378 114 HB3 LEU 17 HB3 LEU 17 9.573 -14.727 17.421 115 HG LEU 17 HG LEU 17 10.128 -16.498 19.192 116 HD11 LEU 17 HD11 LEU 17 8.803 -18.547 19.120 117 HD12 LEU 17 HD12 LEU 17 7.628 -17.758 18.066 118 HD13 LEU 17 HD13 LEU 17 7.856 -17.186 19.719 119 HD21 LEU 17 HD21 LEU 17 10.629 -18.161 17.485 120 HD22 LEU 17 HD22 LEU 17 10.999 -16.528 16.936 121 HD23 LEU 17 HD23 LEU 17 9.544 -17.341 16.361 122 H TYR 18 H TYR 18 9.976 -12.390 19.367 123 HA TYR 18 HA TYR 18 8.028 -10.496 18.199 124 HB2 TYR 18 HB2 TYR 18 9.299 -8.741 19.527 125 HB3 TYR 18 HB3 TYR 18 8.343 -9.878 20.469 126 HD1 TYR 18 HD2 TYR 18 9.441 -11.608 21.827 127 HD2 TYR 18 HD1 TYR 18 11.723 -8.717 19.688 128 HE1 TYR 18 HE2 TYR 18 11.417 -12.183 23.171 129 HE2 TYR 18 HE1 TYR 18 13.705 -9.283 21.027 130 HH TYR 18 HH TYR 18 14.261 -10.285 23.166 131 H PHE 19 H PHE 19 8.689 -9.087 16.614 132 HA PHE 19 HA PHE 19 11.218 -9.795 15.301 133 HB2 PHE 19 HB2 PHE 19 8.830 -8.284 14.210 134 HB3 PHE 19 HB3 PHE 19 10.240 -8.794 13.286 135 HD1 PHE 19 HD1 PHE 19 10.723 -11.287 13.119 136 HD2 PHE 19 HD2 PHE 19 6.998 -9.726 14.476 137 HE1 PHE 19 HE1 PHE 19 9.649 -13.444 12.645 138 HE2 PHE 19 HE2 PHE 19 5.919 -11.885 14.001 139 HZ PHE 19 HZ PHE 19 7.245 -13.749 13.086 140 H GLN 20 H GLN 20 9.322 -6.853 16.074 141 HA GLN 20 HA GLN 20 9.878 -4.654 16.198 142 HB2 GLN 20 HB2 GLN 20 11.212 -5.484 18.114 143 HB3 GLN 20 HB3 GLN 20 12.589 -5.712 17.044 144 HG2 GLN 20 HG2 GLN 20 12.638 -3.300 16.600 145 HG3 GLN 20 HG3 GLN 20 11.261 -3.078 17.678 146 HE21 GLN 20 HE21 GLN 20 12.413 -1.727 19.049 147 HE22 GLN 20 HE22 GLN 20 13.644 -2.316 20.104 148 H GLY 21 H GLY 21 9.670 -4.183 14.009 149 HA2 GLY 21 HA2 GLY 21 11.953 -4.618 12.234 150 HA3 GLY 21 HA3 GLY 21 10.328 -4.173 11.749 151 H HIS 22 H HIS 22 11.353 -2.663 10.344 152 HA HIS 22 HA HIS 22 11.754 -0.056 11.561 153 HB2 HIS 22 HB2 HIS 22 13.891 0.206 10.077 154 HB3 HIS 22 HB3 HIS 22 14.021 -0.610 11.632 155 HD1 HIS 22 HD1 HIS 22 14.676 -3.061 11.632 156 HD2 HIS 22 HD2 HIS 22 14.090 -1.539 7.805 157 HE1 HIS 22 HE1 HIS 22 15.490 -4.845 10.067 158 HE2 HIS 22 HE2 HIS 22 15.189 -3.888 7.764 159 H MET 23 H MET 23 10.456 1.248 10.427 160 HA MET 23 HA MET 23 9.451 0.483 7.852 161 HB2 MET 23 HB2 MET 23 8.060 2.483 8.057 162 HB3 MET 23 HB3 MET 23 8.023 1.523 9.529 163 HG2 MET 23 HG2 MET 23 9.813 3.109 10.414 164 HG3 MET 23 HG3 MET 23 9.399 4.148 9.050 165 HE1 MET 23 HE1 MET 23 6.221 3.042 9.056 166 HE2 MET 23 HE2 MET 23 6.686 4.674 8.577 167 HE3 MET 23 HE3 MET 23 5.455 4.439 9.818 168 H LEU 24 H LEU 24 9.681 1.500 5.884 169 HA LEU 24 HA LEU 24 12.020 3.280 5.600 170 HB2 LEU 24 HB2 LEU 24 10.780 1.218 3.811 171 HB3 LEU 24 HB3 LEU 24 11.728 2.514 3.107 172 HG LEU 24 HG LEU 24 12.880 0.799 5.293 173 HD11 LEU 24 HD11 LEU 24 13.835 -0.665 3.597 174 HD12 LEU 24 HD12 LEU 24 12.973 0.209 2.332 175 HD13 LEU 24 HD13 LEU 24 12.073 -0.717 3.532 176 HD21 LEU 24 HD21 LEU 24 14.108 2.367 3.018 177 HD22 LEU 24 HD22 LEU 24 14.997 1.436 4.224 178 HD23 LEU 24 HD23 LEU 24 14.070 2.852 4.717 179 H GLU 25 H GLU 25 11.835 5.253 4.635 180 HA GLU 25 HA GLU 25 9.222 6.334 4.210 181 HB2 GLU 25 HB2 GLU 25 11.095 7.632 5.212 182 HB3 GLU 25 HB3 GLU 25 11.935 7.561 3.664 183 HG2 GLU 25 HG2 GLU 25 10.007 8.691 2.629 184 HG3 GLU 25 HG3 GLU 25 9.297 8.864 4.226 185 H VAL 26 H VAL 26 8.126 6.070 2.370 186 HA VAL 26 HA VAL 26 9.608 5.867 -0.176 187 HB VAL 26 HB VAL 26 7.943 4.218 -0.974 188 HG11 VAL 26 HG11 VAL 26 10.084 3.442 -0.088 189 HG12 VAL 26 HG12 VAL 26 8.799 2.292 0.278 190 HG13 VAL 26 HG13 VAL 26 9.402 3.372 1.537 191 HG21 VAL 26 HG21 VAL 26 6.980 4.215 1.897 192 HG22 VAL 26 HG22 VAL 26 6.461 3.095 0.635 193 HG23 VAL 26 HG23 VAL 26 6.086 4.813 0.500 194 H GLU 27 H GLU 27 8.391 6.461 -2.082 195 HA GLU 27 HA GLU 27 6.294 8.446 -1.542 196 HB2 GLU 27 HB2 GLU 27 8.260 9.094 -2.924 197 HB3 GLU 27 HB3 GLU 27 7.798 7.886 -4.112 198 HG2 GLU 27 HG2 GLU 27 5.724 9.082 -4.556 199 HG3 GLU 27 HG3 GLU 27 6.129 10.271 -3.317 200 H VAL 28 H VAL 28 4.312 7.678 -1.557 201 HA VAL 28 HA VAL 28 3.606 5.196 -2.862 202 HB VAL 28 HB VAL 28 1.839 7.055 -1.253 203 HG11 VAL 28 HG11 VAL 28 1.542 4.125 -1.936 204 HG12 VAL 28 HG12 VAL 28 0.599 5.453 -2.613 205 HG13 VAL 28 HG13 VAL 28 0.458 5.056 -0.901 206 HG21 VAL 28 HG21 VAL 28 2.319 5.578 0.666 207 HG22 VAL 28 HG22 VAL 28 3.761 6.413 0.088 208 HG23 VAL 28 HG23 VAL 28 3.507 4.714 -0.313 209 H ILE 29 H ILE 29 3.058 5.226 -4.957 210 HA ILE 29 HA ILE 29 1.947 7.649 -6.156 211 HB ILE 29 HB ILE 29 2.605 5.112 -7.640 212 HG12 ILE 29 HG12 ILE 29 4.568 7.333 -6.988 213 HG13 ILE 29 HG13 ILE 29 4.531 5.779 -6.162 214 HG21 ILE 29 HG21 ILE 29 2.555 8.040 -8.381 215 HG22 ILE 29 HG22 ILE 29 1.435 6.787 -8.918 216 HG23 ILE 29 HG23 ILE 29 3.115 6.752 -9.454 217 HD11 ILE 29 HD11 ILE 29 4.973 4.661 -8.304 218 HD12 ILE 29 HD12 ILE 29 6.248 5.782 -7.828 219 HD13 ILE 29 HD13 ILE 29 5.090 6.244 -9.076 220 H SER 30 H SER 30 0.128 7.504 -7.686 221 HA SER 30 HA SER 30 -1.656 5.201 -7.312 222 HB2 SER 30 HB2 SER 30 -2.461 8.092 -6.957 223 HB3 SER 30 HB3 SER 30 -3.621 6.785 -7.187 224 HG SER 30 HG SER 30 -1.824 6.141 -5.277 225 H GLY 31 H GLY 31 -1.246 4.443 -9.349 226 HA2 GLY 31 HA2 GLY 31 -1.724 6.204 -11.658 227 HA3 GLY 31 HA3 GLY 31 -1.052 4.582 -11.711 228 H ARG 32 H ARG 32 -3.503 6.092 -12.961 229 HA ARG 32 HA ARG 32 -5.772 4.674 -11.937 230 HB2 ARG 32 HB2 ARG 32 -5.942 6.935 -12.927 231 HB3 ARG 32 HB3 ARG 32 -5.521 6.269 -14.499 232 HG2 ARG 32 HG2 ARG 32 -7.556 4.923 -14.496 233 HG3 ARG 32 HG3 ARG 32 -7.967 5.529 -12.891 234 HD2 ARG 32 HD2 ARG 32 -7.708 7.197 -15.398 235 HD3 ARG 32 HD3 ARG 32 -9.222 6.683 -14.656 236 HE ARG 32 HE ARG 32 -7.333 8.366 -13.155 237 HH11 ARG 32 HH11 ARG 32 -10.445 7.900 -14.572 238 HH12 ARG 32 HH12 ARG 32 -11.109 9.314 -13.827 239 HH21 ARG 32 HH21 ARG 32 -8.210 10.180 -12.217 240 HH22 ARG 32 HH22 ARG 32 -9.863 10.589 -12.533 241 H THR 33 H THR 33 -5.058 2.466 -12.143 242 HA THR 33 HA THR 33 -5.028 1.322 -14.839 243 HB THR 33 HB THR 33 -4.567 -0.822 -13.757 244 HG1 THR 33 HG1 THR 33 -5.200 -1.115 -11.770 245 HG21 THR 33 HG21 THR 33 -2.416 -0.303 -12.704 246 HG22 THR 33 HG22 THR 33 -2.894 1.386 -12.534 247 HG23 THR 33 HG23 THR 33 -2.660 0.691 -14.140 248 H LEU 34 H LEU 34 -6.866 0.844 -11.814 249 HA LEU 34 HA LEU 34 -9.128 -0.301 -13.230 250 HB2 LEU 34 HB2 LEU 34 -8.308 -0.909 -10.862 251 HB3 LEU 34 HB3 LEU 34 -9.079 0.575 -10.341 252 HG LEU 34 HG LEU 34 -10.436 -1.493 -9.974 253 HD11 LEU 34 HD11 LEU 34 -12.550 -0.584 -10.711 254 HD12 LEU 34 HD12 LEU 34 -11.729 0.479 -11.854 255 HD13 LEU 34 HD13 LEU 34 -11.514 0.714 -10.118 256 HD21 LEU 34 HD21 LEU 34 -11.534 -2.564 -11.856 257 HD22 LEU 34 HD22 LEU 34 -9.782 -2.704 -11.993 258 HD23 LEU 34 HD23 LEU 34 -10.653 -1.529 -12.980 259 H ASN 35 H ASN 35 -10.229 1.113 -14.465 260 HA ASN 35 HA ASN 35 -10.294 3.909 -13.983 261 HB2 ASN 35 HB2 ASN 35 -11.920 2.224 -15.894 262 HB3 ASN 35 HB3 ASN 35 -11.849 3.983 -15.912 263 HD21 ASN 35 HD21 ASN 35 -10.136 1.050 -16.574 264 HD22 ASN 35 HD22 ASN 35 -8.831 1.775 -17.438 265 H GLN 36 H GLN 36 -11.823 5.228 -13.167 266 HA GLN 36 HA GLN 36 -13.784 3.969 -11.406 267 HB2 GLN 36 HB2 GLN 36 -12.697 6.788 -11.566 268 HB3 GLN 36 HB3 GLN 36 -13.920 6.272 -10.409 269 HG2 GLN 36 HG2 GLN 36 -12.371 4.713 -9.405 270 HG3 GLN 36 HG3 GLN 36 -11.154 5.093 -10.624 271 HE21 GLN 36 HE21 GLN 36 -9.695 5.723 -9.018 272 HE22 GLN 36 HE22 GLN 36 -9.853 7.218 -8.176 273 H GLY 37 H GLY 37 -15.473 6.254 -11.094 274 HA2 GLY 37 HA2 GLY 37 -17.078 7.463 -12.533 275 HA3 GLY 37 HA3 GLY 37 -17.047 6.069 -13.603 276 H ALA 38 H ALA 38 -16.869 4.523 -10.898 277 HA ALA 38 HA ALA 38 -19.704 4.673 -10.106 278 HB1 ALA 38 HB1 ALA 38 -19.899 2.258 -10.159 279 HB2 ALA 38 HB2 ALA 38 -18.223 2.103 -10.689 280 HB3 ALA 38 HB3 ALA 38 -19.422 2.846 -11.753 281 H THR 39 H THR 39 -20.061 3.248 -8.087 282 HA THR 39 HA THR 39 -17.955 3.780 -6.140 283 HB THR 39 HB THR 39 -19.518 3.034 -4.446 284 HG1 THR 39 HG1 THR 39 -21.763 2.520 -5.623 285 HG21 THR 39 HG21 THR 39 -19.838 5.311 -5.291 286 HG22 THR 39 HG22 THR 39 -21.373 4.592 -4.807 287 HG23 THR 39 HG23 THR 39 -20.953 4.706 -6.516 288 H VAL 40 H VAL 40 -17.207 2.070 -4.662 289 HA VAL 40 HA VAL 40 -16.330 -0.283 -5.926 290 HB VAL 40 HB VAL 40 -15.643 -1.072 -3.709 291 HG11 VAL 40 HG11 VAL 40 -15.133 1.876 -4.153 292 HG12 VAL 40 HG12 VAL 40 -14.210 0.533 -4.826 293 HG13 VAL 40 HG13 VAL 40 -14.190 0.831 -3.089 294 HG21 VAL 40 HG21 VAL 40 -16.128 0.245 -1.693 295 HG22 VAL 40 HG22 VAL 40 -17.602 -0.398 -2.418 296 HG23 VAL 40 HG23 VAL 40 -17.179 1.300 -2.637 297 H GLU 41 H GLU 41 -19.291 0.440 -4.240 298 HA GLU 41 HA GLU 41 -20.217 -2.248 -3.929 299 HB2 GLU 41 HB2 GLU 41 -21.160 -0.389 -2.620 300 HB3 GLU 41 HB3 GLU 41 -21.755 0.362 -4.094 301 HG2 GLU 41 HG2 GLU 41 -23.180 -1.655 -4.463 302 HG3 GLU 41 HG3 GLU 41 -22.674 -2.236 -2.877 303 H GLU 42 H GLU 42 -20.762 0.287 -6.376 304 HA GLU 42 HA GLU 42 -22.429 -1.198 -8.100 305 HB2 GLU 42 HB2 GLU 42 -22.087 1.273 -8.190 306 HB3 GLU 42 HB3 GLU 42 -20.471 1.001 -8.824 307 HG2 GLU 42 HG2 GLU 42 -21.919 1.572 -10.635 308 HG3 GLU 42 HG3 GLU 42 -21.481 -0.128 -10.791 309 H LYS 43 H LYS 43 -18.937 -0.999 -7.787 310 HA LYS 43 HA LYS 43 -18.580 -3.039 -9.884 311 HB2 LYS 43 HB2 LYS 43 -16.573 -1.230 -8.532 312 HB3 LYS 43 HB3 LYS 43 -16.166 -2.453 -9.727 313 HG2 LYS 43 HG2 LYS 43 -17.594 -1.262 -11.369 314 HG3 LYS 43 HG3 LYS 43 -17.853 0.006 -10.166 315 HD2 LYS 43 HD2 LYS 43 -15.454 0.457 -10.096 316 HD3 LYS 43 HD3 LYS 43 -15.158 -0.849 -11.245 317 HE2 LYS 43 HE2 LYS 43 -16.751 1.659 -11.781 318 HE3 LYS 43 HE3 LYS 43 -15.105 1.343 -12.330 319 HZ1 LYS 43 HZ1 LYS 43 -17.550 -0.144 -13.127 320 HZ2 LYS 43 HZ2 LYS 43 -15.981 -0.574 -13.577 321 HZ3 LYS 43 HZ3 LYS 43 -16.634 0.892 -14.099 322 H LEU 44 H LEU 44 -19.691 -3.775 -7.336 323 HA LEU 44 HA LEU 44 -17.711 -4.846 -5.605 324 HB2 LEU 44 HB2 LEU 44 -20.275 -4.375 -5.233 325 HB3 LEU 44 HB3 LEU 44 -20.471 -6.021 -5.794 326 HG LEU 44 HG LEU 44 -20.474 -5.892 -3.347 327 HD11 LEU 44 HD11 LEU 44 -17.985 -7.260 -4.355 328 HD12 LEU 44 HD12 LEU 44 -19.615 -7.928 -4.408 329 HD13 LEU 44 HD13 LEU 44 -18.844 -7.610 -2.855 330 HD21 LEU 44 HD21 LEU 44 -17.660 -4.830 -3.611 331 HD22 LEU 44 HD22 LEU 44 -18.474 -5.255 -2.105 332 HD23 LEU 44 HD23 LEU 44 -19.070 -3.913 -3.080 333 H THR 45 H THR 45 -16.269 -5.911 -7.023 334 HA THR 45 HA THR 45 -16.947 -8.719 -7.452 335 HB THR 45 HB THR 45 -17.480 -7.839 -9.632 336 HG1 THR 45 HG1 THR 45 -16.199 -9.198 -10.769 337 HG21 THR 45 HG21 THR 45 -14.732 -6.569 -9.622 338 HG22 THR 45 HG22 THR 45 -16.269 -5.710 -9.508 339 HG23 THR 45 HG23 THR 45 -15.854 -6.583 -10.983 340 H GLU 46 H GLU 46 -14.897 -9.928 -8.280 341 HA GLU 46 HA GLU 46 -12.858 -9.528 -6.351 342 HB2 GLU 46 HB2 GLU 46 -12.895 -11.260 -8.830 343 HB3 GLU 46 HB3 GLU 46 -11.625 -11.303 -7.613 344 HG2 GLU 46 HG2 GLU 46 -13.268 -11.967 -5.923 345 HG3 GLU 46 HG3 GLU 46 -14.535 -11.942 -7.149 346 H GLU 47 H GLU 47 -13.212 -8.412 -9.654 347 HA GLU 47 HA GLU 47 -10.593 -7.749 -10.305 348 HB2 GLU 47 HB2 GLU 47 -13.116 -6.196 -10.914 349 HB3 GLU 47 HB3 GLU 47 -11.562 -5.922 -11.691 350 HG2 GLU 47 HG2 GLU 47 -13.277 -8.390 -11.858 351 HG3 GLU 47 HG3 GLU 47 -12.922 -7.234 -13.137 352 H TYR 48 H TYR 48 -12.947 -5.824 -8.452 353 HA TYR 48 HA TYR 48 -11.183 -3.644 -7.968 354 HB2 TYR 48 HB2 TYR 48 -13.892 -4.100 -7.594 355 HB3 TYR 48 HB3 TYR 48 -13.287 -4.031 -5.944 356 HD1 TYR 48 HD1 TYR 48 -11.449 -1.993 -5.681 357 HD2 TYR 48 HD2 TYR 48 -14.731 -2.101 -8.396 358 HE1 TYR 48 HE1 TYR 48 -11.428 0.454 -5.795 359 HE2 TYR 48 HE2 TYR 48 -14.718 0.358 -8.517 360 HH TYR 48 HH TYR 48 -12.162 2.228 -7.450 361 H PHE 49 H PHE 49 -11.562 -6.742 -6.475 362 HA PHE 49 HA PHE 49 -10.126 -5.949 -4.049 363 HB2 PHE 49 HB2 PHE 49 -12.151 -7.412 -3.922 364 HB3 PHE 49 HB3 PHE 49 -11.264 -8.659 -4.790 365 HD1 PHE 49 HD1 PHE 49 -10.991 -6.521 -1.737 366 HD2 PHE 49 HD2 PHE 49 -10.140 -10.283 -3.556 367 HE1 PHE 49 HE1 PHE 49 -10.107 -7.358 0.403 368 HE2 PHE 49 HE2 PHE 49 -9.253 -11.118 -1.418 369 HZ PHE 49 HZ PHE 49 -9.236 -9.656 0.563 370 H ASN 50 H ASN 50 -9.228 -6.900 -7.107 371 HA ASN 50 HA ASN 50 -6.678 -7.979 -6.066 372 HB2 ASN 50 HB2 ASN 50 -8.149 -8.678 -8.603 373 HB3 ASN 50 HB3 ASN 50 -6.431 -9.015 -8.399 374 HD21 ASN 50 HD21 ASN 50 -9.642 -9.873 -7.420 375 HD22 ASN 50 HD22 ASN 50 -9.213 -11.307 -6.562 376 H ALA 51 H ALA 51 -8.174 -5.613 -8.144 377 HA ALA 51 HA ALA 51 -5.823 -4.932 -9.613 378 HB1 ALA 51 HB1 ALA 51 -8.071 -4.506 -10.479 379 HB2 ALA 51 HB2 ALA 51 -7.114 -3.025 -10.419 380 HB3 ALA 51 HB3 ALA 51 -8.347 -3.330 -9.195 381 H VAL 52 H VAL 52 -7.579 -3.059 -7.108 382 HA VAL 52 HA VAL 52 -5.252 -1.290 -6.853 383 HB VAL 52 HB VAL 52 -6.786 0.190 -5.594 384 HG11 VAL 52 HG11 VAL 52 -6.595 0.425 -8.020 385 HG12 VAL 52 HG12 VAL 52 -8.231 0.801 -7.480 386 HG13 VAL 52 HG13 VAL 52 -7.889 -0.750 -8.250 387 HG21 VAL 52 HG21 VAL 52 -8.864 -1.939 -6.171 388 HG22 VAL 52 HG22 VAL 52 -9.186 -0.348 -5.476 389 HG23 VAL 52 HG23 VAL 52 -8.218 -1.523 -4.583 390 H ASN 53 H ASN 53 -5.376 -4.047 -5.547 391 HA ASN 53 HA ASN 53 -5.523 -3.289 -2.697 392 HB2 ASN 53 HB2 ASN 53 -5.778 -5.989 -4.028 393 HB3 ASN 53 HB3 ASN 53 -5.735 -5.757 -2.285 394 HD21 ASN 53 HD21 ASN 53 -7.362 -3.672 -4.611 395 HD22 ASN 53 HD22 ASN 53 -8.953 -4.009 -4.055 396 H TYR 54 H TYR 54 -3.081 -3.284 -4.740 397 HA TYR 54 HA TYR 54 -1.235 -4.520 -2.812 398 HB2 TYR 54 HB2 TYR 54 0.030 -5.658 -4.495 399 HB3 TYR 54 HB3 TYR 54 -1.655 -6.118 -4.695 400 HD1 TYR 54 HD2 TYR 54 -2.962 -5.232 -6.626 401 HD2 TYR 54 HD1 TYR 54 1.210 -4.468 -6.221 402 HE1 TYR 54 HE2 TYR 54 -2.849 -4.595 -8.999 403 HE2 TYR 54 HE1 TYR 54 1.331 -3.835 -8.593 404 HH TYR 54 HH TYR 54 0.001 -4.349 -10.699 405 H ALA 55 H ALA 55 1.010 -3.864 -3.043 406 HA ALA 55 HA ALA 55 1.389 -1.276 -4.422 407 HB1 ALA 55 HB1 ALA 55 2.804 -0.537 -2.570 408 HB2 ALA 55 HB2 ALA 55 2.502 -2.054 -1.720 409 HB3 ALA 55 HB3 ALA 55 1.178 -0.924 -2.003 410 H GLU 56 H GLU 56 3.105 -1.219 -5.779 411 HA GLU 56 HA GLU 56 4.912 -3.496 -5.897 412 HB2 GLU 56 HB2 GLU 56 4.655 -1.066 -7.687 413 HB3 GLU 56 HB3 GLU 56 5.789 -2.384 -7.959 414 HG2 GLU 56 HG2 GLU 56 3.832 -3.939 -8.062 415 HG3 GLU 56 HG3 GLU 56 2.784 -2.525 -7.990 416 H ILE 57 H ILE 57 6.773 -3.557 -4.897 417 HA ILE 57 HA ILE 57 7.931 -1.069 -3.809 418 HB ILE 57 HB ILE 57 8.136 -3.883 -2.713 419 HG12 ILE 57 HG12 ILE 57 6.458 -1.642 -1.577 420 HG13 ILE 57 HG13 ILE 57 5.809 -2.781 -2.752 421 HG21 ILE 57 HG21 ILE 57 10.007 -2.510 -2.032 422 HG22 ILE 57 HG22 ILE 57 8.923 -2.738 -0.658 423 HG23 ILE 57 HG23 ILE 57 8.920 -1.210 -1.540 424 HD11 ILE 57 HD11 ILE 57 5.228 -3.418 -0.491 425 HD12 ILE 57 HD12 ILE 57 6.936 -3.487 -0.053 426 HD13 ILE 57 HD13 ILE 57 6.279 -4.624 -1.236 427 H ASN 58 H ASN 58 10.149 -0.711 -3.989 428 HA ASN 58 HA ASN 58 11.554 -1.957 -6.103 429 HB2 ASN 58 HB2 ASN 58 12.024 0.350 -5.415 430 HB3 ASN 58 HB3 ASN 58 12.625 -0.220 -3.860 431 HD21 ASN 58 HD21 ASN 58 13.228 -0.154 -7.291 432 HD22 ASN 58 HD22 ASN 58 14.914 -0.503 -7.198 433 H GLU 59 H GLU 59 13.383 -3.304 -6.082 434 HA GLU 59 HA GLU 59 13.302 -5.542 -4.451 435 HB2 GLU 59 HB2 GLU 59 14.401 -5.438 -6.657 436 HB3 GLU 59 HB3 GLU 59 15.688 -4.462 -5.964 437 HG2 GLU 59 HG2 GLU 59 16.452 -6.718 -6.182 438 HG3 GLU 59 HG3 GLU 59 16.272 -6.348 -4.472 439 H GLU 60 H GLU 60 15.550 -2.774 -4.185 440 HA GLU 60 HA GLU 60 17.116 -3.758 -2.097 441 HB2 GLU 60 HB2 GLU 60 16.409 -0.878 -2.704 442 HB3 GLU 60 HB3 GLU 60 17.736 -1.402 -1.676 443 HG2 GLU 60 HG2 GLU 60 17.453 -1.960 -4.626 444 HG3 GLU 60 HG3 GLU 60 18.517 -0.762 -3.892 445 H ASP 61 H ASP 61 14.269 -1.601 -1.867 446 HA ASP 61 HA ASP 61 14.214 -1.523 0.971 447 HB2 ASP 61 HB2 ASP 61 11.908 -1.096 -0.948 448 HB3 ASP 61 HB3 ASP 61 11.994 -0.551 0.726 449 H TRP 62 H TRP 62 12.703 -3.627 -1.413 450 HA TRP 62 HA TRP 62 10.930 -5.089 0.123 451 HB2 TRP 62 HB2 TRP 62 11.170 -5.301 -2.323 452 HB3 TRP 62 HB3 TRP 62 12.727 -6.092 -2.106 453 HD1 TRP 62 HD1 TRP 62 12.698 -8.628 -1.200 454 HE1 TRP 62 HE1 TRP 62 10.861 -10.421 -1.253 455 HE3 TRP 62 HE3 TRP 62 8.659 -5.645 -2.178 456 HZ2 TRP 62 HZ2 TRP 62 8.079 -10.567 -1.666 457 HZ3 TRP 62 HZ3 TRP 62 6.445 -6.693 -2.386 458 HH2 TRP 62 HH2 TRP 62 6.160 -9.106 -2.136 459 H ASN 63 H ASN 63 14.399 -5.785 -0.422 460 HA ASN 63 HA ASN 63 14.486 -7.946 1.449 461 HB2 ASN 63 HB2 ASN 63 16.753 -6.290 0.304 462 HB3 ASN 63 HB3 ASN 63 16.946 -7.792 1.204 463 HD21 ASN 63 HD21 ASN 63 16.046 -6.369 -1.804 464 HD22 ASN 63 HD22 ASN 63 15.900 -7.838 -2.695 465 H ALA 64 H ALA 64 15.189 -4.488 1.661 466 HA ALA 64 HA ALA 64 16.406 -4.407 4.184 467 HB1 ALA 64 HB1 ALA 64 16.344 -2.517 2.612 468 HB2 ALA 64 HB2 ALA 64 15.801 -2.054 4.225 469 HB3 ALA 64 HB3 ALA 64 14.621 -2.315 2.938 470 H LEU 65 H LEU 65 12.999 -4.555 3.312 471 HA LEU 65 HA LEU 65 12.135 -4.285 6.084 472 HB2 LEU 65 HB2 LEU 65 10.615 -4.738 3.515 473 HB3 LEU 65 HB3 LEU 65 9.851 -4.599 5.088 474 HG LEU 65 HG LEU 65 11.523 -2.420 3.820 475 HD11 LEU 65 HD11 LEU 65 9.518 -2.818 2.498 476 HD12 LEU 65 HD12 LEU 65 9.404 -1.290 3.369 477 HD13 LEU 65 HD13 LEU 65 8.520 -2.703 3.950 478 HD21 LEU 65 HD21 LEU 65 11.463 -2.324 6.253 479 HD22 LEU 65 HD22 LEU 65 9.702 -2.411 6.230 480 HD23 LEU 65 HD23 LEU 65 10.524 -1.005 5.553 481 H GLY 66 H GLY 66 13.160 -6.803 4.065 482 HA2 GLY 66 HA2 GLY 66 13.134 -9.096 4.283 483 HA3 GLY 66 HA3 GLY 66 12.497 -8.867 5.907 484 H LEU 67 H LEU 67 11.282 -8.181 2.634 485 HA LEU 67 HA LEU 67 8.664 -9.218 3.400 486 HB2 LEU 67 HB2 LEU 67 9.545 -7.891 0.832 487 HB3 LEU 67 HB3 LEU 67 7.891 -8.249 1.294 488 HG LEU 67 HG LEU 67 9.725 -6.276 2.673 489 HD11 LEU 67 HD11 LEU 67 9.004 -5.475 0.506 490 HD12 LEU 67 HD12 LEU 67 8.187 -4.583 1.788 491 HD13 LEU 67 HD13 LEU 67 7.324 -5.839 0.899 492 HD21 LEU 67 HD21 LEU 67 6.831 -6.950 3.211 493 HD22 LEU 67 HD22 LEU 67 7.739 -5.631 3.954 494 HD23 LEU 67 HD23 LEU 67 8.206 -7.303 4.260 495 H GLN 68 H GLN 68 7.783 -11.063 2.658 496 HA GLN 68 HA GLN 68 9.235 -12.599 0.604 497 HB2 GLN 68 HB2 GLN 68 8.956 -13.811 2.714 498 HB3 GLN 68 HB3 GLN 68 7.220 -13.530 2.673 499 HG2 GLN 68 HG2 GLN 68 6.998 -14.919 0.705 500 HG3 GLN 68 HG3 GLN 68 8.745 -15.127 0.619 501 HE21 GLN 68 HE21 GLN 68 8.531 -17.364 0.738 502 HE22 GLN 68 HE22 GLN 68 8.132 -18.169 2.210 503 H GLU 69 H GLU 69 8.140 -13.323 -1.220 504 HA GLU 69 HA GLU 69 6.073 -11.676 -2.187 505 HB2 GLU 69 HB2 GLU 69 7.227 -14.278 -3.204 506 HB3 GLU 69 HB3 GLU 69 5.994 -13.376 -4.082 507 HG2 GLU 69 HG2 GLU 69 7.404 -11.582 -4.501 508 HG3 GLU 69 HG3 GLU 69 8.507 -12.016 -3.200 509 H GLY 70 H GLY 70 4.179 -11.636 -1.227 510 HA2 GLY 70 HA2 GLY 70 2.003 -12.979 -1.245 511 HA3 GLY 70 HA3 GLY 70 2.923 -14.163 -0.332 512 H ASP 71 H ASP 71 4.287 -11.623 0.936 513 HA ASP 71 HA ASP 71 2.649 -11.521 3.273 514 HB2 ASP 71 HB2 ASP 71 5.127 -10.041 2.410 515 HB3 ASP 71 HB3 ASP 71 4.275 -9.590 3.882 516 H ARG 72 H ARG 72 2.303 -9.220 4.280 517 HA ARG 72 HA ARG 72 1.180 -7.352 2.309 518 HB2 ARG 72 HB2 ARG 72 -0.740 -6.900 3.786 519 HB3 ARG 72 HB3 ARG 72 -0.728 -8.559 3.216 520 HG2 ARG 72 HG2 ARG 72 0.364 -7.811 5.918 521 HG3 ARG 72 HG3 ARG 72 -1.350 -8.132 5.658 522 HD2 ARG 72 HD2 ARG 72 -0.795 -10.374 4.814 523 HD3 ARG 72 HD3 ARG 72 0.914 -10.047 5.089 524 HE ARG 72 HE ARG 72 -0.733 -9.746 7.433 525 HH11 ARG 72 HH11 ARG 72 1.093 -11.971 5.540 526 HH12 ARG 72 HH12 ARG 72 1.334 -13.070 6.848 527 HH21 ARG 72 HH21 ARG 72 -0.420 -11.160 9.115 528 HH22 ARG 72 HH22 ARG 72 0.488 -12.606 8.862 529 H VAL 73 H VAL 73 1.201 -5.133 2.954 530 HA VAL 73 HA VAL 73 3.079 -4.592 5.172 531 HB VAL 73 HB VAL 73 4.034 -2.743 3.788 532 HG11 VAL 73 HG11 VAL 73 5.218 -4.863 3.988 533 HG12 VAL 73 HG12 VAL 73 5.426 -4.195 2.369 534 HG13 VAL 73 HG13 VAL 73 4.299 -5.526 2.633 535 HG21 VAL 73 HG21 VAL 73 2.171 -2.443 2.228 536 HG22 VAL 73 HG22 VAL 73 2.472 -4.042 1.546 537 HG23 VAL 73 HG23 VAL 73 3.673 -2.764 1.359 538 H LYS 74 H LYS 74 2.945 -2.610 6.217 539 HA LYS 74 HA LYS 74 0.356 -1.250 6.080 540 HB2 LYS 74 HB2 LYS 74 1.040 -1.888 8.298 541 HB3 LYS 74 HB3 LYS 74 2.629 -1.171 8.077 542 HG2 LYS 74 HG2 LYS 74 1.452 0.307 9.472 543 HG3 LYS 74 HG3 LYS 74 1.463 1.066 7.883 544 HD2 LYS 74 HD2 LYS 74 -0.736 1.329 8.806 545 HD3 LYS 74 HD3 LYS 74 -0.840 0.136 7.510 546 HE2 LYS 74 HE2 LYS 74 -0.909 -1.668 9.081 547 HE3 LYS 74 HE3 LYS 74 -0.538 -0.586 10.423 548 HZ1 LYS 74 HZ1 LYS 74 -2.902 -1.219 10.270 549 HZ2 LYS 74 HZ2 LYS 74 -3.006 -0.416 8.786 550 HZ3 LYS 74 HZ3 LYS 74 -2.656 0.453 10.194 551 H VAL 75 H VAL 75 0.148 0.589 4.970 552 HA VAL 75 HA VAL 75 2.548 2.176 4.312 553 HB VAL 75 HB VAL 75 -0.139 2.167 2.907 554 HG11 VAL 75 HG11 VAL 75 0.990 4.304 2.686 555 HG12 VAL 75 HG12 VAL 75 1.038 3.439 1.150 556 HG13 VAL 75 HG13 VAL 75 2.473 3.498 2.173 557 HG21 VAL 75 HG21 VAL 75 0.983 0.964 1.096 558 HG22 VAL 75 HG22 VAL 75 1.031 0.038 2.596 559 HG23 VAL 75 HG23 VAL 75 2.469 0.900 2.047 560 H LYS 76 H LYS 76 2.719 4.187 5.147 561 HA LYS 76 HA LYS 76 0.335 5.426 6.363 562 HB2 LYS 76 HB2 LYS 76 2.989 4.885 7.688 563 HB3 LYS 76 HB3 LYS 76 1.848 6.070 8.311 564 HG2 LYS 76 HG2 LYS 76 0.366 4.492 9.025 565 HG3 LYS 76 HG3 LYS 76 0.816 3.339 7.769 566 HD2 LYS 76 HD2 LYS 76 1.499 2.561 9.976 567 HD3 LYS 76 HD3 LYS 76 2.888 2.846 8.932 568 HE2 LYS 76 HE2 LYS 76 3.325 4.964 10.042 569 HE3 LYS 76 HE3 LYS 76 1.885 4.764 11.042 570 HZ1 LYS 76 HZ1 LYS 76 4.183 2.879 11.056 571 HZ2 LYS 76 HZ2 LYS 76 2.873 2.898 12.125 572 HZ3 LYS 76 HZ3 LYS 76 4.005 4.151 12.154 573 H THR 77 H THR 77 0.113 7.508 6.031 574 HA THR 77 HA THR 77 2.435 9.181 5.286 575 HB THR 77 HB THR 77 1.184 10.336 3.566 576 HG1 THR 77 HG1 THR 77 -0.944 9.718 3.047 577 HG21 THR 77 HG21 THR 77 2.352 8.341 2.791 578 HG22 THR 77 HG22 THR 77 0.844 8.544 1.900 579 HG23 THR 77 HG23 THR 77 0.952 7.343 3.186 580 H GLU 78 H GLU 78 1.285 11.618 5.039 581 HA GLU 78 HA GLU 78 0.447 12.250 7.720 582 HB2 GLU 78 HB2 GLU 78 0.334 14.565 6.988 583 HB3 GLU 78 HB3 GLU 78 1.838 13.827 6.462 584 HG2 GLU 78 HG2 GLU 78 -0.495 13.918 4.595 585 HG3 GLU 78 HG3 GLU 78 0.472 15.362 4.863 586 H PHE 79 H PHE 79 -1.157 11.372 4.835 587 HA PHE 79 HA PHE 79 -3.696 12.593 5.484 588 HB2 PHE 79 HB2 PHE 79 -2.937 10.537 3.394 589 HB3 PHE 79 HB3 PHE 79 -4.541 11.252 3.547 590 HD1 PHE 79 HD2 PHE 79 -4.884 13.644 3.054 591 HD2 PHE 79 HD1 PHE 79 -1.116 11.755 2.421 592 HE1 PHE 79 HE2 PHE 79 -4.177 15.530 1.643 593 HE2 PHE 79 HE1 PHE 79 -0.408 13.644 1.011 594 HZ PHE 79 HZ PHE 79 -1.938 15.530 0.620 595 H GLY 80 H GLY 80 -2.494 9.217 5.383 596 HA2 GLY 80 HA2 GLY 80 -3.900 8.481 7.745 597 HA3 GLY 80 HA3 GLY 80 -4.797 7.962 6.327 598 H GLU 81 H GLU 81 -4.536 5.765 6.807 599 HA GLU 81 HA GLU 81 -1.952 4.636 6.068 600 HB2 GLU 81 HB2 GLU 81 -1.882 3.138 8.029 601 HB3 GLU 81 HB3 GLU 81 -1.748 4.830 8.489 602 HG2 GLU 81 HG2 GLU 81 -4.037 4.878 9.219 603 HG3 GLU 81 HG3 GLU 81 -4.309 3.248 8.606 604 H VAL 82 H VAL 82 -2.060 2.399 5.450 605 HA VAL 82 HA VAL 82 -4.597 1.007 5.492 606 HB VAL 82 HB VAL 82 -4.815 2.533 3.530 607 HG11 VAL 82 HG11 VAL 82 -3.507 2.064 1.494 608 HG12 VAL 82 HG12 VAL 82 -2.503 0.944 2.417 609 HG13 VAL 82 HG13 VAL 82 -2.509 2.663 2.821 610 HG21 VAL 82 HG21 VAL 82 -5.554 0.811 1.918 611 HG22 VAL 82 HG22 VAL 82 -6.101 0.482 3.562 612 HG23 VAL 82 HG23 VAL 82 -4.741 -0.421 2.887 613 H VAL 83 H VAL 83 -4.379 -1.226 5.175 614 HA VAL 83 HA VAL 83 -1.633 -2.243 4.815 615 HB VAL 83 HB VAL 83 -4.059 -3.803 5.754 616 HG11 VAL 83 HG11 VAL 83 -2.307 -5.212 4.834 617 HG12 VAL 83 HG12 VAL 83 -2.378 -5.410 6.586 618 HG13 VAL 83 HG13 VAL 83 -1.102 -4.431 5.859 619 HG21 VAL 83 HG21 VAL 83 -3.587 -2.019 7.351 620 HG22 VAL 83 HG22 VAL 83 -1.897 -2.515 7.429 621 HG23 VAL 83 HG23 VAL 83 -3.162 -3.593 8.025 622 H VAL 84 H VAL 84 -1.105 -2.928 2.821 623 HA VAL 84 HA VAL 84 -3.201 -4.174 1.138 624 HB VAL 84 HB VAL 84 -2.164 -3.204 -0.865 625 HG11 VAL 84 HG11 VAL 84 -2.885 -0.885 -0.562 626 HG12 VAL 84 HG12 VAL 84 -2.871 -1.098 1.188 627 HG13 VAL 84 HG13 VAL 84 -4.017 -2.003 0.199 628 HG21 VAL 84 HG21 VAL 84 0.130 -2.977 -0.088 629 HG22 VAL 84 HG22 VAL 84 -0.360 -1.741 1.072 630 HG23 VAL 84 HG23 VAL 84 -0.471 -1.418 -0.659 631 H PHE 85 H PHE 85 -2.274 -5.534 -0.663 632 HA PHE 85 HA PHE 85 -0.464 -7.460 0.388 633 HB2 PHE 85 HB2 PHE 85 -1.604 -7.092 -2.389 634 HB3 PHE 85 HB3 PHE 85 -0.591 -8.457 -1.931 635 HD1 PHE 85 HD1 PHE 85 -1.395 -9.982 -0.069 636 HD2 PHE 85 HD2 PHE 85 -3.924 -7.122 -1.966 637 HE1 PHE 85 HE1 PHE 85 -3.374 -11.199 0.739 638 HE2 PHE 85 HE2 PHE 85 -5.905 -8.338 -1.161 639 HZ PHE 85 HZ PHE 85 -5.633 -10.379 0.193 640 H ALA 86 H ALA 86 1.694 -7.654 0.194 641 HA ALA 86 HA ALA 86 3.192 -5.511 -1.042 642 HB1 ALA 86 HB1 ALA 86 3.865 -6.383 1.132 643 HB2 ALA 86 HB2 ALA 86 5.152 -6.593 -0.057 644 HB3 ALA 86 HB3 ALA 86 4.155 -7.969 0.419 645 H LYS 87 H LYS 87 3.793 -5.520 -3.111 646 HA LYS 87 HA LYS 87 4.757 -8.035 -4.300 647 HB2 LYS 87 HB2 LYS 87 2.952 -6.000 -5.637 648 HB3 LYS 87 HB3 LYS 87 3.829 -7.236 -6.519 649 HG2 LYS 87 HG2 LYS 87 2.606 -8.959 -5.272 650 HG3 LYS 87 HG3 LYS 87 1.686 -7.683 -4.463 651 HD2 LYS 87 HD2 LYS 87 0.902 -6.875 -6.642 652 HD3 LYS 87 HD3 LYS 87 1.797 -8.171 -7.438 653 HE2 LYS 87 HE2 LYS 87 -0.355 -8.632 -5.391 654 HE3 LYS 87 HE3 LYS 87 -0.632 -8.573 -7.124 655 HZ1 LYS 87 HZ1 LYS 87 1.069 -10.516 -5.671 656 HZ2 LYS 87 HZ2 LYS 87 0.974 -10.410 -7.358 657 HZ3 LYS 87 HZ3 LYS 87 -0.394 -10.838 -6.463 658 H LYS 88 H LYS 88 6.260 -7.733 -6.071 659 HA LYS 88 HA LYS 88 8.032 -5.519 -5.399 660 HB2 LYS 88 HB2 LYS 88 8.722 -7.982 -5.407 661 HB3 LYS 88 HB3 LYS 88 8.677 -7.876 -7.164 662 HG2 LYS 88 HG2 LYS 88 10.329 -6.100 -7.114 663 HG3 LYS 88 HG3 LYS 88 10.347 -6.165 -5.352 664 HD2 LYS 88 HD2 LYS 88 11.141 -8.429 -7.196 665 HD3 LYS 88 HD3 LYS 88 12.263 -7.367 -6.344 666 HE2 LYS 88 HE2 LYS 88 11.258 -8.142 -4.194 667 HE3 LYS 88 HE3 LYS 88 10.300 -9.306 -5.111 668 HZ1 LYS 88 HZ1 LYS 88 12.279 -10.335 -4.235 669 HZ2 LYS 88 HZ2 LYS 88 13.262 -9.185 -4.988 670 HZ3 LYS 88 HZ3 LYS 88 12.373 -10.275 -5.921 671 H GLY 89 H GLY 89 8.793 -4.030 -6.892 672 HA2 GLY 89 HA2 GLY 89 7.730 -4.175 -9.635 673 HA3 GLY 89 HA3 GLY 89 7.357 -2.769 -8.655 674 H ASP 90 H ASP 90 8.576 -2.415 -11.042 675 HA ASP 90 HA ASP 90 11.461 -2.234 -10.687 676 HB2 ASP 90 HB2 ASP 90 9.655 -1.511 -13.010 677 HB3 ASP 90 HB3 ASP 90 11.415 -1.428 -13.047 678 H VAL 91 H VAL 91 9.446 -0.501 -9.194 679 HA VAL 91 HA VAL 91 9.890 2.204 -10.031 680 HB VAL 91 HB VAL 91 8.926 2.803 -7.811 681 HG11 VAL 91 HG11 VAL 91 7.395 0.672 -9.320 682 HG12 VAL 91 HG12 VAL 91 7.425 2.396 -9.692 683 HG13 VAL 91 HG13 VAL 91 6.693 1.832 -8.191 684 HG21 VAL 91 HG21 VAL 91 8.845 -0.191 -7.372 685 HG22 VAL 91 HG22 VAL 91 8.100 1.024 -6.331 686 HG23 VAL 91 HG23 VAL 91 9.856 0.959 -6.493 687 HA PRO 92 HA PRO 92 13.884 3.021 -8.213 688 HB2 PRO 92 HB2 PRO 92 13.545 5.572 -7.242 689 HB3 PRO 92 HB3 PRO 92 13.794 5.193 -8.949 690 HG2 PRO 92 HG2 PRO 92 11.230 5.730 -7.486 691 HG3 PRO 92 HG3 PRO 92 11.758 6.324 -9.072 692 HD2 PRO 92 HD2 PRO 92 10.029 4.278 -8.842 693 HD3 PRO 92 HD3 PRO 92 11.248 4.320 -10.134 694 H LYS 93 H LYS 93 15.016 3.370 -6.157 695 HA LYS 93 HA LYS 93 13.737 2.050 -4.012 696 HB2 LYS 93 HB2 LYS 93 16.214 2.064 -4.425 697 HB3 LYS 93 HB3 LYS 93 16.257 3.721 -3.828 698 HG2 LYS 93 HG2 LYS 93 15.325 2.925 -1.674 699 HG3 LYS 93 HG3 LYS 93 15.405 1.273 -2.285 700 HD2 LYS 93 HD2 LYS 93 17.856 1.533 -2.547 701 HD3 LYS 93 HD3 LYS 93 17.734 3.139 -1.819 702 HE2 LYS 93 HE2 LYS 93 17.067 0.488 -0.536 703 HE3 LYS 93 HE3 LYS 93 18.386 1.575 -0.106 704 HZ1 LYS 93 HZ1 LYS 93 16.653 1.854 1.467 705 HZ2 LYS 93 HZ2 LYS 93 15.480 2.038 0.264 706 HZ3 LYS 93 HZ3 LYS 93 16.655 3.235 0.494 707 H GLY 94 H GLY 94 13.119 2.803 -1.926 708 HA2 GLY 94 HA2 GLY 94 12.004 4.229 -0.505 709 HA3 GLY 94 HA3 GLY 94 12.939 5.539 -1.211 710 H MET 95 H MET 95 10.748 3.421 -2.992 711 HA MET 95 HA MET 95 8.622 5.374 -3.106 712 HB2 MET 95 HB2 MET 95 10.393 6.186 -4.697 713 HB3 MET 95 HB3 MET 95 10.189 4.698 -5.608 714 HG2 MET 95 HG2 MET 95 7.988 5.283 -6.235 715 HG3 MET 95 HG3 MET 95 7.951 6.630 -5.098 716 HE1 MET 95 HE1 MET 95 7.096 7.184 -8.107 717 HE2 MET 95 HE2 MET 95 7.977 8.683 -8.382 718 HE3 MET 95 HE3 MET 95 7.198 8.390 -6.826 719 H ILE 96 H ILE 96 6.670 4.394 -3.640 720 HA ILE 96 HA ILE 96 6.756 1.668 -4.761 721 HB ILE 96 HB ILE 96 5.040 0.879 -3.190 722 HG12 ILE 96 HG12 ILE 96 5.492 3.490 -1.714 723 HG13 ILE 96 HG13 ILE 96 4.050 3.093 -2.642 724 HG21 ILE 96 HG21 ILE 96 7.387 0.423 -2.703 725 HG22 ILE 96 HG22 ILE 96 6.470 0.638 -1.213 726 HG23 ILE 96 HG23 ILE 96 7.508 1.936 -1.803 727 HD11 ILE 96 HD11 ILE 96 3.656 2.793 -0.276 728 HD12 ILE 96 HD12 ILE 96 5.015 1.675 -0.166 729 HD13 ILE 96 HD13 ILE 96 3.588 1.238 -1.107 730 H PHE 97 H PHE 97 5.014 1.068 -6.023 731 HA PHE 97 HA PHE 97 3.228 3.274 -6.813 732 HB2 PHE 97 HB2 PHE 97 4.562 2.366 -8.633 733 HB3 PHE 97 HB3 PHE 97 4.000 0.736 -8.280 734 HD1 PHE 97 HD2 PHE 97 3.019 4.024 -9.632 735 HD2 PHE 97 HD1 PHE 97 1.859 -0.036 -9.041 736 HE1 PHE 97 HE2 PHE 97 1.135 4.338 -11.179 737 HE2 PHE 97 HE1 PHE 97 -0.031 0.278 -10.586 738 HZ PHE 97 HZ PHE 97 -0.394 2.465 -11.657 739 H ILE 98 H ILE 98 1.116 3.211 -6.297 740 HA ILE 98 HA ILE 98 -0.164 0.569 -5.963 741 HB ILE 98 HB ILE 98 -0.838 3.112 -4.455 742 HG12 ILE 98 HG12 ILE 98 0.370 0.482 -3.546 743 HG13 ILE 98 HG13 ILE 98 1.167 2.050 -3.573 744 HG21 ILE 98 HG21 ILE 98 -2.132 0.382 -4.287 745 HG22 ILE 98 HG22 ILE 98 -2.852 1.826 -5.002 746 HG23 ILE 98 HG23 ILE 98 -2.515 1.774 -3.272 747 HD11 ILE 98 HD11 ILE 98 -1.165 1.287 -1.831 748 HD12 ILE 98 HD12 ILE 98 -0.364 2.859 -1.857 749 HD13 ILE 98 HD13 ILE 98 0.518 1.427 -1.326 750 HA PRO 99 HA PRO 99 -2.854 1.941 -9.323 751 HB2 PRO 99 HB2 PRO 99 -4.689 -0.077 -8.116 752 HB3 PRO 99 HB3 PRO 99 -4.128 0.079 -9.784 753 HG2 PRO 99 HG2 PRO 99 -3.156 -1.836 -8.216 754 HG3 PRO 99 HG3 PRO 99 -2.096 -0.964 -9.340 755 HD2 PRO 99 HD2 PRO 99 -2.411 -0.619 -6.376 756 HD3 PRO 99 HD3 PRO 99 -0.930 -0.613 -7.361 757 H MET 100 H MET 100 -4.242 3.620 -9.332 758 HA MET 100 HA MET 100 -5.039 4.972 -7.049 759 HB2 MET 100 HB2 MET 100 -4.865 5.749 -9.519 760 HB3 MET 100 HB3 MET 100 -6.527 5.205 -9.662 761 HG2 MET 100 HG2 MET 100 -5.490 7.363 -7.834 762 HG3 MET 100 HG3 MET 100 -6.449 7.583 -9.292 763 HE1 MET 100 HE1 MET 100 -6.589 7.736 -5.611 764 HE2 MET 100 HE2 MET 100 -6.437 5.981 -5.696 765 HE3 MET 100 HE3 MET 100 -7.927 6.709 -5.091 766 H GLY 101 H GLY 101 -6.338 4.106 -5.510 767 HA2 GLY 101 HA2 GLY 101 -9.104 3.527 -6.162 768 HA3 GLY 101 HA3 GLY 101 -8.194 2.108 -5.664 769 HA PRO 102 HA PRO 102 -10.187 4.244 -1.919 770 HB2 PRO 102 HB2 PRO 102 -10.820 1.794 -0.753 771 HB3 PRO 102 HB3 PRO 102 -11.923 2.776 -1.721 772 HG2 PRO 102 HG2 PRO 102 -10.274 0.415 -2.532 773 HG3 PRO 102 HG3 PRO 102 -11.930 0.843 -3.004 774 HD2 PRO 102 HD2 PRO 102 -9.863 1.242 -4.660 775 HD3 PRO 102 HD3 PRO 102 -11.209 2.398 -4.581 776 H TYR 103 H TYR 103 -8.090 1.384 -2.132 777 HA TYR 103 HA TYR 103 -6.935 1.508 0.419 778 HB2 TYR 103 HB2 TYR 103 -5.776 0.490 -2.193 779 HB3 TYR 103 HB3 TYR 103 -5.082 0.179 -0.604 780 HD1 TYR 103 HD2 TYR 103 -8.214 -0.300 -2.584 781 HD2 TYR 103 HD1 TYR 103 -5.781 -1.690 0.624 782 HE1 TYR 103 HE2 TYR 103 -9.676 -2.257 -2.330 783 HE2 TYR 103 HE1 TYR 103 -7.235 -3.651 0.877 784 HH TYR 103 HH TYR 103 -9.346 -4.687 -1.375 785 H ALA 104 H ALA 104 -5.668 2.775 -2.680 786 HA ALA 104 HA ALA 104 -3.522 4.232 -1.608 787 HB1 ALA 104 HB1 ALA 104 -3.520 5.460 -3.729 788 HB2 ALA 104 HB2 ALA 104 -5.120 4.822 -4.108 789 HB3 ALA 104 HB3 ALA 104 -3.739 3.731 -4.000 790 H ASN 105 H ASN 105 -6.894 5.139 -2.159 791 HA ASN 105 HA ASN 105 -6.864 7.851 -1.641 792 HB2 ASN 105 HB2 ASN 105 -8.874 6.880 -2.430 793 HB3 ASN 105 HB3 ASN 105 -8.932 5.722 -1.111 794 HD21 ASN 105 HD21 ASN 105 -9.713 6.359 0.874 795 HD22 ASN 105 HD22 ASN 105 -10.574 7.840 1.102 796 H MET 106 H MET 106 -6.485 5.231 0.621 797 HA MET 106 HA MET 106 -7.111 6.620 3.015 798 HB2 MET 106 HB2 MET 106 -5.266 4.261 2.564 799 HB3 MET 106 HB3 MET 106 -5.851 4.804 4.133 800 HG2 MET 106 HG2 MET 106 -7.654 3.925 1.896 801 HG3 MET 106 HG3 MET 106 -7.060 2.848 3.161 802 HE1 MET 106 HE1 MET 106 -8.775 4.110 6.355 803 HE2 MET 106 HE2 MET 106 -7.121 4.388 5.805 804 HE3 MET 106 HE3 MET 106 -7.872 2.807 5.580 805 H VAL 107 H VAL 107 -4.241 6.520 1.022 806 HA VAL 107 HA VAL 107 -2.711 7.953 3.112 807 HB VAL 107 HB VAL 107 -0.661 6.921 2.185 808 HG11 VAL 107 HG11 VAL 107 -1.028 4.671 3.105 809 HG12 VAL 107 HG12 VAL 107 -2.770 4.950 3.076 810 HG13 VAL 107 HG13 VAL 107 -1.738 5.923 4.125 811 HG21 VAL 107 HG21 VAL 107 -0.839 5.001 0.660 812 HG22 VAL 107 HG22 VAL 107 -1.435 6.480 -0.093 813 HG23 VAL 107 HG23 VAL 107 -2.575 5.278 0.514 814 H ILE 108 H ILE 108 -3.904 8.152 -0.086 815 HA ILE 108 HA ILE 108 -1.883 10.145 -0.860 816 HB ILE 108 HB ILE 108 -2.595 9.961 -3.093 817 HG12 ILE 108 HG12 ILE 108 -4.905 8.195 -2.272 818 HG13 ILE 108 HG13 ILE 108 -5.068 9.936 -2.495 819 HG21 ILE 108 HG21 ILE 108 -1.218 8.098 -2.460 820 HG22 ILE 108 HG22 ILE 108 -2.476 7.506 -3.552 821 HG23 ILE 108 HG23 ILE 108 -2.610 7.225 -1.818 822 HD11 ILE 108 HD11 ILE 108 -5.755 8.794 -4.482 823 HD12 ILE 108 HD12 ILE 108 -4.212 7.939 -4.558 824 HD13 ILE 108 HD13 ILE 108 -4.264 9.685 -4.791 825 H ASP 109 H ASP 109 -2.950 11.946 -2.336 826 HA ASP 109 HA ASP 109 -5.107 13.207 -0.804 827 HB2 ASP 109 HB2 ASP 109 -3.138 14.588 -1.200 828 HB3 ASP 109 HB3 ASP 109 -3.265 14.323 -2.938 829 HA PRO 110 HA PRO 110 -7.783 11.959 -4.239 830 HB2 PRO 110 HB2 PRO 110 -10.052 12.669 -2.614 831 HB3 PRO 110 HB3 PRO 110 -9.456 11.057 -3.008 832 HG2 PRO 110 HG2 PRO 110 -9.393 12.168 -0.482 833 HG3 PRO 110 HG3 PRO 110 -8.327 10.864 -1.034 834 HD2 PRO 110 HD2 PRO 110 -7.768 13.802 -0.807 835 HD3 PRO 110 HD3 PRO 110 -6.716 12.418 -0.431 836 H SER 111 H SER 111 -7.068 15.005 -3.186 837 HA SER 111 HA SER 111 -9.304 16.385 -4.477 838 HB2 SER 111 HB2 SER 111 -8.495 17.299 -2.363 839 HB3 SER 111 HB3 SER 111 -6.870 17.461 -3.029 840 HG SER 111 HG SER 111 -7.442 19.239 -4.004 841 H THR 112 H THR 112 -5.948 15.626 -5.066 842 HA THR 112 HA THR 112 -5.327 17.516 -7.044 843 HB THR 112 HB THR 112 -3.594 16.198 -5.985 844 HG1 THR 112 HG1 THR 112 -2.839 16.840 -7.922 845 HG21 THR 112 HG21 THR 112 -4.813 14.101 -5.698 846 HG22 THR 112 HG22 THR 112 -3.268 13.823 -6.503 847 HG23 THR 112 HG23 THR 112 -4.764 13.818 -7.438 848 H ASP 113 H ASP 113 -4.549 16.468 -9.340 849 HA ASP 113 HA ASP 113 -6.893 16.343 -10.876 850 HB2 ASP 113 HB2 ASP 113 -4.081 15.532 -11.657 851 HB3 ASP 113 HB3 ASP 113 -5.396 15.892 -12.774 852 H GLY 114 H GLY 114 -5.019 13.788 -9.418 853 HA2 GLY 114 HA2 GLY 114 -5.216 11.492 -9.435 854 HA3 GLY 114 HA3 GLY 114 -6.929 11.797 -9.667 855 H THR 115 H THR 115 -4.526 12.767 -12.017 856 HA THR 115 HA THR 115 -5.357 10.593 -13.829 857 HB THR 115 HB THR 115 -5.205 13.525 -14.598 858 HG1 THR 115 HG1 THR 115 -7.119 13.028 -13.447 859 HG21 THR 115 HG21 THR 115 -6.068 12.781 -16.782 860 HG22 THR 115 HG22 THR 115 -5.966 11.103 -16.250 861 HG23 THR 115 HG23 THR 115 -4.496 12.059 -16.434 862 H GLY 116 H GLY 116 -3.692 9.663 -14.875 863 HA2 GLY 116 HA2 GLY 116 -1.498 10.772 -16.055 864 HA3 GLY 116 HA3 GLY 116 -1.001 10.565 -14.383 865 H MET 117 H MET 117 -0.014 9.286 -16.848 866 HA MET 117 HA MET 117 -0.816 6.514 -16.663 867 HB2 MET 117 HB2 MET 117 1.402 7.850 -18.234 868 HB3 MET 117 HB3 MET 117 0.973 6.149 -18.366 869 HG2 MET 117 HG2 MET 117 -0.797 8.491 -19.035 870 HG3 MET 117 HG3 MET 117 -0.001 7.415 -20.181 871 HE1 MET 117 HE1 MET 117 -0.660 4.844 -20.513 872 HE2 MET 117 HE2 MET 117 -1.878 4.023 -19.539 873 HE3 MET 117 HE3 MET 117 -0.374 4.564 -18.794 874 HA PRO 118 HA PRO 118 1.867 5.255 -13.472 875 HB2 PRO 118 HB2 PRO 118 2.397 2.662 -14.134 876 HB3 PRO 118 HB3 PRO 118 0.834 3.211 -13.522 877 HG2 PRO 118 HG2 PRO 118 1.679 2.665 -16.342 878 HG3 PRO 118 HG3 PRO 118 0.153 2.263 -15.531 879 HD2 PRO 118 HD2 PRO 118 0.422 4.391 -17.202 880 HD3 PRO 118 HD3 PRO 118 -0.710 4.384 -15.838 881 H GLN 119 H GLN 119 3.644 6.659 -13.948 882 HA GLN 119 HA GLN 119 6.032 5.133 -14.802 883 HB2 GLN 119 HB2 GLN 119 5.524 8.079 -15.328 884 HB3 GLN 119 HB3 GLN 119 7.024 7.231 -15.670 885 HG2 GLN 119 HG2 GLN 119 5.766 5.774 -17.255 886 HG3 GLN 119 HG3 GLN 119 4.349 6.784 -16.984 887 HE21 GLN 119 HE21 GLN 119 5.971 9.231 -16.806 888 HE22 GLN 119 HE22 GLN 119 6.445 9.603 -18.423 889 H PHE 120 H PHE 120 5.043 8.113 -13.119 890 HA PHE 120 HA PHE 120 6.422 7.406 -10.700 891 HB2 PHE 120 HB2 PHE 120 7.981 9.309 -10.687 892 HB3 PHE 120 HB3 PHE 120 8.320 8.243 -12.043 893 HD1 PHE 120 HD1 PHE 120 7.508 8.923 -14.348 894 HD2 PHE 120 HD2 PHE 120 7.514 11.594 -11.028 895 HE1 PHE 120 HE1 PHE 120 7.374 10.837 -15.887 896 HE2 PHE 120 HE2 PHE 120 7.374 13.509 -12.565 897 HZ PHE 120 HZ PHE 120 7.304 13.131 -14.999 898 H LYS 121 H LYS 121 6.587 10.062 -9.625 899 HA LYS 121 HA LYS 121 5.400 11.828 -8.817 900 HB2 LYS 121 HB2 LYS 121 4.848 12.155 -11.263 901 HB3 LYS 121 HB3 LYS 121 3.357 11.277 -10.975 902 HG2 LYS 121 HG2 LYS 121 4.022 13.742 -9.398 903 HG3 LYS 121 HG3 LYS 121 3.304 13.850 -11.005 904 HD2 LYS 121 HD2 LYS 121 1.451 12.358 -10.169 905 HD3 LYS 121 HD3 LYS 121 2.135 12.531 -8.550 906 HE2 LYS 121 HE2 LYS 121 1.134 14.777 -10.306 907 HE3 LYS 121 HE3 LYS 121 0.295 14.101 -8.910 908 HZ1 LYS 121 HZ1 LYS 121 1.499 16.180 -8.434 909 HZ2 LYS 121 HZ2 LYS 121 2.957 15.402 -8.787 910 HZ3 LYS 121 HZ3 LYS 121 2.022 14.887 -7.481 911 H GLY 122 H GLY 122 4.843 11.049 -6.823 912 HA2 GLY 122 HA2 GLY 122 2.070 10.195 -6.520 913 HA3 GLY 122 HA3 GLY 122 3.294 9.070 -5.954 914 H VAL 123 H VAL 123 1.696 9.677 -4.042 915 HA VAL 123 HA VAL 123 2.496 12.091 -2.607 916 HB VAL 123 HB VAL 123 0.634 9.853 -1.779 917 HG11 VAL 123 HG11 VAL 123 -0.127 11.382 0.002 918 HG12 VAL 123 HG12 VAL 123 1.136 12.525 -0.453 919 HG13 VAL 123 HG13 VAL 123 1.570 10.944 0.195 920 HG21 VAL 123 HG21 VAL 123 -0.199 11.115 -3.688 921 HG22 VAL 123 HG22 VAL 123 0.057 12.631 -2.824 922 HG23 VAL 123 HG23 VAL 123 -1.152 11.482 -2.250 923 H LYS 124 H LYS 124 4.144 12.203 -1.214 924 HA LYS 124 HA LYS 124 5.843 10.048 -0.587 925 HB2 LYS 124 HB2 LYS 124 5.541 12.813 0.575 926 HB3 LYS 124 HB3 LYS 124 6.746 11.688 1.182 927 HG2 LYS 124 HG2 LYS 124 6.623 12.290 -1.741 928 HG3 LYS 124 HG3 LYS 124 7.382 13.438 -0.638 929 HD2 LYS 124 HD2 LYS 124 8.136 10.522 -0.947 930 HD3 LYS 124 HD3 LYS 124 9.016 11.886 -1.637 931 HE2 LYS 124 HE2 LYS 124 9.343 12.756 0.690 932 HE3 LYS 124 HE3 LYS 124 8.630 11.262 1.294 933 HZ1 LYS 124 HZ1 LYS 124 10.417 10.045 0.142 934 HZ2 LYS 124 HZ2 LYS 124 11.007 11.097 1.327 935 HZ3 LYS 124 HZ3 LYS 124 11.117 11.518 -0.304 936 H GLY 125 H GLY 125 6.241 8.932 1.334 937 HA2 GLY 125 HA2 GLY 125 4.786 9.196 3.736 938 HA3 GLY 125 HA3 GLY 125 3.986 7.998 2.730 939 H THR 126 H THR 126 4.433 6.329 4.214 940 HA THR 126 HA THR 126 7.186 5.300 4.086 941 HB THR 126 HB THR 126 7.091 4.631 6.495 942 HG1 THR 126 HG1 THR 126 4.935 6.482 6.719 943 HG21 THR 126 HG21 THR 126 7.600 6.843 7.430 944 HG22 THR 126 HG22 THR 126 6.873 7.612 6.018 945 HG23 THR 126 HG23 THR 126 8.339 6.645 5.840 946 H VAL 127 H VAL 127 7.364 3.017 4.635 947 HA VAL 127 HA VAL 127 4.864 1.486 4.696 948 HB VAL 127 HB VAL 127 5.532 1.656 2.307 949 HG11 VAL 127 HG11 VAL 127 7.539 0.492 1.510 950 HG12 VAL 127 HG12 VAL 127 8.017 0.173 3.179 951 HG13 VAL 127 HG13 VAL 127 7.946 1.832 2.583 952 HG21 VAL 127 HG21 VAL 127 4.283 -0.296 3.097 953 HG22 VAL 127 HG22 VAL 127 5.796 -1.125 3.465 954 HG23 VAL 127 HG23 VAL 127 5.387 -0.734 1.794 955 H GLU 128 H GLU 128 5.038 -0.539 5.729 956 HA GLU 128 HA GLU 128 7.658 -1.486 6.601 957 HB2 GLU 128 HB2 GLU 128 6.919 -1.529 9.007 958 HB3 GLU 128 HB3 GLU 128 7.198 0.078 8.350 959 HG2 GLU 128 HG2 GLU 128 4.800 0.394 8.050 960 HG3 GLU 128 HG3 GLU 128 4.496 -1.229 8.668 961 H LYS 129 H LYS 129 7.657 -3.624 7.488 962 HA LYS 129 HA LYS 129 5.620 -5.385 6.515 963 HB2 LYS 129 HB2 LYS 129 7.817 -6.280 6.544 964 HB3 LYS 129 HB3 LYS 129 8.094 -5.769 8.202 965 HG2 LYS 129 HG2 LYS 129 7.847 -8.163 8.128 966 HG3 LYS 129 HG3 LYS 129 6.471 -7.463 8.976 967 HD2 LYS 129 HD2 LYS 129 5.506 -9.082 7.588 968 HD3 LYS 129 HD3 LYS 129 5.258 -7.576 6.706 969 HE2 LYS 129 HE2 LYS 129 5.988 -9.162 5.109 970 HE3 LYS 129 HE3 LYS 129 7.376 -8.125 5.427 971 HZ1 LYS 129 HZ1 LYS 129 6.985 -10.707 6.820 972 HZ2 LYS 129 HZ2 LYS 129 8.405 -9.795 6.688 973 HZ3 LYS 129 HZ3 LYS 129 7.782 -10.600 5.334 974 H THR 130 H THR 130 3.770 -5.948 7.497 975 HA THR 130 HA THR 130 3.600 -5.786 10.441 976 HB THR 130 HB THR 130 2.405 -3.849 9.588 977 HG1 THR 130 HG1 THR 130 0.587 -4.212 10.755 978 HG21 THR 130 HG21 THR 130 1.913 -4.654 7.318 979 HG22 THR 130 HG22 THR 130 0.450 -4.080 8.118 980 HG23 THR 130 HG23 THR 130 0.755 -5.810 7.976 981 H ASP 131 H ASP 131 2.124 -7.215 11.444 982 HA ASP 131 HA ASP 131 1.709 -9.713 10.037 983 HB2 ASP 131 HB2 ASP 131 2.468 -9.695 12.390 984 HB3 ASP 131 HB3 ASP 131 0.972 -8.899 12.868 985 H GLU 132 H GLU 132 -0.047 -6.860 10.416 986 HA GLU 132 HA GLU 132 -2.652 -7.700 10.932 987 HB2 GLU 132 HB2 GLU 132 -1.510 -5.310 9.549 988 HB3 GLU 132 HB3 GLU 132 -3.241 -5.593 9.462 989 HG2 GLU 132 HG2 GLU 132 -3.100 -5.784 12.036 990 HG3 GLU 132 HG3 GLU 132 -1.551 -4.959 11.842 991 H LYS 133 H LYS 133 -4.493 -7.592 9.521 992 HA LYS 133 HA LYS 133 -4.179 -9.099 7.075 993 HB2 LYS 133 HB2 LYS 133 -6.542 -9.378 7.120 994 HB3 LYS 133 HB3 LYS 133 -6.019 -9.491 8.793 995 HG2 LYS 133 HG2 LYS 133 -7.266 -7.059 7.494 996 HG3 LYS 133 HG3 LYS 133 -8.083 -8.192 8.569 997 HD2 LYS 133 HD2 LYS 133 -6.701 -7.528 10.427 998 HD3 LYS 133 HD3 LYS 133 -5.670 -6.557 9.375 999 HE2 LYS 133 HE2 LYS 133 -7.597 -5.087 8.888 1000 HE3 LYS 133 HE3 LYS 133 -8.579 -6.033 10.006 1001 HZ1 LYS 133 HZ1 LYS 133 -6.151 -4.462 10.708 1002 HZ2 LYS 133 HZ2 LYS 133 -7.046 -5.407 11.788 1003 HZ3 LYS 133 HZ3 LYS 133 -7.754 -4.054 11.072 1004 H VAL 134 H VAL 134 -4.543 -8.348 4.999 1005 HA VAL 134 HA VAL 134 -4.500 -5.619 4.341 1006 HB VAL 134 HB VAL 134 -5.610 -7.927 2.712 1007 HG11 VAL 134 HG11 VAL 134 -4.766 -5.167 1.803 1008 HG12 VAL 134 HG12 VAL 134 -6.420 -5.777 1.866 1009 HG13 VAL 134 HG13 VAL 134 -5.258 -6.496 0.752 1010 HG21 VAL 134 HG21 VAL 134 -3.409 -7.920 1.619 1011 HG22 VAL 134 HG22 VAL 134 -3.274 -8.247 3.347 1012 HG23 VAL 134 HG23 VAL 134 -2.869 -6.649 2.718 1013 H LEU 135 H LEU 135 -6.047 -4.075 4.322 1014 HA LEU 135 HA LEU 135 -8.582 -4.490 5.475 1015 HB2 LEU 135 HB2 LEU 135 -7.248 -2.230 4.070 1016 HB3 LEU 135 HB3 LEU 135 -8.994 -2.160 4.196 1017 HG LEU 135 HG LEU 135 -7.044 -2.314 6.503 1018 HD11 LEU 135 HD11 LEU 135 -7.893 -0.072 7.028 1019 HD12 LEU 135 HD12 LEU 135 -8.884 -0.106 5.568 1020 HD13 LEU 135 HD13 LEU 135 -7.123 -0.118 5.441 1021 HD21 LEU 135 HD21 LEU 135 -9.028 -3.558 7.069 1022 HD22 LEU 135 HD22 LEU 135 -10.067 -2.264 6.471 1023 HD23 LEU 135 HD23 LEU 135 -9.070 -2.008 7.908 1024 H SER 136 H SER 136 -10.100 -5.769 4.563 1025 HA SER 136 HA SER 136 -10.518 -6.204 1.819 1026 HB2 SER 136 HB2 SER 136 -12.566 -6.305 4.063 1027 HB3 SER 136 HB3 SER 136 -12.777 -7.005 2.459 1028 HG SER 136 HG SER 136 -10.529 -7.744 3.975 1029 H VAL 137 H VAL 137 -11.994 -5.266 0.320 1030 HA VAL 137 HA VAL 137 -11.914 -2.548 0.121 1031 HB VAL 137 HB VAL 137 -14.064 -4.331 -1.043 1032 HG11 VAL 137 HG11 VAL 137 -14.303 -2.590 -2.772 1033 HG12 VAL 137 HG12 VAL 137 -13.178 -1.564 -1.882 1034 HG13 VAL 137 HG13 VAL 137 -14.735 -1.990 -1.170 1035 HG21 VAL 137 HG21 VAL 137 -11.798 -5.049 -1.629 1036 HG22 VAL 137 HG22 VAL 137 -11.423 -3.424 -2.205 1037 HG23 VAL 137 HG23 VAL 137 -12.639 -4.395 -3.034 1038 H LYS 138 H LYS 138 -14.712 -4.383 1.418 1039 HA LYS 138 HA LYS 138 -16.203 -2.015 2.033 1040 HB2 LYS 138 HB2 LYS 138 -17.269 -4.228 1.665 1041 HB3 LYS 138 HB3 LYS 138 -16.554 -4.800 3.167 1042 HG2 LYS 138 HG2 LYS 138 -17.785 -2.872 4.302 1043 HG3 LYS 138 HG3 LYS 138 -18.683 -2.708 2.793 1044 HD2 LYS 138 HD2 LYS 138 -19.968 -4.079 4.290 1045 HD3 LYS 138 HD3 LYS 138 -19.343 -5.104 2.996 1046 HE2 LYS 138 HE2 LYS 138 -17.513 -5.829 4.475 1047 HE3 LYS 138 HE3 LYS 138 -18.176 -4.833 5.769 1048 HZ1 LYS 138 HZ1 LYS 138 -19.555 -7.122 4.472 1049 HZ2 LYS 138 HZ2 LYS 138 -20.181 -6.178 5.731 1050 HZ3 LYS 138 HZ3 LYS 138 -18.823 -7.148 5.996 1051 H GLU 139 H GLU 139 -14.068 -4.133 3.931 1052 HA GLU 139 HA GLU 139 -14.611 -3.087 6.477 1053 HB2 GLU 139 HB2 GLU 139 -13.375 -5.169 6.145 1054 HB3 GLU 139 HB3 GLU 139 -12.061 -4.295 5.371 1055 HG2 GLU 139 HG2 GLU 139 -11.459 -3.230 7.422 1056 HG3 GLU 139 HG3 GLU 139 -12.904 -3.849 8.227 1057 H LEU 140 H LEU 140 -12.400 -2.088 3.952 1058 HA LEU 140 HA LEU 140 -11.104 0.039 5.190 1059 HB2 LEU 140 HB2 LEU 140 -10.860 -1.139 2.860 1060 HB3 LEU 140 HB3 LEU 140 -11.954 0.117 2.314 1061 HG LEU 140 HG LEU 140 -9.448 0.827 3.797 1062 HD11 LEU 140 HD11 LEU 140 -9.659 0.319 0.834 1063 HD12 LEU 140 HD12 LEU 140 -8.746 -0.641 1.999 1064 HD13 LEU 140 HD13 LEU 140 -8.273 1.025 1.672 1065 HD21 LEU 140 HD21 LEU 140 -11.097 2.269 1.720 1066 HD22 LEU 140 HD22 LEU 140 -9.632 2.888 2.482 1067 HD23 LEU 140 HD23 LEU 140 -11.074 2.599 3.454 1068 H LEU 141 H LEU 141 -14.206 -0.067 3.435 1069 HA LEU 141 HA LEU 141 -14.897 2.655 3.622 1070 HB2 LEU 141 HB2 LEU 141 -16.871 0.368 3.755 1071 HB3 LEU 141 HB3 LEU 141 -17.156 1.991 3.151 1072 HG LEU 141 HG LEU 141 -15.412 -0.102 1.836 1073 HD11 LEU 141 HD11 LEU 141 -18.134 0.959 1.081 1074 HD12 LEU 141 HD12 LEU 141 -17.769 -0.656 1.691 1075 HD13 LEU 141 HD13 LEU 141 -17.157 -0.150 0.116 1076 HD21 LEU 141 HD21 LEU 141 -14.595 2.177 1.440 1077 HD22 LEU 141 HD22 LEU 141 -16.194 2.646 0.860 1078 HD23 LEU 141 HD23 LEU 141 -15.249 1.448 -0.025 1079 H GLU 142 H GLU 142 -15.567 -0.068 5.789 1080 HA GLU 142 HA GLU 142 -17.047 1.392 7.710 1081 HB2 GLU 142 HB2 GLU 142 -15.436 -1.141 8.137 1082 HB3 GLU 142 HB3 GLU 142 -16.746 -0.548 9.154 1083 HG2 GLU 142 HG2 GLU 142 -18.306 -0.823 7.254 1084 HG3 GLU 142 HG3 GLU 142 -16.987 -1.494 6.297 1085 H ALA 143 H ALA 143 -13.615 0.814 7.273 1086 HA ALA 143 HA ALA 143 -12.751 1.730 9.818 1087 HB1 ALA 143 HB1 ALA 143 -11.223 1.603 7.218 1088 HB2 ALA 143 HB2 ALA 143 -11.376 0.298 8.395 1089 HB3 ALA 143 HB3 ALA 143 -10.523 1.779 8.828 1090 H ILE 144 H ILE 144 -13.179 3.412 6.698 1091 HA ILE 144 HA ILE 144 -11.987 5.841 7.650 1092 HB ILE 144 HB ILE 144 -12.814 6.871 5.555 1093 HG12 ILE 144 HG12 ILE 144 -13.687 5.071 3.843 1094 HG13 ILE 144 HG13 ILE 144 -14.215 4.221 5.287 1095 HG21 ILE 144 HG21 ILE 144 -10.658 5.758 5.632 1096 HG22 ILE 144 HG22 ILE 144 -11.412 5.533 4.053 1097 HG23 ILE 144 HG23 ILE 144 -11.416 4.217 5.229 1098 HD11 ILE 144 HD11 ILE 144 -15.608 6.117 5.903 1099 HD12 ILE 144 HD12 ILE 144 -16.004 5.533 4.288 1100 HD13 ILE 144 HD13 ILE 144 -15.048 7.001 4.484 1101 H GLY 145 H GLY 145 -14.992 4.483 8.250 1102 HA2 GLY 145 HA2 GLY 145 -16.121 5.909 10.044 1103 HA3 GLY 145 HA3 GLY 145 -16.210 7.128 8.785 1104 H SER 146 H SER 146 -16.742 4.739 6.855 1105 HA SER 146 HA SER 146 -19.638 4.900 7.150 1106 HB2 SER 146 HB2 SER 146 -18.608 5.230 4.920 1107 HB3 SER 146 HB3 SER 146 -18.010 3.572 4.965 1108 HG SER 146 HG SER 146 -19.866 3.138 4.061 Start of MODEL 2 1 H1 MET 1 H1 MET 1 38.634 34.810 26.367 2 H2 MET 1 H2 MET 1 39.328 36.182 25.667 3 H3 MET 1 H3 MET 1 38.457 35.093 24.711 4 HA MET 1 HA MET 1 37.363 36.808 26.866 5 HB2 MET 1 HB2 MET 1 36.986 36.885 23.861 6 HB3 MET 1 HB3 MET 1 36.077 37.866 25.002 7 HG2 MET 1 HG2 MET 1 38.199 38.903 25.739 8 HG3 MET 1 HG3 MET 1 39.045 37.975 24.501 9 HE1 MET 1 HE1 MET 1 36.398 40.799 25.205 10 HE2 MET 1 HE2 MET 1 35.470 39.649 24.238 11 HE3 MET 1 HE3 MET 1 35.888 41.225 23.569 12 H GLY 2 H GLY 2 35.069 36.672 27.173 13 HA2 GLY 2 HA2 GLY 2 32.950 35.584 26.729 14 HA3 GLY 2 HA3 GLY 2 33.836 34.155 26.222 15 H SER 3 H SER 3 31.968 33.530 27.920 16 HA SER 3 HA SER 3 33.386 33.084 30.472 17 HB2 SER 3 HB2 SER 3 31.280 33.393 31.719 18 HB3 SER 3 HB3 SER 3 31.730 34.864 30.855 19 HG SER 3 HG SER 3 29.686 34.683 30.263 20 H SER 4 H SER 4 32.338 31.286 31.772 21 HA SER 4 HA SER 4 30.867 29.320 30.166 22 HB2 SER 4 HB2 SER 4 33.189 28.645 29.843 23 HB3 SER 4 HB3 SER 4 33.482 28.700 31.580 24 HG SER 4 HG SER 4 32.224 26.762 30.047 25 H HIS 5 H HIS 5 29.605 27.897 31.364 26 HA HIS 5 HA HIS 5 29.697 28.067 34.295 27 HB2 HIS 5 HB2 HIS 5 27.141 28.355 32.688 28 HB3 HIS 5 HB3 HIS 5 27.261 28.317 34.443 29 HD1 HIS 5 HD1 HIS 5 28.111 30.459 35.619 30 HD2 HIS 5 HD2 HIS 5 27.857 30.776 31.486 31 HE1 HIS 5 HE1 HIS 5 28.392 32.898 35.112 32 HE2 HIS 5 HE2 HIS 5 28.069 33.080 32.627 33 H HIS 6 H HIS 6 30.799 25.978 33.254 34 HA HIS 6 HA HIS 6 29.028 23.888 32.454 35 HB2 HIS 6 HB2 HIS 6 31.097 22.414 32.868 36 HB3 HIS 6 HB3 HIS 6 31.196 23.645 31.619 37 HD1 HIS 6 HD1 HIS 6 32.925 25.488 31.906 38 HD2 HIS 6 HD2 HIS 6 32.689 22.938 35.184 39 HE1 HIS 6 HE1 HIS 6 34.933 26.012 33.315 40 HE2 HIS 6 HE2 HIS 6 34.858 24.348 35.194 41 H HIS 7 H HIS 7 27.494 23.340 33.839 42 HA HIS 7 HA HIS 7 28.115 21.793 36.152 43 HB2 HIS 7 HB2 HIS 7 28.354 24.062 37.123 44 HB3 HIS 7 HB3 HIS 7 26.713 24.445 36.612 45 HD1 HIS 7 HD1 HIS 7 24.865 23.845 38.217 46 HD2 HIS 7 HD2 HIS 7 28.460 21.978 39.159 47 HE1 HIS 7 HE1 HIS 7 24.481 22.715 40.421 48 HE2 HIS 7 HE2 HIS 7 26.590 21.422 40.859 49 H HIS 8 H HIS 8 26.577 20.272 36.318 50 HA HIS 8 HA HIS 8 23.789 20.814 35.802 51 HB2 HIS 8 HB2 HIS 8 23.626 19.043 33.996 52 HB3 HIS 8 HB3 HIS 8 24.417 20.537 33.510 53 HD1 HIS 8 HD1 HIS 8 26.800 20.382 32.698 54 HD2 HIS 8 HD2 HIS 8 25.448 16.814 34.331 55 HE1 HIS 8 HE1 HIS 8 28.556 18.686 32.147 56 HE2 HIS 8 HE2 HIS 8 27.824 16.602 33.337 57 H HIS 9 H HIS 9 22.425 19.252 36.697 58 HA HIS 9 HA HIS 9 23.707 17.402 38.522 59 HB2 HIS 9 HB2 HIS 9 21.402 16.925 39.328 60 HB3 HIS 9 HB3 HIS 9 21.801 18.637 39.361 61 HD1 HIS 9 HD1 HIS 9 20.286 20.201 38.070 62 HD2 HIS 9 HD2 HIS 9 19.539 16.193 37.246 63 HE1 HIS 9 HE1 HIS 9 18.189 20.172 36.693 64 HE2 HIS 9 HE2 HIS 9 17.889 17.764 36.034 65 H HIS 10 H HIS 10 21.646 17.165 35.647 66 HA HIS 10 HA HIS 10 21.261 15.514 34.148 67 HB2 HIS 10 HB2 HIS 10 23.724 15.589 33.983 68 HB3 HIS 10 HB3 HIS 10 23.842 14.352 35.227 69 HD1 HIS 10 HD1 HIS 10 22.356 14.758 31.743 70 HD2 HIS 10 HD2 HIS 10 23.934 11.817 34.223 71 HE1 HIS 10 HE1 HIS 10 22.429 12.677 30.354 72 HE2 HIS 10 HE2 HIS 10 23.544 10.962 31.813 73 H SER 11 H SER 11 20.970 14.889 37.374 74 HA SER 11 HA SER 11 20.534 12.043 37.280 75 HB2 SER 11 HB2 SER 11 19.728 12.379 39.644 76 HB3 SER 11 HB3 SER 11 21.365 12.961 39.344 77 HG SER 11 HG SER 11 19.015 14.397 39.854 78 H SER 12 H SER 12 18.910 11.702 35.761 79 HA SER 12 HA SER 12 16.254 11.749 36.788 80 HB2 SER 12 HB2 SER 12 16.322 14.094 36.048 81 HB3 SER 12 HB3 SER 12 16.792 13.582 34.427 82 HG SER 12 HG SER 12 14.417 12.611 35.621 83 H GLY 13 H GLY 13 16.150 9.584 36.334 84 HA2 GLY 13 HA2 GLY 13 16.680 8.675 33.585 85 HA3 GLY 13 HA3 GLY 13 16.528 7.650 35.000 86 H ARG 14 H ARG 14 15.211 6.713 32.966 87 HA ARG 14 HA ARG 14 12.434 6.964 33.727 88 HB2 ARG 14 HB2 ARG 14 11.582 7.583 31.542 89 HB3 ARG 14 HB3 ARG 14 12.706 8.816 32.101 90 HG2 ARG 14 HG2 ARG 14 14.465 7.828 30.678 91 HG3 ARG 14 HG3 ARG 14 13.292 6.652 30.079 92 HD2 ARG 14 HD2 ARG 14 11.899 8.534 29.255 93 HD3 ARG 14 HD3 ARG 14 13.161 9.654 29.770 94 HE ARG 14 HE ARG 14 13.233 7.855 27.483 95 HH11 ARG 14 HH11 ARG 14 15.009 9.972 29.547 96 HH12 ARG 14 HH12 ARG 14 16.238 10.259 28.367 97 HH21 ARG 14 HH21 ARG 14 14.801 8.237 25.983 98 HH22 ARG 14 HH22 ARG 14 16.114 9.299 26.360 99 H GLU 15 H GLU 15 11.056 5.528 32.166 100 HA GLU 15 HA GLU 15 12.566 3.079 31.502 101 HB2 GLU 15 HB2 GLU 15 9.658 3.459 32.270 102 HB3 GLU 15 HB3 GLU 15 10.346 1.926 31.744 103 HG2 GLU 15 HG2 GLU 15 11.744 1.788 33.655 104 HG3 GLU 15 HG3 GLU 15 11.421 3.461 34.100 105 H ASN 16 H ASN 16 11.821 1.882 29.557 106 HA ASN 16 HA ASN 16 10.984 3.803 27.465 107 HB2 ASN 16 HB2 ASN 16 12.697 2.818 25.985 108 HB3 ASN 16 HB3 ASN 16 13.404 3.558 27.418 109 HD21 ASN 16 HD21 ASN 16 14.317 2.231 29.000 110 HD22 ASN 16 HD22 ASN 16 14.710 0.578 28.696 111 H LEU 17 H LEU 17 10.186 2.916 25.489 112 HA LEU 17 HA LEU 17 8.899 0.281 25.753 113 HB2 LEU 17 HB2 LEU 17 8.257 2.656 24.021 114 HB3 LEU 17 HB3 LEU 17 7.523 1.079 23.788 115 HG LEU 17 HG LEU 17 6.750 1.246 26.222 116 HD11 LEU 17 HD11 LEU 17 8.204 3.065 26.927 117 HD12 LEU 17 HD12 LEU 17 6.505 3.493 27.133 118 HD13 LEU 17 HD13 LEU 17 7.422 4.151 25.777 119 HD21 LEU 17 HD21 LEU 17 5.267 1.439 24.318 120 HD22 LEU 17 HD22 LEU 17 5.638 3.157 24.177 121 HD23 LEU 17 HD23 LEU 17 4.788 2.551 25.600 122 H TYR 18 H TYR 18 9.235 -1.326 24.239 123 HA TYR 18 HA TYR 18 11.723 -1.170 22.807 124 HB2 TYR 18 HB2 TYR 18 9.682 -3.399 23.006 125 HB3 TYR 18 HB3 TYR 18 11.248 -3.548 22.215 126 HD1 TYR 18 HD2 TYR 18 13.341 -3.347 23.587 127 HD2 TYR 18 HD1 TYR 18 9.480 -3.586 25.375 128 HE1 TYR 18 HE2 TYR 18 14.374 -3.972 25.725 129 HE2 TYR 18 HE1 TYR 18 10.511 -4.216 27.519 130 HH TYR 18 HH TYR 18 13.800 -3.863 28.148 131 H PHE 19 H PHE 19 12.038 -0.636 20.763 132 HA PHE 19 HA PHE 19 9.777 -0.757 18.858 133 HB2 PHE 19 HB2 PHE 19 10.458 1.561 19.341 134 HB3 PHE 19 HB3 PHE 19 12.111 1.180 18.876 135 HD1 PHE 19 HD2 PHE 19 8.635 1.176 17.533 136 HD2 PHE 19 HD1 PHE 19 12.793 1.539 16.676 137 HE1 PHE 19 HE2 PHE 19 8.101 1.772 15.209 138 HE2 PHE 19 HE1 PHE 19 12.263 2.133 14.349 139 HZ PHE 19 HZ PHE 19 9.915 2.251 13.610 140 H GLN 20 H GLN 20 10.035 -1.999 17.102 141 HA GLN 20 HA GLN 20 12.717 -2.609 16.101 142 HB2 GLN 20 HB2 GLN 20 10.798 -4.648 17.179 143 HB3 GLN 20 HB3 GLN 20 11.874 -5.080 15.856 144 HG2 GLN 20 HG2 GLN 20 13.800 -4.525 17.185 145 HG3 GLN 20 HG3 GLN 20 12.771 -3.991 18.516 146 HE21 GLN 20 HE21 GLN 20 14.013 -6.719 16.776 147 HE22 GLN 20 HE22 GLN 20 13.522 -7.924 17.909 148 H GLY 21 H GLY 21 12.741 -2.245 14.007 149 HA2 GLY 21 HA2 GLY 21 11.897 -3.385 11.920 150 HA3 GLY 21 HA3 GLY 21 10.312 -2.830 12.429 151 H HIS 22 H HIS 22 13.348 -1.924 10.983 152 HA HIS 22 HA HIS 22 12.966 0.882 10.945 153 HB2 HIS 22 HB2 HIS 22 15.174 -0.022 10.602 154 HB3 HIS 22 HB3 HIS 22 14.641 -0.925 9.189 155 HD1 HIS 22 HD1 HIS 22 15.167 2.661 10.302 156 HD2 HIS 22 HD2 HIS 22 14.903 0.418 6.815 157 HE1 HIS 22 HE1 HIS 22 15.745 4.241 8.442 158 HE2 HIS 22 HE2 HIS 22 15.765 2.815 6.376 159 H MET 23 H MET 23 10.811 1.267 10.265 160 HA MET 23 HA MET 23 9.770 0.492 7.765 161 HB2 MET 23 HB2 MET 23 8.122 2.259 8.131 162 HB3 MET 23 HB3 MET 23 8.385 1.334 9.601 163 HG2 MET 23 HG2 MET 23 9.986 3.171 10.308 164 HG3 MET 23 HG3 MET 23 9.336 4.109 8.963 165 HE1 MET 23 HE1 MET 23 6.523 4.243 8.705 166 HE2 MET 23 HE2 MET 23 5.452 3.860 10.052 167 HE3 MET 23 HE3 MET 23 6.356 2.574 9.248 168 H LEU 24 H LEU 24 9.754 1.502 5.762 169 HA LEU 24 HA LEU 24 11.984 3.380 5.336 170 HB2 LEU 24 HB2 LEU 24 10.655 1.324 3.597 171 HB3 LEU 24 HB3 LEU 24 11.641 2.594 2.889 172 HG LEU 24 HG LEU 24 12.781 0.912 5.090 173 HD11 LEU 24 HD11 LEU 24 13.628 -0.679 3.425 174 HD12 LEU 24 HD12 LEU 24 12.668 0.121 2.179 175 HD13 LEU 24 HD13 LEU 24 11.866 -0.707 3.514 176 HD21 LEU 24 HD21 LEU 24 14.877 1.390 3.921 177 HD22 LEU 24 HD22 LEU 24 14.019 2.876 4.330 178 HD23 LEU 24 HD23 LEU 24 13.986 2.267 2.673 179 H GLU 25 H GLU 25 11.646 5.398 4.647 180 HA GLU 25 HA GLU 25 9.020 6.379 4.145 181 HB2 GLU 25 HB2 GLU 25 10.811 7.739 5.229 182 HB3 GLU 25 HB3 GLU 25 11.684 7.751 3.697 183 HG2 GLU 25 HG2 GLU 25 9.709 8.799 2.650 184 HG3 GLU 25 HG3 GLU 25 8.975 8.903 4.240 185 H VAL 26 H VAL 26 7.996 6.104 2.284 186 HA VAL 26 HA VAL 26 9.523 6.093 -0.243 187 HB VAL 26 HB VAL 26 7.888 4.448 -1.139 188 HG11 VAL 26 HG11 VAL 26 8.808 2.482 0.008 189 HG12 VAL 26 HG12 VAL 26 9.393 3.515 1.312 190 HG13 VAL 26 HG13 VAL 26 10.057 3.686 -0.312 191 HG21 VAL 26 HG21 VAL 26 6.959 4.239 1.736 192 HG22 VAL 26 HG22 VAL 26 6.446 3.202 0.403 193 HG23 VAL 26 HG23 VAL 26 6.032 4.915 0.395 194 H GLU 27 H GLU 27 8.298 6.754 -2.149 195 HA GLU 27 HA GLU 27 6.162 8.671 -1.505 196 HB2 GLU 27 HB2 GLU 27 8.190 9.385 -2.836 197 HB3 GLU 27 HB3 GLU 27 7.617 8.355 -4.139 198 HG2 GLU 27 HG2 GLU 27 5.593 9.674 -4.340 199 HG3 GLU 27 HG3 GLU 27 6.077 10.664 -2.963 200 H VAL 28 H VAL 28 4.155 7.997 -1.715 201 HA VAL 28 HA VAL 28 3.542 5.528 -3.115 202 HB VAL 28 HB VAL 28 1.753 7.266 -1.404 203 HG11 VAL 28 HG11 VAL 28 1.433 4.402 -2.308 204 HG12 VAL 28 HG12 VAL 28 0.506 5.787 -2.886 205 HG13 VAL 28 HG13 VAL 28 0.356 5.263 -1.208 206 HG21 VAL 28 HG21 VAL 28 3.683 6.489 -0.130 207 HG22 VAL 28 HG22 VAL 28 3.359 4.827 -0.624 208 HG23 VAL 28 HG23 VAL 28 2.210 5.683 0.405 209 H ILE 29 H ILE 29 2.826 5.544 -5.162 210 HA ILE 29 HA ILE 29 1.358 7.914 -6.140 211 HB ILE 29 HB ILE 29 2.241 5.837 -8.083 212 HG12 ILE 29 HG12 ILE 29 4.219 7.751 -6.805 213 HG13 ILE 29 HG13 ILE 29 4.177 6.019 -6.508 214 HG21 ILE 29 HG21 ILE 29 2.260 8.863 -8.020 215 HG22 ILE 29 HG22 ILE 29 1.099 7.825 -8.854 216 HG23 ILE 29 HG23 ILE 29 2.776 7.885 -9.398 217 HD11 ILE 29 HD11 ILE 29 5.911 6.581 -8.082 218 HD12 ILE 29 HD12 ILE 29 4.736 7.354 -9.145 219 HD13 ILE 29 HD13 ILE 29 4.666 5.613 -8.870 220 H SER 30 H SER 30 -0.442 7.494 -7.701 221 HA SER 30 HA SER 30 -1.796 4.911 -7.246 222 HB2 SER 30 HB2 SER 30 -3.048 7.651 -7.000 223 HB3 SER 30 HB3 SER 30 -3.982 6.158 -7.125 224 HG SER 30 HG SER 30 -2.116 5.850 -5.243 225 H GLY 31 H GLY 31 -1.738 3.983 -9.193 226 HA2 GLY 31 HA2 GLY 31 -2.290 5.556 -11.612 227 HA3 GLY 31 HA3 GLY 31 -1.751 3.884 -11.557 228 H ARG 32 H ARG 32 -4.386 5.884 -12.119 229 HA ARG 32 HA ARG 32 -6.432 4.070 -11.178 230 HB2 ARG 32 HB2 ARG 32 -6.661 6.600 -11.241 231 HB3 ARG 32 HB3 ARG 32 -6.838 6.459 -12.987 232 HG2 ARG 32 HG2 ARG 32 -8.829 5.093 -12.706 233 HG3 ARG 32 HG3 ARG 32 -8.630 5.133 -10.953 234 HD2 ARG 32 HD2 ARG 32 -10.303 6.732 -11.509 235 HD3 ARG 32 HD3 ARG 32 -8.850 7.630 -11.073 236 HE ARG 32 HE ARG 32 -8.977 7.199 -13.877 237 HH11 ARG 32 HH11 ARG 32 -10.279 9.148 -11.353 238 HH12 ARG 32 HH12 ARG 32 -10.707 10.437 -12.422 239 HH21 ARG 32 HH21 ARG 32 -9.545 8.843 -15.232 240 HH22 ARG 32 HH22 ARG 32 -10.292 10.274 -14.597 241 H THR 33 H THR 33 -5.631 2.221 -12.404 242 HA THR 33 HA THR 33 -6.382 2.213 -15.249 243 HB THR 33 HB THR 33 -4.217 1.235 -14.826 244 HG1 THR 33 HG1 THR 33 -5.545 0.168 -16.400 245 HG21 THR 33 HG21 THR 33 -4.523 0.638 -12.466 246 HG22 THR 33 HG22 THR 33 -3.916 -0.734 -13.395 247 HG23 THR 33 HG23 THR 33 -5.618 -0.665 -12.933 248 H LEU 34 H LEU 34 -7.363 0.943 -12.162 249 HA LEU 34 HA LEU 34 -9.194 -1.015 -13.247 250 HB2 LEU 34 HB2 LEU 34 -7.875 -1.214 -11.078 251 HB3 LEU 34 HB3 LEU 34 -8.981 -0.043 -10.396 252 HG LEU 34 HG LEU 34 -9.444 -2.459 -9.844 253 HD11 LEU 34 HD11 LEU 34 -11.866 -2.273 -10.075 254 HD12 LEU 34 HD12 LEU 34 -11.658 -0.956 -11.230 255 HD13 LEU 34 HD13 LEU 34 -11.155 -0.746 -9.552 256 HD21 LEU 34 HD21 LEU 34 -10.570 -3.830 -11.512 257 HD22 LEU 34 HD22 LEU 34 -8.940 -3.409 -12.035 258 HD23 LEU 34 HD23 LEU 34 -10.330 -2.571 -12.724 259 H ASN 35 H ASN 35 -9.650 1.822 -11.118 260 HA ASN 35 HA ASN 35 -12.470 1.954 -11.885 261 HB2 ASN 35 HB2 ASN 35 -12.623 3.569 -9.980 262 HB3 ASN 35 HB3 ASN 35 -12.022 1.981 -9.515 263 HD21 ASN 35 HD21 ASN 35 -11.674 4.486 -8.144 264 HD22 ASN 35 HD22 ASN 35 -9.973 4.761 -8.042 265 H GLN 36 H GLN 36 -11.247 2.714 -14.077 266 HA GLN 36 HA GLN 36 -10.268 5.366 -14.215 267 HB2 GLN 36 HB2 GLN 36 -11.363 3.564 -16.380 268 HB3 GLN 36 HB3 GLN 36 -10.609 5.121 -16.692 269 HG2 GLN 36 HG2 GLN 36 -8.548 4.254 -15.557 270 HG3 GLN 36 HG3 GLN 36 -9.320 2.671 -15.505 271 HE21 GLN 36 HE21 GLN 36 -7.902 5.099 -17.545 272 HE22 GLN 36 HE22 GLN 36 -7.755 4.119 -18.960 273 H GLY 37 H GLY 37 -13.537 4.118 -14.328 274 HA2 GLY 37 HA2 GLY 37 -14.510 6.879 -14.690 275 HA3 GLY 37 HA3 GLY 37 -15.124 5.618 -15.741 276 H ALA 38 H ALA 38 -14.530 4.553 -12.540 277 HA ALA 38 HA ALA 38 -17.231 5.217 -11.621 278 HB1 ALA 38 HB1 ALA 38 -17.490 3.112 -12.864 279 HB2 ALA 38 HB2 ALA 38 -17.815 2.903 -11.142 280 HB3 ALA 38 HB3 ALA 38 -16.281 2.357 -11.825 281 H THR 39 H THR 39 -17.572 4.907 -9.365 282 HA THR 39 HA THR 39 -15.160 4.977 -7.738 283 HB THR 39 HB THR 39 -16.763 5.351 -5.833 284 HG1 THR 39 HG1 THR 39 -18.956 5.745 -6.396 285 HG21 THR 39 HG21 THR 39 -17.070 7.215 -8.196 286 HG22 THR 39 HG22 THR 39 -15.762 7.252 -7.013 287 HG23 THR 39 HG23 THR 39 -17.414 7.621 -6.515 288 H VAL 40 H VAL 40 -15.293 3.725 -5.561 289 HA VAL 40 HA VAL 40 -15.019 1.003 -6.133 290 HB VAL 40 HB VAL 40 -15.589 2.123 -3.386 291 HG11 VAL 40 HG11 VAL 40 -15.626 -0.300 -3.488 292 HG12 VAL 40 HG12 VAL 40 -14.200 0.253 -2.608 293 HG13 VAL 40 HG13 VAL 40 -14.047 -0.312 -4.273 294 HG21 VAL 40 HG21 VAL 40 -13.826 3.453 -4.424 295 HG22 VAL 40 HG22 VAL 40 -12.939 1.983 -4.823 296 HG23 VAL 40 HG23 VAL 40 -13.170 2.442 -3.137 297 H GLU 41 H GLU 41 -17.728 2.712 -4.600 298 HA GLU 41 HA GLU 41 -19.301 0.508 -3.918 299 HB2 GLU 41 HB2 GLU 41 -19.699 2.790 -3.100 300 HB3 GLU 41 HB3 GLU 41 -20.201 3.288 -4.709 301 HG2 GLU 41 HG2 GLU 41 -22.135 1.855 -4.604 302 HG3 GLU 41 HG3 GLU 41 -21.599 1.181 -3.066 303 H GLU 42 H GLU 42 -18.762 1.929 -7.043 304 HA GLU 42 HA GLU 42 -21.104 0.778 -8.290 305 HB2 GLU 42 HB2 GLU 42 -18.622 1.936 -9.579 306 HB3 GLU 42 HB3 GLU 42 -20.146 1.593 -10.388 307 HG2 GLU 42 HG2 GLU 42 -19.678 3.647 -8.235 308 HG3 GLU 42 HG3 GLU 42 -19.907 3.962 -9.953 309 H LYS 43 H LYS 43 -17.880 -0.261 -7.606 310 HA LYS 43 HA LYS 43 -18.172 -2.574 -9.423 311 HB2 LYS 43 HB2 LYS 43 -15.638 -1.028 -8.838 312 HB3 LYS 43 HB3 LYS 43 -15.757 -2.444 -9.874 313 HG2 LYS 43 HG2 LYS 43 -17.103 -1.236 -11.464 314 HG3 LYS 43 HG3 LYS 43 -17.199 0.158 -10.389 315 HD2 LYS 43 HD2 LYS 43 -15.572 0.589 -12.133 316 HD3 LYS 43 HD3 LYS 43 -14.745 0.442 -10.581 317 HE2 LYS 43 HE2 LYS 43 -13.508 -0.728 -12.315 318 HE3 LYS 43 HE3 LYS 43 -14.139 -1.877 -11.137 319 HZ1 LYS 43 HZ1 LYS 43 -16.018 -2.244 -12.723 320 HZ2 LYS 43 HZ2 LYS 43 -14.513 -2.785 -13.269 321 HZ3 LYS 43 HZ3 LYS 43 -15.164 -1.341 -13.870 322 H LEU 44 H LEU 44 -18.951 -2.702 -6.733 323 HA LEU 44 HA LEU 44 -16.878 -3.723 -5.051 324 HB2 LEU 44 HB2 LEU 44 -19.884 -4.005 -4.886 325 HB3 LEU 44 HB3 LEU 44 -18.777 -4.547 -3.638 326 HG LEU 44 HG LEU 44 -19.112 -1.675 -4.535 327 HD11 LEU 44 HD11 LEU 44 -20.189 -1.320 -2.379 328 HD12 LEU 44 HD12 LEU 44 -20.036 -3.037 -2.002 329 HD13 LEU 44 HD13 LEU 44 -21.075 -2.513 -3.329 330 HD21 LEU 44 HD21 LEU 44 -16.850 -2.115 -3.762 331 HD22 LEU 44 HD22 LEU 44 -17.473 -2.872 -2.296 332 HD23 LEU 44 HD23 LEU 44 -17.722 -1.148 -2.572 333 H THR 45 H THR 45 -15.859 -5.250 -6.491 334 HA THR 45 HA THR 45 -16.982 -7.936 -6.254 335 HB THR 45 HB THR 45 -17.905 -7.189 -8.392 336 HG1 THR 45 HG1 THR 45 -17.532 -9.139 -9.091 337 HG21 THR 45 HG21 THR 45 -15.038 -6.757 -9.256 338 HG22 THR 45 HG22 THR 45 -16.216 -5.483 -8.939 339 HG23 THR 45 HG23 THR 45 -16.469 -6.604 -10.275 340 H GLU 46 H GLU 46 -15.376 -9.577 -7.327 341 HA GLU 46 HA GLU 46 -12.950 -9.479 -5.961 342 HB2 GLU 46 HB2 GLU 46 -14.061 -11.521 -6.916 343 HB3 GLU 46 HB3 GLU 46 -13.475 -11.036 -8.502 344 HG2 GLU 46 HG2 GLU 46 -11.156 -11.163 -7.640 345 HG3 GLU 46 HG3 GLU 46 -11.793 -11.758 -6.108 346 H GLU 47 H GLU 47 -13.710 -8.416 -9.234 347 HA GLU 47 HA GLU 47 -11.193 -7.992 -10.305 348 HB2 GLU 47 HB2 GLU 47 -13.216 -7.672 -11.610 349 HB3 GLU 47 HB3 GLU 47 -13.704 -6.321 -10.594 350 HG2 GLU 47 HG2 GLU 47 -11.629 -5.125 -11.368 351 HG3 GLU 47 HG3 GLU 47 -11.402 -6.428 -12.532 352 H TYR 48 H TYR 48 -13.053 -5.871 -8.141 353 HA TYR 48 HA TYR 48 -11.149 -3.746 -8.177 354 HB2 TYR 48 HB2 TYR 48 -13.739 -3.939 -7.340 355 HB3 TYR 48 HB3 TYR 48 -12.903 -4.000 -5.792 356 HD1 TYR 48 HD1 TYR 48 -11.129 -2.114 -5.374 357 HD2 TYR 48 HD2 TYR 48 -14.197 -1.871 -8.309 358 HE1 TYR 48 HE1 TYR 48 -10.863 0.324 -5.443 359 HE2 TYR 48 HE2 TYR 48 -13.947 0.569 -8.392 360 HH TYR 48 HH TYR 48 -11.305 2.188 -7.094 361 H PHE 49 H PHE 49 -11.669 -6.570 -6.148 362 HA PHE 49 HA PHE 49 -9.925 -5.883 -4.035 363 HB2 PHE 49 HB2 PHE 49 -11.676 -7.640 -3.892 364 HB3 PHE 49 HB3 PHE 49 -10.742 -8.644 -4.994 365 HD1 PHE 49 HD1 PHE 49 -10.915 -7.260 -1.593 366 HD2 PHE 49 HD2 PHE 49 -8.775 -9.832 -4.236 367 HE1 PHE 49 HE1 PHE 49 -9.716 -8.229 0.324 368 HE2 PHE 49 HE2 PHE 49 -7.574 -10.801 -2.317 369 HZ PHE 49 HZ PHE 49 -8.045 -10.004 -0.037 370 H ASN 50 H ASN 50 -9.393 -8.314 -6.621 371 HA ASN 50 HA ASN 50 -6.717 -8.812 -6.060 372 HB2 ASN 50 HB2 ASN 50 -8.088 -8.988 -8.752 373 HB3 ASN 50 HB3 ASN 50 -6.565 -9.765 -8.329 374 HD21 ASN 50 HD21 ASN 50 -8.976 -11.004 -9.240 375 HD22 ASN 50 HD22 ASN 50 -9.485 -12.094 -7.997 376 H ALA 51 H ALA 51 -8.037 -6.015 -7.517 377 HA ALA 51 HA ALA 51 -5.629 -5.325 -9.002 378 HB1 ALA 51 HB1 ALA 51 -7.818 -4.830 -9.973 379 HB2 ALA 51 HB2 ALA 51 -6.870 -3.361 -9.736 380 HB3 ALA 51 HB3 ALA 51 -8.177 -3.755 -8.619 381 H VAL 52 H VAL 52 -7.507 -3.752 -6.356 382 HA VAL 52 HA VAL 52 -5.227 -1.941 -5.964 383 HB VAL 52 HB VAL 52 -6.735 -0.511 -4.715 384 HG11 VAL 52 HG11 VAL 52 -6.712 -0.262 -7.132 385 HG12 VAL 52 HG12 VAL 52 -8.338 0.032 -6.514 386 HG13 VAL 52 HG13 VAL 52 -7.956 -1.503 -7.296 387 HG21 VAL 52 HG21 VAL 52 -8.828 -2.652 -5.144 388 HG22 VAL 52 HG22 VAL 52 -9.106 -1.066 -4.426 389 HG23 VAL 52 HG23 VAL 52 -8.075 -2.237 -3.605 390 H ASN 53 H ASN 53 -5.618 -4.828 -4.815 391 HA ASN 53 HA ASN 53 -5.317 -4.211 -1.958 392 HB2 ASN 53 HB2 ASN 53 -6.077 -6.655 -3.495 393 HB3 ASN 53 HB3 ASN 53 -5.305 -6.873 -1.925 394 HD21 ASN 53 HD21 ASN 53 -7.926 -5.054 -3.474 395 HD22 ASN 53 HD22 ASN 53 -8.981 -5.104 -2.108 396 H TYR 54 H TYR 54 -3.179 -4.047 -4.276 397 HA TYR 54 HA TYR 54 -1.062 -5.154 -2.565 398 HB2 TYR 54 HB2 TYR 54 0.126 -6.166 -4.398 399 HB3 TYR 54 HB3 TYR 54 -1.514 -6.799 -4.387 400 HD1 TYR 54 HD1 TYR 54 0.878 -4.658 -6.187 401 HD2 TYR 54 HD2 TYR 54 -3.046 -6.314 -6.208 402 HE1 TYR 54 HE1 TYR 54 0.633 -4.036 -8.552 403 HE2 TYR 54 HE2 TYR 54 -3.299 -5.684 -8.572 404 HH TYR 54 HH TYR 54 -0.690 -4.723 -10.513 405 H ALA 55 H ALA 55 1.097 -4.323 -3.088 406 HA ALA 55 HA ALA 55 1.107 -1.750 -4.531 407 HB1 ALA 55 HB1 ALA 55 2.529 -0.774 -2.806 408 HB2 ALA 55 HB2 ALA 55 2.460 -2.273 -1.876 409 HB3 ALA 55 HB3 ALA 55 0.998 -1.314 -2.113 410 H GLU 56 H GLU 56 3.025 -1.263 -5.629 411 HA GLU 56 HA GLU 56 4.860 -3.518 -6.015 412 HB2 GLU 56 HB2 GLU 56 4.410 -1.001 -7.637 413 HB3 GLU 56 HB3 GLU 56 5.615 -2.223 -8.027 414 HG2 GLU 56 HG2 GLU 56 3.838 -3.890 -8.297 415 HG3 GLU 56 HG3 GLU 56 2.631 -2.669 -7.901 416 H ILE 57 H ILE 57 6.609 -3.523 -4.745 417 HA ILE 57 HA ILE 57 7.888 -0.957 -4.012 418 HB ILE 57 HB ILE 57 8.156 -3.631 -2.605 419 HG12 ILE 57 HG12 ILE 57 6.930 -2.279 -0.728 420 HG13 ILE 57 HG13 ILE 57 6.385 -1.255 -2.049 421 HG21 ILE 57 HG21 ILE 57 9.150 -0.889 -1.817 422 HG22 ILE 57 HG22 ILE 57 10.137 -2.251 -2.349 423 HG23 ILE 57 HG23 ILE 57 9.256 -2.343 -0.824 424 HD11 ILE 57 HD11 ILE 57 4.729 -2.927 -1.469 425 HD12 ILE 57 HD12 ILE 57 5.894 -4.212 -1.793 426 HD13 ILE 57 HD13 ILE 57 5.330 -3.180 -3.108 427 H ASN 58 H ASN 58 10.056 -0.635 -4.386 428 HA ASN 58 HA ASN 58 11.430 -2.125 -6.347 429 HB2 ASN 58 HB2 ASN 58 11.877 0.263 -5.805 430 HB3 ASN 58 HB3 ASN 58 12.592 -0.236 -4.277 431 HD21 ASN 58 HD21 ASN 58 13.675 1.156 -6.661 432 HD22 ASN 58 HD22 ASN 58 15.082 0.260 -7.093 433 H GLU 59 H GLU 59 12.991 -3.718 -6.215 434 HA GLU 59 HA GLU 59 12.845 -5.592 -4.175 435 HB2 GLU 59 HB2 GLU 59 13.639 -6.191 -6.376 436 HB3 GLU 59 HB3 GLU 59 15.053 -5.163 -6.194 437 HG2 GLU 59 HG2 GLU 59 16.028 -6.592 -4.598 438 HG3 GLU 59 HG3 GLU 59 14.519 -7.460 -4.337 439 H GLU 60 H GLU 60 15.019 -2.862 -4.464 440 HA GLU 60 HA GLU 60 16.898 -3.569 -2.511 441 HB2 GLU 60 HB2 GLU 60 15.937 -0.780 -3.190 442 HB3 GLU 60 HB3 GLU 60 17.459 -1.200 -2.412 443 HG2 GLU 60 HG2 GLU 60 16.641 -1.919 -5.223 444 HG3 GLU 60 HG3 GLU 60 17.786 -0.661 -4.764 445 H ASP 61 H ASP 61 14.029 -1.443 -2.104 446 HA ASP 61 HA ASP 61 14.181 -1.336 0.732 447 HB2 ASP 61 HB2 ASP 61 11.735 -0.969 -1.023 448 HB3 ASP 61 HB3 ASP 61 11.937 -0.383 0.626 449 H TRP 62 H TRP 62 12.537 -3.426 -1.531 450 HA TRP 62 HA TRP 62 10.951 -5.029 0.066 451 HB2 TRP 62 HB2 TRP 62 11.130 -5.077 -2.415 452 HB3 TRP 62 HB3 TRP 62 12.694 -5.862 -2.273 453 HD1 TRP 62 HD1 TRP 62 12.693 -8.457 -1.519 454 HE1 TRP 62 HE1 TRP 62 10.858 -10.250 -1.713 455 HE3 TRP 62 HE3 TRP 62 8.656 -5.411 -2.253 456 HZ2 TRP 62 HZ2 TRP 62 8.075 -10.356 -2.131 457 HZ3 TRP 62 HZ3 TRP 62 6.442 -6.440 -2.538 458 HH2 TRP 62 HH2 TRP 62 6.160 -8.862 -2.478 459 H ASN 63 H ASN 63 14.403 -5.442 -0.704 460 HA ASN 63 HA ASN 63 14.805 -7.737 0.930 461 HB2 ASN 63 HB2 ASN 63 16.743 -5.744 -0.266 462 HB3 ASN 63 HB3 ASN 63 17.246 -7.199 0.593 463 HD21 ASN 63 HD21 ASN 63 17.652 -6.414 -2.207 464 HD22 ASN 63 HD22 ASN 63 16.983 -7.696 -3.146 465 H ALA 64 H ALA 64 15.177 -4.264 1.495 466 HA ALA 64 HA ALA 64 16.496 -4.348 3.971 467 HB1 ALA 64 HB1 ALA 64 14.429 -2.352 3.040 468 HB2 ALA 64 HB2 ALA 64 16.157 -2.285 2.688 469 HB3 ALA 64 HB3 ALA 64 15.589 -2.114 4.349 470 H LEU 65 H LEU 65 12.992 -4.199 3.310 471 HA LEU 65 HA LEU 65 12.260 -4.638 6.054 472 HB2 LEU 65 HB2 LEU 65 10.627 -4.774 3.513 473 HB3 LEU 65 HB3 LEU 65 9.955 -4.866 5.130 474 HG LEU 65 HG LEU 65 11.462 -2.480 4.041 475 HD11 LEU 65 HD11 LEU 65 8.490 -2.907 4.354 476 HD12 LEU 65 HD12 LEU 65 9.378 -2.781 2.835 477 HD13 LEU 65 HD13 LEU 65 9.271 -1.388 3.910 478 HD21 LEU 65 HD21 LEU 65 10.555 -1.327 6.011 479 HD22 LEU 65 HD22 LEU 65 11.601 -2.672 6.463 480 HD23 LEU 65 HD23 LEU 65 9.849 -2.844 6.571 481 H GLY 66 H GLY 66 13.506 -6.739 3.797 482 HA2 GLY 66 HA2 GLY 66 13.577 -9.031 3.585 483 HA3 GLY 66 HA3 GLY 66 13.050 -9.085 5.259 484 H LEU 67 H LEU 67 11.482 -8.036 2.238 485 HA LEU 67 HA LEU 67 8.995 -9.244 3.110 486 HB2 LEU 67 HB2 LEU 67 9.706 -7.540 0.727 487 HB3 LEU 67 HB3 LEU 67 8.094 -8.163 1.020 488 HG LEU 67 HG LEU 67 9.578 -6.305 2.887 489 HD11 LEU 67 HD11 LEU 67 8.043 -4.575 2.103 490 HD12 LEU 67 HD12 LEU 67 7.351 -5.703 0.937 491 HD13 LEU 67 HD13 LEU 67 9.031 -5.191 0.780 492 HD21 LEU 67 HD21 LEU 67 7.962 -7.734 4.030 493 HD22 LEU 67 HD22 LEU 67 6.711 -7.256 2.884 494 HD23 LEU 67 HD23 LEU 67 7.398 -6.063 3.987 495 H GLN 68 H GLN 68 7.674 -10.516 1.747 496 HA GLN 68 HA GLN 68 8.949 -11.964 -0.476 497 HB2 GLN 68 HB2 GLN 68 9.035 -13.409 1.535 498 HB3 GLN 68 HB3 GLN 68 7.298 -13.219 1.743 499 HG2 GLN 68 HG2 GLN 68 6.937 -14.334 -0.424 500 HG3 GLN 68 HG3 GLN 68 8.679 -14.564 -0.576 501 HE21 GLN 68 HE21 GLN 68 8.473 -16.804 -0.627 502 HE22 GLN 68 HE22 GLN 68 8.083 -17.721 0.785 503 H GLU 69 H GLU 69 7.412 -12.779 -2.037 504 HA GLU 69 HA GLU 69 5.426 -10.851 -2.565 505 HB2 GLU 69 HB2 GLU 69 5.872 -13.535 -3.879 506 HB3 GLU 69 HB3 GLU 69 4.826 -12.265 -4.499 507 HG2 GLU 69 HG2 GLU 69 6.801 -12.004 -5.709 508 HG3 GLU 69 HG3 GLU 69 6.882 -10.768 -4.453 509 H GLY 70 H GLY 70 3.620 -10.628 -1.520 510 HA2 GLY 70 HA2 GLY 70 1.362 -11.553 -1.121 511 HA3 GLY 70 HA3 GLY 70 2.141 -13.045 -0.622 512 H ASP 71 H ASP 71 4.155 -10.914 0.682 513 HA ASP 71 HA ASP 71 3.185 -11.124 3.326 514 HB2 ASP 71 HB2 ASP 71 5.355 -9.478 2.053 515 HB3 ASP 71 HB3 ASP 71 4.931 -9.229 3.742 516 H ARG 72 H ARG 72 2.432 -9.534 4.769 517 HA ARG 72 HA ARG 72 0.636 -7.585 3.541 518 HB2 ARG 72 HB2 ARG 72 0.930 -8.266 6.472 519 HB3 ARG 72 HB3 ARG 72 -0.429 -7.466 5.690 520 HG2 ARG 72 HG2 ARG 72 -1.134 -9.462 4.636 521 HG3 ARG 72 HG3 ARG 72 0.383 -10.286 5.016 522 HD2 ARG 72 HD2 ARG 72 -1.831 -9.492 6.900 523 HD3 ARG 72 HD3 ARG 72 -1.216 -11.113 6.563 524 HE ARG 72 HE ARG 72 0.009 -9.086 8.264 525 HH11 ARG 72 HH11 ARG 72 0.206 -12.226 6.857 526 HH12 ARG 72 HH12 ARG 72 1.569 -12.685 7.815 527 HH21 ARG 72 HH21 ARG 72 1.756 -9.697 9.483 528 HH22 ARG 72 HH22 ARG 72 2.402 -11.293 9.319 529 H VAL 73 H VAL 73 1.411 -5.587 3.181 530 HA VAL 73 HA VAL 73 3.303 -4.422 5.126 531 HB VAL 73 HB VAL 73 4.050 -2.911 3.294 532 HG11 VAL 73 HG11 VAL 73 5.303 -4.941 3.844 533 HG12 VAL 73 HG12 VAL 73 5.405 -4.568 2.123 534 HG13 VAL 73 HG13 VAL 73 4.337 -5.856 2.685 535 HG21 VAL 73 HG21 VAL 73 2.063 -2.981 1.878 536 HG22 VAL 73 HG22 VAL 73 2.342 -4.691 1.542 537 HG23 VAL 73 HG23 VAL 73 3.486 -3.477 0.963 538 H LYS 74 H LYS 74 2.796 -2.552 6.129 539 HA LYS 74 HA LYS 74 0.285 -1.229 5.396 540 HB2 LYS 74 HB2 LYS 74 0.355 -1.750 7.723 541 HB3 LYS 74 HB3 LYS 74 1.974 -1.082 7.898 542 HG2 LYS 74 HG2 LYS 74 1.157 1.156 7.574 543 HG3 LYS 74 HG3 LYS 74 -0.451 0.562 7.168 544 HD2 LYS 74 HD2 LYS 74 0.843 0.076 9.848 545 HD3 LYS 74 HD3 LYS 74 -0.146 1.498 9.505 546 HE2 LYS 74 HE2 LYS 74 -2.028 0.020 8.914 547 HE3 LYS 74 HE3 LYS 74 -1.038 -1.383 9.321 548 HZ1 LYS 74 HZ1 LYS 74 -0.855 -0.518 11.583 549 HZ2 LYS 74 HZ2 LYS 74 -2.456 -0.828 11.150 550 HZ3 LYS 74 HZ3 LYS 74 -1.884 0.766 11.184 551 H VAL 75 H VAL 75 0.154 0.966 5.032 552 HA VAL 75 HA VAL 75 2.669 2.383 4.434 553 HB VAL 75 HB VAL 75 0.060 2.630 2.900 554 HG11 VAL 75 HG11 VAL 75 1.343 4.030 1.348 555 HG12 VAL 75 HG12 VAL 75 2.766 3.878 2.382 556 HG13 VAL 75 HG13 VAL 75 1.332 4.718 2.973 557 HG21 VAL 75 HG21 VAL 75 2.656 1.315 2.072 558 HG22 VAL 75 HG22 VAL 75 1.249 1.555 1.037 559 HG23 VAL 75 HG23 VAL 75 1.141 0.488 2.435 560 H LYS 76 H LYS 76 2.839 4.388 5.336 561 HA LYS 76 HA LYS 76 0.450 5.490 6.689 562 HB2 LYS 76 HB2 LYS 76 3.258 5.136 7.720 563 HB3 LYS 76 HB3 LYS 76 2.156 6.293 8.449 564 HG2 LYS 76 HG2 LYS 76 0.953 4.698 9.492 565 HG3 LYS 76 HG3 LYS 76 1.049 3.580 8.131 566 HD2 LYS 76 HD2 LYS 76 3.043 2.669 8.833 567 HD3 LYS 76 HD3 LYS 76 3.510 4.105 9.753 568 HE2 LYS 76 HE2 LYS 76 1.721 3.570 11.394 569 HE3 LYS 76 HE3 LYS 76 1.385 2.091 10.502 570 HZ1 LYS 76 HZ1 LYS 76 2.799 1.666 12.401 571 HZ2 LYS 76 HZ2 LYS 76 3.951 2.767 11.838 572 HZ3 LYS 76 HZ3 LYS 76 3.645 1.348 10.972 573 H THR 77 H THR 77 -0.041 7.493 6.118 574 HA THR 77 HA THR 77 2.092 9.412 5.423 575 HB THR 77 HB THR 77 0.910 10.299 3.534 576 HG1 THR 77 HG1 THR 77 -1.116 9.331 2.882 577 HG21 THR 77 HG21 THR 77 2.262 8.321 3.014 578 HG22 THR 77 HG22 THR 77 0.851 8.416 1.963 579 HG23 THR 77 HG23 THR 77 0.870 7.281 3.314 580 H GLU 78 H GLU 78 0.698 11.655 4.974 581 HA GLU 78 HA GLU 78 -0.397 12.389 7.500 582 HB2 GLU 78 HB2 GLU 78 -0.806 14.565 6.488 583 HB3 GLU 78 HB3 GLU 78 0.792 13.983 6.040 584 HG2 GLU 78 HG2 GLU 78 -0.041 13.322 3.849 585 HG3 GLU 78 HG3 GLU 78 -1.666 13.837 4.295 586 H PHE 79 H PHE 79 -1.792 10.913 4.744 587 HA PHE 79 HA PHE 79 -4.487 11.901 5.265 588 HB2 PHE 79 HB2 PHE 79 -3.425 9.965 3.193 589 HB3 PHE 79 HB3 PHE 79 -5.112 10.455 3.317 590 HD1 PHE 79 HD2 PHE 79 -5.694 12.894 3.026 591 HD2 PHE 79 HD1 PHE 79 -1.857 11.318 2.047 592 HE1 PHE 79 HE2 PHE 79 -5.239 14.873 1.636 593 HE2 PHE 79 HE1 PHE 79 -1.399 13.294 0.657 594 HZ PHE 79 HZ PHE 79 -3.086 15.074 0.449 595 H GLY 80 H GLY 80 -2.558 9.162 6.106 596 HA2 GLY 80 HA2 GLY 80 -3.844 8.181 8.189 597 HA3 GLY 80 HA3 GLY 80 -4.887 7.574 6.913 598 H GLU 81 H GLU 81 -4.430 5.427 7.462 599 HA GLU 81 HA GLU 81 -1.927 4.429 6.331 600 HB2 GLU 81 HB2 GLU 81 -1.581 2.872 8.232 601 HB3 GLU 81 HB3 GLU 81 -1.388 4.561 8.679 602 HG2 GLU 81 HG2 GLU 81 -3.467 4.598 9.820 603 HG3 GLU 81 HG3 GLU 81 -3.953 3.054 9.125 604 H VAL 82 H VAL 82 -2.003 2.297 5.566 605 HA VAL 82 HA VAL 82 -4.490 0.781 5.818 606 HB VAL 82 HB VAL 82 -4.805 2.279 3.854 607 HG11 VAL 82 HG11 VAL 82 -2.476 2.436 3.126 608 HG12 VAL 82 HG12 VAL 82 -3.522 1.912 1.807 609 HG13 VAL 82 HG13 VAL 82 -2.507 0.738 2.643 610 HG21 VAL 82 HG21 VAL 82 -5.556 0.544 2.285 611 HG22 VAL 82 HG22 VAL 82 -5.991 0.150 3.947 612 HG23 VAL 82 HG23 VAL 82 -4.627 -0.663 3.178 613 H VAL 83 H VAL 83 -4.260 -1.459 5.370 614 HA VAL 83 HA VAL 83 -1.468 -2.390 5.069 615 HB VAL 83 HB VAL 83 -3.770 -3.957 6.271 616 HG11 VAL 83 HG11 VAL 83 -2.015 -5.392 5.434 617 HG12 VAL 83 HG12 VAL 83 -1.945 -5.367 7.199 618 HG13 VAL 83 HG13 VAL 83 -0.785 -4.429 6.256 619 HG21 VAL 83 HG21 VAL 83 -2.777 -3.481 8.471 620 HG22 VAL 83 HG22 VAL 83 -3.328 -2.008 7.668 621 HG23 VAL 83 HG23 VAL 83 -1.610 -2.403 7.703 622 H VAL 84 H VAL 84 -0.983 -3.296 3.159 623 HA VAL 84 HA VAL 84 -3.088 -4.686 1.609 624 HB VAL 84 HB VAL 84 -2.146 -3.789 -0.472 625 HG11 VAL 84 HG11 VAL 84 -2.916 -1.468 -0.261 626 HG12 VAL 84 HG12 VAL 84 -2.876 -1.613 1.496 627 HG13 VAL 84 HG13 VAL 84 -4.003 -2.592 0.558 628 HG21 VAL 84 HG21 VAL 84 -0.325 -2.180 1.334 629 HG22 VAL 84 HG22 VAL 84 -0.506 -1.933 -0.403 630 HG23 VAL 84 HG23 VAL 84 0.162 -3.448 0.204 631 H PHE 85 H PHE 85 -1.952 -5.910 -0.341 632 HA PHE 85 HA PHE 85 0.082 -7.653 0.766 633 HB2 PHE 85 HB2 PHE 85 -1.345 -7.636 -1.902 634 HB3 PHE 85 HB3 PHE 85 -0.108 -8.814 -1.480 635 HD1 PHE 85 HD1 PHE 85 -0.515 -10.253 0.602 636 HD2 PHE 85 HD2 PHE 85 -3.582 -8.013 -1.333 637 HE1 PHE 85 HE1 PHE 85 -2.219 -11.693 1.637 638 HE2 PHE 85 HE2 PHE 85 -5.286 -9.448 -0.294 639 HZ PHE 85 HZ PHE 85 -4.607 -11.291 1.188 640 H ALA 86 H ALA 86 2.180 -7.937 -0.010 641 HA ALA 86 HA ALA 86 3.289 -5.618 -1.420 642 HB1 ALA 86 HB1 ALA 86 5.446 -6.363 -0.566 643 HB2 ALA 86 HB2 ALA 86 4.692 -7.809 0.107 644 HB3 ALA 86 HB3 ALA 86 4.266 -6.219 0.736 645 H LYS 87 H LYS 87 3.895 -5.722 -3.497 646 HA LYS 87 HA LYS 87 4.885 -8.286 -4.581 647 HB2 LYS 87 HB2 LYS 87 3.191 -6.272 -6.087 648 HB3 LYS 87 HB3 LYS 87 3.933 -7.699 -6.789 649 HG2 LYS 87 HG2 LYS 87 2.549 -9.067 -5.189 650 HG3 LYS 87 HG3 LYS 87 1.693 -7.574 -4.786 651 HD2 LYS 87 HD2 LYS 87 1.184 -7.303 -7.229 652 HD3 LYS 87 HD3 LYS 87 1.877 -8.903 -7.496 653 HE2 LYS 87 HE2 LYS 87 0.213 -9.797 -5.862 654 HE3 LYS 87 HE3 LYS 87 -0.531 -8.206 -5.829 655 HZ1 LYS 87 HZ1 LYS 87 -0.945 -8.398 -8.214 656 HZ2 LYS 87 HZ2 LYS 87 -1.684 -9.659 -7.365 657 HZ3 LYS 87 HZ3 LYS 87 -0.256 -9.942 -8.222 658 H LYS 88 H LYS 88 6.617 -8.200 -5.919 659 HA LYS 88 HA LYS 88 8.340 -5.952 -5.494 660 HB2 LYS 88 HB2 LYS 88 8.980 -8.420 -5.472 661 HB3 LYS 88 HB3 LYS 88 8.892 -8.359 -7.230 662 HG2 LYS 88 HG2 LYS 88 10.591 -6.601 -7.243 663 HG3 LYS 88 HG3 LYS 88 10.676 -6.689 -5.483 664 HD2 LYS 88 HD2 LYS 88 11.296 -8.976 -7.364 665 HD3 LYS 88 HD3 LYS 88 12.508 -7.940 -6.610 666 HE2 LYS 88 HE2 LYS 88 11.749 -8.677 -4.392 667 HE3 LYS 88 HE3 LYS 88 10.541 -9.714 -5.152 668 HZ1 LYS 88 HZ1 LYS 88 12.611 -10.869 -4.468 669 HZ2 LYS 88 HZ2 LYS 88 13.458 -9.972 -5.624 670 HZ3 LYS 88 HZ3 LYS 88 12.240 -11.044 -6.109 671 H GLY 89 H GLY 89 8.600 -4.245 -6.812 672 HA2 GLY 89 HA2 GLY 89 7.736 -4.494 -9.636 673 HA3 GLY 89 HA3 GLY 89 7.320 -3.103 -8.650 674 H ASP 90 H ASP 90 8.567 -2.735 -11.055 675 HA ASP 90 HA ASP 90 11.436 -2.502 -10.679 676 HB2 ASP 90 HB2 ASP 90 9.673 -1.682 -13.003 677 HB3 ASP 90 HB3 ASP 90 11.436 -1.708 -13.009 678 H VAL 91 H VAL 91 9.289 -0.735 -9.265 679 HA VAL 91 HA VAL 91 9.644 1.934 -10.139 680 HB VAL 91 HB VAL 91 8.729 2.578 -7.930 681 HG11 VAL 91 HG11 VAL 91 6.553 1.443 -8.163 682 HG12 VAL 91 HG12 VAL 91 7.293 0.277 -9.262 683 HG13 VAL 91 HG13 VAL 91 7.195 1.977 -9.719 684 HG21 VAL 91 HG21 VAL 91 8.876 -0.385 -7.315 685 HG22 VAL 91 HG22 VAL 91 8.084 0.835 -6.317 686 HG23 VAL 91 HG23 VAL 91 9.833 0.886 -6.547 687 HA PRO 92 HA PRO 92 13.620 3.133 -8.467 688 HB2 PRO 92 HB2 PRO 92 13.079 5.678 -7.570 689 HB3 PRO 92 HB3 PRO 92 13.342 5.266 -9.267 690 HG2 PRO 92 HG2 PRO 92 10.762 5.636 -7.785 691 HG3 PRO 92 HG3 PRO 92 11.218 6.212 -9.401 692 HD2 PRO 92 HD2 PRO 92 9.670 4.038 -9.066 693 HD3 PRO 92 HD3 PRO 92 10.865 4.131 -10.377 694 H LYS 93 H LYS 93 14.765 3.304 -6.478 695 HA LYS 93 HA LYS 93 13.456 2.120 -4.265 696 HB2 LYS 93 HB2 LYS 93 15.896 1.887 -4.743 697 HB3 LYS 93 HB3 LYS 93 16.120 3.556 -4.226 698 HG2 LYS 93 HG2 LYS 93 15.205 2.952 -2.008 699 HG3 LYS 93 HG3 LYS 93 15.099 1.275 -2.540 700 HD2 LYS 93 HD2 LYS 93 17.562 1.303 -2.915 701 HD3 LYS 93 HD3 LYS 93 17.603 2.927 -2.219 702 HE2 LYS 93 HE2 LYS 93 16.714 0.389 -0.852 703 HE3 LYS 93 HE3 LYS 93 18.180 1.310 -0.517 704 HZ1 LYS 93 HZ1 LYS 93 16.543 1.812 1.133 705 HZ2 LYS 93 HZ2 LYS 93 15.380 2.180 -0.036 706 HZ3 LYS 93 HZ3 LYS 93 16.733 3.182 0.158 707 H GLY 94 H GLY 94 12.904 2.942 -2.211 708 HA2 GLY 94 HA2 GLY 94 12.028 4.501 -0.755 709 HA3 GLY 94 HA3 GLY 94 12.997 5.723 -1.564 710 H MET 95 H MET 95 10.804 3.842 -3.473 711 HA MET 95 HA MET 95 8.617 5.741 -3.314 712 HB2 MET 95 HB2 MET 95 10.329 6.739 -4.852 713 HB3 MET 95 HB3 MET 95 10.161 5.333 -5.888 714 HG2 MET 95 HG2 MET 95 7.936 5.907 -6.448 715 HG3 MET 95 HG3 MET 95 7.871 7.143 -5.190 716 HE1 MET 95 HE1 MET 95 6.955 7.896 -8.104 717 HE2 MET 95 HE2 MET 95 7.783 9.438 -8.322 718 HE3 MET 95 HE3 MET 95 7.050 9.039 -6.768 719 H ILE 96 H ILE 96 6.660 4.763 -3.931 720 HA ILE 96 HA ILE 96 6.838 2.076 -5.132 721 HB ILE 96 HB ILE 96 5.209 1.163 -3.539 722 HG12 ILE 96 HG12 ILE 96 5.557 3.764 -2.011 723 HG13 ILE 96 HG13 ILE 96 4.120 3.320 -2.926 724 HG21 ILE 96 HG21 ILE 96 7.643 2.329 -2.183 725 HG22 ILE 96 HG22 ILE 96 7.583 0.826 -3.105 726 HG23 ILE 96 HG23 ILE 96 6.686 0.969 -1.595 727 HD11 ILE 96 HD11 ILE 96 5.192 1.872 -0.510 728 HD12 ILE 96 HD12 ILE 96 3.755 1.420 -1.429 729 HD13 ILE 96 HD13 ILE 96 3.797 2.950 -0.552 730 H PHE 97 H PHE 97 5.011 1.334 -6.215 731 HA PHE 97 HA PHE 97 3.059 3.427 -6.942 732 HB2 PHE 97 HB2 PHE 97 4.366 2.573 -8.828 733 HB3 PHE 97 HB3 PHE 97 3.905 0.922 -8.435 734 HD1 PHE 97 HD1 PHE 97 1.644 0.109 -8.915 735 HD2 PHE 97 HD2 PHE 97 2.822 4.079 -9.928 736 HE1 PHE 97 HE1 PHE 97 -0.328 0.322 -10.370 737 HE2 PHE 97 HE2 PHE 97 0.857 4.286 -11.391 738 HZ PHE 97 HZ PHE 97 -0.719 2.408 -11.612 739 H ILE 98 H ILE 98 0.972 3.177 -6.328 740 HA ILE 98 HA ILE 98 0.001 0.447 -5.736 741 HB ILE 98 HB ILE 98 -0.811 3.008 -4.325 742 HG12 ILE 98 HG12 ILE 98 0.746 0.579 -3.382 743 HG13 ILE 98 HG13 ILE 98 1.359 2.219 -3.554 744 HG21 ILE 98 HG21 ILE 98 -1.799 0.174 -3.910 745 HG22 ILE 98 HG22 ILE 98 -2.726 1.510 -4.592 746 HG23 ILE 98 HG23 ILE 98 -2.216 1.564 -2.906 747 HD11 ILE 98 HD11 ILE 98 0.973 1.679 -1.231 748 HD12 ILE 98 HD12 ILE 98 -0.712 1.293 -1.574 749 HD13 ILE 98 HD13 ILE 98 -0.134 2.949 -1.751 750 HA PRO 99 HA PRO 99 -3.062 1.312 -8.944 751 HB2 PRO 99 HB2 PRO 99 -4.574 -0.771 -7.434 752 HB3 PRO 99 HB3 PRO 99 -4.200 -0.686 -9.158 753 HG2 PRO 99 HG2 PRO 99 -2.897 -2.388 -7.584 754 HG3 PRO 99 HG3 PRO 99 -2.039 -1.504 -8.862 755 HD2 PRO 99 HD2 PRO 99 -2.090 -0.992 -5.908 756 HD3 PRO 99 HD3 PRO 99 -0.729 -0.896 -7.045 757 H MET 100 H MET 100 -4.563 2.889 -8.922 758 HA MET 100 HA MET 100 -5.344 4.262 -6.632 759 HB2 MET 100 HB2 MET 100 -5.372 4.939 -9.151 760 HB3 MET 100 HB3 MET 100 -7.001 4.289 -9.143 761 HG2 MET 100 HG2 MET 100 -5.938 6.628 -7.581 762 HG3 MET 100 HG3 MET 100 -7.145 6.637 -8.860 763 HE1 MET 100 HE1 MET 100 -7.797 6.045 -4.418 764 HE2 MET 100 HE2 MET 100 -6.720 7.164 -5.253 765 HE3 MET 100 HE3 MET 100 -6.343 5.441 -5.213 766 H GLY 101 H GLY 101 -6.599 3.537 -5.018 767 HA2 GLY 101 HA2 GLY 101 -9.297 2.637 -5.570 768 HA3 GLY 101 HA3 GLY 101 -8.264 1.360 -4.941 769 HA PRO 102 HA PRO 102 -10.244 3.736 -1.393 770 HB2 PRO 102 HB2 PRO 102 -10.972 1.502 0.036 771 HB3 PRO 102 HB3 PRO 102 -12.014 2.301 -1.145 772 HG2 PRO 102 HG2 PRO 102 -10.350 -0.161 -1.452 773 HG3 PRO 102 HG3 PRO 102 -11.962 0.191 -2.093 774 HD2 PRO 102 HD2 PRO 102 -9.699 0.317 -3.600 775 HD3 PRO 102 HD3 PRO 102 -11.127 1.334 -3.908 776 H TYR 103 H TYR 103 -8.033 1.035 -1.590 777 HA TYR 103 HA TYR 103 -6.863 1.261 0.987 778 HB2 TYR 103 HB2 TYR 103 -5.680 0.148 -1.575 779 HB3 TYR 103 HB3 TYR 103 -5.055 -0.126 0.049 780 HD1 TYR 103 HD2 TYR 103 -8.300 -0.469 -1.791 781 HD2 TYR 103 HD1 TYR 103 -5.596 -2.157 1.027 782 HE1 TYR 103 HE2 TYR 103 -9.752 -2.436 -1.591 783 HE2 TYR 103 HE1 TYR 103 -7.036 -4.136 1.227 784 HH TYR 103 HH TYR 103 -8.943 -5.098 0.610 785 H ALA 104 H ALA 104 -5.701 2.303 -2.226 786 HA ALA 104 HA ALA 104 -3.572 3.888 -1.349 787 HB1 ALA 104 HB1 ALA 104 -3.664 4.947 -3.541 788 HB2 ALA 104 HB2 ALA 104 -5.282 4.296 -3.805 789 HB3 ALA 104 HB3 ALA 104 -3.902 3.205 -3.690 790 H ASN 105 H ASN 105 -6.990 4.654 -1.780 791 HA ASN 105 HA ASN 105 -6.994 7.400 -1.428 792 HB2 ASN 105 HB2 ASN 105 -8.991 6.289 -2.102 793 HB3 ASN 105 HB3 ASN 105 -8.996 5.269 -0.668 794 HD21 ASN 105 HD21 ASN 105 -9.776 6.075 1.242 795 HD22 ASN 105 HD22 ASN 105 -10.649 7.559 1.343 796 H MET 106 H MET 106 -6.355 4.948 0.941 797 HA MET 106 HA MET 106 -6.930 6.557 3.262 798 HB2 MET 106 HB2 MET 106 -5.320 4.002 3.011 799 HB3 MET 106 HB3 MET 106 -5.895 4.712 4.516 800 HG2 MET 106 HG2 MET 106 -7.738 3.843 2.306 801 HG3 MET 106 HG3 MET 106 -7.227 2.777 3.613 802 HE1 MET 106 HE1 MET 106 -7.293 4.043 6.238 803 HE2 MET 106 HE2 MET 106 -8.330 2.657 5.882 804 HE3 MET 106 HE3 MET 106 -8.992 4.066 6.713 805 H VAL 107 H VAL 107 -4.376 6.553 1.047 806 HA VAL 107 HA VAL 107 -2.575 7.842 2.980 807 HB VAL 107 HB VAL 107 -0.621 6.618 2.054 808 HG11 VAL 107 HG11 VAL 107 -1.635 5.885 4.157 809 HG12 VAL 107 HG12 VAL 107 -1.012 4.511 3.245 810 HG13 VAL 107 HG13 VAL 107 -2.745 4.839 3.268 811 HG21 VAL 107 HG21 VAL 107 -0.978 4.561 0.759 812 HG22 VAL 107 HG22 VAL 107 -1.561 5.982 -0.110 813 HG23 VAL 107 HG23 VAL 107 -2.709 4.906 0.689 814 H ILE 108 H ILE 108 -3.927 7.845 -0.150 815 HA ILE 108 HA ILE 108 -1.814 9.631 -1.161 816 HB ILE 108 HB ILE 108 -2.464 9.136 -3.383 817 HG12 ILE 108 HG12 ILE 108 -4.468 7.276 -3.493 818 HG13 ILE 108 HG13 ILE 108 -5.024 8.283 -2.160 819 HG21 ILE 108 HG21 ILE 108 -1.098 7.410 -2.488 820 HG22 ILE 108 HG22 ILE 108 -2.343 6.629 -3.468 821 HG23 ILE 108 HG23 ILE 108 -2.477 6.630 -1.711 822 HD11 ILE 108 HD11 ILE 108 -4.297 9.271 -4.906 823 HD12 ILE 108 HD12 ILE 108 -4.938 10.237 -3.577 824 HD13 ILE 108 HD13 ILE 108 -5.935 8.983 -4.314 825 H ASP 109 H ASP 109 -2.768 11.320 -2.789 826 HA ASP 109 HA ASP 109 -4.679 12.884 -1.217 827 HB2 ASP 109 HB2 ASP 109 -2.575 13.963 -1.741 828 HB3 ASP 109 HB3 ASP 109 -2.812 13.673 -3.462 829 HA PRO 110 HA PRO 110 -7.688 11.852 -4.442 830 HB2 PRO 110 HB2 PRO 110 -9.902 12.313 -3.008 831 HB3 PRO 110 HB3 PRO 110 -8.883 10.904 -2.689 832 HG2 PRO 110 HG2 PRO 110 -9.004 13.517 -1.227 833 HG3 PRO 110 HG3 PRO 110 -8.912 11.874 -0.567 834 HD2 PRO 110 HD2 PRO 110 -6.740 13.552 -0.844 835 HD3 PRO 110 HD3 PRO 110 -6.630 11.781 -0.801 836 H SER 111 H SER 111 -6.653 14.793 -3.430 837 HA SER 111 HA SER 111 -8.774 16.462 -4.471 838 HB2 SER 111 HB2 SER 111 -5.887 17.244 -3.950 839 HB3 SER 111 HB3 SER 111 -7.279 18.319 -4.067 840 HG SER 111 HG SER 111 -6.415 16.730 -1.967 841 H THR 112 H THR 112 -6.575 14.477 -5.919 842 HA THR 112 HA THR 112 -5.719 16.157 -8.106 843 HB THR 112 HB THR 112 -4.571 14.184 -8.945 844 HG1 THR 112 HG1 THR 112 -5.248 12.485 -6.888 845 HG21 THR 112 HG21 THR 112 -3.530 15.409 -7.071 846 HG22 THR 112 HG22 THR 112 -3.129 13.692 -7.033 847 HG23 THR 112 HG23 THR 112 -4.346 14.337 -5.930 848 H ASP 113 H ASP 113 -6.442 16.151 -10.201 849 HA ASP 113 HA ASP 113 -8.956 14.772 -10.782 850 HB2 ASP 113 HB2 ASP 113 -7.421 16.865 -12.350 851 HB3 ASP 113 HB3 ASP 113 -8.983 16.201 -12.821 852 H GLY 114 H GLY 114 -5.964 15.362 -12.669 853 HA2 GLY 114 HA2 GLY 114 -4.703 13.993 -14.012 854 HA3 GLY 114 HA3 GLY 114 -5.295 12.654 -13.045 855 H THR 115 H THR 115 -6.519 11.186 -14.047 856 HA THR 115 HA THR 115 -7.863 10.122 -15.518 857 HB THR 115 HB THR 115 -8.654 12.890 -16.459 858 HG1 THR 115 HG1 THR 115 -9.245 12.549 -14.302 859 HG21 THR 115 HG21 THR 115 -9.969 10.208 -16.932 860 HG22 THR 115 HG22 THR 115 -9.161 11.195 -18.150 861 HG23 THR 115 HG23 THR 115 -10.642 11.774 -17.387 862 H GLY 116 H GLY 116 -6.679 12.925 -17.436 863 HA2 GLY 116 HA2 GLY 116 -6.025 11.092 -19.620 864 HA3 GLY 116 HA3 GLY 116 -6.060 12.843 -19.707 865 H MET 117 H MET 117 -4.054 10.436 -20.139 866 HA MET 117 HA MET 117 -1.821 10.372 -20.487 867 HB2 MET 117 HB2 MET 117 -1.923 13.174 -19.390 868 HB3 MET 117 HB3 MET 117 -0.406 12.401 -19.829 869 HG2 MET 117 HG2 MET 117 -1.321 12.023 -22.104 870 HG3 MET 117 HG3 MET 117 -2.738 12.964 -21.641 871 HE1 MET 117 HE1 MET 117 -0.485 15.151 -24.126 872 HE2 MET 117 HE2 MET 117 -2.041 14.339 -23.954 873 HE3 MET 117 HE3 MET 117 -0.560 13.388 -24.076 874 HA PRO 118 HA PRO 118 -0.248 8.724 -16.759 875 HB2 PRO 118 HB2 PRO 118 2.344 8.289 -17.371 876 HB3 PRO 118 HB3 PRO 118 1.029 7.423 -18.169 877 HG2 PRO 118 HG2 PRO 118 2.727 9.638 -19.187 878 HG3 PRO 118 HG3 PRO 118 1.957 8.311 -20.071 879 HD2 PRO 118 HD2 PRO 118 1.030 10.975 -19.857 880 HD3 PRO 118 HD3 PRO 118 0.139 9.603 -20.536 881 H GLN 119 H GLN 119 -0.480 10.367 -15.212 882 HA GLN 119 HA GLN 119 1.601 12.352 -14.846 883 HB2 GLN 119 HB2 GLN 119 -0.855 11.690 -13.204 884 HB3 GLN 119 HB3 GLN 119 0.228 13.035 -12.872 885 HG2 GLN 119 HG2 GLN 119 -1.356 12.669 -15.413 886 HG3 GLN 119 HG3 GLN 119 -1.818 13.709 -14.068 887 HE21 GLN 119 HE21 GLN 119 -0.671 15.635 -13.726 888 HE22 GLN 119 HE22 GLN 119 0.373 16.303 -14.925 889 H PHE 120 H PHE 120 3.458 11.868 -13.881 890 HA PHE 120 HA PHE 120 3.656 9.627 -12.019 891 HB2 PHE 120 HB2 PHE 120 5.709 11.427 -13.322 892 HB3 PHE 120 HB3 PHE 120 6.135 10.241 -12.093 893 HD1 PHE 120 HD2 PHE 120 4.494 10.554 -15.427 894 HD2 PHE 120 HD1 PHE 120 6.599 8.038 -12.706 895 HE1 PHE 120 HE2 PHE 120 4.666 8.818 -17.162 896 HE2 PHE 120 HE1 PHE 120 6.771 6.303 -14.440 897 HZ PHE 120 HZ PHE 120 5.804 6.691 -16.670 898 H LYS 121 H LYS 121 5.553 10.288 -10.255 899 HA LYS 121 HA LYS 121 5.857 11.144 -8.183 900 HB2 LYS 121 HB2 LYS 121 4.612 13.633 -9.374 901 HB3 LYS 121 HB3 LYS 121 5.293 13.558 -7.758 902 HG2 LYS 121 HG2 LYS 121 7.038 14.465 -8.950 903 HG3 LYS 121 HG3 LYS 121 7.449 12.752 -8.976 904 HD2 LYS 121 HD2 LYS 121 7.805 13.536 -11.176 905 HD3 LYS 121 HD3 LYS 121 6.288 12.641 -11.230 906 HE2 LYS 121 HE2 LYS 121 6.469 15.648 -10.954 907 HE3 LYS 121 HE3 LYS 121 6.278 14.813 -12.492 908 HZ1 LYS 121 HZ1 LYS 121 4.186 13.888 -11.665 909 HZ2 LYS 121 HZ2 LYS 121 4.160 15.575 -11.674 910 HZ3 LYS 121 HZ3 LYS 121 4.366 14.745 -10.219 911 H GLY 122 H GLY 122 4.825 10.833 -6.282 912 HA2 GLY 122 HA2 GLY 122 1.868 11.021 -6.268 913 HA3 GLY 122 HA3 GLY 122 2.699 9.613 -5.625 914 H VAL 123 H VAL 123 1.476 10.118 -3.666 915 HA VAL 123 HA VAL 123 2.331 12.447 -2.119 916 HB VAL 123 HB VAL 123 0.497 10.149 -1.387 917 HG11 VAL 123 HG11 VAL 123 1.048 12.713 0.127 918 HG12 VAL 123 HG12 VAL 123 1.529 11.089 0.621 919 HG13 VAL 123 HG13 VAL 123 -0.180 11.515 0.541 920 HG21 VAL 123 HG21 VAL 123 -1.303 11.781 -1.679 921 HG22 VAL 123 HG22 VAL 123 -0.379 11.578 -3.167 922 HG23 VAL 123 HG23 VAL 123 -0.127 13.006 -2.162 923 H LYS 124 H LYS 124 3.917 12.458 -0.603 924 HA LYS 124 HA LYS 124 5.637 10.202 -0.283 925 HB2 LYS 124 HB2 LYS 124 5.518 12.925 0.998 926 HB3 LYS 124 HB3 LYS 124 6.685 11.718 1.524 927 HG2 LYS 124 HG2 LYS 124 6.476 12.428 -1.373 928 HG3 LYS 124 HG3 LYS 124 7.355 13.484 -0.268 929 HD2 LYS 124 HD2 LYS 124 7.907 10.532 -0.645 930 HD3 LYS 124 HD3 LYS 124 8.808 11.829 -1.432 931 HE2 LYS 124 HE2 LYS 124 9.402 12.700 0.832 932 HE3 LYS 124 HE3 LYS 124 8.618 11.286 1.533 933 HZ1 LYS 124 HZ1 LYS 124 10.995 10.952 1.364 934 HZ2 LYS 124 HZ2 LYS 124 10.952 11.249 -0.301 935 HZ3 LYS 124 HZ3 LYS 124 10.194 9.883 0.328 936 H GLY 125 H GLY 125 6.047 8.926 1.495 937 HA2 GLY 125 HA2 GLY 125 4.715 9.129 4.002 938 HA3 GLY 125 HA3 GLY 125 3.886 7.974 2.968 939 H THR 126 H THR 126 4.436 6.308 4.505 940 HA THR 126 HA THR 126 7.178 5.290 4.109 941 HB THR 126 HB THR 126 7.268 4.498 6.446 942 HG1 THR 126 HG1 THR 126 5.436 6.047 7.596 943 HG21 THR 126 HG21 THR 126 7.680 6.659 7.522 944 HG22 THR 126 HG22 THR 126 6.789 7.481 6.242 945 HG23 THR 126 HG23 THR 126 8.306 6.659 5.871 946 H VAL 127 H VAL 127 7.418 2.985 4.420 947 HA VAL 127 HA VAL 127 4.918 1.425 4.440 948 HB VAL 127 HB VAL 127 5.746 1.675 2.100 949 HG11 VAL 127 HG11 VAL 127 7.787 0.505 1.400 950 HG12 VAL 127 HG12 VAL 127 8.147 0.131 3.087 951 HG13 VAL 127 HG13 VAL 127 8.139 1.809 2.538 952 HG21 VAL 127 HG21 VAL 127 4.412 -0.268 2.671 953 HG22 VAL 127 HG22 VAL 127 5.849 -1.129 3.228 954 HG23 VAL 127 HG23 VAL 127 5.668 -0.727 1.520 955 H GLU 128 H GLU 128 5.038 -0.585 5.435 956 HA GLU 128 HA GLU 128 7.579 -1.606 6.450 957 HB2 GLU 128 HB2 GLU 128 6.663 -1.680 8.800 958 HB3 GLU 128 HB3 GLU 128 7.026 -0.062 8.209 959 HG2 GLU 128 HG2 GLU 128 4.707 0.383 7.800 960 HG3 GLU 128 HG3 GLU 128 4.272 -1.285 8.160 961 H LYS 129 H LYS 129 7.472 -3.851 7.045 962 HA LYS 129 HA LYS 129 5.032 -5.245 6.299 963 HB2 LYS 129 HB2 LYS 129 7.046 -6.398 5.702 964 HB3 LYS 129 HB3 LYS 129 7.679 -6.283 7.340 965 HG2 LYS 129 HG2 LYS 129 6.312 -7.958 8.142 966 HG3 LYS 129 HG3 LYS 129 5.086 -7.703 6.904 967 HD2 LYS 129 HD2 LYS 129 6.222 -9.828 6.578 968 HD3 LYS 129 HD3 LYS 129 6.549 -8.735 5.237 969 HE2 LYS 129 HE2 LYS 129 8.756 -8.266 6.088 970 HE3 LYS 129 HE3 LYS 129 8.424 -9.181 7.563 971 HZ1 LYS 129 HZ1 LYS 129 8.373 -10.399 4.855 972 HZ2 LYS 129 HZ2 LYS 129 8.363 -11.192 6.349 973 HZ3 LYS 129 HZ3 LYS 129 9.752 -10.383 5.839 974 H THR 130 H THR 130 3.496 -5.964 7.636 975 HA THR 130 HA THR 130 3.902 -5.507 10.539 976 HB THR 130 HB THR 130 2.657 -3.606 9.692 977 HG1 THR 130 HG1 THR 130 0.895 -3.770 11.088 978 HG21 THR 130 HG21 THR 130 0.451 -3.871 8.630 979 HG22 THR 130 HG22 THR 130 0.662 -5.622 8.626 980 HG23 THR 130 HG23 THR 130 1.727 -4.604 7.655 981 H ASP 131 H ASP 131 2.508 -6.675 11.969 982 HA ASP 131 HA ASP 131 1.846 -9.325 11.015 983 HB2 ASP 131 HB2 ASP 131 1.374 -9.796 13.400 984 HB3 ASP 131 HB3 ASP 131 2.969 -9.090 13.156 985 H GLU 132 H GLU 132 0.225 -6.425 11.115 986 HA GLU 132 HA GLU 132 -2.431 -7.238 11.736 987 HB2 GLU 132 HB2 GLU 132 -1.457 -4.961 9.987 988 HB3 GLU 132 HB3 GLU 132 -3.094 -5.140 10.609 989 HG2 GLU 132 HG2 GLU 132 -2.349 -4.840 12.855 990 HG3 GLU 132 HG3 GLU 132 -0.661 -4.908 12.359 991 H LYS 133 H LYS 133 -4.220 -7.470 10.223 992 HA LYS 133 HA LYS 133 -3.455 -9.020 7.877 993 HB2 LYS 133 HB2 LYS 133 -5.748 -9.726 7.766 994 HB3 LYS 133 HB3 LYS 133 -5.234 -9.819 9.444 995 HG2 LYS 133 HG2 LYS 133 -6.401 -7.758 9.957 996 HG3 LYS 133 HG3 LYS 133 -6.838 -7.555 8.261 997 HD2 LYS 133 HD2 LYS 133 -8.125 -9.670 8.372 998 HD3 LYS 133 HD3 LYS 133 -7.741 -9.788 10.090 999 HE2 LYS 133 HE2 LYS 133 -8.900 -7.663 10.493 1000 HE3 LYS 133 HE3 LYS 133 -9.280 -7.542 8.775 1001 HZ1 LYS 133 HZ1 LYS 133 -11.148 -8.407 10.028 1002 HZ2 LYS 133 HZ2 LYS 133 -10.208 -9.687 10.609 1003 HZ3 LYS 133 HZ3 LYS 133 -10.568 -9.586 8.962 1004 H VAL 134 H VAL 134 -4.400 -8.651 5.771 1005 HA VAL 134 HA VAL 134 -4.365 -5.930 4.937 1006 HB VAL 134 HB VAL 134 -5.282 -8.403 3.439 1007 HG11 VAL 134 HG11 VAL 134 -4.642 -5.646 2.371 1008 HG12 VAL 134 HG12 VAL 134 -6.234 -6.404 2.417 1009 HG13 VAL 134 HG13 VAL 134 -4.969 -7.077 1.391 1010 HG21 VAL 134 HG21 VAL 134 -3.071 -8.291 2.364 1011 HG22 VAL 134 HG22 VAL 134 -2.947 -8.533 4.106 1012 HG23 VAL 134 HG23 VAL 134 -2.637 -6.940 3.416 1013 H LEU 135 H LEU 135 -6.026 -4.531 4.469 1014 HA LEU 135 HA LEU 135 -8.575 -5.016 5.669 1015 HB2 LEU 135 HB2 LEU 135 -7.343 -2.764 4.136 1016 HB3 LEU 135 HB3 LEU 135 -9.090 -2.794 4.292 1017 HG LEU 135 HG LEU 135 -7.127 -2.767 6.594 1018 HD11 LEU 135 HD11 LEU 135 -7.205 -0.633 5.389 1019 HD12 LEU 135 HD12 LEU 135 -7.927 -0.500 6.991 1020 HD13 LEU 135 HD13 LEU 135 -8.961 -0.596 5.564 1021 HD21 LEU 135 HD21 LEU 135 -10.150 -2.687 6.545 1022 HD22 LEU 135 HD22 LEU 135 -9.149 -2.416 7.975 1023 HD23 LEU 135 HD23 LEU 135 -9.137 -3.988 7.176 1024 H SER 136 H SER 136 -10.416 -5.799 4.788 1025 HA SER 136 HA SER 136 -10.536 -6.526 1.999 1026 HB2 SER 136 HB2 SER 136 -11.698 -7.894 3.693 1027 HB3 SER 136 HB3 SER 136 -12.725 -6.521 4.106 1028 HG SER 136 HG SER 136 -13.072 -8.328 2.187 1029 H VAL 137 H VAL 137 -11.848 -5.554 0.397 1030 HA VAL 137 HA VAL 137 -11.826 -2.827 0.212 1031 HB VAL 137 HB VAL 137 -13.842 -4.672 -1.097 1032 HG11 VAL 137 HG11 VAL 137 -14.569 -2.336 -1.230 1033 HG12 VAL 137 HG12 VAL 137 -14.064 -2.928 -2.813 1034 HG13 VAL 137 HG13 VAL 137 -12.997 -1.873 -1.885 1035 HG21 VAL 137 HG21 VAL 137 -11.539 -5.326 -1.557 1036 HG22 VAL 137 HG22 VAL 137 -11.148 -3.677 -2.049 1037 HG23 VAL 137 HG23 VAL 137 -12.278 -4.639 -3.004 1038 H LYS 138 H LYS 138 -14.572 -4.790 1.371 1039 HA LYS 138 HA LYS 138 -16.279 -2.547 1.843 1040 HB2 LYS 138 HB2 LYS 138 -17.161 -4.830 1.481 1041 HB3 LYS 138 HB3 LYS 138 -16.452 -5.337 3.009 1042 HG2 LYS 138 HG2 LYS 138 -17.883 -3.653 4.168 1043 HG3 LYS 138 HG3 LYS 138 -18.655 -3.315 2.620 1044 HD2 LYS 138 HD2 LYS 138 -20.032 -4.859 3.849 1045 HD3 LYS 138 HD3 LYS 138 -19.316 -5.704 2.474 1046 HE2 LYS 138 HE2 LYS 138 -19.116 -7.170 4.325 1047 HE3 LYS 138 HE3 LYS 138 -17.512 -6.492 4.052 1048 HZ1 LYS 138 HZ1 LYS 138 -19.447 -5.702 6.161 1049 HZ2 LYS 138 HZ2 LYS 138 -18.011 -4.870 5.840 1050 HZ3 LYS 138 HZ3 LYS 138 -17.954 -6.467 6.379 1051 H GLU 139 H GLU 139 -14.124 -4.467 3.917 1052 HA GLU 139 HA GLU 139 -14.774 -3.398 6.417 1053 HB2 GLU 139 HB2 GLU 139 -13.259 -5.348 5.992 1054 HB3 GLU 139 HB3 GLU 139 -12.034 -4.233 5.408 1055 HG2 GLU 139 HG2 GLU 139 -11.492 -4.867 7.644 1056 HG3 GLU 139 HG3 GLU 139 -11.990 -3.175 7.653 1057 H LEU 140 H LEU 140 -12.675 -2.267 3.863 1058 HA LEU 140 HA LEU 140 -11.602 0.009 5.164 1059 HB2 LEU 140 HB2 LEU 140 -11.037 -1.350 2.919 1060 HB3 LEU 140 HB3 LEU 140 -11.941 -0.024 2.211 1061 HG LEU 140 HG LEU 140 -9.650 0.485 4.089 1062 HD11 LEU 140 HD11 LEU 140 -8.189 0.662 2.137 1063 HD12 LEU 140 HD12 LEU 140 -9.496 0.073 1.106 1064 HD13 LEU 140 HD13 LEU 140 -8.808 -0.975 2.346 1065 HD21 LEU 140 HD21 LEU 140 -11.117 2.365 3.592 1066 HD22 LEU 140 HD22 LEU 140 -10.903 2.097 1.862 1067 HD23 LEU 140 HD23 LEU 140 -9.534 2.599 2.855 1068 H LEU 141 H LEU 141 -14.476 -0.496 3.110 1069 HA LEU 141 HA LEU 141 -15.320 2.179 2.850 1070 HB2 LEU 141 HB2 LEU 141 -17.121 -0.231 3.191 1071 HB3 LEU 141 HB3 LEU 141 -17.542 1.292 2.431 1072 HG LEU 141 HG LEU 141 -15.530 -0.692 1.360 1073 HD11 LEU 141 HD11 LEU 141 -17.765 -1.605 1.228 1074 HD12 LEU 141 HD12 LEU 141 -17.213 -1.137 -0.380 1075 HD13 LEU 141 HD13 LEU 141 -18.361 -0.116 0.485 1076 HD21 LEU 141 HD21 LEU 141 -14.990 1.592 0.705 1077 HD22 LEU 141 HD22 LEU 141 -16.640 1.830 0.121 1078 HD23 LEU 141 HD23 LEU 141 -15.579 0.665 -0.675 1079 H GLU 142 H GLU 142 -16.148 -0.267 5.269 1080 HA GLU 142 HA GLU 142 -17.767 1.358 6.914 1081 HB2 GLU 142 HB2 GLU 142 -16.171 -1.112 7.652 1082 HB3 GLU 142 HB3 GLU 142 -17.538 -0.457 8.549 1083 HG2 GLU 142 HG2 GLU 142 -19.068 -1.031 6.830 1084 HG3 GLU 142 HG3 GLU 142 -17.769 -1.366 5.686 1085 H ALA 143 H ALA 143 -14.300 0.842 6.771 1086 HA ALA 143 HA ALA 143 -13.621 1.996 9.275 1087 HB1 ALA 143 HB1 ALA 143 -12.091 0.554 8.010 1088 HB2 ALA 143 HB2 ALA 143 -11.349 2.103 8.411 1089 HB3 ALA 143 HB3 ALA 143 -11.939 1.804 6.774 1090 H ILE 144 H ILE 144 -13.582 3.399 5.970 1091 HA ILE 144 HA ILE 144 -12.929 6.016 6.953 1092 HB ILE 144 HB ILE 144 -13.332 6.778 4.604 1093 HG12 ILE 144 HG12 ILE 144 -13.385 4.716 2.953 1094 HG13 ILE 144 HG13 ILE 144 -14.181 3.910 4.297 1095 HG21 ILE 144 HG21 ILE 144 -11.374 5.614 3.678 1096 HG22 ILE 144 HG22 ILE 144 -11.476 4.428 4.980 1097 HG23 ILE 144 HG23 ILE 144 -11.126 6.117 5.350 1098 HD11 ILE 144 HD11 ILE 144 -15.932 5.608 4.263 1099 HD12 ILE 144 HD12 ILE 144 -15.777 4.796 2.705 1100 HD13 ILE 144 HD13 ILE 144 -15.121 6.418 2.922 1101 H GLY 145 H GLY 145 -15.893 4.320 6.422 1102 HA2 GLY 145 HA2 GLY 145 -17.741 5.292 7.795 1103 HA3 GLY 145 HA3 GLY 145 -17.393 6.816 6.993 1104 H SER 146 H SER 146 -17.431 6.553 4.467 1105 HA SER 146 HA SER 146 -20.091 6.046 3.734 1106 HB2 SER 146 HB2 SER 146 -17.664 6.246 1.922 1107 HB3 SER 146 HB3 SER 146 -19.347 6.400 1.407 1108 HG SER 146 HG SER 146 -17.740 8.295 2.352 Start of MODEL 3 1 H1 MET 1 H1 MET 1 23.336 9.158 34.029 2 H2 MET 1 H2 MET 1 22.120 8.028 33.699 3 H3 MET 1 H3 MET 1 23.684 7.504 34.065 4 HA MET 1 HA MET 1 23.529 8.244 36.292 5 HB2 MET 1 HB2 MET 1 20.878 9.405 35.412 6 HB3 MET 1 HB3 MET 1 21.305 9.189 37.105 7 HG2 MET 1 HG2 MET 1 23.236 10.663 36.807 8 HG3 MET 1 HG3 MET 1 22.804 10.881 35.112 9 HE1 MET 1 HE1 MET 1 20.691 12.181 34.271 10 HE2 MET 1 HE2 MET 1 19.451 12.849 35.332 11 HE3 MET 1 HE3 MET 1 19.645 11.100 35.194 12 H GLY 2 H GLY 2 22.314 7.139 38.037 13 HA2 GLY 2 HA2 GLY 2 20.741 5.497 38.758 14 HA3 GLY 2 HA3 GLY 2 20.597 4.938 37.102 15 H SER 3 H SER 3 23.597 5.490 38.931 16 HA SER 3 HA SER 3 24.468 2.792 38.285 17 HB2 SER 3 HB2 SER 3 26.641 3.490 39.211 18 HB3 SER 3 HB3 SER 3 26.049 4.646 38.019 19 HG SER 3 HG SER 3 26.414 6.039 39.551 20 H SER 4 H SER 4 24.736 4.613 41.366 21 HA SER 4 HA SER 4 24.374 2.098 42.826 22 HB2 SER 4 HB2 SER 4 26.205 3.586 43.537 23 HB3 SER 4 HB3 SER 4 25.041 4.865 43.881 24 HG SER 4 HG SER 4 25.355 2.369 45.188 25 H HIS 5 H HIS 5 22.959 5.381 42.867 26 HA HIS 5 HA HIS 5 20.774 4.702 44.531 27 HB2 HIS 5 HB2 HIS 5 21.503 7.030 44.198 28 HB3 HIS 5 HB3 HIS 5 20.991 6.955 42.515 29 HD1 HIS 5 HD1 HIS 5 18.773 7.985 42.141 30 HD2 HIS 5 HD2 HIS 5 19.109 6.437 45.983 31 HE1 HIS 5 HE1 HIS 5 16.603 8.521 43.273 32 HE2 HIS 5 HE2 HIS 5 16.927 7.784 45.654 33 H HIS 6 H HIS 6 19.794 2.846 43.808 34 HA HIS 6 HA HIS 6 18.946 2.487 41.093 35 HB2 HIS 6 HB2 HIS 6 18.146 0.920 43.560 36 HB3 HIS 6 HB3 HIS 6 17.947 0.408 41.886 37 HD1 HIS 6 HD1 HIS 6 20.101 -0.147 44.640 38 HD2 HIS 6 HD2 HIS 6 20.712 0.406 40.563 39 HE1 HIS 6 HE1 HIS 6 22.382 -1.076 44.169 40 HE2 HIS 6 HE2 HIS 6 22.776 -0.627 41.730 41 H HIS 7 H HIS 7 17.135 3.148 40.166 42 HA HIS 7 HA HIS 7 14.800 3.860 41.828 43 HB2 HIS 7 HB2 HIS 7 15.944 5.881 40.967 44 HB3 HIS 7 HB3 HIS 7 15.792 5.268 39.326 45 HD1 HIS 7 HD1 HIS 7 13.830 6.878 42.073 46 HD2 HIS 7 HD2 HIS 7 13.255 5.575 38.169 47 HE1 HIS 7 HE1 HIS 7 11.628 7.834 41.360 48 HE2 HIS 7 HE2 HIS 7 11.422 7.234 38.935 49 H HIS 8 H HIS 8 13.027 2.670 41.321 50 HA HIS 8 HA HIS 8 13.007 0.689 39.368 51 HB2 HIS 8 HB2 HIS 8 10.499 0.652 39.681 52 HB3 HIS 8 HB3 HIS 8 11.449 0.498 41.153 53 HD1 HIS 8 HD1 HIS 8 10.967 2.122 42.986 54 HD2 HIS 8 HD2 HIS 8 9.318 3.302 39.358 55 HE1 HIS 8 HE1 HIS 8 9.488 4.080 43.521 56 HE2 HIS 8 HE2 HIS 8 8.414 4.701 41.335 57 H HIS 9 H HIS 9 12.091 0.485 37.306 58 HA HIS 9 HA HIS 9 12.617 2.825 35.733 59 HB2 HIS 9 HB2 HIS 9 11.694 0.082 34.838 60 HB3 HIS 9 HB3 HIS 9 12.354 1.342 33.799 61 HD1 HIS 9 HD1 HIS 9 14.917 1.801 33.982 62 HD2 HIS 9 HD2 HIS 9 13.578 -1.403 36.262 63 HE1 HIS 9 HE1 HIS 9 16.983 0.560 34.671 64 HE2 HIS 9 HE2 HIS 9 16.142 -1.468 35.898 65 H HIS 10 H HIS 10 10.711 3.988 36.778 66 HA HIS 10 HA HIS 10 8.143 3.478 35.487 67 HB2 HIS 10 HB2 HIS 10 8.170 4.148 37.854 68 HB3 HIS 10 HB3 HIS 10 8.999 5.641 37.438 69 HD1 HIS 10 HD1 HIS 10 5.658 4.151 37.754 70 HD2 HIS 10 HD2 HIS 10 7.329 7.526 35.998 71 HE1 HIS 10 HE1 HIS 10 3.734 5.691 37.293 72 HE2 HIS 10 HE2 HIS 10 4.752 7.657 36.100 73 H SER 11 H SER 11 9.970 6.508 35.929 74 HA SER 11 HA SER 11 9.517 7.168 33.087 75 HB2 SER 11 HB2 SER 11 9.997 9.517 33.774 76 HB3 SER 11 HB3 SER 11 8.613 8.834 34.629 77 HG SER 11 HG SER 11 10.786 9.900 35.676 78 H SER 12 H SER 12 11.939 6.963 35.631 79 HA SER 12 HA SER 12 14.035 6.676 33.600 80 HB2 SER 12 HB2 SER 12 14.140 9.030 34.331 81 HB3 SER 12 HB3 SER 12 14.279 8.510 36.010 82 HG SER 12 HG SER 12 16.229 8.844 34.232 83 H GLY 13 H GLY 13 16.209 6.394 35.220 84 HA2 GLY 13 HA2 GLY 13 16.435 4.935 37.418 85 HA3 GLY 13 HA3 GLY 13 15.688 3.744 36.352 86 H ARG 14 H ARG 14 16.819 4.237 33.979 87 HA ARG 14 HA ARG 14 19.584 4.913 34.024 88 HB2 ARG 14 HB2 ARG 14 19.567 2.494 34.863 89 HB3 ARG 14 HB3 ARG 14 19.005 2.038 33.257 90 HG2 ARG 14 HG2 ARG 14 21.018 2.798 32.242 91 HG3 ARG 14 HG3 ARG 14 21.543 3.592 33.727 92 HD2 ARG 14 HD2 ARG 14 21.599 1.316 34.806 93 HD3 ARG 14 HD3 ARG 14 21.326 0.627 33.205 94 HE ARG 14 HE ARG 14 23.449 1.932 32.609 95 HH11 ARG 14 HH11 ARG 14 22.841 0.462 35.670 96 HH12 ARG 14 HH12 ARG 14 24.519 0.265 36.026 97 HH21 ARG 14 HH21 ARG 14 25.605 1.657 33.087 98 HH22 ARG 14 HH22 ARG 14 26.060 0.935 34.591 99 H GLU 15 H GLU 15 19.769 6.041 32.188 100 HA GLU 15 HA GLU 15 17.559 6.124 30.399 101 HB2 GLU 15 HB2 GLU 15 18.788 7.936 29.255 102 HB3 GLU 15 HB3 GLU 15 18.648 8.175 30.989 103 HG2 GLU 15 HG2 GLU 15 21.115 7.027 29.704 104 HG3 GLU 15 HG3 GLU 15 20.868 8.757 29.926 105 H ASN 16 H ASN 16 20.494 4.351 30.216 106 HA ASN 16 HA ASN 16 20.577 4.201 27.340 107 HB2 ASN 16 HB2 ASN 16 22.004 2.589 29.464 108 HB3 ASN 16 HB3 ASN 16 22.290 2.414 27.735 109 HD21 ASN 16 HD21 ASN 16 23.145 4.218 26.591 110 HD22 ASN 16 HD22 ASN 16 24.094 5.402 27.413 111 H LEU 17 H LEU 17 18.815 3.301 26.383 112 HA LEU 17 HA LEU 17 18.088 0.551 27.191 113 HB2 LEU 17 HB2 LEU 17 16.347 2.783 26.170 114 HB3 LEU 17 HB3 LEU 17 15.850 1.111 26.025 115 HG LEU 17 HG LEU 17 14.764 1.940 27.941 116 HD11 LEU 17 HD11 LEU 17 15.735 -0.280 28.233 117 HD12 LEU 17 HD12 LEU 17 15.651 0.598 29.759 118 HD13 LEU 17 HD13 LEU 17 17.193 0.440 28.915 119 HD21 LEU 17 HD21 LEU 17 15.888 3.079 29.788 120 HD22 LEU 17 HD22 LEU 17 16.066 3.971 28.276 121 HD23 LEU 17 HD23 LEU 17 17.412 3.020 28.903 122 H TYR 18 H TYR 18 16.736 -0.464 25.251 123 HA TYR 18 HA TYR 18 18.211 -0.093 22.725 124 HB2 TYR 18 HB2 TYR 18 18.042 -2.648 22.495 125 HB3 TYR 18 HB3 TYR 18 19.231 -2.020 23.632 126 HD1 TYR 18 HD1 TYR 18 15.991 -3.759 23.323 127 HD2 TYR 18 HD2 TYR 18 18.991 -2.378 26.016 128 HE1 TYR 18 HE1 TYR 18 15.000 -5.114 25.122 129 HE2 TYR 18 HE2 TYR 18 18.009 -3.731 27.814 130 HH TYR 18 HH TYR 18 15.691 -6.139 27.255 131 H PHE 19 H PHE 19 17.046 -0.603 20.804 132 HA PHE 19 HA PHE 19 14.127 -0.912 21.147 133 HB2 PHE 19 HB2 PHE 19 15.496 1.118 19.361 134 HB3 PHE 19 HB3 PHE 19 13.759 0.827 19.425 135 HD1 PHE 19 HD1 PHE 19 12.488 1.384 21.486 136 HD2 PHE 19 HD2 PHE 19 16.585 2.452 21.007 137 HE1 PHE 19 HE1 PHE 19 12.287 2.988 23.336 138 HE2 PHE 19 HE2 PHE 19 16.383 4.061 22.855 139 HZ PHE 19 HZ PHE 19 14.234 4.330 24.024 140 H GLN 20 H GLN 20 13.141 -1.018 18.710 141 HA GLN 20 HA GLN 20 14.758 -2.772 17.016 142 HB2 GLN 20 HB2 GLN 20 13.068 -4.562 17.020 143 HB3 GLN 20 HB3 GLN 20 13.744 -4.311 18.626 144 HG2 GLN 20 HG2 GLN 20 11.764 -3.033 19.273 145 HG3 GLN 20 HG3 GLN 20 11.088 -3.252 17.661 146 HE21 GLN 20 HE21 GLN 20 10.020 -4.046 20.246 147 HE22 GLN 20 HE22 GLN 20 9.770 -5.752 20.153 148 H GLY 21 H GLY 21 13.670 -3.316 14.944 149 HA2 GLY 21 HA2 GLY 21 11.996 -3.043 13.307 150 HA3 GLY 21 HA3 GLY 21 11.278 -1.765 14.271 151 H HIS 22 H HIS 22 12.129 -1.984 11.363 152 HA HIS 22 HA HIS 22 13.287 0.691 11.229 153 HB2 HIS 22 HB2 HIS 22 15.239 -0.848 11.160 154 HB3 HIS 22 HB3 HIS 22 14.551 -1.635 9.746 155 HD1 HIS 22 HD1 HIS 22 16.666 1.171 10.768 156 HD2 HIS 22 HD2 HIS 22 14.491 0.093 7.391 157 HE1 HIS 22 HE1 HIS 22 17.518 2.639 8.919 158 HE2 HIS 22 HE2 HIS 22 16.178 1.990 6.891 159 H MET 23 H MET 23 11.243 1.332 10.418 160 HA MET 23 HA MET 23 10.148 0.185 8.022 161 HB2 MET 23 HB2 MET 23 8.492 1.940 8.182 162 HB3 MET 23 HB3 MET 23 8.765 1.257 9.777 163 HG2 MET 23 HG2 MET 23 10.370 3.207 10.156 164 HG3 MET 23 HG3 MET 23 9.653 3.918 8.710 165 HE1 MET 23 HE1 MET 23 6.808 3.931 8.547 166 HE2 MET 23 HE2 MET 23 5.806 3.739 9.988 167 HE3 MET 23 HE3 MET 23 6.714 2.363 9.355 168 H LEU 24 H LEU 24 9.687 1.622 6.071 169 HA LEU 24 HA LEU 24 12.100 3.211 5.425 170 HB2 LEU 24 HB2 LEU 24 10.583 1.182 3.844 171 HB3 LEU 24 HB3 LEU 24 11.401 2.478 2.991 172 HG LEU 24 HG LEU 24 12.832 0.692 4.949 173 HD11 LEU 24 HD11 LEU 24 13.635 -0.581 3.017 174 HD12 LEU 24 HD12 LEU 24 12.570 0.346 1.962 175 HD13 LEU 24 HD13 LEU 24 11.887 -0.714 3.194 176 HD21 LEU 24 HD21 LEU 24 14.817 1.460 3.723 177 HD22 LEU 24 HD22 LEU 24 13.932 2.801 4.448 178 HD23 LEU 24 HD23 LEU 24 13.790 2.484 2.717 179 H GLU 25 H GLU 25 11.846 5.231 4.709 180 HA GLU 25 HA GLU 25 9.251 6.371 4.306 181 HB2 GLU 25 HB2 GLU 25 11.219 7.558 5.339 182 HB3 GLU 25 HB3 GLU 25 11.975 7.575 3.748 183 HG2 GLU 25 HG2 GLU 25 9.968 8.778 2.908 184 HG3 GLU 25 HG3 GLU 25 9.425 8.904 4.574 185 H VAL 26 H VAL 26 8.166 6.310 2.407 186 HA VAL 26 HA VAL 26 9.682 6.091 -0.113 187 HB VAL 26 HB VAL 26 8.034 4.441 -0.966 188 HG11 VAL 26 HG11 VAL 26 10.184 3.665 -0.100 189 HG12 VAL 26 HG12 VAL 26 8.911 2.492 0.235 190 HG13 VAL 26 HG13 VAL 26 9.500 3.543 1.522 191 HG21 VAL 26 HG21 VAL 26 7.076 4.351 1.902 192 HG22 VAL 26 HG22 VAL 26 6.573 3.253 0.614 193 HG23 VAL 26 HG23 VAL 26 6.167 4.968 0.520 194 H GLU 27 H GLU 27 8.447 6.682 -2.043 195 HA GLU 27 HA GLU 27 6.327 8.629 -1.461 196 HB2 GLU 27 HB2 GLU 27 8.270 9.357 -2.836 197 HB3 GLU 27 HB3 GLU 27 7.831 8.162 -4.052 198 HG2 GLU 27 HG2 GLU 27 5.792 9.298 -4.543 199 HG3 GLU 27 HG3 GLU 27 5.996 10.382 -3.169 200 H VAL 28 H VAL 28 4.297 7.961 -1.612 201 HA VAL 28 HA VAL 28 3.664 5.426 -2.900 202 HB VAL 28 HB VAL 28 1.902 7.204 -1.202 203 HG11 VAL 28 HG11 VAL 28 1.583 4.317 -2.017 204 HG12 VAL 28 HG12 VAL 28 0.626 5.681 -2.594 205 HG13 VAL 28 HG13 VAL 28 0.533 5.193 -0.903 206 HG21 VAL 28 HG21 VAL 28 3.859 6.490 0.067 207 HG22 VAL 28 HG22 VAL 28 3.554 4.810 -0.381 208 HG23 VAL 28 HG23 VAL 28 2.408 5.672 0.648 209 H ILE 29 H ILE 29 3.038 5.446 -4.968 210 HA ILE 29 HA ILE 29 1.737 7.833 -6.075 211 HB ILE 29 HB ILE 29 2.482 5.462 -7.755 212 HG12 ILE 29 HG12 ILE 29 4.469 7.584 -6.904 213 HG13 ILE 29 HG13 ILE 29 4.409 5.972 -6.202 214 HG21 ILE 29 HG21 ILE 29 2.504 8.456 -8.180 215 HG22 ILE 29 HG22 ILE 29 1.314 7.311 -8.804 216 HG23 ILE 29 HG23 ILE 29 2.977 7.260 -9.392 217 HD11 ILE 29 HD11 ILE 29 6.128 6.077 -7.865 218 HD12 ILE 29 HD12 ILE 29 4.981 6.659 -9.072 219 HD13 ILE 29 HD13 ILE 29 4.834 5.021 -8.432 220 H SER 30 H SER 30 -0.121 7.614 -7.492 221 HA SER 30 HA SER 30 -1.659 5.127 -7.217 222 HB2 SER 30 HB2 SER 30 -2.748 7.910 -6.754 223 HB3 SER 30 HB3 SER 30 -3.754 6.477 -6.954 224 HG SER 30 HG SER 30 -1.845 5.999 -5.126 225 H GLY 31 H GLY 31 -1.642 4.379 -9.234 226 HA2 GLY 31 HA2 GLY 31 -1.732 6.157 -11.530 227 HA3 GLY 31 HA3 GLY 31 -1.631 4.406 -11.567 228 H ARG 32 H ARG 32 -3.573 6.933 -12.390 229 HA ARG 32 HA ARG 32 -6.121 6.125 -11.515 230 HB2 ARG 32 HB2 ARG 32 -5.361 7.758 -13.945 231 HB3 ARG 32 HB3 ARG 32 -7.011 7.545 -13.368 232 HG2 ARG 32 HG2 ARG 32 -6.178 8.497 -11.145 233 HG3 ARG 32 HG3 ARG 32 -4.741 8.997 -12.038 234 HD2 ARG 32 HD2 ARG 32 -7.581 9.773 -12.716 235 HD3 ARG 32 HD3 ARG 32 -6.429 10.789 -11.850 236 HE ARG 32 HE ARG 32 -5.567 9.888 -14.467 237 HH11 ARG 32 HH11 ARG 32 -7.183 12.349 -12.674 238 HH12 ARG 32 HH12 ARG 32 -6.851 13.574 -13.851 239 HH21 ARG 32 HH21 ARG 32 -5.178 11.465 -15.981 240 HH22 ARG 32 HH22 ARG 32 -5.744 13.077 -15.705 241 H THR 33 H THR 33 -6.516 4.022 -11.768 242 HA THR 33 HA THR 33 -6.973 3.041 -14.512 243 HB THR 33 HB THR 33 -5.051 1.850 -13.673 244 HG1 THR 33 HG1 THR 33 -5.821 -0.237 -13.873 245 HG21 THR 33 HG21 THR 33 -5.333 2.262 -11.286 246 HG22 THR 33 HG22 THR 33 -5.111 0.541 -11.596 247 HG23 THR 33 HG23 THR 33 -6.719 1.173 -11.248 248 H LEU 34 H LEU 34 -8.401 0.778 -14.058 249 HA LEU 34 HA LEU 34 -10.517 0.041 -13.648 250 HB2 LEU 34 HB2 LEU 34 -9.958 1.548 -11.110 251 HB3 LEU 34 HB3 LEU 34 -11.537 0.840 -11.386 252 HG LEU 34 HG LEU 34 -10.227 -0.655 -10.034 253 HD11 LEU 34 HD11 LEU 34 -10.317 -2.691 -11.362 254 HD12 LEU 34 HD12 LEU 34 -10.439 -1.734 -12.839 255 HD13 LEU 34 HD13 LEU 34 -11.736 -1.683 -11.644 256 HD21 LEU 34 HD21 LEU 34 -8.135 -1.646 -10.784 257 HD22 LEU 34 HD22 LEU 34 -7.996 0.108 -10.662 258 HD23 LEU 34 HD23 LEU 34 -8.177 -0.654 -12.243 259 H ASN 35 H ASN 35 -10.113 2.538 -15.137 260 HA ASN 35 HA ASN 35 -11.393 4.002 -16.300 261 HB2 ASN 35 HB2 ASN 35 -13.174 2.299 -16.229 262 HB3 ASN 35 HB3 ASN 35 -13.730 2.942 -14.690 263 HD21 ASN 35 HD21 ASN 35 -14.769 4.958 -14.658 264 HD22 ASN 35 HD22 ASN 35 -15.438 5.655 -16.091 265 H GLN 36 H GLN 36 -10.297 5.746 -15.420 266 HA GLN 36 HA GLN 36 -10.092 7.814 -14.510 267 HB2 GLN 36 HB2 GLN 36 -12.481 7.883 -15.500 268 HB3 GLN 36 HB3 GLN 36 -13.032 7.768 -13.849 269 HG2 GLN 36 HG2 GLN 36 -11.220 9.953 -14.874 270 HG3 GLN 36 HG3 GLN 36 -12.973 10.083 -14.780 271 HE21 GLN 36 HE21 GLN 36 -13.958 10.141 -12.720 272 HE22 GLN 36 HE22 GLN 36 -13.057 10.601 -11.318 273 H GLY 37 H GLY 37 -12.764 6.767 -12.438 274 HA2 GLY 37 HA2 GLY 37 -11.311 6.136 -10.143 275 HA3 GLY 37 HA3 GLY 37 -11.602 7.868 -10.128 276 H ALA 38 H ALA 38 -13.578 5.031 -11.025 277 HA ALA 38 HA ALA 38 -15.939 6.154 -9.793 278 HB1 ALA 38 HB1 ALA 38 -17.055 4.110 -10.543 279 HB2 ALA 38 HB2 ALA 38 -15.497 3.411 -10.982 280 HB3 ALA 38 HB3 ALA 38 -16.104 4.823 -11.846 281 H THR 39 H THR 39 -17.173 5.115 -8.074 282 HA THR 39 HA THR 39 -15.512 4.398 -5.861 283 HB THR 39 HB THR 39 -17.469 4.238 -4.524 284 HG1 THR 39 HG1 THR 39 -19.161 4.265 -6.803 285 HG21 THR 39 HG21 THR 39 -18.740 6.279 -5.088 286 HG22 THR 39 HG22 THR 39 -17.976 6.302 -6.678 287 HG23 THR 39 HG23 THR 39 -16.999 6.522 -5.225 288 H VAL 40 H VAL 40 -16.117 2.411 -4.472 289 HA VAL 40 HA VAL 40 -15.443 0.082 -5.920 290 HB VAL 40 HB VAL 40 -15.738 -1.151 -3.860 291 HG11 VAL 40 HG11 VAL 40 -14.605 1.597 -3.304 292 HG12 VAL 40 HG12 VAL 40 -13.742 0.243 -4.032 293 HG13 VAL 40 HG13 VAL 40 -14.290 0.141 -2.361 294 HG21 VAL 40 HG21 VAL 40 -16.710 -0.135 -1.851 295 HG22 VAL 40 HG22 VAL 40 -17.890 -0.229 -3.159 296 HG23 VAL 40 HG23 VAL 40 -17.117 1.311 -2.778 297 H GLU 41 H GLU 41 -18.525 1.499 -5.152 298 HA GLU 41 HA GLU 41 -20.101 -0.862 -5.391 299 HB2 GLU 41 HB2 GLU 41 -20.844 2.058 -5.608 300 HB3 GLU 41 HB3 GLU 41 -22.014 0.746 -5.638 301 HG2 GLU 41 HG2 GLU 41 -21.180 0.045 -3.394 302 HG3 GLU 41 HG3 GLU 41 -20.183 1.499 -3.369 303 H GLU 42 H GLU 42 -19.139 1.649 -7.724 304 HA GLU 42 HA GLU 42 -20.697 0.852 -9.890 305 HB2 GLU 42 HB2 GLU 42 -17.996 2.154 -9.718 306 HB3 GLU 42 HB3 GLU 42 -18.644 1.684 -11.282 307 HG2 GLU 42 HG2 GLU 42 -19.178 3.960 -10.985 308 HG3 GLU 42 HG3 GLU 42 -20.674 3.063 -10.753 309 H LYS 43 H LYS 43 -17.684 -0.526 -8.682 310 HA LYS 43 HA LYS 43 -18.129 -2.844 -10.441 311 HB2 LYS 43 HB2 LYS 43 -15.422 -1.641 -9.837 312 HB3 LYS 43 HB3 LYS 43 -15.704 -3.120 -10.744 313 HG2 LYS 43 HG2 LYS 43 -15.458 -1.685 -12.489 314 HG3 LYS 43 HG3 LYS 43 -17.188 -1.483 -12.229 315 HD2 LYS 43 HD2 LYS 43 -16.252 0.702 -12.460 316 HD3 LYS 43 HD3 LYS 43 -16.634 0.483 -10.750 317 HE2 LYS 43 HE2 LYS 43 -14.429 1.537 -11.101 318 HE3 LYS 43 HE3 LYS 43 -14.316 -0.007 -10.253 319 HZ1 LYS 43 HZ1 LYS 43 -13.718 -1.060 -12.360 320 HZ2 LYS 43 HZ2 LYS 43 -12.629 0.160 -11.946 321 HZ3 LYS 43 HZ3 LYS 43 -13.784 0.438 -13.144 322 H LEU 44 H LEU 44 -19.190 -2.936 -8.026 323 HA LEU 44 HA LEU 44 -17.449 -3.946 -5.994 324 HB2 LEU 44 HB2 LEU 44 -19.824 -2.872 -5.796 325 HB3 LEU 44 HB3 LEU 44 -20.408 -4.495 -6.088 326 HG LEU 44 HG LEU 44 -20.374 -3.934 -3.693 327 HD11 LEU 44 HD11 LEU 44 -18.367 -6.073 -4.406 328 HD12 LEU 44 HD12 LEU 44 -20.117 -6.272 -4.312 329 HD13 LEU 44 HD13 LEU 44 -19.193 -5.900 -2.858 330 HD21 LEU 44 HD21 LEU 44 -17.385 -3.695 -4.037 331 HD22 LEU 44 HD22 LEU 44 -18.253 -3.657 -2.502 332 HD23 LEU 44 HD23 LEU 44 -18.504 -2.377 -3.689 333 H THR 45 H THR 45 -16.274 -5.543 -7.118 334 HA THR 45 HA THR 45 -17.524 -8.172 -7.116 335 HB THR 45 HB THR 45 -18.002 -7.607 -9.386 336 HG1 THR 45 HG1 THR 45 -16.934 -9.258 -10.386 337 HG21 THR 45 HG21 THR 45 -16.295 -6.810 -10.967 338 HG22 THR 45 HG22 THR 45 -15.112 -6.752 -9.660 339 HG23 THR 45 HG23 THR 45 -16.512 -5.679 -9.630 340 H GLU 46 H GLU 46 -15.866 -9.907 -7.638 341 HA GLU 46 HA GLU 46 -13.665 -9.785 -5.953 342 HB2 GLU 46 HB2 GLU 46 -14.643 -11.877 -6.823 343 HB3 GLU 46 HB3 GLU 46 -13.999 -11.514 -8.419 344 HG2 GLU 46 HG2 GLU 46 -11.726 -11.678 -7.561 345 HG3 GLU 46 HG3 GLU 46 -12.344 -11.993 -5.940 346 H GLU 47 H GLU 47 -13.901 -8.911 -9.346 347 HA GLU 47 HA GLU 47 -11.242 -8.643 -10.065 348 HB2 GLU 47 HB2 GLU 47 -13.606 -6.915 -10.814 349 HB3 GLU 47 HB3 GLU 47 -12.040 -6.845 -11.612 350 HG2 GLU 47 HG2 GLU 47 -13.799 -9.287 -11.473 351 HG3 GLU 47 HG3 GLU 47 -13.686 -8.187 -12.842 352 H TYR 48 H TYR 48 -13.299 -6.357 -8.311 353 HA TYR 48 HA TYR 48 -11.435 -4.230 -8.172 354 HB2 TYR 48 HB2 TYR 48 -14.064 -4.444 -7.594 355 HB3 TYR 48 HB3 TYR 48 -13.418 -4.587 -5.965 356 HD1 TYR 48 HD1 TYR 48 -11.832 -2.714 -5.161 357 HD2 TYR 48 HD2 TYR 48 -14.355 -2.335 -8.575 358 HE1 TYR 48 HE1 TYR 48 -11.633 -0.270 -5.035 359 HE2 TYR 48 HE2 TYR 48 -14.158 0.111 -8.454 360 HH TYR 48 HH TYR 48 -13.604 1.851 -6.906 361 H PHE 49 H PHE 49 -11.852 -7.157 -6.337 362 HA PHE 49 HA PHE 49 -10.177 -6.342 -4.117 363 HB2 PHE 49 HB2 PHE 49 -12.130 -7.916 -3.905 364 HB3 PHE 49 HB3 PHE 49 -11.196 -9.111 -4.793 365 HD1 PHE 49 HD1 PHE 49 -11.089 -6.989 -1.737 366 HD2 PHE 49 HD2 PHE 49 -9.792 -10.578 -3.634 367 HE1 PHE 49 HE1 PHE 49 -10.097 -7.751 0.383 368 HE2 PHE 49 HE2 PHE 49 -8.797 -11.342 -1.516 369 HZ PHE 49 HZ PHE 49 -8.951 -9.929 0.496 370 H ASN 50 H ASN 50 -9.573 -7.492 -7.246 371 HA ASN 50 HA ASN 50 -6.854 -8.371 -6.464 372 HB2 ASN 50 HB2 ASN 50 -8.498 -9.167 -8.884 373 HB3 ASN 50 HB3 ASN 50 -6.806 -9.598 -8.654 374 HD21 ASN 50 HD21 ASN 50 -10.061 -10.134 -7.574 375 HD22 ASN 50 HD22 ASN 50 -9.730 -11.558 -6.659 376 H ALA 51 H ALA 51 -8.431 -5.767 -7.662 377 HA ALA 51 HA ALA 51 -6.480 -5.075 -9.731 378 HB1 ALA 51 HB1 ALA 51 -8.843 -4.734 -10.224 379 HB2 ALA 51 HB2 ALA 51 -7.966 -3.203 -10.240 380 HB3 ALA 51 HB3 ALA 51 -8.978 -3.629 -8.858 381 H VAL 52 H VAL 52 -7.745 -3.619 -6.702 382 HA VAL 52 HA VAL 52 -5.456 -1.731 -6.741 383 HB VAL 52 HB VAL 52 -6.888 -0.154 -5.500 384 HG11 VAL 52 HG11 VAL 52 -8.107 -1.151 -8.081 385 HG12 VAL 52 HG12 VAL 52 -6.796 0.018 -7.926 386 HG13 VAL 52 HG13 VAL 52 -8.412 0.424 -7.349 387 HG21 VAL 52 HG21 VAL 52 -9.065 -2.220 -5.906 388 HG22 VAL 52 HG22 VAL 52 -9.300 -0.594 -5.264 389 HG23 VAL 52 HG23 VAL 52 -8.338 -1.766 -4.365 390 H ASN 53 H ASN 53 -5.691 -4.443 -5.314 391 HA ASN 53 HA ASN 53 -5.807 -3.577 -2.497 392 HB2 ASN 53 HB2 ASN 53 -5.989 -6.338 -3.721 393 HB3 ASN 53 HB3 ASN 53 -6.034 -6.009 -1.992 394 HD21 ASN 53 HD21 ASN 53 -7.585 -4.011 -4.448 395 HD22 ASN 53 HD22 ASN 53 -9.194 -4.374 -3.968 396 H TYR 54 H TYR 54 -3.369 -3.378 -4.365 397 HA TYR 54 HA TYR 54 -1.460 -4.638 -2.543 398 HB2 TYR 54 HB2 TYR 54 -0.185 -5.632 -4.448 399 HB3 TYR 54 HB3 TYR 54 -1.770 -6.361 -4.203 400 HD1 TYR 54 HD1 TYR 54 0.265 -4.251 -6.423 401 HD2 TYR 54 HD2 TYR 54 -3.540 -6.076 -5.844 402 HE1 TYR 54 HE1 TYR 54 -0.309 -3.798 -8.773 403 HE2 TYR 54 HE2 TYR 54 -4.114 -5.630 -8.191 404 HH TYR 54 HH TYR 54 -3.492 -4.154 -9.987 405 H ALA 55 H ALA 55 0.790 -3.996 -2.973 406 HA ALA 55 HA ALA 55 1.081 -1.445 -4.437 407 HB1 ALA 55 HB1 ALA 55 2.505 -0.576 -2.646 408 HB2 ALA 55 HB2 ALA 55 2.245 -2.046 -1.708 409 HB3 ALA 55 HB3 ALA 55 0.897 -0.956 -2.032 410 H GLU 56 H GLU 56 3.028 -1.192 -5.534 411 HA GLU 56 HA GLU 56 4.752 -3.574 -5.638 412 HB2 GLU 56 HB2 GLU 56 4.508 -1.271 -7.591 413 HB3 GLU 56 HB3 GLU 56 5.558 -2.669 -7.794 414 HG2 GLU 56 HG2 GLU 56 3.523 -4.119 -7.734 415 HG3 GLU 56 HG3 GLU 56 2.544 -2.653 -7.733 416 H ILE 57 H ILE 57 6.626 -3.552 -4.615 417 HA ILE 57 HA ILE 57 7.886 -0.970 -3.921 418 HB ILE 57 HB ILE 57 8.248 -3.640 -2.520 419 HG12 ILE 57 HG12 ILE 57 6.993 -2.357 -0.626 420 HG13 ILE 57 HG13 ILE 57 6.416 -1.317 -1.922 421 HG21 ILE 57 HG21 ILE 57 10.180 -2.182 -2.291 422 HG22 ILE 57 HG22 ILE 57 9.328 -2.326 -0.753 423 HG23 ILE 57 HG23 ILE 57 9.145 -0.867 -1.729 424 HD11 ILE 57 HD11 ILE 57 5.390 -3.238 -3.012 425 HD12 ILE 57 HD12 ILE 57 4.805 -3.048 -1.358 426 HD13 ILE 57 HD13 ILE 57 5.998 -4.292 -1.733 427 H ASN 58 H ASN 58 10.177 -0.775 -4.053 428 HA ASN 58 HA ASN 58 11.454 -2.073 -6.241 429 HB2 ASN 58 HB2 ASN 58 11.973 0.236 -5.525 430 HB3 ASN 58 HB3 ASN 58 12.633 -0.379 -4.015 431 HD21 ASN 58 HD21 ASN 58 13.174 0.083 -7.383 432 HD22 ASN 58 HD22 ASN 58 14.837 -0.381 -7.390 433 H GLU 59 H GLU 59 13.363 -3.433 -6.194 434 HA GLU 59 HA GLU 59 13.212 -5.661 -4.506 435 HB2 GLU 59 HB2 GLU 59 14.267 -5.744 -6.701 436 HB3 GLU 59 HB3 GLU 59 15.543 -4.664 -6.156 437 HG2 GLU 59 HG2 GLU 59 16.395 -6.892 -6.202 438 HG3 GLU 59 HG3 GLU 59 16.254 -6.384 -4.523 439 H GLU 60 H GLU 60 15.437 -2.885 -4.341 440 HA GLU 60 HA GLU 60 17.021 -3.833 -2.219 441 HB2 GLU 60 HB2 GLU 60 16.427 -0.975 -3.021 442 HB3 GLU 60 HB3 GLU 60 17.739 -1.487 -1.964 443 HG2 GLU 60 HG2 GLU 60 18.688 -2.808 -3.818 444 HG3 GLU 60 HG3 GLU 60 17.407 -2.213 -4.874 445 H ASP 61 H ASP 61 14.221 -1.614 -2.160 446 HA ASP 61 HA ASP 61 14.096 -1.371 0.658 447 HB2 ASP 61 HB2 ASP 61 11.860 -1.090 -1.368 448 HB3 ASP 61 HB3 ASP 61 11.838 -0.491 0.289 449 H TRP 62 H TRP 62 12.666 -3.652 -1.603 450 HA TRP 62 HA TRP 62 10.907 -5.049 0.028 451 HB2 TRP 62 HB2 TRP 62 11.231 -5.341 -2.445 452 HB3 TRP 62 HB3 TRP 62 12.709 -6.230 -2.105 453 HD1 TRP 62 HD1 TRP 62 12.423 -8.690 -0.991 454 HE1 TRP 62 HE1 TRP 62 10.446 -10.332 -1.043 455 HE3 TRP 62 HE3 TRP 62 8.735 -5.471 -2.465 456 HZ2 TRP 62 HZ2 TRP 62 7.694 -10.269 -1.642 457 HZ3 TRP 62 HZ3 TRP 62 6.456 -6.346 -2.751 458 HH2 TRP 62 HH2 TRP 62 5.948 -8.697 -2.348 459 H ASN 63 H ASN 63 14.326 -5.846 -0.632 460 HA ASN 63 HA ASN 63 14.567 -7.855 1.340 461 HB2 ASN 63 HB2 ASN 63 16.636 -6.115 -0.018 462 HB3 ASN 63 HB3 ASN 63 17.054 -7.430 1.073 463 HD21 ASN 63 HD21 ASN 63 17.569 -7.048 -1.809 464 HD22 ASN 63 HD22 ASN 63 16.916 -8.451 -2.576 465 H ALA 64 H ALA 64 14.975 -4.356 1.489 466 HA ALA 64 HA ALA 64 16.296 -4.150 3.956 467 HB1 ALA 64 HB1 ALA 64 14.304 -2.216 2.769 468 HB2 ALA 64 HB2 ALA 64 16.026 -2.278 2.391 469 HB3 ALA 64 HB3 ALA 64 15.497 -1.855 4.020 470 H LEU 65 H LEU 65 12.805 -4.242 3.248 471 HA LEU 65 HA LEU 65 12.098 -4.204 6.065 472 HB2 LEU 65 HB2 LEU 65 10.417 -4.615 3.588 473 HB3 LEU 65 HB3 LEU 65 9.776 -4.461 5.212 474 HG LEU 65 HG LEU 65 11.331 -2.308 3.766 475 HD11 LEU 65 HD11 LEU 65 9.175 -1.158 3.572 476 HD12 LEU 65 HD12 LEU 65 8.362 -2.574 4.243 477 HD13 LEU 65 HD13 LEU 65 9.190 -2.682 2.689 478 HD21 LEU 65 HD21 LEU 65 9.820 -2.251 6.384 479 HD22 LEU 65 HD22 LEU 65 10.544 -0.854 5.585 480 HD23 LEU 65 HD23 LEU 65 11.570 -2.156 6.183 481 H GLY 66 H GLY 66 13.146 -6.597 3.958 482 HA2 GLY 66 HA2 GLY 66 13.239 -8.896 4.125 483 HA3 GLY 66 HA3 GLY 66 12.588 -8.738 5.749 484 H LEU 67 H LEU 67 11.218 -7.890 2.578 485 HA LEU 67 HA LEU 67 8.678 -9.051 3.345 486 HB2 LEU 67 HB2 LEU 67 9.490 -7.720 0.759 487 HB3 LEU 67 HB3 LEU 67 7.851 -8.103 1.253 488 HG LEU 67 HG LEU 67 9.682 -6.093 2.581 489 HD11 LEU 67 HD11 LEU 67 8.060 -4.436 1.766 490 HD12 LEU 67 HD12 LEU 67 7.189 -5.714 0.917 491 HD13 LEU 67 HD13 LEU 67 8.838 -5.304 0.442 492 HD21 LEU 67 HD21 LEU 67 8.273 -7.157 4.239 493 HD22 LEU 67 HD22 LEU 67 6.840 -6.888 3.248 494 HD23 LEU 67 HD23 LEU 67 7.705 -5.516 3.943 495 H GLN 68 H GLN 68 7.451 -10.354 1.700 496 HA GLN 68 HA GLN 68 9.058 -12.196 0.099 497 HB2 GLN 68 HB2 GLN 68 9.002 -13.198 2.373 498 HB3 GLN 68 HB3 GLN 68 7.244 -13.147 2.323 499 HG2 GLN 68 HG2 GLN 68 7.190 -14.739 0.521 500 HG3 GLN 68 HG3 GLN 68 8.949 -14.715 0.398 501 HE21 GLN 68 HE21 GLN 68 6.230 -15.764 2.311 502 HE22 GLN 68 HE22 GLN 68 7.103 -16.906 3.266 503 H GLU 69 H GLU 69 8.011 -12.577 -1.748 504 HA GLU 69 HA GLU 69 5.902 -11.047 -2.546 505 HB2 GLU 69 HB2 GLU 69 6.846 -13.679 -3.672 506 HB3 GLU 69 HB3 GLU 69 5.667 -12.649 -4.479 507 HG2 GLU 69 HG2 GLU 69 7.265 -10.852 -4.624 508 HG3 GLU 69 HG3 GLU 69 8.445 -11.781 -3.704 509 H GLY 70 H GLY 70 4.074 -10.938 -1.453 510 HA2 GLY 70 HA2 GLY 70 1.772 -11.899 -1.624 511 HA3 GLY 70 HA3 GLY 70 2.480 -13.411 -1.085 512 H ASP 71 H ASP 71 4.100 -11.151 0.684 513 HA ASP 71 HA ASP 71 2.510 -11.721 3.023 514 HB2 ASP 71 HB2 ASP 71 4.290 -10.739 4.291 515 HB3 ASP 71 HB3 ASP 71 5.013 -11.715 3.019 516 H ARG 72 H ARG 72 2.595 -9.606 4.649 517 HA ARG 72 HA ARG 72 0.766 -7.697 3.336 518 HB2 ARG 72 HB2 ARG 72 0.904 -8.738 6.166 519 HB3 ARG 72 HB3 ARG 72 0.029 -7.268 5.777 520 HG2 ARG 72 HG2 ARG 72 -1.485 -9.143 5.913 521 HG3 ARG 72 HG3 ARG 72 -1.424 -8.529 4.262 522 HD2 ARG 72 HD2 ARG 72 -0.019 -10.364 3.579 523 HD3 ARG 72 HD3 ARG 72 0.131 -10.924 5.245 524 HE ARG 72 HE ARG 72 -2.462 -11.126 4.987 525 HH11 ARG 72 HH11 ARG 72 -0.089 -11.876 2.607 526 HH12 ARG 72 HH12 ARG 72 -1.028 -13.145 1.912 527 HH21 ARG 72 HH21 ARG 72 -3.659 -12.768 4.084 528 HH22 ARG 72 HH22 ARG 72 -3.034 -13.628 2.724 529 H VAL 73 H VAL 73 1.451 -5.667 3.083 530 HA VAL 73 HA VAL 73 3.465 -4.602 4.969 531 HB VAL 73 HB VAL 73 4.056 -2.949 3.179 532 HG11 VAL 73 HG11 VAL 73 5.470 -4.871 3.588 533 HG12 VAL 73 HG12 VAL 73 5.404 -4.534 1.857 534 HG13 VAL 73 HG13 VAL 73 4.468 -5.869 2.530 535 HG21 VAL 73 HG21 VAL 73 2.011 -3.082 1.842 536 HG22 VAL 73 HG22 VAL 73 2.382 -4.754 1.418 537 HG23 VAL 73 HG23 VAL 73 3.427 -3.448 0.855 538 H LYS 74 H LYS 74 3.188 -2.587 5.842 539 HA LYS 74 HA LYS 74 0.504 -1.399 5.551 540 HB2 LYS 74 HB2 LYS 74 0.986 -2.223 7.789 541 HB3 LYS 74 HB3 LYS 74 2.475 -1.294 7.843 542 HG2 LYS 74 HG2 LYS 74 1.157 0.788 7.760 543 HG3 LYS 74 HG3 LYS 74 -0.325 -0.175 7.769 544 HD2 LYS 74 HD2 LYS 74 1.775 -0.358 9.932 545 HD3 LYS 74 HD3 LYS 74 0.407 0.752 10.012 546 HE2 LYS 74 HE2 LYS 74 0.134 -2.236 9.691 547 HE3 LYS 74 HE3 LYS 74 0.093 -1.405 11.246 548 HZ1 LYS 74 HZ1 LYS 74 -2.137 -1.752 10.489 549 HZ2 LYS 74 HZ2 LYS 74 -1.808 -1.034 8.997 550 HZ3 LYS 74 HZ3 LYS 74 -1.801 -0.098 10.397 551 H VAL 75 H VAL 75 0.308 0.862 5.390 552 HA VAL 75 HA VAL 75 2.734 2.322 4.572 553 HB VAL 75 HB VAL 75 0.091 2.333 3.081 554 HG11 VAL 75 HG11 VAL 75 1.268 3.750 1.439 555 HG12 VAL 75 HG12 VAL 75 2.668 3.808 2.510 556 HG13 VAL 75 HG13 VAL 75 1.139 4.524 3.017 557 HG21 VAL 75 HG21 VAL 75 2.780 1.225 2.254 558 HG22 VAL 75 HG22 VAL 75 1.338 1.297 1.241 559 HG23 VAL 75 HG23 VAL 75 1.353 0.279 2.680 560 H LYS 76 H LYS 76 2.871 4.343 5.408 561 HA LYS 76 HA LYS 76 0.471 5.534 6.663 562 HB2 LYS 76 HB2 LYS 76 3.205 5.108 7.862 563 HB3 LYS 76 HB3 LYS 76 2.067 6.275 8.520 564 HG2 LYS 76 HG2 LYS 76 0.691 4.670 9.377 565 HG3 LYS 76 HG3 LYS 76 1.087 3.497 8.119 566 HD2 LYS 76 HD2 LYS 76 3.051 2.839 9.164 567 HD3 LYS 76 HD3 LYS 76 3.151 4.307 10.145 568 HE2 LYS 76 HE2 LYS 76 1.188 3.554 11.433 569 HE3 LYS 76 HE3 LYS 76 1.134 2.080 10.469 570 HZ1 LYS 76 HZ1 LYS 76 2.245 1.684 12.554 571 HZ2 LYS 76 HZ2 LYS 76 3.355 2.921 12.246 572 HZ3 LYS 76 HZ3 LYS 76 3.354 1.531 11.287 573 H THR 77 H THR 77 0.121 7.572 6.041 574 HA THR 77 HA THR 77 2.421 9.279 5.268 575 HB THR 77 HB THR 77 1.083 10.385 3.581 576 HG1 THR 77 HG1 THR 77 -1.068 9.510 3.137 577 HG21 THR 77 HG21 THR 77 2.247 8.347 2.854 578 HG22 THR 77 HG22 THR 77 0.746 8.581 1.960 579 HG23 THR 77 HG23 THR 77 0.824 7.388 3.257 580 H GLU 78 H GLU 78 1.255 11.712 5.036 581 HA GLU 78 HA GLU 78 0.472 12.380 7.724 582 HB2 GLU 78 HB2 GLU 78 0.343 14.700 6.885 583 HB3 GLU 78 HB3 GLU 78 1.866 13.923 6.483 584 HG2 GLU 78 HG2 GLU 78 1.071 13.532 4.204 585 HG3 GLU 78 HG3 GLU 78 -0.458 14.313 4.605 586 H PHE 79 H PHE 79 -1.253 11.185 5.129 587 HA PHE 79 HA PHE 79 -3.762 12.538 5.778 588 HB2 PHE 79 HB2 PHE 79 -3.116 10.401 3.727 589 HB3 PHE 79 HB3 PHE 79 -4.692 11.158 3.922 590 HD1 PHE 79 HD1 PHE 79 -1.158 11.816 3.013 591 HD2 PHE 79 HD2 PHE 79 -5.172 13.242 2.928 592 HE1 PHE 79 HE1 PHE 79 -0.483 13.614 1.475 593 HE2 PHE 79 HE2 PHE 79 -4.503 15.040 1.390 594 HZ PHE 79 HZ PHE 79 -2.157 15.229 0.659 595 H GLY 80 H GLY 80 -2.702 9.131 5.482 596 HA2 GLY 80 HA2 GLY 80 -3.911 8.410 8.000 597 HA3 GLY 80 HA3 GLY 80 -4.822 7.830 6.614 598 H GLU 81 H GLU 81 -4.445 5.630 6.936 599 HA GLU 81 HA GLU 81 -1.858 4.691 6.055 600 HB2 GLU 81 HB2 GLU 81 -1.313 3.338 7.953 601 HB3 GLU 81 HB3 GLU 81 -1.601 4.968 8.537 602 HG2 GLU 81 HG2 GLU 81 -2.737 3.812 10.124 603 HG3 GLU 81 HG3 GLU 81 -4.036 4.011 8.950 604 H VAL 82 H VAL 82 -1.845 2.362 5.572 605 HA VAL 82 HA VAL 82 -4.352 0.917 5.643 606 HB VAL 82 HB VAL 82 -4.579 2.410 3.648 607 HG11 VAL 82 HG11 VAL 82 -3.294 1.937 1.629 608 HG12 VAL 82 HG12 VAL 82 -2.326 0.754 2.506 609 HG13 VAL 82 HG13 VAL 82 -2.239 2.459 2.944 610 HG21 VAL 82 HG21 VAL 82 -5.368 0.654 2.118 611 HG22 VAL 82 HG22 VAL 82 -5.856 0.350 3.784 612 HG23 VAL 82 HG23 VAL 82 -4.517 -0.558 3.079 613 H VAL 83 H VAL 83 -4.101 -1.299 5.433 614 HA VAL 83 HA VAL 83 -1.366 -2.323 4.981 615 HB VAL 83 HB VAL 83 -3.716 -3.809 6.192 616 HG11 VAL 83 HG11 VAL 83 -2.062 -5.308 5.266 617 HG12 VAL 83 HG12 VAL 83 -1.961 -5.352 7.031 618 HG13 VAL 83 HG13 VAL 83 -0.765 -4.450 6.099 619 HG21 VAL 83 HG21 VAL 83 -1.438 -2.413 7.610 620 HG22 VAL 83 HG22 VAL 83 -2.652 -3.439 8.376 621 HG23 VAL 83 HG23 VAL 83 -3.133 -1.918 7.619 622 H VAL 84 H VAL 84 -0.952 -3.218 3.041 623 HA VAL 84 HA VAL 84 -3.166 -4.455 1.511 624 HB VAL 84 HB VAL 84 -2.210 -3.566 -0.576 625 HG11 VAL 84 HG11 VAL 84 -2.829 -1.401 1.441 626 HG12 VAL 84 HG12 VAL 84 -4.011 -2.327 0.518 627 HG13 VAL 84 HG13 VAL 84 -2.908 -1.233 -0.315 628 HG21 VAL 84 HG21 VAL 84 -0.321 -2.037 1.228 629 HG22 VAL 84 HG22 VAL 84 -0.499 -1.788 -0.510 630 HG23 VAL 84 HG23 VAL 84 0.118 -3.321 0.102 631 H PHE 85 H PHE 85 -2.194 -5.706 -0.474 632 HA PHE 85 HA PHE 85 -0.289 -7.634 0.525 633 HB2 PHE 85 HB2 PHE 85 -1.634 -7.385 -2.181 634 HB3 PHE 85 HB3 PHE 85 -0.596 -8.724 -1.707 635 HD1 PHE 85 HD1 PHE 85 -1.306 -10.136 0.299 636 HD2 PHE 85 HD2 PHE 85 -3.922 -7.416 -1.679 637 HE1 PHE 85 HE1 PHE 85 -3.246 -11.310 1.254 638 HE2 PHE 85 HE2 PHE 85 -5.863 -8.588 -0.727 639 HZ PHE 85 HZ PHE 85 -5.529 -10.536 0.742 640 H ALA 86 H ALA 86 1.816 -7.985 -0.152 641 HA ALA 86 HA ALA 86 3.122 -5.681 -1.384 642 HB1 ALA 86 HB1 ALA 86 5.194 -6.636 -0.550 643 HB2 ALA 86 HB2 ALA 86 4.342 -8.101 -0.055 644 HB3 ALA 86 HB3 ALA 86 3.983 -6.564 0.731 645 H LYS 87 H LYS 87 3.743 -5.621 -3.439 646 HA LYS 87 HA LYS 87 4.554 -8.115 -4.809 647 HB2 LYS 87 HB2 LYS 87 3.008 -5.781 -5.964 648 HB3 LYS 87 HB3 LYS 87 3.786 -6.997 -6.957 649 HG2 LYS 87 HG2 LYS 87 2.350 -8.709 -5.925 650 HG3 LYS 87 HG3 LYS 87 1.528 -7.430 -5.024 651 HD2 LYS 87 HD2 LYS 87 0.932 -6.334 -7.131 652 HD3 LYS 87 HD3 LYS 87 1.743 -7.618 -8.028 653 HE2 LYS 87 HE2 LYS 87 -0.501 -8.183 -6.115 654 HE3 LYS 87 HE3 LYS 87 -0.775 -7.727 -7.790 655 HZ1 LYS 87 HZ1 LYS 87 -0.778 -10.129 -7.476 656 HZ2 LYS 87 HZ2 LYS 87 0.815 -10.068 -6.916 657 HZ3 LYS 87 HZ3 LYS 87 0.464 -9.643 -8.514 658 H LYS 88 H LYS 88 6.341 -8.044 -6.069 659 HA LYS 88 HA LYS 88 8.123 -5.810 -5.578 660 HB2 LYS 88 HB2 LYS 88 8.785 -8.241 -5.328 661 HB3 LYS 88 HB3 LYS 88 8.704 -8.368 -7.084 662 HG2 LYS 88 HG2 LYS 88 10.380 -6.618 -7.284 663 HG3 LYS 88 HG3 LYS 88 10.453 -6.495 -5.530 664 HD2 LYS 88 HD2 LYS 88 11.144 -8.962 -7.133 665 HD3 LYS 88 HD3 LYS 88 12.316 -7.826 -6.464 666 HE2 LYS 88 HE2 LYS 88 11.424 -8.330 -4.193 667 HE3 LYS 88 HE3 LYS 88 10.386 -9.559 -4.916 668 HZ1 LYS 88 HZ1 LYS 88 13.345 -9.540 -5.113 669 HZ2 LYS 88 HZ2 LYS 88 12.305 -10.767 -5.635 670 HZ3 LYS 88 HZ3 LYS 88 12.473 -10.445 -3.982 671 H GLY 89 H GLY 89 8.439 -4.196 -7.020 672 HA2 GLY 89 HA2 GLY 89 7.552 -4.659 -9.813 673 HA3 GLY 89 HA3 GLY 89 7.120 -3.210 -8.927 674 H ASP 90 H ASP 90 8.144 -2.591 -11.168 675 HA ASP 90 HA ASP 90 11.060 -2.418 -11.092 676 HB2 ASP 90 HB2 ASP 90 9.117 -1.379 -13.170 677 HB3 ASP 90 HB3 ASP 90 10.862 -1.529 -13.354 678 H VAL 91 H VAL 91 9.139 -0.866 -9.280 679 HA VAL 91 HA VAL 91 9.319 1.891 -10.004 680 HB VAL 91 HB VAL 91 8.480 2.339 -7.726 681 HG11 VAL 91 HG11 VAL 91 6.872 1.796 -9.469 682 HG12 VAL 91 HG12 VAL 91 6.337 1.137 -7.922 683 HG13 VAL 91 HG13 VAL 91 7.058 0.074 -9.133 684 HG21 VAL 91 HG21 VAL 91 8.795 -0.640 -7.321 685 HG22 VAL 91 HG22 VAL 91 7.965 0.455 -6.214 686 HG23 VAL 91 HG23 VAL 91 9.699 0.629 -6.494 687 HA PRO 92 HA PRO 92 13.360 3.033 -8.521 688 HB2 PRO 92 HB2 PRO 92 12.102 5.469 -7.368 689 HB3 PRO 92 HB3 PRO 92 13.396 5.327 -8.563 690 HG2 PRO 92 HG2 PRO 92 10.943 6.080 -9.289 691 HG3 PRO 92 HG3 PRO 92 11.906 5.004 -10.324 692 HD2 PRO 92 HD2 PRO 92 9.656 4.326 -8.453 693 HD3 PRO 92 HD3 PRO 92 9.980 3.720 -10.092 694 H LYS 93 H LYS 93 14.624 3.452 -6.587 695 HA LYS 93 HA LYS 93 13.672 2.035 -4.306 696 HB2 LYS 93 HB2 LYS 93 16.055 2.097 -5.037 697 HB3 LYS 93 HB3 LYS 93 16.138 3.779 -4.525 698 HG2 LYS 93 HG2 LYS 93 15.724 3.145 -2.228 699 HG3 LYS 93 HG3 LYS 93 15.491 1.461 -2.702 700 HD2 LYS 93 HD2 LYS 93 17.837 1.435 -3.540 701 HD3 LYS 93 HD3 LYS 93 18.045 3.065 -2.896 702 HE2 LYS 93 HE2 LYS 93 17.626 2.271 -0.647 703 HE3 LYS 93 HE3 LYS 93 17.265 0.652 -1.250 704 HZ1 LYS 93 HZ1 LYS 93 19.888 2.023 -1.469 705 HZ2 LYS 93 HZ2 LYS 93 19.543 0.462 -2.015 706 HZ3 LYS 93 HZ3 LYS 93 19.511 0.806 -0.359 707 H GLY 94 H GLY 94 13.040 2.754 -2.276 708 HA2 GLY 94 HA2 GLY 94 12.036 4.177 -0.764 709 HA3 GLY 94 HA3 GLY 94 12.970 5.486 -1.474 710 H MET 95 H MET 95 10.837 3.544 -3.425 711 HA MET 95 HA MET 95 8.685 5.509 -3.364 712 HB2 MET 95 HB2 MET 95 10.455 6.287 -4.992 713 HB3 MET 95 HB3 MET 95 10.165 4.825 -5.920 714 HG2 MET 95 HG2 MET 95 7.924 5.503 -6.395 715 HG3 MET 95 HG3 MET 95 8.077 6.900 -5.326 716 HE1 MET 95 HE1 MET 95 7.050 7.417 -8.284 717 HE2 MET 95 HE2 MET 95 8.023 8.842 -8.639 718 HE3 MET 95 HE3 MET 95 7.343 8.616 -7.027 719 H ILE 96 H ILE 96 6.690 4.558 -3.870 720 HA ILE 96 HA ILE 96 6.730 1.822 -4.967 721 HB ILE 96 HB ILE 96 5.107 1.030 -3.316 722 HG12 ILE 96 HG12 ILE 96 5.544 3.687 -1.912 723 HG13 ILE 96 HG13 ILE 96 4.076 3.220 -2.762 724 HG21 ILE 96 HG21 ILE 96 7.472 0.629 -2.898 725 HG22 ILE 96 HG22 ILE 96 6.611 0.874 -1.379 726 HG23 ILE 96 HG23 ILE 96 7.602 2.169 -2.048 727 HD11 ILE 96 HD11 ILE 96 5.197 1.866 -0.316 728 HD12 ILE 96 HD12 ILE 96 3.717 1.413 -1.165 729 HD13 ILE 96 HD13 ILE 96 3.827 2.978 -0.358 730 H PHE 97 H PHE 97 4.893 1.168 -6.074 731 HA PHE 97 HA PHE 97 3.067 3.358 -6.838 732 HB2 PHE 97 HB2 PHE 97 4.343 2.473 -8.704 733 HB3 PHE 97 HB3 PHE 97 3.850 0.829 -8.312 734 HD1 PHE 97 HD2 PHE 97 2.703 4.070 -9.641 735 HD2 PHE 97 HD1 PHE 97 1.717 -0.027 -8.999 736 HE1 PHE 97 HE2 PHE 97 0.758 4.305 -11.126 737 HE2 PHE 97 HE1 PHE 97 -0.230 0.205 -10.484 738 HZ PHE 97 HZ PHE 97 -0.711 2.373 -11.550 739 H ILE 98 H ILE 98 0.961 3.240 -6.300 740 HA ILE 98 HA ILE 98 -0.221 0.576 -5.807 741 HB ILE 98 HB ILE 98 -0.962 3.167 -4.415 742 HG12 ILE 98 HG12 ILE 98 0.407 0.659 -3.394 743 HG13 ILE 98 HG13 ILE 98 1.121 2.260 -3.538 744 HG21 ILE 98 HG21 ILE 98 -2.113 0.389 -4.070 745 HG22 ILE 98 HG22 ILE 98 -2.928 1.769 -4.807 746 HG23 ILE 98 HG23 ILE 98 -2.520 1.802 -3.094 747 HD11 ILE 98 HD11 ILE 98 0.568 1.744 -1.235 748 HD12 ILE 98 HD12 ILE 98 -1.118 1.485 -1.681 749 HD13 ILE 98 HD13 ILE 98 -0.405 3.091 -1.823 750 HA PRO 99 HA PRO 99 -3.022 1.687 -9.169 751 HB2 PRO 99 HB2 PRO 99 -4.752 -0.335 -7.823 752 HB3 PRO 99 HB3 PRO 99 -4.239 -0.243 -9.512 753 HG2 PRO 99 HG2 PRO 99 -3.168 -2.042 -7.872 754 HG3 PRO 99 HG3 PRO 99 -2.167 -1.203 -9.073 755 HD2 PRO 99 HD2 PRO 99 -2.391 -0.720 -6.121 756 HD3 PRO 99 HD3 PRO 99 -0.951 -0.694 -7.163 757 H MET 100 H MET 100 -4.502 3.301 -9.236 758 HA MET 100 HA MET 100 -5.394 4.728 -7.041 759 HB2 MET 100 HB2 MET 100 -5.389 5.660 -9.276 760 HB3 MET 100 HB3 MET 100 -6.599 4.507 -9.809 761 HG2 MET 100 HG2 MET 100 -7.684 6.581 -9.544 762 HG3 MET 100 HG3 MET 100 -8.194 5.570 -8.198 763 HE1 MET 100 HE1 MET 100 -6.991 7.346 -5.098 764 HE2 MET 100 HE2 MET 100 -6.607 5.758 -5.760 765 HE3 MET 100 HE3 MET 100 -8.257 6.377 -5.851 766 H GLY 101 H GLY 101 -6.571 3.926 -5.381 767 HA2 GLY 101 HA2 GLY 101 -9.288 3.088 -5.846 768 HA3 GLY 101 HA3 GLY 101 -8.262 1.745 -5.366 769 HA PRO 102 HA PRO 102 -10.224 3.916 -1.617 770 HB2 PRO 102 HB2 PRO 102 -10.793 1.475 -0.395 771 HB3 PRO 102 HB3 PRO 102 -11.935 2.429 -1.348 772 HG2 PRO 102 HG2 PRO 102 -10.259 0.090 -2.179 773 HG3 PRO 102 HG3 PRO 102 -11.944 0.464 -2.593 774 HD2 PRO 102 HD2 PRO 102 -9.974 0.903 -4.347 775 HD3 PRO 102 HD3 PRO 102 -11.323 2.051 -4.195 776 H TYR 103 H TYR 103 -8.056 1.121 -1.873 777 HA TYR 103 HA TYR 103 -6.862 1.286 0.666 778 HB2 TYR 103 HB2 TYR 103 -5.737 0.272 -1.962 779 HB3 TYR 103 HB3 TYR 103 -4.996 -0.003 -0.388 780 HD1 TYR 103 HD2 TYR 103 -8.180 -0.579 -2.263 781 HD2 TYR 103 HD1 TYR 103 -5.599 -1.897 0.857 782 HE1 TYR 103 HE2 TYR 103 -9.576 -2.578 -1.957 783 HE2 TYR 103 HE1 TYR 103 -6.987 -3.897 1.166 784 HH TYR 103 HH TYR 103 -9.223 -4.950 -1.034 785 H ALA 104 H ALA 104 -5.721 2.578 -2.468 786 HA ALA 104 HA ALA 104 -3.590 4.107 -1.459 787 HB1 ALA 104 HB1 ALA 104 -3.700 5.329 -3.580 788 HB2 ALA 104 HB2 ALA 104 -5.281 4.623 -3.910 789 HB3 ALA 104 HB3 ALA 104 -3.852 3.591 -3.837 790 H ASN 105 H ASN 105 -7.010 4.867 -1.885 791 HA ASN 105 HA ASN 105 -7.045 7.587 -1.360 792 HB2 ASN 105 HB2 ASN 105 -9.023 6.522 -2.141 793 HB3 ASN 105 HB3 ASN 105 -9.042 5.396 -0.792 794 HD21 ASN 105 HD21 ASN 105 -9.841 6.048 1.171 795 HD22 ASN 105 HD22 ASN 105 -10.736 7.512 1.371 796 H MET 106 H MET 106 -6.536 4.954 0.865 797 HA MET 106 HA MET 106 -7.126 6.331 3.285 798 HB2 MET 106 HB2 MET 106 -5.327 3.952 2.768 799 HB3 MET 106 HB3 MET 106 -5.837 4.498 4.360 800 HG2 MET 106 HG2 MET 106 -7.784 3.699 2.221 801 HG3 MET 106 HG3 MET 106 -7.099 2.551 3.369 802 HE1 MET 106 HE1 MET 106 -7.897 2.257 5.809 803 HE2 MET 106 HE2 MET 106 -8.594 3.575 6.748 804 HE3 MET 106 HE3 MET 106 -6.965 3.731 6.087 805 H VAL 107 H VAL 107 -4.496 6.638 1.116 806 HA VAL 107 HA VAL 107 -2.874 7.963 3.193 807 HB VAL 107 HB VAL 107 -0.811 7.061 2.143 808 HG11 VAL 107 HG11 VAL 107 -1.715 6.023 4.153 809 HG12 VAL 107 HG12 VAL 107 -0.982 4.811 3.103 810 HG13 VAL 107 HG13 VAL 107 -2.737 4.973 3.172 811 HG21 VAL 107 HG21 VAL 107 -0.975 5.105 0.654 812 HG22 VAL 107 HG22 VAL 107 -1.671 6.550 -0.079 813 HG23 VAL 107 HG23 VAL 107 -2.727 5.308 0.592 814 H ILE 108 H ILE 108 -4.113 8.104 -0.028 815 HA ILE 108 HA ILE 108 -2.132 10.114 -0.833 816 HB ILE 108 HB ILE 108 -2.780 9.844 -3.060 817 HG12 ILE 108 HG12 ILE 108 -5.145 8.138 -2.259 818 HG13 ILE 108 HG13 ILE 108 -5.275 9.869 -2.561 819 HG21 ILE 108 HG21 ILE 108 -2.847 7.163 -1.679 820 HG22 ILE 108 HG22 ILE 108 -1.446 7.989 -2.365 821 HG23 ILE 108 HG23 ILE 108 -2.712 7.359 -3.426 822 HD11 ILE 108 HD11 ILE 108 -4.383 7.765 -4.499 823 HD12 ILE 108 HD12 ILE 108 -4.350 9.499 -4.806 824 HD13 ILE 108 HD13 ILE 108 -5.894 8.679 -4.534 825 H ASP 109 H ASP 109 -3.184 11.829 -2.419 826 HA ASP 109 HA ASP 109 -5.342 13.181 -0.945 827 HB2 ASP 109 HB2 ASP 109 -3.327 14.504 -1.131 828 HB3 ASP 109 HB3 ASP 109 -3.261 14.245 -2.874 829 HA PRO 110 HA PRO 110 -7.830 12.109 -4.562 830 HB2 PRO 110 HB2 PRO 110 -10.238 12.514 -3.479 831 HB3 PRO 110 HB3 PRO 110 -9.219 11.165 -2.952 832 HG2 PRO 110 HG2 PRO 110 -9.675 13.824 -1.640 833 HG3 PRO 110 HG3 PRO 110 -9.593 12.211 -0.906 834 HD2 PRO 110 HD2 PRO 110 -7.496 14.024 -0.975 835 HD3 PRO 110 HD3 PRO 110 -7.307 12.269 -0.774 836 H SER 111 H SER 111 -6.996 15.116 -3.631 837 HA SER 111 HA SER 111 -9.180 16.666 -4.760 838 HB2 SER 111 HB2 SER 111 -6.431 17.633 -3.928 839 HB3 SER 111 HB3 SER 111 -7.882 18.609 -4.138 840 HG SER 111 HG SER 111 -7.050 17.118 -2.000 841 H THR 112 H THR 112 -7.957 14.837 -6.631 842 HA THR 112 HA THR 112 -5.947 16.218 -8.171 843 HB THR 112 HB THR 112 -6.020 14.253 -9.660 844 HG1 THR 112 HG1 THR 112 -7.445 12.479 -8.789 845 HG21 THR 112 HG21 THR 112 -5.980 13.598 -6.704 846 HG22 THR 112 HG22 THR 112 -4.613 14.147 -7.673 847 HG23 THR 112 HG23 THR 112 -5.332 12.566 -7.981 848 H ASP 113 H ASP 113 -9.175 16.753 -8.088 849 HA ASP 113 HA ASP 113 -9.860 16.786 -10.851 850 HB2 ASP 113 HB2 ASP 113 -11.092 18.168 -8.462 851 HB3 ASP 113 HB3 ASP 113 -11.792 18.191 -10.081 852 H GLY 114 H GLY 114 -9.677 18.335 -12.381 853 HA2 GLY 114 HA2 GLY 114 -9.400 20.473 -13.283 854 HA3 GLY 114 HA3 GLY 114 -9.031 21.086 -11.681 855 H THR 115 H THR 115 -7.204 18.313 -12.400 856 HA THR 115 HA THR 115 -4.835 19.999 -12.891 857 HB THR 115 HB THR 115 -3.471 18.174 -12.085 858 HG1 THR 115 HG1 THR 115 -5.683 16.566 -11.439 859 HG21 THR 115 HG21 THR 115 -4.433 19.598 -10.354 860 HG22 THR 115 HG22 THR 115 -4.318 17.936 -9.776 861 HG23 THR 115 HG23 THR 115 -5.875 18.584 -10.293 862 H GLY 116 H GLY 116 -3.447 19.657 -14.589 863 HA2 GLY 116 HA2 GLY 116 -4.274 17.681 -16.639 864 HA3 GLY 116 HA3 GLY 116 -3.497 19.215 -17.000 865 H MET 117 H MET 117 -2.842 16.166 -17.295 866 HA MET 117 HA MET 117 -1.007 14.835 -17.362 867 HB2 MET 117 HB2 MET 117 0.445 17.423 -16.788 868 HB3 MET 117 HB3 MET 117 1.274 15.900 -17.073 869 HG2 MET 117 HG2 MET 117 -0.609 17.201 -19.032 870 HG3 MET 117 HG3 MET 117 1.145 17.377 -19.060 871 HE1 MET 117 HE1 MET 117 2.295 13.678 -19.747 872 HE2 MET 117 HE2 MET 117 2.056 14.415 -18.163 873 HE3 MET 117 HE3 MET 117 2.825 15.336 -19.457 874 HA PRO 118 HA PRO 118 -0.625 13.726 -13.056 875 HB2 PRO 118 HB2 PRO 118 0.419 11.276 -13.357 876 HB3 PRO 118 HB3 PRO 118 -1.236 11.642 -13.863 877 HG2 PRO 118 HG2 PRO 118 1.247 11.406 -15.522 878 HG3 PRO 118 HG3 PRO 118 -0.391 10.822 -15.868 879 HD2 PRO 118 HD2 PRO 118 0.702 13.167 -16.873 880 HD3 PRO 118 HD3 PRO 118 -1.038 12.838 -16.742 881 H GLN 119 H GLN 119 2.227 13.356 -15.154 882 HA GLN 119 HA GLN 119 4.457 13.509 -14.826 883 HB2 GLN 119 HB2 GLN 119 3.952 15.698 -13.817 884 HB3 GLN 119 HB3 GLN 119 3.709 14.923 -12.254 885 HG2 GLN 119 HG2 GLN 119 6.095 14.095 -12.456 886 HG3 GLN 119 HG3 GLN 119 6.266 15.210 -13.808 887 HE21 GLN 119 HE21 GLN 119 7.623 15.166 -11.221 888 HE22 GLN 119 HE22 GLN 119 7.319 16.708 -10.500 889 H PHE 120 H PHE 120 6.198 12.410 -13.779 890 HA PHE 120 HA PHE 120 5.395 10.055 -12.360 891 HB2 PHE 120 HB2 PHE 120 8.117 11.120 -13.133 892 HB3 PHE 120 HB3 PHE 120 7.885 9.593 -12.291 893 HD1 PHE 120 HD1 PHE 120 6.858 7.691 -13.414 894 HD2 PHE 120 HD2 PHE 120 7.541 11.364 -15.466 895 HE1 PHE 120 HE1 PHE 120 6.512 6.552 -15.568 896 HE2 PHE 120 HE2 PHE 120 7.194 10.229 -17.619 897 HZ PHE 120 HZ PHE 120 6.677 7.822 -17.672 898 H LYS 121 H LYS 121 4.416 11.215 -10.501 899 HA LYS 121 HA LYS 121 6.273 10.974 -8.302 900 HB2 LYS 121 HB2 LYS 121 6.176 13.083 -7.377 901 HB3 LYS 121 HB3 LYS 121 6.215 13.478 -9.087 902 HG2 LYS 121 HG2 LYS 121 3.680 13.324 -7.456 903 HG3 LYS 121 HG3 LYS 121 4.601 14.804 -7.707 904 HD2 LYS 121 HD2 LYS 121 4.221 14.684 -10.096 905 HD3 LYS 121 HD3 LYS 121 3.416 13.122 -9.922 906 HE2 LYS 121 HE2 LYS 121 1.814 14.983 -10.185 907 HE3 LYS 121 HE3 LYS 121 1.626 14.150 -8.643 908 HZ1 LYS 121 HZ1 LYS 121 2.943 15.943 -7.611 909 HZ2 LYS 121 HZ2 LYS 121 1.506 16.505 -8.299 910 HZ3 LYS 121 HZ3 LYS 121 2.976 16.758 -9.092 911 H GLY 122 H GLY 122 5.152 11.036 -6.172 912 HA2 GLY 122 HA2 GLY 122 2.247 10.645 -6.319 913 HA3 GLY 122 HA3 GLY 122 3.219 9.330 -5.677 914 H VAL 123 H VAL 123 1.523 9.960 -3.907 915 HA VAL 123 HA VAL 123 2.281 12.207 -2.232 916 HB VAL 123 HB VAL 123 0.416 9.896 -1.666 917 HG11 VAL 123 HG11 VAL 123 -0.473 11.285 0.148 918 HG12 VAL 123 HG12 VAL 123 0.773 12.492 -0.173 919 HG13 VAL 123 HG13 VAL 123 1.228 10.887 0.399 920 HG21 VAL 123 HG21 VAL 123 -1.385 11.516 -2.138 921 HG22 VAL 123 HG22 VAL 123 -0.360 11.230 -3.544 922 HG23 VAL 123 HG23 VAL 123 -0.170 12.710 -2.600 923 H LYS 124 H LYS 124 3.975 12.168 -0.851 924 HA LYS 124 HA LYS 124 5.483 9.808 -0.399 925 HB2 LYS 124 HB2 LYS 124 5.660 12.575 0.757 926 HB3 LYS 124 HB3 LYS 124 6.692 11.277 1.343 927 HG2 LYS 124 HG2 LYS 124 7.391 10.955 -1.092 928 HG3 LYS 124 HG3 LYS 124 6.619 12.515 -1.395 929 HD2 LYS 124 HD2 LYS 124 8.995 12.832 -1.001 930 HD3 LYS 124 HD3 LYS 124 8.069 13.539 0.321 931 HE2 LYS 124 HE2 LYS 124 8.475 11.466 1.644 932 HE3 LYS 124 HE3 LYS 124 9.504 10.880 0.341 933 HZ1 LYS 124 HZ1 LYS 124 10.944 12.796 0.680 934 HZ2 LYS 124 HZ2 LYS 124 10.805 11.879 2.090 935 HZ3 LYS 124 HZ3 LYS 124 9.956 13.337 1.945 936 H GLY 125 H GLY 125 6.042 8.818 1.575 937 HA2 GLY 125 HA2 GLY 125 4.750 9.168 4.041 938 HA3 GLY 125 HA3 GLY 125 3.863 7.955 3.126 939 H THR 126 H THR 126 4.408 6.250 4.518 940 HA THR 126 HA THR 126 7.174 5.279 4.231 941 HB THR 126 HB THR 126 7.140 4.465 6.600 942 HG1 THR 126 HG1 THR 126 4.993 6.295 6.988 943 HG21 THR 126 HG21 THR 126 7.682 6.620 7.630 944 HG22 THR 126 HG22 THR 126 6.911 7.467 6.290 945 HG23 THR 126 HG23 THR 126 8.367 6.512 6.009 946 H VAL 127 H VAL 127 7.430 3.021 4.382 947 HA VAL 127 HA VAL 127 4.964 1.406 4.480 948 HB VAL 127 HB VAL 127 5.780 1.597 2.138 949 HG11 VAL 127 HG11 VAL 127 7.879 0.477 1.490 950 HG12 VAL 127 HG12 VAL 127 8.260 0.235 3.196 951 HG13 VAL 127 HG13 VAL 127 8.155 1.870 2.540 952 HG21 VAL 127 HG21 VAL 127 4.555 -0.402 2.843 953 HG22 VAL 127 HG22 VAL 127 6.071 -1.177 3.315 954 HG23 VAL 127 HG23 VAL 127 5.763 -0.797 1.618 955 H GLU 128 H GLU 128 5.160 -0.635 5.492 956 HA GLU 128 HA GLU 128 7.734 -1.338 6.688 957 HB2 GLU 128 HB2 GLU 128 6.708 -1.440 8.976 958 HB3 GLU 128 HB3 GLU 128 6.862 0.190 8.330 959 HG2 GLU 128 HG2 GLU 128 4.541 0.320 7.844 960 HG3 GLU 128 HG3 GLU 128 4.316 -1.403 8.143 961 H LYS 129 H LYS 129 7.914 -3.467 7.364 962 HA LYS 129 HA LYS 129 6.023 -5.449 6.596 963 HB2 LYS 129 HB2 LYS 129 8.315 -6.112 6.774 964 HB3 LYS 129 HB3 LYS 129 8.447 -5.476 8.405 965 HG2 LYS 129 HG2 LYS 129 8.373 -7.797 8.683 966 HG3 LYS 129 HG3 LYS 129 6.741 -7.256 9.069 967 HD2 LYS 129 HD2 LYS 129 6.515 -9.194 7.715 968 HD3 LYS 129 HD3 LYS 129 6.114 -7.817 6.684 969 HE2 LYS 129 HE2 LYS 129 8.371 -7.869 5.737 970 HE3 LYS 129 HE3 LYS 129 8.786 -9.224 6.786 971 HZ1 LYS 129 HZ1 LYS 129 8.241 -10.004 4.602 972 HZ2 LYS 129 HZ2 LYS 129 6.747 -9.219 4.637 973 HZ3 LYS 129 HZ3 LYS 129 7.044 -10.516 5.680 974 H THR 130 H THR 130 4.037 -5.500 7.541 975 HA THR 130 HA THR 130 3.820 -4.826 10.398 976 HB THR 130 HB THR 130 2.369 -3.499 8.980 977 HG1 THR 130 HG1 THR 130 1.426 -3.880 10.938 978 HG21 THR 130 HG21 THR 130 0.537 -4.499 7.699 979 HG22 THR 130 HG22 THR 130 1.106 -6.114 8.126 980 HG23 THR 130 HG23 THR 130 2.099 -5.069 7.108 981 H ASP 131 H ASP 131 2.292 -6.012 11.724 982 HA ASP 131 HA ASP 131 2.350 -8.899 11.190 983 HB2 ASP 131 HB2 ASP 131 3.376 -8.126 13.277 984 HB3 ASP 131 HB3 ASP 131 1.882 -7.325 13.740 985 H GLU 132 H GLU 132 0.309 -6.417 10.637 986 HA GLU 132 HA GLU 132 -2.155 -7.610 11.621 987 HB2 GLU 132 HB2 GLU 132 -1.701 -5.105 9.991 988 HB3 GLU 132 HB3 GLU 132 -3.252 -5.627 10.635 989 HG2 GLU 132 HG2 GLU 132 -2.056 -5.567 12.926 990 HG3 GLU 132 HG3 GLU 132 -0.853 -4.590 12.085 991 H LYS 133 H LYS 133 -4.067 -7.344 9.976 992 HA LYS 133 HA LYS 133 -3.417 -8.945 7.602 993 HB2 LYS 133 HB2 LYS 133 -5.919 -9.349 7.565 994 HB3 LYS 133 HB3 LYS 133 -5.065 -9.995 8.954 995 HG2 LYS 133 HG2 LYS 133 -7.022 -9.078 9.845 996 HG3 LYS 133 HG3 LYS 133 -5.781 -7.873 10.188 997 HD2 LYS 133 HD2 LYS 133 -6.532 -6.601 8.185 998 HD3 LYS 133 HD3 LYS 133 -7.820 -7.783 7.954 999 HE2 LYS 133 HE2 LYS 133 -8.712 -5.848 9.083 1000 HE3 LYS 133 HE3 LYS 133 -8.694 -7.210 10.200 1001 HZ1 LYS 133 HZ1 LYS 133 -6.676 -6.325 11.191 1002 HZ2 LYS 133 HZ2 LYS 133 -7.921 -5.187 11.258 1003 HZ3 LYS 133 HZ3 LYS 133 -6.688 -5.020 10.114 1004 H VAL 134 H VAL 134 -4.579 -8.478 5.574 1005 HA VAL 134 HA VAL 134 -4.424 -5.734 4.827 1006 HB VAL 134 HB VAL 134 -5.596 -8.101 3.342 1007 HG11 VAL 134 HG11 VAL 134 -4.950 -5.325 2.327 1008 HG12 VAL 134 HG12 VAL 134 -6.552 -6.053 2.451 1009 HG13 VAL 134 HG13 VAL 134 -5.375 -6.704 1.313 1010 HG21 VAL 134 HG21 VAL 134 -3.484 -8.061 2.095 1011 HG22 VAL 134 HG22 VAL 134 -3.209 -8.320 3.819 1012 HG23 VAL 134 HG23 VAL 134 -2.910 -6.734 3.106 1013 H LEU 135 H LEU 135 -5.992 -4.192 4.590 1014 HA LEU 135 HA LEU 135 -8.584 -4.657 5.770 1015 HB2 LEU 135 HB2 LEU 135 -7.061 -2.315 4.826 1016 HB3 LEU 135 HB3 LEU 135 -8.791 -2.191 4.574 1017 HG LEU 135 HG LEU 135 -7.359 -2.548 7.209 1018 HD11 LEU 135 HD11 LEU 135 -8.422 -0.395 7.736 1019 HD12 LEU 135 HD12 LEU 135 -9.094 -0.334 6.104 1020 HD13 LEU 135 HD13 LEU 135 -7.347 -0.274 6.343 1021 HD21 LEU 135 HD21 LEU 135 -10.315 -2.620 6.595 1022 HD22 LEU 135 HD22 LEU 135 -9.632 -2.441 8.213 1023 HD23 LEU 135 HD23 LEU 135 -9.338 -3.914 7.292 1024 H SER 136 H SER 136 -9.827 -6.017 4.551 1025 HA SER 136 HA SER 136 -10.000 -6.139 1.772 1026 HB2 SER 136 HB2 SER 136 -12.197 -7.260 2.116 1027 HB3 SER 136 HB3 SER 136 -10.933 -7.902 3.162 1028 HG SER 136 HG SER 136 -11.859 -6.998 4.888 1029 H VAL 137 H VAL 137 -11.685 -5.451 0.321 1030 HA VAL 137 HA VAL 137 -11.825 -2.747 0.089 1031 HB VAL 137 HB VAL 137 -13.833 -4.730 -1.001 1032 HG11 VAL 137 HG11 VAL 137 -14.732 -2.475 -1.139 1033 HG12 VAL 137 HG12 VAL 137 -14.273 -3.039 -2.745 1034 HG13 VAL 137 HG13 VAL 137 -13.239 -1.899 -1.884 1035 HG21 VAL 137 HG21 VAL 137 -11.579 -5.296 -1.670 1036 HG22 VAL 137 HG22 VAL 137 -11.268 -3.634 -2.166 1037 HG23 VAL 137 HG23 VAL 137 -12.437 -4.614 -3.052 1038 H LYS 138 H LYS 138 -14.533 -4.752 1.339 1039 HA LYS 138 HA LYS 138 -16.166 -2.454 1.823 1040 HB2 LYS 138 HB2 LYS 138 -17.110 -4.689 1.337 1041 HB3 LYS 138 HB3 LYS 138 -16.517 -5.262 2.892 1042 HG2 LYS 138 HG2 LYS 138 -17.938 -3.576 4.019 1043 HG3 LYS 138 HG3 LYS 138 -18.573 -3.098 2.444 1044 HD2 LYS 138 HD2 LYS 138 -20.121 -4.618 3.513 1045 HD3 LYS 138 HD3 LYS 138 -19.394 -5.408 2.112 1046 HE2 LYS 138 HE2 LYS 138 -17.850 -6.606 3.571 1047 HE3 LYS 138 HE3 LYS 138 -18.518 -5.781 4.981 1048 HZ1 LYS 138 HZ1 LYS 138 -20.027 -7.594 3.184 1049 HZ2 LYS 138 HZ2 LYS 138 -20.633 -6.835 4.567 1050 HZ3 LYS 138 HZ3 LYS 138 -19.425 -8.011 4.710 1051 H GLU 139 H GLU 139 -14.207 -4.542 3.958 1052 HA GLU 139 HA GLU 139 -14.890 -3.420 6.421 1053 HB2 GLU 139 HB2 GLU 139 -13.531 -5.458 6.157 1054 HB3 GLU 139 HB3 GLU 139 -12.211 -4.507 5.496 1055 HG2 GLU 139 HG2 GLU 139 -11.728 -5.067 7.773 1056 HG3 GLU 139 HG3 GLU 139 -12.013 -3.331 7.653 1057 H LEU 140 H LEU 140 -12.489 -2.451 4.036 1058 HA LEU 140 HA LEU 140 -11.388 -0.219 5.302 1059 HB2 LEU 140 HB2 LEU 140 -10.860 -1.524 3.064 1060 HB3 LEU 140 HB3 LEU 140 -11.855 -0.270 2.348 1061 HG LEU 140 HG LEU 140 -9.499 0.393 4.094 1062 HD11 LEU 140 HD11 LEU 140 -9.473 -0.012 1.106 1063 HD12 LEU 140 HD12 LEU 140 -8.712 -1.061 2.302 1064 HD13 LEU 140 HD13 LEU 140 -8.138 0.593 2.093 1065 HD21 LEU 140 HD21 LEU 140 -11.036 2.217 3.686 1066 HD22 LEU 140 HD22 LEU 140 -10.979 1.916 1.950 1067 HD23 LEU 140 HD23 LEU 140 -9.541 2.488 2.793 1068 H LEU 141 H LEU 141 -14.292 -0.531 3.252 1069 HA LEU 141 HA LEU 141 -15.006 2.179 3.059 1070 HB2 LEU 141 HB2 LEU 141 -16.912 -0.158 3.281 1071 HB3 LEU 141 HB3 LEU 141 -17.275 1.417 2.603 1072 HG LEU 141 HG LEU 141 -15.390 -0.632 1.435 1073 HD11 LEU 141 HD11 LEU 141 -18.098 0.321 0.515 1074 HD12 LEU 141 HD12 LEU 141 -17.730 -1.255 1.221 1075 HD13 LEU 141 HD13 LEU 141 -17.050 -0.810 -0.344 1076 HD21 LEU 141 HD21 LEU 141 -16.197 2.075 0.371 1077 HD22 LEU 141 HD22 LEU 141 -15.230 0.871 -0.484 1078 HD23 LEU 141 HD23 LEU 141 -14.599 1.629 0.979 1079 H GLU 142 H GLU 142 -16.167 -0.274 5.370 1080 HA GLU 142 HA GLU 142 -17.716 1.512 6.919 1081 HB2 GLU 142 HB2 GLU 142 -16.512 -1.133 7.769 1082 HB3 GLU 142 HB3 GLU 142 -17.864 -0.309 8.538 1083 HG2 GLU 142 HG2 GLU 142 -19.134 -0.547 6.404 1084 HG3 GLU 142 HG3 GLU 142 -17.803 -1.517 5.777 1085 H ALA 143 H ALA 143 -14.341 0.552 7.095 1086 HA ALA 143 HA ALA 143 -13.674 1.587 9.615 1087 HB1 ALA 143 HB1 ALA 143 -11.932 1.480 7.149 1088 HB2 ALA 143 HB2 ALA 143 -12.191 0.151 8.278 1089 HB3 ALA 143 HB3 ALA 143 -11.376 1.619 8.818 1090 H ILE 144 H ILE 144 -13.424 3.185 6.412 1091 HA ILE 144 HA ILE 144 -12.819 5.729 7.644 1092 HB ILE 144 HB ILE 144 -12.849 6.632 5.324 1093 HG12 ILE 144 HG12 ILE 144 -12.752 4.673 3.546 1094 HG13 ILE 144 HG13 ILE 144 -13.769 3.838 4.710 1095 HG21 ILE 144 HG21 ILE 144 -10.828 5.446 4.591 1096 HG22 ILE 144 HG22 ILE 144 -11.154 4.177 5.772 1097 HG23 ILE 144 HG23 ILE 144 -10.793 5.816 6.316 1098 HD11 ILE 144 HD11 ILE 144 -15.069 4.915 2.961 1099 HD12 ILE 144 HD12 ILE 144 -14.389 6.481 3.407 1100 HD13 ILE 144 HD13 ILE 144 -15.423 5.613 4.543 1101 H GLY 145 H GLY 145 -15.698 4.096 6.750 1102 HA2 GLY 145 HA2 GLY 145 -17.724 5.077 7.797 1103 HA3 GLY 145 HA3 GLY 145 -17.233 6.613 7.102 1104 H SER 146 H SER 146 -16.953 6.507 4.615 1105 HA SER 146 HA SER 146 -19.478 5.923 3.499 1106 HB2 SER 146 HB2 SER 146 -16.854 6.444 2.063 1107 HB3 SER 146 HB3 SER 146 -18.454 6.501 1.323 1108 HG SER 146 HG SER 146 -18.590 8.473 1.996 Start of MODEL 4 1 H1 MET 1 H1 MET 1 -23.053 17.033 65.284 2 H2 MET 1 H2 MET 1 -24.190 17.005 64.036 3 H3 MET 1 H3 MET 1 -22.555 16.764 63.691 4 HA MET 1 HA MET 1 -22.539 14.703 64.887 5 HB2 MET 1 HB2 MET 1 -25.466 15.314 65.378 6 HB3 MET 1 HB3 MET 1 -24.700 13.768 65.719 7 HG2 MET 1 HG2 MET 1 -24.935 15.113 67.732 8 HG3 MET 1 HG3 MET 1 -23.236 14.828 67.348 9 HE1 MET 1 HE1 MET 1 -23.186 18.410 68.945 10 HE2 MET 1 HE2 MET 1 -22.508 16.783 69.006 11 HE3 MET 1 HE3 MET 1 -24.203 17.048 69.411 12 H GLY 2 H GLY 2 -22.060 13.670 63.031 13 HA2 GLY 2 HA2 GLY 2 -23.964 12.300 61.514 14 HA3 GLY 2 HA3 GLY 2 -23.613 13.792 60.654 15 H SER 3 H SER 3 -22.874 10.656 60.597 16 HA SER 3 HA SER 3 -19.979 10.986 60.173 17 HB2 SER 3 HB2 SER 3 -19.862 8.521 60.337 18 HB3 SER 3 HB3 SER 3 -20.600 9.240 61.767 19 HG SER 3 HG SER 3 -21.782 7.733 59.707 20 H SER 4 H SER 4 -19.411 11.375 58.130 21 HA SER 4 HA SER 4 -20.802 10.005 55.926 22 HB2 SER 4 HB2 SER 4 -18.725 12.217 55.847 23 HB3 SER 4 HB3 SER 4 -19.512 11.513 54.438 24 HG SER 4 HG SER 4 -20.470 13.500 55.197 25 H HIS 5 H HIS 5 -18.962 9.556 54.042 26 HA HIS 5 HA HIS 5 -16.662 8.207 55.187 27 HB2 HIS 5 HB2 HIS 5 -17.338 5.994 54.176 28 HB3 HIS 5 HB3 HIS 5 -18.268 6.499 55.582 29 HD1 HIS 5 HD1 HIS 5 -18.608 5.549 52.056 30 HD2 HIS 5 HD2 HIS 5 -20.922 7.443 54.945 31 HE1 HIS 5 HE1 HIS 5 -20.954 5.537 51.156 32 HE2 HIS 5 HE2 HIS 5 -22.304 6.820 52.849 33 H HIS 6 H HIS 6 -15.147 7.436 53.668 34 HA HIS 6 HA HIS 6 -15.561 7.826 50.833 35 HB2 HIS 6 HB2 HIS 6 -13.664 9.421 50.573 36 HB3 HIS 6 HB3 HIS 6 -15.021 10.112 51.454 37 HD1 HIS 6 HD1 HIS 6 -14.619 10.816 53.882 38 HD2 HIS 6 HD2 HIS 6 -11.328 8.982 52.126 39 HE1 HIS 6 HE1 HIS 6 -12.714 11.178 55.476 40 HE2 HIS 6 HE2 HIS 6 -10.766 9.961 54.452 41 H HIS 7 H HIS 7 -14.206 6.555 49.622 42 HA HIS 7 HA HIS 7 -11.686 5.579 50.614 43 HB2 HIS 7 HB2 HIS 7 -12.247 3.204 50.663 44 HB3 HIS 7 HB3 HIS 7 -13.258 4.078 51.807 45 HD1 HIS 7 HD1 HIS 7 -15.807 4.419 51.086 46 HD2 HIS 7 HD2 HIS 7 -13.605 1.813 48.714 47 HE1 HIS 7 HE1 HIS 7 -17.493 3.129 49.755 48 HE2 HIS 7 HE2 HIS 7 -16.133 1.684 48.215 49 H HIS 8 H HIS 8 -10.382 4.704 48.922 50 HA HIS 8 HA HIS 8 -11.485 4.214 46.308 51 HB2 HIS 8 HB2 HIS 8 -10.424 6.160 45.187 52 HB3 HIS 8 HB3 HIS 8 -11.703 6.630 46.304 53 HD1 HIS 8 HD1 HIS 8 -8.046 6.944 45.716 54 HD2 HIS 8 HD2 HIS 8 -10.803 7.971 48.647 55 HE1 HIS 8 HE1 HIS 8 -6.856 8.551 47.222 56 HE2 HIS 8 HE2 HIS 8 -8.482 9.019 49.078 57 H HIS 9 H HIS 9 -10.118 3.104 45.010 58 HA HIS 9 HA HIS 9 -7.214 3.223 45.557 59 HB2 HIS 9 HB2 HIS 9 -8.780 0.892 44.407 60 HB3 HIS 9 HB3 HIS 9 -7.035 0.941 44.631 61 HD1 HIS 9 HD1 HIS 9 -9.780 -0.566 46.118 62 HD2 HIS 9 HD2 HIS 9 -6.602 1.628 47.648 63 HE1 HIS 9 HE1 HIS 9 -9.614 -1.222 48.531 64 HE2 HIS 9 HE2 HIS 9 -7.570 -0.032 49.376 65 H HIS 10 H HIS 10 -5.909 2.698 43.495 66 HA HIS 10 HA HIS 10 -7.242 3.457 41.018 67 HB2 HIS 10 HB2 HIS 10 -5.643 5.303 40.553 68 HB3 HIS 10 HB3 HIS 10 -6.682 5.636 41.934 69 HD1 HIS 10 HD1 HIS 10 -5.574 5.817 44.237 70 HD2 HIS 10 HD2 HIS 10 -2.905 4.937 41.171 71 HE1 HIS 10 HE1 HIS 10 -3.289 6.120 45.224 72 HE2 HIS 10 HE2 HIS 10 -1.691 5.492 43.386 73 H SER 11 H SER 11 -6.299 2.618 39.221 74 HA SER 11 HA SER 11 -3.768 1.127 39.573 75 HB2 SER 11 HB2 SER 11 -5.912 0.749 37.455 76 HB3 SER 11 HB3 SER 11 -4.471 -0.247 37.661 77 HG SER 11 HG SER 11 -5.280 -1.023 39.570 78 H SER 12 H SER 12 -2.049 1.440 38.162 79 HA SER 12 HA SER 12 -2.405 3.320 35.927 80 HB2 SER 12 HB2 SER 12 -0.468 4.650 36.551 81 HB3 SER 12 HB3 SER 12 -1.611 4.638 37.895 82 HG SER 12 HG SER 12 0.786 4.205 38.255 83 H GLY 13 H GLY 13 -1.321 2.721 34.120 84 HA2 GLY 13 HA2 GLY 13 1.221 1.694 33.922 85 HA3 GLY 13 HA3 GLY 13 0.203 0.282 34.143 86 H ARG 14 H ARG 14 1.855 1.534 31.858 87 HA ARG 14 HA ARG 14 -0.114 0.831 29.780 88 HB2 ARG 14 HB2 ARG 14 1.890 3.104 29.635 89 HB3 ARG 14 HB3 ARG 14 0.962 2.516 28.262 90 HG2 ARG 14 HG2 ARG 14 -0.206 3.718 30.772 91 HG3 ARG 14 HG3 ARG 14 0.002 4.555 29.232 92 HD2 ARG 14 HD2 ARG 14 -1.544 3.044 28.152 93 HD3 ARG 14 HD3 ARG 14 -1.663 2.063 29.612 94 HE ARG 14 HE ARG 14 -2.438 4.797 30.018 95 HH11 ARG 14 HH11 ARG 14 -3.514 1.717 28.908 96 HH12 ARG 14 HH12 ARG 14 -5.172 2.046 29.269 97 HH21 ARG 14 HH21 ARG 14 -4.581 5.208 30.467 98 HH22 ARG 14 HH22 ARG 14 -5.767 3.986 30.158 99 H GLU 15 H GLU 15 0.586 -0.797 28.508 100 HA GLU 15 HA GLU 15 3.276 -1.810 28.850 101 HB2 GLU 15 HB2 GLU 15 0.940 -2.818 27.216 102 HB3 GLU 15 HB3 GLU 15 2.486 -3.646 27.327 103 HG2 GLU 15 HG2 GLU 15 0.636 -3.062 29.636 104 HG3 GLU 15 HG3 GLU 15 0.807 -4.615 28.819 105 H ASN 16 H ASN 16 4.488 -2.604 26.886 106 HA ASN 16 HA ASN 16 5.473 -0.491 25.430 107 HB2 ASN 16 HB2 ASN 16 5.535 -3.439 24.737 108 HB3 ASN 16 HB3 ASN 16 6.522 -2.212 23.947 109 HD21 ASN 16 HD21 ASN 16 8.411 -3.218 24.627 110 HD22 ASN 16 HD22 ASN 16 8.961 -3.141 26.263 111 H LEU 17 H LEU 17 4.954 0.580 23.634 112 HA LEU 17 HA LEU 17 2.544 -0.148 22.169 113 HB2 LEU 17 HB2 LEU 17 4.310 2.299 22.051 114 HB3 LEU 17 HB3 LEU 17 2.921 2.058 21.015 115 HG LEU 17 HG LEU 17 2.243 3.513 22.756 116 HD11 LEU 17 HD11 LEU 17 1.204 0.758 23.403 117 HD12 LEU 17 HD12 LEU 17 0.593 1.836 22.144 118 HD13 LEU 17 HD13 LEU 17 0.442 2.288 23.843 119 HD21 LEU 17 HD21 LEU 17 2.445 2.995 25.138 120 HD22 LEU 17 HD22 LEU 17 4.025 3.062 24.362 121 HD23 LEU 17 HD23 LEU 17 3.300 1.501 24.749 122 H TYR 18 H TYR 18 2.521 -1.065 20.217 123 HA TYR 18 HA TYR 18 3.170 -2.037 18.279 124 HB2 TYR 18 HB2 TYR 18 4.971 0.393 18.222 125 HB3 TYR 18 HB3 TYR 18 4.724 -0.681 16.850 126 HD1 TYR 18 HD2 TYR 18 2.437 -0.872 15.833 127 HD2 TYR 18 HD1 TYR 18 3.368 2.081 18.759 128 HE1 TYR 18 HE2 TYR 18 0.439 0.398 15.179 129 HE2 TYR 18 HE1 TYR 18 1.370 3.360 18.107 130 HH TYR 18 HH TYR 18 -1.110 2.076 16.277 131 H PHE 19 H PHE 19 5.661 -2.155 16.950 132 HA PHE 19 HA PHE 19 7.213 -3.870 18.792 133 HB2 PHE 19 HB2 PHE 19 6.797 -4.224 15.811 134 HB3 PHE 19 HB3 PHE 19 7.759 -5.274 16.847 135 HD1 PHE 19 HD1 PHE 19 6.587 -6.531 18.710 136 HD2 PHE 19 HD2 PHE 19 4.479 -4.563 15.572 137 HE1 PHE 19 HE1 PHE 19 4.593 -7.879 19.202 138 HE2 PHE 19 HE2 PHE 19 2.483 -5.910 16.068 139 HZ PHE 19 HZ PHE 19 2.539 -7.570 17.883 140 H GLN 20 H GLN 20 9.464 -4.368 17.490 141 HA GLN 20 HA GLN 20 10.742 -1.749 17.196 142 HB2 GLN 20 HB2 GLN 20 11.906 -4.526 17.479 143 HB3 GLN 20 HB3 GLN 20 12.872 -3.073 17.270 144 HG2 GLN 20 HG2 GLN 20 12.879 -3.579 19.564 145 HG3 GLN 20 HG3 GLN 20 11.826 -2.183 19.349 146 HE21 GLN 20 HE21 GLN 20 10.684 -2.571 21.247 147 HE22 GLN 20 HE22 GLN 20 9.590 -3.894 21.416 148 H GLY 21 H GLY 21 12.224 -1.292 15.485 149 HA2 GLY 21 HA2 GLY 21 13.282 -2.684 13.546 150 HA3 GLY 21 HA3 GLY 21 11.623 -2.686 12.978 151 H HIS 22 H HIS 22 12.013 -1.524 11.105 152 HA HIS 22 HA HIS 22 12.314 1.346 11.432 153 HB2 HIS 22 HB2 HIS 22 14.105 1.483 9.672 154 HB3 HIS 22 HB3 HIS 22 14.633 0.775 11.192 155 HD1 HIS 22 HD1 HIS 22 15.220 -1.749 11.186 156 HD2 HIS 22 HD2 HIS 22 14.217 -0.241 7.449 157 HE1 HIS 22 HE1 HIS 22 15.931 -3.504 9.544 158 HE2 HIS 22 HE2 HIS 22 15.525 -2.468 7.291 159 H MET 23 H MET 23 10.673 2.187 10.308 160 HA MET 23 HA MET 23 9.609 0.816 7.972 161 HB2 MET 23 HB2 MET 23 7.822 2.478 8.082 162 HB3 MET 23 HB3 MET 23 8.074 1.732 9.653 163 HG2 MET 23 HG2 MET 23 9.530 3.766 10.188 164 HG3 MET 23 HG3 MET 23 8.807 4.502 8.760 165 HE1 MET 23 HE1 MET 23 5.984 4.187 8.506 166 HE2 MET 23 HE2 MET 23 4.954 3.937 9.914 167 HE3 MET 23 HE3 MET 23 5.985 2.628 9.329 168 H LEU 24 H LEU 24 9.649 1.617 5.872 169 HA LEU 24 HA LEU 24 11.908 3.392 5.359 170 HB2 LEU 24 HB2 LEU 24 10.378 1.427 3.697 171 HB3 LEU 24 HB3 LEU 24 11.423 2.612 2.932 172 HG LEU 24 HG LEU 24 12.411 0.742 5.075 173 HD11 LEU 24 HD11 LEU 24 13.323 -0.652 3.284 174 HD12 LEU 24 HD12 LEU 24 12.523 0.361 2.083 175 HD13 LEU 24 HD13 LEU 24 11.563 -0.597 3.211 176 HD21 LEU 24 HD21 LEU 24 14.603 1.292 4.118 177 HD22 LEU 24 HD22 LEU 24 13.762 2.730 4.697 178 HD23 LEU 24 HD23 LEU 24 13.821 2.379 2.967 179 H GLU 25 H GLU 25 11.801 5.362 4.590 180 HA GLU 25 HA GLU 25 9.254 6.617 4.067 181 HB2 GLU 25 HB2 GLU 25 12.097 7.586 4.088 182 HB3 GLU 25 HB3 GLU 25 10.809 8.604 3.446 183 HG2 GLU 25 HG2 GLU 25 9.706 8.712 5.500 184 HG3 GLU 25 HG3 GLU 25 10.609 7.351 6.152 185 H VAL 26 H VAL 26 8.252 6.678 2.254 186 HA VAL 26 HA VAL 26 9.687 6.380 -0.307 187 HB VAL 26 HB VAL 26 8.102 4.659 -1.088 188 HG11 VAL 26 HG11 VAL 26 10.240 3.918 -0.178 189 HG12 VAL 26 HG12 VAL 26 8.968 2.755 0.200 190 HG13 VAL 26 HG13 VAL 26 9.551 3.862 1.445 191 HG21 VAL 26 HG21 VAL 26 7.089 4.660 1.764 192 HG22 VAL 26 HG22 VAL 26 6.642 3.491 0.521 193 HG23 VAL 26 HG23 VAL 26 6.198 5.187 0.333 194 H GLU 27 H GLU 27 8.327 6.862 -2.216 195 HA GLU 27 HA GLU 27 6.121 8.705 -1.582 196 HB2 GLU 27 HB2 GLU 27 7.904 9.488 -3.135 197 HB3 GLU 27 HB3 GLU 27 7.457 8.208 -4.258 198 HG2 GLU 27 HG2 GLU 27 5.233 9.177 -4.506 199 HG3 GLU 27 HG3 GLU 27 5.640 10.438 -3.344 200 H VAL 28 H VAL 28 4.076 8.072 -1.765 201 HA VAL 28 HA VAL 28 3.486 5.430 -2.892 202 HB VAL 28 HB VAL 28 1.709 7.204 -1.198 203 HG11 VAL 28 HG11 VAL 28 1.511 4.269 -1.890 204 HG12 VAL 28 HG12 VAL 28 0.468 5.558 -2.489 205 HG13 VAL 28 HG13 VAL 28 0.449 5.134 -0.779 206 HG21 VAL 28 HG21 VAL 28 3.724 6.642 0.047 207 HG22 VAL 28 HG22 VAL 28 3.511 4.933 -0.338 208 HG23 VAL 28 HG23 VAL 28 2.341 5.758 0.693 209 H ILE 29 H ILE 29 2.838 5.435 -4.983 210 HA ILE 29 HA ILE 29 1.424 7.780 -6.040 211 HB ILE 29 HB ILE 29 2.192 5.448 -7.760 212 HG12 ILE 29 HG12 ILE 29 4.107 7.625 -6.863 213 HG13 ILE 29 HG13 ILE 29 4.180 5.943 -6.349 214 HG21 ILE 29 HG21 ILE 29 2.065 8.439 -8.169 215 HG22 ILE 29 HG22 ILE 29 0.912 7.242 -8.761 216 HG23 ILE 29 HG23 ILE 29 2.555 7.275 -9.403 217 HD11 ILE 29 HD11 ILE 29 5.797 6.366 -8.072 218 HD12 ILE 29 HD12 ILE 29 4.540 6.970 -9.151 219 HD13 ILE 29 HD13 ILE 29 4.554 5.271 -8.674 220 H SER 30 H SER 30 -0.451 7.500 -7.453 221 HA SER 30 HA SER 30 -1.965 5.005 -7.027 222 HB2 SER 30 HB2 SER 30 -3.057 7.824 -6.892 223 HB3 SER 30 HB3 SER 30 -4.067 6.379 -6.988 224 HG SER 30 HG SER 30 -2.247 6.051 -5.057 225 H GLY 31 H GLY 31 -1.580 4.124 -9.005 226 HA2 GLY 31 HA2 GLY 31 -1.834 5.699 -11.431 227 HA3 GLY 31 HA3 GLY 31 -1.418 3.997 -11.329 228 H ARG 32 H ARG 32 -3.640 5.974 -12.580 229 HA ARG 32 HA ARG 32 -6.101 4.778 -11.776 230 HB2 ARG 32 HB2 ARG 32 -5.771 7.099 -12.761 231 HB3 ARG 32 HB3 ARG 32 -5.609 6.319 -14.328 232 HG2 ARG 32 HG2 ARG 32 -7.889 5.342 -13.992 233 HG3 ARG 32 HG3 ARG 32 -8.031 6.327 -12.532 234 HD2 ARG 32 HD2 ARG 32 -7.776 7.250 -15.390 235 HD3 ARG 32 HD3 ARG 32 -9.096 7.553 -14.261 236 HE ARG 32 HE ARG 32 -7.364 8.887 -12.970 237 HH11 ARG 32 HH11 ARG 32 -7.295 8.554 -16.411 238 HH12 ARG 32 HH12 ARG 32 -6.361 9.989 -16.629 239 HH21 ARG 32 HH21 ARG 32 -6.177 10.702 -13.272 240 HH22 ARG 32 HH22 ARG 32 -5.758 11.218 -14.870 241 H THR 33 H THR 33 -5.736 2.516 -12.041 242 HA THR 33 HA THR 33 -5.158 1.296 -14.548 243 HB THR 33 HB THR 33 -5.995 -0.797 -13.496 244 HG1 THR 33 HG1 THR 33 -6.859 -0.725 -11.427 245 HG21 THR 33 HG21 THR 33 -4.186 0.865 -11.726 246 HG22 THR 33 HG22 THR 33 -3.678 -0.123 -13.095 247 HG23 THR 33 HG23 THR 33 -4.349 -0.889 -11.656 248 H LEU 34 H LEU 34 -8.212 1.718 -12.758 249 HA LEU 34 HA LEU 34 -9.872 0.849 -14.915 250 HB2 LEU 34 HB2 LEU 34 -10.571 2.493 -12.475 251 HB3 LEU 34 HB3 LEU 34 -11.728 1.731 -13.552 252 HG LEU 34 HG LEU 34 -9.724 0.272 -11.816 253 HD11 LEU 34 HD11 LEU 34 -11.688 -0.463 -10.551 254 HD12 LEU 34 HD12 LEU 34 -12.714 0.573 -11.542 255 HD13 LEU 34 HD13 LEU 34 -11.486 1.288 -10.496 256 HD21 LEU 34 HD21 LEU 34 -11.929 -0.819 -13.571 257 HD22 LEU 34 HD22 LEU 34 -10.888 -1.760 -12.502 258 HD23 LEU 34 HD23 LEU 34 -10.199 -0.933 -13.897 259 H ASN 35 H ASN 35 -10.024 1.947 -16.762 260 HA ASN 35 HA ASN 35 -9.260 4.629 -17.119 261 HB2 ASN 35 HB2 ASN 35 -10.947 2.859 -18.902 262 HB3 ASN 35 HB3 ASN 35 -10.242 4.398 -19.390 263 HD21 ASN 35 HD21 ASN 35 -9.786 1.714 -20.445 264 HD22 ASN 35 HD22 ASN 35 -8.086 1.435 -20.303 265 H GLN 36 H GLN 36 -12.315 3.299 -16.141 266 HA GLN 36 HA GLN 36 -13.821 5.708 -16.763 267 HB2 GLN 36 HB2 GLN 36 -14.563 3.247 -15.165 268 HB3 GLN 36 HB3 GLN 36 -15.668 4.564 -15.536 269 HG2 GLN 36 HG2 GLN 36 -15.428 4.090 -17.927 270 HG3 GLN 36 HG3 GLN 36 -14.323 2.767 -17.549 271 HE21 GLN 36 HE21 GLN 36 -15.670 1.229 -18.487 272 HE22 GLN 36 HE22 GLN 36 -17.144 0.720 -17.741 273 H GLY 37 H GLY 37 -11.917 4.565 -14.116 274 HA2 GLY 37 HA2 GLY 37 -11.496 5.431 -12.021 275 HA3 GLY 37 HA3 GLY 37 -12.371 6.876 -12.510 276 H ALA 38 H ALA 38 -14.494 7.145 -11.884 277 HA ALA 38 HA ALA 38 -16.427 6.873 -10.708 278 HB1 ALA 38 HB1 ALA 38 -17.473 4.682 -10.683 279 HB2 ALA 38 HB2 ALA 38 -15.935 3.910 -11.082 280 HB3 ALA 38 HB3 ALA 38 -16.723 4.970 -12.254 281 H THR 39 H THR 39 -17.374 5.364 -8.734 282 HA THR 39 HA THR 39 -15.278 5.282 -6.666 283 HB THR 39 HB THR 39 -16.978 5.242 -4.999 284 HG1 THR 39 HG1 THR 39 -19.020 5.029 -6.964 285 HG21 THR 39 HG21 THR 39 -17.895 7.092 -7.210 286 HG22 THR 39 HG22 THR 39 -16.681 7.451 -5.982 287 HG23 THR 39 HG23 THR 39 -18.365 7.219 -5.513 288 H VAL 40 H VAL 40 -16.080 3.354 -4.957 289 HA VAL 40 HA VAL 40 -15.195 1.013 -6.317 290 HB VAL 40 HB VAL 40 -16.357 1.177 -3.534 291 HG11 VAL 40 HG11 VAL 40 -16.228 -1.094 -4.357 292 HG12 VAL 40 HG12 VAL 40 -14.990 -0.837 -3.130 293 HG13 VAL 40 HG13 VAL 40 -14.546 -0.859 -4.835 294 HG21 VAL 40 HG21 VAL 40 -13.492 1.516 -4.441 295 HG22 VAL 40 HG22 VAL 40 -14.026 1.402 -2.764 296 HG23 VAL 40 HG23 VAL 40 -14.530 2.769 -3.758 297 H GLU 41 H GLU 41 -18.366 2.119 -5.218 298 HA GLU 41 HA GLU 41 -19.602 -0.442 -5.471 299 HB2 GLU 41 HB2 GLU 41 -20.854 2.298 -5.239 300 HB3 GLU 41 HB3 GLU 41 -21.729 0.775 -5.117 301 HG2 GLU 41 HG2 GLU 41 -20.270 0.164 -3.186 302 HG3 GLU 41 HG3 GLU 41 -19.574 1.781 -3.263 303 H GLU 42 H GLU 42 -18.948 2.049 -7.809 304 HA GLU 42 HA GLU 42 -20.811 1.128 -9.773 305 HB2 GLU 42 HB2 GLU 42 -18.268 2.727 -9.956 306 HB3 GLU 42 HB3 GLU 42 -19.083 2.170 -11.407 307 HG2 GLU 42 HG2 GLU 42 -19.816 4.368 -11.077 308 HG3 GLU 42 HG3 GLU 42 -21.150 3.344 -10.558 309 H LYS 43 H LYS 43 -17.334 0.465 -9.280 310 HA LYS 43 HA LYS 43 -17.609 -2.004 -10.855 311 HB2 LYS 43 HB2 LYS 43 -15.213 -0.422 -9.967 312 HB3 LYS 43 HB3 LYS 43 -15.049 -2.092 -10.467 313 HG2 LYS 43 HG2 LYS 43 -14.588 -1.146 -12.453 314 HG3 LYS 43 HG3 LYS 43 -16.341 -1.139 -12.612 315 HD2 LYS 43 HD2 LYS 43 -15.149 1.224 -11.280 316 HD3 LYS 43 HD3 LYS 43 -14.777 1.033 -12.994 317 HE2 LYS 43 HE2 LYS 43 -17.531 1.079 -11.779 318 HE3 LYS 43 HE3 LYS 43 -16.763 2.413 -12.638 319 HZ1 LYS 43 HZ1 LYS 43 -16.628 0.920 -14.611 320 HZ2 LYS 43 HZ2 LYS 43 -18.211 1.291 -14.145 321 HZ3 LYS 43 HZ3 LYS 43 -17.558 -0.218 -13.772 322 H LEU 44 H LEU 44 -18.970 -2.466 -8.631 323 HA LEU 44 HA LEU 44 -17.350 -3.100 -6.343 324 HB2 LEU 44 HB2 LEU 44 -19.761 -2.357 -6.297 325 HB3 LEU 44 HB3 LEU 44 -20.199 -3.961 -6.857 326 HG LEU 44 HG LEU 44 -19.199 -4.929 -4.800 327 HD11 LEU 44 HD11 LEU 44 -17.544 -3.228 -4.309 328 HD12 LEU 44 HD12 LEU 44 -18.618 -3.446 -2.929 329 HD13 LEU 44 HD13 LEU 44 -18.815 -2.048 -3.987 330 HD21 LEU 44 HD21 LEU 44 -21.279 -2.805 -4.269 331 HD22 LEU 44 HD22 LEU 44 -20.951 -4.219 -3.265 332 HD23 LEU 44 HD23 LEU 44 -21.594 -4.423 -4.894 333 H THR 45 H THR 45 -16.688 -4.530 -8.837 334 HA THR 45 HA THR 45 -17.412 -7.308 -8.411 335 HB THR 45 HB THR 45 -17.309 -6.628 -10.700 336 HG1 THR 45 HG1 THR 45 -15.809 -8.122 -11.501 337 HG21 THR 45 HG21 THR 45 -15.866 -4.670 -10.472 338 HG22 THR 45 HG22 THR 45 -15.266 -5.739 -11.742 339 HG23 THR 45 HG23 THR 45 -14.476 -5.717 -10.165 340 H GLU 46 H GLU 46 -15.805 -9.010 -8.244 341 HA GLU 46 HA GLU 46 -13.776 -8.660 -6.341 342 HB2 GLU 46 HB2 GLU 46 -14.737 -10.844 -6.801 343 HB3 GLU 46 HB3 GLU 46 -14.132 -10.802 -8.451 344 HG2 GLU 46 HG2 GLU 46 -11.840 -10.907 -7.634 345 HG3 GLU 46 HG3 GLU 46 -12.424 -10.894 -5.969 346 H GLU 47 H GLU 47 -13.758 -8.323 -9.815 347 HA GLU 47 HA GLU 47 -11.032 -8.296 -10.393 348 HB2 GLU 47 HB2 GLU 47 -13.133 -6.472 -11.600 349 HB3 GLU 47 HB3 GLU 47 -11.614 -6.961 -12.342 350 HG2 GLU 47 HG2 GLU 47 -12.370 -9.213 -12.592 351 HG3 GLU 47 HG3 GLU 47 -13.799 -8.905 -11.609 352 H TYR 48 H TYR 48 -13.093 -5.789 -9.025 353 HA TYR 48 HA TYR 48 -11.251 -3.637 -9.046 354 HB2 TYR 48 HB2 TYR 48 -13.791 -3.609 -8.648 355 HB3 TYR 48 HB3 TYR 48 -13.429 -4.073 -6.994 356 HD1 TYR 48 HD1 TYR 48 -11.890 -2.466 -5.634 357 HD2 TYR 48 HD2 TYR 48 -13.820 -1.368 -9.263 358 HE1 TYR 48 HE1 TYR 48 -11.649 -0.096 -5.051 359 HE2 TYR 48 HE2 TYR 48 -13.589 1.000 -8.695 360 HH TYR 48 HH TYR 48 -13.227 2.419 -6.807 361 H PHE 49 H PHE 49 -12.024 -6.125 -6.655 362 HA PHE 49 HA PHE 49 -10.434 -5.248 -4.526 363 HB2 PHE 49 HB2 PHE 49 -12.140 -6.973 -4.252 364 HB3 PHE 49 HB3 PHE 49 -11.272 -8.049 -5.338 365 HD1 PHE 49 HD1 PHE 49 -11.317 -6.560 -1.970 366 HD2 PHE 49 HD2 PHE 49 -9.388 -9.336 -4.565 367 HE1 PHE 49 HE1 PHE 49 -10.145 -7.546 -0.043 368 HE2 PHE 49 HE2 PHE 49 -8.220 -10.325 -2.640 369 HZ PHE 49 HZ PHE 49 -8.598 -9.432 -0.378 370 H ASN 50 H ASN 50 -9.692 -7.852 -6.857 371 HA ASN 50 HA ASN 50 -7.030 -8.215 -6.076 372 HB2 ASN 50 HB2 ASN 50 -8.469 -8.856 -8.651 373 HB3 ASN 50 HB3 ASN 50 -6.795 -9.326 -8.359 374 HD21 ASN 50 HD21 ASN 50 -9.278 -10.907 -8.720 375 HD22 ASN 50 HD22 ASN 50 -9.339 -11.949 -7.344 376 H ALA 51 H ALA 51 -8.411 -5.780 -8.114 377 HA ALA 51 HA ALA 51 -6.018 -5.160 -9.573 378 HB1 ALA 51 HB1 ALA 51 -8.239 -4.718 -10.499 379 HB2 ALA 51 HB2 ALA 51 -7.263 -3.251 -10.426 380 HB3 ALA 51 HB3 ALA 51 -8.531 -3.527 -9.232 381 H VAL 52 H VAL 52 -7.431 -3.982 -6.549 382 HA VAL 52 HA VAL 52 -5.269 -1.956 -6.388 383 HB VAL 52 HB VAL 52 -6.768 -0.470 -5.160 384 HG11 VAL 52 HG11 VAL 52 -6.641 -0.207 -7.572 385 HG12 VAL 52 HG12 VAL 52 -8.276 0.148 -7.011 386 HG13 VAL 52 HG13 VAL 52 -7.927 -1.394 -7.797 387 HG21 VAL 52 HG21 VAL 52 -8.889 -2.569 -5.658 388 HG22 VAL 52 HG22 VAL 52 -9.182 -0.959 -5.000 389 HG23 VAL 52 HG23 VAL 52 -8.210 -2.118 -4.093 390 H ASN 53 H ASN 53 -5.753 -4.797 -5.129 391 HA ASN 53 HA ASN 53 -5.584 -4.077 -2.285 392 HB2 ASN 53 HB2 ASN 53 -6.402 -6.479 -3.789 393 HB3 ASN 53 HB3 ASN 53 -5.475 -6.816 -2.331 394 HD21 ASN 53 HD21 ASN 53 -8.258 -4.992 -3.511 395 HD22 ASN 53 HD22 ASN 53 -9.154 -5.087 -2.036 396 H TYR 54 H TYR 54 -3.293 -3.763 -4.300 397 HA TYR 54 HA TYR 54 -1.270 -5.041 -2.621 398 HB2 TYR 54 HB2 TYR 54 -0.081 -6.032 -4.507 399 HB3 TYR 54 HB3 TYR 54 -1.719 -6.668 -4.419 400 HD1 TYR 54 HD2 TYR 54 -3.452 -5.794 -6.022 401 HD2 TYR 54 HD1 TYR 54 0.687 -4.915 -6.460 402 HE1 TYR 54 HE2 TYR 54 -3.842 -5.143 -8.357 403 HE2 TYR 54 HE1 TYR 54 0.307 -4.259 -8.800 404 HH TYR 54 HH TYR 54 -2.794 -3.723 -10.073 405 H ALA 55 H ALA 55 0.879 -4.230 -2.927 406 HA ALA 55 HA ALA 55 1.059 -1.666 -4.388 407 HB1 ALA 55 HB1 ALA 55 2.564 -0.842 -2.635 408 HB2 ALA 55 HB2 ALA 55 2.340 -2.342 -1.734 409 HB3 ALA 55 HB3 ALA 55 0.977 -1.250 -1.981 410 H GLU 56 H GLU 56 2.924 -1.331 -5.588 411 HA GLU 56 HA GLU 56 4.700 -3.651 -5.886 412 HB2 GLU 56 HB2 GLU 56 4.372 -1.206 -7.648 413 HB3 GLU 56 HB3 GLU 56 5.432 -2.567 -7.989 414 HG2 GLU 56 HG2 GLU 56 3.358 -4.026 -7.947 415 HG3 GLU 56 HG3 GLU 56 2.423 -2.531 -7.935 416 H ILE 57 H ILE 57 6.489 -3.634 -4.689 417 HA ILE 57 HA ILE 57 7.843 -1.066 -4.116 418 HB ILE 57 HB ILE 57 8.153 -3.670 -2.588 419 HG12 ILE 57 HG12 ILE 57 6.884 -2.253 -0.772 420 HG13 ILE 57 HG13 ILE 57 6.275 -1.353 -2.155 421 HG21 ILE 57 HG21 ILE 57 10.076 -2.190 -2.420 422 HG22 ILE 57 HG22 ILE 57 9.221 -2.275 -0.881 423 HG23 ILE 57 HG23 ILE 57 9.030 -0.861 -1.918 424 HD11 ILE 57 HD11 ILE 57 4.711 -3.068 -1.461 425 HD12 ILE 57 HD12 ILE 57 5.947 -4.308 -1.681 426 HD13 ILE 57 HD13 ILE 57 5.335 -3.412 -3.073 427 H ASN 58 H ASN 58 10.125 -0.923 -4.356 428 HA ASN 58 HA ASN 58 11.342 -2.637 -6.317 429 HB2 ASN 58 HB2 ASN 58 11.856 -0.208 -6.119 430 HB3 ASN 58 HB3 ASN 58 12.626 -0.514 -4.567 431 HD21 ASN 58 HD21 ASN 58 13.606 0.490 -7.221 432 HD22 ASN 58 HD22 ASN 58 14.988 -0.483 -7.566 433 H GLU 59 H GLU 59 13.027 -4.139 -6.025 434 HA GLU 59 HA GLU 59 12.854 -5.795 -3.801 435 HB2 GLU 59 HB2 GLU 59 13.720 -6.565 -5.957 436 HB3 GLU 59 HB3 GLU 59 15.172 -5.592 -5.737 437 HG2 GLU 59 HG2 GLU 59 15.937 -6.926 -3.967 438 HG3 GLU 59 HG3 GLU 59 14.365 -7.680 -3.747 439 H GLU 60 H GLU 60 15.041 -3.099 -4.350 440 HA GLU 60 HA GLU 60 16.868 -3.450 -2.287 441 HB2 GLU 60 HB2 GLU 60 15.688 -1.016 -3.593 442 HB3 GLU 60 HB3 GLU 60 16.806 -0.840 -2.249 443 HG2 GLU 60 HG2 GLU 60 17.454 -2.402 -4.739 444 HG3 GLU 60 HG3 GLU 60 17.814 -0.688 -4.545 445 H ASP 61 H ASP 61 13.852 -1.509 -2.098 446 HA ASP 61 HA ASP 61 13.932 -1.204 0.726 447 HB2 ASP 61 HB2 ASP 61 11.518 -1.070 -1.108 448 HB3 ASP 61 HB3 ASP 61 11.654 -0.356 0.498 449 H TRP 62 H TRP 62 12.487 -3.554 -1.417 450 HA TRP 62 HA TRP 62 10.843 -5.038 0.229 451 HB2 TRP 62 HB2 TRP 62 11.163 -5.313 -2.226 452 HB3 TRP 62 HB3 TRP 62 12.720 -6.061 -1.918 453 HD1 TRP 62 HD1 TRP 62 12.681 -8.569 -0.873 454 HE1 TRP 62 HE1 TRP 62 10.885 -10.401 -1.013 455 HE3 TRP 62 HE3 TRP 62 8.699 -5.687 -2.262 456 HZ2 TRP 62 HZ2 TRP 62 8.140 -10.595 -1.640 457 HZ3 TRP 62 HZ3 TRP 62 6.522 -6.773 -2.612 458 HH2 TRP 62 HH2 TRP 62 6.251 -9.180 -2.307 459 H ASN 63 H ASN 63 14.336 -5.535 -0.331 460 HA ASN 63 HA ASN 63 14.634 -7.636 1.563 461 HB2 ASN 63 HB2 ASN 63 16.701 -5.768 0.378 462 HB3 ASN 63 HB3 ASN 63 17.064 -7.235 1.280 463 HD21 ASN 63 HD21 ASN 63 17.664 -6.454 -1.479 464 HD22 ASN 63 HD22 ASN 63 17.033 -7.721 -2.463 465 H ALA 64 H ALA 64 15.096 -4.133 1.735 466 HA ALA 64 HA ALA 64 16.377 -3.910 4.196 467 HB1 ALA 64 HB1 ALA 64 16.027 -2.061 2.590 468 HB2 ALA 64 HB2 ALA 64 15.600 -1.625 4.245 469 HB3 ALA 64 HB3 ALA 64 14.332 -1.995 3.075 470 H LEU 65 H LEU 65 12.948 -4.343 3.508 471 HA LEU 65 HA LEU 65 12.240 -4.198 6.341 472 HB2 LEU 65 HB2 LEU 65 10.556 -4.709 3.881 473 HB3 LEU 65 HB3 LEU 65 9.922 -4.574 5.511 474 HG LEU 65 HG LEU 65 11.369 -2.367 4.034 475 HD11 LEU 65 HD11 LEU 65 8.421 -2.671 4.588 476 HD12 LEU 65 HD12 LEU 65 9.201 -2.875 3.020 477 HD13 LEU 65 HD13 LEU 65 9.207 -1.298 3.808 478 HD21 LEU 65 HD21 LEU 65 10.575 -0.930 5.854 479 HD22 LEU 65 HD22 LEU 65 11.642 -2.201 6.448 480 HD23 LEU 65 HD23 LEU 65 9.897 -2.339 6.671 481 H GLY 66 H GLY 66 13.145 -6.595 4.066 482 HA2 GLY 66 HA2 GLY 66 13.398 -8.883 4.326 483 HA3 GLY 66 HA3 GLY 66 12.758 -8.733 5.956 484 H LEU 67 H LEU 67 11.357 -7.966 2.777 485 HA LEU 67 HA LEU 67 8.831 -9.146 3.573 486 HB2 LEU 67 HB2 LEU 67 9.710 -7.734 1.054 487 HB3 LEU 67 HB3 LEU 67 8.074 -8.303 1.337 488 HG LEU 67 HG LEU 67 9.476 -6.272 3.085 489 HD11 LEU 67 HD11 LEU 67 9.163 -5.358 0.847 490 HD12 LEU 67 HD12 LEU 67 8.050 -4.604 1.987 491 HD13 LEU 67 HD13 LEU 67 7.466 -5.838 0.869 492 HD21 LEU 67 HD21 LEU 67 6.590 -7.143 2.921 493 HD22 LEU 67 HD22 LEU 67 7.226 -5.859 3.951 494 HD23 LEU 67 HD23 LEU 67 7.724 -7.529 4.217 495 H GLN 68 H GLN 68 7.875 -10.964 2.772 496 HA GLN 68 HA GLN 68 9.383 -12.605 0.852 497 HB2 GLN 68 HB2 GLN 68 7.154 -13.227 2.787 498 HB3 GLN 68 HB3 GLN 68 7.579 -14.336 1.490 499 HG2 GLN 68 HG2 GLN 68 9.865 -14.475 2.374 500 HG3 GLN 68 HG3 GLN 68 9.424 -13.370 3.669 501 HE21 GLN 68 HE21 GLN 68 10.427 -16.092 3.819 502 HE22 GLN 68 HE22 GLN 68 9.246 -16.988 4.707 503 H GLU 69 H GLU 69 8.233 -13.611 -0.936 504 HA GLU 69 HA GLU 69 6.607 -11.681 -2.292 505 HB2 GLU 69 HB2 GLU 69 7.445 -14.475 -3.081 506 HB3 GLU 69 HB3 GLU 69 6.563 -13.370 -4.135 507 HG2 GLU 69 HG2 GLU 69 8.400 -11.735 -3.894 508 HG3 GLU 69 HG3 GLU 69 9.297 -12.923 -2.952 509 H GLY 70 H GLY 70 4.700 -11.370 -1.376 510 HA2 GLY 70 HA2 GLY 70 2.340 -12.202 -1.505 511 HA3 GLY 70 HA3 GLY 70 2.952 -13.704 -0.827 512 H ASP 71 H ASP 71 4.744 -11.464 0.677 513 HA ASP 71 HA ASP 71 3.476 -11.626 3.181 514 HB2 ASP 71 HB2 ASP 71 5.951 -10.852 2.280 515 HB3 ASP 71 HB3 ASP 71 5.271 -9.309 2.779 516 H ARG 72 H ARG 72 3.067 -9.502 4.510 517 HA ARG 72 HA ARG 72 1.135 -7.856 2.986 518 HB2 ARG 72 HB2 ARG 72 1.075 -8.515 5.941 519 HB3 ARG 72 HB3 ARG 72 -0.167 -7.666 5.027 520 HG2 ARG 72 HG2 ARG 72 -0.699 -9.655 3.784 521 HG3 ARG 72 HG3 ARG 72 0.657 -10.522 4.510 522 HD2 ARG 72 HD2 ARG 72 -1.827 -9.523 5.896 523 HD3 ARG 72 HD3 ARG 72 -1.370 -11.201 5.614 524 HE ARG 72 HE ARG 72 -0.531 -9.545 7.762 525 HH11 ARG 72 HH11 ARG 72 0.563 -12.087 5.708 526 HH12 ARG 72 HH12 ARG 72 1.725 -12.661 6.850 527 HH21 ARG 72 HH21 ARG 72 0.939 -10.313 9.232 528 HH22 ARG 72 HH22 ARG 72 1.942 -11.657 8.819 529 H VAL 73 H VAL 73 1.553 -5.733 2.853 530 HA VAL 73 HA VAL 73 3.484 -4.558 4.756 531 HB VAL 73 HB VAL 73 3.993 -2.875 2.978 532 HG11 VAL 73 HG11 VAL 73 5.478 -4.758 3.371 533 HG12 VAL 73 HG12 VAL 73 5.422 -4.366 1.652 534 HG13 VAL 73 HG13 VAL 73 4.533 -5.759 2.270 535 HG21 VAL 73 HG21 VAL 73 1.963 -3.080 1.639 536 HG22 VAL 73 HG22 VAL 73 2.382 -4.741 1.218 537 HG23 VAL 73 HG23 VAL 73 3.383 -3.404 0.646 538 H LYS 74 H LYS 74 3.034 -2.666 5.750 539 HA LYS 74 HA LYS 74 0.377 -1.495 5.342 540 HB2 LYS 74 HB2 LYS 74 1.075 -2.129 7.656 541 HB3 LYS 74 HB3 LYS 74 2.373 -0.949 7.551 542 HG2 LYS 74 HG2 LYS 74 0.639 0.819 7.195 543 HG3 LYS 74 HG3 LYS 74 -0.592 -0.405 7.517 544 HD2 LYS 74 HD2 LYS 74 1.574 0.529 9.402 545 HD3 LYS 74 HD3 LYS 74 -0.150 0.872 9.530 546 HE2 LYS 74 HE2 LYS 74 -0.577 -1.543 9.830 547 HE3 LYS 74 HE3 LYS 74 1.163 -1.839 9.764 548 HZ1 LYS 74 HZ1 LYS 74 0.388 -1.728 12.035 549 HZ2 LYS 74 HZ2 LYS 74 -0.246 -0.184 11.785 550 HZ3 LYS 74 HZ3 LYS 74 1.428 -0.430 11.718 551 H VAL 75 H VAL 75 0.131 0.740 4.997 552 HA VAL 75 HA VAL 75 2.506 2.186 4.020 553 HB VAL 75 HB VAL 75 -0.198 2.110 2.639 554 HG11 VAL 75 HG11 VAL 75 0.914 3.437 0.877 555 HG12 VAL 75 HG12 VAL 75 2.355 3.542 1.890 556 HG13 VAL 75 HG13 VAL 75 0.848 4.287 2.422 557 HG21 VAL 75 HG21 VAL 75 0.968 0.966 0.802 558 HG22 VAL 75 HG22 VAL 75 1.038 0.026 2.292 559 HG23 VAL 75 HG23 VAL 75 2.450 0.938 1.759 560 H LYS 76 H LYS 76 2.654 4.200 4.892 561 HA LYS 76 HA LYS 76 0.252 5.303 6.203 562 HB2 LYS 76 HB2 LYS 76 2.965 5.079 7.517 563 HB3 LYS 76 HB3 LYS 76 1.491 5.714 8.242 564 HG2 LYS 76 HG2 LYS 76 0.451 3.508 8.064 565 HG3 LYS 76 HG3 LYS 76 1.926 2.871 7.339 566 HD2 LYS 76 HD2 LYS 76 2.010 2.242 9.593 567 HD3 LYS 76 HD3 LYS 76 3.114 3.610 9.452 568 HE2 LYS 76 HE2 LYS 76 0.255 3.829 10.402 569 HE3 LYS 76 HE3 LYS 76 1.634 3.650 11.480 570 HZ1 LYS 76 HZ1 LYS 76 1.185 5.909 9.601 571 HZ2 LYS 76 HZ2 LYS 76 2.520 5.737 10.621 572 HZ3 LYS 76 HZ3 LYS 76 0.979 5.958 11.276 573 H THR 77 H THR 77 -0.030 7.391 5.939 574 HA THR 77 HA THR 77 2.259 9.157 5.339 575 HB THR 77 HB THR 77 1.112 10.300 3.564 576 HG1 THR 77 HG1 THR 77 -1.030 9.562 2.938 577 HG21 THR 77 HG21 THR 77 2.244 8.257 2.819 578 HG22 THR 77 HG22 THR 77 0.789 8.541 1.862 579 HG23 THR 77 HG23 THR 77 0.784 7.320 3.135 580 H GLU 78 H GLU 78 1.080 11.528 5.106 581 HA GLU 78 HA GLU 78 0.168 12.236 7.689 582 HB2 GLU 78 HB2 GLU 78 -0.210 14.465 6.684 583 HB3 GLU 78 HB3 GLU 78 1.372 13.808 6.286 584 HG2 GLU 78 HG2 GLU 78 0.407 13.059 4.093 585 HG3 GLU 78 HG3 GLU 78 -1.053 13.958 4.501 586 H PHE 79 H PHE 79 -1.510 10.919 5.024 587 HA PHE 79 HA PHE 79 -4.090 12.082 5.731 588 HB2 PHE 79 HB2 PHE 79 -3.320 10.072 3.598 589 HB3 PHE 79 HB3 PHE 79 -4.944 10.714 3.823 590 HD1 PHE 79 HD1 PHE 79 -1.537 11.473 2.704 591 HD2 PHE 79 HD2 PHE 79 -5.488 12.987 3.188 592 HE1 PHE 79 HE1 PHE 79 -0.980 13.384 1.261 593 HE2 PHE 79 HE2 PHE 79 -4.934 14.901 1.745 594 HZ PHE 79 HZ PHE 79 -2.677 15.101 0.781 595 H GLY 80 H GLY 80 -2.459 8.935 5.928 596 HA2 GLY 80 HA2 GLY 80 -3.653 8.031 8.228 597 HA3 GLY 80 HA3 GLY 80 -4.749 7.529 6.949 598 H GLU 81 H GLU 81 -4.240 5.343 7.703 599 HA GLU 81 HA GLU 81 -1.827 4.320 6.360 600 HB2 GLU 81 HB2 GLU 81 -1.475 2.692 8.179 601 HB3 GLU 81 HB3 GLU 81 -1.287 4.351 8.721 602 HG2 GLU 81 HG2 GLU 81 -3.843 2.809 9.102 603 HG3 GLU 81 HG3 GLU 81 -2.519 2.753 10.264 604 H VAL 82 H VAL 82 -1.955 2.236 5.494 605 HA VAL 82 HA VAL 82 -4.466 0.744 5.704 606 HB VAL 82 HB VAL 82 -4.738 2.308 3.780 607 HG11 VAL 82 HG11 VAL 82 -3.460 1.928 1.715 608 HG12 VAL 82 HG12 VAL 82 -2.440 0.771 2.569 609 HG13 VAL 82 HG13 VAL 82 -2.432 2.470 3.043 610 HG21 VAL 82 HG21 VAL 82 -5.503 0.629 2.148 611 HG22 VAL 82 HG22 VAL 82 -5.988 0.225 3.796 612 HG23 VAL 82 HG23 VAL 82 -4.634 -0.622 3.042 613 H VAL 83 H VAL 83 -4.242 -1.494 5.220 614 HA VAL 83 HA VAL 83 -1.452 -2.422 4.876 615 HB VAL 83 HB VAL 83 -3.742 -3.966 6.128 616 HG11 VAL 83 HG11 VAL 83 -2.015 -5.416 5.232 617 HG12 VAL 83 HG12 VAL 83 -1.951 -5.430 6.996 618 HG13 VAL 83 HG13 VAL 83 -0.765 -4.500 6.078 619 HG21 VAL 83 HG21 VAL 83 -2.678 -3.502 8.301 620 HG22 VAL 83 HG22 VAL 83 -3.241 -2.027 7.513 621 HG23 VAL 83 HG23 VAL 83 -1.524 -2.432 7.500 622 H VAL 84 H VAL 84 -0.997 -3.356 2.965 623 HA VAL 84 HA VAL 84 -3.147 -4.702 1.440 624 HB VAL 84 HB VAL 84 -2.243 -3.778 -0.656 625 HG11 VAL 84 HG11 VAL 84 -4.092 -2.600 0.433 626 HG12 VAL 84 HG12 VAL 84 -3.033 -1.469 -0.408 627 HG13 VAL 84 HG13 VAL 84 -2.942 -1.622 1.347 628 HG21 VAL 84 HG21 VAL 84 -0.412 -2.173 1.140 629 HG22 VAL 84 HG22 VAL 84 -0.603 -1.933 -0.598 630 HG23 VAL 84 HG23 VAL 84 0.072 -3.443 0.014 631 H PHE 85 H PHE 85 -2.125 -5.979 -0.500 632 HA PHE 85 HA PHE 85 -0.173 -7.810 0.561 633 HB2 PHE 85 HB2 PHE 85 -1.472 -7.606 -2.167 634 HB3 PHE 85 HB3 PHE 85 -0.333 -8.873 -1.732 635 HD1 PHE 85 HD1 PHE 85 -0.922 -10.379 0.245 636 HD2 PHE 85 HD2 PHE 85 -3.753 -7.847 -1.686 637 HE1 PHE 85 HE1 PHE 85 -2.758 -11.746 1.149 638 HE2 PHE 85 HE2 PHE 85 -5.592 -9.208 -0.783 639 HZ PHE 85 HZ PHE 85 -5.097 -11.162 0.636 640 H ALA 86 H ALA 86 1.951 -8.153 -0.078 641 HA ALA 86 HA ALA 86 3.269 -5.836 -1.296 642 HB1 ALA 86 HB1 ALA 86 4.049 -6.709 0.888 643 HB2 ALA 86 HB2 ALA 86 5.309 -6.694 -0.346 644 HB3 ALA 86 HB3 ALA 86 4.518 -8.211 0.088 645 H LYS 87 H LYS 87 3.835 -5.845 -3.386 646 HA LYS 87 HA LYS 87 4.773 -8.374 -4.590 647 HB2 LYS 87 HB2 LYS 87 3.162 -6.242 -6.026 648 HB3 LYS 87 HB3 LYS 87 3.827 -7.695 -6.756 649 HG2 LYS 87 HG2 LYS 87 2.391 -9.010 -5.155 650 HG3 LYS 87 HG3 LYS 87 1.605 -7.480 -4.748 651 HD2 LYS 87 HD2 LYS 87 1.099 -7.184 -7.185 652 HD3 LYS 87 HD3 LYS 87 1.726 -8.813 -7.457 653 HE2 LYS 87 HE2 LYS 87 0.049 -9.631 -5.790 654 HE3 LYS 87 HE3 LYS 87 -0.638 -8.016 -5.777 655 HZ1 LYS 87 HZ1 LYS 87 -0.469 -9.833 -8.117 656 HZ2 LYS 87 HZ2 LYS 87 -1.031 -8.242 -8.179 657 HZ3 LYS 87 HZ3 LYS 87 -1.870 -9.398 -7.273 658 H LYS 88 H LYS 88 6.541 -8.294 -5.858 659 HA LYS 88 HA LYS 88 8.244 -6.007 -5.483 660 HB2 LYS 88 HB2 LYS 88 8.903 -8.496 -5.402 661 HB3 LYS 88 HB3 LYS 88 8.881 -8.431 -7.162 662 HG2 LYS 88 HG2 LYS 88 10.523 -6.615 -7.093 663 HG3 LYS 88 HG3 LYS 88 10.560 -6.742 -5.335 664 HD2 LYS 88 HD2 LYS 88 11.315 -8.945 -7.266 665 HD3 LYS 88 HD3 LYS 88 12.455 -7.916 -6.402 666 HE2 LYS 88 HE2 LYS 88 11.620 -8.776 -4.265 667 HE3 LYS 88 HE3 LYS 88 10.463 -9.794 -5.124 668 HZ1 LYS 88 HZ1 LYS 88 12.235 -11.037 -6.088 669 HZ2 LYS 88 HZ2 LYS 88 12.504 -10.970 -4.423 670 HZ3 LYS 88 HZ3 LYS 88 13.403 -9.985 -5.467 671 H GLY 89 H GLY 89 7.893 -4.269 -6.757 672 HA2 GLY 89 HA2 GLY 89 6.890 -4.687 -9.495 673 HA3 GLY 89 HA3 GLY 89 6.721 -3.218 -8.554 674 H ASP 90 H ASP 90 7.417 -2.208 -10.545 675 HA ASP 90 HA ASP 90 10.310 -2.427 -11.099 676 HB2 ASP 90 HB2 ASP 90 8.117 -1.382 -12.913 677 HB3 ASP 90 HB3 ASP 90 9.796 -1.694 -13.354 678 H VAL 91 H VAL 91 9.188 -0.817 -8.979 679 HA VAL 91 HA VAL 91 9.390 1.953 -9.895 680 HB VAL 91 HB VAL 91 8.786 2.520 -7.541 681 HG11 VAL 91 HG11 VAL 91 6.936 0.543 -8.889 682 HG12 VAL 91 HG12 VAL 91 7.038 2.271 -9.230 683 HG13 VAL 91 HG13 VAL 91 6.470 1.715 -7.655 684 HG21 VAL 91 HG21 VAL 91 8.595 -0.482 -7.201 685 HG22 VAL 91 HG22 VAL 91 8.057 0.722 -6.028 686 HG23 VAL 91 HG23 VAL 91 9.770 0.581 -6.423 687 HA PRO 92 HA PRO 92 13.563 2.529 -8.329 688 HB2 PRO 92 HB2 PRO 92 13.530 5.135 -7.596 689 HB3 PRO 92 HB3 PRO 92 13.500 4.627 -9.290 690 HG2 PRO 92 HG2 PRO 92 11.227 5.488 -7.532 691 HG3 PRO 92 HG3 PRO 92 11.572 5.940 -9.212 692 HD2 PRO 92 HD2 PRO 92 9.746 4.036 -8.541 693 HD3 PRO 92 HD3 PRO 92 10.674 3.988 -10.054 694 H LYS 93 H LYS 93 14.800 3.045 -6.360 695 HA LYS 93 HA LYS 93 13.633 1.928 -4.050 696 HB2 LYS 93 HB2 LYS 93 16.075 1.905 -4.653 697 HB3 LYS 93 HB3 LYS 93 16.159 3.592 -4.165 698 HG2 LYS 93 HG2 LYS 93 15.599 3.022 -1.894 699 HG3 LYS 93 HG3 LYS 93 15.310 1.340 -2.345 700 HD2 LYS 93 HD2 LYS 93 17.741 1.270 -3.096 701 HD3 LYS 93 HD3 LYS 93 17.935 2.826 -2.285 702 HE2 LYS 93 HE2 LYS 93 17.252 1.842 -0.171 703 HE3 LYS 93 HE3 LYS 93 16.941 0.297 -0.965 704 HZ1 LYS 93 HZ1 LYS 93 19.579 1.627 -0.661 705 HZ2 LYS 93 HZ2 LYS 93 19.314 0.199 -1.531 706 HZ3 LYS 93 HZ3 LYS 93 19.052 0.231 0.138 707 H GLY 94 H GLY 94 12.998 2.832 -2.055 708 HA2 GLY 94 HA2 GLY 94 12.011 4.410 -0.693 709 HA3 GLY 94 HA3 GLY 94 12.962 5.630 -1.524 710 H MET 95 H MET 95 10.738 3.537 -3.237 711 HA MET 95 HA MET 95 8.617 5.519 -3.326 712 HB2 MET 95 HB2 MET 95 10.407 6.200 -4.987 713 HB3 MET 95 HB3 MET 95 10.077 4.707 -5.850 714 HG2 MET 95 HG2 MET 95 7.856 5.417 -6.352 715 HG3 MET 95 HG3 MET 95 8.029 6.839 -5.323 716 HE1 MET 95 HE1 MET 95 7.304 8.513 -7.133 717 HE2 MET 95 HE2 MET 95 7.013 7.236 -8.314 718 HE3 MET 95 HE3 MET 95 7.997 8.633 -8.751 719 H ILE 96 H ILE 96 6.632 4.543 -3.781 720 HA ILE 96 HA ILE 96 6.669 1.777 -4.794 721 HB ILE 96 HB ILE 96 5.014 1.050 -3.142 722 HG12 ILE 96 HG12 ILE 96 5.476 3.732 -1.796 723 HG13 ILE 96 HG13 ILE 96 4.012 3.275 -2.662 724 HG21 ILE 96 HG21 ILE 96 7.516 2.189 -1.890 725 HG22 ILE 96 HG22 ILE 96 7.360 0.622 -2.685 726 HG23 ILE 96 HG23 ILE 96 6.496 0.937 -1.181 727 HD11 ILE 96 HD11 ILE 96 3.711 3.082 -0.264 728 HD12 ILE 96 HD12 ILE 96 5.068 1.961 -0.164 729 HD13 ILE 96 HD13 ILE 96 3.604 1.499 -1.032 730 H PHE 97 H PHE 97 4.889 1.119 -5.959 731 HA PHE 97 HA PHE 97 3.050 3.277 -6.781 732 HB2 PHE 97 HB2 PHE 97 4.415 2.386 -8.592 733 HB3 PHE 97 HB3 PHE 97 3.894 0.746 -8.221 734 HD1 PHE 97 HD2 PHE 97 2.940 3.942 -9.729 735 HD2 PHE 97 HD1 PHE 97 1.683 -0.037 -8.863 736 HE1 PHE 97 HE2 PHE 97 1.067 4.192 -11.302 737 HE2 PHE 97 HE1 PHE 97 -0.196 0.212 -10.431 738 HZ PHE 97 HZ PHE 97 -0.505 2.328 -11.654 739 H ILE 98 H ILE 98 0.993 3.151 -6.113 740 HA ILE 98 HA ILE 98 -0.203 0.479 -5.693 741 HB ILE 98 HB ILE 98 -0.870 3.059 -4.245 742 HG12 ILE 98 HG12 ILE 98 0.388 0.473 -3.279 743 HG13 ILE 98 HG13 ILE 98 1.188 2.034 -3.424 744 HG21 ILE 98 HG21 ILE 98 -2.136 0.326 -3.975 745 HG22 ILE 98 HG22 ILE 98 -2.900 1.769 -4.642 746 HG23 ILE 98 HG23 ILE 98 -2.464 1.712 -2.934 747 HD11 ILE 98 HD11 ILE 98 0.673 1.592 -1.125 748 HD12 ILE 98 HD12 ILE 98 -1.026 1.318 -1.515 749 HD13 ILE 98 HD13 ILE 98 -0.327 2.928 -1.696 750 HA PRO 99 HA PRO 99 -2.973 1.689 -9.031 751 HB2 PRO 99 HB2 PRO 99 -4.725 -0.386 -7.811 752 HB3 PRO 99 HB3 PRO 99 -4.152 -0.234 -9.477 753 HG2 PRO 99 HG2 PRO 99 -3.128 -2.085 -7.861 754 HG3 PRO 99 HG3 PRO 99 -2.089 -1.194 -8.992 755 HD2 PRO 99 HD2 PRO 99 -2.456 -0.796 -6.039 756 HD3 PRO 99 HD3 PRO 99 -0.962 -0.768 -7.001 757 H MET 100 H MET 100 -4.635 3.129 -9.163 758 HA MET 100 HA MET 100 -5.478 4.586 -6.940 759 HB2 MET 100 HB2 MET 100 -5.512 5.162 -9.489 760 HB3 MET 100 HB3 MET 100 -7.112 4.444 -9.470 761 HG2 MET 100 HG2 MET 100 -6.167 6.892 -7.998 762 HG3 MET 100 HG3 MET 100 -7.371 6.790 -9.277 763 HE1 MET 100 HE1 MET 100 -6.893 7.366 -5.673 764 HE2 MET 100 HE2 MET 100 -6.559 5.637 -5.581 765 HE3 MET 100 HE3 MET 100 -8.002 6.299 -4.811 766 H GLY 101 H GLY 101 -6.575 3.643 -5.283 767 HA2 GLY 101 HA2 GLY 101 -9.264 2.634 -5.804 768 HA3 GLY 101 HA3 GLY 101 -8.142 1.444 -5.165 769 HA PRO 102 HA PRO 102 -10.313 3.772 -1.681 770 HB2 PRO 102 HB2 PRO 102 -11.031 1.531 -0.266 771 HB3 PRO 102 HB3 PRO 102 -12.054 2.288 -1.491 772 HG2 PRO 102 HG2 PRO 102 -10.282 -0.114 -1.723 773 HG3 PRO 102 HG3 PRO 102 -11.897 0.158 -2.402 774 HD2 PRO 102 HD2 PRO 102 -9.631 0.374 -3.880 775 HD3 PRO 102 HD3 PRO 102 -11.079 1.357 -4.197 776 H TYR 103 H TYR 103 -8.120 1.025 -1.719 777 HA TYR 103 HA TYR 103 -6.983 1.331 0.841 778 HB2 TYR 103 HB2 TYR 103 -5.731 0.244 -1.703 779 HB3 TYR 103 HB3 TYR 103 -5.102 0.004 -0.075 780 HD1 TYR 103 HD2 TYR 103 -8.249 -0.510 -2.030 781 HD2 TYR 103 HD1 TYR 103 -5.688 -1.966 1.042 782 HE1 TYR 103 HE2 TYR 103 -9.675 -2.490 -1.791 783 HE2 TYR 103 HE1 TYR 103 -7.108 -3.955 1.285 784 HH TYR 103 HH TYR 103 -8.898 -5.036 0.559 785 H ALA 104 H ALA 104 -5.911 2.534 -2.335 786 HA ALA 104 HA ALA 104 -3.826 4.170 -1.463 787 HB1 ALA 104 HB1 ALA 104 -4.077 5.359 -3.579 788 HB2 ALA 104 HB2 ALA 104 -5.666 4.630 -3.815 789 HB3 ALA 104 HB3 ALA 104 -4.221 3.619 -3.821 790 H ASN 105 H ASN 105 -7.306 4.927 -1.808 791 HA ASN 105 HA ASN 105 -7.229 7.649 -1.224 792 HB2 ASN 105 HB2 ASN 105 -9.327 5.542 -0.886 793 HB3 ASN 105 HB3 ASN 105 -9.604 7.129 -0.173 794 HD21 ASN 105 HD21 ASN 105 -9.299 5.340 -3.121 795 HD22 ASN 105 HD22 ASN 105 -9.855 6.590 -4.170 796 H MET 106 H MET 106 -6.649 5.017 0.932 797 HA MET 106 HA MET 106 -7.236 6.322 3.393 798 HB2 MET 106 HB2 MET 106 -5.289 4.076 2.800 799 HB3 MET 106 HB3 MET 106 -5.831 4.554 4.404 800 HG2 MET 106 HG2 MET 106 -7.702 3.616 2.248 801 HG3 MET 106 HG3 MET 106 -6.953 2.536 3.423 802 HE1 MET 106 HE1 MET 106 -6.930 3.882 6.126 803 HE2 MET 106 HE2 MET 106 -7.661 2.293 5.881 804 HE3 MET 106 HE3 MET 106 -8.534 3.538 6.775 805 H VAL 107 H VAL 107 -4.497 6.406 1.219 806 HA VAL 107 HA VAL 107 -2.927 7.918 3.223 807 HB VAL 107 HB VAL 107 -0.876 6.928 2.266 808 HG11 VAL 107 HG11 VAL 107 -1.879 5.933 4.259 809 HG12 VAL 107 HG12 VAL 107 -1.125 4.699 3.252 810 HG13 VAL 107 HG13 VAL 107 -2.879 4.888 3.248 811 HG21 VAL 107 HG21 VAL 107 -1.040 4.960 0.797 812 HG22 VAL 107 HG22 VAL 107 -1.683 6.410 0.024 813 HG23 VAL 107 HG23 VAL 107 -2.785 5.198 0.683 814 H ILE 108 H ILE 108 -4.334 8.106 0.159 815 HA ILE 108 HA ILE 108 -2.317 10.035 -0.795 816 HB ILE 108 HB ILE 108 -3.060 9.751 -2.995 817 HG12 ILE 108 HG12 ILE 108 -5.351 7.991 -2.114 818 HG13 ILE 108 HG13 ILE 108 -5.538 9.731 -2.324 819 HG21 ILE 108 HG21 ILE 108 -2.946 7.279 -3.355 820 HG22 ILE 108 HG22 ILE 108 -3.051 7.068 -1.607 821 HG23 ILE 108 HG23 ILE 108 -1.673 7.918 -2.311 822 HD11 ILE 108 HD11 ILE 108 -4.741 9.487 -4.638 823 HD12 ILE 108 HD12 ILE 108 -6.248 8.625 -4.309 824 HD13 ILE 108 HD13 ILE 108 -4.723 7.739 -4.407 825 H ASP 109 H ASP 109 -3.350 11.771 -2.280 826 HA ASP 109 HA ASP 109 -5.541 13.082 -0.831 827 HB2 ASP 109 HB2 ASP 109 -3.544 14.431 -1.047 828 HB3 ASP 109 HB3 ASP 109 -3.478 14.140 -2.782 829 HA PRO 110 HA PRO 110 -8.120 11.801 -4.272 830 HB2 PRO 110 HB2 PRO 110 -10.461 12.808 -3.394 831 HB3 PRO 110 HB3 PRO 110 -9.690 11.418 -2.619 832 HG2 PRO 110 HG2 PRO 110 -9.648 14.303 -1.792 833 HG3 PRO 110 HG3 PRO 110 -9.920 12.862 -0.794 834 HD2 PRO 110 HD2 PRO 110 -7.512 14.131 -0.946 835 HD3 PRO 110 HD3 PRO 110 -7.670 12.388 -0.645 836 H SER 111 H SER 111 -6.746 14.679 -4.171 837 HA SER 111 HA SER 111 -8.618 15.965 -6.076 838 HB2 SER 111 HB2 SER 111 -6.499 17.241 -4.333 839 HB3 SER 111 HB3 SER 111 -7.503 18.106 -5.497 840 HG SER 111 HG SER 111 -8.124 17.126 -2.982 841 H THR 112 H THR 112 -5.529 14.512 -5.822 842 HA THR 112 HA THR 112 -4.172 16.045 -7.821 843 HB THR 112 HB THR 112 -2.793 14.888 -6.269 844 HG1 THR 112 HG1 THR 112 -1.372 14.246 -7.730 845 HG21 THR 112 HG21 THR 112 -2.741 12.433 -6.085 846 HG22 THR 112 HG22 THR 112 -4.100 12.329 -7.209 847 HG23 THR 112 HG23 THR 112 -4.311 13.100 -5.634 848 H ASP 113 H ASP 113 -5.959 12.965 -7.962 849 HA ASP 113 HA ASP 113 -5.329 12.641 -10.777 850 HB2 ASP 113 HB2 ASP 113 -5.443 10.696 -9.215 851 HB3 ASP 113 HB3 ASP 113 -7.173 10.980 -9.041 852 H GLY 114 H GLY 114 -6.357 14.092 -12.055 853 HA2 GLY 114 HA2 GLY 114 -9.311 14.010 -12.070 854 HA3 GLY 114 HA3 GLY 114 -8.486 15.561 -12.088 855 H THR 115 H THR 115 -6.430 15.104 -13.850 856 HA THR 115 HA THR 115 -7.808 14.464 -16.392 857 HB THR 115 HB THR 115 -6.172 15.968 -17.500 858 HG1 THR 115 HG1 THR 115 -4.510 16.712 -16.419 859 HG21 THR 115 HG21 THR 115 -7.063 18.109 -16.652 860 HG22 THR 115 HG22 THR 115 -7.727 17.265 -15.255 861 HG23 THR 115 HG23 THR 115 -8.329 16.900 -16.873 862 H GLY 116 H GLY 116 -5.804 14.190 -18.139 863 HA2 GLY 116 HA2 GLY 116 -4.554 11.719 -17.543 864 HA3 GLY 116 HA3 GLY 116 -4.185 12.755 -18.914 865 H MET 117 H MET 117 -3.097 11.591 -15.900 866 HA MET 117 HA MET 117 -1.323 13.705 -15.196 867 HB2 MET 117 HB2 MET 117 -2.163 11.913 -13.634 868 HB3 MET 117 HB3 MET 117 -1.058 10.802 -14.423 869 HG2 MET 117 HG2 MET 117 -0.092 11.613 -12.364 870 HG3 MET 117 HG3 MET 117 0.836 12.194 -13.745 871 HE1 MET 117 HE1 MET 117 -2.072 14.805 -11.278 872 HE2 MET 117 HE2 MET 117 -1.711 13.118 -10.914 873 HE3 MET 117 HE3 MET 117 -2.632 13.532 -12.358 874 HA PRO 118 HA PRO 118 1.609 12.724 -18.454 875 HB2 PRO 118 HB2 PRO 118 3.111 14.927 -18.251 876 HB3 PRO 118 HB3 PRO 118 1.438 15.020 -18.821 877 HG2 PRO 118 HG2 PRO 118 2.534 15.578 -16.077 878 HG3 PRO 118 HG3 PRO 118 1.392 16.542 -17.035 879 HD2 PRO 118 HD2 PRO 118 0.617 14.791 -15.059 880 HD3 PRO 118 HD3 PRO 118 -0.401 15.211 -16.453 881 H GLN 119 H GLN 119 2.403 13.065 -15.078 882 HA GLN 119 HA GLN 119 5.108 11.978 -15.582 883 HB2 GLN 119 HB2 GLN 119 4.405 14.112 -13.549 884 HB3 GLN 119 HB3 GLN 119 5.997 13.404 -13.793 885 HG2 GLN 119 HG2 GLN 119 6.100 14.348 -16.032 886 HG3 GLN 119 HG3 GLN 119 4.477 15.010 -15.843 887 HE21 GLN 119 HE21 GLN 119 5.181 17.111 -16.161 888 HE22 GLN 119 HE22 GLN 119 6.099 17.970 -14.977 889 H PHE 120 H PHE 120 6.009 10.669 -13.929 890 HA PHE 120 HA PHE 120 4.092 9.230 -12.327 891 HB2 PHE 120 HB2 PHE 120 7.098 9.000 -12.573 892 HB3 PHE 120 HB3 PHE 120 6.123 7.949 -11.552 893 HD1 PHE 120 HD1 PHE 120 4.625 6.296 -12.530 894 HD2 PHE 120 HD2 PHE 120 7.062 8.789 -14.982 895 HE1 PHE 120 HE1 PHE 120 4.209 4.813 -14.449 896 HE2 PHE 120 HE2 PHE 120 6.651 7.306 -16.902 897 HZ PHE 120 HZ PHE 120 5.221 5.317 -16.639 898 H LYS 121 H LYS 121 3.289 10.712 -10.824 899 HA LYS 121 HA LYS 121 5.117 11.309 -8.593 900 HB2 LYS 121 HB2 LYS 121 4.897 13.398 -9.795 901 HB3 LYS 121 HB3 LYS 121 3.149 13.223 -9.860 902 HG2 LYS 121 HG2 LYS 121 3.877 14.890 -8.207 903 HG3 LYS 121 HG3 LYS 121 2.968 13.565 -7.480 904 HD2 LYS 121 HD2 LYS 121 4.874 14.148 -6.085 905 HD3 LYS 121 HD3 LYS 121 5.079 12.529 -6.749 906 HE2 LYS 121 HE2 LYS 121 6.576 13.442 -8.476 907 HE3 LYS 121 HE3 LYS 121 6.382 15.053 -7.780 908 HZ1 LYS 121 HZ1 LYS 121 7.378 14.265 -5.738 909 HZ2 LYS 121 HZ2 LYS 121 8.419 13.970 -7.035 910 HZ3 LYS 121 HZ3 LYS 121 7.522 12.701 -6.367 911 H GLY 122 H GLY 122 4.305 10.869 -6.620 912 HA2 GLY 122 HA2 GLY 122 1.388 10.541 -6.350 913 HA3 GLY 122 HA3 GLY 122 2.472 9.284 -5.775 914 H VAL 123 H VAL 123 1.130 9.835 -3.808 915 HA VAL 123 HA VAL 123 1.943 12.236 -2.361 916 HB VAL 123 HB VAL 123 0.178 9.937 -1.492 917 HG11 VAL 123 HG11 VAL 123 1.181 11.082 0.421 918 HG12 VAL 123 HG12 VAL 123 -0.549 11.409 0.323 919 HG13 VAL 123 HG13 VAL 123 0.610 12.634 -0.197 920 HG21 VAL 123 HG21 VAL 123 -1.681 11.514 -1.885 921 HG22 VAL 123 HG22 VAL 123 -0.793 11.145 -3.361 922 HG23 VAL 123 HG23 VAL 123 -0.533 12.685 -2.540 923 H LYS 124 H LYS 124 3.672 12.318 -1.035 924 HA LYS 124 HA LYS 124 5.305 10.011 -0.611 925 HB2 LYS 124 HB2 LYS 124 5.518 12.801 0.541 926 HB3 LYS 124 HB3 LYS 124 6.739 11.548 0.731 927 HG2 LYS 124 HG2 LYS 124 7.015 11.478 -1.722 928 HG3 LYS 124 HG3 LYS 124 5.845 12.792 -1.871 929 HD2 LYS 124 HD2 LYS 124 7.316 14.238 -0.523 930 HD3 LYS 124 HD3 LYS 124 8.482 12.920 -0.394 931 HE2 LYS 124 HE2 LYS 124 7.615 14.298 -2.940 932 HE3 LYS 124 HE3 LYS 124 9.161 14.498 -2.119 933 HZ1 LYS 124 HZ1 LYS 124 9.543 12.088 -2.490 934 HZ2 LYS 124 HZ2 LYS 124 9.457 12.992 -3.914 935 HZ3 LYS 124 HZ3 LYS 124 8.144 12.046 -3.438 936 H GLY 125 H GLY 125 5.862 8.968 1.284 937 HA2 GLY 125 HA2 GLY 125 4.827 9.541 3.854 938 HA3 GLY 125 HA3 GLY 125 3.828 8.319 3.078 939 H THR 126 H THR 126 4.351 6.499 4.197 940 HA THR 126 HA THR 126 7.134 5.559 4.085 941 HB THR 126 HB THR 126 6.987 4.714 6.431 942 HG1 THR 126 HG1 THR 126 4.645 6.345 6.512 943 HG21 THR 126 HG21 THR 126 7.426 6.848 7.541 944 HG22 THR 126 HG22 THR 126 6.693 7.716 6.192 945 HG23 THR 126 HG23 THR 126 8.186 6.808 5.948 946 H VAL 127 H VAL 127 7.370 3.268 4.398 947 HA VAL 127 HA VAL 127 4.910 1.658 4.296 948 HB VAL 127 HB VAL 127 5.811 1.909 1.982 949 HG11 VAL 127 HG11 VAL 127 7.905 0.810 1.360 950 HG12 VAL 127 HG12 VAL 127 8.220 0.430 3.054 951 HG13 VAL 127 HG13 VAL 127 8.185 2.111 2.518 952 HG21 VAL 127 HG21 VAL 127 5.778 -0.485 1.413 953 HG22 VAL 127 HG22 VAL 127 4.515 -0.073 2.572 954 HG23 VAL 127 HG23 VAL 127 5.979 -0.890 3.118 955 H GLU 128 H GLU 128 5.070 -0.378 5.268 956 HA GLU 128 HA GLU 128 7.606 -1.209 6.463 957 HB2 GLU 128 HB2 GLU 128 6.542 -1.395 8.727 958 HB3 GLU 128 HB3 GLU 128 6.754 0.263 8.180 959 HG2 GLU 128 HG2 GLU 128 4.459 0.524 7.716 960 HG3 GLU 128 HG3 GLU 128 4.162 -1.211 7.807 961 H LYS 129 H LYS 129 7.612 -3.430 7.152 962 HA LYS 129 HA LYS 129 5.392 -5.060 6.205 963 HB2 LYS 129 HB2 LYS 129 7.612 -5.980 5.878 964 HB3 LYS 129 HB3 LYS 129 7.969 -5.837 7.596 965 HG2 LYS 129 HG2 LYS 129 6.442 -7.565 8.161 966 HG3 LYS 129 HG3 LYS 129 5.716 -7.546 6.555 967 HD2 LYS 129 HD2 LYS 129 7.176 -9.487 6.881 968 HD3 LYS 129 HD3 LYS 129 7.751 -8.437 5.587 969 HE2 LYS 129 HE2 LYS 129 9.634 -9.139 6.896 970 HE3 LYS 129 HE3 LYS 129 9.355 -7.425 7.191 971 HZ1 LYS 129 HZ1 LYS 129 9.820 -8.573 9.241 972 HZ2 LYS 129 HZ2 LYS 129 8.557 -9.665 8.972 973 HZ3 LYS 129 HZ3 LYS 129 8.215 -8.036 9.259 974 H THR 130 H THR 130 3.866 -6.042 7.483 975 HA THR 130 HA THR 130 3.953 -5.350 10.356 976 HB THR 130 HB THR 130 2.593 -3.636 9.345 977 HG1 THR 130 HG1 THR 130 1.518 -3.959 11.145 978 HG21 THR 130 HG21 THR 130 0.886 -5.862 8.210 979 HG22 THR 130 HG22 THR 130 1.963 -4.823 7.277 980 HG23 THR 130 HG23 THR 130 0.558 -4.131 8.089 981 H ASP 131 H ASP 131 2.448 -6.494 11.699 982 HA ASP 131 HA ASP 131 2.143 -9.271 10.948 983 HB2 ASP 131 HB2 ASP 131 2.916 -8.550 13.208 984 HB3 ASP 131 HB3 ASP 131 1.335 -7.831 13.492 985 H GLU 132 H GLU 132 0.245 -6.408 11.003 986 HA GLU 132 HA GLU 132 -2.357 -7.422 11.300 987 HB2 GLU 132 HB2 GLU 132 -1.271 -4.975 9.908 988 HB3 GLU 132 HB3 GLU 132 -2.996 -5.308 10.003 989 HG2 GLU 132 HG2 GLU 132 -3.015 -5.119 12.343 990 HG3 GLU 132 HG3 GLU 132 -1.259 -5.199 12.444 991 H LYS 133 H LYS 133 -4.031 -7.673 9.708 992 HA LYS 133 HA LYS 133 -3.088 -9.072 7.331 993 HB2 LYS 133 HB2 LYS 133 -5.180 -10.108 7.226 994 HB3 LYS 133 HB3 LYS 133 -4.931 -9.917 8.955 995 HG2 LYS 133 HG2 LYS 133 -6.602 -8.096 7.221 996 HG3 LYS 133 HG3 LYS 133 -7.227 -9.379 8.254 997 HD2 LYS 133 HD2 LYS 133 -6.525 -8.241 10.232 998 HD3 LYS 133 HD3 LYS 133 -5.595 -7.063 9.303 999 HE2 LYS 133 HE2 LYS 133 -7.718 -6.124 10.107 1000 HE3 LYS 133 HE3 LYS 133 -7.649 -6.168 8.346 1001 HZ1 LYS 133 HZ1 LYS 133 -8.971 -8.218 8.419 1002 HZ2 LYS 133 HZ2 LYS 133 -9.788 -6.905 9.095 1003 HZ3 LYS 133 HZ3 LYS 133 -9.094 -8.076 10.101 1004 H VAL 134 H VAL 134 -4.161 -8.708 5.231 1005 HA VAL 134 HA VAL 134 -4.201 -5.986 4.444 1006 HB VAL 134 HB VAL 134 -5.259 -8.433 3.003 1007 HG11 VAL 134 HG11 VAL 134 -4.687 -5.672 1.912 1008 HG12 VAL 134 HG12 VAL 134 -6.279 -6.409 2.098 1009 HG13 VAL 134 HG13 VAL 134 -5.123 -7.088 0.953 1010 HG21 VAL 134 HG21 VAL 134 -2.880 -8.576 3.488 1011 HG22 VAL 134 HG22 VAL 134 -2.619 -6.980 2.782 1012 HG23 VAL 134 HG23 VAL 134 -3.137 -8.324 1.762 1013 H LEU 135 H LEU 135 -5.833 -4.529 4.330 1014 HA LEU 135 HA LEU 135 -8.309 -4.969 5.607 1015 HB2 LEU 135 HB2 LEU 135 -7.155 -2.778 3.941 1016 HB3 LEU 135 HB3 LEU 135 -8.893 -2.780 4.178 1017 HG LEU 135 HG LEU 135 -6.827 -2.704 6.392 1018 HD11 LEU 135 HD11 LEU 135 -8.681 -0.550 5.365 1019 HD12 LEU 135 HD12 LEU 135 -6.934 -0.613 5.116 1020 HD13 LEU 135 HD13 LEU 135 -7.586 -0.415 6.743 1021 HD21 LEU 135 HD21 LEU 135 -9.845 -2.588 6.462 1022 HD22 LEU 135 HD22 LEU 135 -8.787 -2.258 7.838 1023 HD23 LEU 135 HD23 LEU 135 -8.817 -3.865 7.115 1024 H SER 136 H SER 136 -10.281 -5.603 4.883 1025 HA SER 136 HA SER 136 -10.594 -6.391 2.094 1026 HB2 SER 136 HB2 SER 136 -11.586 -7.802 3.874 1027 HB3 SER 136 HB3 SER 136 -12.606 -6.453 4.376 1028 HG SER 136 HG SER 136 -13.354 -8.210 2.753 1029 H VAL 137 H VAL 137 -12.062 -5.395 0.631 1030 HA VAL 137 HA VAL 137 -12.021 -2.647 0.534 1031 HB VAL 137 HB VAL 137 -14.116 -4.434 -0.727 1032 HG11 VAL 137 HG11 VAL 137 -14.398 -2.628 -2.366 1033 HG12 VAL 137 HG12 VAL 137 -13.277 -1.622 -1.451 1034 HG13 VAL 137 HG13 VAL 137 -14.819 -2.096 -0.738 1035 HG21 VAL 137 HG21 VAL 137 -11.859 -5.111 -1.344 1036 HG22 VAL 137 HG22 VAL 137 -11.458 -3.450 -1.786 1037 HG23 VAL 137 HG23 VAL 137 -12.658 -4.345 -2.718 1038 H LYS 138 H LYS 138 -14.732 -4.645 1.690 1039 HA LYS 138 HA LYS 138 -16.431 -2.475 2.372 1040 HB2 LYS 138 HB2 LYS 138 -17.254 -4.760 1.987 1041 HB3 LYS 138 HB3 LYS 138 -16.399 -5.321 3.417 1042 HG2 LYS 138 HG2 LYS 138 -17.814 -3.946 4.839 1043 HG3 LYS 138 HG3 LYS 138 -18.638 -3.301 3.417 1044 HD2 LYS 138 HD2 LYS 138 -18.617 -6.199 4.293 1045 HD3 LYS 138 HD3 LYS 138 -19.955 -5.068 4.494 1046 HE2 LYS 138 HE2 LYS 138 -20.116 -4.835 2.051 1047 HE3 LYS 138 HE3 LYS 138 -18.800 -5.992 1.858 1048 HZ1 LYS 138 HZ1 LYS 138 -20.957 -7.040 1.571 1049 HZ2 LYS 138 HZ2 LYS 138 -21.435 -6.556 3.118 1050 HZ3 LYS 138 HZ3 LYS 138 -20.175 -7.672 2.931 1051 H GLU 139 H GLU 139 -14.093 -4.370 4.263 1052 HA GLU 139 HA GLU 139 -14.628 -3.263 6.801 1053 HB2 GLU 139 HB2 GLU 139 -13.361 -5.300 6.578 1054 HB3 GLU 139 HB3 GLU 139 -12.147 -4.501 5.595 1055 HG2 GLU 139 HG2 GLU 139 -11.389 -3.218 7.500 1056 HG3 GLU 139 HG3 GLU 139 -12.672 -3.905 8.500 1057 H LEU 140 H LEU 140 -12.624 -2.252 4.129 1058 HA LEU 140 HA LEU 140 -11.277 -0.100 5.347 1059 HB2 LEU 140 HB2 LEU 140 -10.980 -1.387 3.060 1060 HB3 LEU 140 HB3 LEU 140 -11.999 -0.099 2.446 1061 HG LEU 140 HG LEU 140 -9.536 0.543 4.027 1062 HD11 LEU 140 HD11 LEU 140 -9.634 -0.032 1.072 1063 HD12 LEU 140 HD12 LEU 140 -8.810 -0.997 2.298 1064 HD13 LEU 140 HD13 LEU 140 -8.260 0.642 1.948 1065 HD21 LEU 140 HD21 LEU 140 -11.039 1.998 1.851 1066 HD22 LEU 140 HD22 LEU 140 -9.574 2.574 2.646 1067 HD23 LEU 140 HD23 LEU 140 -11.060 2.376 3.575 1068 H LEU 141 H LEU 141 -14.442 -0.372 3.754 1069 HA LEU 141 HA LEU 141 -15.121 2.363 3.658 1070 HB2 LEU 141 HB2 LEU 141 -17.022 0.073 4.229 1071 HB3 LEU 141 HB3 LEU 141 -17.440 1.647 3.578 1072 HG LEU 141 HG LEU 141 -15.849 -0.509 2.177 1073 HD11 LEU 141 HD11 LEU 141 -18.596 0.607 1.610 1074 HD12 LEU 141 HD12 LEU 141 -18.243 -0.974 2.310 1075 HD13 LEU 141 HD13 LEU 141 -17.750 -0.613 0.655 1076 HD21 LEU 141 HD21 LEU 141 -16.621 2.243 1.203 1077 HD22 LEU 141 HD22 LEU 141 -15.907 0.966 0.216 1078 HD23 LEU 141 HD23 LEU 141 -14.988 1.668 1.546 1079 H GLU 142 H GLU 142 -15.494 -0.054 6.211 1080 HA GLU 142 HA GLU 142 -16.664 1.638 8.159 1081 HB2 GLU 142 HB2 GLU 142 -14.950 -0.833 8.537 1082 HB3 GLU 142 HB3 GLU 142 -15.978 -0.105 9.766 1083 HG2 GLU 142 HG2 GLU 142 -17.959 -0.642 8.497 1084 HG3 GLU 142 HG3 GLU 142 -16.983 -1.234 7.153 1085 H ALA 143 H ALA 143 -13.321 0.935 7.267 1086 HA ALA 143 HA ALA 143 -12.048 2.204 9.452 1087 HB1 ALA 143 HB1 ALA 143 -10.993 1.760 6.660 1088 HB2 ALA 143 HB2 ALA 143 -10.897 0.612 7.996 1089 HB3 ALA 143 HB3 ALA 143 -10.028 2.144 8.085 1090 H ILE 144 H ILE 144 -12.904 3.451 6.206 1091 HA ILE 144 HA ILE 144 -11.886 6.077 6.797 1092 HB ILE 144 HB ILE 144 -12.912 6.765 4.642 1093 HG12 ILE 144 HG12 ILE 144 -13.623 4.649 3.210 1094 HG13 ILE 144 HG13 ILE 144 -14.045 3.988 4.783 1095 HG21 ILE 144 HG21 ILE 144 -10.639 5.913 4.724 1096 HG22 ILE 144 HG22 ILE 144 -11.428 5.417 3.228 1097 HG23 ILE 144 HG23 ILE 144 -11.230 4.260 4.546 1098 HD11 ILE 144 HD11 ILE 144 -15.138 6.526 3.589 1099 HD12 ILE 144 HD12 ILE 144 -15.573 5.850 5.159 1100 HD13 ILE 144 HD13 ILE 144 -15.969 4.974 3.682 1101 H GLY 145 H GLY 145 -14.711 4.487 7.665 1102 HA2 GLY 145 HA2 GLY 145 -16.263 5.295 9.200 1103 HA3 GLY 145 HA3 GLY 145 -15.664 6.917 8.921 1104 H SER 146 H SER 146 -16.908 4.692 6.436 1105 HA SER 146 HA SER 146 -19.531 5.892 6.437 1106 HB2 SER 146 HB2 SER 146 -18.241 7.641 5.233 1107 HB3 SER 146 HB3 SER 146 -17.743 6.435 4.048 1108 HG SER 146 HG SER 146 -19.606 6.633 3.098 Start of MODEL 5 1 H1 MET 1 H1 MET 1 1.714 54.783 33.946 2 H2 MET 1 H2 MET 1 2.848 54.014 34.932 3 H3 MET 1 H3 MET 1 1.831 55.203 35.579 4 HA MET 1 HA MET 1 1.097 53.013 36.243 5 HB2 MET 1 HB2 MET 1 -0.755 54.317 34.229 6 HB3 MET 1 HB3 MET 1 -1.245 53.177 35.474 7 HG2 MET 1 HG2 MET 1 -1.771 55.434 36.150 8 HG3 MET 1 HG3 MET 1 -0.523 54.762 37.202 9 HE1 MET 1 HE1 MET 1 0.371 58.600 36.993 10 HE2 MET 1 HE2 MET 1 0.046 57.254 38.086 11 HE3 MET 1 HE3 MET 1 -1.231 57.863 37.035 12 H GLY 2 H GLY 2 1.489 50.932 35.750 13 HA2 GLY 2 HA2 GLY 2 0.343 49.382 33.864 14 HA3 GLY 2 HA3 GLY 2 1.698 50.059 32.976 15 H SER 3 H SER 3 0.834 48.137 35.825 16 HA SER 3 HA SER 3 3.538 47.304 36.343 17 HB2 SER 3 HB2 SER 3 2.527 45.807 38.024 18 HB3 SER 3 HB3 SER 3 1.920 47.456 38.168 19 HG SER 3 HG SER 3 0.267 45.851 38.297 20 H SER 4 H SER 4 4.633 45.668 35.457 21 HA SER 4 HA SER 4 3.357 43.975 33.474 22 HB2 SER 4 HB2 SER 4 6.245 44.158 34.378 23 HB3 SER 4 HB3 SER 4 5.674 43.136 33.056 24 HG SER 4 HG SER 4 6.520 45.252 32.443 25 H HIS 5 H HIS 5 3.403 41.680 33.453 26 HA HIS 5 HA HIS 5 4.221 40.194 35.792 27 HB2 HIS 5 HB2 HIS 5 1.974 39.282 36.293 28 HB3 HIS 5 HB3 HIS 5 2.065 41.015 36.584 29 HD1 HIS 5 HD1 HIS 5 0.298 38.466 34.579 30 HD2 HIS 5 HD2 HIS 5 0.613 42.607 34.699 31 HE1 HIS 5 HE1 HIS 5 -1.592 39.323 33.172 32 HE2 HIS 5 HE2 HIS 5 -1.385 41.827 33.253 33 H HIS 6 H HIS 6 4.575 38.041 35.333 34 HA HIS 6 HA HIS 6 3.839 37.138 32.615 35 HB2 HIS 6 HB2 HIS 6 6.003 35.789 32.694 36 HB3 HIS 6 HB3 HIS 6 6.167 37.529 32.507 37 HD1 HIS 6 HD1 HIS 6 7.821 38.582 34.007 38 HD2 HIS 6 HD2 HIS 6 6.417 34.992 35.557 39 HE1 HIS 6 HE1 HIS 6 9.130 38.204 36.112 40 HE2 HIS 6 HE2 HIS 6 8.132 36.131 37.121 41 H HIS 7 H HIS 7 3.271 34.998 32.304 42 HA HIS 7 HA HIS 7 2.178 33.673 34.653 43 HB2 HIS 7 HB2 HIS 7 2.015 32.885 31.727 44 HB3 HIS 7 HB3 HIS 7 1.078 32.183 33.041 45 HD1 HIS 7 HD1 HIS 7 -1.072 33.354 33.665 46 HD2 HIS 7 HD2 HIS 7 1.287 35.607 31.095 47 HE1 HIS 7 HE1 HIS 7 -2.505 35.284 32.961 48 HE2 HIS 7 HE2 HIS 7 -1.099 36.572 31.321 49 H HIS 8 H HIS 8 2.537 31.401 35.118 50 HA HIS 8 HA HIS 8 5.174 30.406 34.213 51 HB2 HIS 8 HB2 HIS 8 5.466 29.462 36.521 52 HB3 HIS 8 HB3 HIS 8 5.482 31.219 36.447 53 HD1 HIS 8 HD1 HIS 8 3.694 32.465 37.744 54 HD2 HIS 8 HD2 HIS 8 3.144 28.347 37.762 55 HE1 HIS 8 HE1 HIS 8 1.879 32.039 39.416 56 HE2 HIS 8 HE2 HIS 8 1.469 29.564 39.312 57 H HIS 9 H HIS 9 5.390 28.217 33.835 58 HA HIS 9 HA HIS 9 3.311 26.351 34.616 59 HB2 HIS 9 HB2 HIS 9 2.699 25.609 32.411 60 HB3 HIS 9 HB3 HIS 9 2.466 27.351 32.468 61 HD1 HIS 9 HD1 HIS 9 3.983 24.749 30.481 62 HD2 HIS 9 HD2 HIS 9 4.714 28.785 31.161 63 HE1 HIS 9 HE1 HIS 9 5.443 25.497 28.584 64 HE2 HIS 9 HE2 HIS 9 5.676 27.978 28.898 65 H HIS 10 H HIS 10 3.947 24.144 34.436 66 HA HIS 10 HA HIS 10 6.795 23.739 33.746 67 HB2 HIS 10 HB2 HIS 10 6.814 21.844 35.325 68 HB3 HIS 10 HB3 HIS 10 6.398 23.353 36.124 69 HD1 HIS 10 HD1 HIS 10 4.865 20.078 35.034 70 HD2 HIS 10 HD2 HIS 10 3.893 23.410 37.325 71 HE1 HIS 10 HE1 HIS 10 2.771 19.464 36.266 72 HE2 HIS 10 HE2 HIS 10 2.093 21.559 37.465 73 H SER 11 H SER 11 7.103 22.670 31.903 74 HA SER 11 HA SER 11 4.971 21.207 30.627 75 HB2 SER 11 HB2 SER 11 7.881 21.534 29.833 76 HB3 SER 11 HB3 SER 11 6.628 20.815 28.821 77 HG SER 11 HG SER 11 6.841 22.965 28.255 78 H SER 12 H SER 12 4.449 19.359 31.710 79 HA SER 12 HA SER 12 6.593 17.433 32.343 80 HB2 SER 12 HB2 SER 12 3.726 17.517 33.339 81 HB3 SER 12 HB3 SER 12 4.963 16.371 33.855 82 HG SER 12 HG SER 12 5.821 17.843 35.103 83 H GLY 13 H GLY 13 6.861 15.729 31.015 84 HA2 GLY 13 HA2 GLY 13 4.497 14.611 29.628 85 HA3 GLY 13 HA3 GLY 13 5.952 14.988 28.720 86 H ARG 14 H ARG 14 5.762 12.669 28.141 87 HA ARG 14 HA ARG 14 7.014 10.950 30.196 88 HB2 ARG 14 HB2 ARG 14 5.178 10.144 27.926 89 HB3 ARG 14 HB3 ARG 14 6.007 9.018 28.995 90 HG2 ARG 14 HG2 ARG 14 4.804 10.009 30.919 91 HG3 ARG 14 HG3 ARG 14 3.918 11.043 29.798 92 HD2 ARG 14 HD2 ARG 14 3.022 9.034 28.686 93 HD3 ARG 14 HD3 ARG 14 3.886 8.020 29.843 94 HE ARG 14 HE ARG 14 2.194 9.891 31.158 95 HH11 ARG 14 HH11 ARG 14 2.158 6.868 29.489 96 HH12 ARG 14 HH12 ARG 14 0.700 6.348 30.258 97 HH21 ARG 14 HH21 ARG 14 0.340 9.211 32.127 98 HH22 ARG 14 HH22 ARG 14 -0.335 7.672 31.720 99 H GLU 15 H GLU 15 7.937 8.878 28.809 100 HA GLU 15 HA GLU 15 10.096 10.118 27.246 101 HB2 GLU 15 HB2 GLU 15 11.426 8.128 27.804 102 HB3 GLU 15 HB3 GLU 15 10.841 8.950 29.240 103 HG2 GLU 15 HG2 GLU 15 9.428 6.558 28.088 104 HG3 GLU 15 HG3 GLU 15 10.770 6.401 29.217 105 H ASN 16 H ASN 16 11.169 8.598 25.619 106 HA ASN 16 HA ASN 16 9.081 7.409 23.907 107 HB2 ASN 16 HB2 ASN 16 11.851 8.389 23.159 108 HB3 ASN 16 HB3 ASN 16 10.640 7.769 22.039 109 HD21 ASN 16 HD21 ASN 16 8.791 9.026 21.613 110 HD22 ASN 16 HD22 ASN 16 8.763 10.722 21.951 111 H LEU 17 H LEU 17 8.975 5.249 23.988 112 HA LEU 17 HA LEU 17 11.148 3.644 24.993 113 HB2 LEU 17 HB2 LEU 17 8.421 2.930 23.946 114 HB3 LEU 17 HB3 LEU 17 9.581 1.736 24.500 115 HG LEU 17 HG LEU 17 9.608 3.015 26.720 116 HD11 LEU 17 HD11 LEU 17 7.597 4.310 27.240 117 HD12 LEU 17 HD12 LEU 17 7.085 4.190 25.557 118 HD13 LEU 17 HD13 LEU 17 8.558 5.068 25.972 119 HD21 LEU 17 HD21 LEU 17 7.075 1.616 25.878 120 HD22 LEU 17 HD22 LEU 17 7.652 1.832 27.532 121 HD23 LEU 17 HD23 LEU 17 8.567 0.836 26.402 122 H TYR 18 H TYR 18 11.927 1.677 23.851 123 HA TYR 18 HA TYR 18 12.624 2.345 21.090 124 HB2 TYR 18 HB2 TYR 18 13.725 0.293 23.017 125 HB3 TYR 18 HB3 TYR 18 14.257 0.432 21.346 126 HD1 TYR 18 HD2 TYR 18 15.485 2.456 20.598 127 HD2 TYR 18 HD1 TYR 18 14.481 1.848 24.697 128 HE1 TYR 18 HE2 TYR 18 17.133 4.156 21.253 129 HE2 TYR 18 HE1 TYR 18 16.132 3.548 25.353 130 HH TYR 18 HH TYR 18 17.624 5.640 23.077 131 H PHE 19 H PHE 19 11.677 1.438 19.395 132 HA PHE 19 HA PHE 19 10.244 -1.124 19.712 133 HB2 PHE 19 HB2 PHE 19 9.945 1.040 17.609 134 HB3 PHE 19 HB3 PHE 19 9.043 -0.474 17.632 135 HD1 PHE 19 HD2 PHE 19 7.416 -0.914 19.456 136 HD2 PHE 19 HD1 PHE 19 9.330 2.868 19.017 137 HE1 PHE 19 HE2 PHE 19 5.724 0.108 20.912 138 HE2 PHE 19 HE1 PHE 19 7.636 3.893 20.478 139 HZ PHE 19 HZ PHE 19 5.831 2.515 21.426 140 H GLN 20 H GLN 20 10.686 -2.855 18.336 141 HA GLN 20 HA GLN 20 13.244 -2.679 16.913 142 HB2 GLN 20 HB2 GLN 20 12.940 -4.438 18.635 143 HB3 GLN 20 HB3 GLN 20 11.638 -5.125 17.677 144 HG2 GLN 20 HG2 GLN 20 13.155 -5.707 15.910 145 HG3 GLN 20 HG3 GLN 20 14.475 -4.849 16.703 146 HE21 GLN 20 HE21 GLN 20 15.450 -5.775 18.520 147 HE22 GLN 20 HE22 GLN 20 15.234 -7.437 18.929 148 H GLY 21 H GLY 21 12.764 -1.791 14.939 149 HA2 GLY 21 HA2 GLY 21 12.015 -3.279 12.778 150 HA3 GLY 21 HA3 GLY 21 10.490 -2.644 13.370 151 H HIS 22 H HIS 22 13.042 -2.077 11.302 152 HA HIS 22 HA HIS 22 12.807 0.846 11.381 153 HB2 HIS 22 HB2 HIS 22 15.071 0.096 11.293 154 HB3 HIS 22 HB3 HIS 22 14.725 -1.022 9.979 155 HD1 HIS 22 HD1 HIS 22 14.998 2.719 10.614 156 HD2 HIS 22 HD2 HIS 22 15.070 0.001 7.468 157 HE1 HIS 22 HE1 HIS 22 15.680 4.042 8.594 158 HE2 HIS 22 HE2 HIS 22 15.891 2.344 6.752 159 H MET 23 H MET 23 11.237 1.729 10.208 160 HA MET 23 HA MET 23 10.140 0.448 7.853 161 HB2 MET 23 HB2 MET 23 8.680 2.475 7.737 162 HB3 MET 23 HB3 MET 23 8.588 1.624 9.272 163 HG2 MET 23 HG2 MET 23 9.888 3.282 10.369 164 HG3 MET 23 HG3 MET 23 10.332 4.035 8.838 165 HE1 MET 23 HE1 MET 23 7.135 2.985 10.909 166 HE2 MET 23 HE2 MET 23 6.668 2.762 9.221 167 HE3 MET 23 HE3 MET 23 5.925 4.041 10.184 168 H LEU 24 H LEU 24 9.846 1.767 5.810 169 HA LEU 24 HA LEU 24 12.260 3.374 5.242 170 HB2 LEU 24 HB2 LEU 24 10.928 1.242 3.610 171 HB3 LEU 24 HB3 LEU 24 11.878 2.493 2.826 172 HG LEU 24 HG LEU 24 13.018 0.828 5.055 173 HD11 LEU 24 HD11 LEU 24 14.016 -0.628 3.371 174 HD12 LEU 24 HD12 LEU 24 13.134 0.216 2.100 175 HD13 LEU 24 HD13 LEU 24 12.257 -0.715 3.316 176 HD21 LEU 24 HD21 LEU 24 15.148 1.472 4.040 177 HD22 LEU 24 HD22 LEU 24 14.198 2.885 4.499 178 HD23 LEU 24 HD23 LEU 24 14.283 2.391 2.807 179 H GLU 25 H GLU 25 11.935 5.353 4.567 180 HA GLU 25 HA GLU 25 9.356 6.443 4.158 181 HB2 GLU 25 HB2 GLU 25 11.458 7.575 5.097 182 HB3 GLU 25 HB3 GLU 25 11.981 7.748 3.423 183 HG2 GLU 25 HG2 GLU 25 9.857 8.940 2.962 184 HG3 GLU 25 HG3 GLU 25 9.509 8.874 4.684 185 H VAL 26 H VAL 26 8.191 6.295 2.336 186 HA VAL 26 HA VAL 26 9.581 6.069 -0.261 187 HB VAL 26 HB VAL 26 7.843 4.459 -1.000 188 HG11 VAL 26 HG11 VAL 26 8.703 2.511 0.227 189 HG12 VAL 26 HG12 VAL 26 9.396 3.584 1.443 190 HG13 VAL 26 HG13 VAL 26 10.000 3.624 -0.214 191 HG21 VAL 26 HG21 VAL 26 7.008 4.476 1.910 192 HG22 VAL 26 HG22 VAL 26 6.415 3.361 0.676 193 HG23 VAL 26 HG23 VAL 26 6.063 5.084 0.550 194 H GLU 27 H GLU 27 8.327 6.704 -2.143 195 HA GLU 27 HA GLU 27 6.247 8.690 -1.551 196 HB2 GLU 27 HB2 GLU 27 8.108 9.429 -2.970 197 HB3 GLU 27 HB3 GLU 27 7.756 8.146 -4.124 198 HG2 GLU 27 HG2 GLU 27 5.698 9.147 -4.752 199 HG3 GLU 27 HG3 GLU 27 5.767 10.287 -3.410 200 H VAL 28 H VAL 28 4.190 8.122 -1.715 201 HA VAL 28 HA VAL 28 3.467 5.608 -3.014 202 HB VAL 28 HB VAL 28 1.760 7.432 -1.303 203 HG11 VAL 28 HG11 VAL 28 0.344 5.431 -1.017 204 HG12 VAL 28 HG12 VAL 28 1.368 4.560 -2.159 205 HG13 VAL 28 HG13 VAL 28 0.432 5.953 -2.701 206 HG21 VAL 28 HG21 VAL 28 2.215 5.863 0.532 207 HG22 VAL 28 HG22 VAL 28 3.686 6.652 -0.037 208 HG23 VAL 28 HG23 VAL 28 3.345 4.984 -0.502 209 H ILE 29 H ILE 29 3.013 5.775 -5.134 210 HA ILE 29 HA ILE 29 1.432 8.060 -6.126 211 HB ILE 29 HB ILE 29 2.027 6.999 -8.414 212 HG12 ILE 29 HG12 ILE 29 3.766 5.453 -6.522 213 HG13 ILE 29 HG13 ILE 29 2.906 4.900 -7.958 214 HG21 ILE 29 HG21 ILE 29 2.933 9.112 -7.609 215 HG22 ILE 29 HG22 ILE 29 4.150 8.190 -8.490 216 HG23 ILE 29 HG23 ILE 29 4.193 8.248 -6.726 217 HD11 ILE 29 HD11 ILE 29 5.299 4.885 -8.301 218 HD12 ILE 29 HD12 ILE 29 5.379 6.605 -7.907 219 HD13 ILE 29 HD13 ILE 29 4.528 6.067 -9.360 220 H SER 30 H SER 30 -0.459 7.794 -7.308 221 HA SER 30 HA SER 30 -1.792 5.185 -6.973 222 HB2 SER 30 HB2 SER 30 -2.963 7.958 -7.265 223 HB3 SER 30 HB3 SER 30 -3.924 6.481 -7.264 224 HG SER 30 HG SER 30 -2.227 6.512 -5.168 225 H GLY 31 H GLY 31 -1.482 4.020 -8.776 226 HA2 GLY 31 HA2 GLY 31 -1.366 5.150 -11.407 227 HA3 GLY 31 HA3 GLY 31 -1.450 3.443 -11.013 228 H ARG 32 H ARG 32 -3.258 6.280 -11.860 229 HA ARG 32 HA ARG 32 -5.852 5.179 -11.519 230 HB2 ARG 32 HB2 ARG 32 -6.558 7.064 -13.068 231 HB3 ARG 32 HB3 ARG 32 -5.737 7.533 -11.589 232 HG2 ARG 32 HG2 ARG 32 -3.662 7.872 -12.828 233 HG3 ARG 32 HG3 ARG 32 -4.459 7.361 -14.317 234 HD2 ARG 32 HD2 ARG 32 -4.312 9.807 -14.155 235 HD3 ARG 32 HD3 ARG 32 -5.984 9.248 -14.177 236 HE ARG 32 HE ARG 32 -4.924 9.643 -11.530 237 HH11 ARG 32 HH11 ARG 32 -6.492 11.161 -14.201 238 HH12 ARG 32 HH12 ARG 32 -7.197 12.393 -13.211 239 HH21 ARG 32 HH21 ARG 32 -5.811 11.256 -10.295 240 HH22 ARG 32 HH22 ARG 32 -6.811 12.455 -11.045 241 H THR 33 H THR 33 -5.877 3.134 -12.430 242 HA THR 33 HA THR 33 -5.745 2.978 -15.383 243 HB THR 33 HB THR 33 -5.442 0.574 -15.157 244 HG1 THR 33 HG1 THR 33 -5.292 -0.361 -13.050 245 HG21 THR 33 HG21 THR 33 -3.262 0.495 -14.049 246 HG22 THR 33 HG22 THR 33 -3.594 2.033 -13.250 247 HG23 THR 33 HG23 THR 33 -3.414 1.969 -15.005 248 H LEU 34 H LEU 34 -7.265 1.200 -16.263 249 HA LEU 34 HA LEU 34 -9.305 0.292 -16.618 250 HB2 LEU 34 HB2 LEU 34 -9.178 -0.434 -14.249 251 HB3 LEU 34 HB3 LEU 34 -9.964 1.058 -13.770 252 HG LEU 34 HG LEU 34 -11.984 0.392 -15.029 253 HD11 LEU 34 HD11 LEU 34 -10.950 -0.984 -16.745 254 HD12 LEU 34 HD12 LEU 34 -12.188 -1.899 -15.882 255 HD13 LEU 34 HD13 LEU 34 -10.480 -2.175 -15.532 256 HD21 LEU 34 HD21 LEU 34 -11.811 -0.146 -12.655 257 HD22 LEU 34 HD22 LEU 34 -11.020 -1.676 -13.046 258 HD23 LEU 34 HD23 LEU 34 -12.699 -1.401 -13.517 259 H ASN 35 H ASN 35 -9.598 3.338 -14.762 260 HA ASN 35 HA ASN 35 -10.760 5.247 -15.122 261 HB2 ASN 35 HB2 ASN 35 -10.747 4.306 -17.999 262 HB3 ASN 35 HB3 ASN 35 -11.146 5.938 -17.465 263 HD21 ASN 35 HD21 ASN 35 -8.968 4.916 -19.188 264 HD22 ASN 35 HD22 ASN 35 -7.508 5.500 -18.469 265 H GLN 36 H GLN 36 -12.599 4.950 -13.986 266 HA GLN 36 HA GLN 36 -14.988 3.992 -15.426 267 HB2 GLN 36 HB2 GLN 36 -14.137 3.174 -12.640 268 HB3 GLN 36 HB3 GLN 36 -15.708 2.817 -13.338 269 HG2 GLN 36 HG2 GLN 36 -13.135 1.914 -14.602 270 HG3 GLN 36 HG3 GLN 36 -13.986 0.962 -13.387 271 HE21 GLN 36 HE21 GLN 36 -13.419 0.414 -16.235 272 HE22 GLN 36 HE22 GLN 36 -14.958 0.093 -16.946 273 H GLY 37 H GLY 37 -13.857 5.584 -12.428 274 HA2 GLY 37 HA2 GLY 37 -14.627 7.538 -11.439 275 HA3 GLY 37 HA3 GLY 37 -15.804 7.700 -12.731 276 H ALA 38 H ALA 38 -16.331 4.671 -11.747 277 HA ALA 38 HA ALA 38 -18.695 5.376 -10.251 278 HB1 ALA 38 HB1 ALA 38 -19.232 3.009 -10.365 279 HB2 ALA 38 HB2 ALA 38 -17.601 2.640 -10.931 280 HB3 ALA 38 HB3 ALA 38 -18.697 3.579 -11.948 281 H THR 39 H THR 39 -19.136 4.958 -8.092 282 HA THR 39 HA THR 39 -17.069 4.712 -6.193 283 HB THR 39 HB THR 39 -19.238 5.599 -5.533 284 HG1 THR 39 HG1 THR 39 -19.226 4.667 -3.560 285 HG21 THR 39 HG21 THR 39 -20.690 4.213 -6.942 286 HG22 THR 39 HG22 THR 39 -21.198 4.136 -5.254 287 HG23 THR 39 HG23 THR 39 -20.298 2.796 -5.967 288 H VAL 40 H VAL 40 -16.544 2.924 -4.768 289 HA VAL 40 HA VAL 40 -16.004 0.544 -6.126 290 HB VAL 40 HB VAL 40 -15.254 -0.403 -4.058 291 HG11 VAL 40 HG11 VAL 40 -13.766 1.338 -3.208 292 HG12 VAL 40 HG12 VAL 40 -14.745 2.574 -4.000 293 HG13 VAL 40 HG13 VAL 40 -13.864 1.391 -4.969 294 HG21 VAL 40 HG21 VAL 40 -15.709 0.628 -1.873 295 HG22 VAL 40 HG22 VAL 40 -17.181 0.052 -2.655 296 HG23 VAL 40 HG23 VAL 40 -16.800 1.775 -2.651 297 H GLU 41 H GLU 41 -18.788 1.479 -4.229 298 HA GLU 41 HA GLU 41 -19.941 -1.036 -3.745 299 HB2 GLU 41 HB2 GLU 41 -20.741 0.969 -2.623 300 HB3 GLU 41 HB3 GLU 41 -21.272 1.654 -4.153 301 HG2 GLU 41 HG2 GLU 41 -22.896 -0.192 -4.386 302 HG3 GLU 41 HG3 GLU 41 -22.401 -0.798 -2.806 303 H GLU 42 H GLU 42 -20.004 1.007 -6.606 304 HA GLU 42 HA GLU 42 -22.123 -0.132 -8.024 305 HB2 GLU 42 HB2 GLU 42 -20.812 1.932 -8.639 306 HB3 GLU 42 HB3 GLU 42 -19.523 0.887 -9.205 307 HG2 GLU 42 HG2 GLU 42 -22.275 0.581 -10.341 308 HG3 GLU 42 HG3 GLU 42 -21.255 1.913 -10.872 309 H LYS 43 H LYS 43 -18.782 -1.185 -7.679 310 HA LYS 43 HA LYS 43 -19.271 -3.449 -9.486 311 HB2 LYS 43 HB2 LYS 43 -16.645 -2.300 -8.569 312 HB3 LYS 43 HB3 LYS 43 -16.870 -3.560 -9.782 313 HG2 LYS 43 HG2 LYS 43 -18.101 -1.984 -11.195 314 HG3 LYS 43 HG3 LYS 43 -17.883 -0.725 -9.980 315 HD2 LYS 43 HD2 LYS 43 -15.436 -0.896 -10.283 316 HD3 LYS 43 HD3 LYS 43 -15.696 -2.101 -11.549 317 HE2 LYS 43 HE2 LYS 43 -16.635 0.769 -11.570 318 HE3 LYS 43 HE3 LYS 43 -15.325 0.088 -12.533 319 HZ1 LYS 43 HZ1 LYS 43 -16.974 -1.368 -13.601 320 HZ2 LYS 43 HZ2 LYS 43 -17.294 0.270 -13.866 321 HZ3 LYS 43 HZ3 LYS 43 -18.207 -0.596 -12.735 322 H LEU 44 H LEU 44 -17.247 -2.929 -6.558 323 HA LEU 44 HA LEU 44 -16.618 -4.373 -4.895 324 HB2 LEU 44 HB2 LEU 44 -19.574 -4.927 -5.110 325 HB3 LEU 44 HB3 LEU 44 -18.580 -5.595 -3.829 326 HG LEU 44 HG LEU 44 -19.054 -2.650 -4.342 327 HD11 LEU 44 HD11 LEU 44 -21.009 -3.800 -3.419 328 HD12 LEU 44 HD12 LEU 44 -20.294 -2.697 -2.244 329 HD13 LEU 44 HD13 LEU 44 -20.020 -4.436 -2.104 330 HD21 LEU 44 HD21 LEU 44 -17.473 -4.030 -2.165 331 HD22 LEU 44 HD22 LEU 44 -17.850 -2.307 -2.222 332 HD23 LEU 44 HD23 LEU 44 -16.817 -3.024 -3.458 333 H THR 45 H THR 45 -16.571 -5.539 -7.712 334 HA THR 45 HA THR 45 -17.087 -8.362 -7.344 335 HB THR 45 HB THR 45 -17.396 -7.447 -9.571 336 HG1 THR 45 HG1 THR 45 -16.649 -9.231 -10.427 337 HG21 THR 45 HG21 THR 45 -14.442 -6.789 -9.525 338 HG22 THR 45 HG22 THR 45 -15.761 -5.619 -9.466 339 HG23 THR 45 HG23 THR 45 -15.521 -6.603 -10.909 340 H GLU 46 H GLU 46 -15.470 -10.037 -7.500 341 HA GLU 46 HA GLU 46 -13.314 -9.855 -5.791 342 HB2 GLU 46 HB2 GLU 46 -14.181 -11.994 -6.538 343 HB3 GLU 46 HB3 GLU 46 -13.675 -11.668 -8.190 344 HG2 GLU 46 HG2 GLU 46 -11.320 -11.684 -7.444 345 HG3 GLU 46 HG3 GLU 46 -11.863 -12.099 -5.817 346 H GLU 47 H GLU 47 -13.361 -9.256 -9.279 347 HA GLU 47 HA GLU 47 -10.609 -8.897 -9.684 348 HB2 GLU 47 HB2 GLU 47 -12.271 -9.122 -11.510 349 HB3 GLU 47 HB3 GLU 47 -12.884 -7.517 -11.128 350 HG2 GLU 47 HG2 GLU 47 -10.644 -6.588 -11.650 351 HG3 GLU 47 HG3 GLU 47 -10.127 -8.201 -12.137 352 H TYR 48 H TYR 48 -13.097 -6.625 -8.579 353 HA TYR 48 HA TYR 48 -11.613 -4.250 -8.665 354 HB2 TYR 48 HB2 TYR 48 -14.140 -4.703 -8.050 355 HB3 TYR 48 HB3 TYR 48 -13.529 -4.789 -6.403 356 HD1 TYR 48 HD1 TYR 48 -11.809 -2.689 -5.886 357 HD2 TYR 48 HD2 TYR 48 -15.049 -2.672 -8.661 358 HE1 TYR 48 HE1 TYR 48 -11.891 -0.236 -5.764 359 HE2 TYR 48 HE2 TYR 48 -15.129 -0.217 -8.552 360 HH TYR 48 HH TYR 48 -12.683 1.652 -7.262 361 H PHE 49 H PHE 49 -11.826 -6.774 -6.210 362 HA PHE 49 HA PHE 49 -10.149 -5.599 -4.261 363 HB2 PHE 49 HB2 PHE 49 -11.696 -7.533 -3.886 364 HB3 PHE 49 HB3 PHE 49 -10.617 -8.546 -4.832 365 HD1 PHE 49 HD2 PHE 49 -8.436 -9.230 -3.921 366 HD2 PHE 49 HD1 PHE 49 -11.169 -6.899 -1.627 367 HE1 PHE 49 HE2 PHE 49 -7.193 -9.790 -1.873 368 HE2 PHE 49 HE1 PHE 49 -9.930 -7.460 0.423 369 HZ PHE 49 HZ PHE 49 -7.939 -8.907 0.302 370 H ASN 50 H ASN 50 -9.418 -8.212 -6.588 371 HA ASN 50 HA ASN 50 -6.646 -8.269 -6.059 372 HB2 ASN 50 HB2 ASN 50 -8.206 -9.286 -8.443 373 HB3 ASN 50 HB3 ASN 50 -6.520 -9.674 -8.117 374 HD21 ASN 50 HD21 ASN 50 -8.931 -11.371 -8.262 375 HD22 ASN 50 HD22 ASN 50 -8.960 -12.235 -6.768 376 H ALA 51 H ALA 51 -8.323 -5.871 -7.677 377 HA ALA 51 HA ALA 51 -6.207 -5.277 -9.597 378 HB1 ALA 51 HB1 ALA 51 -7.656 -3.501 -10.395 379 HB2 ALA 51 HB2 ALA 51 -8.762 -3.769 -9.046 380 HB3 ALA 51 HB3 ALA 51 -8.552 -5.016 -10.275 381 H VAL 52 H VAL 52 -7.359 -4.081 -6.482 382 HA VAL 52 HA VAL 52 -5.265 -1.990 -6.553 383 HB VAL 52 HB VAL 52 -6.758 -0.453 -5.325 384 HG11 VAL 52 HG11 VAL 52 -7.914 -1.420 -7.946 385 HG12 VAL 52 HG12 VAL 52 -6.584 -0.278 -7.759 386 HG13 VAL 52 HG13 VAL 52 -8.202 0.155 -7.207 387 HG21 VAL 52 HG21 VAL 52 -8.891 -2.537 -5.835 388 HG22 VAL 52 HG22 VAL 52 -9.164 -0.923 -5.175 389 HG23 VAL 52 HG23 VAL 52 -8.219 -2.101 -4.264 390 H ASN 53 H ASN 53 -5.528 -4.729 -5.172 391 HA ASN 53 HA ASN 53 -5.348 -3.859 -2.361 392 HB2 ASN 53 HB2 ASN 53 -6.150 -6.390 -3.698 393 HB3 ASN 53 HB3 ASN 53 -5.334 -6.542 -2.147 394 HD21 ASN 53 HD21 ASN 53 -8.012 -4.836 -3.715 395 HD22 ASN 53 HD22 ASN 53 -9.011 -4.790 -2.308 396 H TYR 54 H TYR 54 -3.123 -3.660 -4.427 397 HA TYR 54 HA TYR 54 -1.066 -4.972 -2.791 398 HB2 TYR 54 HB2 TYR 54 0.108 -5.750 -4.853 399 HB3 TYR 54 HB3 TYR 54 -1.438 -6.549 -4.584 400 HD1 TYR 54 HD1 TYR 54 0.375 -4.138 -6.695 401 HD2 TYR 54 HD2 TYR 54 -3.295 -6.203 -6.090 402 HE1 TYR 54 HE1 TYR 54 -0.370 -3.465 -8.941 403 HE2 TYR 54 HE2 TYR 54 -4.047 -5.542 -8.329 404 HH TYR 54 HH TYR 54 -3.570 -3.686 -9.942 405 H ALA 55 H ALA 55 1.074 -4.122 -3.069 406 HA ALA 55 HA ALA 55 1.249 -1.524 -4.469 407 HB1 ALA 55 HB1 ALA 55 2.613 -0.643 -2.642 408 HB2 ALA 55 HB2 ALA 55 2.426 -2.158 -1.756 409 HB3 ALA 55 HB3 ALA 55 1.022 -1.134 -2.058 410 H GLU 56 H GLU 56 3.115 -1.194 -5.637 411 HA GLU 56 HA GLU 56 4.974 -3.444 -5.834 412 HB2 GLU 56 HB2 GLU 56 4.678 -0.972 -7.558 413 HB3 GLU 56 HB3 GLU 56 5.827 -2.268 -7.853 414 HG2 GLU 56 HG2 GLU 56 3.871 -3.836 -8.029 415 HG3 GLU 56 HG3 GLU 56 2.824 -2.420 -7.967 416 H ILE 57 H ILE 57 6.699 -3.415 -4.531 417 HA ILE 57 HA ILE 57 7.984 -0.837 -3.868 418 HB ILE 57 HB ILE 57 8.270 -3.473 -2.393 419 HG12 ILE 57 HG12 ILE 57 6.994 -2.063 -0.569 420 HG13 ILE 57 HG13 ILE 57 6.416 -1.142 -1.952 421 HG21 ILE 57 HG21 ILE 57 9.179 -0.693 -1.649 422 HG22 ILE 57 HG22 ILE 57 10.212 -2.026 -2.167 423 HG23 ILE 57 HG23 ILE 57 9.334 -2.134 -0.642 424 HD11 ILE 57 HD11 ILE 57 5.469 -3.178 -2.906 425 HD12 ILE 57 HD12 ILE 57 4.821 -2.840 -1.304 426 HD13 ILE 57 HD13 ILE 57 6.043 -4.096 -1.513 427 H ASN 58 H ASN 58 10.244 -0.617 -4.087 428 HA ASN 58 HA ASN 58 11.464 -2.075 -6.202 429 HB2 ASN 58 HB2 ASN 58 11.924 0.307 -5.692 430 HB3 ASN 58 HB3 ASN 58 12.731 -0.180 -4.208 431 HD21 ASN 58 HD21 ASN 58 13.587 1.172 -6.766 432 HD22 ASN 58 HD22 ASN 58 15.009 0.319 -7.240 433 H GLU 59 H GLU 59 13.119 -3.572 -6.192 434 HA GLU 59 HA GLU 59 13.212 -5.610 -4.358 435 HB2 GLU 59 HB2 GLU 59 14.161 -5.733 -6.612 436 HB3 GLU 59 HB3 GLU 59 15.455 -4.644 -6.136 437 HG2 GLU 59 HG2 GLU 59 16.346 -6.823 -6.135 438 HG3 GLU 59 HG3 GLU 59 16.162 -6.354 -4.451 439 H GLU 60 H GLU 60 15.246 -2.708 -4.386 440 HA GLU 60 HA GLU 60 17.049 -3.404 -2.367 441 HB2 GLU 60 HB2 GLU 60 15.980 -0.623 -2.895 442 HB3 GLU 60 HB3 GLU 60 17.521 -1.041 -2.157 443 HG2 GLU 60 HG2 GLU 60 16.689 -1.438 -5.023 444 HG3 GLU 60 HG3 GLU 60 17.930 -0.354 -4.397 445 H ASP 61 H ASP 61 14.043 -1.495 -2.051 446 HA ASP 61 HA ASP 61 14.093 -1.379 0.783 447 HB2 ASP 61 HB2 ASP 61 11.703 -1.127 -1.066 448 HB3 ASP 61 HB3 ASP 61 11.796 -0.554 0.597 449 H TRP 62 H TRP 62 12.731 -3.645 -1.514 450 HA TRP 62 HA TRP 62 11.034 -5.174 0.057 451 HB2 TRP 62 HB2 TRP 62 11.326 -5.402 -2.393 452 HB3 TRP 62 HB3 TRP 62 12.901 -6.134 -2.133 453 HD1 TRP 62 HD1 TRP 62 12.927 -8.668 -1.158 454 HE1 TRP 62 HE1 TRP 62 11.137 -10.518 -1.238 455 HE3 TRP 62 HE3 TRP 62 8.845 -5.807 -2.331 456 HZ2 TRP 62 HZ2 TRP 62 8.375 -10.733 -1.743 457 HZ3 TRP 62 HZ3 TRP 62 6.667 -6.921 -2.593 458 HH2 TRP 62 HH2 TRP 62 6.438 -9.332 -2.306 459 H ASN 63 H ASN 63 14.513 -5.798 -0.548 460 HA ASN 63 HA ASN 63 14.692 -7.886 1.381 461 HB2 ASN 63 HB2 ASN 63 16.816 -6.223 0.014 462 HB3 ASN 63 HB3 ASN 63 17.188 -7.553 1.111 463 HD21 ASN 63 HD21 ASN 63 15.894 -6.682 -1.991 464 HD22 ASN 63 HD22 ASN 63 15.901 -8.270 -2.657 465 H ALA 64 H ALA 64 15.311 -4.407 1.533 466 HA ALA 64 HA ALA 64 16.583 -4.284 4.029 467 HB1 ALA 64 HB1 ALA 64 16.437 -2.398 2.451 468 HB2 ALA 64 HB2 ALA 64 15.936 -1.948 4.080 469 HB3 ALA 64 HB3 ALA 64 14.721 -2.231 2.830 470 H LEU 65 H LEU 65 13.148 -4.466 3.226 471 HA LEU 65 HA LEU 65 12.369 -4.298 6.035 472 HB2 LEU 65 HB2 LEU 65 10.739 -4.698 3.524 473 HB3 LEU 65 HB3 LEU 65 10.059 -4.549 5.135 474 HG LEU 65 HG LEU 65 11.681 -2.397 3.760 475 HD11 LEU 65 HD11 LEU 65 8.690 -2.630 4.111 476 HD12 LEU 65 HD12 LEU 65 9.578 -2.739 2.589 477 HD13 LEU 65 HD13 LEU 65 9.549 -1.221 3.485 478 HD21 LEU 65 HD21 LEU 65 11.820 -2.286 6.186 479 HD22 LEU 65 HD22 LEU 65 10.062 -2.362 6.311 480 HD23 LEU 65 HD23 LEU 65 10.835 -0.962 5.565 481 H GLY 66 H GLY 66 13.358 -6.730 3.900 482 HA2 GLY 66 HA2 GLY 66 13.444 -9.025 4.115 483 HA3 GLY 66 HA3 GLY 66 12.799 -8.840 5.740 484 H LEU 67 H LEU 67 11.441 -8.039 2.549 485 HA LEU 67 HA LEU 67 8.905 -9.226 3.343 486 HB2 LEU 67 HB2 LEU 67 9.727 -7.712 0.861 487 HB3 LEU 67 HB3 LEU 67 8.103 -8.301 1.169 488 HG LEU 67 HG LEU 67 9.571 -6.248 2.837 489 HD11 LEU 67 HD11 LEU 67 7.244 -5.924 0.939 490 HD12 LEU 67 HD12 LEU 67 8.899 -5.384 0.652 491 HD13 LEU 67 HD13 LEU 67 7.949 -4.659 1.949 492 HD21 LEU 67 HD21 LEU 67 6.765 -7.348 3.071 493 HD22 LEU 67 HD22 LEU 67 7.393 -5.966 3.972 494 HD23 LEU 67 HD23 LEU 67 8.083 -7.569 4.225 495 H GLN 68 H GLN 68 7.723 -10.635 1.945 496 HA GLN 68 HA GLN 68 9.249 -12.294 0.075 497 HB2 GLN 68 HB2 GLN 68 9.368 -13.446 2.250 498 HB3 GLN 68 HB3 GLN 68 7.618 -13.368 2.396 499 HG2 GLN 68 HG2 GLN 68 7.420 -14.793 0.385 500 HG3 GLN 68 HG3 GLN 68 9.177 -14.922 0.336 501 HE21 GLN 68 HE21 GLN 68 7.129 -16.982 0.671 502 HE22 GLN 68 HE22 GLN 68 7.516 -17.794 2.144 503 H GLU 69 H GLU 69 8.013 -12.940 -1.655 504 HA GLU 69 HA GLU 69 5.763 -11.420 -2.251 505 HB2 GLU 69 HB2 GLU 69 6.797 -13.951 -3.527 506 HB3 GLU 69 HB3 GLU 69 5.494 -12.978 -4.207 507 HG2 GLU 69 HG2 GLU 69 6.933 -11.094 -4.455 508 HG3 GLU 69 HG3 GLU 69 8.228 -11.901 -3.577 509 H GLY 70 H GLY 70 4.076 -11.493 -0.944 510 HA2 GLY 70 HA2 GLY 70 1.905 -12.940 -1.082 511 HA3 GLY 70 HA3 GLY 70 2.905 -14.090 -0.212 512 H ASP 71 H ASP 71 4.188 -11.648 1.260 513 HA ASP 71 HA ASP 71 2.161 -11.743 3.367 514 HB2 ASP 71 HB2 ASP 71 3.837 -10.675 4.842 515 HB3 ASP 71 HB3 ASP 71 4.384 -12.185 4.142 516 H ARG 72 H ARG 72 2.283 -9.527 4.797 517 HA ARG 72 HA ARG 72 0.913 -7.657 2.969 518 HB2 ARG 72 HB2 ARG 72 0.366 -7.914 5.922 519 HB3 ARG 72 HB3 ARG 72 -0.662 -7.221 4.674 520 HG2 ARG 72 HG2 ARG 72 -0.934 -9.505 3.714 521 HG3 ARG 72 HG3 ARG 72 -0.029 -10.140 5.089 522 HD2 ARG 72 HD2 ARG 72 -1.742 -9.047 6.580 523 HD3 ARG 72 HD3 ARG 72 -2.686 -8.714 5.130 524 HE ARG 72 HE ARG 72 -2.341 -11.255 6.456 525 HH11 ARG 72 HH11 ARG 72 -3.219 -9.739 3.486 526 HH12 ARG 72 HH12 ARG 72 -4.261 -11.033 3.015 527 HH21 ARG 72 HH21 ARG 72 -3.686 -12.896 5.831 528 HH22 ARG 72 HH22 ARG 72 -4.511 -12.795 4.315 529 H VAL 73 H VAL 73 1.308 -5.506 3.060 530 HA VAL 73 HA VAL 73 3.200 -4.504 5.098 531 HB VAL 73 HB VAL 73 4.056 -2.903 3.401 532 HG11 VAL 73 HG11 VAL 73 5.301 -4.937 3.853 533 HG12 VAL 73 HG12 VAL 73 5.414 -4.530 2.141 534 HG13 VAL 73 HG13 VAL 73 4.336 -5.821 2.671 535 HG21 VAL 73 HG21 VAL 73 2.117 -2.877 1.888 536 HG22 VAL 73 HG22 VAL 73 2.450 -4.548 1.425 537 HG23 VAL 73 HG23 VAL 73 3.600 -3.271 1.019 538 H LYS 74 H LYS 74 2.715 -2.584 6.074 539 HA LYS 74 HA LYS 74 0.185 -1.280 5.284 540 HB2 LYS 74 HB2 LYS 74 0.221 -2.161 7.595 541 HB3 LYS 74 HB3 LYS 74 1.623 -1.156 7.951 542 HG2 LYS 74 HG2 LYS 74 0.211 0.849 7.373 543 HG3 LYS 74 HG3 LYS 74 -1.175 -0.238 7.295 544 HD2 LYS 74 HD2 LYS 74 0.587 0.096 9.727 545 HD3 LYS 74 HD3 LYS 74 -0.915 0.981 9.469 546 HE2 LYS 74 HE2 LYS 74 -2.078 -1.244 9.302 547 HE3 LYS 74 HE3 LYS 74 -0.564 -1.990 9.821 548 HZ1 LYS 74 HZ1 LYS 74 -0.657 -0.667 11.848 549 HZ2 LYS 74 HZ2 LYS 74 -2.040 -1.626 11.690 550 HZ3 LYS 74 HZ3 LYS 74 -2.117 0.031 11.349 551 H VAL 75 H VAL 75 0.206 0.765 4.561 552 HA VAL 75 HA VAL 75 2.742 2.278 4.677 553 HB VAL 75 HB VAL 75 0.386 2.687 2.816 554 HG11 VAL 75 HG11 VAL 75 1.927 4.137 1.554 555 HG12 VAL 75 HG12 VAL 75 3.141 3.927 2.816 556 HG13 VAL 75 HG13 VAL 75 1.621 4.744 3.181 557 HG21 VAL 75 HG21 VAL 75 1.800 1.713 1.069 558 HG22 VAL 75 HG22 VAL 75 1.505 0.556 2.368 559 HG23 VAL 75 HG23 VAL 75 3.059 1.385 2.262 560 H LYS 76 H LYS 76 2.848 4.137 5.822 561 HA LYS 76 HA LYS 76 0.324 5.380 6.743 562 HB2 LYS 76 HB2 LYS 76 2.975 5.129 8.173 563 HB3 LYS 76 HB3 LYS 76 1.774 6.319 8.645 564 HG2 LYS 76 HG2 LYS 76 1.463 4.507 10.098 565 HG3 LYS 76 HG3 LYS 76 0.155 4.391 8.923 566 HD2 LYS 76 HD2 LYS 76 1.032 2.194 9.284 567 HD3 LYS 76 HD3 LYS 76 1.520 2.712 7.671 568 HE2 LYS 76 HE2 LYS 76 3.381 1.638 8.747 569 HE3 LYS 76 HE3 LYS 76 3.725 3.361 8.601 570 HZ1 LYS 76 HZ1 LYS 76 2.672 2.077 11.062 571 HZ2 LYS 76 HZ2 LYS 76 3.206 3.676 10.898 572 HZ3 LYS 76 HZ3 LYS 76 4.307 2.395 10.781 573 H THR 77 H THR 77 -0.050 7.390 6.085 574 HA THR 77 HA THR 77 2.226 9.191 5.534 575 HB THR 77 HB THR 77 1.231 10.109 3.566 576 HG1 THR 77 HG1 THR 77 -0.830 9.130 2.805 577 HG21 THR 77 HG21 THR 77 1.140 8.216 2.017 578 HG22 THR 77 HG22 THR 77 0.971 7.102 3.375 579 HG23 THR 77 HG23 THR 77 2.462 8.021 3.169 580 H GLU 78 H GLU 78 1.002 11.491 4.983 581 HA GLU 78 HA GLU 78 -0.164 12.330 7.442 582 HB2 GLU 78 HB2 GLU 78 -0.388 14.522 6.270 583 HB3 GLU 78 HB3 GLU 78 1.233 13.841 6.198 584 HG2 GLU 78 HG2 GLU 78 0.608 12.935 3.913 585 HG3 GLU 78 HG3 GLU 78 -0.826 13.953 4.006 586 H PHE 79 H PHE 79 -1.546 10.736 4.837 587 HA PHE 79 HA PHE 79 -4.201 11.933 5.225 588 HB2 PHE 79 HB2 PHE 79 -3.140 10.017 3.140 589 HB3 PHE 79 HB3 PHE 79 -4.841 10.459 3.266 590 HD1 PHE 79 HD2 PHE 79 -5.588 12.707 2.716 591 HD2 PHE 79 HD1 PHE 79 -1.496 11.597 2.305 592 HE1 PHE 79 HE2 PHE 79 -5.181 14.717 1.359 593 HE2 PHE 79 HE1 PHE 79 -1.085 13.610 0.952 594 HZ PHE 79 HZ PHE 79 -2.927 15.170 0.477 595 H GLY 80 H GLY 80 -2.384 9.117 6.099 596 HA2 GLY 80 HA2 GLY 80 -3.769 8.148 8.123 597 HA3 GLY 80 HA3 GLY 80 -4.799 7.614 6.804 598 H GLU 81 H GLU 81 -4.455 5.421 7.328 599 HA GLU 81 HA GLU 81 -1.923 4.345 6.316 600 HB2 GLU 81 HB2 GLU 81 -1.753 2.722 8.138 601 HB3 GLU 81 HB3 GLU 81 -1.683 4.363 8.760 602 HG2 GLU 81 HG2 GLU 81 -3.908 4.232 9.602 603 HG3 GLU 81 HG3 GLU 81 -4.203 2.712 8.760 604 H VAL 82 H VAL 82 -2.056 2.259 5.409 605 HA VAL 82 HA VAL 82 -4.616 0.851 5.439 606 HB VAL 82 HB VAL 82 -4.776 2.432 3.520 607 HG11 VAL 82 HG11 VAL 82 -2.417 2.548 2.916 608 HG12 VAL 82 HG12 VAL 82 -3.400 2.080 1.528 609 HG13 VAL 82 HG13 VAL 82 -2.456 0.864 2.389 610 HG21 VAL 82 HG21 VAL 82 -4.663 -0.497 2.773 611 HG22 VAL 82 HG22 VAL 82 -5.483 0.763 1.848 612 HG23 VAL 82 HG23 VAL 82 -6.040 0.358 3.471 613 H VAL 83 H VAL 83 -4.456 -1.366 4.865 614 HA VAL 83 HA VAL 83 -1.688 -2.404 4.721 615 HB VAL 83 HB VAL 83 -4.120 -3.886 5.744 616 HG11 VAL 83 HG11 VAL 83 -2.379 -5.362 4.930 617 HG12 VAL 83 HG12 VAL 83 -2.441 -5.435 6.692 618 HG13 VAL 83 HG13 VAL 83 -1.166 -4.513 5.891 619 HG21 VAL 83 HG21 VAL 83 -1.976 -2.468 7.334 620 HG22 VAL 83 HG22 VAL 83 -3.222 -3.519 8.004 621 HG23 VAL 83 HG23 VAL 83 -3.674 -2.007 7.220 622 H VAL 84 H VAL 84 -1.141 -3.241 2.814 623 HA VAL 84 HA VAL 84 -3.169 -4.648 1.182 624 HB VAL 84 HB VAL 84 -2.133 -3.741 -0.869 625 HG11 VAL 84 HG11 VAL 84 -4.110 -2.635 0.053 626 HG12 VAL 84 HG12 VAL 84 -3.041 -1.465 -0.721 627 HG13 VAL 84 HG13 VAL 84 -3.080 -1.596 1.038 628 HG21 VAL 84 HG21 VAL 84 -0.527 -2.012 1.021 629 HG22 VAL 84 HG22 VAL 84 -0.585 -1.831 -0.732 630 HG23 VAL 84 HG23 VAL 84 0.107 -3.288 -0.019 631 H PHE 85 H PHE 85 -1.949 -5.871 -0.708 632 HA PHE 85 HA PHE 85 -0.046 -7.659 0.529 633 HB2 PHE 85 HB2 PHE 85 -1.178 -7.581 -2.281 634 HB3 PHE 85 HB3 PHE 85 -0.111 -8.845 -1.675 635 HD1 PHE 85 HD1 PHE 85 -0.901 -10.236 0.303 636 HD2 PHE 85 HD2 PHE 85 -3.497 -7.701 -1.932 637 HE1 PHE 85 HE1 PHE 85 -2.847 -11.481 1.149 638 HE2 PHE 85 HE2 PHE 85 -5.443 -8.937 -1.080 639 HZ PHE 85 HZ PHE 85 -5.120 -10.829 0.462 640 H ALA 86 H ALA 86 2.095 -8.032 -0.081 641 HA ALA 86 HA ALA 86 3.464 -5.696 -1.156 642 HB1 ALA 86 HB1 ALA 86 4.262 -6.706 0.920 643 HB2 ALA 86 HB2 ALA 86 5.501 -6.763 -0.333 644 HB3 ALA 86 HB3 ALA 86 4.588 -8.217 0.071 645 H LYS 87 H LYS 87 3.785 -5.543 -3.294 646 HA LYS 87 HA LYS 87 4.725 -7.926 -4.779 647 HB2 LYS 87 HB2 LYS 87 3.290 -5.452 -5.743 648 HB3 LYS 87 HB3 LYS 87 4.185 -6.485 -6.838 649 HG2 LYS 87 HG2 LYS 87 2.683 -8.372 -5.960 650 HG3 LYS 87 HG3 LYS 87 1.668 -7.069 -5.330 651 HD2 LYS 87 HD2 LYS 87 1.559 -6.090 -7.600 652 HD3 LYS 87 HD3 LYS 87 2.528 -7.430 -8.209 653 HE2 LYS 87 HE2 LYS 87 0.718 -8.957 -7.351 654 HE3 LYS 87 HE3 LYS 87 -0.257 -7.520 -7.077 655 HZ1 LYS 87 HZ1 LYS 87 -0.798 -8.445 -9.209 656 HZ2 LYS 87 HZ2 LYS 87 0.821 -8.456 -9.682 657 HZ3 LYS 87 HZ3 LYS 87 0.020 -6.986 -9.460 658 H LYS 88 H LYS 88 6.374 -7.631 -6.324 659 HA LYS 88 HA LYS 88 8.331 -5.633 -5.479 660 HB2 LYS 88 HB2 LYS 88 8.865 -8.103 -5.483 661 HB3 LYS 88 HB3 LYS 88 8.763 -8.050 -7.242 662 HG2 LYS 88 HG2 LYS 88 10.548 -6.437 -7.325 663 HG3 LYS 88 HG3 LYS 88 10.611 -6.389 -5.565 664 HD2 LYS 88 HD2 LYS 88 11.169 -8.837 -7.250 665 HD3 LYS 88 HD3 LYS 88 12.406 -7.785 -6.554 666 HE2 LYS 88 HE2 LYS 88 11.524 -8.296 -4.301 667 HE3 LYS 88 HE3 LYS 88 10.363 -9.409 -5.026 668 HZ1 LYS 88 HZ1 LYS 88 12.337 -10.540 -4.167 669 HZ2 LYS 88 HZ2 LYS 88 13.316 -9.656 -5.230 670 HZ3 LYS 88 HZ3 LYS 88 12.177 -10.749 -5.838 671 H GLY 89 H GLY 89 8.418 -3.830 -6.671 672 HA2 GLY 89 HA2 GLY 89 7.466 -3.939 -9.466 673 HA3 GLY 89 HA3 GLY 89 7.378 -2.529 -8.427 674 H ASP 90 H ASP 90 8.324 -2.131 -10.857 675 HA ASP 90 HA ASP 90 11.251 -2.230 -10.820 676 HB2 ASP 90 HB2 ASP 90 9.415 -1.221 -13.008 677 HB3 ASP 90 HB3 ASP 90 11.114 -1.655 -13.163 678 H VAL 91 H VAL 91 9.437 -0.399 -9.188 679 HA VAL 91 HA VAL 91 9.851 2.261 -10.209 680 HB VAL 91 HB VAL 91 8.822 2.991 -8.078 681 HG11 VAL 91 HG11 VAL 91 7.346 0.739 -9.463 682 HG12 VAL 91 HG12 VAL 91 7.385 2.430 -9.969 683 HG13 VAL 91 HG13 VAL 91 6.608 1.984 -8.449 684 HG21 VAL 91 HG21 VAL 91 7.979 1.316 -6.484 685 HG22 VAL 91 HG22 VAL 91 9.739 1.270 -6.598 686 HG23 VAL 91 HG23 VAL 91 8.769 0.038 -7.409 687 HA PRO 92 HA PRO 92 13.762 3.350 -8.329 688 HB2 PRO 92 HB2 PRO 92 12.457 5.813 -7.285 689 HB3 PRO 92 HB3 PRO 92 13.875 5.644 -8.326 690 HG2 PRO 92 HG2 PRO 92 11.536 6.479 -9.312 691 HG3 PRO 92 HG3 PRO 92 12.597 5.412 -10.251 692 HD2 PRO 92 HD2 PRO 92 10.098 4.751 -8.735 693 HD3 PRO 92 HD3 PRO 92 10.666 4.130 -10.300 694 H LYS 93 H LYS 93 14.823 3.437 -6.272 695 HA LYS 93 HA LYS 93 13.472 2.169 -4.142 696 HB2 LYS 93 HB2 LYS 93 15.946 2.099 -4.525 697 HB3 LYS 93 HB3 LYS 93 16.038 3.759 -3.944 698 HG2 LYS 93 HG2 LYS 93 15.056 3.016 -1.791 699 HG3 LYS 93 HG3 LYS 93 15.109 1.353 -2.380 700 HD2 LYS 93 HD2 LYS 93 17.578 1.606 -2.652 701 HD3 LYS 93 HD3 LYS 93 17.450 3.196 -1.892 702 HE2 LYS 93 HE2 LYS 93 16.757 0.524 -0.668 703 HE3 LYS 93 HE3 LYS 93 18.093 1.585 -0.220 704 HZ1 LYS 93 HZ1 LYS 93 16.372 1.875 1.366 705 HZ2 LYS 93 HZ2 LYS 93 15.192 2.083 0.171 706 HZ3 LYS 93 HZ3 LYS 93 16.375 3.268 0.402 707 H GLY 94 H GLY 94 12.890 2.974 -2.023 708 HA2 GLY 94 HA2 GLY 94 11.827 4.488 -0.637 709 HA3 GLY 94 HA3 GLY 94 12.800 5.743 -1.389 710 H MET 95 H MET 95 10.718 3.725 -3.298 711 HA MET 95 HA MET 95 8.536 5.647 -3.332 712 HB2 MET 95 HB2 MET 95 10.284 6.360 -5.029 713 HB3 MET 95 HB3 MET 95 9.983 4.850 -5.875 714 HG2 MET 95 HG2 MET 95 7.708 5.495 -6.305 715 HG3 MET 95 HG3 MET 95 7.907 6.958 -5.338 716 HE1 MET 95 HE1 MET 95 6.713 7.372 -8.130 717 HE2 MET 95 HE2 MET 95 7.716 8.670 -8.777 718 HE3 MET 95 HE3 MET 95 7.218 8.699 -7.084 719 H ILE 96 H ILE 96 6.567 4.617 -3.769 720 HA ILE 96 HA ILE 96 6.692 1.831 -4.727 721 HB ILE 96 HB ILE 96 5.016 1.106 -3.096 722 HG12 ILE 96 HG12 ILE 96 5.370 3.842 -1.829 723 HG13 ILE 96 HG13 ILE 96 3.936 3.302 -2.694 724 HG21 ILE 96 HG21 ILE 96 7.447 2.353 -1.806 725 HG22 ILE 96 HG22 ILE 96 7.376 0.773 -2.586 726 HG23 ILE 96 HG23 ILE 96 6.456 1.069 -1.110 727 HD11 ILE 96 HD11 ILE 96 3.609 3.183 -0.294 728 HD12 ILE 96 HD12 ILE 96 5.006 2.116 -0.140 729 HD13 ILE 96 HD13 ILE 96 3.570 1.570 -1.008 730 H PHE 97 H PHE 97 5.007 1.131 -5.969 731 HA PHE 97 HA PHE 97 3.176 3.227 -6.924 732 HB2 PHE 97 HB2 PHE 97 4.669 2.162 -8.589 733 HB3 PHE 97 HB3 PHE 97 3.949 0.598 -8.220 734 HD1 PHE 97 HD1 PHE 97 1.688 0.058 -8.959 735 HD2 PHE 97 HD2 PHE 97 3.477 3.816 -9.888 736 HE1 PHE 97 HE1 PHE 97 -0.050 0.463 -10.652 737 HE2 PHE 97 HE2 PHE 97 1.744 4.219 -11.585 738 HZ PHE 97 HZ PHE 97 -0.020 2.547 -11.964 739 H ILE 98 H ILE 98 1.152 3.168 -6.166 740 HA ILE 98 HA ILE 98 -0.111 0.533 -5.703 741 HB ILE 98 HB ILE 98 -0.732 3.143 -4.289 742 HG12 ILE 98 HG12 ILE 98 0.584 0.594 -3.299 743 HG13 ILE 98 HG13 ILE 98 1.362 2.162 -3.492 744 HG21 ILE 98 HG21 ILE 98 -1.948 0.396 -3.941 745 HG22 ILE 98 HG22 ILE 98 -2.747 1.819 -4.611 746 HG23 ILE 98 HG23 ILE 98 -2.272 1.794 -2.913 747 HD11 ILE 98 HD11 ILE 98 0.880 1.723 -1.166 748 HD12 ILE 98 HD12 ILE 98 -0.828 1.493 -1.534 749 HD13 ILE 98 HD13 ILE 98 -0.089 3.081 -1.740 750 HA PRO 99 HA PRO 99 -2.807 1.769 -9.111 751 HB2 PRO 99 HB2 PRO 99 -4.773 -0.109 -8.478 752 HB3 PRO 99 HB3 PRO 99 -3.399 -0.380 -9.551 753 HG2 PRO 99 HG2 PRO 99 -3.735 -1.121 -6.675 754 HG3 PRO 99 HG3 PRO 99 -2.931 -2.012 -7.980 755 HD2 PRO 99 HD2 PRO 99 -1.530 -0.675 -6.118 756 HD3 PRO 99 HD3 PRO 99 -0.985 -0.760 -7.809 757 H MET 100 H MET 100 -4.469 3.202 -9.237 758 HA MET 100 HA MET 100 -5.240 4.638 -6.955 759 HB2 MET 100 HB2 MET 100 -5.225 5.293 -9.491 760 HB3 MET 100 HB3 MET 100 -6.871 4.687 -9.484 761 HG2 MET 100 HG2 MET 100 -5.745 7.019 -7.955 762 HG3 MET 100 HG3 MET 100 -6.983 7.031 -9.204 763 HE1 MET 100 HE1 MET 100 -7.529 6.425 -4.732 764 HE2 MET 100 HE2 MET 100 -6.385 7.467 -5.578 765 HE3 MET 100 HE3 MET 100 -6.147 5.719 -5.571 766 H GLY 101 H GLY 101 -6.381 3.659 -5.356 767 HA2 GLY 101 HA2 GLY 101 -9.095 2.746 -5.974 768 HA3 GLY 101 HA3 GLY 101 -8.016 1.540 -5.294 769 HA PRO 102 HA PRO 102 -10.281 3.954 -1.913 770 HB2 PRO 102 HB2 PRO 102 -11.077 1.695 -0.523 771 HB3 PRO 102 HB3 PRO 102 -12.071 2.529 -1.720 772 HG2 PRO 102 HG2 PRO 102 -10.427 0.053 -2.010 773 HG3 PRO 102 HG3 PRO 102 -12.007 0.443 -2.713 774 HD2 PRO 102 HD2 PRO 102 -9.694 0.549 -4.130 775 HD3 PRO 102 HD3 PRO 102 -11.074 1.622 -4.466 776 H TYR 103 H TYR 103 -8.089 1.231 -1.957 777 HA TYR 103 HA TYR 103 -7.024 1.487 0.656 778 HB2 TYR 103 HB2 TYR 103 -5.732 0.381 -1.862 779 HB3 TYR 103 HB3 TYR 103 -5.177 0.101 -0.213 780 HD1 TYR 103 HD2 TYR 103 -8.243 -0.292 -2.318 781 HD2 TYR 103 HD1 TYR 103 -5.883 -1.844 0.870 782 HE1 TYR 103 HE2 TYR 103 -9.746 -2.218 -2.157 783 HE2 TYR 103 HE1 TYR 103 -7.388 -3.778 1.036 784 HH TYR 103 HH TYR 103 -9.171 -4.799 0.209 785 H ALA 104 H ALA 104 -5.847 2.616 -2.511 786 HA ALA 104 HA ALA 104 -3.716 4.183 -1.630 787 HB1 ALA 104 HB1 ALA 104 -3.885 5.343 -3.772 788 HB2 ALA 104 HB2 ALA 104 -5.496 4.670 -4.023 789 HB3 ALA 104 HB3 ALA 104 -4.092 3.604 -3.982 790 H ASN 105 H ASN 105 -7.167 4.990 -1.887 791 HA ASN 105 HA ASN 105 -7.035 7.763 -1.533 792 HB2 ASN 105 HB2 ASN 105 -9.153 5.753 -0.763 793 HB3 ASN 105 HB3 ASN 105 -9.384 7.487 -0.569 794 HD21 ASN 105 HD21 ASN 105 -10.740 5.517 -2.247 795 HD22 ASN 105 HD22 ASN 105 -10.640 6.134 -3.858 796 H MET 106 H MET 106 -6.632 5.201 0.746 797 HA MET 106 HA MET 106 -7.094 6.728 3.120 798 HB2 MET 106 HB2 MET 106 -5.400 4.237 2.939 799 HB3 MET 106 HB3 MET 106 -6.312 4.831 4.322 800 HG2 MET 106 HG2 MET 106 -8.401 4.433 3.000 801 HG3 MET 106 HG3 MET 106 -7.401 3.663 1.777 802 HE1 MET 106 HE1 MET 106 -7.854 2.039 6.076 803 HE2 MET 106 HE2 MET 106 -8.743 3.438 5.477 804 HE3 MET 106 HE3 MET 106 -6.995 3.533 5.697 805 H VAL 107 H VAL 107 -4.392 6.536 0.970 806 HA VAL 107 HA VAL 107 -2.668 7.857 2.968 807 HB VAL 107 HB VAL 107 -0.711 6.561 2.157 808 HG11 VAL 107 HG11 VAL 107 -1.837 5.914 4.222 809 HG12 VAL 107 HG12 VAL 107 -1.232 4.492 3.372 810 HG13 VAL 107 HG13 VAL 107 -2.950 4.890 3.314 811 HG21 VAL 107 HG21 VAL 107 -1.068 4.491 0.884 812 HG22 VAL 107 HG22 VAL 107 -1.572 5.906 -0.040 813 HG23 VAL 107 HG23 VAL 107 -2.782 4.879 0.729 814 H ILE 108 H ILE 108 -3.962 8.056 -0.123 815 HA ILE 108 HA ILE 108 -1.672 9.653 -1.092 816 HB ILE 108 HB ILE 108 -2.285 9.222 -3.343 817 HG12 ILE 108 HG12 ILE 108 -4.365 7.485 -3.566 818 HG13 ILE 108 HG13 ILE 108 -4.915 8.442 -2.195 819 HG21 ILE 108 HG21 ILE 108 -2.245 6.739 -3.470 820 HG22 ILE 108 HG22 ILE 108 -2.520 6.685 -1.729 821 HG23 ILE 108 HG23 ILE 108 -1.047 7.420 -2.366 822 HD11 ILE 108 HD11 ILE 108 -4.788 10.451 -3.492 823 HD12 ILE 108 HD12 ILE 108 -5.736 9.249 -4.370 824 HD13 ILE 108 HD13 ILE 108 -4.068 9.580 -4.844 825 H ASP 109 H ASP 109 -2.445 11.385 -2.763 826 HA ASP 109 HA ASP 109 -4.345 13.085 -1.319 827 HB2 ASP 109 HB2 ASP 109 -2.128 14.006 -1.684 828 HB3 ASP 109 HB3 ASP 109 -2.265 13.736 -3.420 829 HA PRO 110 HA PRO 110 -7.159 12.446 -4.797 830 HB2 PRO 110 HB2 PRO 110 -9.402 13.262 -3.598 831 HB3 PRO 110 HB3 PRO 110 -8.612 11.755 -3.114 832 HG2 PRO 110 HG2 PRO 110 -8.556 14.438 -1.783 833 HG3 PRO 110 HG3 PRO 110 -8.683 12.828 -1.052 834 HD2 PRO 110 HD2 PRO 110 -6.333 14.317 -1.280 835 HD3 PRO 110 HD3 PRO 110 -6.411 12.564 -1.007 836 H SER 111 H SER 111 -5.894 15.307 -3.673 837 HA SER 111 HA SER 111 -7.735 17.117 -5.027 838 HB2 SER 111 HB2 SER 111 -5.109 17.691 -3.622 839 HB3 SER 111 HB3 SER 111 -6.242 18.905 -4.219 840 HG SER 111 HG SER 111 -6.246 17.721 -1.871 841 H THR 112 H THR 112 -5.333 15.131 -6.049 842 HA THR 112 HA THR 112 -3.961 16.728 -7.953 843 HB THR 112 HB THR 112 -3.260 14.639 -8.998 844 HG1 THR 112 HG1 THR 112 -5.258 13.501 -8.885 845 HG21 THR 112 HG21 THR 112 -2.203 15.305 -6.855 846 HG22 THR 112 HG22 THR 112 -2.205 13.557 -7.094 847 HG23 THR 112 HG23 THR 112 -3.370 14.299 -5.993 848 H ASP 113 H ASP 113 -5.631 17.991 -8.910 849 HA ASP 113 HA ASP 113 -7.900 16.889 -10.187 850 HB2 ASP 113 HB2 ASP 113 -7.421 19.331 -9.393 851 HB3 ASP 113 HB3 ASP 113 -6.706 19.535 -10.989 852 H GLY 114 H GLY 114 -7.927 15.669 -11.981 853 HA2 GLY 114 HA2 GLY 114 -5.576 15.292 -13.570 854 HA3 GLY 114 HA3 GLY 114 -7.130 14.518 -13.810 855 H THR 115 H THR 115 -5.439 17.608 -14.320 856 HA THR 115 HA THR 115 -6.863 17.862 -16.907 857 HB THR 115 HB THR 115 -6.603 20.335 -16.706 858 HG1 THR 115 HG1 THR 115 -6.093 20.003 -13.945 859 HG21 THR 115 HG21 THR 115 -8.389 20.684 -15.047 860 HG22 THR 115 HG22 THR 115 -8.147 19.042 -14.447 861 HG23 THR 115 HG23 THR 115 -8.732 19.303 -16.092 862 H GLY 116 H GLY 116 -4.437 16.449 -16.572 863 HA2 GLY 116 HA2 GLY 116 -2.659 16.472 -18.237 864 HA3 GLY 116 HA3 GLY 116 -2.534 18.208 -18.008 865 H MET 117 H MET 117 -2.956 16.596 -15.076 866 HA MET 117 HA MET 117 -0.381 17.299 -14.126 867 HB2 MET 117 HB2 MET 117 -2.676 15.741 -12.955 868 HB3 MET 117 HB3 MET 117 -1.153 15.906 -12.087 869 HG2 MET 117 HG2 MET 117 -2.867 17.579 -11.445 870 HG3 MET 117 HG3 MET 117 -1.360 18.285 -12.029 871 HE1 MET 117 HE1 MET 117 -1.999 20.592 -12.788 872 HE2 MET 117 HE2 MET 117 -3.491 20.327 -11.882 873 HE3 MET 117 HE3 MET 117 -3.557 21.006 -13.508 874 HA PRO 118 HA PRO 118 2.063 13.839 -15.215 875 HB2 PRO 118 HB2 PRO 118 3.973 13.905 -13.279 876 HB3 PRO 118 HB3 PRO 118 3.864 15.106 -14.571 877 HG2 PRO 118 HG2 PRO 118 2.940 15.293 -11.729 878 HG3 PRO 118 HG3 PRO 118 3.755 16.512 -12.725 879 HD2 PRO 118 HD2 PRO 118 1.062 16.500 -12.260 880 HD3 PRO 118 HD3 PRO 118 1.790 17.183 -13.727 881 H GLN 119 H GLN 119 1.532 11.763 -15.054 882 HA GLN 119 HA GLN 119 0.456 10.638 -12.619 883 HB2 GLN 119 HB2 GLN 119 -0.424 10.151 -14.926 884 HB3 GLN 119 HB3 GLN 119 1.053 9.258 -15.252 885 HG2 GLN 119 HG2 GLN 119 0.500 7.620 -13.584 886 HG3 GLN 119 HG3 GLN 119 -0.886 8.568 -13.045 887 HE21 GLN 119 HE21 GLN 119 -0.751 5.812 -14.086 888 HE22 GLN 119 HE22 GLN 119 -1.824 5.781 -15.438 889 H PHE 120 H PHE 120 3.050 11.459 -12.230 890 HA PHE 120 HA PHE 120 4.421 8.941 -11.588 891 HB2 PHE 120 HB2 PHE 120 5.595 11.355 -12.961 892 HB3 PHE 120 HB3 PHE 120 6.603 10.188 -12.113 893 HD1 PHE 120 HD1 PHE 120 6.873 7.918 -12.980 894 HD2 PHE 120 HD2 PHE 120 4.566 10.824 -15.074 895 HE1 PHE 120 HE1 PHE 120 6.949 6.521 -15.002 896 HE2 PHE 120 HE2 PHE 120 4.637 9.428 -17.096 897 HZ PHE 120 HZ PHE 120 5.831 7.276 -17.061 898 H LYS 121 H LYS 121 3.393 12.065 -10.656 899 HA LYS 121 HA LYS 121 5.183 12.265 -8.370 900 HB2 LYS 121 HB2 LYS 121 4.506 14.326 -9.523 901 HB3 LYS 121 HB3 LYS 121 2.817 13.969 -9.182 902 HG2 LYS 121 HG2 LYS 121 3.764 15.679 -7.673 903 HG3 LYS 121 HG3 LYS 121 3.170 14.256 -6.817 904 HD2 LYS 121 HD2 LYS 121 5.538 13.398 -6.802 905 HD3 LYS 121 HD3 LYS 121 6.039 14.966 -7.435 906 HE2 LYS 121 HE2 LYS 121 5.242 16.084 -5.464 907 HE3 LYS 121 HE3 LYS 121 4.500 14.601 -4.862 908 HZ1 LYS 121 HZ1 LYS 121 7.411 15.048 -5.243 909 HZ2 LYS 121 HZ2 LYS 121 6.700 13.624 -4.667 910 HZ3 LYS 121 HZ3 LYS 121 6.597 15.050 -3.762 911 H GLY 122 H GLY 122 4.745 11.502 -6.375 912 HA2 GLY 122 HA2 GLY 122 1.970 10.639 -5.832 913 HA3 GLY 122 HA3 GLY 122 3.361 9.678 -5.377 914 H VAL 123 H VAL 123 1.700 10.094 -3.405 915 HA VAL 123 HA VAL 123 2.633 12.397 -1.832 916 HB VAL 123 HB VAL 123 0.632 10.248 -1.099 917 HG11 VAL 123 HG11 VAL 123 1.657 11.237 0.876 918 HG12 VAL 123 HG12 VAL 123 -0.018 11.764 0.725 919 HG13 VAL 123 HG13 VAL 123 1.293 12.856 0.279 920 HG21 VAL 123 HG21 VAL 123 -0.156 11.588 -2.969 921 HG22 VAL 123 HG22 VAL 123 0.196 13.071 -2.080 922 HG23 VAL 123 HG23 VAL 123 -1.066 11.979 -1.509 923 H LYS 124 H LYS 124 4.354 12.213 -0.518 924 HA LYS 124 HA LYS 124 5.616 9.672 -0.154 925 HB2 LYS 124 HB2 LYS 124 6.285 12.418 0.890 926 HB3 LYS 124 HB3 LYS 124 7.224 10.991 1.307 927 HG2 LYS 124 HG2 LYS 124 7.446 10.636 -1.230 928 HG3 LYS 124 HG3 LYS 124 6.903 12.311 -1.366 929 HD2 LYS 124 HD2 LYS 124 9.331 12.218 -1.380 930 HD3 LYS 124 HD3 LYS 124 8.768 13.011 0.091 931 HE2 LYS 124 HE2 LYS 124 9.102 10.948 1.353 932 HE3 LYS 124 HE3 LYS 124 9.602 10.115 -0.118 933 HZ1 LYS 124 HZ1 LYS 124 11.519 11.528 -0.264 934 HZ2 LYS 124 HZ2 LYS 124 11.477 10.826 1.277 935 HZ3 LYS 124 HZ3 LYS 124 11.017 12.442 1.068 936 H GLY 125 H GLY 125 6.199 8.688 1.767 937 HA2 GLY 125 HA2 GLY 125 5.158 9.284 4.329 938 HA3 GLY 125 HA3 GLY 125 4.131 8.096 3.529 939 H THR 126 H THR 126 4.707 6.443 5.029 940 HA THR 126 HA THR 126 7.395 5.321 4.533 941 HB THR 126 HB THR 126 7.455 4.504 6.898 942 HG1 THR 126 HG1 THR 126 5.737 6.416 7.848 943 HG21 THR 126 HG21 THR 126 7.330 7.512 6.592 944 HG22 THR 126 HG22 THR 126 8.725 6.501 6.216 945 HG23 THR 126 HG23 THR 126 8.152 6.631 7.881 946 H VAL 127 H VAL 127 7.559 3.093 4.485 947 HA VAL 127 HA VAL 127 5.023 1.585 4.668 948 HB VAL 127 HB VAL 127 5.810 1.815 2.324 949 HG11 VAL 127 HG11 VAL 127 7.830 0.616 1.590 950 HG12 VAL 127 HG12 VAL 127 8.225 0.270 3.273 951 HG13 VAL 127 HG13 VAL 127 8.208 1.937 2.696 952 HG21 VAL 127 HG21 VAL 127 5.675 -0.576 1.739 953 HG22 VAL 127 HG22 VAL 127 4.477 -0.117 2.950 954 HG23 VAL 127 HG23 VAL 127 5.930 -0.994 3.436 955 H GLU 128 H GLU 128 5.065 -0.384 5.670 956 HA GLU 128 HA GLU 128 7.588 -1.565 6.549 957 HB2 GLU 128 HB2 GLU 128 6.749 -1.735 8.902 958 HB3 GLU 128 HB3 GLU 128 7.082 -0.081 8.397 959 HG2 GLU 128 HG2 GLU 128 4.765 0.392 8.121 960 HG3 GLU 128 HG3 GLU 128 4.330 -1.303 8.322 961 H LYS 129 H LYS 129 7.398 -3.803 7.066 962 HA LYS 129 HA LYS 129 5.086 -5.207 6.107 963 HB2 LYS 129 HB2 LYS 129 7.345 -6.223 6.061 964 HB3 LYS 129 HB3 LYS 129 7.378 -6.212 7.820 965 HG2 LYS 129 HG2 LYS 129 5.247 -7.647 7.675 966 HG3 LYS 129 HG3 LYS 129 5.694 -7.894 5.988 967 HD2 LYS 129 HD2 LYS 129 7.492 -8.483 8.339 968 HD3 LYS 129 HD3 LYS 129 6.488 -9.682 7.531 969 HE2 LYS 129 HE2 LYS 129 8.544 -8.044 6.064 970 HE3 LYS 129 HE3 LYS 129 8.936 -9.575 6.846 971 HZ1 LYS 129 HZ1 LYS 129 8.445 -9.907 4.523 972 HZ2 LYS 129 HZ2 LYS 129 6.920 -9.189 4.692 973 HZ3 LYS 129 HZ3 LYS 129 7.261 -10.653 5.467 974 H THR 130 H THR 130 3.364 -6.064 7.308 975 HA THR 130 HA THR 130 3.314 -5.238 10.148 976 HB THR 130 HB THR 130 2.050 -3.580 8.894 977 HG1 THR 130 HG1 THR 130 0.941 -3.661 10.698 978 HG21 THR 130 HG21 THR 130 0.298 -5.878 7.999 979 HG22 THR 130 HG22 THR 130 1.408 -4.974 6.968 980 HG23 THR 130 HG23 THR 130 0.009 -4.167 7.683 981 H ASP 131 H ASP 131 1.763 -6.262 11.492 982 HA ASP 131 HA ASP 131 1.435 -9.088 10.925 983 HB2 ASP 131 HB2 ASP 131 2.254 -8.365 13.109 984 HB3 ASP 131 HB3 ASP 131 0.808 -7.395 13.359 985 H GLU 132 H GLU 132 -0.407 -6.253 10.601 986 HA GLU 132 HA GLU 132 -3.008 -7.320 11.131 987 HB2 GLU 132 HB2 GLU 132 -2.099 -4.811 9.718 988 HB3 GLU 132 HB3 GLU 132 -3.791 -5.210 9.985 989 HG2 GLU 132 HG2 GLU 132 -1.725 -4.829 12.143 990 HG3 GLU 132 HG3 GLU 132 -2.934 -3.644 11.650 991 H LYS 133 H LYS 133 -4.710 -7.597 9.636 992 HA LYS 133 HA LYS 133 -3.947 -9.053 7.276 993 HB2 LYS 133 HB2 LYS 133 -6.184 -9.744 7.133 994 HB3 LYS 133 HB3 LYS 133 -5.918 -9.564 8.860 995 HG2 LYS 133 HG2 LYS 133 -7.285 -7.536 7.084 996 HG3 LYS 133 HG3 LYS 133 -8.104 -8.692 8.134 997 HD2 LYS 133 HD2 LYS 133 -7.161 -7.647 10.103 998 HD3 LYS 133 HD3 LYS 133 -6.168 -6.578 9.108 999 HE2 LYS 133 HE2 LYS 133 -8.167 -5.498 8.234 1000 HE3 LYS 133 HE3 LYS 133 -9.191 -6.602 9.150 1001 HZ1 LYS 133 HZ1 LYS 133 -8.191 -5.694 11.193 1002 HZ2 LYS 133 HZ2 LYS 133 -9.031 -4.531 10.302 1003 HZ3 LYS 133 HZ3 LYS 133 -7.345 -4.560 10.265 1004 H VAL 134 H VAL 134 -4.692 -8.598 5.096 1005 HA VAL 134 HA VAL 134 -4.612 -5.843 4.338 1006 HB VAL 134 HB VAL 134 -5.381 -8.307 2.743 1007 HG11 VAL 134 HG11 VAL 134 -4.992 -5.469 1.764 1008 HG12 VAL 134 HG12 VAL 134 -6.510 -6.366 1.777 1009 HG13 VAL 134 HG13 VAL 134 -5.187 -6.887 0.734 1010 HG21 VAL 134 HG21 VAL 134 -3.044 -8.242 3.408 1011 HG22 VAL 134 HG22 VAL 134 -2.883 -6.605 2.769 1012 HG23 VAL 134 HG23 VAL 134 -3.187 -7.954 1.674 1013 H LEU 135 H LEU 135 -6.245 -4.420 4.049 1014 HA LEU 135 HA LEU 135 -8.738 -4.949 5.268 1015 HB2 LEU 135 HB2 LEU 135 -7.579 -2.670 3.742 1016 HB3 LEU 135 HB3 LEU 135 -9.322 -2.706 3.943 1017 HG LEU 135 HG LEU 135 -7.310 -2.746 6.206 1018 HD11 LEU 135 HD11 LEU 135 -9.120 -0.532 5.242 1019 HD12 LEU 135 HD12 LEU 135 -7.365 -0.584 5.067 1020 HD13 LEU 135 HD13 LEU 135 -8.089 -0.480 6.671 1021 HD21 LEU 135 HD21 LEU 135 -10.334 -2.617 6.209 1022 HD22 LEU 135 HD22 LEU 135 -9.304 -2.381 7.626 1023 HD23 LEU 135 HD23 LEU 135 -9.328 -3.940 6.805 1024 H SER 136 H SER 136 -10.605 -5.736 4.521 1025 HA SER 136 HA SER 136 -10.948 -6.444 1.745 1026 HB2 SER 136 HB2 SER 136 -12.870 -6.476 4.094 1027 HB3 SER 136 HB3 SER 136 -13.293 -7.039 2.477 1028 HG SER 136 HG SER 136 -11.047 -8.048 3.884 1029 H VAL 137 H VAL 137 -12.441 -5.489 0.265 1030 HA VAL 137 HA VAL 137 -12.171 -2.779 -0.005 1031 HB VAL 137 HB VAL 137 -14.432 -4.453 -1.113 1032 HG11 VAL 137 HG11 VAL 137 -14.965 -2.085 -1.298 1033 HG12 VAL 137 HG12 VAL 137 -14.569 -2.741 -2.885 1034 HG13 VAL 137 HG13 VAL 137 -13.386 -1.761 -2.019 1035 HG21 VAL 137 HG21 VAL 137 -11.724 -3.761 -2.274 1036 HG22 VAL 137 HG22 VAL 137 -13.010 -4.628 -3.118 1037 HG23 VAL 137 HG23 VAL 137 -12.245 -5.350 -1.703 1038 H LYS 138 H LYS 138 -15.130 -4.377 1.268 1039 HA LYS 138 HA LYS 138 -16.413 -1.881 1.841 1040 HB2 LYS 138 HB2 LYS 138 -17.644 -4.016 1.408 1041 HB3 LYS 138 HB3 LYS 138 -17.097 -4.606 2.973 1042 HG2 LYS 138 HG2 LYS 138 -18.247 -2.691 4.052 1043 HG3 LYS 138 HG3 LYS 138 -18.857 -2.208 2.470 1044 HD2 LYS 138 HD2 LYS 138 -20.574 -3.438 3.622 1045 HD3 LYS 138 HD3 LYS 138 -19.978 -4.417 2.281 1046 HE2 LYS 138 HE2 LYS 138 -18.634 -5.744 3.793 1047 HE3 LYS 138 HE3 LYS 138 -19.072 -4.703 5.149 1048 HZ1 LYS 138 HZ1 LYS 138 -20.359 -6.751 5.125 1049 HZ2 LYS 138 HZ2 LYS 138 -20.962 -6.382 3.590 1050 HZ3 LYS 138 HZ3 LYS 138 -21.361 -5.406 4.911 1051 H GLU 139 H GLU 139 -14.538 -4.181 3.771 1052 HA GLU 139 HA GLU 139 -15.000 -3.138 6.332 1053 HB2 GLU 139 HB2 GLU 139 -13.936 -5.284 6.008 1054 HB3 GLU 139 HB3 GLU 139 -12.613 -4.551 5.114 1055 HG2 GLU 139 HG2 GLU 139 -11.839 -3.441 7.142 1056 HG3 GLU 139 HG3 GLU 139 -13.183 -4.145 8.048 1057 H LEU 140 H LEU 140 -12.689 -2.289 3.831 1058 HA LEU 140 HA LEU 140 -11.231 -0.297 5.098 1059 HB2 LEU 140 HB2 LEU 140 -10.966 -1.459 2.802 1060 HB3 LEU 140 HB3 LEU 140 -12.050 -0.217 2.203 1061 HG LEU 140 HG LEU 140 -9.557 0.516 3.688 1062 HD11 LEU 140 HD11 LEU 140 -8.379 0.656 1.553 1063 HD12 LEU 140 HD12 LEU 140 -9.769 -0.074 0.743 1064 HD13 LEU 140 HD13 LEU 140 -8.855 -0.997 1.937 1065 HD21 LEU 140 HD21 LEU 140 -11.148 1.935 1.550 1066 HD22 LEU 140 HD22 LEU 140 -9.704 2.554 2.353 1067 HD23 LEU 140 HD23 LEU 140 -11.182 2.295 3.278 1068 H LEU 141 H LEU 141 -14.316 -0.141 3.326 1069 HA LEU 141 HA LEU 141 -14.721 2.629 3.401 1070 HB2 LEU 141 HB2 LEU 141 -16.890 0.531 3.632 1071 HB3 LEU 141 HB3 LEU 141 -17.070 2.172 3.042 1072 HG LEU 141 HG LEU 141 -15.569 -0.069 1.675 1073 HD11 LEU 141 HD11 LEU 141 -17.965 -0.331 1.509 1074 HD12 LEU 141 HD12 LEU 141 -17.310 0.169 -0.051 1075 HD13 LEU 141 HD13 LEU 141 -18.144 1.341 0.972 1076 HD21 LEU 141 HD21 LEU 141 -15.253 1.498 -0.180 1077 HD22 LEU 141 HD22 LEU 141 -14.441 2.052 1.284 1078 HD23 LEU 141 HD23 LEU 141 -15.964 2.792 0.787 1079 H GLU 142 H GLU 142 -15.718 0.116 5.707 1080 HA GLU 142 HA GLU 142 -16.947 1.811 7.587 1081 HB2 GLU 142 HB2 GLU 142 -15.572 -0.853 8.049 1082 HB3 GLU 142 HB3 GLU 142 -16.680 -0.068 9.169 1083 HG2 GLU 142 HG2 GLU 142 -18.474 -0.229 7.485 1084 HG3 GLU 142 HG3 GLU 142 -17.362 -1.055 6.397 1085 H ALA 143 H ALA 143 -13.580 0.915 7.115 1086 HA ALA 143 HA ALA 143 -12.599 2.015 9.557 1087 HB1 ALA 143 HB1 ALA 143 -11.094 1.464 6.998 1088 HB2 ALA 143 HB2 ALA 143 -11.390 0.295 8.287 1089 HB3 ALA 143 HB3 ALA 143 -10.390 1.716 8.597 1090 H ILE 144 H ILE 144 -12.762 3.322 6.223 1091 HA ILE 144 HA ILE 144 -11.390 5.738 6.932 1092 HB ILE 144 HB ILE 144 -12.042 6.557 4.664 1093 HG12 ILE 144 HG12 ILE 144 -12.879 4.605 3.130 1094 HG13 ILE 144 HG13 ILE 144 -13.521 3.931 4.622 1095 HG21 ILE 144 HG21 ILE 144 -10.602 4.972 3.466 1096 HG22 ILE 144 HG22 ILE 144 -10.738 3.846 4.815 1097 HG23 ILE 144 HG23 ILE 144 -9.948 5.405 5.045 1098 HD11 ILE 144 HD11 ILE 144 -14.218 6.619 3.459 1099 HD12 ILE 144 HD12 ILE 144 -14.882 5.924 4.940 1100 HD13 ILE 144 HD13 ILE 144 -15.208 5.162 3.384 1101 H GLY 145 H GLY 145 -14.550 4.772 7.477 1102 HA2 GLY 145 HA2 GLY 145 -15.484 6.754 8.952 1103 HA3 GLY 145 HA3 GLY 145 -15.651 7.494 7.368 1104 H SER 146 H SER 146 -16.487 5.252 5.890 1105 HA SER 146 HA SER 146 -19.268 5.291 6.403 1106 HB2 SER 146 HB2 SER 146 -17.699 3.364 4.664 1107 HB3 SER 146 HB3 SER 146 -19.441 3.628 4.594 1108 HG SER 146 HG SER 146 -19.035 5.209 3.290 Start of MODEL 6 1 H1 MET 1 H1 MET 1 -44.579 -19.543 36.287 2 H2 MET 1 H2 MET 1 -46.140 -19.787 36.880 3 H3 MET 1 H3 MET 1 -44.828 -20.532 37.637 4 HA MET 1 HA MET 1 -45.299 -17.611 37.481 5 HB2 MET 1 HB2 MET 1 -45.641 -19.537 39.793 6 HB3 MET 1 HB3 MET 1 -45.721 -17.785 39.938 7 HG2 MET 1 HG2 MET 1 -47.944 -18.767 39.861 8 HG3 MET 1 HG3 MET 1 -47.657 -17.739 38.455 9 HE1 MET 1 HE1 MET 1 -50.070 -19.735 38.535 10 HE2 MET 1 HE2 MET 1 -49.963 -20.511 36.955 11 HE3 MET 1 HE3 MET 1 -49.685 -18.775 37.105 12 H GLY 2 H GLY 2 -43.676 -16.304 38.253 13 HA2 GLY 2 HA2 GLY 2 -41.697 -15.903 39.561 14 HA3 GLY 2 HA3 GLY 2 -41.268 -17.596 39.375 15 H SER 3 H SER 3 -39.391 -15.636 38.882 16 HA SER 3 HA SER 3 -38.734 -16.243 36.125 17 HB2 SER 3 HB2 SER 3 -38.379 -13.928 35.409 18 HB3 SER 3 HB3 SER 3 -40.062 -14.176 35.864 19 HG SER 3 HG SER 3 -39.568 -13.196 37.885 20 H SER 4 H SER 4 -36.774 -17.095 36.414 21 HA SER 4 HA SER 4 -34.989 -16.179 38.491 22 HB2 SER 4 HB2 SER 4 -35.138 -18.586 37.808 23 HB3 SER 4 HB3 SER 4 -34.389 -18.155 36.270 24 HG SER 4 HG SER 4 -32.506 -18.043 37.224 25 H HIS 5 H HIS 5 -32.814 -15.425 38.137 26 HA HIS 5 HA HIS 5 -32.095 -14.379 35.540 27 HB2 HIS 5 HB2 HIS 5 -31.885 -11.997 36.495 28 HB3 HIS 5 HB3 HIS 5 -33.495 -12.566 36.067 29 HD1 HIS 5 HD1 HIS 5 -35.193 -12.864 37.969 30 HD2 HIS 5 HD2 HIS 5 -31.434 -11.664 39.281 31 HE1 HIS 5 HE1 HIS 5 -35.496 -12.206 40.370 32 HE2 HIS 5 HE2 HIS 5 -33.204 -11.550 41.162 33 H HIS 6 H HIS 6 -30.234 -15.662 35.817 34 HA HIS 6 HA HIS 6 -28.244 -14.514 37.684 35 HB2 HIS 6 HB2 HIS 6 -28.745 -16.888 38.151 36 HB3 HIS 6 HB3 HIS 6 -28.302 -17.308 36.500 37 HD1 HIS 6 HD1 HIS 6 -26.739 -15.956 39.676 38 HD2 HIS 6 HD2 HIS 6 -25.615 -17.801 36.127 39 HE1 HIS 6 HE1 HIS 6 -24.294 -16.445 39.923 40 HE2 HIS 6 HE2 HIS 6 -23.685 -17.738 37.855 41 H HIS 7 H HIS 7 -26.591 -13.442 36.777 42 HA HIS 7 HA HIS 7 -25.848 -14.062 33.993 43 HB2 HIS 7 HB2 HIS 7 -25.556 -11.580 33.610 44 HB3 HIS 7 HB3 HIS 7 -27.220 -12.132 33.762 45 HD1 HIS 7 HD1 HIS 7 -28.609 -11.162 35.648 46 HD2 HIS 7 HD2 HIS 7 -24.613 -10.045 35.840 47 HE1 HIS 7 HE1 HIS 7 -28.492 -9.394 37.416 48 HE2 HIS 7 HE2 HIS 7 -26.100 -8.627 37.409 49 H HIS 8 H HIS 8 -23.732 -14.202 33.609 50 HA HIS 8 HA HIS 8 -21.759 -12.909 35.310 51 HB2 HIS 8 HB2 HIS 8 -22.236 -14.993 36.529 52 HB3 HIS 8 HB3 HIS 8 -21.921 -15.931 35.075 53 HD1 HIS 8 HD1 HIS 8 -19.612 -16.815 34.871 54 HD2 HIS 8 HD2 HIS 8 -19.793 -13.551 37.435 55 HE1 HIS 8 HE1 HIS 8 -17.314 -16.599 35.850 56 HE2 HIS 8 HE2 HIS 8 -17.516 -14.767 37.561 57 H HIS 9 H HIS 9 -19.768 -12.627 34.243 58 HA HIS 9 HA HIS 9 -19.529 -13.740 31.532 59 HB2 HIS 9 HB2 HIS 9 -20.711 -11.667 31.194 60 HB3 HIS 9 HB3 HIS 9 -19.585 -10.796 32.224 61 HD1 HIS 9 HD1 HIS 9 -19.746 -12.462 28.829 62 HD2 HIS 9 HD2 HIS 9 -17.397 -9.760 30.936 63 HE1 HIS 9 HE1 HIS 9 -18.097 -11.564 27.164 64 HE2 HIS 9 HE2 HIS 9 -16.790 -9.822 28.427 65 H HIS 10 H HIS 10 -17.478 -13.993 30.771 66 HA HIS 10 HA HIS 10 -15.250 -12.584 32.031 67 HB2 HIS 10 HB2 HIS 10 -15.714 -15.482 32.267 68 HB3 HIS 10 HB3 HIS 10 -14.114 -15.079 31.657 69 HD1 HIS 10 HD1 HIS 10 -12.415 -14.273 33.331 70 HD2 HIS 10 HD2 HIS 10 -16.265 -14.390 34.891 71 HE1 HIS 10 HE1 HIS 10 -12.158 -13.830 35.786 72 HE2 HIS 10 HE2 HIS 10 -14.479 -14.038 36.731 73 H SER 11 H SER 11 -14.012 -11.720 30.511 74 HA SER 11 HA SER 11 -13.410 -13.140 28.035 75 HB2 SER 11 HB2 SER 11 -14.005 -11.152 26.627 76 HB3 SER 11 HB3 SER 11 -15.404 -11.926 27.365 77 HG SER 11 HG SER 11 -14.344 -9.406 27.776 78 H SER 12 H SER 12 -11.353 -12.706 27.325 79 HA SER 12 HA SER 12 -9.952 -10.313 28.208 80 HB2 SER 12 HB2 SER 12 -9.000 -13.059 29.082 81 HB3 SER 12 HB3 SER 12 -8.129 -11.545 29.326 82 HG SER 12 HG SER 12 -9.355 -11.123 30.981 83 H GLY 13 H GLY 13 -8.537 -9.656 26.696 84 HA2 GLY 13 HA2 GLY 13 -7.594 -11.590 24.665 85 HA3 GLY 13 HA3 GLY 13 -7.604 -9.840 24.488 86 H ARG 14 H ARG 14 -5.282 -11.019 23.813 87 HA ARG 14 HA ARG 14 -3.456 -9.964 25.767 88 HB2 ARG 14 HB2 ARG 14 -3.881 -12.173 26.749 89 HB3 ARG 14 HB3 ARG 14 -3.393 -12.946 25.248 90 HG2 ARG 14 HG2 ARG 14 -1.134 -12.319 25.532 91 HG3 ARG 14 HG3 ARG 14 -1.535 -11.159 26.800 92 HD2 ARG 14 HD2 ARG 14 -1.859 -14.157 27.019 93 HD3 ARG 14 HD3 ARG 14 -0.508 -13.233 27.677 94 HE ARG 14 HE ARG 14 -3.221 -12.546 28.543 95 HH11 ARG 14 HH11 ARG 14 -0.142 -13.911 29.280 96 HH12 ARG 14 HH12 ARG 14 -0.429 -13.897 30.984 97 HH21 ARG 14 HH21 ARG 14 -3.565 -12.519 30.727 98 HH22 ARG 14 HH22 ARG 14 -2.347 -13.129 31.795 99 H GLU 15 H GLU 15 -1.620 -9.274 24.888 100 HA GLU 15 HA GLU 15 -1.217 -9.594 22.021 101 HB2 GLU 15 HB2 GLU 15 0.415 -7.768 22.301 102 HB3 GLU 15 HB3 GLU 15 -1.153 -7.357 22.984 103 HG2 GLU 15 HG2 GLU 15 -0.175 -8.145 25.224 104 HG3 GLU 15 HG3 GLU 15 1.391 -8.046 24.422 105 H ASN 16 H ASN 16 1.328 -9.440 21.479 106 HA ASN 16 HA ASN 16 2.815 -11.469 22.992 107 HB2 ASN 16 HB2 ASN 16 1.466 -12.507 21.076 108 HB3 ASN 16 HB3 ASN 16 2.520 -11.629 19.980 109 HD21 ASN 16 HD21 ASN 16 2.083 -14.514 20.430 110 HD22 ASN 16 HD22 ASN 16 3.652 -15.173 20.737 111 H LEU 17 H LEU 17 5.134 -11.512 22.392 112 HA LEU 17 HA LEU 17 6.390 -9.083 22.505 113 HB2 LEU 17 HB2 LEU 17 7.322 -11.427 22.845 114 HB3 LEU 17 HB3 LEU 17 7.629 -11.444 21.120 115 HG LEU 17 HG LEU 17 8.740 -9.249 22.862 116 HD11 LEU 17 HD11 LEU 17 10.796 -10.553 23.087 117 HD12 LEU 17 HD12 LEU 17 10.001 -11.935 22.330 118 HD13 LEU 17 HD13 LEU 17 9.427 -11.327 23.884 119 HD21 LEU 17 HD21 LEU 17 8.833 -8.905 20.448 120 HD22 LEU 17 HD22 LEU 17 9.658 -10.450 20.244 121 HD23 LEU 17 HD23 LEU 17 10.450 -9.133 21.112 122 H TYR 18 H TYR 18 6.970 -7.493 21.127 123 HA TYR 18 HA TYR 18 5.868 -7.621 18.430 124 HB2 TYR 18 HB2 TYR 18 6.943 -5.296 20.044 125 HB3 TYR 18 HB3 TYR 18 6.247 -5.157 18.432 126 HD1 TYR 18 HD1 TYR 18 5.476 -6.095 21.943 127 HD2 TYR 18 HD2 TYR 18 3.900 -5.032 18.131 128 HE1 TYR 18 HE1 TYR 18 3.242 -5.858 22.935 129 HE2 TYR 18 HE2 TYR 18 1.663 -4.793 19.118 130 HH TYR 18 HH TYR 18 1.163 -4.933 22.579 131 H PHE 19 H PHE 19 6.998 -7.546 16.568 132 HA PHE 19 HA PHE 19 9.900 -7.611 16.617 133 HB2 PHE 19 HB2 PHE 19 7.930 -7.762 14.319 134 HB3 PHE 19 HB3 PHE 19 9.676 -7.923 14.147 135 HD1 PHE 19 HD1 PHE 19 10.836 -9.841 15.324 136 HD2 PHE 19 HD2 PHE 19 6.598 -9.615 14.923 137 HE1 PHE 19 HE1 PHE 19 10.665 -12.252 15.781 138 HE2 PHE 19 HE2 PHE 19 6.426 -12.027 15.379 139 HZ PHE 19 HZ PHE 19 8.460 -13.348 15.808 140 H GLN 20 H GLN 20 10.843 -6.285 14.536 141 HA GLN 20 HA GLN 20 10.638 -3.542 15.423 142 HB2 GLN 20 HB2 GLN 20 12.826 -4.479 14.973 143 HB3 GLN 20 HB3 GLN 20 12.364 -4.852 13.318 144 HG2 GLN 20 HG2 GLN 20 12.158 -2.458 12.836 145 HG3 GLN 20 HG3 GLN 20 12.621 -2.088 14.496 146 HE21 GLN 20 HE21 GLN 20 14.412 -0.910 13.790 147 HE22 GLN 20 HE22 GLN 20 15.830 -1.694 13.194 148 H GLY 21 H GLY 21 9.979 -5.263 12.378 149 HA2 GLY 21 HA2 GLY 21 8.586 -4.630 10.615 150 HA3 GLY 21 HA3 GLY 21 8.215 -3.139 11.473 151 H HIS 22 H HIS 22 10.308 -1.707 11.709 152 HA HIS 22 HA HIS 22 11.977 -0.457 10.814 153 HB2 HIS 22 HB2 HIS 22 13.135 -2.653 10.624 154 HB3 HIS 22 HB3 HIS 22 12.477 -2.836 9.004 155 HD1 HIS 22 HD1 HIS 22 15.177 -1.166 10.917 156 HD2 HIS 22 HD2 HIS 22 13.683 -1.156 7.040 157 HE1 HIS 22 HE1 HIS 22 16.938 -0.052 9.527 158 HE2 HIS 22 HE2 HIS 22 16.086 -0.210 7.165 159 H MET 23 H MET 23 10.465 1.063 9.977 160 HA MET 23 HA MET 23 9.367 0.734 7.339 161 HB2 MET 23 HB2 MET 23 8.438 3.001 7.647 162 HB3 MET 23 HB3 MET 23 8.047 1.916 8.972 163 HG2 MET 23 HG2 MET 23 9.543 2.989 10.436 164 HG3 MET 23 HG3 MET 23 10.354 3.836 9.120 165 HE1 MET 23 HE1 MET 23 6.789 3.438 10.850 166 HE2 MET 23 HE2 MET 23 6.503 3.457 9.109 167 HE3 MET 23 HE3 MET 23 5.954 4.804 10.105 168 H LEU 24 H LEU 24 9.705 1.994 5.535 169 HA LEU 24 HA LEU 24 12.261 3.477 5.397 170 HB2 LEU 24 HB2 LEU 24 10.858 1.701 3.420 171 HB3 LEU 24 HB3 LEU 24 11.970 2.935 2.860 172 HG LEU 24 HG LEU 24 12.871 0.961 4.931 173 HD11 LEU 24 HD11 LEU 24 13.663 -0.522 3.151 174 HD12 LEU 24 HD12 LEU 24 12.860 0.487 1.946 175 HD13 LEU 24 HD13 LEU 24 11.905 -0.395 3.138 176 HD21 LEU 24 HD21 LEU 24 15.050 1.386 3.902 177 HD22 LEU 24 HD22 LEU 24 14.290 2.887 4.432 178 HD23 LEU 24 HD23 LEU 24 14.290 2.453 2.719 179 H GLU 25 H GLU 25 12.255 5.509 4.545 180 HA GLU 25 HA GLU 25 9.708 6.803 4.138 181 HB2 GLU 25 HB2 GLU 25 12.539 7.728 4.296 182 HB3 GLU 25 HB3 GLU 25 11.370 8.770 3.485 183 HG2 GLU 25 HG2 GLU 25 10.016 8.907 5.430 184 HG3 GLU 25 HG3 GLU 25 10.943 7.652 6.237 185 H VAL 26 H VAL 26 8.645 6.687 2.373 186 HA VAL 26 HA VAL 26 10.030 6.510 -0.235 187 HB VAL 26 HB VAL 26 8.475 4.746 -0.977 188 HG11 VAL 26 HG11 VAL 26 10.654 4.074 -0.108 189 HG12 VAL 26 HG12 VAL 26 9.428 2.872 0.297 190 HG13 VAL 26 HG13 VAL 26 9.997 4.001 1.528 191 HG21 VAL 26 HG21 VAL 26 7.526 4.744 1.895 192 HG22 VAL 26 HG22 VAL 26 7.081 3.550 0.673 193 HG23 VAL 26 HG23 VAL 26 6.592 5.233 0.482 194 H GLU 27 H GLU 27 8.651 7.005 -2.095 195 HA GLU 27 HA GLU 27 6.405 8.768 -1.403 196 HB2 GLU 27 HB2 GLU 27 8.195 9.647 -2.904 197 HB3 GLU 27 HB3 GLU 27 7.750 8.429 -4.095 198 HG2 GLU 27 HG2 GLU 27 5.613 9.407 -4.435 199 HG3 GLU 27 HG3 GLU 27 5.798 10.462 -3.035 200 H VAL 28 H VAL 28 4.421 8.022 -1.514 201 HA VAL 28 HA VAL 28 3.864 5.425 -2.714 202 HB VAL 28 HB VAL 28 2.057 7.173 -1.021 203 HG11 VAL 28 HG11 VAL 28 0.827 5.533 -2.323 204 HG12 VAL 28 HG12 VAL 28 0.810 5.091 -0.617 205 HG13 VAL 28 HG13 VAL 28 1.878 4.242 -1.736 206 HG21 VAL 28 HG21 VAL 28 2.687 5.717 0.865 207 HG22 VAL 28 HG22 VAL 28 4.063 6.621 0.235 208 HG23 VAL 28 HG23 VAL 28 3.875 4.913 -0.163 209 H ILE 29 H ILE 29 3.243 5.429 -4.792 210 HA ILE 29 HA ILE 29 1.910 7.766 -5.929 211 HB ILE 29 HB ILE 29 2.650 5.280 -7.459 212 HG12 ILE 29 HG12 ILE 29 4.500 7.626 -6.936 213 HG13 ILE 29 HG13 ILE 29 4.608 6.089 -6.081 214 HG21 ILE 29 HG21 ILE 29 2.409 8.202 -8.201 215 HG22 ILE 29 HG22 ILE 29 1.284 6.910 -8.628 216 HG23 ILE 29 HG23 ILE 29 2.913 6.917 -9.305 217 HD11 ILE 29 HD11 ILE 29 6.222 6.161 -7.843 218 HD12 ILE 29 HD12 ILE 29 4.969 6.530 -9.030 219 HD13 ILE 29 HD13 ILE 29 4.992 4.956 -8.226 220 H SER 30 H SER 30 -0.072 7.675 -7.048 221 HA SER 30 HA SER 30 -1.634 5.183 -6.775 222 HB2 SER 30 HB2 SER 30 -2.501 7.009 -5.297 223 HB3 SER 30 HB3 SER 30 -2.787 7.985 -6.736 224 HG SER 30 HG SER 30 -3.862 5.398 -6.633 225 H GLY 31 H GLY 31 -1.225 4.389 -8.806 226 HA2 GLY 31 HA2 GLY 31 -1.258 6.109 -11.135 227 HA3 GLY 31 HA3 GLY 31 -0.973 4.379 -11.117 228 H ARG 32 H ARG 32 -2.701 6.152 -12.808 229 HA ARG 32 HA ARG 32 -5.425 5.697 -12.191 230 HB2 ARG 32 HB2 ARG 32 -4.566 7.483 -13.701 231 HB3 ARG 32 HB3 ARG 32 -4.184 6.253 -14.896 232 HG2 ARG 32 HG2 ARG 32 -6.506 5.730 -15.198 233 HG3 ARG 32 HG3 ARG 32 -6.965 6.770 -13.848 234 HD2 ARG 32 HD2 ARG 32 -6.051 8.715 -15.098 235 HD3 ARG 32 HD3 ARG 32 -5.731 7.646 -16.463 236 HE ARG 32 HE ARG 32 -8.254 7.237 -16.361 237 HH11 ARG 32 HH11 ARG 32 -6.781 10.206 -15.442 238 HH12 ARG 32 HH12 ARG 32 -8.143 11.159 -15.900 239 HH21 ARG 32 HH21 ARG 32 -9.998 8.450 -16.945 240 HH22 ARG 32 HH22 ARG 32 -9.950 10.171 -16.767 241 H THR 33 H THR 33 -5.461 3.457 -11.650 242 HA THR 33 HA THR 33 -5.210 1.543 -13.876 243 HB THR 33 HB THR 33 -5.340 -0.205 -12.104 244 HG1 THR 33 HG1 THR 33 -6.484 1.231 -10.571 245 HG21 THR 33 HG21 THR 33 -3.112 0.206 -11.146 246 HG22 THR 33 HG22 THR 33 -3.200 1.888 -11.668 247 HG23 THR 33 HG23 THR 33 -3.154 0.596 -12.866 248 H LEU 34 H LEU 34 -6.941 0.492 -14.701 249 HA LEU 34 HA LEU 34 -9.100 0.053 -15.244 250 HB2 LEU 34 HB2 LEU 34 -9.419 0.244 -12.249 251 HB3 LEU 34 HB3 LEU 34 -10.770 -0.110 -13.304 252 HG LEU 34 HG LEU 34 -9.564 -2.148 -14.099 253 HD11 LEU 34 HD11 LEU 34 -7.666 -2.988 -12.800 254 HD12 LEU 34 HD12 LEU 34 -7.608 -1.471 -11.903 255 HD13 LEU 34 HD13 LEU 34 -7.274 -1.485 -13.634 256 HD21 LEU 34 HD21 LEU 34 -11.259 -2.309 -12.362 257 HD22 LEU 34 HD22 LEU 34 -10.049 -1.976 -11.122 258 HD23 LEU 34 HD23 LEU 34 -9.959 -3.465 -12.066 259 H ASN 35 H ASN 35 -11.511 0.992 -14.774 260 HA ASN 35 HA ASN 35 -11.282 3.833 -15.384 261 HB2 ASN 35 HB2 ASN 35 -13.640 1.935 -15.484 262 HB3 ASN 35 HB3 ASN 35 -13.729 3.643 -15.911 263 HD21 ASN 35 HD21 ASN 35 -12.819 4.343 -17.816 264 HD22 ASN 35 HD22 ASN 35 -12.271 3.260 -19.043 265 H GLN 36 H GLN 36 -11.369 5.285 -13.801 266 HA GLN 36 HA GLN 36 -12.638 4.794 -11.260 267 HB2 GLN 36 HB2 GLN 36 -11.308 7.205 -12.500 268 HB3 GLN 36 HB3 GLN 36 -12.150 7.318 -10.964 269 HG2 GLN 36 HG2 GLN 36 -9.796 7.051 -10.575 270 HG3 GLN 36 HG3 GLN 36 -10.646 5.607 -10.030 271 HE21 GLN 36 HE21 GLN 36 -10.296 3.668 -11.103 272 HE22 GLN 36 HE22 GLN 36 -9.031 3.459 -12.259 273 H GLY 37 H GLY 37 -13.759 7.522 -10.969 274 HA2 GLY 37 HA2 GLY 37 -15.662 8.747 -11.516 275 HA3 GLY 37 HA3 GLY 37 -15.916 7.699 -12.905 276 H ALA 38 H ALA 38 -16.347 5.272 -12.045 277 HA ALA 38 HA ALA 38 -18.867 5.343 -10.724 278 HB1 ALA 38 HB1 ALA 38 -18.214 3.634 -12.412 279 HB2 ALA 38 HB2 ALA 38 -18.866 2.941 -10.927 280 HB3 ALA 38 HB3 ALA 38 -17.125 2.924 -11.218 281 H THR 39 H THR 39 -19.450 4.841 -8.641 282 HA THR 39 HA THR 39 -17.536 4.895 -6.534 283 HB THR 39 HB THR 39 -19.383 4.277 -5.038 284 HG1 THR 39 HG1 THR 39 -21.520 4.137 -6.443 285 HG21 THR 39 HG21 THR 39 -20.244 6.246 -7.166 286 HG22 THR 39 HG22 THR 39 -19.259 6.610 -5.749 287 HG23 THR 39 HG23 THR 39 -20.941 6.116 -5.552 288 H VAL 40 H VAL 40 -16.956 3.169 -5.073 289 HA VAL 40 HA VAL 40 -16.307 0.701 -6.242 290 HB VAL 40 HB VAL 40 -15.830 -0.142 -4.002 291 HG11 VAL 40 HG11 VAL 40 -15.012 2.748 -4.322 292 HG12 VAL 40 HG12 VAL 40 -14.190 1.344 -5.001 293 HG13 VAL 40 HG13 VAL 40 -14.237 1.576 -3.255 294 HG21 VAL 40 HG21 VAL 40 -16.338 1.171 -2.000 295 HG22 VAL 40 HG22 VAL 40 -17.809 0.698 -2.849 296 HG23 VAL 40 HG23 VAL 40 -17.204 2.350 -2.988 297 H GLU 41 H GLU 41 -19.226 1.814 -4.754 298 HA GLU 41 HA GLU 41 -20.596 -0.611 -4.340 299 HB2 GLU 41 HB2 GLU 41 -21.360 1.577 -3.501 300 HB3 GLU 41 HB3 GLU 41 -21.670 2.104 -5.148 301 HG2 GLU 41 HG2 GLU 41 -23.294 0.145 -5.298 302 HG3 GLU 41 HG3 GLU 41 -23.137 0.033 -3.545 303 H GLU 42 H GLU 42 -20.686 1.622 -7.147 304 HA GLU 42 HA GLU 42 -22.183 0.054 -8.907 305 HB2 GLU 42 HB2 GLU 42 -20.006 2.085 -9.381 306 HB3 GLU 42 HB3 GLU 42 -20.830 1.293 -10.715 307 HG2 GLU 42 HG2 GLU 42 -22.207 2.902 -8.574 308 HG3 GLU 42 HG3 GLU 42 -21.725 3.533 -10.148 309 H LYS 43 H LYS 43 -18.696 0.081 -8.332 310 HA LYS 43 HA LYS 43 -18.317 -2.166 -10.191 311 HB2 LYS 43 HB2 LYS 43 -16.283 -0.429 -8.763 312 HB3 LYS 43 HB3 LYS 43 -15.918 -1.646 -9.981 313 HG2 LYS 43 HG2 LYS 43 -17.077 -0.366 -11.674 314 HG3 LYS 43 HG3 LYS 43 -17.611 0.804 -10.467 315 HD2 LYS 43 HD2 LYS 43 -15.723 1.675 -11.742 316 HD3 LYS 43 HD3 LYS 43 -15.283 1.447 -10.049 317 HE2 LYS 43 HE2 LYS 43 -13.508 0.707 -11.569 318 HE3 LYS 43 HE3 LYS 43 -14.139 -0.626 -10.602 319 HZ1 LYS 43 HZ1 LYS 43 -15.512 -1.266 -12.515 320 HZ2 LYS 43 HZ2 LYS 43 -13.862 -1.324 -12.867 321 HZ3 LYS 43 HZ3 LYS 43 -14.800 -0.040 -13.438 322 H LEU 44 H LEU 44 -19.603 -2.549 -7.575 323 HA LEU 44 HA LEU 44 -17.787 -3.683 -5.713 324 HB2 LEU 44 HB2 LEU 44 -20.374 -2.956 -5.564 325 HB3 LEU 44 HB3 LEU 44 -20.603 -4.672 -5.815 326 HG LEU 44 HG LEU 44 -20.687 -4.277 -3.467 327 HD11 LEU 44 HD11 LEU 44 -17.972 -5.412 -4.127 328 HD12 LEU 44 HD12 LEU 44 -19.495 -6.302 -4.093 329 HD13 LEU 44 HD13 LEU 44 -18.842 -5.619 -2.606 330 HD21 LEU 44 HD21 LEU 44 -18.047 -2.836 -3.730 331 HD22 LEU 44 HD22 LEU 44 -18.898 -3.166 -2.220 332 HD23 LEU 44 HD23 LEU 44 -19.619 -2.093 -3.421 333 H THR 45 H THR 45 -16.446 -5.029 -7.045 334 HA THR 45 HA THR 45 -17.539 -7.723 -7.420 335 HB THR 45 HB THR 45 -17.791 -6.813 -9.643 336 HG1 THR 45 HG1 THR 45 -16.937 -8.558 -10.494 337 HG21 THR 45 HG21 THR 45 -16.237 -4.922 -9.458 338 HG22 THR 45 HG22 THR 45 -15.912 -5.873 -10.908 339 HG23 THR 45 HG23 THR 45 -14.871 -6.036 -9.492 340 H GLU 46 H GLU 46 -15.903 -9.373 -7.677 341 HA GLU 46 HA GLU 46 -13.793 -9.259 -5.888 342 HB2 GLU 46 HB2 GLU 46 -14.787 -11.342 -6.796 343 HB3 GLU 46 HB3 GLU 46 -14.004 -11.028 -8.337 344 HG2 GLU 46 HG2 GLU 46 -11.810 -11.215 -7.262 345 HG3 GLU 46 HG3 GLU 46 -12.598 -11.528 -5.717 346 H GLU 47 H GLU 47 -13.858 -8.321 -9.271 347 HA GLU 47 HA GLU 47 -11.102 -8.246 -9.791 348 HB2 GLU 47 HB2 GLU 47 -12.796 -8.036 -11.557 349 HB3 GLU 47 HB3 GLU 47 -13.274 -6.466 -10.925 350 HG2 GLU 47 HG2 GLU 47 -11.121 -5.530 -11.482 351 HG3 GLU 47 HG3 GLU 47 -10.524 -7.111 -11.981 352 H TYR 48 H TYR 48 -13.208 -5.856 -8.226 353 HA TYR 48 HA TYR 48 -11.267 -3.783 -8.047 354 HB2 TYR 48 HB2 TYR 48 -13.949 -3.968 -7.456 355 HB3 TYR 48 HB3 TYR 48 -13.248 -3.924 -5.845 356 HD1 TYR 48 HD1 TYR 48 -11.030 -2.056 -6.086 357 HD2 TYR 48 HD2 TYR 48 -14.887 -1.874 -7.884 358 HE1 TYR 48 HE1 TYR 48 -10.840 0.388 -6.251 359 HE2 TYR 48 HE2 TYR 48 -14.702 0.573 -8.065 360 HH TYR 48 HH TYR 48 -11.833 2.230 -7.721 361 H PHE 49 H PHE 49 -11.839 -6.692 -6.250 362 HA PHE 49 HA PHE 49 -10.056 -5.992 -4.061 363 HB2 PHE 49 HB2 PHE 49 -12.103 -7.421 -3.755 364 HB3 PHE 49 HB3 PHE 49 -11.327 -8.671 -4.717 365 HD1 PHE 49 HD1 PHE 49 -11.222 -6.828 -1.529 366 HD2 PHE 49 HD2 PHE 49 -9.633 -10.083 -3.775 367 HE1 PHE 49 HE1 PHE 49 -10.170 -7.720 0.509 368 HE2 PHE 49 HE2 PHE 49 -8.578 -10.974 -1.740 369 HZ PHE 49 HZ PHE 49 -8.844 -9.794 0.405 370 H ASN 50 H ASN 50 -9.795 -7.396 -7.187 371 HA ASN 50 HA ASN 50 -7.348 -8.851 -6.639 372 HB2 ASN 50 HB2 ASN 50 -8.754 -8.211 -9.242 373 HB3 ASN 50 HB3 ASN 50 -7.310 -9.211 -9.113 374 HD21 ASN 50 HD21 ASN 50 -9.976 -9.866 -10.086 375 HD22 ASN 50 HD22 ASN 50 -10.503 -11.209 -9.137 376 H ALA 51 H ALA 51 -8.240 -5.794 -8.200 377 HA ALA 51 HA ALA 51 -5.596 -5.389 -9.280 378 HB1 ALA 51 HB1 ALA 51 -6.516 -3.348 -10.229 379 HB2 ALA 51 HB2 ALA 51 -7.974 -3.532 -9.251 380 HB3 ALA 51 HB3 ALA 51 -7.598 -4.712 -10.507 381 H VAL 52 H VAL 52 -7.557 -3.395 -7.008 382 HA VAL 52 HA VAL 52 -5.224 -1.701 -6.585 383 HB VAL 52 HB VAL 52 -6.757 -0.175 -5.454 384 HG11 VAL 52 HG11 VAL 52 -6.595 -0.083 -7.897 385 HG12 VAL 52 HG12 VAL 52 -8.215 0.346 -7.349 386 HG13 VAL 52 HG13 VAL 52 -7.911 -1.251 -8.032 387 HG21 VAL 52 HG21 VAL 52 -8.843 -2.324 -5.884 388 HG22 VAL 52 HG22 VAL 52 -9.164 -0.690 -5.300 389 HG23 VAL 52 HG23 VAL 52 -8.195 -1.799 -4.330 390 H ASN 53 H ASN 53 -5.419 -4.452 -5.249 391 HA ASN 53 HA ASN 53 -5.581 -3.622 -2.419 392 HB2 ASN 53 HB2 ASN 53 -5.860 -6.358 -3.668 393 HB3 ASN 53 HB3 ASN 53 -5.833 -6.067 -1.932 394 HD21 ASN 53 HD21 ASN 53 -7.409 -4.074 -4.383 395 HD22 ASN 53 HD22 ASN 53 -9.008 -4.347 -3.818 396 H TYR 54 H TYR 54 -3.151 -3.690 -4.450 397 HA TYR 54 HA TYR 54 -1.299 -4.779 -2.444 398 HB2 TYR 54 HB2 TYR 54 -0.032 -6.036 -4.000 399 HB3 TYR 54 HB3 TYR 54 -1.711 -6.456 -4.311 400 HD1 TYR 54 HD2 TYR 54 -2.872 -5.415 -6.316 401 HD2 TYR 54 HD1 TYR 54 1.332 -5.124 -5.700 402 HE1 TYR 54 HE2 TYR 54 -2.568 -4.834 -8.686 403 HE2 TYR 54 HE1 TYR 54 1.642 -4.539 -8.068 404 HH TYR 54 HH TYR 54 0.559 -4.737 -10.163 405 H ALA 55 H ALA 55 0.964 -4.100 -2.802 406 HA ALA 55 HA ALA 55 1.167 -1.488 -4.168 407 HB1 ALA 55 HB1 ALA 55 2.628 -0.705 -2.376 408 HB2 ALA 55 HB2 ALA 55 2.435 -2.241 -1.530 409 HB3 ALA 55 HB3 ALA 55 1.051 -1.171 -1.742 410 H GLU 56 H GLU 56 3.004 -1.109 -5.322 411 HA GLU 56 HA GLU 56 4.821 -3.347 -5.780 412 HB2 GLU 56 HB2 GLU 56 4.424 -0.729 -7.248 413 HB3 GLU 56 HB3 GLU 56 5.598 -1.953 -7.713 414 HG2 GLU 56 HG2 GLU 56 3.774 -3.552 -8.090 415 HG3 GLU 56 HG3 GLU 56 2.602 -2.317 -7.630 416 H ILE 57 H ILE 57 6.589 -3.439 -4.542 417 HA ILE 57 HA ILE 57 7.915 -0.933 -3.711 418 HB ILE 57 HB ILE 57 8.121 -3.689 -2.454 419 HG12 ILE 57 HG12 ILE 57 7.095 -2.353 -0.456 420 HG13 ILE 57 HG13 ILE 57 6.579 -1.213 -1.693 421 HG21 ILE 57 HG21 ILE 57 9.360 -1.076 -1.588 422 HG22 ILE 57 HG22 ILE 57 10.213 -2.479 -2.232 423 HG23 ILE 57 HG23 ILE 57 9.400 -2.582 -0.670 424 HD11 ILE 57 HD11 ILE 57 4.825 -2.801 -1.103 425 HD12 ILE 57 HD12 ILE 57 5.861 -4.136 -1.604 426 HD13 ILE 57 HD13 ILE 57 5.303 -2.960 -2.793 427 H ASN 58 H ASN 58 10.141 -0.680 -4.033 428 HA ASN 58 HA ASN 58 11.347 -2.023 -6.221 429 HB2 ASN 58 HB2 ASN 58 11.918 0.289 -5.607 430 HB3 ASN 58 HB3 ASN 58 12.599 -0.275 -4.084 431 HD21 ASN 58 HD21 ASN 58 13.034 -0.148 -7.532 432 HD22 ASN 58 HD22 ASN 58 14.705 -0.576 -7.531 433 H GLU 59 H GLU 59 13.227 -3.396 -6.229 434 HA GLU 59 HA GLU 59 13.041 -5.593 -4.514 435 HB2 GLU 59 HB2 GLU 59 13.998 -5.753 -6.744 436 HB3 GLU 59 HB3 GLU 59 15.352 -4.738 -6.267 437 HG2 GLU 59 HG2 GLU 59 16.213 -6.416 -4.820 438 HG3 GLU 59 HG3 GLU 59 14.754 -7.391 -4.984 439 H GLU 60 H GLU 60 15.308 -2.865 -4.403 440 HA GLU 60 HA GLU 60 16.946 -3.837 -2.322 441 HB2 GLU 60 HB2 GLU 60 16.337 -0.983 -3.115 442 HB3 GLU 60 HB3 GLU 60 17.658 -1.477 -2.063 443 HG2 GLU 60 HG2 GLU 60 17.327 -2.359 -4.927 444 HG3 GLU 60 HG3 GLU 60 18.335 -1.013 -4.402 445 H ASP 61 H ASP 61 14.150 -1.594 -2.174 446 HA ASP 61 HA ASP 61 14.105 -1.392 0.652 447 HB2 ASP 61 HB2 ASP 61 11.790 -1.086 -1.282 448 HB3 ASP 61 HB3 ASP 61 11.847 -0.489 0.375 449 H TRP 62 H TRP 62 12.559 -3.602 -1.611 450 HA TRP 62 HA TRP 62 10.931 -5.115 0.030 451 HB2 TRP 62 HB2 TRP 62 11.070 -5.394 -2.398 452 HB3 TRP 62 HB3 TRP 62 12.706 -6.018 -2.259 453 HD1 TRP 62 HD1 TRP 62 12.967 -8.534 -1.261 454 HE1 TRP 62 HE1 TRP 62 11.320 -10.509 -1.253 455 HE3 TRP 62 HE3 TRP 62 8.648 -5.985 -2.239 456 HZ2 TRP 62 HZ2 TRP 62 8.557 -10.928 -1.616 457 HZ3 TRP 62 HZ3 TRP 62 6.547 -7.251 -2.396 458 HH2 TRP 62 HH2 TRP 62 6.501 -9.674 -2.094 459 H ASN 63 H ASN 63 14.395 -5.602 -0.634 460 HA ASN 63 HA ASN 63 14.768 -7.752 1.175 461 HB2 ASN 63 HB2 ASN 63 16.822 -5.767 0.160 462 HB3 ASN 63 HB3 ASN 63 17.164 -7.347 0.862 463 HD21 ASN 63 HD21 ASN 63 17.852 -6.316 -1.769 464 HD22 ASN 63 HD22 ASN 63 17.142 -7.404 -2.905 465 H ALA 64 H ALA 64 15.175 -4.246 1.512 466 HA ALA 64 HA ALA 64 16.325 -4.177 4.074 467 HB1 ALA 64 HB1 ALA 64 16.239 -2.234 2.591 468 HB2 ALA 64 HB2 ALA 64 15.547 -1.859 4.171 469 HB3 ALA 64 HB3 ALA 64 14.488 -2.152 2.790 470 H LEU 65 H LEU 65 12.931 -4.258 3.081 471 HA LEU 65 HA LEU 65 11.924 -4.123 5.784 472 HB2 LEU 65 HB2 LEU 65 10.525 -4.833 3.197 473 HB3 LEU 65 HB3 LEU 65 9.730 -4.514 4.729 474 HG LEU 65 HG LEU 65 11.401 -2.474 3.245 475 HD11 LEU 65 HD11 LEU 65 9.294 -1.439 2.585 476 HD12 LEU 65 HD12 LEU 65 8.396 -2.763 3.329 477 HD13 LEU 65 HD13 LEU 65 9.426 -3.072 1.931 478 HD21 LEU 65 HD21 LEU 65 11.264 -2.085 5.648 479 HD22 LEU 65 HD22 LEU 65 9.506 -2.203 5.585 480 HD23 LEU 65 HD23 LEU 65 10.332 -0.876 4.767 481 H GLY 66 H GLY 66 13.301 -6.564 3.933 482 HA2 GLY 66 HA2 GLY 66 13.483 -8.843 4.185 483 HA3 GLY 66 HA3 GLY 66 12.789 -8.635 5.787 484 H LEU 67 H LEU 67 11.348 -7.927 2.620 485 HA LEU 67 HA LEU 67 8.879 -9.170 3.433 486 HB2 LEU 67 HB2 LEU 67 9.710 -7.888 0.826 487 HB3 LEU 67 HB3 LEU 67 8.088 -8.465 1.169 488 HG LEU 67 HG LEU 67 9.503 -6.268 2.693 489 HD11 LEU 67 HD11 LEU 67 8.961 -5.590 0.404 490 HD12 LEU 67 HD12 LEU 67 7.960 -4.745 1.583 491 HD13 LEU 67 HD13 LEU 67 7.285 -6.081 0.652 492 HD21 LEU 67 HD21 LEU 67 6.654 -7.260 2.844 493 HD22 LEU 67 HD22 LEU 67 7.318 -5.880 3.719 494 HD23 LEU 67 HD23 LEU 67 7.903 -7.506 4.063 495 H GLN 68 H GLN 68 7.698 -10.695 2.115 496 HA GLN 68 HA GLN 68 9.305 -12.517 0.462 497 HB2 GLN 68 HB2 GLN 68 9.277 -13.498 2.712 498 HB3 GLN 68 HB3 GLN 68 7.525 -13.371 2.756 499 HG2 GLN 68 HG2 GLN 68 7.356 -14.978 0.916 500 HG3 GLN 68 HG3 GLN 68 9.115 -15.102 0.866 501 HE21 GLN 68 HE21 GLN 68 9.046 -17.323 1.331 502 HE22 GLN 68 HE22 GLN 68 8.664 -17.907 2.912 503 H GLU 69 H GLU 69 8.210 -13.172 -1.325 504 HA GLU 69 HA GLU 69 5.977 -11.737 -2.164 505 HB2 GLU 69 HB2 GLU 69 7.149 -14.309 -3.223 506 HB3 GLU 69 HB3 GLU 69 5.910 -13.379 -4.063 507 HG2 GLU 69 HG2 GLU 69 7.333 -11.583 -4.445 508 HG3 GLU 69 HG3 GLU 69 8.464 -12.088 -3.195 509 H GLY 70 H GLY 70 4.229 -11.818 -0.905 510 HA2 GLY 70 HA2 GLY 70 2.094 -13.335 -1.108 511 HA3 GLY 70 HA3 GLY 70 3.080 -14.414 -0.133 512 H ASP 71 H ASP 71 4.204 -11.801 1.195 513 HA ASP 71 HA ASP 71 2.133 -11.764 3.259 514 HB2 ASP 71 HB2 ASP 71 3.833 -10.511 4.621 515 HB3 ASP 71 HB3 ASP 71 4.329 -12.122 4.122 516 H ARG 72 H ARG 72 2.510 -9.280 4.441 517 HA ARG 72 HA ARG 72 1.567 -7.384 2.407 518 HB2 ARG 72 HB2 ARG 72 -0.362 -6.743 3.748 519 HB3 ARG 72 HB3 ARG 72 -0.438 -8.445 3.332 520 HG2 ARG 72 HG2 ARG 72 0.571 -7.468 5.994 521 HG3 ARG 72 HG3 ARG 72 -1.128 -7.818 5.678 522 HD2 ARG 72 HD2 ARG 72 -0.528 -10.131 5.085 523 HD3 ARG 72 HD3 ARG 72 1.162 -9.772 5.433 524 HE ARG 72 HE ARG 72 -0.487 -9.170 7.659 525 HH11 ARG 72 HH11 ARG 72 0.928 -11.827 5.983 526 HH12 ARG 72 HH12 ARG 72 0.983 -12.828 7.388 527 HH21 ARG 72 HH21 ARG 72 -0.440 -10.461 9.447 528 HH22 ARG 72 HH22 ARG 72 0.201 -12.061 9.337 529 H VAL 73 H VAL 73 1.374 -5.137 3.242 530 HA VAL 73 HA VAL 73 3.317 -4.567 5.388 531 HB VAL 73 HB VAL 73 4.231 -2.695 4.017 532 HG11 VAL 73 HG11 VAL 73 5.458 -4.785 4.158 533 HG12 VAL 73 HG12 VAL 73 5.621 -4.095 2.543 534 HG13 VAL 73 HG13 VAL 73 4.526 -5.450 2.818 535 HG21 VAL 73 HG21 VAL 73 2.368 -2.364 2.482 536 HG22 VAL 73 HG22 VAL 73 2.623 -3.965 1.787 537 HG23 VAL 73 HG23 VAL 73 3.842 -2.707 1.577 538 H LYS 74 H LYS 74 3.120 -2.555 6.408 539 HA LYS 74 HA LYS 74 0.507 -1.240 6.204 540 HB2 LYS 74 HB2 LYS 74 1.204 -1.927 8.444 541 HB3 LYS 74 HB3 LYS 74 2.715 -1.050 8.272 542 HG2 LYS 74 HG2 LYS 74 1.466 0.374 9.588 543 HG3 LYS 74 HG3 LYS 74 1.205 1.034 7.977 544 HD2 LYS 74 HD2 LYS 74 -0.909 1.005 9.060 545 HD3 LYS 74 HD3 LYS 74 -0.928 -0.311 7.885 546 HE2 LYS 74 HE2 LYS 74 -0.658 -1.953 9.572 547 HE3 LYS 74 HE3 LYS 74 -0.196 -0.750 10.775 548 HZ1 LYS 74 HZ1 LYS 74 -2.892 -1.008 9.556 549 HZ2 LYS 74 HZ2 LYS 74 -2.446 0.117 10.735 550 HZ3 LYS 74 HZ3 LYS 74 -2.464 -1.538 11.104 551 H VAL 75 H VAL 75 0.292 0.753 5.331 552 HA VAL 75 HA VAL 75 2.738 2.279 4.666 553 HB VAL 75 HB VAL 75 0.101 2.319 3.166 554 HG11 VAL 75 HG11 VAL 75 1.337 4.421 3.006 555 HG12 VAL 75 HG12 VAL 75 1.343 3.574 1.460 556 HG13 VAL 75 HG13 VAL 75 2.779 3.550 2.484 557 HG21 VAL 75 HG21 VAL 75 1.223 0.157 2.892 558 HG22 VAL 75 HG22 VAL 75 2.705 0.981 2.403 559 HG23 VAL 75 HG23 VAL 75 1.261 1.086 1.393 560 H LYS 76 H LYS 76 2.913 4.226 5.628 561 HA LYS 76 HA LYS 76 0.468 5.497 6.716 562 HB2 LYS 76 HB2 LYS 76 3.166 5.117 8.006 563 HB3 LYS 76 HB3 LYS 76 2.035 6.336 8.572 564 HG2 LYS 76 HG2 LYS 76 0.755 4.830 9.635 565 HG3 LYS 76 HG3 LYS 76 0.843 3.671 8.309 566 HD2 LYS 76 HD2 LYS 76 2.875 2.773 9.075 567 HD3 LYS 76 HD3 LYS 76 3.175 4.135 10.159 568 HE2 LYS 76 HE2 LYS 76 0.943 2.120 10.465 569 HE3 LYS 76 HE3 LYS 76 2.470 2.075 11.346 570 HZ1 LYS 76 HZ1 LYS 76 0.853 3.086 12.736 571 HZ2 LYS 76 HZ2 LYS 76 0.354 4.150 11.521 572 HZ3 LYS 76 HZ3 LYS 76 1.887 4.321 12.219 573 H THR 77 H THR 77 0.118 7.510 6.038 574 HA THR 77 HA THR 77 2.405 9.215 5.231 575 HB THR 77 HB THR 77 1.243 10.077 3.319 576 HG1 THR 77 HG1 THR 77 -0.882 9.305 2.803 577 HG21 THR 77 HG21 THR 77 2.403 7.956 2.906 578 HG22 THR 77 HG22 THR 77 0.961 8.089 1.900 579 HG23 THR 77 HG23 THR 77 0.942 7.066 3.335 580 H GLU 78 H GLU 78 1.183 11.526 4.626 581 HA GLU 78 HA GLU 78 0.348 12.586 7.140 582 HB2 GLU 78 HB2 GLU 78 0.066 14.707 5.882 583 HB3 GLU 78 HB3 GLU 78 1.634 13.954 5.615 584 HG2 GLU 78 HG2 GLU 78 1.049 13.245 3.447 585 HG3 GLU 78 HG3 GLU 78 -0.665 13.552 3.723 586 H PHE 79 H PHE 79 -1.438 10.839 4.937 587 HA PHE 79 HA PHE 79 -3.935 12.300 5.521 588 HB2 PHE 79 HB2 PHE 79 -3.317 10.254 3.374 589 HB3 PHE 79 HB3 PHE 79 -4.916 10.938 3.662 590 HD1 PHE 79 HD2 PHE 79 -5.314 13.360 3.282 591 HD2 PHE 79 HD1 PHE 79 -1.649 11.480 2.183 592 HE1 PHE 79 HE2 PHE 79 -4.772 15.269 1.828 593 HE2 PHE 79 HE1 PHE 79 -1.104 13.390 0.732 594 HZ PHE 79 HZ PHE 79 -2.665 15.285 0.551 595 H GLY 80 H GLY 80 -2.485 9.064 5.654 596 HA2 GLY 80 HA2 GLY 80 -3.735 8.301 8.026 597 HA3 GLY 80 HA3 GLY 80 -4.765 7.743 6.715 598 H GLU 81 H GLU 81 -4.400 5.540 7.179 599 HA GLU 81 HA GLU 81 -1.930 4.535 6.034 600 HB2 GLU 81 HB2 GLU 81 -1.456 3.000 7.895 601 HB3 GLU 81 HB3 GLU 81 -1.318 4.685 8.370 602 HG2 GLU 81 HG2 GLU 81 -3.447 4.585 9.507 603 HG3 GLU 81 HG3 GLU 81 -3.704 2.934 8.941 604 H VAL 82 H VAL 82 -2.007 2.404 5.303 605 HA VAL 82 HA VAL 82 -4.532 0.930 5.536 606 HB VAL 82 HB VAL 82 -4.644 2.410 3.492 607 HG11 VAL 82 HG11 VAL 82 -3.352 1.779 1.509 608 HG12 VAL 82 HG12 VAL 82 -2.465 0.589 2.461 609 HG13 VAL 82 HG13 VAL 82 -2.299 2.308 2.822 610 HG21 VAL 82 HG21 VAL 82 -5.489 0.640 1.987 611 HG22 VAL 82 HG22 VAL 82 -6.057 0.451 3.646 612 HG23 VAL 82 HG23 VAL 82 -4.758 -0.577 3.037 613 H VAL 83 H VAL 83 -4.330 -1.337 4.915 614 HA VAL 83 HA VAL 83 -1.529 -2.292 4.840 615 HB VAL 83 HB VAL 83 -3.900 -3.796 5.978 616 HG11 VAL 83 HG11 VAL 83 -2.143 -5.261 5.147 617 HG12 VAL 83 HG12 VAL 83 -2.160 -5.286 6.911 618 HG13 VAL 83 HG13 VAL 83 -0.927 -4.360 6.056 619 HG21 VAL 83 HG21 VAL 83 -3.400 -1.831 7.355 620 HG22 VAL 83 HG22 VAL 83 -1.709 -2.321 7.453 621 HG23 VAL 83 HG23 VAL 83 -2.960 -3.320 8.192 622 H VAL 84 H VAL 84 -0.994 -3.149 2.945 623 HA VAL 84 HA VAL 84 -3.040 -4.541 1.319 624 HB VAL 84 HB VAL 84 -2.053 -3.563 -0.721 625 HG11 VAL 84 HG11 VAL 84 -2.963 -1.488 1.281 626 HG12 VAL 84 HG12 VAL 84 -4.004 -2.475 0.256 627 HG13 VAL 84 HG13 VAL 84 -2.931 -1.278 -0.469 628 HG21 VAL 84 HG21 VAL 84 -0.405 -1.887 1.185 629 HG22 VAL 84 HG22 VAL 84 -0.488 -1.675 -0.564 630 HG23 VAL 84 HG23 VAL 84 0.205 -3.147 0.113 631 H PHE 85 H PHE 85 -1.996 -5.865 -0.489 632 HA PHE 85 HA PHE 85 -0.024 -7.614 0.639 633 HB2 PHE 85 HB2 PHE 85 -1.207 -7.509 -2.148 634 HB3 PHE 85 HB3 PHE 85 -0.161 -8.795 -1.558 635 HD1 PHE 85 HD1 PHE 85 -0.939 -10.163 0.430 636 HD2 PHE 85 HD2 PHE 85 -3.531 -7.570 -1.743 637 HE1 PHE 85 HE1 PHE 85 -2.891 -11.357 1.333 638 HE2 PHE 85 HE2 PHE 85 -5.483 -8.763 -0.838 639 HZ PHE 85 HZ PHE 85 -5.162 -10.654 0.706 640 H ALA 86 H ALA 86 2.146 -7.671 0.339 641 HA ALA 86 HA ALA 86 3.394 -5.462 -1.082 642 HB1 ALA 86 HB1 ALA 86 5.456 -6.222 -0.029 643 HB2 ALA 86 HB2 ALA 86 4.636 -7.669 0.558 644 HB3 ALA 86 HB3 ALA 86 4.160 -6.082 1.157 645 H LYS 87 H LYS 87 4.065 -5.598 -3.152 646 HA LYS 87 HA LYS 87 5.131 -8.167 -4.138 647 HB2 LYS 87 HB2 LYS 87 3.341 -6.342 -5.762 648 HB3 LYS 87 HB3 LYS 87 4.050 -7.855 -6.300 649 HG2 LYS 87 HG2 LYS 87 2.721 -9.014 -4.527 650 HG3 LYS 87 HG3 LYS 87 1.913 -7.475 -4.215 651 HD2 LYS 87 HD2 LYS 87 1.305 -7.442 -6.680 652 HD3 LYS 87 HD3 LYS 87 1.873 -9.110 -6.751 653 HE2 LYS 87 HE2 LYS 87 0.251 -9.658 -4.945 654 HE3 LYS 87 HE3 LYS 87 -0.367 -8.020 -5.064 655 HZ1 LYS 87 HZ1 LYS 87 -0.922 -8.462 -7.400 656 HZ2 LYS 87 HZ2 LYS 87 -1.737 -9.504 -6.348 657 HZ3 LYS 87 HZ3 LYS 87 -0.400 -10.060 -7.220 658 H LYS 88 H LYS 88 6.702 -8.035 -5.759 659 HA LYS 88 HA LYS 88 8.326 -5.641 -5.558 660 HB2 LYS 88 HB2 LYS 88 9.031 -8.180 -5.459 661 HB3 LYS 88 HB3 LYS 88 9.049 -8.044 -7.212 662 HG2 LYS 88 HG2 LYS 88 10.660 -6.212 -7.046 663 HG3 LYS 88 HG3 LYS 88 10.632 -6.360 -5.290 664 HD2 LYS 88 HD2 LYS 88 11.529 -8.499 -7.232 665 HD3 LYS 88 HD3 LYS 88 12.590 -7.496 -6.244 666 HE2 LYS 88 HE2 LYS 88 11.642 -8.458 -4.213 667 HE3 LYS 88 HE3 LYS 88 10.518 -9.420 -5.172 668 HZ1 LYS 88 HZ1 LYS 88 12.405 -10.582 -6.140 669 HZ2 LYS 88 HZ2 LYS 88 12.403 -10.726 -4.457 670 HZ3 LYS 88 HZ3 LYS 88 13.479 -9.662 -5.206 671 H GLY 89 H GLY 89 7.814 -3.985 -6.936 672 HA2 GLY 89 HA2 GLY 89 6.768 -4.728 -9.610 673 HA3 GLY 89 HA3 GLY 89 6.083 -3.444 -8.646 674 H ASP 90 H ASP 90 6.347 -2.245 -10.628 675 HA ASP 90 HA ASP 90 9.022 -1.663 -11.595 676 HB2 ASP 90 HB2 ASP 90 7.241 -2.075 -13.187 677 HB3 ASP 90 HB3 ASP 90 6.286 -0.763 -12.514 678 H VAL 91 H VAL 91 9.681 -0.628 -9.606 679 HA VAL 91 HA VAL 91 9.280 2.264 -9.740 680 HB VAL 91 HB VAL 91 9.041 2.432 -7.236 681 HG11 VAL 91 HG11 VAL 91 6.774 1.031 -8.661 682 HG12 VAL 91 HG12 VAL 91 7.115 2.761 -8.708 683 HG13 VAL 91 HG13 VAL 91 6.638 1.999 -7.191 684 HG21 VAL 91 HG21 VAL 91 8.434 -0.523 -7.450 685 HG22 VAL 91 HG22 VAL 91 8.202 0.473 -6.013 686 HG23 VAL 91 HG23 VAL 91 9.827 0.199 -6.643 687 HA PRO 92 HA PRO 92 13.619 2.171 -8.457 688 HB2 PRO 92 HB2 PRO 92 14.005 4.774 -7.929 689 HB3 PRO 92 HB3 PRO 92 13.724 4.207 -9.580 690 HG2 PRO 92 HG2 PRO 92 11.802 5.481 -7.661 691 HG3 PRO 92 HG3 PRO 92 12.024 5.792 -9.394 692 HD2 PRO 92 HD2 PRO 92 10.047 4.179 -8.350 693 HD3 PRO 92 HD3 PRO 92 10.691 4.022 -9.998 694 H LYS 93 H LYS 93 14.991 2.836 -6.495 695 HA LYS 93 HA LYS 93 13.671 1.864 -4.170 696 HB2 LYS 93 HB2 LYS 93 16.125 1.551 -4.668 697 HB3 LYS 93 HB3 LYS 93 16.370 3.236 -4.212 698 HG2 LYS 93 HG2 LYS 93 15.394 2.732 -1.988 699 HG3 LYS 93 HG3 LYS 93 15.282 1.037 -2.457 700 HD2 LYS 93 HD2 LYS 93 17.766 1.050 -2.784 701 HD3 LYS 93 HD3 LYS 93 17.788 2.681 -2.104 702 HE2 LYS 93 HE2 LYS 93 16.886 0.144 -0.742 703 HE3 LYS 93 HE3 LYS 93 18.302 1.119 -0.351 704 HZ1 LYS 93 HZ1 LYS 93 16.611 1.608 1.218 705 HZ2 LYS 93 HZ2 LYS 93 15.450 1.856 0.017 706 HZ3 LYS 93 HZ3 LYS 93 16.731 2.951 0.198 707 H GLY 94 H GLY 94 13.176 2.875 -2.206 708 HA2 GLY 94 HA2 GLY 94 12.458 4.596 -0.844 709 HA3 GLY 94 HA3 GLY 94 13.364 5.717 -1.846 710 H MET 95 H MET 95 11.069 3.716 -3.477 711 HA MET 95 HA MET 95 8.893 5.624 -3.276 712 HB2 MET 95 HB2 MET 95 10.541 6.481 -4.996 713 HB3 MET 95 HB3 MET 95 10.180 5.053 -5.957 714 HG2 MET 95 HG2 MET 95 7.929 5.735 -6.254 715 HG3 MET 95 HG3 MET 95 8.106 7.037 -5.079 716 HE1 MET 95 HE1 MET 95 7.746 9.179 -8.294 717 HE2 MET 95 HE2 MET 95 7.182 8.882 -6.649 718 HE3 MET 95 HE3 MET 95 6.863 7.703 -7.918 719 H ILE 96 H ILE 96 6.901 4.655 -3.692 720 HA ILE 96 HA ILE 96 6.930 1.915 -4.786 721 HB ILE 96 HB ILE 96 5.348 1.143 -3.081 722 HG12 ILE 96 HG12 ILE 96 5.827 3.821 -1.735 723 HG13 ILE 96 HG13 ILE 96 4.330 3.332 -2.523 724 HG21 ILE 96 HG21 ILE 96 6.910 1.031 -1.178 725 HG22 ILE 96 HG22 ILE 96 7.888 2.293 -1.923 726 HG23 ILE 96 HG23 ILE 96 7.711 0.731 -2.719 727 HD11 ILE 96 HD11 ILE 96 4.184 3.132 -0.104 728 HD12 ILE 96 HD12 ILE 96 5.550 2.016 -0.102 729 HD13 ILE 96 HD13 ILE 96 4.037 1.556 -0.883 730 H PHE 97 H PHE 97 4.964 1.189 -5.709 731 HA PHE 97 HA PHE 97 3.192 3.401 -6.564 732 HB2 PHE 97 HB2 PHE 97 4.535 2.491 -8.387 733 HB3 PHE 97 HB3 PHE 97 3.988 0.862 -8.017 734 HD1 PHE 97 HD1 PHE 97 1.718 0.146 -8.601 735 HD2 PHE 97 HD2 PHE 97 3.132 4.044 -9.589 736 HE1 PHE 97 HE1 PHE 97 -0.141 0.416 -10.187 737 HE2 PHE 97 HE2 PHE 97 1.271 4.316 -11.171 738 HZ PHE 97 HZ PHE 97 -0.369 2.502 -11.471 739 H ILE 98 H ILE 98 1.059 3.264 -6.076 740 HA ILE 98 HA ILE 98 -0.101 0.587 -5.590 741 HB ILE 98 HB ILE 98 -0.859 3.153 -4.161 742 HG12 ILE 98 HG12 ILE 98 0.533 0.642 -3.187 743 HG13 ILE 98 HG13 ILE 98 1.223 2.256 -3.288 744 HG21 ILE 98 HG21 ILE 98 -2.000 0.364 -3.888 745 HG22 ILE 98 HG22 ILE 98 -2.824 1.774 -4.559 746 HG23 ILE 98 HG23 ILE 98 -2.395 1.737 -2.848 747 HD11 ILE 98 HD11 ILE 98 -0.992 1.378 -1.447 748 HD12 ILE 98 HD12 ILE 98 -0.346 3.015 -1.559 749 HD13 ILE 98 HD13 ILE 98 0.685 1.696 -1.003 750 HA PRO 99 HA PRO 99 -2.863 1.643 -8.989 751 HB2 PRO 99 HB2 PRO 99 -4.637 -0.317 -7.598 752 HB3 PRO 99 HB3 PRO 99 -4.121 -0.270 -9.289 753 HG2 PRO 99 HG2 PRO 99 -3.062 -2.046 -7.619 754 HG3 PRO 99 HG3 PRO 99 -2.045 -1.220 -8.817 755 HD2 PRO 99 HD2 PRO 99 -2.318 -0.689 -5.873 756 HD3 PRO 99 HD3 PRO 99 -0.856 -0.696 -6.887 757 H MET 100 H MET 100 -4.562 3.056 -9.250 758 HA MET 100 HA MET 100 -5.397 4.654 -7.093 759 HB2 MET 100 HB2 MET 100 -5.359 5.151 -9.653 760 HB3 MET 100 HB3 MET 100 -6.968 4.453 -9.657 761 HG2 MET 100 HG2 MET 100 -6.043 6.911 -8.179 762 HG3 MET 100 HG3 MET 100 -7.151 6.837 -9.544 763 HE1 MET 100 HE1 MET 100 -6.627 5.709 -5.804 764 HE2 MET 100 HE2 MET 100 -8.127 6.341 -5.123 765 HE3 MET 100 HE3 MET 100 -6.968 7.439 -5.880 766 H GLY 101 H GLY 101 -6.531 3.759 -5.435 767 HA2 GLY 101 HA2 GLY 101 -9.269 2.975 -5.911 768 HA3 GLY 101 HA3 GLY 101 -8.256 1.620 -5.436 769 HA PRO 102 HA PRO 102 -10.210 3.873 -1.715 770 HB2 PRO 102 HB2 PRO 102 -10.820 1.440 -0.474 771 HB3 PRO 102 HB3 PRO 102 -11.946 2.438 -1.394 772 HG2 PRO 102 HG2 PRO 102 -10.415 0.023 -2.258 773 HG3 PRO 102 HG3 PRO 102 -12.061 0.522 -2.685 774 HD2 PRO 102 HD2 PRO 102 -10.017 0.825 -4.397 775 HD3 PRO 102 HD3 PRO 102 -11.320 2.024 -4.302 776 H TYR 103 H TYR 103 -8.015 1.119 -2.002 777 HA TYR 103 HA TYR 103 -6.856 1.291 0.573 778 HB2 TYR 103 HB2 TYR 103 -5.727 0.184 -2.014 779 HB3 TYR 103 HB3 TYR 103 -5.013 -0.061 -0.421 780 HD1 TYR 103 HD2 TYR 103 -8.135 -0.653 -2.373 781 HD2 TYR 103 HD1 TYR 103 -5.724 -1.854 0.928 782 HE1 TYR 103 HE2 TYR 103 -9.594 -2.594 -2.018 783 HE2 TYR 103 HE1 TYR 103 -7.177 -3.802 1.286 784 HH TYR 103 HH TYR 103 -9.256 -4.974 -0.915 785 H ALA 104 H ALA 104 -5.707 2.518 -2.581 786 HA ALA 104 HA ALA 104 -3.548 4.025 -1.593 787 HB1 ALA 104 HB1 ALA 104 -3.665 5.246 -3.728 788 HB2 ALA 104 HB2 ALA 104 -5.236 4.512 -4.056 789 HB3 ALA 104 HB3 ALA 104 -3.794 3.503 -3.964 790 H ASN 105 H ASN 105 -6.959 4.812 -2.019 791 HA ASN 105 HA ASN 105 -7.003 7.532 -1.530 792 HB2 ASN 105 HB2 ASN 105 -8.994 6.448 -2.240 793 HB3 ASN 105 HB3 ASN 105 -8.964 5.330 -0.885 794 HD21 ASN 105 HD21 ASN 105 -9.680 6.013 1.114 795 HD22 ASN 105 HD22 ASN 105 -10.606 7.453 1.318 796 H MET 106 H MET 106 -6.438 4.945 0.740 797 HA MET 106 HA MET 106 -6.993 6.428 3.130 798 HB2 MET 106 HB2 MET 106 -5.306 3.942 2.746 799 HB3 MET 106 HB3 MET 106 -5.909 4.549 4.283 800 HG2 MET 106 HG2 MET 106 -7.689 3.708 2.010 801 HG3 MET 106 HG3 MET 106 -7.183 2.634 3.312 802 HE1 MET 106 HE1 MET 106 -8.224 2.569 5.654 803 HE2 MET 106 HE2 MET 106 -8.989 3.966 6.415 804 HE3 MET 106 HE3 MET 106 -7.293 4.040 5.934 805 H VAL 107 H VAL 107 -4.314 6.367 0.972 806 HA VAL 107 HA VAL 107 -2.599 7.678 2.989 807 HB VAL 107 HB VAL 107 -0.622 6.550 2.002 808 HG11 VAL 107 HG11 VAL 107 -1.623 5.660 4.036 809 HG12 VAL 107 HG12 VAL 107 -1.018 4.345 3.026 810 HG13 VAL 107 HG13 VAL 107 -2.748 4.691 3.082 811 HG21 VAL 107 HG21 VAL 107 -0.953 4.564 0.573 812 HG22 VAL 107 HG22 VAL 107 -1.497 6.047 -0.214 813 HG23 VAL 107 HG23 VAL 107 -2.677 4.933 0.479 814 H ILE 108 H ILE 108 -4.024 7.996 -0.055 815 HA ILE 108 HA ILE 108 -1.919 9.848 -0.970 816 HB ILE 108 HB ILE 108 -2.743 9.725 -3.162 817 HG12 ILE 108 HG12 ILE 108 -5.095 8.053 -2.256 818 HG13 ILE 108 HG13 ILE 108 -5.187 9.802 -2.465 819 HG21 ILE 108 HG21 ILE 108 -2.821 6.963 -1.943 820 HG22 ILE 108 HG22 ILE 108 -1.415 7.795 -2.608 821 HG23 ILE 108 HG23 ILE 108 -2.728 7.288 -3.674 822 HD11 ILE 108 HD11 ILE 108 -6.006 8.807 -4.436 823 HD12 ILE 108 HD12 ILE 108 -4.606 7.736 -4.547 824 HD13 ILE 108 HD13 ILE 108 -4.409 9.471 -4.801 825 H ASP 109 H ASP 109 -2.989 11.702 -2.389 826 HA ASP 109 HA ASP 109 -4.846 13.138 -0.663 827 HB2 ASP 109 HB2 ASP 109 -2.889 14.354 -1.442 828 HB3 ASP 109 HB3 ASP 109 -3.294 13.997 -3.120 829 HA PRO 110 HA PRO 110 -8.124 11.796 -3.517 830 HB2 PRO 110 HB2 PRO 110 -10.210 12.499 -1.953 831 HB3 PRO 110 HB3 PRO 110 -9.247 11.048 -1.638 832 HG2 PRO 110 HG2 PRO 110 -9.074 13.753 -0.345 833 HG3 PRO 110 HG3 PRO 110 -9.051 12.149 0.415 834 HD2 PRO 110 HD2 PRO 110 -6.792 13.591 -0.071 835 HD3 PRO 110 HD3 PRO 110 -6.818 11.815 -0.072 836 H SER 111 H SER 111 -7.362 14.920 -2.294 837 HA SER 111 HA SER 111 -9.404 16.494 -3.430 838 HB2 SER 111 HB2 SER 111 -6.515 17.318 -3.026 839 HB3 SER 111 HB3 SER 111 -7.913 18.385 -3.134 840 HG SER 111 HG SER 111 -6.935 16.967 -1.005 841 H THR 112 H THR 112 -6.044 16.288 -4.636 842 HA THR 112 HA THR 112 -5.149 16.532 -6.723 843 HB THR 112 HB THR 112 -5.979 15.048 -8.453 844 HG1 THR 112 HG1 THR 112 -8.314 14.787 -6.828 845 HG21 THR 112 HG21 THR 112 -6.327 13.792 -5.725 846 HG22 THR 112 HG22 THR 112 -4.797 14.006 -6.576 847 HG23 THR 112 HG23 THR 112 -6.028 12.926 -7.231 848 H ASP 113 H ASP 113 -6.239 16.650 -9.306 849 HA ASP 113 HA ASP 113 -8.232 18.771 -9.362 850 HB2 ASP 113 HB2 ASP 113 -6.026 19.934 -9.129 851 HB3 ASP 113 HB3 ASP 113 -5.506 19.182 -10.635 852 H GLY 114 H GLY 114 -9.067 19.162 -11.542 853 HA2 GLY 114 HA2 GLY 114 -9.563 16.792 -12.961 854 HA3 GLY 114 HA3 GLY 114 -9.931 18.409 -13.530 855 H THR 115 H THR 115 -6.955 19.062 -13.323 856 HA THR 115 HA THR 115 -6.279 18.173 -16.010 857 HB THR 115 HB THR 115 -4.324 19.689 -15.803 858 HG1 THR 115 HG1 THR 115 -5.304 20.739 -13.391 859 HG21 THR 115 HG21 THR 115 -6.459 20.577 -16.624 860 HG22 THR 115 HG22 THR 115 -5.575 21.796 -15.707 861 HG23 THR 115 HG23 THR 115 -6.941 20.960 -14.970 862 H GLY 116 H GLY 116 -4.211 18.406 -13.097 863 HA2 GLY 116 HA2 GLY 116 -2.996 16.655 -12.076 864 HA3 GLY 116 HA3 GLY 116 -3.347 15.624 -13.451 865 H MET 117 H MET 117 -0.788 16.269 -12.062 866 HA MET 117 HA MET 117 0.749 17.763 -14.030 867 HB2 MET 117 HB2 MET 117 1.653 16.315 -11.527 868 HB3 MET 117 HB3 MET 117 2.650 17.378 -12.510 869 HG2 MET 117 HG2 MET 117 1.128 19.248 -11.977 870 HG3 MET 117 HG3 MET 117 0.205 18.166 -10.933 871 HE1 MET 117 HE1 MET 117 4.135 18.357 -11.439 872 HE2 MET 117 HE2 MET 117 4.571 19.468 -10.138 873 HE3 MET 117 HE3 MET 117 3.600 20.038 -11.498 874 HA PRO 118 HA PRO 118 2.260 14.106 -16.163 875 HB2 PRO 118 HB2 PRO 118 4.382 15.134 -17.447 876 HB3 PRO 118 HB3 PRO 118 2.733 15.625 -17.863 877 HG2 PRO 118 HG2 PRO 118 4.749 17.036 -16.138 878 HG3 PRO 118 HG3 PRO 118 3.699 17.706 -17.401 879 HD2 PRO 118 HD2 PRO 118 3.131 17.846 -14.720 880 HD3 PRO 118 HD3 PRO 118 1.888 17.845 -15.989 881 H GLN 119 H GLN 119 4.602 13.089 -16.604 882 HA GLN 119 HA GLN 119 6.415 11.991 -15.788 883 HB2 GLN 119 HB2 GLN 119 6.602 14.348 -13.897 884 HB3 GLN 119 HB3 GLN 119 7.862 13.144 -14.141 885 HG2 GLN 119 HG2 GLN 119 8.131 13.826 -16.443 886 HG3 GLN 119 HG3 GLN 119 6.781 14.952 -16.298 887 HE21 GLN 119 HE21 GLN 119 10.100 14.342 -15.485 888 HE22 GLN 119 HE22 GLN 119 10.470 15.945 -14.964 889 H PHE 120 H PHE 120 7.347 10.882 -13.808 890 HA PHE 120 HA PHE 120 5.214 9.579 -12.426 891 HB2 PHE 120 HB2 PHE 120 6.949 8.180 -11.415 892 HB3 PHE 120 HB3 PHE 120 7.204 8.340 -13.147 893 HD1 PHE 120 HD1 PHE 120 8.906 10.223 -13.864 894 HD2 PHE 120 HD2 PHE 120 8.733 8.485 -9.977 895 HE1 PHE 120 HE1 PHE 120 11.228 10.926 -13.446 896 HE2 PHE 120 HE2 PHE 120 11.051 9.187 -9.556 897 HZ PHE 120 HZ PHE 120 12.301 10.410 -11.291 898 H LYS 121 H LYS 121 4.172 10.465 -10.766 899 HA LYS 121 HA LYS 121 5.696 11.524 -8.515 900 HB2 LYS 121 HB2 LYS 121 5.209 13.486 -9.945 901 HB3 LYS 121 HB3 LYS 121 3.491 13.121 -9.846 902 HG2 LYS 121 HG2 LYS 121 4.098 14.922 -8.323 903 HG3 LYS 121 HG3 LYS 121 3.535 13.505 -7.433 904 HD2 LYS 121 HD2 LYS 121 5.914 12.855 -7.076 905 HD3 LYS 121 HD3 LYS 121 6.404 14.363 -7.845 906 HE2 LYS 121 HE2 LYS 121 5.270 15.637 -6.101 907 HE3 LYS 121 HE3 LYS 121 4.714 14.139 -5.353 908 HZ1 LYS 121 HZ1 LYS 121 7.563 14.900 -5.697 909 HZ2 LYS 121 HZ2 LYS 121 6.980 13.531 -4.895 910 HZ3 LYS 121 HZ3 LYS 121 6.685 15.069 -4.264 911 H GLY 122 H GLY 122 4.777 11.120 -6.559 912 HA2 GLY 122 HA2 GLY 122 1.922 10.410 -6.440 913 HA3 GLY 122 HA3 GLY 122 3.099 9.263 -5.821 914 H VAL 123 H VAL 123 1.440 9.823 -3.963 915 HA VAL 123 HA VAL 123 2.189 12.191 -2.431 916 HB VAL 123 HB VAL 123 0.335 9.893 -1.750 917 HG11 VAL 123 HG11 VAL 123 1.262 10.877 0.286 918 HG12 VAL 123 HG12 VAL 123 -0.445 11.288 0.112 919 HG13 VAL 123 HG13 VAL 123 0.793 12.488 -0.265 920 HG21 VAL 123 HG21 VAL 123 -1.448 11.552 -2.145 921 HG22 VAL 123 HG22 VAL 123 -0.484 11.253 -3.591 922 HG23 VAL 123 HG23 VAL 123 -0.230 12.725 -2.651 923 H LYS 124 H LYS 124 3.694 12.266 -0.849 924 HA LYS 124 HA LYS 124 5.446 10.013 -0.560 925 HB2 LYS 124 HB2 LYS 124 5.536 12.614 0.964 926 HB3 LYS 124 HB3 LYS 124 6.858 11.478 0.714 927 HG2 LYS 124 HG2 LYS 124 6.682 11.953 -1.747 928 HG3 LYS 124 HG3 LYS 124 5.530 13.230 -1.349 929 HD2 LYS 124 HD2 LYS 124 7.494 14.429 -1.426 930 HD3 LYS 124 HD3 LYS 124 7.424 14.008 0.286 931 HE2 LYS 124 HE2 LYS 124 9.648 13.578 -0.433 932 HE3 LYS 124 HE3 LYS 124 8.862 12.011 -0.251 933 HZ1 LYS 124 HZ1 LYS 124 9.281 13.465 -2.806 934 HZ2 LYS 124 HZ2 LYS 124 8.497 11.979 -2.656 935 HZ3 LYS 124 HZ3 LYS 124 10.142 12.108 -2.285 936 H GLY 125 H GLY 125 6.225 9.185 1.528 937 HA2 GLY 125 HA2 GLY 125 4.959 9.422 3.990 938 HA3 GLY 125 HA3 GLY 125 4.056 8.207 3.103 939 H THR 126 H THR 126 4.617 6.570 4.584 940 HA THR 126 HA THR 126 7.371 5.534 4.321 941 HB THR 126 HB THR 126 7.392 4.882 6.714 942 HG1 THR 126 HG1 THR 126 4.988 6.419 6.809 943 HG21 THR 126 HG21 THR 126 7.785 7.117 7.673 944 HG22 THR 126 HG22 THR 126 6.999 7.854 6.277 945 HG23 THR 126 HG23 THR 126 8.510 6.965 6.071 946 H VAL 127 H VAL 127 7.566 3.213 4.833 947 HA VAL 127 HA VAL 127 5.076 1.701 5.096 948 HB VAL 127 HB VAL 127 5.367 1.979 2.660 949 HG11 VAL 127 HG11 VAL 127 7.235 0.891 1.491 950 HG12 VAL 127 HG12 VAL 127 7.973 0.494 3.044 951 HG13 VAL 127 HG13 VAL 127 7.795 2.181 2.557 952 HG21 VAL 127 HG21 VAL 127 4.259 -0.025 3.487 953 HG22 VAL 127 HG22 VAL 127 5.810 -0.848 3.639 954 HG23 VAL 127 HG23 VAL 127 5.201 -0.401 2.046 955 H GLU 128 H GLU 128 5.316 -0.296 6.047 956 HA GLU 128 HA GLU 128 7.914 -1.598 6.237 957 HB2 GLU 128 HB2 GLU 128 7.743 -1.828 8.735 958 HB3 GLU 128 HB3 GLU 128 8.077 -0.194 8.184 959 HG2 GLU 128 HG2 GLU 128 5.787 0.460 8.550 960 HG3 GLU 128 HG3 GLU 128 5.342 -1.196 8.960 961 H LYS 129 H LYS 129 7.731 -3.846 7.109 962 HA LYS 129 HA LYS 129 5.149 -4.998 6.445 963 HB2 LYS 129 HB2 LYS 129 7.028 -6.266 5.662 964 HB3 LYS 129 HB3 LYS 129 7.748 -6.311 7.269 965 HG2 LYS 129 HG2 LYS 129 6.249 -7.892 8.051 966 HG3 LYS 129 HG3 LYS 129 5.023 -7.473 6.861 967 HD2 LYS 129 HD2 LYS 129 5.930 -9.658 6.377 968 HD3 LYS 129 HD3 LYS 129 6.387 -8.529 5.105 969 HE2 LYS 129 HE2 LYS 129 8.620 -8.360 5.974 970 HE3 LYS 129 HE3 LYS 129 8.185 -9.302 7.403 971 HZ1 LYS 129 HZ1 LYS 129 9.374 -10.546 5.591 972 HZ2 LYS 129 HZ2 LYS 129 7.972 -10.386 4.653 973 HZ3 LYS 129 HZ3 LYS 129 7.922 -11.234 6.110 974 H THR 130 H THR 130 3.803 -6.144 7.796 975 HA THR 130 HA THR 130 4.305 -6.181 10.668 976 HB THR 130 HB THR 130 3.373 -3.977 10.489 977 HG1 THR 130 HG1 THR 130 1.985 -4.316 12.068 978 HG21 THR 130 HG21 THR 130 1.105 -5.221 8.919 979 HG22 THR 130 HG22 THR 130 2.359 -4.163 8.269 980 HG23 THR 130 HG23 THR 130 1.195 -3.538 9.439 981 H ASP 131 H ASP 131 2.600 -7.332 11.870 982 HA ASP 131 HA ASP 131 1.680 -9.643 10.429 983 HB2 ASP 131 HB2 ASP 131 2.555 -9.769 12.743 984 HB3 ASP 131 HB3 ASP 131 1.178 -8.827 13.305 985 H GLU 132 H GLU 132 0.403 -6.580 10.882 986 HA GLU 132 HA GLU 132 -2.306 -6.842 11.300 987 HB2 GLU 132 HB2 GLU 132 -0.842 -5.019 9.385 988 HB3 GLU 132 HB3 GLU 132 -2.542 -4.834 9.792 989 HG2 GLU 132 HG2 GLU 132 -0.454 -4.877 11.936 990 HG3 GLU 132 HG3 GLU 132 -0.770 -3.410 11.016 991 H LYS 133 H LYS 133 -4.126 -6.979 9.931 992 HA LYS 133 HA LYS 133 -3.772 -8.835 7.712 993 HB2 LYS 133 HB2 LYS 133 -6.306 -8.916 7.743 994 HB3 LYS 133 HB3 LYS 133 -5.502 -9.488 9.192 995 HG2 LYS 133 HG2 LYS 133 -7.350 -8.247 9.945 996 HG3 LYS 133 HG3 LYS 133 -5.956 -7.203 10.197 997 HD2 LYS 133 HD2 LYS 133 -6.513 -6.020 8.084 998 HD3 LYS 133 HD3 LYS 133 -7.949 -7.027 7.927 999 HE2 LYS 133 HE2 LYS 133 -7.388 -5.223 10.282 1000 HE3 LYS 133 HE3 LYS 133 -8.358 -4.751 8.889 1001 HZ1 LYS 133 HZ1 LYS 133 -8.967 -7.005 10.731 1002 HZ2 LYS 133 HZ2 LYS 133 -9.909 -6.529 9.407 1003 HZ3 LYS 133 HZ3 LYS 133 -9.730 -5.495 10.730 1004 H VAL 134 H VAL 134 -4.367 -8.469 5.565 1005 HA VAL 134 HA VAL 134 -4.425 -5.791 4.600 1006 HB VAL 134 HB VAL 134 -5.188 -8.376 3.208 1007 HG11 VAL 134 HG11 VAL 134 -4.782 -5.617 2.024 1008 HG12 VAL 134 HG12 VAL 134 -6.304 -6.506 2.114 1009 HG13 VAL 134 HG13 VAL 134 -4.992 -7.108 1.102 1010 HG21 VAL 134 HG21 VAL 134 -3.001 -8.156 2.124 1011 HG22 VAL 134 HG22 VAL 134 -2.841 -8.257 3.877 1012 HG23 VAL 134 HG23 VAL 134 -2.680 -6.698 3.066 1013 H LEU 135 H LEU 135 -6.088 -4.433 4.246 1014 HA LEU 135 HA LEU 135 -8.670 -5.011 5.295 1015 HB2 LEU 135 HB2 LEU 135 -7.479 -2.732 3.761 1016 HB3 LEU 135 HB3 LEU 135 -9.223 -2.810 3.940 1017 HG LEU 135 HG LEU 135 -7.231 -2.714 6.217 1018 HD11 LEU 135 HD11 LEU 135 -9.135 -0.607 5.196 1019 HD12 LEU 135 HD12 LEU 135 -7.380 -0.588 5.005 1020 HD13 LEU 135 HD13 LEU 135 -8.094 -0.469 6.614 1021 HD21 LEU 135 HD21 LEU 135 -10.256 -2.776 6.180 1022 HD22 LEU 135 HD22 LEU 135 -9.285 -2.349 7.597 1023 HD23 LEU 135 HD23 LEU 135 -9.161 -3.964 6.897 1024 H SER 136 H SER 136 -10.605 -5.444 4.282 1025 HA SER 136 HA SER 136 -10.539 -6.258 1.472 1026 HB2 SER 136 HB2 SER 136 -11.782 -7.676 3.066 1027 HB3 SER 136 HB3 SER 136 -12.820 -6.310 3.477 1028 HG SER 136 HG SER 136 -13.324 -8.035 1.667 1029 H VAL 137 H VAL 137 -11.953 -5.292 -0.117 1030 HA VAL 137 HA VAL 137 -11.834 -2.547 -0.256 1031 HB VAL 137 HB VAL 137 -13.910 -4.306 -1.582 1032 HG11 VAL 137 HG11 VAL 137 -14.054 -2.536 -3.283 1033 HG12 VAL 137 HG12 VAL 137 -12.960 -1.534 -2.333 1034 HG13 VAL 137 HG13 VAL 137 -14.550 -1.951 -1.696 1035 HG21 VAL 137 HG21 VAL 137 -11.650 -5.063 -2.067 1036 HG22 VAL 137 HG22 VAL 137 -11.177 -3.429 -2.536 1037 HG23 VAL 137 HG23 VAL 137 -12.360 -4.316 -3.499 1038 H LYS 138 H LYS 138 -14.644 -4.474 0.784 1039 HA LYS 138 HA LYS 138 -16.253 -2.215 1.464 1040 HB2 LYS 138 HB2 LYS 138 -17.165 -4.451 0.873 1041 HB3 LYS 138 HB3 LYS 138 -16.538 -5.084 2.389 1042 HG2 LYS 138 HG2 LYS 138 -17.973 -3.468 3.610 1043 HG3 LYS 138 HG3 LYS 138 -18.652 -2.957 2.062 1044 HD2 LYS 138 HD2 LYS 138 -20.121 -4.570 3.142 1045 HD3 LYS 138 HD3 LYS 138 -19.444 -5.252 1.663 1046 HE2 LYS 138 HE2 LYS 138 -17.782 -6.473 2.978 1047 HE3 LYS 138 HE3 LYS 138 -18.427 -5.768 4.459 1048 HZ1 LYS 138 HZ1 LYS 138 -19.978 -7.500 2.611 1049 HZ2 LYS 138 HZ2 LYS 138 -20.486 -6.920 4.116 1050 HZ3 LYS 138 HZ3 LYS 138 -19.224 -8.036 4.024 1051 H GLU 139 H GLU 139 -14.148 -4.372 3.361 1052 HA GLU 139 HA GLU 139 -14.823 -3.463 5.936 1053 HB2 GLU 139 HB2 GLU 139 -13.551 -5.510 5.535 1054 HB3 GLU 139 HB3 GLU 139 -12.227 -4.582 4.849 1055 HG2 GLU 139 HG2 GLU 139 -11.770 -3.576 7.012 1056 HG3 GLU 139 HG3 GLU 139 -13.145 -4.433 7.718 1057 H LEU 140 H LEU 140 -12.599 -2.284 3.523 1058 HA LEU 140 HA LEU 140 -11.375 -0.207 4.966 1059 HB2 LEU 140 HB2 LEU 140 -10.915 -1.331 2.630 1060 HB3 LEU 140 HB3 LEU 140 -11.945 -0.047 2.029 1061 HG LEU 140 HG LEU 140 -9.576 0.571 3.760 1062 HD11 LEU 140 HD11 LEU 140 -8.213 0.823 1.765 1063 HD12 LEU 140 HD12 LEU 140 -9.539 0.229 0.765 1064 HD13 LEU 140 HD13 LEU 140 -8.770 -0.841 1.939 1065 HD21 LEU 140 HD21 LEU 140 -11.116 2.393 3.389 1066 HD22 LEU 140 HD22 LEU 140 -11.083 2.111 1.647 1067 HD23 LEU 140 HD23 LEU 140 -9.636 2.687 2.476 1068 H LEU 141 H LEU 141 -14.347 -0.367 3.016 1069 HA LEU 141 HA LEU 141 -15.110 2.337 3.155 1070 HB2 LEU 141 HB2 LEU 141 -16.981 -0.043 3.187 1071 HB3 LEU 141 HB3 LEU 141 -17.368 1.588 2.673 1072 HG LEU 141 HG LEU 141 -15.507 -0.332 1.272 1073 HD11 LEU 141 HD11 LEU 141 -17.833 -0.946 1.011 1074 HD12 LEU 141 HD12 LEU 141 -17.207 -0.296 -0.503 1075 HD13 LEU 141 HD13 LEU 141 -18.243 0.699 0.520 1076 HD21 LEU 141 HD21 LEU 141 -16.307 2.477 0.505 1077 HD22 LEU 141 HD22 LEU 141 -15.386 1.356 -0.499 1078 HD23 LEU 141 HD23 LEU 141 -14.704 1.946 1.014 1079 H GLU 142 H GLU 142 -15.899 -0.396 5.286 1080 HA GLU 142 HA GLU 142 -17.479 0.956 7.151 1081 HB2 GLU 142 HB2 GLU 142 -15.598 -1.357 7.691 1082 HB3 GLU 142 HB3 GLU 142 -16.981 -0.893 8.673 1083 HG2 GLU 142 HG2 GLU 142 -18.478 -1.426 6.797 1084 HG3 GLU 142 HG3 GLU 142 -17.085 -1.913 5.836 1085 H ALA 143 H ALA 143 -13.974 0.693 6.892 1086 HA ALA 143 HA ALA 143 -13.337 1.878 9.397 1087 HB1 ALA 143 HB1 ALA 143 -11.659 1.766 6.890 1088 HB2 ALA 143 HB2 ALA 143 -11.765 0.495 8.107 1089 HB3 ALA 143 HB3 ALA 143 -11.077 2.063 8.529 1090 H ILE 144 H ILE 144 -13.540 3.266 6.095 1091 HA ILE 144 HA ILE 144 -12.964 5.925 7.083 1092 HB ILE 144 HB ILE 144 -13.275 6.684 4.772 1093 HG12 ILE 144 HG12 ILE 144 -13.426 4.598 3.094 1094 HG13 ILE 144 HG13 ILE 144 -14.363 3.923 4.420 1095 HG21 ILE 144 HG21 ILE 144 -11.104 5.853 5.496 1096 HG22 ILE 144 HG22 ILE 144 -11.383 5.474 3.798 1097 HG23 ILE 144 HG23 ILE 144 -11.556 4.215 5.021 1098 HD11 ILE 144 HD11 ILE 144 -15.913 5.785 4.294 1099 HD12 ILE 144 HD12 ILE 144 -15.768 4.981 2.733 1100 HD13 ILE 144 HD13 ILE 144 -14.950 6.517 3.012 1101 H GLY 145 H GLY 145 -15.728 4.074 7.066 1102 HA2 GLY 145 HA2 GLY 145 -17.731 4.711 8.084 1103 HA3 GLY 145 HA3 GLY 145 -17.280 6.391 7.888 1104 H SER 146 H SER 146 -17.486 3.932 5.333 1105 HA SER 146 HA SER 146 -19.662 5.486 4.078 1106 HB2 SER 146 HB2 SER 146 -17.698 5.172 2.647 1107 HB3 SER 146 HB3 SER 146 -17.811 3.423 2.848 1108 HG SER 146 HG SER 146 -18.779 4.420 0.881 Start of MODEL 7 1 H1 MET 1 H1 MET 1 -1.878 37.458 58.549 2 H2 MET 1 H2 MET 1 -3.324 38.321 58.453 3 H3 MET 1 H3 MET 1 -2.477 37.934 57.042 4 HA MET 1 HA MET 1 -3.740 35.994 58.887 5 HB2 MET 1 HB2 MET 1 -4.574 37.032 56.170 6 HB3 MET 1 HB3 MET 1 -5.254 35.578 56.894 7 HG2 MET 1 HG2 MET 1 -6.688 37.525 57.233 8 HG3 MET 1 HG3 MET 1 -6.103 36.865 58.760 9 HE1 MET 1 HE1 MET 1 -6.256 40.615 59.696 10 HE2 MET 1 HE2 MET 1 -6.622 38.966 60.198 11 HE3 MET 1 HE3 MET 1 -7.415 39.653 58.780 12 H GLY 2 H GLY 2 -3.656 33.799 58.205 13 HA2 GLY 2 HA2 GLY 2 -1.967 33.098 55.928 14 HA3 GLY 2 HA3 GLY 2 -1.351 32.648 57.509 15 H SER 3 H SER 3 -2.107 30.922 55.277 16 HA SER 3 HA SER 3 -3.793 29.077 56.762 17 HB2 SER 3 HB2 SER 3 -5.478 30.366 55.532 18 HB3 SER 3 HB3 SER 3 -4.634 30.063 54.014 19 HG SER 3 HG SER 3 -6.174 28.331 55.595 20 H SER 4 H SER 4 -2.364 27.409 56.783 21 HA SER 4 HA SER 4 -0.879 26.738 54.348 22 HB2 SER 4 HB2 SER 4 0.386 25.169 55.811 23 HB3 SER 4 HB3 SER 4 0.433 26.833 56.390 24 HG SER 4 HG SER 4 -0.278 26.039 58.193 25 H HIS 5 H HIS 5 -2.724 25.985 53.186 26 HA HIS 5 HA HIS 5 -4.051 23.564 54.125 27 HB2 HIS 5 HB2 HIS 5 -5.412 23.796 52.038 28 HB3 HIS 5 HB3 HIS 5 -5.490 25.195 53.101 29 HD1 HIS 5 HD1 HIS 5 -4.777 24.220 49.671 30 HD2 HIS 5 HD2 HIS 5 -3.858 27.435 52.130 31 HE1 HIS 5 HE1 HIS 5 -4.022 26.046 48.136 32 HE2 HIS 5 HE2 HIS 5 -3.588 28.017 49.629 33 H HIS 6 H HIS 6 -2.978 21.736 53.908 34 HA HIS 6 HA HIS 6 -1.091 21.431 51.670 35 HB2 HIS 6 HB2 HIS 6 -0.241 19.497 53.221 36 HB3 HIS 6 HB3 HIS 6 0.161 21.169 53.596 37 HD1 HIS 6 HD1 HIS 6 -1.103 22.267 55.622 38 HD2 HIS 6 HD2 HIS 6 -1.814 18.202 55.120 39 HE1 HIS 6 HE1 HIS 6 -2.177 21.502 57.752 40 HE2 HIS 6 HE2 HIS 6 -2.735 19.084 57.366 41 H HIS 7 H HIS 7 -0.719 19.162 50.912 42 HA HIS 7 HA HIS 7 -3.051 17.411 50.932 43 HB2 HIS 7 HB2 HIS 7 -3.134 17.351 48.431 44 HB3 HIS 7 HB3 HIS 7 -3.631 18.896 49.112 45 HD1 HIS 7 HD1 HIS 7 -0.831 17.293 47.181 46 HD2 HIS 7 HD2 HIS 7 -2.048 21.072 48.407 47 HE1 HIS 7 HE1 HIS 7 0.632 18.904 45.936 48 HE2 HIS 7 HE2 HIS 7 -0.216 21.178 46.583 49 H HIS 8 H HIS 8 -2.504 15.269 50.622 50 HA HIS 8 HA HIS 8 0.281 14.702 49.835 51 HB2 HIS 8 HB2 HIS 8 0.496 13.044 51.629 52 HB3 HIS 8 HB3 HIS 8 0.192 14.650 52.277 53 HD1 HIS 8 HD1 HIS 8 -2.382 15.061 53.067 54 HD2 HIS 8 HD2 HIS 8 -1.195 11.113 52.554 55 HE1 HIS 8 HE1 HIS 8 -4.074 13.688 54.304 56 HE2 HIS 8 HE2 HIS 8 -3.370 11.300 53.945 57 H HIS 9 H HIS 9 -0.087 13.800 47.886 58 HA HIS 9 HA HIS 9 -1.198 11.102 47.933 59 HB2 HIS 9 HB2 HIS 9 -2.163 13.253 46.039 60 HB3 HIS 9 HB3 HIS 9 -2.339 11.534 45.690 61 HD1 HIS 9 HD1 HIS 9 -3.489 10.243 47.971 62 HD2 HIS 9 HD2 HIS 9 -4.433 14.208 47.150 63 HE1 HIS 9 HE1 HIS 9 -5.648 10.683 49.169 64 HE2 HIS 9 HE2 HIS 9 -6.185 13.093 48.690 65 H HIS 10 H HIS 10 -0.221 9.697 46.525 66 HA HIS 10 HA HIS 10 1.760 10.666 44.618 67 HB2 HIS 10 HB2 HIS 10 2.965 10.647 46.777 68 HB3 HIS 10 HB3 HIS 10 2.537 8.955 47.002 69 HD1 HIS 10 HD1 HIS 10 4.530 11.124 44.604 70 HD2 HIS 10 HD2 HIS 10 4.367 7.209 45.990 71 HE1 HIS 10 HE1 HIS 10 6.534 9.979 43.627 72 HE2 HIS 10 HE2 HIS 10 6.318 7.580 44.339 73 H SER 11 H SER 11 1.012 9.559 42.882 74 HA SER 11 HA SER 11 0.740 6.632 43.096 75 HB2 SER 11 HB2 SER 11 -1.353 6.681 41.815 76 HB3 SER 11 HB3 SER 11 -1.520 7.609 43.305 77 HG SER 11 HG SER 11 -2.389 8.740 41.532 78 H SER 12 H SER 12 1.284 5.470 41.287 79 HA SER 12 HA SER 12 1.649 6.742 38.706 80 HB2 SER 12 HB2 SER 12 4.030 5.536 40.153 81 HB3 SER 12 HB3 SER 12 4.015 6.005 38.453 82 HG SER 12 HG SER 12 4.707 7.832 39.261 83 H GLY 13 H GLY 13 1.654 5.278 36.994 84 HA2 GLY 13 HA2 GLY 13 0.869 2.541 37.692 85 HA3 GLY 13 HA3 GLY 13 0.682 3.310 36.124 86 H ARG 14 H ARG 14 1.617 0.811 36.109 87 HA ARG 14 HA ARG 14 4.362 1.188 35.165 88 HB2 ARG 14 HB2 ARG 14 4.673 0.318 37.409 89 HB3 ARG 14 HB3 ARG 14 3.534 -0.987 37.103 90 HG2 ARG 14 HG2 ARG 14 5.045 -1.941 35.441 91 HG3 ARG 14 HG3 ARG 14 6.177 -0.611 35.697 92 HD2 ARG 14 HD2 ARG 14 6.520 -1.306 37.997 93 HD3 ARG 14 HD3 ARG 14 5.322 -2.589 37.814 94 HE ARG 14 HE ARG 14 7.056 -3.235 35.903 95 HH11 ARG 14 HH11 ARG 14 7.625 -2.288 39.165 96 HH12 ARG 14 HH12 ARG 14 9.036 -3.270 39.321 97 HH21 ARG 14 HH21 ARG 14 8.870 -4.485 36.107 98 HH22 ARG 14 HH22 ARG 14 9.742 -4.493 37.603 99 H GLU 15 H GLU 15 4.131 0.744 33.063 100 HA GLU 15 HA GLU 15 3.453 -1.927 32.240 101 HB2 GLU 15 HB2 GLU 15 1.206 -0.924 32.399 102 HB3 GLU 15 HB3 GLU 15 1.700 0.364 31.307 103 HG2 GLU 15 HG2 GLU 15 2.003 -1.234 29.511 104 HG3 GLU 15 HG3 GLU 15 1.609 -2.567 30.595 105 H ASN 16 H ASN 16 5.518 -1.975 31.372 106 HA ASN 16 HA ASN 16 6.007 -0.210 29.052 107 HB2 ASN 16 HB2 ASN 16 7.575 0.200 30.908 108 HB3 ASN 16 HB3 ASN 16 8.044 -1.497 30.891 109 HD21 ASN 16 HD21 ASN 16 7.437 0.460 28.025 110 HD22 ASN 16 HD22 ASN 16 9.069 0.443 27.465 111 H LEU 17 H LEU 17 5.552 -1.357 27.262 112 HA LEU 17 HA LEU 17 6.407 -4.175 27.092 113 HB2 LEU 17 HB2 LEU 17 4.332 -2.636 25.531 114 HB3 LEU 17 HB3 LEU 17 4.886 -4.228 25.057 115 HG LEU 17 HG LEU 17 2.826 -4.518 26.197 116 HD11 LEU 17 HD11 LEU 17 5.059 -5.225 28.098 117 HD12 LEU 17 HD12 LEU 17 4.532 -6.177 26.711 118 HD13 LEU 17 HD13 LEU 17 3.444 -5.935 28.076 119 HD21 LEU 17 HD21 LEU 17 2.385 -3.696 28.449 120 HD22 LEU 17 HD22 LEU 17 2.736 -2.364 27.350 121 HD23 LEU 17 HD23 LEU 17 3.967 -2.913 28.489 122 H TYR 18 H TYR 18 7.255 -4.921 24.996 123 HA TYR 18 HA TYR 18 9.341 -3.189 24.048 124 HB2 TYR 18 HB2 TYR 18 10.022 -5.098 22.666 125 HB3 TYR 18 HB3 TYR 18 9.709 -5.609 24.320 126 HD1 TYR 18 HD2 TYR 18 7.632 -6.901 24.844 127 HD2 TYR 18 HD1 TYR 18 8.730 -5.960 20.835 128 HE1 TYR 18 HE2 TYR 18 6.076 -8.616 24.016 129 HE2 TYR 18 HE1 TYR 18 7.174 -7.671 20.004 130 HH TYR 18 HH TYR 18 4.814 -9.123 21.972 131 H PHE 19 H PHE 19 9.762 -2.918 21.669 132 HA PHE 19 HA PHE 19 7.612 -3.149 19.797 133 HB2 PHE 19 HB2 PHE 19 6.878 -1.118 21.018 134 HB3 PHE 19 HB3 PHE 19 8.406 -0.339 20.620 135 HD1 PHE 19 HD2 PHE 19 5.377 -1.856 19.092 136 HD2 PHE 19 HD1 PHE 19 8.642 0.839 18.599 137 HE1 PHE 19 HE2 PHE 19 4.403 -1.066 16.978 138 HE2 PHE 19 HE1 PHE 19 7.666 1.635 16.485 139 HZ PHE 19 HZ PHE 19 5.545 0.683 15.670 140 H GLN 20 H GLN 20 8.704 -3.830 18.067 141 HA GLN 20 HA GLN 20 11.217 -2.465 17.325 142 HB2 GLN 20 HB2 GLN 20 11.707 -4.679 18.242 143 HB3 GLN 20 HB3 GLN 20 10.578 -5.418 17.112 144 HG2 GLN 20 HG2 GLN 20 11.984 -4.790 15.242 145 HG3 GLN 20 HG3 GLN 20 13.086 -3.937 16.323 146 HE21 GLN 20 HE21 GLN 20 14.454 -5.135 17.663 147 HE22 GLN 20 HE22 GLN 20 14.757 -6.812 17.394 148 H GLY 21 H GLY 21 11.278 -1.660 15.320 149 HA2 GLY 21 HA2 GLY 21 10.101 -2.855 13.033 150 HA3 GLY 21 HA3 GLY 21 9.065 -1.561 13.616 151 H HIS 22 H HIS 22 10.187 -1.431 11.080 152 HA HIS 22 HA HIS 22 11.743 0.991 11.260 153 HB2 HIS 22 HB2 HIS 22 13.577 -0.584 11.494 154 HB3 HIS 22 HB3 HIS 22 13.034 -1.488 10.086 155 HD1 HIS 22 HD1 HIS 22 14.697 1.751 11.046 156 HD2 HIS 22 HD2 HIS 22 13.840 -0.445 7.621 157 HE1 HIS 22 HE1 HIS 22 15.952 2.877 9.192 158 HE2 HIS 22 HE2 HIS 22 15.263 1.654 7.113 159 H MET 23 H MET 23 10.236 2.025 10.030 160 HA MET 23 HA MET 23 9.355 0.960 7.504 161 HB2 MET 23 HB2 MET 23 8.180 3.163 7.283 162 HB3 MET 23 HB3 MET 23 7.760 2.234 8.716 163 HG2 MET 23 HG2 MET 23 9.184 3.638 10.085 164 HG3 MET 23 HG3 MET 23 9.705 4.536 8.660 165 HE1 MET 23 HE1 MET 23 6.454 3.403 10.592 166 HE2 MET 23 HE2 MET 23 6.059 3.271 8.877 167 HE3 MET 23 HE3 MET 23 5.267 4.493 9.873 168 H LEU 24 H LEU 24 9.627 1.919 5.476 169 HA LEU 24 HA LEU 24 12.161 3.383 5.127 170 HB2 LEU 24 HB2 LEU 24 10.591 1.507 3.403 171 HB3 LEU 24 HB3 LEU 24 11.603 2.706 2.621 172 HG LEU 24 HG LEU 24 12.764 0.898 4.726 173 HD11 LEU 24 HD11 LEU 24 13.413 -0.679 2.988 174 HD12 LEU 24 HD12 LEU 24 12.509 0.250 1.790 175 HD13 LEU 24 HD13 LEU 24 11.657 -0.563 3.102 176 HD21 LEU 24 HD21 LEU 24 13.941 2.269 2.301 177 HD22 LEU 24 HD22 LEU 24 14.827 1.304 3.484 178 HD23 LEU 24 HD23 LEU 24 14.080 2.825 3.972 179 H GLU 25 H GLU 25 12.195 5.412 4.399 180 HA GLU 25 HA GLU 25 9.712 6.809 4.005 181 HB2 GLU 25 HB2 GLU 25 12.591 7.632 4.104 182 HB3 GLU 25 HB3 GLU 25 11.370 8.759 3.512 183 HG2 GLU 25 HG2 GLU 25 10.264 8.838 5.544 184 HG3 GLU 25 HG3 GLU 25 10.981 7.333 6.105 185 H VAL 26 H VAL 26 8.654 6.698 2.250 186 HA VAL 26 HA VAL 26 10.034 6.564 -0.366 187 HB VAL 26 HB VAL 26 8.503 4.811 -1.134 188 HG11 VAL 26 HG11 VAL 26 10.660 4.143 -0.167 189 HG12 VAL 26 HG12 VAL 26 9.415 2.924 0.103 190 HG13 VAL 26 HG13 VAL 26 9.901 3.995 1.419 191 HG21 VAL 26 HG21 VAL 26 7.042 3.620 0.449 192 HG22 VAL 26 HG22 VAL 26 6.579 5.312 0.278 193 HG23 VAL 26 HG23 VAL 26 7.466 4.782 1.707 194 H GLU 27 H GLU 27 8.569 7.001 -2.231 195 HA GLU 27 HA GLU 27 6.323 8.754 -1.470 196 HB2 GLU 27 HB2 GLU 27 8.060 9.678 -3.009 197 HB3 GLU 27 HB3 GLU 27 7.599 8.467 -4.201 198 HG2 GLU 27 HG2 GLU 27 5.422 9.409 -4.440 199 HG3 GLU 27 HG3 GLU 27 5.662 10.475 -3.059 200 H VAL 28 H VAL 28 4.301 8.098 -1.680 201 HA VAL 28 HA VAL 28 3.750 5.455 -2.803 202 HB VAL 28 HB VAL 28 1.934 7.239 -1.165 203 HG11 VAL 28 HG11 VAL 28 1.794 4.285 -1.775 204 HG12 VAL 28 HG12 VAL 28 0.738 5.540 -2.428 205 HG13 VAL 28 HG13 VAL 28 0.703 5.166 -0.704 206 HG21 VAL 28 HG21 VAL 28 2.574 5.880 0.773 207 HG22 VAL 28 HG22 VAL 28 3.964 6.729 0.099 208 HG23 VAL 28 HG23 VAL 28 3.744 5.008 -0.217 209 H ILE 29 H ILE 29 3.009 5.344 -4.860 210 HA ILE 29 HA ILE 29 1.663 7.693 -6.016 211 HB ILE 29 HB ILE 29 2.452 5.302 -7.652 212 HG12 ILE 29 HG12 ILE 29 4.361 7.507 -6.817 213 HG13 ILE 29 HG13 ILE 29 4.407 5.862 -6.194 214 HG21 ILE 29 HG21 ILE 29 1.204 7.063 -8.744 215 HG22 ILE 29 HG22 ILE 29 2.866 7.095 -9.337 216 HG23 ILE 29 HG23 ILE 29 2.329 8.282 -8.142 217 HD11 ILE 29 HD11 ILE 29 6.070 6.159 -7.901 218 HD12 ILE 29 HD12 ILE 29 4.846 6.707 -9.046 219 HD13 ILE 29 HD13 ILE 29 4.831 5.040 -8.467 220 H SER 30 H SER 30 -0.179 7.390 -7.459 221 HA SER 30 HA SER 30 -1.739 4.926 -7.004 222 HB2 SER 30 HB2 SER 30 -2.786 7.769 -7.056 223 HB3 SER 30 HB3 SER 30 -3.818 6.338 -7.115 224 HG SER 30 HG SER 30 -2.058 6.127 -5.091 225 H GLY 31 H GLY 31 -1.644 3.865 -8.895 226 HA2 GLY 31 HA2 GLY 31 -1.790 5.425 -11.408 227 HA3 GLY 31 HA3 GLY 31 -1.029 3.853 -11.243 228 H ARG 32 H ARG 32 -3.362 5.122 -12.851 229 HA ARG 32 HA ARG 32 -5.726 3.725 -12.213 230 HB2 ARG 32 HB2 ARG 32 -5.900 5.639 -13.613 231 HB3 ARG 32 HB3 ARG 32 -4.727 5.002 -14.757 232 HG2 ARG 32 HG2 ARG 32 -6.313 3.277 -15.451 233 HG3 ARG 32 HG3 ARG 32 -7.489 3.877 -14.283 234 HD2 ARG 32 HD2 ARG 32 -6.351 5.602 -16.477 235 HD3 ARG 32 HD3 ARG 32 -7.788 4.606 -16.703 236 HE ARG 32 HE ARG 32 -8.304 6.069 -14.453 237 HH11 ARG 32 HH11 ARG 32 -7.390 6.861 -17.682 238 HH12 ARG 32 HH12 ARG 32 -8.352 8.299 -17.713 239 HH21 ARG 32 HH21 ARG 32 -9.530 7.908 -14.505 240 HH22 ARG 32 HH22 ARG 32 -9.560 8.881 -15.936 241 H THR 33 H THR 33 -5.313 1.528 -11.858 242 HA THR 33 HA THR 33 -4.521 -0.132 -14.122 243 HB THR 33 HB THR 33 -5.009 -2.057 -12.601 244 HG1 THR 33 HG1 THR 33 -5.441 -1.551 -10.390 245 HG21 THR 33 HG21 THR 33 -2.754 -1.082 -12.700 246 HG22 THR 33 HG22 THR 33 -3.128 -1.682 -11.085 247 HG23 THR 33 HG23 THR 33 -3.188 0.049 -11.417 248 H LEU 34 H LEU 34 -7.390 1.136 -12.710 249 HA LEU 34 HA LEU 34 -9.078 -0.502 -14.503 250 HB2 LEU 34 HB2 LEU 34 -9.861 1.157 -12.090 251 HB3 LEU 34 HB3 LEU 34 -10.976 0.252 -13.099 252 HG LEU 34 HG LEU 34 -8.769 -0.986 -11.435 253 HD11 LEU 34 HD11 LEU 34 -10.510 0.022 -10.029 254 HD12 LEU 34 HD12 LEU 34 -10.542 -1.739 -9.943 255 HD13 LEU 34 HD13 LEU 34 -11.745 -0.883 -10.908 256 HD21 LEU 34 HD21 LEU 34 -11.053 -2.244 -12.963 257 HD22 LEU 34 HD22 LEU 34 -9.902 -3.099 -11.934 258 HD23 LEU 34 HD23 LEU 34 -9.346 -2.306 -13.407 259 H ASN 35 H ASN 35 -9.542 0.523 -16.381 260 HA ASN 35 HA ASN 35 -9.142 3.378 -16.633 261 HB2 ASN 35 HB2 ASN 35 -9.987 1.298 -18.659 262 HB3 ASN 35 HB3 ASN 35 -9.685 2.992 -19.041 263 HD21 ASN 35 HD21 ASN 35 -8.324 0.602 -19.992 264 HD22 ASN 35 HD22 ASN 35 -6.659 0.820 -19.589 265 H GLN 36 H GLN 36 -11.874 1.262 -16.270 266 HA GLN 36 HA GLN 36 -13.863 3.074 -17.214 267 HB2 GLN 36 HB2 GLN 36 -14.147 0.836 -15.203 268 HB3 GLN 36 HB3 GLN 36 -15.465 1.647 -16.033 269 HG2 GLN 36 HG2 GLN 36 -13.331 -0.043 -17.328 270 HG3 GLN 36 HG3 GLN 36 -15.007 -0.512 -17.045 271 HE21 GLN 36 HE21 GLN 36 -16.642 0.468 -18.292 272 HE22 GLN 36 HE22 GLN 36 -16.282 1.238 -19.795 273 H GLY 37 H GLY 37 -14.311 4.991 -16.328 274 HA2 GLY 37 HA2 GLY 37 -13.538 5.653 -13.649 275 HA3 GLY 37 HA3 GLY 37 -14.407 6.691 -14.766 276 H ALA 38 H ALA 38 -14.858 3.850 -12.686 277 HA ALA 38 HA ALA 38 -17.644 4.715 -12.202 278 HB1 ALA 38 HB1 ALA 38 -18.194 2.402 -11.736 279 HB2 ALA 38 HB2 ALA 38 -16.506 1.929 -11.941 280 HB3 ALA 38 HB3 ALA 38 -17.428 2.527 -13.322 281 H THR 39 H THR 39 -18.480 3.898 -10.009 282 HA THR 39 HA THR 39 -16.669 4.809 -7.922 283 HB THR 39 HB THR 39 -18.586 4.652 -6.415 284 HG1 THR 39 HG1 THR 39 -20.660 4.050 -7.717 285 HG21 THR 39 HG21 THR 39 -18.442 6.672 -7.774 286 HG22 THR 39 HG22 THR 39 -20.132 6.220 -7.542 287 HG23 THR 39 HG23 THR 39 -19.332 5.884 -9.078 288 H VAL 40 H VAL 40 -16.406 3.570 -5.898 289 HA VAL 40 HA VAL 40 -15.612 0.900 -6.210 290 HB VAL 40 HB VAL 40 -16.538 2.195 -3.634 291 HG11 VAL 40 HG11 VAL 40 -15.011 0.585 -2.557 292 HG12 VAL 40 HG12 VAL 40 -14.706 -0.152 -4.131 293 HG13 VAL 40 HG13 VAL 40 -16.324 -0.210 -3.429 294 HG21 VAL 40 HG21 VAL 40 -13.778 2.171 -4.866 295 HG22 VAL 40 HG22 VAL 40 -14.195 2.816 -3.278 296 HG23 VAL 40 HG23 VAL 40 -14.842 3.571 -4.734 297 H GLU 41 H GLU 41 -18.671 2.297 -5.157 298 HA GLU 41 HA GLU 41 -20.061 -0.017 -4.435 299 HB2 GLU 41 HB2 GLU 41 -20.889 2.246 -3.990 300 HB3 GLU 41 HB3 GLU 41 -21.099 2.526 -5.713 301 HG2 GLU 41 HG2 GLU 41 -22.791 0.744 -5.778 302 HG3 GLU 41 HG3 GLU 41 -22.594 0.509 -4.042 303 H GLU 42 H GLU 42 -19.741 1.563 -7.602 304 HA GLU 42 HA GLU 42 -21.397 -0.138 -9.092 305 HB2 GLU 42 HB2 GLU 42 -20.577 1.990 -9.963 306 HB3 GLU 42 HB3 GLU 42 -18.927 1.386 -9.950 307 HG2 GLU 42 HG2 GLU 42 -19.616 1.273 -12.187 308 HG3 GLU 42 HG3 GLU 42 -19.696 -0.382 -11.593 309 H LYS 43 H LYS 43 -18.110 -0.556 -7.987 310 HA LYS 43 HA LYS 43 -17.837 -3.009 -9.606 311 HB2 LYS 43 HB2 LYS 43 -15.744 -1.138 -8.525 312 HB3 LYS 43 HB3 LYS 43 -15.388 -2.673 -9.309 313 HG2 LYS 43 HG2 LYS 43 -16.448 -1.866 -11.365 314 HG3 LYS 43 HG3 LYS 43 -16.794 -0.322 -10.579 315 HD2 LYS 43 HD2 LYS 43 -14.443 0.146 -10.337 316 HD3 LYS 43 HD3 LYS 43 -14.013 -1.466 -10.912 317 HE2 LYS 43 HE2 LYS 43 -15.378 0.690 -12.521 318 HE3 LYS 43 HE3 LYS 43 -13.687 0.212 -12.650 319 HZ1 LYS 43 HZ1 LYS 43 -14.556 -2.076 -13.197 320 HZ2 LYS 43 HZ2 LYS 43 -14.799 -0.894 -14.377 321 HZ3 LYS 43 HZ3 LYS 43 -16.082 -1.368 -13.388 322 H LEU 44 H LEU 44 -19.124 -2.843 -6.921 323 HA LEU 44 HA LEU 44 -17.412 -3.994 -4.985 324 HB2 LEU 44 HB2 LEU 44 -20.408 -4.167 -5.323 325 HB3 LEU 44 HB3 LEU 44 -19.558 -4.853 -3.951 326 HG LEU 44 HG LEU 44 -19.615 -1.921 -4.688 327 HD11 LEU 44 HD11 LEU 44 -20.979 -1.650 -2.682 328 HD12 LEU 44 HD12 LEU 44 -20.973 -3.397 -2.431 329 HD13 LEU 44 HD13 LEU 44 -21.766 -2.712 -3.849 330 HD21 LEU 44 HD21 LEU 44 -18.522 -1.593 -2.494 331 HD22 LEU 44 HD22 LEU 44 -17.512 -2.492 -3.624 332 HD23 LEU 44 HD23 LEU 44 -18.359 -3.343 -2.332 333 H THR 45 H THR 45 -16.172 -5.524 -6.127 334 HA THR 45 HA THR 45 -17.093 -8.215 -5.965 335 HB THR 45 HB THR 45 -18.232 -7.733 -8.056 336 HG1 THR 45 HG1 THR 45 -17.356 -9.401 -9.247 337 HG21 THR 45 HG21 THR 45 -15.535 -6.855 -9.111 338 HG22 THR 45 HG22 THR 45 -16.924 -5.811 -8.805 339 HG23 THR 45 HG23 THR 45 -17.001 -7.036 -10.072 340 H GLU 46 H GLU 46 -15.378 -9.666 -7.296 341 HA GLU 46 HA GLU 46 -12.906 -9.317 -6.036 342 HB2 GLU 46 HB2 GLU 46 -13.679 -10.976 -8.436 343 HB3 GLU 46 HB3 GLU 46 -12.081 -11.040 -7.712 344 HG2 GLU 46 HG2 GLU 46 -13.367 -12.879 -6.899 345 HG3 GLU 46 HG3 GLU 46 -13.109 -11.746 -5.578 346 H GLU 47 H GLU 47 -14.050 -8.068 -9.088 347 HA GLU 47 HA GLU 47 -11.687 -7.481 -10.420 348 HB2 GLU 47 HB2 GLU 47 -13.887 -7.133 -11.429 349 HB3 GLU 47 HB3 GLU 47 -14.226 -5.831 -10.297 350 HG2 GLU 47 HG2 GLU 47 -12.384 -4.519 -11.274 351 HG3 GLU 47 HG3 GLU 47 -12.081 -5.820 -12.424 352 H TYR 48 H TYR 48 -13.278 -5.639 -7.832 353 HA TYR 48 HA TYR 48 -11.357 -3.503 -7.891 354 HB2 TYR 48 HB2 TYR 48 -13.891 -3.857 -6.767 355 HB3 TYR 48 HB3 TYR 48 -12.822 -3.746 -5.373 356 HD1 TYR 48 HD2 TYR 48 -13.857 -2.004 -8.473 357 HD2 TYR 48 HD1 TYR 48 -11.944 -1.628 -4.691 358 HE1 TYR 48 HE2 TYR 48 -13.816 0.438 -8.747 359 HE2 TYR 48 HE1 TYR 48 -11.895 0.814 -4.961 360 HH TYR 48 HH TYR 48 -11.948 2.478 -6.790 361 H PHE 49 H PHE 49 -11.495 -6.604 -6.395 362 HA PHE 49 HA PHE 49 -9.720 -6.026 -4.214 363 HB2 PHE 49 HB2 PHE 49 -11.427 -7.889 -4.254 364 HB3 PHE 49 HB3 PHE 49 -10.389 -8.740 -5.389 365 HD1 PHE 49 HD2 PHE 49 -8.210 -9.634 -4.653 366 HD2 PHE 49 HD1 PHE 49 -10.900 -7.780 -1.914 367 HE1 PHE 49 HE2 PHE 49 -6.971 -10.621 -2.769 368 HE2 PHE 49 HE1 PHE 49 -9.662 -8.768 -0.029 369 HZ PHE 49 HZ PHE 49 -7.699 -10.191 -0.454 370 H ASN 50 H ASN 50 -9.244 -8.231 -6.993 371 HA ASN 50 HA ASN 50 -6.463 -8.463 -6.586 372 HB2 ASN 50 HB2 ASN 50 -8.119 -9.042 -9.050 373 HB3 ASN 50 HB3 ASN 50 -6.453 -9.569 -8.810 374 HD21 ASN 50 HD21 ASN 50 -9.023 -11.050 -9.116 375 HD22 ASN 50 HD22 ASN 50 -9.062 -12.127 -7.767 376 H ALA 51 H ALA 51 -8.114 -5.812 -7.818 377 HA ALA 51 HA ALA 51 -6.082 -5.063 -9.775 378 HB1 ALA 51 HB1 ALA 51 -8.612 -3.621 -9.005 379 HB2 ALA 51 HB2 ALA 51 -8.449 -4.772 -10.331 380 HB3 ALA 51 HB3 ALA 51 -7.565 -3.246 -10.375 381 H VAL 52 H VAL 52 -7.114 -4.044 -6.531 382 HA VAL 52 HA VAL 52 -4.988 -1.980 -6.584 383 HB VAL 52 HB VAL 52 -6.386 -0.414 -5.345 384 HG11 VAL 52 HG11 VAL 52 -7.933 0.221 -7.115 385 HG12 VAL 52 HG12 VAL 52 -7.778 -1.376 -7.848 386 HG13 VAL 52 HG13 VAL 52 -6.388 -0.292 -7.794 387 HG21 VAL 52 HG21 VAL 52 -8.791 -0.826 -5.024 388 HG22 VAL 52 HG22 VAL 52 -7.804 -1.994 -4.145 389 HG23 VAL 52 HG23 VAL 52 -8.588 -2.461 -5.653 390 H ASN 53 H ASN 53 -5.647 -4.759 -5.093 391 HA ASN 53 HA ASN 53 -5.439 -3.847 -2.318 392 HB2 ASN 53 HB2 ASN 53 -5.835 -6.582 -3.529 393 HB3 ASN 53 HB3 ASN 53 -5.648 -6.312 -1.800 394 HD21 ASN 53 HD21 ASN 53 -7.349 -4.078 -3.901 395 HD22 ASN 53 HD22 ASN 53 -8.915 -4.407 -3.275 396 H TYR 54 H TYR 54 -3.104 -3.715 -4.284 397 HA TYR 54 HA TYR 54 -1.153 -5.019 -2.525 398 HB2 TYR 54 HB2 TYR 54 0.081 -5.979 -4.393 399 HB3 TYR 54 HB3 TYR 54 -1.574 -6.575 -4.409 400 HD1 TYR 54 HD2 TYR 54 -3.232 -5.458 -6.026 401 HD2 TYR 54 HD1 TYR 54 0.991 -4.923 -6.307 402 HE1 TYR 54 HE2 TYR 54 -3.483 -4.701 -8.350 403 HE2 TYR 54 HE1 TYR 54 0.739 -4.153 -8.627 404 HH TYR 54 HH TYR 54 -2.294 -3.372 -9.995 405 H ALA 55 H ALA 55 0.910 -4.113 -2.530 406 HA ALA 55 HA ALA 55 1.236 -1.574 -4.013 407 HB1 ALA 55 HB1 ALA 55 1.045 -1.201 -1.597 408 HB2 ALA 55 HB2 ALA 55 2.658 -0.796 -2.182 409 HB3 ALA 55 HB3 ALA 55 2.388 -2.308 -1.313 410 H GLU 56 H GLU 56 3.043 -1.377 -5.258 411 HA GLU 56 HA GLU 56 4.856 -3.678 -5.358 412 HB2 GLU 56 HB2 GLU 56 4.537 -1.389 -7.315 413 HB3 GLU 56 HB3 GLU 56 5.566 -2.800 -7.540 414 HG2 GLU 56 HG2 GLU 56 3.505 -4.220 -7.378 415 HG3 GLU 56 HG3 GLU 56 2.563 -2.732 -7.394 416 H ILE 57 H ILE 57 6.692 -3.579 -4.272 417 HA ILE 57 HA ILE 57 7.905 -0.957 -3.668 418 HB ILE 57 HB ILE 57 8.339 -3.568 -2.178 419 HG12 ILE 57 HG12 ILE 57 7.050 -2.194 -0.336 420 HG13 ILE 57 HG13 ILE 57 6.397 -1.319 -1.717 421 HG21 ILE 57 HG21 ILE 57 9.155 -0.741 -1.499 422 HG22 ILE 57 HG22 ILE 57 10.226 -2.058 -1.978 423 HG23 ILE 57 HG23 ILE 57 9.357 -2.142 -0.446 424 HD11 ILE 57 HD11 ILE 57 6.189 -4.286 -1.264 425 HD12 ILE 57 HD12 ILE 57 5.502 -3.388 -2.618 426 HD13 ILE 57 HD13 ILE 57 4.915 -3.099 -0.980 427 H ASN 58 H ASN 58 10.221 -0.822 -3.642 428 HA ASN 58 HA ASN 58 11.488 -1.859 -5.937 429 HB2 ASN 58 HB2 ASN 58 12.962 -0.775 -3.540 430 HB3 ASN 58 HB3 ASN 58 13.358 -0.595 -5.251 431 HD21 ASN 58 HD21 ASN 58 12.084 0.821 -6.509 432 HD22 ASN 58 HD22 ASN 58 11.173 2.088 -5.770 433 H GLU 59 H GLU 59 13.306 -3.327 -6.101 434 HA GLU 59 HA GLU 59 12.948 -5.691 -4.567 435 HB2 GLU 59 HB2 GLU 59 13.680 -5.825 -6.883 436 HB3 GLU 59 HB3 GLU 59 15.164 -4.962 -6.496 437 HG2 GLU 59 HG2 GLU 59 16.023 -6.778 -5.259 438 HG3 GLU 59 HG3 GLU 59 14.456 -7.581 -5.202 439 H GLU 60 H GLU 60 15.479 -3.186 -4.512 440 HA GLU 60 HA GLU 60 17.097 -4.418 -2.549 441 HB2 GLU 60 HB2 GLU 60 16.745 -1.496 -3.228 442 HB3 GLU 60 HB3 GLU 60 17.964 -2.105 -2.116 443 HG2 GLU 60 HG2 GLU 60 18.819 -3.528 -4.022 444 HG3 GLU 60 HG3 GLU 60 17.749 -2.607 -5.078 445 H ASP 61 H ASP 61 14.561 -1.929 -2.213 446 HA ASP 61 HA ASP 61 14.589 -1.853 0.611 447 HB2 ASP 61 HB2 ASP 61 12.395 -1.138 -1.348 448 HB3 ASP 61 HB3 ASP 61 12.396 -0.715 0.364 449 H TRP 62 H TRP 62 12.886 -3.887 -1.684 450 HA TRP 62 HA TRP 62 11.047 -5.212 -0.092 451 HB2 TRP 62 HB2 TRP 62 11.282 -5.517 -2.527 452 HB3 TRP 62 HB3 TRP 62 12.813 -6.343 -2.286 453 HD1 TRP 62 HD1 TRP 62 12.722 -8.897 -1.534 454 HE1 TRP 62 HE1 TRP 62 10.807 -10.619 -1.492 455 HE3 TRP 62 HE3 TRP 62 8.758 -5.718 -2.099 456 HZ2 TRP 62 HZ2 TRP 62 8.002 -10.621 -1.691 457 HZ3 TRP 62 HZ3 TRP 62 6.490 -6.663 -2.164 458 HH2 TRP 62 HH2 TRP 62 6.119 -9.065 -1.962 459 H ASN 63 H ASN 63 14.418 -6.221 -0.734 460 HA ASN 63 HA ASN 63 14.446 -8.231 1.290 461 HB2 ASN 63 HB2 ASN 63 16.706 -6.851 -0.179 462 HB3 ASN 63 HB3 ASN 63 16.923 -8.227 0.901 463 HD21 ASN 63 HD21 ASN 63 17.466 -7.966 -1.955 464 HD22 ASN 63 HD22 ASN 63 16.561 -9.225 -2.716 465 H ALA 64 H ALA 64 15.211 -4.812 1.257 466 HA ALA 64 HA ALA 64 16.647 -4.597 3.656 467 HB1 ALA 64 HB1 ALA 64 14.714 -2.577 2.498 468 HB2 ALA 64 HB2 ALA 64 16.403 -2.760 2.019 469 HB3 ALA 64 HB3 ALA 64 16.002 -2.252 3.660 470 H LEU 65 H LEU 65 13.147 -4.624 3.073 471 HA LEU 65 HA LEU 65 12.539 -4.460 5.919 472 HB2 LEU 65 HB2 LEU 65 10.752 -4.847 3.511 473 HB3 LEU 65 HB3 LEU 65 10.178 -4.639 5.156 474 HG LEU 65 HG LEU 65 11.764 -2.575 3.617 475 HD11 LEU 65 HD11 LEU 65 9.571 -2.885 2.620 476 HD12 LEU 65 HD12 LEU 65 9.658 -1.341 3.467 477 HD13 LEU 65 HD13 LEU 65 8.806 -2.702 4.200 478 HD21 LEU 65 HD21 LEU 65 12.073 -2.430 6.040 479 HD22 LEU 65 HD22 LEU 65 10.323 -2.389 6.267 480 HD23 LEU 65 HD23 LEU 65 11.137 -1.065 5.431 481 H GLY 66 H GLY 66 13.319 -6.923 3.732 482 HA2 GLY 66 HA2 GLY 66 13.289 -9.223 3.903 483 HA3 GLY 66 HA3 GLY 66 12.760 -9.031 5.568 484 H LEU 67 H LEU 67 11.273 -8.124 2.466 485 HA LEU 67 HA LEU 67 8.720 -9.159 3.368 486 HB2 LEU 67 HB2 LEU 67 9.549 -7.720 0.848 487 HB3 LEU 67 HB3 LEU 67 7.905 -8.242 1.174 488 HG LEU 67 HG LEU 67 9.475 -6.241 2.813 489 HD11 LEU 67 HD11 LEU 67 7.865 -4.607 1.938 490 HD12 LEU 67 HD12 LEU 67 7.166 -5.855 0.905 491 HD13 LEU 67 HD13 LEU 67 8.832 -5.333 0.654 492 HD21 LEU 67 HD21 LEU 67 7.964 -7.475 4.230 493 HD22 LEU 67 HD22 LEU 67 6.640 -7.252 3.085 494 HD23 LEU 67 HD23 LEU 67 7.304 -5.863 3.950 495 H GLN 68 H GLN 68 7.404 -10.533 2.066 496 HA GLN 68 HA GLN 68 8.818 -12.367 0.249 497 HB2 GLN 68 HB2 GLN 68 8.702 -13.402 2.511 498 HB3 GLN 68 HB3 GLN 68 6.955 -13.217 2.487 499 HG2 GLN 68 HG2 GLN 68 6.835 -14.718 0.541 500 HG3 GLN 68 HG3 GLN 68 8.585 -14.927 0.614 501 HE21 GLN 68 HE21 GLN 68 8.453 -17.127 0.981 502 HE22 GLN 68 HE22 GLN 68 7.889 -17.794 2.468 503 H GLU 69 H GLU 69 7.628 -12.827 -1.552 504 HA GLU 69 HA GLU 69 5.525 -11.103 -2.198 505 HB2 GLU 69 HB2 GLU 69 6.439 -13.637 -3.573 506 HB3 GLU 69 HB3 GLU 69 5.319 -12.470 -4.277 507 HG2 GLU 69 HG2 GLU 69 6.976 -10.753 -4.238 508 HG3 GLU 69 HG3 GLU 69 8.086 -11.771 -3.332 509 H GLY 70 H GLY 70 3.884 -11.201 -0.789 510 HA2 GLY 70 HA2 GLY 70 1.560 -12.340 -1.087 511 HA3 GLY 70 HA3 GLY 70 2.414 -13.737 -0.459 512 H ASP 71 H ASP 71 3.848 -11.306 1.225 513 HA ASP 71 HA ASP 71 2.004 -11.727 3.458 514 HB2 ASP 71 HB2 ASP 71 3.804 -10.636 4.858 515 HB3 ASP 71 HB3 ASP 71 4.227 -12.164 4.104 516 H ARG 72 H ARG 72 2.330 -9.567 5.077 517 HA ARG 72 HA ARG 72 0.670 -7.617 3.615 518 HB2 ARG 72 HB2 ARG 72 0.672 -8.456 6.518 519 HB3 ARG 72 HB3 ARG 72 -0.192 -7.038 5.942 520 HG2 ARG 72 HG2 ARG 72 -1.754 -8.820 6.121 521 HG3 ARG 72 HG3 ARG 72 -1.478 -8.524 4.406 522 HD2 ARG 72 HD2 ARG 72 0.048 -10.439 4.319 523 HD3 ARG 72 HD3 ARG 72 -0.209 -10.724 6.040 524 HE ARG 72 HE ARG 72 -2.696 -10.890 5.164 525 HH11 ARG 72 HH11 ARG 72 0.170 -12.215 3.790 526 HH12 ARG 72 HH12 ARG 72 -0.653 -13.564 3.097 527 HH21 ARG 72 HH21 ARG 72 -3.740 -12.639 4.278 528 HH22 ARG 72 HH22 ARG 72 -2.837 -13.810 3.384 529 H VAL 73 H VAL 73 1.206 -5.527 3.521 530 HA VAL 73 HA VAL 73 3.285 -4.483 5.345 531 HB VAL 73 HB VAL 73 4.040 -2.966 3.521 532 HG11 VAL 73 HG11 VAL 73 5.267 -5.025 3.994 533 HG12 VAL 73 HG12 VAL 73 5.318 -4.639 2.274 534 HG13 VAL 73 HG13 VAL 73 4.241 -5.905 2.861 535 HG21 VAL 73 HG21 VAL 73 2.032 -2.955 2.140 536 HG22 VAL 73 HG22 VAL 73 2.250 -4.665 1.769 537 HG23 VAL 73 HG23 VAL 73 3.421 -3.481 1.189 538 H LYS 74 H LYS 74 2.992 -2.417 6.147 539 HA LYS 74 HA LYS 74 0.365 -1.183 5.621 540 HB2 LYS 74 HB2 LYS 74 0.788 -1.795 7.971 541 HB3 LYS 74 HB3 LYS 74 2.241 -0.803 7.972 542 HG2 LYS 74 HG2 LYS 74 0.804 1.188 7.498 543 HG3 LYS 74 HG3 LYS 74 -0.609 0.154 7.701 544 HD2 LYS 74 HD2 LYS 74 1.515 0.538 9.811 545 HD3 LYS 74 HD3 LYS 74 0.033 1.490 9.728 546 HE2 LYS 74 HE2 LYS 74 0.019 -1.517 9.877 547 HE3 LYS 74 HE3 LYS 74 0.046 -0.501 11.314 548 HZ1 LYS 74 HZ1 LYS 74 -2.034 0.478 10.667 549 HZ2 LYS 74 HZ2 LYS 74 -2.198 -1.209 10.676 550 HZ3 LYS 74 HZ3 LYS 74 -2.047 -0.383 9.210 551 H VAL 75 H VAL 75 0.218 1.083 5.368 552 HA VAL 75 HA VAL 75 2.682 2.471 4.534 553 HB VAL 75 HB VAL 75 0.044 2.543 3.028 554 HG11 VAL 75 HG11 VAL 75 1.258 3.880 1.371 555 HG12 VAL 75 HG12 VAL 75 2.696 3.847 2.391 556 HG13 VAL 75 HG13 VAL 75 1.239 4.673 2.946 557 HG21 VAL 75 HG21 VAL 75 1.260 1.415 1.203 558 HG22 VAL 75 HG22 VAL 75 1.168 0.418 2.653 559 HG23 VAL 75 HG23 VAL 75 2.669 1.254 2.254 560 H LYS 76 H LYS 76 2.758 4.630 5.129 561 HA LYS 76 HA LYS 76 0.375 5.772 6.427 562 HB2 LYS 76 HB2 LYS 76 3.014 5.166 7.699 563 HB3 LYS 76 HB3 LYS 76 2.108 6.571 8.249 564 HG2 LYS 76 HG2 LYS 76 0.373 5.296 9.094 565 HG3 LYS 76 HG3 LYS 76 0.746 3.915 8.061 566 HD2 LYS 76 HD2 LYS 76 2.478 3.197 9.407 567 HD3 LYS 76 HD3 LYS 76 2.709 4.787 10.151 568 HE2 LYS 76 HE2 LYS 76 0.334 2.963 10.596 569 HE3 LYS 76 HE3 LYS 76 1.690 3.159 11.707 570 HZ1 LYS 76 HZ1 LYS 76 -0.324 4.487 12.263 571 HZ2 LYS 76 HZ2 LYS 76 -0.065 5.398 10.862 572 HZ3 LYS 76 HZ3 LYS 76 1.088 5.406 12.099 573 H THR 77 H THR 77 0.045 7.840 6.042 574 HA THR 77 HA THR 77 2.281 9.603 5.258 575 HB THR 77 HB THR 77 0.990 10.649 3.505 576 HG1 THR 77 HG1 THR 77 -1.118 9.769 2.977 577 HG21 THR 77 HG21 THR 77 0.710 8.804 1.891 578 HG22 THR 77 HG22 THR 77 0.849 7.640 3.210 579 HG23 THR 77 HG23 THR 77 2.220 8.669 2.791 580 H GLU 78 H GLU 78 1.037 11.976 5.005 581 HA GLU 78 HA GLU 78 0.105 12.583 7.655 582 HB2 GLU 78 HB2 GLU 78 -0.075 14.890 6.870 583 HB3 GLU 78 HB3 GLU 78 1.466 14.185 6.406 584 HG2 GLU 78 HG2 GLU 78 0.579 13.801 4.136 585 HG3 GLU 78 HG3 GLU 78 -0.923 14.593 4.615 586 H PHE 79 H PHE 79 -1.460 11.368 4.948 587 HA PHE 79 HA PHE 79 -4.043 12.616 5.512 588 HB2 PHE 79 HB2 PHE 79 -3.231 10.572 3.429 589 HB3 PHE 79 HB3 PHE 79 -4.842 11.268 3.574 590 HD1 PHE 79 HD2 PHE 79 -5.268 13.582 2.940 591 HD2 PHE 79 HD1 PHE 79 -1.380 11.878 2.555 592 HE1 PHE 79 HE2 PHE 79 -4.590 15.454 1.499 593 HE2 PHE 79 HE1 PHE 79 -0.702 13.753 1.116 594 HZ PHE 79 HZ PHE 79 -2.305 15.541 0.586 595 H GLY 80 H GLY 80 -2.477 9.454 5.798 596 HA2 GLY 80 HA2 GLY 80 -3.871 8.581 8.017 597 HA3 GLY 80 HA3 GLY 80 -4.830 8.059 6.640 598 H GLU 81 H GLU 81 -4.493 5.851 6.991 599 HA GLU 81 HA GLU 81 -1.954 4.819 6.059 600 HB2 GLU 81 HB2 GLU 81 -1.553 3.381 7.999 601 HB3 GLU 81 HB3 GLU 81 -1.506 5.080 8.444 602 HG2 GLU 81 HG2 GLU 81 -3.698 4.941 9.427 603 HG3 GLU 81 HG3 GLU 81 -3.884 3.281 8.862 604 H VAL 82 H VAL 82 -1.983 2.532 5.593 605 HA VAL 82 HA VAL 82 -4.512 1.094 5.732 606 HB VAL 82 HB VAL 82 -4.701 2.511 3.686 607 HG11 VAL 82 HG11 VAL 82 -3.330 2.015 1.722 608 HG12 VAL 82 HG12 VAL 82 -2.373 0.876 2.668 609 HG13 VAL 82 HG13 VAL 82 -2.341 2.594 3.064 610 HG21 VAL 82 HG21 VAL 82 -4.570 -0.472 3.214 611 HG22 VAL 82 HG22 VAL 82 -5.351 0.687 2.137 612 HG23 VAL 82 HG23 VAL 82 -5.964 0.456 3.774 613 H VAL 83 H VAL 83 -4.281 -1.181 5.383 614 HA VAL 83 HA VAL 83 -1.493 -2.153 5.133 615 HB VAL 83 HB VAL 83 -3.841 -3.678 6.310 616 HG11 VAL 83 HG11 VAL 83 -2.119 -5.129 5.403 617 HG12 VAL 83 HG12 VAL 83 -2.090 -5.194 7.168 618 HG13 VAL 83 HG13 VAL 83 -0.875 -4.254 6.300 619 HG21 VAL 83 HG21 VAL 83 -3.324 -1.792 7.766 620 HG22 VAL 83 HG22 VAL 83 -1.616 -2.237 7.767 621 HG23 VAL 83 HG23 VAL 83 -2.807 -3.308 8.514 622 H VAL 84 H VAL 84 -1.014 -3.056 3.214 623 HA VAL 84 HA VAL 84 -3.159 -4.374 1.650 624 HB VAL 84 HB VAL 84 -2.103 -3.573 -0.418 625 HG11 VAL 84 HG11 VAL 84 -3.898 -2.226 0.527 626 HG12 VAL 84 HG12 VAL 84 -2.702 -1.192 -0.253 627 HG13 VAL 84 HG13 VAL 84 -2.738 -1.329 1.506 628 HG21 VAL 84 HG21 VAL 84 0.204 -3.391 0.343 629 HG22 VAL 84 HG22 VAL 84 -0.229 -2.048 1.402 630 HG23 VAL 84 HG23 VAL 84 -0.332 -1.860 -0.349 631 H PHE 85 H PHE 85 -2.073 -5.730 -0.232 632 HA PHE 85 HA PHE 85 -0.229 -7.604 0.972 633 HB2 PHE 85 HB2 PHE 85 -1.500 -7.476 -1.770 634 HB3 PHE 85 HB3 PHE 85 -0.377 -8.743 -1.294 635 HD1 PHE 85 HD1 PHE 85 -0.987 -10.143 0.771 636 HD2 PHE 85 HD2 PHE 85 -3.783 -7.705 -1.325 637 HE1 PHE 85 HE1 PHE 85 -2.841 -11.461 1.713 638 HE2 PHE 85 HE2 PHE 85 -5.640 -9.014 -0.383 639 HZ PHE 85 HZ PHE 85 -5.170 -10.896 1.138 640 H ALA 86 H ALA 86 1.890 -8.047 0.354 641 HA ALA 86 HA ALA 86 3.317 -5.798 -0.827 642 HB1 ALA 86 HB1 ALA 86 5.324 -6.853 0.028 643 HB2 ALA 86 HB2 ALA 86 4.410 -8.301 0.453 644 HB3 ALA 86 HB3 ALA 86 4.092 -6.781 1.288 645 H LYS 87 H LYS 87 3.882 -5.735 -2.895 646 HA LYS 87 HA LYS 87 4.791 -8.198 -4.229 647 HB2 LYS 87 HB2 LYS 87 2.912 -6.108 -5.336 648 HB3 LYS 87 HB3 LYS 87 3.874 -7.135 -6.390 649 HG2 LYS 87 HG2 LYS 87 2.811 -9.123 -5.384 650 HG3 LYS 87 HG3 LYS 87 1.814 -8.063 -4.401 651 HD2 LYS 87 HD2 LYS 87 0.726 -8.961 -6.499 652 HD3 LYS 87 HD3 LYS 87 0.670 -7.209 -6.294 653 HE2 LYS 87 HE2 LYS 87 2.529 -6.939 -7.811 654 HE3 LYS 87 HE3 LYS 87 2.716 -8.681 -7.936 655 HZ1 LYS 87 HZ1 LYS 87 0.683 -8.858 -9.104 656 HZ2 LYS 87 HZ2 LYS 87 1.530 -7.583 -9.828 657 HZ3 LYS 87 HZ3 LYS 87 0.253 -7.260 -8.769 658 H LYS 88 H LYS 88 6.303 -7.839 -5.967 659 HA LYS 88 HA LYS 88 8.047 -5.573 -5.340 660 HB2 LYS 88 HB2 LYS 88 8.733 -8.095 -5.377 661 HB3 LYS 88 HB3 LYS 88 8.797 -7.875 -7.122 662 HG2 LYS 88 HG2 LYS 88 10.321 -5.901 -6.656 663 HG3 LYS 88 HG3 LYS 88 10.418 -6.514 -5.006 664 HD2 LYS 88 HD2 LYS 88 11.186 -8.020 -7.511 665 HD3 LYS 88 HD3 LYS 88 12.306 -7.297 -6.358 666 HE2 LYS 88 HE2 LYS 88 11.559 -8.820 -4.625 667 HE3 LYS 88 HE3 LYS 88 10.331 -9.491 -5.699 668 HZ1 LYS 88 HZ1 LYS 88 12.110 -10.264 -7.163 669 HZ2 LYS 88 HZ2 LYS 88 12.259 -10.920 -5.613 670 HZ3 LYS 88 HZ3 LYS 88 13.272 -9.653 -6.095 671 H GLY 89 H GLY 89 8.378 -3.925 -6.754 672 HA2 GLY 89 HA2 GLY 89 7.449 -4.285 -9.547 673 HA3 GLY 89 HA3 GLY 89 7.040 -2.853 -8.618 674 H ASP 90 H ASP 90 8.426 -2.969 -11.149 675 HA ASP 90 HA ASP 90 11.222 -2.432 -10.684 676 HB2 ASP 90 HB2 ASP 90 9.544 -1.936 -13.155 677 HB3 ASP 90 HB3 ASP 90 11.303 -1.967 -13.079 678 H VAL 91 H VAL 91 9.894 -0.748 -9.034 679 HA VAL 91 HA VAL 91 9.625 1.877 -10.311 680 HB VAL 91 HB VAL 91 8.682 2.575 -8.096 681 HG11 VAL 91 HG11 VAL 91 7.366 0.148 -9.338 682 HG12 VAL 91 HG12 VAL 91 7.202 1.812 -9.897 683 HG13 VAL 91 HG13 VAL 91 6.569 1.345 -8.319 684 HG21 VAL 91 HG21 VAL 91 8.095 0.820 -6.460 685 HG22 VAL 91 HG22 VAL 91 9.840 0.994 -6.648 686 HG23 VAL 91 HG23 VAL 91 9.002 -0.356 -7.412 687 HA PRO 92 HA PRO 92 13.477 3.586 -8.834 688 HB2 PRO 92 HB2 PRO 92 12.008 5.905 -7.696 689 HB3 PRO 92 HB3 PRO 92 13.271 5.868 -8.931 690 HG2 PRO 92 HG2 PRO 92 10.727 6.353 -9.586 691 HG3 PRO 92 HG3 PRO 92 11.773 5.377 -10.635 692 HD2 PRO 92 HD2 PRO 92 9.648 4.478 -8.715 693 HD3 PRO 92 HD3 PRO 92 10.013 3.884 -10.349 694 H LYS 93 H LYS 93 14.734 3.314 -7.033 695 HA LYS 93 HA LYS 93 13.740 2.113 -4.737 696 HB2 LYS 93 HB2 LYS 93 16.098 2.002 -5.521 697 HB3 LYS 93 HB3 LYS 93 16.337 3.650 -4.952 698 HG2 LYS 93 HG2 LYS 93 15.956 2.971 -2.665 699 HG3 LYS 93 HG3 LYS 93 15.527 1.340 -3.184 700 HD2 LYS 93 HD2 LYS 93 17.829 1.070 -4.083 701 HD3 LYS 93 HD3 LYS 93 18.236 2.659 -3.430 702 HE2 LYS 93 HE2 LYS 93 17.742 1.865 -1.169 703 HE3 LYS 93 HE3 LYS 93 17.294 0.283 -1.808 704 HZ1 LYS 93 HZ1 LYS 93 19.983 1.538 -1.868 705 HZ2 LYS 93 HZ2 LYS 93 19.595 0.112 -2.684 706 HZ3 LYS 93 HZ3 LYS 93 19.513 0.168 -1.000 707 H GLY 94 H GLY 94 13.102 2.789 -2.697 708 HA2 GLY 94 HA2 GLY 94 12.329 4.274 -1.091 709 HA3 GLY 94 HA3 GLY 94 13.243 5.550 -1.884 710 H MET 95 H MET 95 10.912 3.643 -3.644 711 HA MET 95 HA MET 95 8.774 5.592 -3.378 712 HB2 MET 95 HB2 MET 95 10.407 6.451 -5.109 713 HB3 MET 95 HB3 MET 95 10.051 5.024 -6.066 714 HG2 MET 95 HG2 MET 95 7.772 5.707 -6.329 715 HG3 MET 95 HG3 MET 95 8.021 7.073 -5.239 716 HE1 MET 95 HE1 MET 95 7.233 8.917 -6.825 717 HE2 MET 95 HE2 MET 95 6.768 7.735 -8.048 718 HE3 MET 95 HE3 MET 95 7.760 9.121 -8.496 719 H ILE 96 H ILE 96 6.777 4.598 -3.732 720 HA ILE 96 HA ILE 96 6.852 1.826 -4.753 721 HB ILE 96 HB ILE 96 5.245 1.122 -3.044 722 HG12 ILE 96 HG12 ILE 96 5.692 3.857 -1.800 723 HG13 ILE 96 HG13 ILE 96 4.211 3.338 -2.598 724 HG21 ILE 96 HG21 ILE 96 6.789 1.078 -1.135 725 HG22 ILE 96 HG22 ILE 96 7.757 2.346 -1.889 726 HG23 ILE 96 HG23 ILE 96 7.623 0.763 -2.657 727 HD11 ILE 96 HD11 ILE 96 3.988 3.216 -0.196 728 HD12 ILE 96 HD12 ILE 96 5.387 2.149 -0.096 729 HD13 ILE 96 HD13 ILE 96 3.916 1.601 -0.900 730 H PHE 97 H PHE 97 5.071 1.076 -5.842 731 HA PHE 97 HA PHE 97 3.203 3.169 -6.756 732 HB2 PHE 97 HB2 PHE 97 4.574 2.200 -8.521 733 HB3 PHE 97 HB3 PHE 97 4.072 0.576 -8.069 734 HD1 PHE 97 HD2 PHE 97 3.020 3.724 -9.649 735 HD2 PHE 97 HD1 PHE 97 1.931 -0.298 -8.747 736 HE1 PHE 97 HE2 PHE 97 1.138 3.880 -11.222 737 HE2 PHE 97 HE1 PHE 97 0.048 -0.144 -10.324 738 HZ PHE 97 HZ PHE 97 -0.349 1.946 -11.564 739 H ILE 98 H ILE 98 1.211 3.077 -5.914 740 HA ILE 98 HA ILE 98 -0.023 0.425 -5.474 741 HB ILE 98 HB ILE 98 -0.686 3.051 -4.102 742 HG12 ILE 98 HG12 ILE 98 0.599 0.504 -3.068 743 HG13 ILE 98 HG13 ILE 98 1.376 2.074 -3.238 744 HG21 ILE 98 HG21 ILE 98 -1.928 0.315 -3.746 745 HG22 ILE 98 HG22 ILE 98 -2.702 1.726 -4.470 746 HG23 ILE 98 HG23 ILE 98 -2.277 1.735 -2.758 747 HD11 ILE 98 HD11 ILE 98 0.836 1.630 -0.926 748 HD12 ILE 98 HD12 ILE 98 -0.862 1.393 -1.341 749 HD13 ILE 98 HD13 ILE 98 -0.122 2.985 -1.524 750 HA PRO 99 HA PRO 99 -2.692 1.579 -8.924 751 HB2 PRO 99 HB2 PRO 99 -4.504 -0.409 -7.639 752 HB3 PRO 99 HB3 PRO 99 -3.944 -0.314 -9.312 753 HG2 PRO 99 HG2 PRO 99 -2.939 -2.141 -7.662 754 HG3 PRO 99 HG3 PRO 99 -1.891 -1.294 -8.818 755 HD2 PRO 99 HD2 PRO 99 -2.216 -0.846 -5.870 756 HD3 PRO 99 HD3 PRO 99 -0.738 -0.829 -6.856 757 H MET 100 H MET 100 -4.366 3.007 -9.166 758 HA MET 100 HA MET 100 -5.254 4.588 -7.063 759 HB2 MET 100 HB2 MET 100 -5.283 5.309 -9.399 760 HB3 MET 100 HB3 MET 100 -6.529 4.131 -9.770 761 HG2 MET 100 HG2 MET 100 -7.564 6.259 -9.629 762 HG3 MET 100 HG3 MET 100 -8.046 5.347 -8.205 763 HE1 MET 100 HE1 MET 100 -6.525 7.235 -5.267 764 HE2 MET 100 HE2 MET 100 -6.121 5.641 -5.903 765 HE3 MET 100 HE3 MET 100 -7.804 6.165 -5.833 766 H GLY 101 H GLY 101 -6.286 3.704 -5.331 767 HA2 GLY 101 HA2 GLY 101 -8.989 2.693 -5.731 768 HA3 GLY 101 HA3 GLY 101 -7.857 1.504 -5.110 769 HA PRO 102 HA PRO 102 -9.945 4.036 -1.686 770 HB2 PRO 102 HB2 PRO 102 -10.863 1.894 -0.252 771 HB3 PRO 102 HB3 PRO 102 -11.795 2.710 -1.512 772 HG2 PRO 102 HG2 PRO 102 -10.186 0.185 -1.682 773 HG3 PRO 102 HG3 PRO 102 -11.790 0.537 -2.357 774 HD2 PRO 102 HD2 PRO 102 -9.560 0.600 -3.875 775 HD3 PRO 102 HD3 PRO 102 -10.912 1.717 -4.155 776 H TYR 103 H TYR 103 -7.879 1.211 -1.703 777 HA TYR 103 HA TYR 103 -6.759 1.438 0.872 778 HB2 TYR 103 HB2 TYR 103 -5.481 0.455 -1.705 779 HB3 TYR 103 HB3 TYR 103 -4.840 0.178 -0.086 780 HD1 TYR 103 HD2 TYR 103 -7.875 -0.440 -2.177 781 HD2 TYR 103 HD1 TYR 103 -5.486 -1.739 1.100 782 HE1 TYR 103 HE2 TYR 103 -9.263 -2.455 -1.970 783 HE2 TYR 103 HE1 TYR 103 -6.868 -3.756 1.313 784 HH TYR 103 HH TYR 103 -8.962 -4.817 -1.028 785 H ALA 104 H ALA 104 -5.692 2.721 -2.256 786 HA ALA 104 HA ALA 104 -3.677 4.418 -1.282 787 HB1 ALA 104 HB1 ALA 104 -5.366 4.749 -3.768 788 HB2 ALA 104 HB2 ALA 104 -3.890 3.789 -3.647 789 HB3 ALA 104 HB3 ALA 104 -3.823 5.540 -3.445 790 H ASN 105 H ASN 105 -7.187 4.861 -1.516 791 HA ASN 105 HA ASN 105 -7.244 7.677 -1.229 792 HB2 ASN 105 HB2 ASN 105 -9.352 5.683 -0.343 793 HB3 ASN 105 HB3 ASN 105 -9.596 7.415 -0.533 794 HD21 ASN 105 HD21 ASN 105 -7.733 7.120 -2.985 795 HD22 ASN 105 HD22 ASN 105 -8.817 6.598 -4.211 796 H MET 106 H MET 106 -6.350 5.295 1.006 797 HA MET 106 HA MET 106 -7.077 6.841 3.366 798 HB2 MET 106 HB2 MET 106 -5.371 4.347 3.295 799 HB3 MET 106 HB3 MET 106 -6.296 4.989 4.648 800 HG2 MET 106 HG2 MET 106 -8.377 4.524 3.359 801 HG3 MET 106 HG3 MET 106 -7.382 3.753 2.130 802 HE1 MET 106 HE1 MET 106 -8.068 2.144 6.395 803 HE2 MET 106 HE2 MET 106 -8.891 3.538 5.694 804 HE3 MET 106 HE3 MET 106 -7.181 3.644 6.117 805 H VAL 107 H VAL 107 -4.466 6.725 1.180 806 HA VAL 107 HA VAL 107 -2.694 8.034 3.147 807 HB VAL 107 HB VAL 107 -0.737 6.965 2.044 808 HG11 VAL 107 HG11 VAL 107 -1.644 6.061 4.131 809 HG12 VAL 107 HG12 VAL 107 -0.994 4.780 3.108 810 HG13 VAL 107 HG13 VAL 107 -2.739 5.026 3.211 811 HG21 VAL 107 HG21 VAL 107 -1.088 4.985 0.631 812 HG22 VAL 107 HG22 VAL 107 -1.744 6.439 -0.120 813 HG23 VAL 107 HG23 VAL 107 -2.827 5.281 0.651 814 H ILE 108 H ILE 108 -4.108 8.207 0.032 815 HA ILE 108 HA ILE 108 -2.140 10.213 -0.841 816 HB ILE 108 HB ILE 108 -2.838 9.960 -3.053 817 HG12 ILE 108 HG12 ILE 108 -5.163 8.220 -2.215 818 HG13 ILE 108 HG13 ILE 108 -5.320 9.957 -2.468 819 HG21 ILE 108 HG21 ILE 108 -2.863 7.256 -1.718 820 HG22 ILE 108 HG22 ILE 108 -1.479 8.101 -2.419 821 HG23 ILE 108 HG23 ILE 108 -2.766 7.488 -3.464 822 HD11 ILE 108 HD11 ILE 108 -6.002 8.828 -4.443 823 HD12 ILE 108 HD12 ILE 108 -4.504 7.899 -4.482 824 HD13 ILE 108 HD13 ILE 108 -4.466 9.640 -4.760 825 H ASP 109 H ASP 109 -3.248 11.973 -2.293 826 HA ASP 109 HA ASP 109 -5.318 13.279 -0.704 827 HB2 ASP 109 HB2 ASP 109 -3.360 14.584 -1.424 828 HB3 ASP 109 HB3 ASP 109 -3.749 14.259 -3.109 829 HA PRO 110 HA PRO 110 -8.222 11.706 -3.815 830 HB2 PRO 110 HB2 PRO 110 -10.434 11.788 -2.319 831 HB3 PRO 110 HB3 PRO 110 -9.161 10.603 -1.995 832 HG2 PRO 110 HG2 PRO 110 -9.750 13.183 -0.587 833 HG3 PRO 110 HG3 PRO 110 -9.306 11.611 0.101 834 HD2 PRO 110 HD2 PRO 110 -7.538 13.708 -0.328 835 HD3 PRO 110 HD3 PRO 110 -7.067 12.004 -0.164 836 H SER 111 H SER 111 -7.675 14.821 -2.953 837 HA SER 111 HA SER 111 -10.233 15.899 -3.944 838 HB2 SER 111 HB2 SER 111 -9.353 16.770 -1.789 839 HB3 SER 111 HB3 SER 111 -7.938 17.384 -2.642 840 HG SER 111 HG SER 111 -9.957 18.327 -3.985 841 H THR 112 H THR 112 -6.954 15.474 -4.918 842 HA THR 112 HA THR 112 -6.645 17.603 -6.728 843 HB THR 112 HB THR 112 -4.691 16.385 -6.200 844 HG1 THR 112 HG1 THR 112 -4.649 17.060 -8.360 845 HG21 THR 112 HG21 THR 112 -5.723 14.260 -5.588 846 HG22 THR 112 HG22 THR 112 -4.391 13.997 -6.715 847 HG23 THR 112 HG23 THR 112 -6.057 13.915 -7.287 848 H ASP 113 H ASP 113 -6.884 17.784 -8.949 849 HA ASP 113 HA ASP 113 -8.822 15.939 -10.216 850 HB2 ASP 113 HB2 ASP 113 -8.325 18.875 -10.794 851 HB3 ASP 113 HB3 ASP 113 -9.537 17.862 -11.576 852 H GLY 114 H GLY 114 -5.814 15.817 -10.143 853 HA2 GLY 114 HA2 GLY 114 -4.747 16.617 -12.649 854 HA3 GLY 114 HA3 GLY 114 -4.024 15.465 -11.541 855 H THR 115 H THR 115 -6.416 15.804 -14.129 856 HA THR 115 HA THR 115 -6.340 12.900 -14.643 857 HB THR 115 HB THR 115 -8.251 13.260 -16.124 858 HG1 THR 115 HG1 THR 115 -8.745 15.195 -16.851 859 HG21 THR 115 HG21 THR 115 -9.906 14.032 -14.487 860 HG22 THR 115 HG22 THR 115 -8.618 14.722 -13.500 861 HG23 THR 115 HG23 THR 115 -8.715 12.976 -13.726 862 H GLY 116 H GLY 116 -4.230 15.037 -15.404 863 HA2 GLY 116 HA2 GLY 116 -4.405 15.392 -18.236 864 HA3 GLY 116 HA3 GLY 116 -3.034 15.792 -17.221 865 H MET 117 H MET 117 -1.259 14.839 -17.940 866 HA MET 117 HA MET 117 -1.475 12.319 -19.442 867 HB2 MET 117 HB2 MET 117 0.768 14.357 -19.366 868 HB3 MET 117 HB3 MET 117 0.710 12.935 -20.401 869 HG2 MET 117 HG2 MET 117 -1.312 13.831 -21.484 870 HG3 MET 117 HG3 MET 117 -1.194 15.269 -20.473 871 HE1 MET 117 HE1 MET 117 1.735 13.237 -22.152 872 HE2 MET 117 HE2 MET 117 1.932 14.117 -23.668 873 HE3 MET 117 HE3 MET 117 0.460 13.192 -23.369 874 HA PRO 118 HA PRO 118 0.549 9.761 -16.483 875 HB2 PRO 118 HB2 PRO 118 2.475 8.502 -18.047 876 HB3 PRO 118 HB3 PRO 118 0.781 8.014 -17.927 877 HG2 PRO 118 HG2 PRO 118 2.129 9.690 -20.012 878 HG3 PRO 118 HG3 PRO 118 0.903 8.424 -20.210 879 HD2 PRO 118 HD2 PRO 118 0.241 11.006 -20.352 880 HD3 PRO 118 HD3 PRO 118 -0.838 9.834 -19.559 881 H GLN 119 H GLN 119 1.786 10.618 -14.940 882 HA GLN 119 HA GLN 119 4.562 11.391 -15.547 883 HB2 GLN 119 HB2 GLN 119 2.586 13.028 -13.929 884 HB3 GLN 119 HB3 GLN 119 4.313 13.356 -14.017 885 HG2 GLN 119 HG2 GLN 119 4.193 13.947 -16.298 886 HG3 GLN 119 HG3 GLN 119 2.578 13.262 -16.472 887 HE21 GLN 119 HE21 GLN 119 0.813 14.421 -15.729 888 HE22 GLN 119 HE22 GLN 119 0.909 16.105 -15.362 889 H PHE 120 H PHE 120 5.982 10.495 -14.136 890 HA PHE 120 HA PHE 120 4.944 8.702 -12.147 891 HB2 PHE 120 HB2 PHE 120 7.788 9.355 -12.950 892 HB3 PHE 120 HB3 PHE 120 7.360 8.128 -11.760 893 HD1 PHE 120 HD1 PHE 120 5.537 6.400 -12.615 894 HD2 PHE 120 HD2 PHE 120 8.136 8.658 -15.121 895 HE1 PHE 120 HE1 PHE 120 5.248 4.740 -14.403 896 HE2 PHE 120 HE2 PHE 120 7.847 7.001 -16.914 897 HZ PHE 120 HZ PHE 120 6.400 5.041 -16.559 898 H LYS 121 H LYS 121 3.937 10.267 -10.727 899 HA LYS 121 HA LYS 121 5.714 10.727 -8.484 900 HB2 LYS 121 HB2 LYS 121 5.871 12.879 -9.612 901 HB3 LYS 121 HB3 LYS 121 4.114 13.013 -9.643 902 HG2 LYS 121 HG2 LYS 121 3.977 13.315 -7.324 903 HG3 LYS 121 HG3 LYS 121 5.613 12.713 -7.060 904 HD2 LYS 121 HD2 LYS 121 6.510 14.701 -8.195 905 HD3 LYS 121 HD3 LYS 121 4.866 15.312 -8.401 906 HE2 LYS 121 HE2 LYS 121 5.986 16.336 -6.464 907 HE3 LYS 121 HE3 LYS 121 4.566 15.404 -5.989 908 HZ1 LYS 121 HZ1 LYS 121 6.388 14.969 -4.501 909 HZ2 LYS 121 HZ2 LYS 121 7.394 14.517 -5.782 910 HZ3 LYS 121 HZ3 LYS 121 6.056 13.565 -5.383 911 H GLY 122 H GLY 122 4.695 10.698 -6.505 912 HA2 GLY 122 HA2 GLY 122 1.757 10.527 -6.465 913 HA3 GLY 122 HA3 GLY 122 2.698 9.224 -5.764 914 H VAL 123 H VAL 123 1.406 9.821 -3.846 915 HA VAL 123 HA VAL 123 2.212 12.252 -2.436 916 HB VAL 123 HB VAL 123 0.376 10.004 -1.579 917 HG11 VAL 123 HG11 VAL 123 1.321 11.119 0.358 918 HG12 VAL 123 HG12 VAL 123 -0.380 11.550 0.182 919 HG13 VAL 123 HG13 VAL 123 0.874 12.696 -0.298 920 HG21 VAL 123 HG21 VAL 123 -1.444 11.575 -2.065 921 HG22 VAL 123 HG22 VAL 123 -0.485 11.243 -3.506 922 HG23 VAL 123 HG23 VAL 123 -0.273 12.764 -2.637 923 H LYS 124 H LYS 124 3.880 12.334 -1.032 924 HA LYS 124 HA LYS 124 5.562 10.098 -0.580 925 HB2 LYS 124 HB2 LYS 124 5.533 12.797 0.785 926 HB3 LYS 124 HB3 LYS 124 6.823 11.610 0.932 927 HG2 LYS 124 HG2 LYS 124 7.201 11.772 -1.511 928 HG3 LYS 124 HG3 LYS 124 5.971 13.037 -1.588 929 HD2 LYS 124 HD2 LYS 124 7.310 14.418 -0.051 930 HD3 LYS 124 HD3 LYS 124 8.535 13.151 0.017 931 HE2 LYS 124 HE2 LYS 124 7.719 14.731 -2.425 932 HE3 LYS 124 HE3 LYS 124 9.221 14.903 -1.519 933 HZ1 LYS 124 HZ1 LYS 124 8.358 12.551 -3.103 934 HZ2 LYS 124 HZ2 LYS 124 9.725 12.572 -2.113 935 HZ3 LYS 124 HZ3 LYS 124 9.639 13.599 -3.449 936 H GLY 125 H GLY 125 6.093 8.989 1.328 937 HA2 GLY 125 HA2 GLY 125 4.869 9.337 3.844 938 HA3 GLY 125 HA3 GLY 125 3.957 8.139 2.935 939 H THR 126 H THR 126 4.559 6.573 4.561 940 HA THR 126 HA THR 126 7.263 5.461 4.119 941 HB THR 126 HB THR 126 7.318 4.699 6.488 942 HG1 THR 126 HG1 THR 126 5.818 5.860 7.920 943 HG21 THR 126 HG21 THR 126 7.058 7.691 6.123 944 HG22 THR 126 HG22 THR 126 8.521 6.731 5.892 945 HG23 THR 126 HG23 THR 126 7.817 6.891 7.501 946 H VAL 127 H VAL 127 7.457 3.150 4.545 947 HA VAL 127 HA VAL 127 4.993 1.610 4.803 948 HB VAL 127 HB VAL 127 5.182 1.991 2.375 949 HG11 VAL 127 HG11 VAL 127 7.039 1.039 1.092 950 HG12 VAL 127 HG12 VAL 127 7.846 0.582 2.593 951 HG13 VAL 127 HG13 VAL 127 7.594 2.284 2.209 952 HG21 VAL 127 HG21 VAL 127 5.752 -0.861 3.204 953 HG22 VAL 127 HG22 VAL 127 5.087 -0.365 1.647 954 HG23 VAL 127 HG23 VAL 127 4.171 -0.084 3.128 955 H GLU 128 H GLU 128 5.295 -0.413 5.690 956 HA GLU 128 HA GLU 128 7.757 -1.853 5.490 957 HB2 GLU 128 HB2 GLU 128 8.358 -1.978 7.838 958 HB3 GLU 128 HB3 GLU 128 8.381 -0.305 7.307 959 HG2 GLU 128 HG2 GLU 128 6.298 0.142 8.420 960 HG3 GLU 128 HG3 GLU 128 6.102 -1.563 8.830 961 H LYS 129 H LYS 129 7.643 -3.930 6.851 962 HA LYS 129 HA LYS 129 5.211 -5.246 6.195 963 HB2 LYS 129 HB2 LYS 129 7.221 -6.523 6.075 964 HB3 LYS 129 HB3 LYS 129 7.650 -6.135 7.736 965 HG2 LYS 129 HG2 LYS 129 5.869 -7.508 8.587 966 HG3 LYS 129 HG3 LYS 129 5.236 -7.777 6.963 967 HD2 LYS 129 HD2 LYS 129 7.972 -8.664 7.888 968 HD3 LYS 129 HD3 LYS 129 6.539 -9.691 7.903 969 HE2 LYS 129 HE2 LYS 129 6.318 -9.245 5.435 970 HE3 LYS 129 HE3 LYS 129 7.898 -8.467 5.508 971 HZ1 LYS 129 HZ1 LYS 129 7.472 -11.243 6.434 972 HZ2 LYS 129 HZ2 LYS 129 8.933 -10.487 6.037 973 HZ3 LYS 129 HZ3 LYS 129 7.820 -10.883 4.818 974 H THR 130 H THR 130 3.637 -6.166 7.511 975 HA THR 130 HA THR 130 3.734 -5.715 10.402 976 HB THR 130 HB THR 130 2.535 -3.730 9.697 977 HG1 THR 130 HG1 THR 130 0.888 -4.019 11.083 978 HG21 THR 130 HG21 THR 130 0.664 -5.591 8.213 979 HG22 THR 130 HG22 THR 130 1.821 -4.485 7.469 980 HG23 THR 130 HG23 THR 130 0.458 -3.849 8.393 981 H ASP 131 H ASP 131 2.204 -7.019 11.591 982 HA ASP 131 HA ASP 131 1.589 -9.524 10.223 983 HB2 ASP 131 HB2 ASP 131 1.275 -8.800 13.150 984 HB3 ASP 131 HB3 ASP 131 1.209 -10.419 12.457 985 H GLU 132 H GLU 132 0.033 -6.672 10.656 986 HA GLU 132 HA GLU 132 -2.567 -7.410 11.493 987 HB2 GLU 132 HB2 GLU 132 -1.571 -5.065 9.866 988 HB3 GLU 132 HB3 GLU 132 -3.221 -5.213 10.462 989 HG2 GLU 132 HG2 GLU 132 -2.498 -5.125 12.724 990 HG3 GLU 132 HG3 GLU 132 -0.808 -5.270 12.251 991 H LYS 133 H LYS 133 -4.510 -6.912 10.006 992 HA LYS 133 HA LYS 133 -4.350 -8.759 7.764 993 HB2 LYS 133 HB2 LYS 133 -6.755 -8.747 7.779 994 HB3 LYS 133 HB3 LYS 133 -6.217 -8.847 9.453 995 HG2 LYS 133 HG2 LYS 133 -6.653 -6.475 9.766 996 HG3 LYS 133 HG3 LYS 133 -7.096 -6.311 8.068 997 HD2 LYS 133 HD2 LYS 133 -8.957 -7.914 8.457 998 HD3 LYS 133 HD3 LYS 133 -8.555 -7.906 10.176 999 HE2 LYS 133 HE2 LYS 133 -9.452 -5.545 8.515 1000 HE3 LYS 133 HE3 LYS 133 -10.388 -6.377 9.752 1001 HZ1 LYS 133 HZ1 LYS 133 -9.472 -4.340 10.622 1002 HZ2 LYS 133 HZ2 LYS 133 -7.904 -4.812 10.201 1003 HZ3 LYS 133 HZ3 LYS 133 -8.745 -5.657 11.398 1004 H VAL 134 H VAL 134 -4.832 -8.278 5.630 1005 HA VAL 134 HA VAL 134 -4.588 -5.604 4.672 1006 HB VAL 134 HB VAL 134 -5.608 -8.106 3.288 1007 HG11 VAL 134 HG11 VAL 134 -4.908 -5.417 2.091 1008 HG12 VAL 134 HG12 VAL 134 -6.516 -6.145 2.162 1009 HG13 VAL 134 HG13 VAL 134 -5.255 -6.884 1.173 1010 HG21 VAL 134 HG21 VAL 134 -3.278 -8.260 3.964 1011 HG22 VAL 134 HG22 VAL 134 -2.926 -6.714 3.192 1012 HG23 VAL 134 HG23 VAL 134 -3.391 -8.106 2.211 1013 H LEU 135 H LEU 135 -6.132 -4.057 4.579 1014 HA LEU 135 HA LEU 135 -8.769 -4.603 5.532 1015 HB2 LEU 135 HB2 LEU 135 -7.313 -2.187 4.613 1016 HB3 LEU 135 HB3 LEU 135 -9.063 -2.129 4.514 1017 HG LEU 135 HG LEU 135 -7.415 -2.573 7.006 1018 HD11 LEU 135 HD11 LEU 135 -8.404 -0.466 7.719 1019 HD12 LEU 135 HD12 LEU 135 -9.266 -0.341 6.183 1020 HD13 LEU 135 HD13 LEU 135 -7.503 -0.264 6.215 1021 HD21 LEU 135 HD21 LEU 135 -10.414 -2.618 6.622 1022 HD22 LEU 135 HD22 LEU 135 -9.592 -2.569 8.186 1023 HD23 LEU 135 HD23 LEU 135 -9.390 -3.963 7.127 1024 H SER 136 H SER 136 -9.705 -6.083 4.172 1025 HA SER 136 HA SER 136 -9.846 -6.159 1.427 1026 HB2 SER 136 HB2 SER 136 -12.130 -6.813 3.314 1027 HB3 SER 136 HB3 SER 136 -11.959 -7.389 1.658 1028 HG SER 136 HG SER 136 -11.268 -8.941 3.185 1029 H VAL 137 H VAL 137 -11.351 -5.384 -0.137 1030 HA VAL 137 HA VAL 137 -11.654 -2.686 -0.208 1031 HB VAL 137 HB VAL 137 -13.470 -4.677 -1.584 1032 HG11 VAL 137 HG11 VAL 137 -14.408 -2.422 -1.671 1033 HG12 VAL 137 HG12 VAL 137 -13.831 -2.921 -3.260 1034 HG13 VAL 137 HG13 VAL 137 -12.877 -1.798 -2.291 1035 HG21 VAL 137 HG21 VAL 137 -10.878 -3.419 -2.501 1036 HG22 VAL 137 HG22 VAL 137 -11.910 -4.473 -3.470 1037 HG23 VAL 137 HG23 VAL 137 -11.110 -5.105 -2.032 1038 H LYS 138 H LYS 138 -14.190 -4.961 0.835 1039 HA LYS 138 HA LYS 138 -16.115 -2.933 1.421 1040 HB2 LYS 138 HB2 LYS 138 -16.696 -5.287 0.904 1041 HB3 LYS 138 HB3 LYS 138 -15.953 -5.793 2.413 1042 HG2 LYS 138 HG2 LYS 138 -17.619 -4.383 3.628 1043 HG3 LYS 138 HG3 LYS 138 -18.409 -4.081 2.077 1044 HD2 LYS 138 HD2 LYS 138 -18.015 -6.768 3.406 1045 HD3 LYS 138 HD3 LYS 138 -19.538 -5.891 3.250 1046 HE2 LYS 138 HE2 LYS 138 -19.439 -6.110 0.825 1047 HE3 LYS 138 HE3 LYS 138 -17.875 -6.919 0.939 1048 HZ1 LYS 138 HZ1 LYS 138 -20.480 -7.925 1.936 1049 HZ2 LYS 138 HZ2 LYS 138 -19.000 -8.676 2.240 1050 HZ3 LYS 138 HZ3 LYS 138 -19.572 -8.552 0.655 1051 H GLU 139 H GLU 139 -13.919 -4.869 3.486 1052 HA GLU 139 HA GLU 139 -14.692 -3.919 5.991 1053 HB2 GLU 139 HB2 GLU 139 -13.186 -5.846 5.591 1054 HB3 GLU 139 HB3 GLU 139 -11.930 -4.747 5.046 1055 HG2 GLU 139 HG2 GLU 139 -11.394 -5.380 7.257 1056 HG3 GLU 139 HG3 GLU 139 -11.955 -3.711 7.323 1057 H LEU 140 H LEU 140 -12.422 -2.616 3.645 1058 HA LEU 140 HA LEU 140 -11.333 -0.503 5.105 1059 HB2 LEU 140 HB2 LEU 140 -10.795 -1.561 2.759 1060 HB3 LEU 140 HB3 LEU 140 -11.855 -0.296 2.164 1061 HG LEU 140 HG LEU 140 -9.508 0.323 3.939 1062 HD11 LEU 140 HD11 LEU 140 -9.504 0.143 0.932 1063 HD12 LEU 140 HD12 LEU 140 -8.660 -0.936 2.044 1064 HD13 LEU 140 HD13 LEU 140 -8.191 0.761 1.938 1065 HD21 LEU 140 HD21 LEU 140 -11.139 2.110 3.670 1066 HD22 LEU 140 HD22 LEU 140 -11.034 1.965 1.914 1067 HD23 LEU 140 HD23 LEU 140 -9.636 2.515 2.840 1068 H LEU 141 H LEU 141 -14.266 -0.667 3.080 1069 HA LEU 141 HA LEU 141 -14.979 2.043 3.112 1070 HB2 LEU 141 HB2 LEU 141 -16.967 -0.230 3.267 1071 HB3 LEU 141 HB3 LEU 141 -17.214 1.356 2.566 1072 HG LEU 141 HG LEU 141 -15.485 -0.853 1.453 1073 HD11 LEU 141 HD11 LEU 141 -17.875 -1.218 1.150 1074 HD12 LEU 141 HD12 LEU 141 -17.084 -0.866 -0.387 1075 HD13 LEU 141 HD13 LEU 141 -18.037 0.381 0.422 1076 HD21 LEU 141 HD21 LEU 141 -14.447 1.308 1.026 1077 HD22 LEU 141 HD22 LEU 141 -15.964 1.915 0.358 1078 HD23 LEU 141 HD23 LEU 141 -15.098 0.610 -0.454 1079 H GLU 142 H GLU 142 -15.832 -0.554 5.357 1080 HA GLU 142 HA GLU 142 -17.319 1.168 7.108 1081 HB2 GLU 142 HB2 GLU 142 -16.325 -1.660 7.523 1082 HB3 GLU 142 HB3 GLU 142 -17.526 -0.836 8.514 1083 HG2 GLU 142 HG2 GLU 142 -18.994 -0.648 6.539 1084 HG3 GLU 142 HG3 GLU 142 -17.803 -1.531 5.589 1085 H ALA 143 H ALA 143 -14.023 -0.022 6.972 1086 HA ALA 143 HA ALA 143 -13.202 0.547 9.598 1087 HB1 ALA 143 HB1 ALA 143 -11.882 -0.795 8.016 1088 HB2 ALA 143 HB2 ALA 143 -10.930 0.504 8.734 1089 HB3 ALA 143 HB3 ALA 143 -11.530 0.661 7.083 1090 H ILE 144 H ILE 144 -13.237 2.622 6.695 1091 HA ILE 144 HA ILE 144 -12.126 4.889 8.057 1092 HB ILE 144 HB ILE 144 -12.667 6.188 6.092 1093 HG12 ILE 144 HG12 ILE 144 -14.014 3.681 5.060 1094 HG13 ILE 144 HG13 ILE 144 -14.844 5.131 5.607 1095 HG21 ILE 144 HG21 ILE 144 -10.631 4.853 6.085 1096 HG22 ILE 144 HG22 ILE 144 -11.323 4.939 4.465 1097 HG23 ILE 144 HG23 ILE 144 -11.519 3.477 5.430 1098 HD11 ILE 144 HD11 ILE 144 -14.714 5.077 3.198 1099 HD12 ILE 144 HD12 ILE 144 -12.956 4.947 3.287 1100 HD13 ILE 144 HD13 ILE 144 -13.761 6.412 3.846 1101 H GLY 145 H GLY 145 -15.168 3.495 8.215 1102 HA2 GLY 145 HA2 GLY 145 -16.696 4.385 9.869 1103 HA3 GLY 145 HA3 GLY 145 -16.283 6.000 9.326 1104 H SER 146 H SER 146 -16.719 3.920 6.684 1105 HA SER 146 HA SER 146 -19.506 4.865 6.351 1106 HB2 SER 146 HB2 SER 146 -17.984 5.868 4.723 1107 HB3 SER 146 HB3 SER 146 -17.427 4.271 4.225 1108 HG SER 146 HG SER 146 -20.094 5.243 3.995 Start of MODEL 8 1 H1 MET 1 H1 MET 1 -27.001 54.318 16.870 2 H2 MET 1 H2 MET 1 -27.750 55.770 16.453 3 H3 MET 1 H3 MET 1 -26.233 55.389 15.814 4 HA MET 1 HA MET 1 -28.763 53.934 15.282 5 HB2 MET 1 HB2 MET 1 -28.505 54.825 12.969 6 HB3 MET 1 HB3 MET 1 -28.776 56.077 14.171 7 HG2 MET 1 HG2 MET 1 -26.091 55.344 13.011 8 HG3 MET 1 HG3 MET 1 -27.086 56.709 12.505 9 HE1 MET 1 HE1 MET 1 -27.055 59.000 15.666 10 HE2 MET 1 HE2 MET 1 -28.269 57.795 15.244 11 HE3 MET 1 HE3 MET 1 -27.579 58.827 13.992 12 H GLY 2 H GLY 2 -26.162 52.837 16.218 13 HA2 GLY 2 HA2 GLY 2 -25.971 50.707 14.299 14 HA3 GLY 2 HA3 GLY 2 -24.547 51.737 14.290 15 H SER 3 H SER 3 -25.218 48.854 15.223 16 HA SER 3 HA SER 3 -23.438 48.885 17.508 17 HB2 SER 3 HB2 SER 3 -26.306 47.962 17.856 18 HB3 SER 3 HB3 SER 3 -25.010 47.623 19.001 19 HG SER 3 HG SER 3 -24.912 50.202 18.592 20 H SER 4 H SER 4 -22.970 46.627 18.313 21 HA SER 4 HA SER 4 -23.764 44.386 16.695 22 HB2 SER 4 HB2 SER 4 -21.526 43.828 15.822 23 HB3 SER 4 HB3 SER 4 -22.088 45.376 15.193 24 HG SER 4 HG SER 4 -20.836 46.230 17.138 25 H HIS 5 H HIS 5 -22.809 42.352 17.406 26 HA HIS 5 HA HIS 5 -21.538 42.445 20.071 27 HB2 HIS 5 HB2 HIS 5 -23.659 40.519 19.077 28 HB3 HIS 5 HB3 HIS 5 -22.771 40.322 20.587 29 HD1 HIS 5 HD1 HIS 5 -25.574 42.209 19.047 30 HD2 HIS 5 HD2 HIS 5 -23.430 42.220 22.605 31 HE1 HIS 5 HE1 HIS 5 -26.898 43.636 20.624 32 HE2 HIS 5 HE2 HIS 5 -25.485 43.784 22.697 33 H HIS 6 H HIS 6 -19.874 40.941 20.448 34 HA HIS 6 HA HIS 6 -18.819 39.722 17.966 35 HB2 HIS 6 HB2 HIS 6 -17.930 42.059 18.602 36 HB3 HIS 6 HB3 HIS 6 -17.096 41.246 19.918 37 HD1 HIS 6 HD1 HIS 6 -17.212 41.370 16.150 38 HD2 HIS 6 HD2 HIS 6 -14.735 40.014 19.201 39 HE1 HIS 6 HE1 HIS 6 -15.050 40.749 15.037 40 HE2 HIS 6 HE2 HIS 6 -13.613 39.820 16.879 41 H HIS 7 H HIS 7 -18.006 37.717 18.165 42 HA HIS 7 HA HIS 7 -16.399 36.874 20.339 43 HB2 HIS 7 HB2 HIS 7 -17.802 35.045 21.229 44 HB3 HIS 7 HB3 HIS 7 -18.504 36.627 21.535 45 HD1 HIS 7 HD1 HIS 7 -20.743 37.170 20.417 46 HD2 HIS 7 HD2 HIS 7 -19.287 33.397 19.459 47 HE1 HIS 7 HE1 HIS 7 -22.648 35.974 19.316 48 HE2 HIS 7 HE2 HIS 7 -21.736 33.715 18.694 49 H HIS 8 H HIS 8 -14.923 35.568 19.434 50 HA HIS 8 HA HIS 8 -15.596 34.143 16.956 51 HB2 HIS 8 HB2 HIS 8 -13.597 35.649 17.060 52 HB3 HIS 8 HB3 HIS 8 -12.878 34.552 18.232 53 HD1 HIS 8 HD1 HIS 8 -11.127 33.235 17.106 54 HD2 HIS 8 HD2 HIS 8 -14.400 33.860 14.629 55 HE1 HIS 8 HE1 HIS 8 -10.595 32.024 14.976 56 HE2 HIS 8 HE2 HIS 8 -12.677 32.245 13.583 57 H HIS 9 H HIS 9 -13.756 33.439 19.934 58 HA HIS 9 HA HIS 9 -13.467 31.541 21.163 59 HB2 HIS 9 HB2 HIS 9 -15.630 32.318 21.913 60 HB3 HIS 9 HB3 HIS 9 -16.433 31.454 20.608 61 HD1 HIS 9 HD1 HIS 9 -14.261 30.624 23.622 62 HD2 HIS 9 HD2 HIS 9 -17.353 29.015 21.365 63 HE1 HIS 9 HE1 HIS 9 -14.898 28.492 24.779 64 HE2 HIS 9 HE2 HIS 9 -16.849 27.602 23.470 65 H HIS 10 H HIS 10 -12.128 30.247 19.782 66 HA HIS 10 HA HIS 10 -13.373 27.685 19.234 67 HB2 HIS 10 HB2 HIS 10 -12.194 29.368 17.040 68 HB3 HIS 10 HB3 HIS 10 -12.080 27.614 16.952 69 HD1 HIS 10 HD1 HIS 10 -14.585 30.404 16.841 70 HD2 HIS 10 HD2 HIS 10 -14.470 26.283 16.392 71 HE1 HIS 10 HE1 HIS 10 -16.809 29.777 15.877 72 HE2 HIS 10 HE2 HIS 10 -16.791 27.269 15.837 73 H SER 11 H SER 11 -11.622 26.070 18.440 74 HA SER 11 HA SER 11 -8.951 26.602 19.482 75 HB2 SER 11 HB2 SER 11 -9.031 24.634 21.010 76 HB3 SER 11 HB3 SER 11 -10.149 25.907 21.500 77 HG SER 11 HG SER 11 -10.960 23.646 21.452 78 H SER 12 H SER 12 -7.809 24.177 19.493 79 HA SER 12 HA SER 12 -8.585 22.667 17.106 80 HB2 SER 12 HB2 SER 12 -7.102 24.424 16.224 81 HB3 SER 12 HB3 SER 12 -5.855 23.966 17.382 82 HG SER 12 HG SER 12 -6.907 22.318 15.309 83 H GLY 13 H GLY 13 -7.026 20.742 16.785 84 HA2 GLY 13 HA2 GLY 13 -6.193 19.685 19.435 85 HA3 GLY 13 HA3 GLY 13 -6.935 18.696 18.188 86 H ARG 14 H ARG 14 -4.333 18.346 19.535 87 HA ARG 14 HA ARG 14 -2.431 18.920 17.360 88 HB2 ARG 14 HB2 ARG 14 -1.858 18.057 20.207 89 HB3 ARG 14 HB3 ARG 14 -0.671 18.580 19.015 90 HG2 ARG 14 HG2 ARG 14 -1.612 20.809 18.989 91 HG3 ARG 14 HG3 ARG 14 -2.906 20.307 20.077 92 HD2 ARG 14 HD2 ARG 14 -1.176 19.806 21.803 93 HD3 ARG 14 HD3 ARG 14 0.043 20.468 20.710 94 HE ARG 14 HE ARG 14 -1.905 22.403 20.949 95 HH11 ARG 14 HH11 ARG 14 0.313 20.815 23.046 96 HH12 ARG 14 HH12 ARG 14 0.380 22.139 24.152 97 HH21 ARG 14 HH21 ARG 14 -1.831 24.078 22.363 98 HH22 ARG 14 HH22 ARG 14 -0.853 23.966 23.786 99 H GLU 15 H GLU 15 -1.988 16.330 19.715 100 HA GLU 15 HA GLU 15 -1.708 14.091 19.553 101 HB2 GLU 15 HB2 GLU 15 -4.021 14.115 18.730 102 HB3 GLU 15 HB3 GLU 15 -3.442 14.332 17.085 103 HG2 GLU 15 HG2 GLU 15 -2.442 12.154 17.077 104 HG3 GLU 15 HG3 GLU 15 -2.782 11.940 18.794 105 H ASN 16 H ASN 16 0.249 13.300 19.141 106 HA ASN 16 HA ASN 16 1.266 13.241 16.384 107 HB2 ASN 16 HB2 ASN 16 2.220 15.258 17.405 108 HB3 ASN 16 HB3 ASN 16 2.821 14.307 18.759 109 HD21 ASN 16 HD21 ASN 16 4.634 13.036 18.482 110 HD22 ASN 16 HD22 ASN 16 5.658 13.177 17.099 111 H LEU 17 H LEU 17 1.646 11.134 15.965 112 HA LEU 17 HA LEU 17 2.442 9.353 18.174 113 HB2 LEU 17 HB2 LEU 17 1.067 8.793 15.563 114 HB3 LEU 17 HB3 LEU 17 1.707 7.527 16.593 115 HG LEU 17 HG LEU 17 0.222 8.487 18.445 116 HD11 LEU 17 HD11 LEU 17 -1.748 9.733 17.729 117 HD12 LEU 17 HD12 LEU 17 -1.100 9.832 16.091 118 HD13 LEU 17 HD13 LEU 17 -0.267 10.638 17.421 119 HD21 LEU 17 HD21 LEU 17 -1.731 7.253 17.652 120 HD22 LEU 17 HD22 LEU 17 -0.227 6.388 17.335 121 HD23 LEU 17 HD23 LEU 17 -1.052 7.229 16.022 122 H TYR 18 H TYR 18 3.815 7.459 17.574 123 HA TYR 18 HA TYR 18 5.778 8.032 15.450 124 HB2 TYR 18 HB2 TYR 18 6.405 7.189 18.290 125 HB3 TYR 18 HB3 TYR 18 7.577 7.181 16.980 126 HD1 TYR 18 HD2 TYR 18 8.377 9.317 16.018 127 HD2 TYR 18 HD1 TYR 18 5.754 9.238 19.373 128 HE1 TYR 18 HE2 TYR 18 8.947 11.656 16.516 129 HE2 TYR 18 HE1 TYR 18 6.327 11.571 19.880 130 HH TYR 18 HH TYR 18 8.007 13.570 17.698 131 H PHE 19 H PHE 19 7.148 6.085 14.954 132 HA PHE 19 HA PHE 19 5.663 3.559 15.343 133 HB2 PHE 19 HB2 PHE 19 7.133 4.460 12.849 134 HB3 PHE 19 HB3 PHE 19 6.376 2.885 13.073 135 HD1 PHE 19 HD1 PHE 19 3.873 2.788 13.455 136 HD2 PHE 19 HD2 PHE 19 5.869 6.302 12.099 137 HE1 PHE 19 HE1 PHE 19 1.729 3.698 12.660 138 HE2 PHE 19 HE2 PHE 19 3.730 7.213 11.300 139 HZ PHE 19 HZ PHE 19 1.656 5.914 11.581 140 H GLN 20 H GLN 20 7.311 1.664 14.500 141 HA GLN 20 HA GLN 20 9.892 2.110 15.865 142 HB2 GLN 20 HB2 GLN 20 8.146 1.101 17.406 143 HB3 GLN 20 HB3 GLN 20 8.152 -0.316 16.366 144 HG2 GLN 20 HG2 GLN 20 9.555 -0.830 18.184 145 HG3 GLN 20 HG3 GLN 20 10.633 -0.494 16.829 146 HE21 GLN 20 HE21 GLN 20 11.884 1.401 16.872 147 HE22 GLN 20 HE22 GLN 20 12.109 2.310 18.319 148 H GLY 21 H GLY 21 11.630 0.963 15.061 149 HA2 GLY 21 HA2 GLY 21 12.642 -0.932 14.036 150 HA3 GLY 21 HA3 GLY 21 11.137 -1.253 13.194 151 H HIS 22 H HIS 22 13.168 -1.469 11.611 152 HA HIS 22 HA HIS 22 13.964 1.023 10.395 153 HB2 HIS 22 HB2 HIS 22 15.521 -0.864 10.422 154 HB3 HIS 22 HB3 HIS 22 14.391 -1.839 9.490 155 HD1 HIS 22 HD1 HIS 22 16.108 1.541 9.013 156 HD2 HIS 22 HD2 HIS 22 15.081 -1.866 6.869 157 HE1 HIS 22 HE1 HIS 22 16.992 1.914 6.700 158 HE2 HIS 22 HE2 HIS 22 16.546 -0.241 5.486 159 H MET 23 H MET 23 11.707 1.739 10.038 160 HA MET 23 HA MET 23 10.326 0.576 7.762 161 HB2 MET 23 HB2 MET 23 8.647 2.274 8.171 162 HB3 MET 23 HB3 MET 23 9.090 1.512 9.692 163 HG2 MET 23 HG2 MET 23 10.675 3.481 10.031 164 HG3 MET 23 HG3 MET 23 9.809 4.253 8.701 165 HE1 MET 23 HE1 MET 23 6.942 4.079 8.809 166 HE2 MET 23 HE2 MET 23 6.107 3.790 10.334 167 HE3 MET 23 HE3 MET 23 7.025 2.490 9.570 168 H LEU 24 H LEU 24 9.967 1.715 5.755 169 HA LEU 24 HA LEU 24 12.264 3.452 5.143 170 HB2 LEU 24 HB2 LEU 24 10.774 1.437 3.500 171 HB3 LEU 24 HB3 LEU 24 11.794 2.654 2.745 172 HG LEU 24 HG LEU 24 12.831 0.839 4.908 173 HD11 LEU 24 HD11 LEU 24 13.748 -0.607 3.175 174 HD12 LEU 24 HD12 LEU 24 12.946 0.352 1.932 175 HD13 LEU 24 HD13 LEU 24 11.987 -0.570 3.089 176 HD21 LEU 24 HD21 LEU 24 14.211 2.414 2.737 177 HD22 LEU 24 HD22 LEU 24 15.002 1.410 3.953 178 HD23 LEU 24 HD23 LEU 24 14.122 2.858 4.442 179 H GLU 25 H GLU 25 11.979 5.437 4.657 180 HA GLU 25 HA GLU 25 9.450 6.664 4.242 181 HB2 GLU 25 HB2 GLU 25 11.918 7.519 5.062 182 HB3 GLU 25 HB3 GLU 25 11.882 8.139 3.417 183 HG2 GLU 25 HG2 GLU 25 9.729 9.241 3.932 184 HG3 GLU 25 HG3 GLU 25 9.893 8.687 5.597 185 H VAL 26 H VAL 26 8.369 6.178 2.397 186 HA VAL 26 HA VAL 26 9.838 6.226 -0.175 187 HB VAL 26 HB VAL 26 8.245 4.574 -1.042 188 HG11 VAL 26 HG11 VAL 26 10.313 3.748 -0.051 189 HG12 VAL 26 HG12 VAL 26 8.993 2.619 0.252 190 HG13 VAL 26 HG13 VAL 26 9.551 3.689 1.538 191 HG21 VAL 26 HG21 VAL 26 7.103 4.562 1.760 192 HG22 VAL 26 HG22 VAL 26 6.670 3.433 0.475 193 HG23 VAL 26 HG23 VAL 26 6.301 5.149 0.302 194 H GLU 27 H GLU 27 8.486 6.781 -2.085 195 HA GLU 27 HA GLU 27 6.376 8.715 -1.423 196 HB2 GLU 27 HB2 GLU 27 8.207 9.442 -2.941 197 HB3 GLU 27 HB3 GLU 27 7.711 8.210 -4.096 198 HG2 GLU 27 HG2 GLU 27 5.547 9.276 -4.346 199 HG3 GLU 27 HG3 GLU 27 5.976 10.477 -3.130 200 H VAL 28 H VAL 28 4.349 8.045 -1.466 201 HA VAL 28 HA VAL 28 3.634 5.511 -2.713 202 HB VAL 28 HB VAL 28 1.891 7.316 -1.023 203 HG11 VAL 28 HG11 VAL 28 1.702 4.365 -1.642 204 HG12 VAL 28 HG12 VAL 28 0.671 5.633 -2.308 205 HG13 VAL 28 HG13 VAL 28 0.619 5.269 -0.582 206 HG21 VAL 28 HG21 VAL 28 3.933 6.759 0.210 207 HG22 VAL 28 HG22 VAL 28 3.660 5.044 -0.102 208 HG23 VAL 28 HG23 VAL 28 2.528 5.950 0.902 209 H ILE 29 H ILE 29 2.980 5.564 -4.792 210 HA ILE 29 HA ILE 29 1.598 7.957 -5.802 211 HB ILE 29 HB ILE 29 2.362 5.747 -7.661 212 HG12 ILE 29 HG12 ILE 29 4.398 7.684 -6.514 213 HG13 ILE 29 HG13 ILE 29 4.327 5.967 -6.141 214 HG21 ILE 29 HG21 ILE 29 2.438 8.768 -7.773 215 HG22 ILE 29 HG22 ILE 29 1.253 7.705 -8.536 216 HG23 ILE 29 HG23 ILE 29 2.926 7.704 -9.097 217 HD11 ILE 29 HD11 ILE 29 6.045 6.451 -7.775 218 HD12 ILE 29 HD12 ILE 29 4.843 7.158 -8.854 219 HD13 ILE 29 HD13 ILE 29 4.783 5.436 -8.472 220 H SER 30 H SER 30 -0.331 7.792 -7.039 221 HA SER 30 HA SER 30 -1.804 5.243 -6.765 222 HB2 SER 30 HB2 SER 30 -2.754 7.084 -5.369 223 HB3 SER 30 HB3 SER 30 -3.030 8.016 -6.840 224 HG SER 30 HG SER 30 -4.072 5.411 -6.448 225 H GLY 31 H GLY 31 -1.651 4.301 -8.725 226 HA2 GLY 31 HA2 GLY 31 -1.816 5.968 -11.152 227 HA3 GLY 31 HA3 GLY 31 -1.227 4.318 -11.070 228 H ARG 32 H ARG 32 -3.546 5.995 -12.452 229 HA ARG 32 HA ARG 32 -5.924 4.585 -11.705 230 HB2 ARG 32 HB2 ARG 32 -5.321 6.307 -14.126 231 HB3 ARG 32 HB3 ARG 32 -6.921 5.714 -13.690 232 HG2 ARG 32 HG2 ARG 32 -6.853 6.961 -11.606 233 HG3 ARG 32 HG3 ARG 32 -5.210 7.497 -11.955 234 HD2 ARG 32 HD2 ARG 32 -6.053 8.686 -13.950 235 HD3 ARG 32 HD3 ARG 32 -7.696 8.191 -13.527 236 HE ARG 32 HE ARG 32 -7.056 9.411 -11.304 237 HH11 ARG 32 HH11 ARG 32 -6.369 10.415 -14.527 238 HH12 ARG 32 HH12 ARG 32 -6.262 12.085 -14.089 239 HH21 ARG 32 HH21 ARG 32 -6.925 11.555 -10.762 240 HH22 ARG 32 HH22 ARG 32 -6.578 12.721 -11.989 241 H THR 33 H THR 33 -5.581 2.403 -11.898 242 HA THR 33 HA THR 33 -4.712 1.257 -14.439 243 HB THR 33 HB THR 33 -4.724 -0.902 -13.228 244 HG1 THR 33 HG1 THR 33 -5.372 -1.009 -11.124 245 HG21 THR 33 HG21 THR 33 -3.311 1.319 -11.731 246 HG22 THR 33 HG22 THR 33 -2.699 0.489 -13.162 247 HG23 THR 33 HG23 THR 33 -2.907 -0.395 -11.651 248 H LEU 34 H LEU 34 -7.511 0.938 -12.232 249 HA LEU 34 HA LEU 34 -9.071 -0.727 -13.862 250 HB2 LEU 34 HB2 LEU 34 -9.850 1.254 -11.726 251 HB3 LEU 34 HB3 LEU 34 -11.040 0.285 -12.573 252 HG LEU 34 HG LEU 34 -10.596 -0.779 -10.495 253 HD11 LEU 34 HD11 LEU 34 -9.129 -2.272 -12.660 254 HD12 LEU 34 HD12 LEU 34 -10.871 -2.280 -12.386 255 HD13 LEU 34 HD13 LEU 34 -9.786 -2.970 -11.178 256 HD21 LEU 34 HD21 LEU 34 -8.467 0.259 -9.954 257 HD22 LEU 34 HD22 LEU 34 -7.665 -0.703 -11.197 258 HD23 LEU 34 HD23 LEU 34 -8.367 -1.494 -9.785 259 H ASN 35 H ASN 35 -9.261 -0.171 -15.976 260 HA ASN 35 HA ASN 35 -9.689 2.419 -16.992 261 HB2 ASN 35 HB2 ASN 35 -8.828 0.491 -18.317 262 HB3 ASN 35 HB3 ASN 35 -10.443 -0.211 -18.295 263 HD21 ASN 35 HD21 ASN 35 -10.651 -0.133 -20.522 264 HD22 ASN 35 HD22 ASN 35 -10.862 1.347 -21.384 265 H GLN 36 H GLN 36 -11.853 0.367 -15.371 266 HA GLN 36 HA GLN 36 -14.337 0.893 -16.444 267 HB2 GLN 36 HB2 GLN 36 -13.523 0.699 -13.539 268 HB3 GLN 36 HB3 GLN 36 -15.197 0.746 -14.074 269 HG2 GLN 36 HG2 GLN 36 -13.188 -1.365 -14.843 270 HG3 GLN 36 HG3 GLN 36 -14.415 -1.531 -13.590 271 HE21 GLN 36 HE21 GLN 36 -14.045 -3.119 -15.981 272 HE22 GLN 36 HE22 GLN 36 -15.512 -2.986 -16.884 273 H GLY 37 H GLY 37 -12.279 3.103 -14.641 274 HA2 GLY 37 HA2 GLY 37 -12.511 5.319 -14.063 275 HA3 GLY 37 HA3 GLY 37 -13.634 5.432 -15.411 276 H ALA 38 H ALA 38 -13.462 4.372 -12.011 277 HA ALA 38 HA ALA 38 -15.940 5.624 -11.313 278 HB1 ALA 38 HB1 ALA 38 -17.298 3.674 -10.927 279 HB2 ALA 38 HB2 ALA 38 -15.977 2.602 -11.398 280 HB3 ALA 38 HB3 ALA 38 -16.747 3.641 -12.604 281 H THR 39 H THR 39 -16.626 5.009 -9.043 282 HA THR 39 HA THR 39 -14.347 4.838 -7.283 283 HB THR 39 HB THR 39 -15.879 5.122 -5.471 284 HG1 THR 39 HG1 THR 39 -18.163 4.794 -7.105 285 HG21 THR 39 HG21 THR 39 -16.961 6.637 -7.856 286 HG22 THR 39 HG22 THR 39 -15.612 7.133 -6.833 287 HG23 THR 39 HG23 THR 39 -17.242 7.054 -6.165 288 H VAL 40 H VAL 40 -14.940 3.281 -5.204 289 HA VAL 40 HA VAL 40 -14.678 0.608 -6.155 290 HB VAL 40 HB VAL 40 -13.622 1.381 -4.056 291 HG11 VAL 40 HG11 VAL 40 -16.434 1.374 -2.956 292 HG12 VAL 40 HG12 VAL 40 -15.412 2.790 -3.200 293 HG13 VAL 40 HG13 VAL 40 -14.958 1.571 -2.009 294 HG21 VAL 40 HG21 VAL 40 -14.108 -0.628 -2.725 295 HG22 VAL 40 HG22 VAL 40 -13.921 -1.002 -4.438 296 HG23 VAL 40 HG23 VAL 40 -15.531 -0.937 -3.718 297 H GLU 41 H GLU 41 -17.378 2.555 -5.146 298 HA GLU 41 HA GLU 41 -19.151 0.513 -4.339 299 HB2 GLU 41 HB2 GLU 41 -19.817 3.245 -5.456 300 HB3 GLU 41 HB3 GLU 41 -20.917 2.204 -4.556 301 HG2 GLU 41 HG2 GLU 41 -19.386 2.356 -2.608 302 HG3 GLU 41 HG3 GLU 41 -18.400 3.503 -3.516 303 H GLU 42 H GLU 42 -18.590 2.001 -7.515 304 HA GLU 42 HA GLU 42 -20.744 0.754 -8.849 305 HB2 GLU 42 HB2 GLU 42 -18.139 1.874 -9.873 306 HB3 GLU 42 HB3 GLU 42 -19.343 1.175 -10.943 307 HG2 GLU 42 HG2 GLU 42 -19.687 3.494 -11.010 308 HG3 GLU 42 HG3 GLU 42 -20.986 2.847 -10.013 309 H LYS 43 H LYS 43 -17.535 -0.459 -8.050 310 HA LYS 43 HA LYS 43 -18.161 -2.930 -9.548 311 HB2 LYS 43 HB2 LYS 43 -15.372 -1.843 -9.143 312 HB3 LYS 43 HB3 LYS 43 -15.838 -3.232 -10.109 313 HG2 LYS 43 HG2 LYS 43 -15.679 -1.765 -11.815 314 HG3 LYS 43 HG3 LYS 43 -17.314 -1.326 -11.321 315 HD2 LYS 43 HD2 LYS 43 -16.127 0.716 -11.554 316 HD3 LYS 43 HD3 LYS 43 -16.257 0.426 -9.818 317 HE2 LYS 43 HE2 LYS 43 -13.947 -0.643 -9.983 318 HE3 LYS 43 HE3 LYS 43 -13.853 0.054 -11.598 319 HZ1 LYS 43 HZ1 LYS 43 -12.798 1.471 -9.946 320 HZ2 LYS 43 HZ2 LYS 43 -14.245 1.581 -9.080 321 HZ3 LYS 43 HZ3 LYS 43 -14.135 2.249 -10.627 322 H LEU 44 H LEU 44 -19.032 -2.884 -7.012 323 HA LEU 44 HA LEU 44 -17.128 -3.874 -5.126 324 HB2 LEU 44 HB2 LEU 44 -20.145 -3.963 -5.174 325 HB3 LEU 44 HB3 LEU 44 -19.190 -4.581 -3.839 326 HG LEU 44 HG LEU 44 -19.207 -1.707 -4.784 327 HD11 LEU 44 HD11 LEU 44 -20.450 -2.952 -2.334 328 HD12 LEU 44 HD12 LEU 44 -21.318 -2.342 -3.742 329 HD13 LEU 44 HD13 LEU 44 -20.408 -1.231 -2.719 330 HD21 LEU 44 HD21 LEU 44 -17.944 -1.271 -2.714 331 HD22 LEU 44 HD22 LEU 44 -17.061 -2.310 -3.830 332 HD23 LEU 44 HD23 LEU 44 -17.854 -3.007 -2.418 333 H THR 45 H THR 45 -16.045 -5.524 -6.251 334 HA THR 45 HA THR 45 -17.210 -8.145 -5.804 335 HB THR 45 HB THR 45 -17.988 -7.780 -8.076 336 HG1 THR 45 HG1 THR 45 -16.579 -9.506 -9.104 337 HG21 THR 45 HG21 THR 45 -16.457 -7.354 -9.933 338 HG22 THR 45 HG22 THR 45 -15.092 -7.294 -8.817 339 HG23 THR 45 HG23 THR 45 -16.347 -6.056 -8.744 340 H GLU 46 H GLU 46 -15.506 -9.899 -6.538 341 HA GLU 46 HA GLU 46 -13.148 -9.382 -5.047 342 HB2 GLU 46 HB2 GLU 46 -14.105 -11.638 -5.250 343 HB3 GLU 46 HB3 GLU 46 -13.720 -11.656 -6.967 344 HG2 GLU 46 HG2 GLU 46 -11.338 -11.532 -6.453 345 HG3 GLU 46 HG3 GLU 46 -11.704 -11.465 -4.731 346 H GLU 47 H GLU 47 -13.852 -9.205 -8.479 347 HA GLU 47 HA GLU 47 -11.257 -9.049 -9.511 348 HB2 GLU 47 HB2 GLU 47 -13.827 -7.763 -10.427 349 HB3 GLU 47 HB3 GLU 47 -12.323 -7.615 -11.327 350 HG2 GLU 47 HG2 GLU 47 -13.660 -9.367 -12.282 351 HG3 GLU 47 HG3 GLU 47 -12.228 -10.069 -11.541 352 H TYR 48 H TYR 48 -13.111 -6.690 -7.721 353 HA TYR 48 HA TYR 48 -11.343 -4.482 -8.238 354 HB2 TYR 48 HB2 TYR 48 -13.836 -4.501 -7.347 355 HB3 TYR 48 HB3 TYR 48 -13.059 -4.632 -5.773 356 HD1 TYR 48 HD1 TYR 48 -11.190 -2.828 -5.290 357 HD2 TYR 48 HD2 TYR 48 -14.218 -2.402 -8.246 358 HE1 TYR 48 HE1 TYR 48 -10.837 -0.399 -5.297 359 HE2 TYR 48 HE2 TYR 48 -13.876 0.027 -8.265 360 HH TYR 48 HH TYR 48 -11.197 1.513 -6.877 361 H PHE 49 H PHE 49 -11.670 -6.966 -5.787 362 HA PHE 49 HA PHE 49 -9.877 -6.048 -3.849 363 HB2 PHE 49 HB2 PHE 49 -11.509 -7.937 -3.609 364 HB3 PHE 49 HB3 PHE 49 -10.473 -8.924 -4.625 365 HD1 PHE 49 HD2 PHE 49 -8.193 -9.578 -3.784 366 HD2 PHE 49 HD1 PHE 49 -11.093 -7.691 -1.294 367 HE1 PHE 49 HE2 PHE 49 -6.980 -10.346 -1.787 368 HE2 PHE 49 HE1 PHE 49 -9.885 -8.467 0.704 369 HZ PHE 49 HZ PHE 49 -7.826 -9.796 0.458 370 H ASN 50 H ASN 50 -9.261 -8.550 -6.338 371 HA ASN 50 HA ASN 50 -6.453 -8.526 -5.865 372 HB2 ASN 50 HB2 ASN 50 -6.357 -10.019 -7.878 373 HB3 ASN 50 HB3 ASN 50 -7.451 -10.559 -6.612 374 HD21 ASN 50 HD21 ASN 50 -8.724 -11.771 -7.949 375 HD22 ASN 50 HD22 ASN 50 -9.762 -11.089 -9.147 376 H ALA 51 H ALA 51 -8.244 -6.219 -7.337 377 HA ALA 51 HA ALA 51 -6.274 -5.544 -9.393 378 HB1 ALA 51 HB1 ALA 51 -8.880 -4.185 -8.712 379 HB2 ALA 51 HB2 ALA 51 -8.648 -5.401 -9.969 380 HB3 ALA 51 HB3 ALA 51 -7.850 -3.834 -10.100 381 H VAL 52 H VAL 52 -7.393 -4.366 -6.239 382 HA VAL 52 HA VAL 52 -5.398 -2.178 -6.424 383 HB VAL 52 HB VAL 52 -6.845 -0.739 -5.079 384 HG11 VAL 52 HG11 VAL 52 -7.002 -0.564 -7.496 385 HG12 VAL 52 HG12 VAL 52 -8.583 -0.293 -6.762 386 HG13 VAL 52 HG13 VAL 52 -8.221 -1.838 -7.534 387 HG21 VAL 52 HG21 VAL 52 -8.859 -2.984 -5.268 388 HG22 VAL 52 HG22 VAL 52 -9.185 -1.370 -4.637 389 HG23 VAL 52 HG23 VAL 52 -8.044 -2.428 -3.807 390 H ASN 53 H ASN 53 -5.879 -4.997 -4.804 391 HA ASN 53 HA ASN 53 -5.341 -3.975 -2.113 392 HB2 ASN 53 HB2 ASN 53 -5.896 -6.745 -3.175 393 HB3 ASN 53 HB3 ASN 53 -5.367 -6.470 -1.518 394 HD21 ASN 53 HD21 ASN 53 -7.551 -4.470 -3.445 395 HD22 ASN 53 HD22 ASN 53 -8.915 -4.690 -2.414 396 H TYR 54 H TYR 54 -3.190 -3.557 -4.036 397 HA TYR 54 HA TYR 54 -1.072 -4.901 -2.563 398 HB2 TYR 54 HB2 TYR 54 0.070 -5.728 -4.606 399 HB3 TYR 54 HB3 TYR 54 -1.476 -6.522 -4.321 400 HD1 TYR 54 HD2 TYR 54 -3.377 -6.108 -5.791 401 HD2 TYR 54 HD1 TYR 54 0.389 -4.261 -6.520 402 HE1 TYR 54 HE2 TYR 54 -4.109 -5.526 -8.059 403 HE2 TYR 54 HE1 TYR 54 -0.338 -3.667 -8.794 404 HH TYR 54 HH TYR 54 -3.563 -3.839 -9.785 405 H ALA 55 H ALA 55 1.061 -4.055 -2.957 406 HA ALA 55 HA ALA 55 1.141 -1.441 -4.336 407 HB1 ALA 55 HB1 ALA 55 2.553 -0.550 -2.561 408 HB2 ALA 55 HB2 ALA 55 2.449 -2.080 -1.686 409 HB3 ALA 55 HB3 ALA 55 1.005 -1.089 -1.905 410 H GLU 56 H GLU 56 2.847 -1.178 -5.693 411 HA GLU 56 HA GLU 56 4.723 -3.387 -5.972 412 HB2 GLU 56 HB2 GLU 56 4.365 -0.912 -7.684 413 HB3 GLU 56 HB3 GLU 56 5.431 -2.262 -8.050 414 HG2 GLU 56 HG2 GLU 56 3.342 -3.723 -7.981 415 HG3 GLU 56 HG3 GLU 56 2.431 -2.214 -8.013 416 H ILE 57 H ILE 57 6.572 -3.397 -4.963 417 HA ILE 57 HA ILE 57 7.756 -0.880 -3.977 418 HB ILE 57 HB ILE 57 8.120 -3.678 -2.882 419 HG12 ILE 57 HG12 ILE 57 6.389 -1.530 -1.644 420 HG13 ILE 57 HG13 ILE 57 5.735 -2.674 -2.809 421 HG21 ILE 57 HG21 ILE 57 8.974 -2.525 -0.883 422 HG22 ILE 57 HG22 ILE 57 8.780 -0.970 -1.696 423 HG23 ILE 57 HG23 ILE 57 9.939 -2.149 -2.311 424 HD11 ILE 57 HD11 ILE 57 5.336 -3.317 -0.477 425 HD12 ILE 57 HD12 ILE 57 7.079 -3.447 -0.237 426 HD13 ILE 57 HD13 ILE 57 6.260 -4.517 -1.380 427 H ASN 58 H ASN 58 10.024 -0.565 -4.164 428 HA ASN 58 HA ASN 58 11.374 -1.885 -6.307 429 HB2 ASN 58 HB2 ASN 58 11.860 0.451 -5.704 430 HB3 ASN 58 HB3 ASN 58 12.485 -0.077 -4.143 431 HD21 ASN 58 HD21 ASN 58 13.075 0.068 -7.550 432 HD22 ASN 58 HD22 ASN 58 14.743 -0.365 -7.483 433 H GLU 59 H GLU 59 12.982 -3.463 -6.263 434 HA GLU 59 HA GLU 59 12.826 -5.438 -4.321 435 HB2 GLU 59 HB2 GLU 59 13.672 -5.875 -6.558 436 HB3 GLU 59 HB3 GLU 59 15.112 -4.917 -6.230 437 HG2 GLU 59 HG2 GLU 59 15.903 -6.488 -4.635 438 HG3 GLU 59 HG3 GLU 59 14.372 -7.356 -4.636 439 H GLU 60 H GLU 60 15.171 -2.779 -4.482 440 HA GLU 60 HA GLU 60 16.889 -3.586 -2.431 441 HB2 GLU 60 HB2 GLU 60 16.045 -0.859 -3.396 442 HB3 GLU 60 HB3 GLU 60 17.183 -1.044 -2.070 443 HG2 GLU 60 HG2 GLU 60 17.606 -2.289 -4.777 444 HG3 GLU 60 HG3 GLU 60 18.180 -0.677 -4.350 445 H ASP 61 H ASP 61 14.013 -1.456 -2.129 446 HA ASP 61 HA ASP 61 14.003 -1.382 0.696 447 HB2 ASP 61 HB2 ASP 61 11.612 -1.138 -1.152 448 HB3 ASP 61 HB3 ASP 61 11.733 -0.530 0.497 449 H TRP 62 H TRP 62 12.509 -3.545 -1.631 450 HA TRP 62 HA TRP 62 10.908 -5.143 -0.043 451 HB2 TRP 62 HB2 TRP 62 11.019 -5.279 -2.491 452 HB3 TRP 62 HB3 TRP 62 12.641 -5.945 -2.395 453 HD1 TRP 62 HD1 TRP 62 12.861 -8.533 -1.657 454 HE1 TRP 62 HE1 TRP 62 11.140 -10.448 -1.666 455 HE3 TRP 62 HE3 TRP 62 8.578 -5.779 -2.133 456 HZ2 TRP 62 HZ2 TRP 62 8.357 -10.746 -1.877 457 HZ3 TRP 62 HZ3 TRP 62 6.427 -6.963 -2.237 458 HH2 TRP 62 HH2 TRP 62 6.320 -9.396 -2.110 459 H ASN 63 H ASN 63 14.388 -5.503 -0.708 460 HA ASN 63 HA ASN 63 14.743 -7.808 0.928 461 HB2 ASN 63 HB2 ASN 63 16.825 -5.779 0.054 462 HB3 ASN 63 HB3 ASN 63 17.146 -7.401 0.658 463 HD21 ASN 63 HD21 ASN 63 17.897 -6.206 -1.858 464 HD22 ASN 63 HD22 ASN 63 17.216 -7.198 -3.095 465 H ALA 64 H ALA 64 15.170 -4.333 1.477 466 HA ALA 64 HA ALA 64 16.409 -4.444 3.998 467 HB1 ALA 64 HB1 ALA 64 16.321 -2.433 2.580 468 HB2 ALA 64 HB2 ALA 64 15.780 -2.112 4.227 469 HB3 ALA 64 HB3 ALA 64 14.598 -2.277 2.927 470 H LEU 65 H LEU 65 12.986 -4.435 3.118 471 HA LEU 65 HA LEU 65 12.120 -4.374 5.894 472 HB2 LEU 65 HB2 LEU 65 10.554 -4.698 3.329 473 HB3 LEU 65 HB3 LEU 65 9.844 -4.507 4.921 474 HG LEU 65 HG LEU 65 11.575 -2.443 3.546 475 HD11 LEU 65 HD11 LEU 65 9.454 -2.701 2.383 476 HD12 LEU 65 HD12 LEU 65 9.496 -1.172 3.262 477 HD13 LEU 65 HD13 LEU 65 8.579 -2.536 3.906 478 HD21 LEU 65 HD21 LEU 65 11.703 -2.337 5.987 479 HD22 LEU 65 HD22 LEU 65 9.942 -2.277 6.084 480 HD23 LEU 65 HD23 LEU 65 10.833 -0.952 5.334 481 H GLY 66 H GLY 66 13.271 -6.764 3.887 482 HA2 GLY 66 HA2 GLY 66 13.198 -9.060 3.888 483 HA3 GLY 66 HA3 GLY 66 12.673 -8.924 5.559 484 H LEU 67 H LEU 67 11.173 -8.116 2.427 485 HA LEU 67 HA LEU 67 8.639 -9.172 3.412 486 HB2 LEU 67 HB2 LEU 67 9.324 -7.646 0.900 487 HB3 LEU 67 HB3 LEU 67 7.702 -8.136 1.360 488 HG LEU 67 HG LEU 67 9.466 -6.258 2.943 489 HD11 LEU 67 HD11 LEU 67 7.875 -4.523 2.242 490 HD12 LEU 67 HD12 LEU 67 7.077 -5.694 1.189 491 HD13 LEU 67 HD13 LEU 67 8.749 -5.222 0.879 492 HD21 LEU 67 HD21 LEU 67 7.986 -7.495 4.408 493 HD22 LEU 67 HD22 LEU 67 6.605 -7.141 3.367 494 HD23 LEU 67 HD23 LEU 67 7.403 -5.836 4.247 495 H GLN 68 H GLN 68 7.261 -10.466 2.075 496 HA GLN 68 HA GLN 68 8.652 -12.301 0.227 497 HB2 GLN 68 HB2 GLN 68 6.641 -12.940 2.390 498 HB3 GLN 68 HB3 GLN 68 6.960 -14.037 1.059 499 HG2 GLN 68 HG2 GLN 68 8.386 -14.906 2.593 500 HG3 GLN 68 HG3 GLN 68 9.466 -13.718 1.869 501 HE21 GLN 68 HE21 GLN 68 9.557 -14.885 4.515 502 HE22 GLN 68 HE22 GLN 68 9.465 -13.571 5.634 503 H GLU 69 H GLU 69 7.487 -12.938 -1.603 504 HA GLU 69 HA GLU 69 5.581 -11.084 -2.541 505 HB2 GLU 69 HB2 GLU 69 6.437 -13.773 -3.617 506 HB3 GLU 69 HB3 GLU 69 5.286 -12.729 -4.451 507 HG2 GLU 69 HG2 GLU 69 6.964 -10.949 -4.524 508 HG3 GLU 69 HG3 GLU 69 8.119 -12.007 -3.720 509 H GLY 70 H GLY 70 3.819 -10.912 -1.313 510 HA2 GLY 70 HA2 GLY 70 1.461 -11.764 -1.519 511 HA3 GLY 70 HA3 GLY 70 2.107 -13.314 -1.016 512 H ASP 71 H ASP 71 3.862 -11.283 0.862 513 HA ASP 71 HA ASP 71 2.102 -11.681 3.125 514 HB2 ASP 71 HB2 ASP 71 3.899 -11.211 4.491 515 HB3 ASP 71 HB3 ASP 71 4.724 -11.775 3.048 516 H ARG 72 H ARG 72 2.307 -9.548 4.775 517 HA ARG 72 HA ARG 72 0.628 -7.589 3.345 518 HB2 ARG 72 HB2 ARG 72 0.668 -8.222 6.305 519 HB3 ARG 72 HB3 ARG 72 -0.403 -7.080 5.509 520 HG2 ARG 72 HG2 ARG 72 -1.742 -8.947 5.805 521 HG3 ARG 72 HG3 ARG 72 -1.209 -9.104 4.132 522 HD2 ARG 72 HD2 ARG 72 0.470 -10.726 4.781 523 HD3 ARG 72 HD3 ARG 72 0.078 -10.496 6.485 524 HE ARG 72 HE ARG 72 -2.016 -11.463 4.683 525 HH11 ARG 72 HH11 ARG 72 0.171 -12.071 7.267 526 HH12 ARG 72 HH12 ARG 72 -0.606 -13.538 7.734 527 HH21 ARG 72 HH21 ARG 72 -2.997 -13.360 5.270 528 HH22 ARG 72 HH22 ARG 72 -2.389 -14.259 6.616 529 H VAL 73 H VAL 73 1.407 -5.617 3.045 530 HA VAL 73 HA VAL 73 3.353 -4.511 4.977 531 HB VAL 73 HB VAL 73 4.047 -2.945 3.179 532 HG11 VAL 73 HG11 VAL 73 5.335 -4.957 3.601 533 HG12 VAL 73 HG12 VAL 73 5.335 -4.580 1.878 534 HG13 VAL 73 HG13 VAL 73 4.308 -5.873 2.498 535 HG21 VAL 73 HG21 VAL 73 2.039 -2.936 1.811 536 HG22 VAL 73 HG22 VAL 73 2.257 -4.644 1.429 537 HG23 VAL 73 HG23 VAL 73 3.416 -3.454 0.838 538 H LYS 74 H LYS 74 3.091 -2.332 5.652 539 HA LYS 74 HA LYS 74 0.350 -1.291 5.270 540 HB2 LYS 74 HB2 LYS 74 0.940 -2.343 7.532 541 HB3 LYS 74 HB3 LYS 74 1.976 -0.947 7.790 542 HG2 LYS 74 HG2 LYS 74 0.056 0.531 7.599 543 HG3 LYS 74 HG3 LYS 74 -0.988 -0.852 7.261 544 HD2 LYS 74 HD2 LYS 74 -0.338 -1.787 9.502 545 HD3 LYS 74 HD3 LYS 74 0.499 -0.265 9.826 546 HE2 LYS 74 HE2 LYS 74 -1.721 0.863 9.282 547 HE3 LYS 74 HE3 LYS 74 -2.440 -0.734 9.410 548 HZ1 LYS 74 HZ1 LYS 74 -0.858 0.529 11.576 549 HZ2 LYS 74 HZ2 LYS 74 -1.795 -0.875 11.679 550 HZ3 LYS 74 HZ3 LYS 74 -2.542 0.632 11.466 551 H VAL 75 H VAL 75 0.159 0.761 4.632 552 HA VAL 75 HA VAL 75 2.604 2.413 4.479 553 HB VAL 75 HB VAL 75 0.071 2.629 2.824 554 HG11 VAL 75 HG11 VAL 75 1.219 4.776 3.091 555 HG12 VAL 75 HG12 VAL 75 1.350 4.186 1.435 556 HG13 VAL 75 HG13 VAL 75 2.725 4.048 2.529 557 HG21 VAL 75 HG21 VAL 75 1.426 1.744 0.975 558 HG22 VAL 75 HG22 VAL 75 1.291 0.582 2.295 559 HG23 VAL 75 HG23 VAL 75 2.780 1.504 2.078 560 H LYS 76 H LYS 76 2.678 4.366 5.498 561 HA LYS 76 HA LYS 76 0.139 5.547 6.464 562 HB2 LYS 76 HB2 LYS 76 2.807 5.627 7.896 563 HB3 LYS 76 HB3 LYS 76 1.361 6.483 8.400 564 HG2 LYS 76 HG2 LYS 76 1.296 4.673 9.786 565 HG3 LYS 76 HG3 LYS 76 0.307 4.089 8.449 566 HD2 LYS 76 HD2 LYS 76 2.150 2.823 7.561 567 HD3 LYS 76 HD3 LYS 76 3.264 3.535 8.731 568 HE2 LYS 76 HE2 LYS 76 1.940 2.491 10.552 569 HE3 LYS 76 HE3 LYS 76 0.943 1.705 9.328 570 HZ1 LYS 76 HZ1 LYS 76 3.874 1.348 9.591 571 HZ2 LYS 76 HZ2 LYS 76 2.856 0.522 8.531 572 HZ3 LYS 76 HZ3 LYS 76 2.716 0.275 10.199 573 H THR 77 H THR 77 -0.164 7.680 6.120 574 HA THR 77 HA THR 77 2.107 9.401 5.371 575 HB THR 77 HB THR 77 0.856 10.516 3.624 576 HG1 THR 77 HG1 THR 77 -1.238 9.647 3.017 577 HG21 THR 77 HG21 THR 77 0.641 8.733 1.944 578 HG22 THR 77 HG22 THR 77 0.721 7.519 3.220 579 HG23 THR 77 HG23 THR 77 2.115 8.551 2.896 580 H GLU 78 H GLU 78 0.944 11.810 5.148 581 HA GLU 78 HA GLU 78 -0.130 12.370 7.760 582 HB2 GLU 78 HB2 GLU 78 -0.179 14.717 7.002 583 HB3 GLU 78 HB3 GLU 78 1.379 13.956 6.719 584 HG2 GLU 78 HG2 GLU 78 0.660 13.581 4.340 585 HG3 GLU 78 HG3 GLU 78 -0.753 14.577 4.684 586 H PHE 79 H PHE 79 -1.576 11.064 5.141 587 HA PHE 79 HA PHE 79 -4.174 12.380 5.553 588 HB2 PHE 79 HB2 PHE 79 -3.266 10.387 3.458 589 HB3 PHE 79 HB3 PHE 79 -4.893 11.055 3.562 590 HD1 PHE 79 HD1 PHE 79 -1.362 11.831 2.828 591 HD2 PHE 79 HD2 PHE 79 -5.371 13.272 2.808 592 HE1 PHE 79 HE1 PHE 79 -0.664 13.749 1.453 593 HE2 PHE 79 HE2 PHE 79 -4.676 15.189 1.435 594 HZ PHE 79 HZ PHE 79 -2.320 15.431 0.755 595 H GLY 80 H GLY 80 -2.553 9.253 5.896 596 HA2 GLY 80 HA2 GLY 80 -3.941 8.311 8.051 597 HA3 GLY 80 HA3 GLY 80 -4.941 7.838 6.686 598 H GLU 81 H GLU 81 -4.576 5.623 7.265 599 HA GLU 81 HA GLU 81 -2.061 4.571 6.183 600 HB2 GLU 81 HB2 GLU 81 -1.933 2.906 8.040 601 HB3 GLU 81 HB3 GLU 81 -1.635 4.562 8.544 602 HG2 GLU 81 HG2 GLU 81 -3.698 4.730 9.643 603 HG3 GLU 81 HG3 GLU 81 -4.356 3.321 8.812 604 H VAL 82 H VAL 82 -2.142 2.283 5.623 605 HA VAL 82 HA VAL 82 -4.656 0.865 5.623 606 HB VAL 82 HB VAL 82 -4.946 2.403 3.689 607 HG11 VAL 82 HG11 VAL 82 -2.621 2.620 3.007 608 HG12 VAL 82 HG12 VAL 82 -3.616 2.076 1.656 609 HG13 VAL 82 HG13 VAL 82 -2.589 0.927 2.514 610 HG21 VAL 82 HG21 VAL 82 -5.637 0.689 2.060 611 HG22 VAL 82 HG22 VAL 82 -6.115 0.266 3.702 612 HG23 VAL 82 HG23 VAL 82 -4.724 -0.525 2.958 613 H VAL 83 H VAL 83 -4.432 -1.357 5.043 614 HA VAL 83 HA VAL 83 -1.639 -2.301 4.797 615 HB VAL 83 HB VAL 83 -4.019 -3.891 5.786 616 HG11 VAL 83 HG11 VAL 83 -2.232 -5.268 4.855 617 HG12 VAL 83 HG12 VAL 83 -2.312 -5.464 6.606 618 HG13 VAL 83 HG13 VAL 83 -1.051 -4.462 5.888 619 HG21 VAL 83 HG21 VAL 83 -1.858 -2.539 7.408 620 HG22 VAL 83 HG22 VAL 83 -3.122 -3.595 8.040 621 HG23 VAL 83 HG23 VAL 83 -3.549 -2.044 7.319 622 H VAL 84 H VAL 84 -1.056 -3.228 2.924 623 HA VAL 84 HA VAL 84 -3.087 -4.557 1.238 624 HB VAL 84 HB VAL 84 -2.038 -3.619 -0.795 625 HG11 VAL 84 HG11 VAL 84 -2.949 -1.345 -0.622 626 HG12 VAL 84 HG12 VAL 84 -3.024 -1.514 1.134 627 HG13 VAL 84 HG13 VAL 84 -4.028 -2.538 0.106 628 HG21 VAL 84 HG21 VAL 84 -0.506 -1.692 -0.611 629 HG22 VAL 84 HG22 VAL 84 0.192 -3.165 0.062 630 HG23 VAL 84 HG23 VAL 84 -0.447 -1.921 1.137 631 H PHE 85 H PHE 85 -1.945 -5.849 -0.598 632 HA PHE 85 HA PHE 85 -0.004 -7.600 0.597 633 HB2 PHE 85 HB2 PHE 85 -1.221 -7.516 -2.167 634 HB3 PHE 85 HB3 PHE 85 -0.038 -8.722 -1.683 635 HD1 PHE 85 HD1 PHE 85 -0.634 -10.063 0.496 636 HD2 PHE 85 HD2 PHE 85 -3.476 -7.999 -1.917 637 HE1 PHE 85 HE1 PHE 85 -2.430 -11.483 1.394 638 HE2 PHE 85 HE2 PHE 85 -5.274 -9.419 -1.019 639 HZ PHE 85 HZ PHE 85 -4.752 -11.161 0.639 640 H ALA 86 H ALA 86 2.132 -7.926 0.066 641 HA ALA 86 HA ALA 86 3.530 -5.632 -1.028 642 HB1 ALA 86 HB1 ALA 86 5.544 -6.743 -0.253 643 HB2 ALA 86 HB2 ALA 86 4.631 -8.215 0.083 644 HB3 ALA 86 HB3 ALA 86 4.317 -6.750 1.013 645 H LYS 87 H LYS 87 4.259 -5.435 -3.064 646 HA LYS 87 HA LYS 87 4.957 -7.868 -4.583 647 HB2 LYS 87 HB2 LYS 87 3.477 -5.442 -5.599 648 HB3 LYS 87 HB3 LYS 87 4.294 -6.560 -6.671 649 HG2 LYS 87 HG2 LYS 87 2.828 -8.365 -5.662 650 HG3 LYS 87 HG3 LYS 87 1.897 -7.051 -4.937 651 HD2 LYS 87 HD2 LYS 87 1.546 -6.084 -7.178 652 HD3 LYS 87 HD3 LYS 87 2.451 -7.422 -7.889 653 HE2 LYS 87 HE2 LYS 87 0.770 -8.969 -6.894 654 HE3 LYS 87 HE3 LYS 87 -0.164 -7.561 -6.410 655 HZ1 LYS 87 HZ1 LYS 87 -1.059 -8.286 -8.445 656 HZ2 LYS 87 HZ2 LYS 87 0.459 -8.464 -9.155 657 HZ3 LYS 87 HZ3 LYS 87 -0.139 -6.920 -8.828 658 H LYS 88 H LYS 88 6.523 -7.619 -6.221 659 HA LYS 88 HA LYS 88 8.468 -5.505 -5.639 660 HB2 LYS 88 HB2 LYS 88 9.035 -8.021 -5.576 661 HB3 LYS 88 HB3 LYS 88 8.932 -7.960 -7.332 662 HG2 LYS 88 HG2 LYS 88 10.635 -6.180 -7.325 663 HG3 LYS 88 HG3 LYS 88 10.778 -6.376 -5.580 664 HD2 LYS 88 HD2 LYS 88 11.316 -8.530 -7.632 665 HD3 LYS 88 HD3 LYS 88 12.554 -7.580 -6.811 666 HE2 LYS 88 HE2 LYS 88 11.820 -8.494 -4.651 667 HE3 LYS 88 HE3 LYS 88 10.573 -9.432 -5.474 668 HZ1 LYS 88 HZ1 LYS 88 13.471 -9.711 -6.045 669 HZ2 LYS 88 HZ2 LYS 88 12.213 -10.714 -6.575 670 HZ3 LYS 88 HZ3 LYS 88 12.638 -10.683 -4.938 671 H GLY 89 H GLY 89 8.081 -3.754 -6.918 672 HA2 GLY 89 HA2 GLY 89 6.886 -4.197 -9.574 673 HA3 GLY 89 HA3 GLY 89 6.809 -2.711 -8.649 674 H ASP 90 H ASP 90 7.344 -1.839 -10.801 675 HA ASP 90 HA ASP 90 10.142 -2.148 -11.643 676 HB2 ASP 90 HB2 ASP 90 7.924 -0.607 -13.011 677 HB3 ASP 90 HB3 ASP 90 9.446 -1.151 -13.715 678 H VAL 91 H VAL 91 8.824 -0.391 -9.369 679 HA VAL 91 HA VAL 91 9.471 2.316 -10.125 680 HB VAL 91 HB VAL 91 8.830 2.880 -7.801 681 HG11 VAL 91 HG11 VAL 91 6.897 0.987 -9.151 682 HG12 VAL 91 HG12 VAL 91 7.093 2.699 -9.523 683 HG13 VAL 91 HG13 VAL 91 6.481 2.204 -7.944 684 HG21 VAL 91 HG21 VAL 91 8.506 -0.108 -7.469 685 HG22 VAL 91 HG22 VAL 91 7.992 1.111 -6.302 686 HG23 VAL 91 HG23 VAL 91 9.706 0.905 -6.666 687 HA PRO 92 HA PRO 92 13.642 2.439 -8.425 688 HB2 PRO 92 HB2 PRO 92 13.854 5.028 -7.679 689 HB3 PRO 92 HB3 PRO 92 13.789 4.542 -9.378 690 HG2 PRO 92 HG2 PRO 92 11.592 5.602 -7.632 691 HG3 PRO 92 HG3 PRO 92 12.008 6.043 -9.300 692 HD2 PRO 92 HD2 PRO 92 9.995 4.312 -8.680 693 HD3 PRO 92 HD3 PRO 92 10.927 4.208 -10.188 694 H LYS 93 H LYS 93 14.861 3.038 -6.376 695 HA LYS 93 HA LYS 93 13.536 1.898 -4.151 696 HB2 LYS 93 HB2 LYS 93 16.025 1.825 -4.599 697 HB3 LYS 93 HB3 LYS 93 16.104 3.488 -4.024 698 HG2 LYS 93 HG2 LYS 93 15.073 2.707 -1.881 699 HG3 LYS 93 HG3 LYS 93 15.244 1.055 -2.472 700 HD2 LYS 93 HD2 LYS 93 17.706 1.497 -2.708 701 HD3 LYS 93 HD3 LYS 93 17.439 3.035 -1.882 702 HE2 LYS 93 HE2 LYS 93 16.924 0.270 -0.793 703 HE3 LYS 93 HE3 LYS 93 18.176 1.396 -0.275 704 HZ1 LYS 93 HZ1 LYS 93 16.349 1.391 1.269 705 HZ2 LYS 93 HZ2 LYS 93 15.243 1.759 0.043 706 HZ3 LYS 93 HZ3 LYS 93 16.417 2.892 0.493 707 H GLY 94 H GLY 94 12.992 2.807 -2.113 708 HA2 GLY 94 HA2 GLY 94 11.989 4.374 -0.758 709 HA3 GLY 94 HA3 GLY 94 12.956 5.595 -1.573 710 H MET 95 H MET 95 10.694 3.506 -3.255 711 HA MET 95 HA MET 95 8.625 5.537 -3.380 712 HB2 MET 95 HB2 MET 95 10.520 5.992 -5.108 713 HB3 MET 95 HB3 MET 95 9.869 4.602 -5.962 714 HG2 MET 95 HG2 MET 95 7.756 5.688 -6.226 715 HG3 MET 95 HG3 MET 95 8.283 7.041 -5.224 716 HE1 MET 95 HE1 MET 95 7.044 7.816 -7.913 717 HE2 MET 95 HE2 MET 95 8.245 8.916 -8.585 718 HE3 MET 95 HE3 MET 95 7.863 8.973 -6.865 719 H ILE 96 H ILE 96 6.608 4.597 -3.760 720 HA ILE 96 HA ILE 96 6.560 1.825 -4.751 721 HB ILE 96 HB ILE 96 4.862 1.181 -3.094 722 HG12 ILE 96 HG12 ILE 96 5.487 3.830 -1.748 723 HG13 ILE 96 HG13 ILE 96 3.990 3.454 -2.593 724 HG21 ILE 96 HG21 ILE 96 7.435 2.171 -1.859 725 HG22 ILE 96 HG22 ILE 96 7.197 0.630 -2.684 726 HG23 ILE 96 HG23 ILE 96 6.360 0.955 -1.166 727 HD11 ILE 96 HD11 ILE 96 3.722 3.274 -0.192 728 HD12 ILE 96 HD12 ILE 96 5.009 2.071 -0.124 729 HD13 ILE 96 HD13 ILE 96 3.503 1.707 -0.969 730 H PHE 97 H PHE 97 4.893 1.281 -6.035 731 HA PHE 97 HA PHE 97 3.027 3.419 -6.807 732 HB2 PHE 97 HB2 PHE 97 4.381 2.522 -8.622 733 HB3 PHE 97 HB3 PHE 97 3.878 0.881 -8.236 734 HD1 PHE 97 HD2 PHE 97 2.855 4.072 -9.739 735 HD2 PHE 97 HD1 PHE 97 1.708 0.051 -8.908 736 HE1 PHE 97 HE2 PHE 97 0.979 4.277 -11.318 737 HE2 PHE 97 HE1 PHE 97 -0.168 0.253 -10.485 738 HZ PHE 97 HZ PHE 97 -0.534 2.369 -11.694 739 H ILE 98 H ILE 98 0.955 3.288 -6.117 740 HA ILE 98 HA ILE 98 -0.200 0.606 -5.646 741 HB ILE 98 HB ILE 98 -0.930 3.169 -4.200 742 HG12 ILE 98 HG12 ILE 98 0.580 0.705 -3.278 743 HG13 ILE 98 HG13 ILE 98 1.223 2.335 -3.439 744 HG21 ILE 98 HG21 ILE 98 -2.379 1.763 -2.815 745 HG22 ILE 98 HG22 ILE 98 -1.960 0.356 -3.794 746 HG23 ILE 98 HG23 ILE 98 -2.860 1.692 -4.511 747 HD11 ILE 98 HD11 ILE 98 -0.883 1.453 -1.476 748 HD12 ILE 98 HD12 ILE 98 -0.242 3.089 -1.637 749 HD13 ILE 98 HD13 ILE 98 0.813 1.774 -1.119 750 HA PRO 99 HA PRO 99 -2.998 1.687 -8.993 751 HB2 PRO 99 HB2 PRO 99 -4.928 -0.201 -8.309 752 HB3 PRO 99 HB3 PRO 99 -3.530 -0.496 -9.348 753 HG2 PRO 99 HG2 PRO 99 -3.896 -1.101 -6.445 754 HG3 PRO 99 HG3 PRO 99 -3.080 -2.053 -7.699 755 HD2 PRO 99 HD2 PRO 99 -1.695 -0.620 -5.902 756 HD3 PRO 99 HD3 PRO 99 -1.142 -0.776 -7.584 757 H MET 100 H MET 100 -4.789 2.969 -9.208 758 HA MET 100 HA MET 100 -5.603 4.525 -7.021 759 HB2 MET 100 HB2 MET 100 -5.644 5.010 -9.590 760 HB3 MET 100 HB3 MET 100 -7.249 4.302 -9.528 761 HG2 MET 100 HG2 MET 100 -6.273 6.782 -8.129 762 HG3 MET 100 HG3 MET 100 -7.475 6.665 -9.408 763 HE1 MET 100 HE1 MET 100 -7.044 7.359 -5.804 764 HE2 MET 100 HE2 MET 100 -6.669 5.637 -5.686 765 HE3 MET 100 HE3 MET 100 -8.130 6.276 -4.930 766 H GLY 101 H GLY 101 -6.644 3.591 -5.341 767 HA2 GLY 101 HA2 GLY 101 -9.364 2.638 -5.784 768 HA3 GLY 101 HA3 GLY 101 -8.255 1.422 -5.163 769 HA PRO 102 HA PRO 102 -10.277 3.935 -1.665 770 HB2 PRO 102 HB2 PRO 102 -11.042 1.705 -0.220 771 HB3 PRO 102 HB3 PRO 102 -12.082 2.554 -1.367 772 HG2 PRO 102 HG2 PRO 102 -10.473 0.061 -1.757 773 HG3 PRO 102 HG3 PRO 102 -12.110 0.440 -2.323 774 HD2 PRO 102 HD2 PRO 102 -9.974 0.557 -3.963 775 HD3 PRO 102 HD3 PRO 102 -11.335 1.691 -4.120 776 H TYR 103 H TYR 103 -8.226 1.084 -1.752 777 HA TYR 103 HA TYR 103 -6.984 1.323 0.760 778 HB2 TYR 103 HB2 TYR 103 -5.860 0.204 -1.827 779 HB3 TYR 103 HB3 TYR 103 -5.187 -0.067 -0.223 780 HD1 TYR 103 HD2 TYR 103 -8.464 -0.415 -2.001 781 HD2 TYR 103 HD1 TYR 103 -5.740 -2.079 0.820 782 HE1 TYR 103 HE2 TYR 103 -9.937 -2.356 -1.734 783 HE2 TYR 103 HE1 TYR 103 -7.209 -4.031 1.085 784 HH TYR 103 HH TYR 103 -9.093 -5.018 0.460 785 H ALA 104 H ALA 104 -5.842 2.394 -2.451 786 HA ALA 104 HA ALA 104 -3.674 3.934 -1.601 787 HB1 ALA 104 HB1 ALA 104 -3.822 5.060 -3.757 788 HB2 ALA 104 HB2 ALA 104 -5.458 4.438 -3.988 789 HB3 ALA 104 HB3 ALA 104 -4.090 3.326 -3.950 790 H ASN 105 H ASN 105 -7.078 4.813 -2.025 791 HA ASN 105 HA ASN 105 -6.971 7.550 -1.599 792 HB2 ASN 105 HB2 ASN 105 -8.990 6.573 -2.389 793 HB3 ASN 105 HB3 ASN 105 -9.099 5.489 -1.009 794 HD21 ASN 105 HD21 ASN 105 -9.925 6.243 0.906 795 HD22 ASN 105 HD22 ASN 105 -10.733 7.760 1.039 796 H MET 106 H MET 106 -6.655 4.976 0.743 797 HA MET 106 HA MET 106 -7.275 6.436 3.094 798 HB2 MET 106 HB2 MET 106 -5.438 4.053 2.743 799 HB3 MET 106 HB3 MET 106 -6.065 4.638 4.280 800 HG2 MET 106 HG2 MET 106 -7.830 3.717 2.032 801 HG3 MET 106 HG3 MET 106 -7.230 2.641 3.289 802 HE1 MET 106 HE1 MET 106 -8.276 2.405 5.626 803 HE2 MET 106 HE2 MET 106 -9.032 3.760 6.465 804 HE3 MET 106 HE3 MET 106 -7.351 3.875 5.938 805 H VAL 107 H VAL 107 -4.523 6.567 1.024 806 HA VAL 107 HA VAL 107 -2.972 8.008 3.082 807 HB VAL 107 HB VAL 107 -0.884 6.948 2.257 808 HG11 VAL 107 HG11 VAL 107 -1.973 6.101 4.270 809 HG12 VAL 107 HG12 VAL 107 -1.196 4.792 3.381 810 HG13 VAL 107 HG13 VAL 107 -2.947 4.999 3.297 811 HG21 VAL 107 HG21 VAL 107 -1.003 4.909 0.898 812 HG22 VAL 107 HG22 VAL 107 -1.648 6.297 0.022 813 HG23 VAL 107 HG23 VAL 107 -2.747 5.116 0.734 814 H ILE 108 H ILE 108 -3.808 7.677 -0.292 815 HA ILE 108 HA ILE 108 -1.836 9.629 -1.152 816 HB ILE 108 HB ILE 108 -2.468 9.180 -3.391 817 HG12 ILE 108 HG12 ILE 108 -4.516 7.382 -3.572 818 HG13 ILE 108 HG13 ILE 108 -5.063 8.358 -2.211 819 HG21 ILE 108 HG21 ILE 108 -1.167 7.396 -2.488 820 HG22 ILE 108 HG22 ILE 108 -2.402 6.687 -3.540 821 HG23 ILE 108 HG23 ILE 108 -2.596 6.634 -1.788 822 HD11 ILE 108 HD11 ILE 108 -5.924 9.132 -4.369 823 HD12 ILE 108 HD12 ILE 108 -4.266 9.440 -4.898 824 HD13 ILE 108 HD13 ILE 108 -4.944 10.345 -3.547 825 H ASP 109 H ASP 109 -2.662 11.405 -2.684 826 HA ASP 109 HA ASP 109 -4.829 12.850 -1.321 827 HB2 ASP 109 HB2 ASP 109 -2.763 14.073 -1.377 828 HB3 ASP 109 HB3 ASP 109 -2.575 13.792 -3.105 829 HA PRO 110 HA PRO 110 -7.384 11.712 -4.846 830 HB2 PRO 110 HB2 PRO 110 -9.624 13.088 -4.101 831 HB3 PRO 110 HB3 PRO 110 -9.143 11.547 -3.381 832 HG2 PRO 110 HG2 PRO 110 -8.698 14.334 -2.360 833 HG3 PRO 110 HG3 PRO 110 -9.251 12.898 -1.474 834 HD2 PRO 110 HD2 PRO 110 -6.698 13.743 -1.345 835 HD3 PRO 110 HD3 PRO 110 -7.109 12.015 -1.318 836 H SER 111 H SER 111 -6.102 14.754 -4.230 837 HA SER 111 HA SER 111 -7.533 16.296 -6.201 838 HB2 SER 111 HB2 SER 111 -4.853 16.863 -4.923 839 HB3 SER 111 HB3 SER 111 -5.902 18.032 -5.726 840 HG SER 111 HG SER 111 -6.048 16.960 -3.176 841 H THR 112 H THR 112 -6.107 13.749 -7.008 842 HA THR 112 HA THR 112 -3.849 14.291 -8.572 843 HB THR 112 HB THR 112 -4.307 12.158 -9.699 844 HG1 THR 112 HG1 THR 112 -6.745 12.059 -8.205 845 HG21 THR 112 HG21 THR 112 -4.826 12.174 -6.718 846 HG22 THR 112 HG22 THR 112 -3.261 12.044 -7.525 847 HG23 THR 112 HG23 THR 112 -4.430 10.728 -7.650 848 H ASP 113 H ASP 113 -3.591 14.512 -10.840 849 HA ASP 113 HA ASP 113 -5.129 16.589 -11.900 850 HB2 ASP 113 HB2 ASP 113 -3.341 14.715 -13.461 851 HB3 ASP 113 HB3 ASP 113 -3.792 16.358 -13.904 852 H GLY 114 H GLY 114 -7.015 16.646 -12.966 853 HA2 GLY 114 HA2 GLY 114 -8.320 14.283 -13.957 854 HA3 GLY 114 HA3 GLY 114 -8.850 15.945 -14.191 855 H THR 115 H THR 115 -6.059 16.537 -15.238 856 HA THR 115 HA THR 115 -6.554 15.776 -18.018 857 HB THR 115 HB THR 115 -4.768 17.402 -18.571 858 HG1 THR 115 HG1 THR 115 -4.718 18.366 -15.935 859 HG21 THR 115 HG21 THR 115 -7.078 18.195 -18.429 860 HG22 THR 115 HG22 THR 115 -5.964 19.437 -17.862 861 HG23 THR 115 HG23 THR 115 -6.885 18.486 -16.699 862 H GLY 116 H GLY 116 -3.450 16.138 -16.280 863 HA2 GLY 116 HA2 GLY 116 -2.439 13.693 -15.996 864 HA3 GLY 116 HA3 GLY 116 -2.389 13.839 -17.746 865 H MET 117 H MET 117 -0.275 13.698 -15.537 866 HA MET 117 HA MET 117 1.324 16.020 -16.437 867 HB2 MET 117 HB2 MET 117 1.249 14.721 -13.704 868 HB3 MET 117 HB3 MET 117 2.479 15.874 -14.198 869 HG2 MET 117 HG2 MET 117 -0.462 16.500 -14.201 870 HG3 MET 117 HG3 MET 117 0.599 16.805 -12.828 871 HE1 MET 117 HE1 MET 117 3.312 17.676 -14.326 872 HE2 MET 117 HE2 MET 117 2.655 18.459 -12.889 873 HE3 MET 117 HE3 MET 117 3.106 19.428 -14.292 874 HA PRO 118 HA PRO 118 4.472 12.995 -17.537 875 HB2 PRO 118 HB2 PRO 118 6.494 15.092 -17.238 876 HB3 PRO 118 HB3 PRO 118 5.920 14.303 -18.710 877 HG2 PRO 118 HG2 PRO 118 5.386 16.902 -18.125 878 HG3 PRO 118 HG3 PRO 118 4.295 15.884 -19.081 879 HD2 PRO 118 HD2 PRO 118 4.119 16.651 -16.183 880 HD3 PRO 118 HD3 PRO 118 2.831 16.551 -17.404 881 H GLN 119 H GLN 119 6.525 12.096 -16.671 882 HA GLN 119 HA GLN 119 7.809 11.226 -15.005 883 HB2 GLN 119 HB2 GLN 119 7.176 13.830 -13.584 884 HB3 GLN 119 HB3 GLN 119 8.396 12.670 -13.073 885 HG2 GLN 119 HG2 GLN 119 9.675 13.070 -15.086 886 HG3 GLN 119 HG3 GLN 119 8.418 14.140 -15.708 887 HE21 GLN 119 HE21 GLN 119 10.974 13.787 -13.376 888 HE22 GLN 119 HE22 GLN 119 11.082 15.456 -12.948 889 H PHE 120 H PHE 120 7.600 11.273 -12.227 890 HA PHE 120 HA PHE 120 4.912 10.121 -11.786 891 HB2 PHE 120 HB2 PHE 120 7.561 9.340 -10.531 892 HB3 PHE 120 HB3 PHE 120 5.998 8.673 -10.071 893 HD1 PHE 120 HD2 PHE 120 8.587 8.765 -12.675 894 HD2 PHE 120 HD1 PHE 120 4.860 7.076 -11.483 895 HE1 PHE 120 HE2 PHE 120 8.811 7.045 -14.419 896 HE2 PHE 120 HE1 PHE 120 5.083 5.352 -13.223 897 HZ PHE 120 HZ PHE 120 7.057 5.337 -14.696 898 H LYS 121 H LYS 121 3.670 11.188 -10.365 899 HA LYS 121 HA LYS 121 4.979 12.605 -8.128 900 HB2 LYS 121 HB2 LYS 121 2.500 13.467 -9.627 901 HB3 LYS 121 HB3 LYS 121 3.056 14.192 -8.126 902 HG2 LYS 121 HG2 LYS 121 5.276 14.563 -9.466 903 HG3 LYS 121 HG3 LYS 121 4.222 14.388 -10.871 904 HD2 LYS 121 HD2 LYS 121 3.915 16.379 -8.618 905 HD3 LYS 121 HD3 LYS 121 4.423 16.739 -10.269 906 HE2 LYS 121 HE2 LYS 121 2.256 16.192 -11.129 907 HE3 LYS 121 HE3 LYS 121 1.739 15.533 -9.579 908 HZ1 LYS 121 HZ1 LYS 121 2.321 18.383 -10.174 909 HZ2 LYS 121 HZ2 LYS 121 1.962 17.783 -8.641 910 HZ3 LYS 121 HZ3 LYS 121 0.803 17.702 -9.869 911 H GLY 122 H GLY 122 4.667 11.321 -6.415 912 HA2 GLY 122 HA2 GLY 122 1.886 10.496 -5.806 913 HA3 GLY 122 HA3 GLY 122 3.271 9.480 -5.443 914 H VAL 123 H VAL 123 1.524 10.088 -3.451 915 HA VAL 123 HA VAL 123 2.449 12.377 -1.926 916 HB VAL 123 HB VAL 123 0.633 10.099 -1.109 917 HG11 VAL 123 HG11 VAL 123 -0.087 11.583 0.720 918 HG12 VAL 123 HG12 VAL 123 1.141 12.757 0.243 919 HG13 VAL 123 HG13 VAL 123 1.624 11.170 0.844 920 HG21 VAL 123 HG21 VAL 123 -0.300 11.369 -2.959 921 HG22 VAL 123 HG22 VAL 123 -0.007 12.882 -2.102 922 HG23 VAL 123 HG23 VAL 123 -1.188 11.729 -1.479 923 H LYS 124 H LYS 124 4.130 12.419 -0.527 924 HA LYS 124 HA LYS 124 5.829 10.211 -0.069 925 HB2 LYS 124 HB2 LYS 124 5.614 12.968 1.057 926 HB3 LYS 124 HB3 LYS 124 6.586 11.805 1.943 927 HG2 LYS 124 HG2 LYS 124 8.010 13.078 0.500 928 HG3 LYS 124 HG3 LYS 124 7.930 11.421 -0.094 929 HD2 LYS 124 HD2 LYS 124 6.434 12.059 -1.861 930 HD3 LYS 124 HD3 LYS 124 6.266 13.687 -1.197 931 HE2 LYS 124 HE2 LYS 124 8.682 14.061 -1.597 932 HE3 LYS 124 HE3 LYS 124 8.786 12.462 -2.334 933 HZ1 LYS 124 HZ1 LYS 124 7.040 14.652 -3.318 934 HZ2 LYS 124 HZ2 LYS 124 7.304 13.155 -4.065 935 HZ3 LYS 124 HZ3 LYS 124 8.560 14.282 -3.958 936 H GLY 125 H GLY 125 6.162 8.873 1.707 937 HA2 GLY 125 HA2 GLY 125 4.817 9.125 4.199 938 HA3 GLY 125 HA3 GLY 125 3.989 7.952 3.185 939 H THR 126 H THR 126 4.588 6.492 4.999 940 HA THR 126 HA THR 126 7.273 5.323 4.539 941 HB THR 126 HB THR 126 7.223 4.475 6.896 942 HG1 THR 126 HG1 THR 126 5.046 4.594 7.377 943 HG21 THR 126 HG21 THR 126 7.801 6.610 7.977 944 HG22 THR 126 HG22 THR 126 7.060 7.497 6.646 945 HG23 THR 126 HG23 THR 126 8.497 6.515 6.359 946 H VAL 127 H VAL 127 7.381 3.115 4.294 947 HA VAL 127 HA VAL 127 4.921 1.558 4.774 948 HB VAL 127 HB VAL 127 5.142 1.965 2.337 949 HG11 VAL 127 HG11 VAL 127 7.725 0.410 2.555 950 HG12 VAL 127 HG12 VAL 127 7.589 2.137 2.225 951 HG13 VAL 127 HG13 VAL 127 6.964 0.968 1.063 952 HG21 VAL 127 HG21 VAL 127 4.052 -0.077 3.131 953 HG22 VAL 127 HG22 VAL 127 5.608 -0.910 3.152 954 HG23 VAL 127 HG23 VAL 127 4.916 -0.373 1.620 955 H GLU 128 H GLU 128 5.217 -0.454 5.659 956 HA GLU 128 HA GLU 128 7.749 -1.808 5.570 957 HB2 GLU 128 HB2 GLU 128 8.269 -1.774 7.916 958 HB3 GLU 128 HB3 GLU 128 8.117 -0.121 7.358 959 HG2 GLU 128 HG2 GLU 128 6.305 -1.672 9.168 960 HG3 GLU 128 HG3 GLU 128 7.100 -0.126 9.434 961 H LYS 129 H LYS 129 7.635 -3.903 6.940 962 HA LYS 129 HA LYS 129 5.224 -5.272 6.257 963 HB2 LYS 129 HB2 LYS 129 7.418 -6.402 6.311 964 HB3 LYS 129 HB3 LYS 129 7.489 -6.179 8.054 965 HG2 LYS 129 HG2 LYS 129 5.424 -7.559 8.257 966 HG3 LYS 129 HG3 LYS 129 5.514 -7.866 6.522 967 HD2 LYS 129 HD2 LYS 129 7.695 -8.542 8.490 968 HD3 LYS 129 HD3 LYS 129 6.471 -9.679 7.932 969 HE2 LYS 129 HE2 LYS 129 8.430 -8.243 6.138 970 HE3 LYS 129 HE3 LYS 129 8.638 -9.887 6.739 971 HZ1 LYS 129 HZ1 LYS 129 6.500 -10.437 5.646 972 HZ2 LYS 129 HZ2 LYS 129 7.724 -10.008 4.569 973 HZ3 LYS 129 HZ3 LYS 129 6.495 -8.903 4.935 974 H THR 130 H THR 130 3.533 -6.004 7.568 975 HA THR 130 HA THR 130 3.514 -5.033 10.357 976 HB THR 130 HB THR 130 2.261 -3.391 9.026 977 HG1 THR 130 HG1 THR 130 1.472 -3.617 11.074 978 HG21 THR 130 HG21 THR 130 0.439 -5.702 8.321 979 HG22 THR 130 HG22 THR 130 1.495 -4.838 7.202 980 HG23 THR 130 HG23 THR 130 0.137 -4.000 7.959 981 H ASP 131 H ASP 131 1.855 -5.996 11.708 982 HA ASP 131 HA ASP 131 1.631 -8.847 11.262 983 HB2 ASP 131 HB2 ASP 131 0.576 -7.182 13.564 984 HB3 ASP 131 HB3 ASP 131 0.843 -8.924 13.549 985 H GLU 132 H GLU 132 -0.321 -6.080 10.763 986 HA GLU 132 HA GLU 132 -2.897 -7.247 11.061 987 HB2 GLU 132 HB2 GLU 132 -1.881 -4.766 9.704 988 HB3 GLU 132 HB3 GLU 132 -3.555 -5.262 9.509 989 HG2 GLU 132 HG2 GLU 132 -2.206 -4.707 12.143 990 HG3 GLU 132 HG3 GLU 132 -3.246 -3.583 11.272 991 H LYS 133 H LYS 133 -4.375 -7.889 9.512 992 HA LYS 133 HA LYS 133 -3.356 -9.151 7.128 993 HB2 LYS 133 HB2 LYS 133 -5.574 -9.996 6.807 994 HB3 LYS 133 HB3 LYS 133 -5.241 -10.087 8.528 995 HG2 LYS 133 HG2 LYS 133 -6.842 -7.887 7.213 996 HG3 LYS 133 HG3 LYS 133 -7.539 -9.315 7.979 997 HD2 LYS 133 HD2 LYS 133 -6.629 -8.660 10.127 998 HD3 LYS 133 HD3 LYS 133 -5.775 -7.304 9.391 999 HE2 LYS 133 HE2 LYS 133 -7.918 -6.276 8.793 1000 HE3 LYS 133 HE3 LYS 133 -8.777 -7.638 9.516 1001 HZ1 LYS 133 HZ1 LYS 133 -6.965 -5.792 10.981 1002 HZ2 LYS 133 HZ2 LYS 133 -7.851 -7.066 11.656 1003 HZ3 LYS 133 HZ3 LYS 133 -8.657 -5.727 11.011 1004 H VAL 134 H VAL 134 -4.216 -8.699 4.949 1005 HA VAL 134 HA VAL 134 -4.287 -5.943 4.277 1006 HB VAL 134 HB VAL 134 -5.153 -8.343 2.641 1007 HG11 VAL 134 HG11 VAL 134 -4.616 -5.496 1.759 1008 HG12 VAL 134 HG12 VAL 134 -6.178 -6.317 1.753 1009 HG13 VAL 134 HG13 VAL 134 -4.891 -6.866 0.680 1010 HG21 VAL 134 HG21 VAL 134 -2.803 -8.404 3.314 1011 HG22 VAL 134 HG22 VAL 134 -2.566 -6.781 2.664 1012 HG23 VAL 134 HG23 VAL 134 -2.956 -8.116 1.581 1013 H LEU 135 H LEU 135 -5.936 -4.529 4.249 1014 HA LEU 135 HA LEU 135 -8.349 -5.080 5.536 1015 HB2 LEU 135 HB2 LEU 135 -7.234 -2.800 4.033 1016 HB3 LEU 135 HB3 LEU 135 -8.986 -2.860 4.063 1017 HG LEU 135 HG LEU 135 -7.185 -2.808 6.494 1018 HD11 LEU 135 HD11 LEU 135 -8.120 -0.582 6.870 1019 HD12 LEU 135 HD12 LEU 135 -9.017 -0.696 5.356 1020 HD13 LEU 135 HD13 LEU 135 -7.252 -0.663 5.336 1021 HD21 LEU 135 HD21 LEU 135 -10.201 -2.819 6.272 1022 HD22 LEU 135 HD22 LEU 135 -9.283 -2.549 7.760 1023 HD23 LEU 135 HD23 LEU 135 -9.189 -4.104 6.934 1024 H SER 136 H SER 136 -10.255 -5.885 4.934 1025 HA SER 136 HA SER 136 -10.732 -6.820 2.268 1026 HB2 SER 136 HB2 SER 136 -12.787 -6.460 4.474 1027 HB3 SER 136 HB3 SER 136 -12.883 -7.550 3.093 1028 HG SER 136 HG SER 136 -11.339 -7.750 5.436 1029 H VAL 137 H VAL 137 -12.060 -5.922 0.662 1030 HA VAL 137 HA VAL 137 -11.998 -3.222 0.248 1031 HB VAL 137 HB VAL 137 -14.078 -5.147 -0.825 1032 HG11 VAL 137 HG11 VAL 137 -14.796 -2.824 -1.128 1033 HG12 VAL 137 HG12 VAL 137 -14.349 -3.551 -2.671 1034 HG13 VAL 137 HG13 VAL 137 -13.244 -2.434 -1.872 1035 HG21 VAL 137 HG21 VAL 137 -11.766 -5.823 -1.287 1036 HG22 VAL 137 HG22 VAL 137 -11.434 -4.234 -1.978 1037 HG23 VAL 137 HG23 VAL 137 -12.586 -5.316 -2.764 1038 H LYS 138 H LYS 138 -14.817 -4.998 1.532 1039 HA LYS 138 HA LYS 138 -16.403 -2.653 1.961 1040 HB2 LYS 138 HB2 LYS 138 -17.402 -4.883 1.657 1041 HB3 LYS 138 HB3 LYS 138 -16.653 -5.432 3.151 1042 HG2 LYS 138 HG2 LYS 138 -17.983 -3.692 4.367 1043 HG3 LYS 138 HG3 LYS 138 -18.826 -3.361 2.852 1044 HD2 LYS 138 HD2 LYS 138 -18.756 -6.009 4.316 1045 HD3 LYS 138 HD3 LYS 138 -20.117 -4.889 4.258 1046 HE2 LYS 138 HE2 LYS 138 -20.346 -5.222 1.873 1047 HE3 LYS 138 HE3 LYS 138 -18.903 -6.235 1.842 1048 HZ1 LYS 138 HZ1 LYS 138 -20.053 -7.814 3.289 1049 HZ2 LYS 138 HZ2 LYS 138 -20.877 -7.590 1.832 1050 HZ3 LYS 138 HZ3 LYS 138 -21.447 -6.856 3.245 1051 H GLU 139 H GLU 139 -14.383 -4.667 4.065 1052 HA GLU 139 HA GLU 139 -14.911 -3.507 6.543 1053 HB2 GLU 139 HB2 GLU 139 -13.667 -5.575 6.273 1054 HB3 GLU 139 HB3 GLU 139 -12.389 -4.741 5.408 1055 HG2 GLU 139 HG2 GLU 139 -11.731 -3.578 7.422 1056 HG3 GLU 139 HG3 GLU 139 -13.079 -4.303 8.309 1057 H LEU 140 H LEU 140 -12.747 -2.524 3.966 1058 HA LEU 140 HA LEU 140 -11.479 -0.352 5.218 1059 HB2 LEU 140 HB2 LEU 140 -11.064 -1.645 2.966 1060 HB3 LEU 140 HB3 LEU 140 -12.104 -0.407 2.289 1061 HG LEU 140 HG LEU 140 -9.704 0.340 3.921 1062 HD11 LEU 140 HD11 LEU 140 -9.730 -0.255 0.967 1063 HD12 LEU 140 HD12 LEU 140 -8.922 -1.204 2.216 1064 HD13 LEU 140 HD13 LEU 140 -8.384 0.440 1.877 1065 HD21 LEU 140 HD21 LEU 140 -11.194 1.718 1.682 1066 HD22 LEU 140 HD22 LEU 140 -9.786 2.362 2.530 1067 HD23 LEU 140 HD23 LEU 140 -11.300 2.110 3.400 1068 H LEU 141 H LEU 141 -14.460 -0.580 3.270 1069 HA LEU 141 HA LEU 141 -15.143 2.147 3.197 1070 HB2 LEU 141 HB2 LEU 141 -17.127 -0.127 3.393 1071 HB3 LEU 141 HB3 LEU 141 -17.378 1.448 2.661 1072 HG LEU 141 HG LEU 141 -15.644 -0.791 1.606 1073 HD11 LEU 141 HD11 LEU 141 -18.155 0.476 0.518 1074 HD12 LEU 141 HD12 LEU 141 -18.018 -1.130 1.239 1075 HD13 LEU 141 HD13 LEU 141 -17.197 -0.772 -0.281 1076 HD21 LEU 141 HD21 LEU 141 -14.546 1.338 1.181 1077 HD22 LEU 141 HD22 LEU 141 -16.030 1.977 0.472 1078 HD23 LEU 141 HD23 LEU 141 -15.180 0.645 -0.310 1079 H GLU 142 H GLU 142 -15.724 -0.341 5.618 1080 HA GLU 142 HA GLU 142 -17.322 1.289 7.349 1081 HB2 GLU 142 HB2 GLU 142 -15.746 -1.216 8.009 1082 HB3 GLU 142 HB3 GLU 142 -17.061 -0.529 8.954 1083 HG2 GLU 142 HG2 GLU 142 -18.610 -0.963 7.100 1084 HG3 GLU 142 HG3 GLU 142 -17.289 -1.672 6.173 1085 H ALA 143 H ALA 143 -13.895 0.464 7.161 1086 HA ALA 143 HA ALA 143 -13.026 1.515 9.606 1087 HB1 ALA 143 HB1 ALA 143 -11.684 0.029 8.168 1088 HB2 ALA 143 HB2 ALA 143 -10.796 1.471 8.660 1089 HB3 ALA 143 HB3 ALA 143 -11.458 1.357 7.028 1090 H ILE 144 H ILE 144 -13.512 3.137 6.490 1091 HA ILE 144 HA ILE 144 -12.238 5.571 7.324 1092 HB ILE 144 HB ILE 144 -13.158 6.555 5.238 1093 HG12 ILE 144 HG12 ILE 144 -14.064 4.705 3.601 1094 HG13 ILE 144 HG13 ILE 144 -14.539 3.886 5.081 1095 HG21 ILE 144 HG21 ILE 144 -11.806 5.160 3.722 1096 HG22 ILE 144 HG22 ILE 144 -11.724 3.918 4.973 1097 HG23 ILE 144 HG23 ILE 144 -10.990 5.498 5.249 1098 HD11 ILE 144 HD11 ILE 144 -16.366 5.170 4.094 1099 HD12 ILE 144 HD12 ILE 144 -15.416 6.647 4.254 1100 HD13 ILE 144 HD13 ILE 144 -15.939 5.771 5.694 1101 H GLY 145 H GLY 145 -15.102 4.291 8.280 1102 HA2 GLY 145 HA2 GLY 145 -16.258 5.634 9.998 1103 HA3 GLY 145 HA3 GLY 145 -16.220 6.977 8.870 1104 H SER 146 H SER 146 -17.256 6.261 6.626 1105 HA SER 146 HA SER 146 -19.134 5.744 5.452 1106 HB2 SER 146 HB2 SER 146 -18.585 3.422 5.908 1107 HB3 SER 146 HB3 SER 146 -19.354 3.511 7.490 1108 HG SER 146 HG SER 146 -20.732 2.548 5.969 Start of MODEL 9 1 H1 MET 1 H1 MET 1 70.131 -16.744 12.325 2 H2 MET 1 H2 MET 1 71.560 -17.581 11.991 3 H3 MET 1 H3 MET 1 71.406 -16.714 13.434 4 HA MET 1 HA MET 1 69.828 -19.101 12.673 5 HB2 MET 1 HB2 MET 1 72.069 -18.731 14.675 6 HB3 MET 1 HB3 MET 1 71.052 -20.161 14.600 7 HG2 MET 1 HG2 MET 1 73.205 -20.498 13.494 8 HG3 MET 1 HG3 MET 1 71.853 -20.654 12.369 9 HE1 MET 1 HE1 MET 1 74.676 -19.125 10.121 10 HE2 MET 1 HE2 MET 1 73.584 -20.487 10.370 11 HE3 MET 1 HE3 MET 1 74.945 -20.237 11.462 12 H GLY 2 H GLY 2 68.251 -19.770 14.158 13 HA2 GLY 2 HA2 GLY 2 67.087 -19.664 16.225 14 HA3 GLY 2 HA3 GLY 2 67.795 -18.087 16.526 15 H SER 3 H SER 3 65.036 -18.815 16.786 16 HA SER 3 HA SER 3 63.869 -16.700 15.157 17 HB2 SER 3 HB2 SER 3 62.007 -18.073 14.342 18 HB3 SER 3 HB3 SER 3 63.539 -18.732 13.771 19 HG SER 3 HG SER 3 63.382 -20.172 15.672 20 H SER 4 H SER 4 61.222 -16.897 15.808 21 HA SER 4 HA SER 4 61.086 -17.277 18.716 22 HB2 SER 4 HB2 SER 4 61.797 -14.935 18.400 23 HB3 SER 4 HB3 SER 4 60.391 -14.644 17.381 24 HG SER 4 HG SER 4 60.262 -14.044 19.699 25 H HIS 5 H HIS 5 58.928 -17.191 19.599 26 HA HIS 5 HA HIS 5 56.665 -17.081 17.794 27 HB2 HIS 5 HB2 HIS 5 55.772 -19.309 18.539 28 HB3 HIS 5 HB3 HIS 5 57.192 -19.407 17.510 29 HD1 HIS 5 HD1 HIS 5 59.309 -20.414 18.494 30 HD2 HIS 5 HD2 HIS 5 56.193 -20.143 21.232 31 HE1 HIS 5 HE1 HIS 5 60.035 -21.766 20.475 32 HE2 HIS 5 HE2 HIS 5 58.044 -21.776 22.008 33 H HIS 6 H HIS 6 54.977 -16.140 18.784 34 HA HIS 6 HA HIS 6 54.383 -16.387 21.556 35 HB2 HIS 6 HB2 HIS 6 54.830 -13.878 22.034 36 HB3 HIS 6 HB3 HIS 6 56.184 -14.997 22.088 37 HD1 HIS 6 HD1 HIS 6 57.973 -13.288 21.522 38 HD2 HIS 6 HD2 HIS 6 54.950 -13.458 18.675 39 HE1 HIS 6 HE1 HIS 6 58.798 -11.933 19.578 40 HE2 HIS 6 HE2 HIS 6 57.004 -12.140 17.830 41 H HIS 7 H HIS 7 52.255 -16.106 21.745 42 HA HIS 7 HA HIS 7 50.925 -13.899 20.405 43 HB2 HIS 7 HB2 HIS 7 50.363 -16.769 19.694 44 HB3 HIS 7 HB3 HIS 7 49.087 -15.561 19.584 45 HD1 HIS 7 HD1 HIS 7 51.810 -17.001 17.680 46 HD2 HIS 7 HD2 HIS 7 49.839 -13.340 17.775 47 HE1 HIS 7 HE1 HIS 7 52.339 -15.894 15.491 48 HE2 HIS 7 HE2 HIS 7 51.198 -13.654 15.593 49 H HIS 8 H HIS 8 50.083 -12.965 22.153 50 HA HIS 8 HA HIS 8 48.118 -14.526 23.703 51 HB2 HIS 8 HB2 HIS 8 50.127 -12.523 24.721 52 HB3 HIS 8 HB3 HIS 8 48.638 -12.841 25.602 53 HD1 HIS 8 HD1 HIS 8 48.796 -14.634 27.289 54 HD2 HIS 8 HD2 HIS 8 51.678 -15.055 24.326 55 HE1 HIS 8 HE1 HIS 8 50.178 -16.613 27.969 56 HE2 HIS 8 HE2 HIS 8 51.812 -16.939 26.090 57 H HIS 9 H HIS 9 46.312 -13.880 22.642 58 HA HIS 9 HA HIS 9 45.627 -11.011 22.794 59 HB2 HIS 9 HB2 HIS 9 46.236 -11.488 20.476 60 HB3 HIS 9 HB3 HIS 9 45.138 -12.862 20.439 61 HD1 HIS 9 HD1 HIS 9 42.951 -12.380 19.402 62 HD2 HIS 9 HD2 HIS 9 44.707 -8.945 20.946 63 HE1 HIS 9 HE1 HIS 9 41.401 -10.506 18.797 64 HE2 HIS 9 HE2 HIS 9 42.589 -8.427 19.558 65 H HIS 10 H HIS 10 43.770 -10.683 23.873 66 HA HIS 10 HA HIS 10 41.571 -12.569 23.720 67 HB2 HIS 10 HB2 HIS 10 41.453 -12.867 26.210 68 HB3 HIS 10 HB3 HIS 10 42.838 -13.652 25.457 69 HD1 HIS 10 HD1 HIS 10 45.169 -12.778 26.058 70 HD2 HIS 10 HD2 HIS 10 42.094 -10.674 27.893 71 HE1 HIS 10 HE1 HIS 10 46.280 -11.327 27.771 72 HE2 HIS 10 HE2 HIS 10 44.420 -9.963 28.770 73 H SER 11 H SER 11 39.662 -11.544 23.856 74 HA SER 11 HA SER 11 39.431 -9.047 25.389 75 HB2 SER 11 HB2 SER 11 39.924 -8.327 23.087 76 HB3 SER 11 HB3 SER 11 38.582 -9.299 22.485 77 HG SER 11 HG SER 11 38.425 -6.840 23.147 78 H SER 12 H SER 12 37.641 -9.105 26.632 79 HA SER 12 HA SER 12 35.574 -11.116 25.957 80 HB2 SER 12 HB2 SER 12 35.112 -11.254 28.377 81 HB3 SER 12 HB3 SER 12 36.797 -11.637 28.017 82 HG SER 12 HG SER 12 35.900 -9.846 29.708 83 H GLY 13 H GLY 13 33.370 -10.687 26.630 84 HA2 GLY 13 HA2 GLY 13 32.403 -8.190 27.495 85 HA3 GLY 13 HA3 GLY 13 32.378 -8.210 25.735 86 H ARG 14 H ARG 14 30.155 -8.217 27.799 87 HA ARG 14 HA ARG 14 28.664 -10.487 26.677 88 HB2 ARG 14 HB2 ARG 14 29.616 -11.251 28.821 89 HB3 ARG 14 HB3 ARG 14 28.827 -9.911 29.644 90 HG2 ARG 14 HG2 ARG 14 27.542 -11.902 30.001 91 HG3 ARG 14 HG3 ARG 14 26.629 -10.834 28.935 92 HD2 ARG 14 HD2 ARG 14 27.415 -12.144 26.991 93 HD3 ARG 14 HD3 ARG 14 28.266 -13.231 28.090 94 HE ARG 14 HE ARG 14 25.362 -12.998 27.757 95 HH11 ARG 14 HH11 ARG 14 28.056 -14.569 29.246 96 HH12 ARG 14 HH12 ARG 14 27.113 -15.933 29.732 97 HH21 ARG 14 HH21 ARG 14 24.189 -14.759 28.373 98 HH22 ARG 14 HH22 ARG 14 24.954 -16.035 29.259 99 H GLU 15 H GLU 15 27.278 -9.156 25.516 100 HA GLU 15 HA GLU 15 25.026 -8.230 27.048 101 HB2 GLU 15 HB2 GLU 15 26.957 -6.280 26.289 102 HB3 GLU 15 HB3 GLU 15 25.552 -6.031 25.265 103 HG2 GLU 15 HG2 GLU 15 25.554 -6.110 28.280 104 HG3 GLU 15 HG3 GLU 15 25.454 -4.664 27.280 105 H ASN 16 H ASN 16 23.140 -7.765 25.735 106 HA ASN 16 HA ASN 16 23.326 -8.693 22.947 107 HB2 ASN 16 HB2 ASN 16 21.308 -10.122 23.311 108 HB3 ASN 16 HB3 ASN 16 22.734 -10.668 24.187 109 HD21 ASN 16 HD21 ASN 16 22.787 -10.477 26.432 110 HD22 ASN 16 HD22 ASN 16 21.356 -10.199 27.358 111 H LEU 17 H LEU 17 22.407 -7.252 21.645 112 HA LEU 17 HA LEU 17 19.949 -5.872 22.523 113 HB2 LEU 17 HB2 LEU 17 22.258 -4.691 20.989 114 HB3 LEU 17 HB3 LEU 17 20.681 -3.933 21.103 115 HG LEU 17 HG LEU 17 21.049 -4.096 23.678 116 HD11 LEU 17 HD11 LEU 17 23.017 -5.504 23.634 117 HD12 LEU 17 HD12 LEU 17 23.391 -3.942 24.361 118 HD13 LEU 17 HD13 LEU 17 23.897 -4.289 22.706 119 HD21 LEU 17 HD21 LEU 17 22.592 -2.154 21.970 120 HD22 LEU 17 HD22 LEU 17 22.158 -1.921 23.664 121 HD23 LEU 17 HD23 LEU 17 20.897 -2.026 22.437 122 H TYR 18 H TYR 18 18.885 -4.801 20.410 123 HA TYR 18 HA TYR 18 19.185 -6.317 17.987 124 HB2 TYR 18 HB2 TYR 18 16.911 -7.318 18.008 125 HB3 TYR 18 HB3 TYR 18 17.947 -7.975 19.270 126 HD1 TYR 18 HD2 TYR 18 17.539 -7.415 21.636 127 HD2 TYR 18 HD1 TYR 18 14.942 -6.002 18.569 128 HE1 TYR 18 HE2 TYR 18 15.853 -6.848 23.333 129 HE2 TYR 18 HE1 TYR 18 13.250 -5.432 20.260 130 HH TYR 18 HH TYR 18 13.928 -5.289 23.565 131 H PHE 19 H PHE 19 17.191 -5.820 16.480 132 HA PHE 19 HA PHE 19 16.619 -2.930 16.703 133 HB2 PHE 19 HB2 PHE 19 16.565 -4.740 14.266 134 HB3 PHE 19 HB3 PHE 19 16.234 -3.008 14.262 135 HD1 PHE 19 HD1 PHE 19 18.072 -1.416 14.899 136 HD2 PHE 19 HD2 PHE 19 18.775 -5.554 14.165 137 HE1 PHE 19 HE1 PHE 19 20.469 -0.955 14.610 138 HE2 PHE 19 HE2 PHE 19 21.172 -5.098 13.869 139 HZ PHE 19 HZ PHE 19 22.026 -2.796 14.095 140 H GLN 20 H GLN 20 14.606 -2.385 17.283 141 HA GLN 20 HA GLN 20 12.529 -4.425 17.372 142 HB2 GLN 20 HB2 GLN 20 13.010 -3.060 19.358 143 HB3 GLN 20 HB3 GLN 20 12.577 -1.607 18.467 144 HG2 GLN 20 HG2 GLN 20 10.281 -2.401 18.261 145 HG3 GLN 20 HG3 GLN 20 10.710 -3.885 19.114 146 HE21 GLN 20 HE21 GLN 20 9.247 -3.489 20.771 147 HE22 GLN 20 HE22 GLN 20 9.500 -2.259 21.955 148 H GLY 21 H GLY 21 13.019 -1.238 15.875 149 HA2 GLY 21 HA2 GLY 21 10.925 -1.900 13.930 150 HA3 GLY 21 HA3 GLY 21 10.692 -0.448 14.888 151 H HIS 22 H HIS 22 11.501 -1.333 11.927 152 HA HIS 22 HA HIS 22 13.045 1.112 11.494 153 HB2 HIS 22 HB2 HIS 22 14.794 -0.557 11.648 154 HB3 HIS 22 HB3 HIS 22 13.956 -1.602 10.507 155 HD1 HIS 22 HD1 HIS 22 15.310 1.969 10.454 156 HD2 HIS 22 HD2 HIS 22 15.006 -1.387 8.021 157 HE1 HIS 22 HE1 HIS 22 16.487 2.573 8.323 158 HE2 HIS 22 HE2 HIS 22 16.438 0.476 6.947 159 H MET 23 H MET 23 11.115 1.931 10.577 160 HA MET 23 HA MET 23 9.997 0.695 8.214 161 HB2 MET 23 HB2 MET 23 8.499 2.622 8.212 162 HB3 MET 23 HB3 MET 23 8.595 1.914 9.819 163 HG2 MET 23 HG2 MET 23 10.313 3.694 10.362 164 HG3 MET 23 HG3 MET 23 9.856 4.461 8.841 165 HE1 MET 23 HE1 MET 23 7.108 4.841 8.334 166 HE2 MET 23 HE2 MET 23 5.909 4.752 9.625 167 HE3 MET 23 HE3 MET 23 6.737 3.289 9.084 168 H LEU 24 H LEU 24 9.814 1.883 6.149 169 HA LEU 24 HA LEU 24 12.267 3.436 5.549 170 HB2 LEU 24 HB2 LEU 24 10.783 1.354 3.972 171 HB3 LEU 24 HB3 LEU 24 11.792 2.532 3.153 172 HG LEU 24 HG LEU 24 12.905 0.849 5.383 173 HD11 LEU 24 HD11 LEU 24 13.680 -0.772 3.748 174 HD12 LEU 24 HD12 LEU 24 12.839 0.094 2.461 175 HD13 LEU 24 HD13 LEU 24 11.918 -0.694 3.742 176 HD21 LEU 24 HD21 LEU 24 14.152 2.206 2.984 177 HD22 LEU 24 HD22 LEU 24 15.018 1.277 4.213 178 HD23 LEU 24 HD23 LEU 24 14.209 2.781 4.655 179 H GLU 25 H GLU 25 12.146 5.213 4.209 180 HA GLU 25 HA GLU 25 9.498 6.425 3.933 181 HB2 GLU 25 HB2 GLU 25 12.299 7.498 3.831 182 HB3 GLU 25 HB3 GLU 25 10.971 8.438 3.154 183 HG2 GLU 25 HG2 GLU 25 9.891 8.612 5.233 184 HG3 GLU 25 HG3 GLU 25 10.892 7.357 5.946 185 H VAL 26 H VAL 26 8.451 6.599 2.118 186 HA VAL 26 HA VAL 26 9.794 6.165 -0.463 187 HB VAL 26 HB VAL 26 8.115 4.477 -1.152 188 HG11 VAL 26 HG11 VAL 26 10.301 3.720 -0.364 189 HG12 VAL 26 HG12 VAL 26 9.039 2.574 0.080 190 HG13 VAL 26 HG13 VAL 26 9.698 3.670 1.293 191 HG21 VAL 26 HG21 VAL 26 6.728 3.357 0.538 192 HG22 VAL 26 HG22 VAL 26 6.322 5.069 0.399 193 HG23 VAL 26 HG23 VAL 26 7.293 4.500 1.759 194 H GLU 27 H GLU 27 8.451 6.734 -2.335 195 HA GLU 27 HA GLU 27 6.300 8.615 -1.653 196 HB2 GLU 27 HB2 GLU 27 8.086 9.382 -3.198 197 HB3 GLU 27 HB3 GLU 27 7.614 8.129 -4.341 198 HG2 GLU 27 HG2 GLU 27 5.410 9.151 -4.576 199 HG3 GLU 27 HG3 GLU 27 5.844 10.385 -3.396 200 H VAL 28 H VAL 28 4.283 7.950 -1.696 201 HA VAL 28 HA VAL 28 3.565 5.384 -2.859 202 HB VAL 28 HB VAL 28 1.886 7.294 -1.211 203 HG11 VAL 28 HG11 VAL 28 0.522 5.748 -2.493 204 HG12 VAL 28 HG12 VAL 28 0.478 5.321 -0.782 205 HG13 VAL 28 HG13 VAL 28 1.468 4.381 -1.900 206 HG21 VAL 28 HG21 VAL 28 2.397 5.839 0.696 207 HG22 VAL 28 HG22 VAL 28 3.860 6.569 0.032 208 HG23 VAL 28 HG23 VAL 28 3.479 4.884 -0.322 209 H ILE 29 H ILE 29 3.064 5.433 -4.983 210 HA ILE 29 HA ILE 29 1.760 7.782 -6.137 211 HB ILE 29 HB ILE 29 2.607 5.293 -7.622 212 HG12 ILE 29 HG12 ILE 29 4.293 7.750 -7.037 213 HG13 ILE 29 HG13 ILE 29 4.518 6.169 -6.295 214 HG21 ILE 29 HG21 ILE 29 1.180 6.771 -8.884 215 HG22 ILE 29 HG22 ILE 29 2.825 6.923 -9.502 216 HG23 ILE 29 HG23 ILE 29 2.160 8.169 -8.438 217 HD11 ILE 29 HD11 ILE 29 6.111 6.507 -8.057 218 HD12 ILE 29 HD12 ILE 29 4.817 6.828 -9.209 219 HD13 ILE 29 HD13 ILE 29 4.990 5.222 -8.500 220 H SER 30 H SER 30 -0.117 7.585 -7.535 221 HA SER 30 HA SER 30 -1.719 5.150 -7.236 222 HB2 SER 30 HB2 SER 30 -2.693 7.916 -6.516 223 HB3 SER 30 HB3 SER 30 -3.771 6.547 -6.799 224 HG SER 30 HG SER 30 -1.783 5.857 -5.109 225 H GLY 31 H GLY 31 -1.480 4.609 -9.348 226 HA2 GLY 31 HA2 GLY 31 -2.120 6.512 -11.464 227 HA3 GLY 31 HA3 GLY 31 -1.629 4.838 -11.676 228 H ARG 32 H ARG 32 -4.104 6.796 -12.344 229 HA ARG 32 HA ARG 32 -6.351 5.398 -11.322 230 HB2 ARG 32 HB2 ARG 32 -7.655 6.622 -13.069 231 HB3 ARG 32 HB3 ARG 32 -6.688 7.651 -12.024 232 HG2 ARG 32 HG2 ARG 32 -5.046 7.960 -13.759 233 HG3 ARG 32 HG3 ARG 32 -5.870 6.795 -14.800 234 HD2 ARG 32 HD2 ARG 32 -6.376 9.102 -15.451 235 HD3 ARG 32 HD3 ARG 32 -7.821 8.245 -14.917 236 HE ARG 32 HE ARG 32 -6.575 9.745 -12.819 237 HH11 ARG 32 HH11 ARG 32 -8.735 9.960 -15.493 238 HH12 ARG 32 HH12 ARG 32 -9.523 11.370 -14.880 239 HH21 ARG 32 HH21 ARG 32 -7.623 11.549 -12.034 240 HH22 ARG 32 HH22 ARG 32 -8.902 12.256 -12.960 241 H THR 33 H THR 33 -6.222 3.236 -11.670 242 HA THR 33 HA THR 33 -6.169 2.236 -14.436 243 HB THR 33 HB THR 33 -5.888 -0.007 -13.401 244 HG1 THR 33 HG1 THR 33 -5.630 -0.167 -11.169 245 HG21 THR 33 HG21 THR 33 -3.901 1.294 -14.008 246 HG22 THR 33 HG22 THR 33 -3.602 0.334 -12.559 247 HG23 THR 33 HG23 THR 33 -3.909 2.066 -12.422 248 H LEU 34 H LEU 34 -7.936 1.345 -11.445 249 HA LEU 34 HA LEU 34 -10.272 0.617 -13.052 250 HB2 LEU 34 HB2 LEU 34 -9.561 0.208 -10.154 251 HB3 LEU 34 HB3 LEU 34 -11.175 -0.110 -10.763 252 HG LEU 34 HG LEU 34 -10.170 -1.751 -12.376 253 HD11 LEU 34 HD11 LEU 34 -7.918 -2.583 -11.961 254 HD12 LEU 34 HD12 LEU 34 -7.680 -1.353 -10.720 255 HD13 LEU 34 HD13 LEU 34 -7.886 -0.878 -12.405 256 HD21 LEU 34 HD21 LEU 34 -9.718 -2.273 -9.440 257 HD22 LEU 34 HD22 LEU 34 -9.859 -3.502 -10.697 258 HD23 LEU 34 HD23 LEU 34 -11.238 -2.472 -10.313 259 H ASN 35 H ASN 35 -9.258 3.470 -12.018 260 HA ASN 35 HA ASN 35 -11.601 4.482 -10.678 261 HB2 ASN 35 HB2 ASN 35 -9.284 5.444 -10.390 262 HB3 ASN 35 HB3 ASN 35 -9.392 6.064 -12.032 263 HD21 ASN 35 HD21 ASN 35 -10.457 6.420 -8.765 264 HD22 ASN 35 HD22 ASN 35 -11.249 7.941 -8.976 265 H GLN 36 H GLN 36 -12.974 3.463 -12.449 266 HA GLN 36 HA GLN 36 -12.963 4.725 -15.059 267 HB2 GLN 36 HB2 GLN 36 -14.836 2.680 -13.860 268 HB3 GLN 36 HB3 GLN 36 -14.797 3.154 -15.552 269 HG2 GLN 36 HG2 GLN 36 -12.558 2.247 -15.791 270 HG3 GLN 36 HG3 GLN 36 -12.510 1.856 -14.073 271 HE21 GLN 36 HE21 GLN 36 -12.243 0.106 -16.403 272 HE22 GLN 36 HE22 GLN 36 -13.479 -1.088 -16.246 273 H GLY 37 H GLY 37 -13.787 6.308 -12.585 274 HA2 GLY 37 HA2 GLY 37 -15.324 7.991 -12.172 275 HA3 GLY 37 HA3 GLY 37 -16.083 7.598 -13.709 276 H ALA 38 H ALA 38 -15.601 5.849 -10.641 277 HA ALA 38 HA ALA 38 -18.432 5.716 -10.108 278 HB1 ALA 38 HB1 ALA 38 -18.657 3.295 -10.241 279 HB2 ALA 38 HB2 ALA 38 -16.983 3.142 -10.781 280 HB3 ALA 38 HB3 ALA 38 -18.175 3.937 -11.813 281 H THR 39 H THR 39 -18.897 4.674 -8.043 282 HA THR 39 HA THR 39 -16.736 4.803 -6.127 283 HB THR 39 HB THR 39 -18.361 4.182 -4.440 284 HG1 THR 39 HG1 THR 39 -20.652 3.926 -5.560 285 HG21 THR 39 HG21 THR 39 -19.610 6.072 -6.448 286 HG22 THR 39 HG22 THR 39 -18.449 6.508 -5.192 287 HG23 THR 39 HG23 THR 39 -20.057 5.937 -4.748 288 H VAL 40 H VAL 40 -16.271 2.926 -4.666 289 HA VAL 40 HA VAL 40 -15.413 0.713 -6.194 290 HB VAL 40 HB VAL 40 -15.735 0.781 -3.189 291 HG11 VAL 40 HG11 VAL 40 -15.289 -1.438 -4.043 292 HG12 VAL 40 HG12 VAL 40 -13.866 -0.816 -3.208 293 HG13 VAL 40 HG13 VAL 40 -13.915 -0.831 -4.970 294 HG21 VAL 40 HG21 VAL 40 -13.431 1.610 -3.098 295 HG22 VAL 40 HG22 VAL 40 -14.491 2.747 -3.929 296 HG23 VAL 40 HG23 VAL 40 -13.400 1.719 -4.858 297 H GLU 41 H GLU 41 -18.302 1.298 -4.320 298 HA GLU 41 HA GLU 41 -19.169 -1.425 -4.226 299 HB2 GLU 41 HB2 GLU 41 -20.747 1.112 -3.746 300 HB3 GLU 41 HB3 GLU 41 -21.268 -0.519 -3.331 301 HG2 GLU 41 HG2 GLU 41 -19.252 -0.693 -1.850 302 HG3 GLU 41 HG3 GLU 41 -18.954 1.017 -2.156 303 H GLU 42 H GLU 42 -19.327 0.996 -6.668 304 HA GLU 42 HA GLU 42 -21.578 0.020 -8.107 305 HB2 GLU 42 HB2 GLU 42 -19.098 1.444 -9.098 306 HB3 GLU 42 HB3 GLU 42 -20.533 1.149 -10.070 307 HG2 GLU 42 HG2 GLU 42 -20.382 2.839 -7.578 308 HG3 GLU 42 HG3 GLU 42 -20.482 3.427 -9.236 309 H LYS 43 H LYS 43 -18.274 -1.040 -7.816 310 HA LYS 43 HA LYS 43 -18.602 -3.027 -9.952 311 HB2 LYS 43 HB2 LYS 43 -16.221 -1.955 -8.499 312 HB3 LYS 43 HB3 LYS 43 -16.126 -3.483 -9.359 313 HG2 LYS 43 HG2 LYS 43 -15.281 -1.749 -10.769 314 HG3 LYS 43 HG3 LYS 43 -16.811 -2.315 -11.434 315 HD2 LYS 43 HD2 LYS 43 -17.957 -0.365 -10.589 316 HD3 LYS 43 HD3 LYS 43 -16.509 0.161 -9.724 317 HE2 LYS 43 HE2 LYS 43 -16.799 1.444 -11.783 318 HE3 LYS 43 HE3 LYS 43 -15.341 0.458 -11.862 319 HZ1 LYS 43 HZ1 LYS 43 -16.544 0.351 -13.931 320 HZ2 LYS 43 HZ2 LYS 43 -17.946 -0.165 -13.142 321 HZ3 LYS 43 HZ3 LYS 43 -16.589 -1.166 -13.184 322 H LEU 44 H LEU 44 -17.087 -3.075 -6.712 323 HA LEU 44 HA LEU 44 -16.887 -4.691 -5.125 324 HB2 LEU 44 HB2 LEU 44 -19.694 -5.272 -6.071 325 HB3 LEU 44 HB3 LEU 44 -18.971 -6.066 -4.684 326 HG LEU 44 HG LEU 44 -19.478 -3.095 -4.952 327 HD11 LEU 44 HD11 LEU 44 -21.143 -3.446 -3.195 328 HD12 LEU 44 HD12 LEU 44 -20.840 -5.181 -3.249 329 HD13 LEU 44 HD13 LEU 44 -21.533 -4.363 -4.650 330 HD21 LEU 44 HD21 LEU 44 -17.473 -3.543 -3.635 331 HD22 LEU 44 HD22 LEU 44 -18.370 -4.681 -2.629 332 HD23 LEU 44 HD23 LEU 44 -18.781 -2.966 -2.607 333 H THR 45 H THR 45 -16.321 -5.439 -8.089 334 HA THR 45 HA THR 45 -16.773 -8.289 -8.182 335 HB THR 45 HB THR 45 -16.803 -7.148 -10.292 336 HG1 THR 45 HG1 THR 45 -15.569 -8.577 -11.362 337 HG21 THR 45 HG21 THR 45 -13.963 -6.279 -9.716 338 HG22 THR 45 HG22 THR 45 -15.381 -5.228 -9.718 339 HG23 THR 45 HG23 THR 45 -14.848 -5.993 -11.216 340 H GLU 46 H GLU 46 -15.107 -9.905 -8.388 341 HA GLU 46 HA GLU 46 -13.081 -9.868 -6.451 342 HB2 GLU 46 HB2 GLU 46 -14.060 -11.917 -7.473 343 HB3 GLU 46 HB3 GLU 46 -13.219 -11.550 -8.972 344 HG2 GLU 46 HG2 GLU 46 -11.982 -13.231 -7.842 345 HG3 GLU 46 HG3 GLU 46 -11.062 -11.731 -7.728 346 H GLU 47 H GLU 47 -13.066 -8.998 -9.854 347 HA GLU 47 HA GLU 47 -10.310 -8.704 -10.276 348 HB2 GLU 47 HB2 GLU 47 -12.524 -7.030 -11.482 349 HB3 GLU 47 HB3 GLU 47 -10.898 -7.221 -12.123 350 HG2 GLU 47 HG2 GLU 47 -11.369 -9.639 -12.443 351 HG3 GLU 47 HG3 GLU 47 -13.031 -9.341 -11.935 352 H TYR 48 H TYR 48 -12.694 -6.472 -8.908 353 HA TYR 48 HA TYR 48 -11.063 -4.172 -8.812 354 HB2 TYR 48 HB2 TYR 48 -13.658 -4.504 -8.383 355 HB3 TYR 48 HB3 TYR 48 -13.153 -4.659 -6.706 356 HD1 TYR 48 HD1 TYR 48 -11.393 -2.676 -5.998 357 HD2 TYR 48 HD2 TYR 48 -14.364 -2.409 -9.041 358 HE1 TYR 48 HE1 TYR 48 -11.366 -0.228 -5.803 359 HE2 TYR 48 HE2 TYR 48 -14.342 0.042 -8.860 360 HH TYR 48 HH TYR 48 -11.939 1.750 -7.301 361 H PHE 49 H PHE 49 -11.561 -6.830 -6.560 362 HA PHE 49 HA PHE 49 -10.053 -5.839 -4.392 363 HB2 PHE 49 HB2 PHE 49 -11.649 -7.763 -4.293 364 HB3 PHE 49 HB3 PHE 49 -10.504 -8.727 -5.214 365 HD1 PHE 49 HD2 PHE 49 -8.417 -9.520 -4.172 366 HD2 PHE 49 HD1 PHE 49 -11.307 -7.303 -1.951 367 HE1 PHE 49 HE2 PHE 49 -7.363 -10.247 -2.070 368 HE2 PHE 49 HE1 PHE 49 -10.253 -8.034 0.151 369 HZ PHE 49 HZ PHE 49 -8.281 -9.509 0.093 370 H ASN 50 H ASN 50 -9.121 -8.430 -6.660 371 HA ASN 50 HA ASN 50 -6.458 -8.598 -5.903 372 HB2 ASN 50 HB2 ASN 50 -7.733 -9.244 -8.569 373 HB3 ASN 50 HB3 ASN 50 -6.110 -9.745 -8.098 374 HD21 ASN 50 HD21 ASN 50 -8.552 -11.291 -8.736 375 HD22 ASN 50 HD22 ASN 50 -8.804 -12.319 -7.373 376 H ALA 51 H ALA 51 -7.931 -6.205 -7.941 377 HA ALA 51 HA ALA 51 -5.461 -5.517 -9.295 378 HB1 ALA 51 HB1 ALA 51 -7.622 -5.426 -10.470 379 HB2 ALA 51 HB2 ALA 51 -6.758 -3.890 -10.508 380 HB3 ALA 51 HB3 ALA 51 -8.123 -4.108 -9.411 381 H VAL 52 H VAL 52 -7.420 -4.101 -6.660 382 HA VAL 52 HA VAL 52 -5.500 -1.846 -6.565 383 HB VAL 52 HB VAL 52 -7.150 -0.520 -5.431 384 HG11 VAL 52 HG11 VAL 52 -7.304 -0.590 -7.865 385 HG12 VAL 52 HG12 VAL 52 -8.895 -0.372 -7.137 386 HG13 VAL 52 HG13 VAL 52 -8.422 -1.951 -7.768 387 HG21 VAL 52 HG21 VAL 52 -9.436 -1.393 -4.974 388 HG22 VAL 52 HG22 VAL 52 -8.182 -2.160 -4.001 389 HG23 VAL 52 HG23 VAL 52 -8.861 -3.010 -5.389 390 H ASN 53 H ASN 53 -5.630 -4.700 -5.133 391 HA ASN 53 HA ASN 53 -5.415 -3.767 -2.352 392 HB2 ASN 53 HB2 ASN 53 -5.762 -6.504 -3.560 393 HB3 ASN 53 HB3 ASN 53 -5.345 -6.280 -1.865 394 HD21 ASN 53 HD21 ASN 53 -7.480 -4.196 -3.721 395 HD22 ASN 53 HD22 ASN 53 -8.907 -4.592 -2.842 396 H TYR 54 H TYR 54 -3.172 -3.550 -4.499 397 HA TYR 54 HA TYR 54 -1.121 -4.766 -2.777 398 HB2 TYR 54 HB2 TYR 54 0.126 -5.653 -4.637 399 HB3 TYR 54 HB3 TYR 54 -1.515 -6.280 -4.701 400 HD1 TYR 54 HD1 TYR 54 0.885 -3.961 -6.276 401 HD2 TYR 54 HD2 TYR 54 -2.957 -5.773 -6.569 402 HE1 TYR 54 HE1 TYR 54 0.720 -3.219 -8.613 403 HE2 TYR 54 HE2 TYR 54 -3.132 -5.031 -8.909 404 HH TYR 54 HH TYR 54 -0.487 -3.896 -10.679 405 H ALA 55 H ALA 55 0.997 -3.911 -2.962 406 HA ALA 55 HA ALA 55 1.261 -1.332 -4.381 407 HB1 ALA 55 HB1 ALA 55 2.614 -0.482 -2.513 408 HB2 ALA 55 HB2 ALA 55 2.319 -1.973 -1.616 409 HB3 ALA 55 HB3 ALA 55 0.980 -0.888 -1.989 410 H GLU 56 H GLU 56 3.172 -1.083 -5.509 411 HA GLU 56 HA GLU 56 4.950 -3.415 -5.579 412 HB2 GLU 56 HB2 GLU 56 4.604 -1.113 -7.510 413 HB3 GLU 56 HB3 GLU 56 5.799 -2.388 -7.706 414 HG2 GLU 56 HG2 GLU 56 3.956 -4.050 -7.750 415 HG3 GLU 56 HG3 GLU 56 2.804 -2.720 -7.677 416 H ILE 57 H ILE 57 6.785 -3.379 -4.482 417 HA ILE 57 HA ILE 57 8.024 -0.786 -3.788 418 HB ILE 57 HB ILE 57 8.399 -3.439 -2.363 419 HG12 ILE 57 HG12 ILE 57 7.091 -2.126 -0.507 420 HG13 ILE 57 HG13 ILE 57 6.482 -1.170 -1.852 421 HG21 ILE 57 HG21 ILE 57 10.297 -1.962 -2.085 422 HG22 ILE 57 HG22 ILE 57 9.396 -2.064 -0.573 423 HG23 ILE 57 HG23 ILE 57 9.235 -0.639 -1.601 424 HD11 ILE 57 HD11 ILE 57 4.935 -2.928 -1.252 425 HD12 ILE 57 HD12 ILE 57 6.185 -4.145 -1.512 426 HD13 ILE 57 HD13 ILE 57 5.579 -3.199 -2.870 427 H ASN 58 H ASN 58 10.335 -0.622 -3.812 428 HA ASN 58 HA ASN 58 11.665 -1.882 -5.983 429 HB2 ASN 58 HB2 ASN 58 12.197 0.394 -5.214 430 HB3 ASN 58 HB3 ASN 58 12.764 -0.249 -3.679 431 HD21 ASN 58 HD21 ASN 58 13.465 0.137 -7.049 432 HD22 ASN 58 HD22 ASN 58 15.131 -0.315 -6.955 433 H GLU 59 H GLU 59 13.406 -3.369 -5.970 434 HA GLU 59 HA GLU 59 13.233 -5.592 -4.325 435 HB2 GLU 59 HB2 GLU 59 14.355 -5.680 -6.465 436 HB3 GLU 59 HB3 GLU 59 15.605 -4.582 -5.900 437 HG2 GLU 59 HG2 GLU 59 16.465 -6.815 -5.945 438 HG3 GLU 59 HG3 GLU 59 16.340 -6.285 -4.274 439 H GLU 60 H GLU 60 15.514 -2.865 -3.996 440 HA GLU 60 HA GLU 60 17.022 -3.982 -1.896 441 HB2 GLU 60 HB2 GLU 60 16.624 -1.072 -2.626 442 HB3 GLU 60 HB3 GLU 60 17.868 -1.682 -1.539 443 HG2 GLU 60 HG2 GLU 60 17.583 -2.402 -4.456 444 HG3 GLU 60 HG3 GLU 60 18.736 -1.250 -3.787 445 H ASP 61 H ASP 61 14.232 -1.764 -1.779 446 HA ASP 61 HA ASP 61 14.137 -1.674 1.078 447 HB2 ASP 61 HB2 ASP 61 11.933 -1.161 -0.936 448 HB3 ASP 61 HB3 ASP 61 11.899 -0.701 0.764 449 H TRP 62 H TRP 62 12.859 -3.801 -1.363 450 HA TRP 62 HA TRP 62 10.928 -5.220 0.064 451 HB2 TRP 62 HB2 TRP 62 11.364 -5.351 -2.397 452 HB3 TRP 62 HB3 TRP 62 12.793 -6.320 -2.054 453 HD1 TRP 62 HD1 TRP 62 12.415 -8.878 -1.431 454 HE1 TRP 62 HE1 TRP 62 10.350 -10.415 -1.573 455 HE3 TRP 62 HE3 TRP 62 8.805 -5.325 -2.113 456 HZ2 TRP 62 HZ2 TRP 62 7.570 -10.141 -1.922 457 HZ3 TRP 62 HZ3 TRP 62 6.470 -6.048 -2.340 458 HH2 TRP 62 HH2 TRP 62 5.866 -8.410 -2.249 459 H ASN 63 H ASN 63 14.393 -6.073 -0.396 460 HA ASN 63 HA ASN 63 14.255 -8.245 1.463 461 HB2 ASN 63 HB2 ASN 63 16.779 -8.216 1.328 462 HB3 ASN 63 HB3 ASN 63 15.937 -8.425 -0.202 463 HD21 ASN 63 HD21 ASN 63 16.162 -6.917 -1.774 464 HD22 ASN 63 HD22 ASN 63 17.241 -5.575 -1.664 465 H ALA 64 H ALA 64 15.036 -4.840 1.772 466 HA ALA 64 HA ALA 64 16.242 -4.821 4.297 467 HB1 ALA 64 HB1 ALA 64 16.103 -2.858 2.823 468 HB2 ALA 64 HB2 ALA 64 15.543 -2.496 4.454 469 HB3 ALA 64 HB3 ALA 64 14.376 -2.739 3.154 470 H LEU 65 H LEU 65 12.788 -4.706 3.453 471 HA LEU 65 HA LEU 65 12.005 -4.832 6.261 472 HB2 LEU 65 HB2 LEU 65 10.365 -4.772 3.723 473 HB3 LEU 65 HB3 LEU 65 9.688 -4.768 5.340 474 HG LEU 65 HG LEU 65 11.452 -2.606 4.171 475 HD11 LEU 65 HD11 LEU 65 9.238 -2.640 3.152 476 HD12 LEU 65 HD12 LEU 65 9.433 -1.231 4.192 477 HD13 LEU 65 HD13 LEU 65 8.488 -2.612 4.748 478 HD21 LEU 65 HD21 LEU 65 11.781 -2.798 6.570 479 HD22 LEU 65 HD22 LEU 65 10.038 -2.762 6.838 480 HD23 LEU 65 HD23 LEU 65 10.863 -1.340 6.202 481 H GLY 66 H GLY 66 12.959 -7.103 4.032 482 HA2 GLY 66 HA2 GLY 66 12.748 -9.386 3.867 483 HA3 GLY 66 HA3 GLY 66 12.174 -9.346 5.526 484 H LEU 67 H LEU 67 10.834 -8.147 2.453 485 HA LEU 67 HA LEU 67 8.213 -9.187 3.178 486 HB2 LEU 67 HB2 LEU 67 9.082 -7.562 0.785 487 HB3 LEU 67 HB3 LEU 67 7.422 -7.935 1.222 488 HG LEU 67 HG LEU 67 9.336 -6.261 2.860 489 HD11 LEU 67 HD11 LEU 67 6.945 -5.451 1.207 490 HD12 LEU 67 HD12 LEU 67 8.638 -5.111 0.841 491 HD13 LEU 67 HD13 LEU 67 7.881 -4.387 2.260 492 HD21 LEU 67 HD21 LEU 67 7.330 -5.745 4.225 493 HD22 LEU 67 HD22 LEU 67 7.805 -7.440 4.310 494 HD23 LEU 67 HD23 LEU 67 6.429 -6.962 3.315 495 H GLN 68 H GLN 68 6.876 -10.280 1.501 496 HA GLN 68 HA GLN 68 8.290 -11.861 -0.499 497 HB2 GLN 68 HB2 GLN 68 8.444 -13.131 1.674 498 HB3 GLN 68 HB3 GLN 68 6.685 -13.213 1.671 499 HG2 GLN 68 HG2 GLN 68 6.683 -14.532 -0.324 500 HG3 GLN 68 HG3 GLN 68 8.422 -14.317 -0.527 501 HE21 GLN 68 HE21 GLN 68 8.781 -16.545 -0.513 502 HE22 GLN 68 HE22 GLN 68 8.684 -17.481 0.934 503 H GLU 69 H GLU 69 7.060 -11.896 -2.249 504 HA GLU 69 HA GLU 69 4.921 -10.294 -2.604 505 HB2 GLU 69 HB2 GLU 69 5.407 -12.820 -4.189 506 HB3 GLU 69 HB3 GLU 69 4.417 -11.460 -4.704 507 HG2 GLU 69 HG2 GLU 69 6.340 -10.927 -5.775 508 HG3 GLU 69 HG3 GLU 69 6.632 -10.117 -4.234 509 H GLY 70 H GLY 70 3.122 -10.225 -1.521 510 HA2 GLY 70 HA2 GLY 70 0.818 -11.152 -1.543 511 HA3 GLY 70 HA3 GLY 70 1.537 -12.718 -1.213 512 H ASP 71 H ASP 71 3.422 -10.924 0.687 513 HA ASP 71 HA ASP 71 1.758 -11.367 3.022 514 HB2 ASP 71 HB2 ASP 71 3.699 -10.647 4.340 515 HB3 ASP 71 HB3 ASP 71 4.134 -11.888 3.176 516 H ARG 72 H ARG 72 2.043 -9.429 4.789 517 HA ARG 72 HA ARG 72 0.461 -7.306 3.514 518 HB2 ARG 72 HB2 ARG 72 0.657 -8.066 6.437 519 HB3 ARG 72 HB3 ARG 72 -0.370 -6.800 5.784 520 HG2 ARG 72 HG2 ARG 72 -1.820 -8.589 6.093 521 HG3 ARG 72 HG3 ARG 72 -1.443 -8.659 4.372 522 HD2 ARG 72 HD2 ARG 72 0.162 -10.431 4.763 523 HD3 ARG 72 HD3 ARG 72 -0.080 -10.308 6.505 524 HE ARG 72 HE ARG 72 -1.986 -11.403 4.558 525 HH11 ARG 72 HH11 ARG 72 -1.134 -10.771 7.832 526 HH12 ARG 72 HH12 ARG 72 -2.212 -11.964 8.461 527 HH21 ARG 72 HH21 ARG 72 -3.387 -12.918 5.367 528 HH22 ARG 72 HH22 ARG 72 -3.475 -13.171 7.076 529 H VAL 73 H VAL 73 1.195 -5.304 3.320 530 HA VAL 73 HA VAL 73 3.357 -4.391 5.116 531 HB VAL 73 HB VAL 73 3.972 -2.752 3.310 532 HG11 VAL 73 HG11 VAL 73 5.203 -4.410 1.951 533 HG12 VAL 73 HG12 VAL 73 4.244 -5.692 2.691 534 HG13 VAL 73 HG13 VAL 73 5.323 -4.712 3.686 535 HG21 VAL 73 HG21 VAL 73 1.889 -2.812 2.028 536 HG22 VAL 73 HG22 VAL 73 2.189 -4.496 1.596 537 HG23 VAL 73 HG23 VAL 73 3.268 -3.228 1.008 538 H LYS 74 H LYS 74 3.051 -2.588 6.256 539 HA LYS 74 HA LYS 74 0.525 -1.167 6.061 540 HB2 LYS 74 HB2 LYS 74 1.319 -1.776 8.280 541 HB3 LYS 74 HB3 LYS 74 2.832 -0.927 8.004 542 HG2 LYS 74 HG2 LYS 74 1.474 0.438 9.404 543 HG3 LYS 74 HG3 LYS 74 1.545 1.198 7.815 544 HD2 LYS 74 HD2 LYS 74 -0.712 1.360 8.504 545 HD3 LYS 74 HD3 LYS 74 -0.674 0.051 7.319 546 HE2 LYS 74 HE2 LYS 74 -2.042 -0.603 9.205 547 HE3 LYS 74 HE3 LYS 74 -0.576 -1.581 9.176 548 HZ1 LYS 74 HZ1 LYS 74 0.352 -0.282 10.931 549 HZ2 LYS 74 HZ2 LYS 74 -1.203 -0.751 11.409 550 HZ3 LYS 74 HZ3 LYS 74 -0.927 0.829 10.875 551 H VAL 75 H VAL 75 0.285 0.684 4.999 552 HA VAL 75 HA VAL 75 2.671 2.226 4.198 553 HB VAL 75 HB VAL 75 -0.076 2.222 2.909 554 HG11 VAL 75 HG11 VAL 75 1.028 3.497 1.102 555 HG12 VAL 75 HG12 VAL 75 2.504 3.557 2.067 556 HG13 VAL 75 HG13 VAL 75 1.042 4.360 2.640 557 HG21 VAL 75 HG21 VAL 75 1.003 1.034 1.041 558 HG22 VAL 75 HG22 VAL 75 1.057 0.094 2.533 559 HG23 VAL 75 HG23 VAL 75 2.500 0.939 1.970 560 H LYS 76 H LYS 76 2.899 4.231 5.030 561 HA LYS 76 HA LYS 76 0.578 5.478 6.365 562 HB2 LYS 76 HB2 LYS 76 3.324 5.016 7.541 563 HB3 LYS 76 HB3 LYS 76 2.124 6.086 8.255 564 HG2 LYS 76 HG2 LYS 76 0.782 4.363 8.945 565 HG3 LYS 76 HG3 LYS 76 1.322 3.283 7.661 566 HD2 LYS 76 HD2 LYS 76 2.140 2.496 9.789 567 HD3 LYS 76 HD3 LYS 76 3.485 3.040 8.791 568 HE2 LYS 76 HE2 LYS 76 3.593 5.134 10.036 569 HE3 LYS 76 HE3 LYS 76 2.190 4.657 10.992 570 HZ1 LYS 76 HZ1 LYS 76 3.439 2.873 11.952 571 HZ2 LYS 76 HZ2 LYS 76 4.328 4.298 12.130 572 HZ3 LYS 76 HZ3 LYS 76 4.765 3.176 10.947 573 H THR 77 H THR 77 0.378 7.593 6.101 574 HA THR 77 HA THR 77 2.646 9.196 5.090 575 HB THR 77 HB THR 77 1.289 10.302 3.428 576 HG1 THR 77 HG1 THR 77 -0.900 9.528 3.071 577 HG21 THR 77 HG21 THR 77 2.375 8.239 2.676 578 HG22 THR 77 HG22 THR 77 0.835 8.473 1.847 579 HG23 THR 77 HG23 THR 77 0.960 7.304 3.163 580 H GLU 78 H GLU 78 1.530 11.603 4.800 581 HA GLU 78 HA GLU 78 0.866 12.449 7.469 582 HB2 GLU 78 HB2 GLU 78 0.830 14.697 6.505 583 HB3 GLU 78 HB3 GLU 78 2.260 13.817 5.985 584 HG2 GLU 78 HG2 GLU 78 0.984 13.266 3.861 585 HG3 GLU 78 HG3 GLU 78 -0.205 14.459 4.385 586 H PHE 79 H PHE 79 -1.003 11.150 5.010 587 HA PHE 79 HA PHE 79 -3.429 12.643 5.735 588 HB2 PHE 79 HB2 PHE 79 -2.931 10.654 3.501 589 HB3 PHE 79 HB3 PHE 79 -4.476 11.443 3.807 590 HD1 PHE 79 HD2 PHE 79 -4.739 13.855 3.426 591 HD2 PHE 79 HD1 PHE 79 -1.123 11.825 2.450 592 HE1 PHE 79 HE2 PHE 79 -4.047 15.762 2.037 593 HE2 PHE 79 HE1 PHE 79 -0.428 13.728 1.060 594 HZ PHE 79 HZ PHE 79 -1.887 15.700 0.851 595 H GLY 80 H GLY 80 -2.213 9.289 5.583 596 HA2 GLY 80 HA2 GLY 80 -3.574 8.485 7.926 597 HA3 GLY 80 HA3 GLY 80 -4.526 8.010 6.529 598 H GLU 81 H GLU 81 -4.257 5.797 7.000 599 HA GLU 81 HA GLU 81 -1.756 4.666 6.049 600 HB2 GLU 81 HB2 GLU 81 -1.369 3.267 8.005 601 HB3 GLU 81 HB3 GLU 81 -1.323 4.967 8.452 602 HG2 GLU 81 HG2 GLU 81 -3.604 4.796 9.335 603 HG3 GLU 81 HG3 GLU 81 -3.647 3.091 8.890 604 H VAL 82 H VAL 82 -1.896 2.448 5.459 605 HA VAL 82 HA VAL 82 -4.443 1.058 5.738 606 HB VAL 82 HB VAL 82 -4.695 2.532 3.720 607 HG11 VAL 82 HG11 VAL 82 -2.527 0.777 2.564 608 HG12 VAL 82 HG12 VAL 82 -2.410 2.502 2.912 609 HG13 VAL 82 HG13 VAL 82 -3.506 1.930 1.655 610 HG21 VAL 82 HG21 VAL 82 -5.620 0.796 2.254 611 HG22 VAL 82 HG22 VAL 82 -6.041 0.510 3.943 612 HG23 VAL 82 HG23 VAL 82 -4.766 -0.440 3.176 613 H VAL 83 H VAL 83 -4.324 -1.207 5.190 614 HA VAL 83 HA VAL 83 -1.569 -2.263 4.956 615 HB VAL 83 HB VAL 83 -4.014 -3.772 5.925 616 HG11 VAL 83 HG11 VAL 83 -2.273 -5.214 5.045 617 HG12 VAL 83 HG12 VAL 83 -2.348 -5.370 6.801 618 HG13 VAL 83 HG13 VAL 83 -1.063 -4.419 6.054 619 HG21 VAL 83 HG21 VAL 83 -3.141 -3.502 8.196 620 HG22 VAL 83 HG22 VAL 83 -3.527 -1.942 7.471 621 HG23 VAL 83 HG23 VAL 83 -1.849 -2.468 7.582 622 H VAL 84 H VAL 84 -1.029 -3.135 3.030 623 HA VAL 84 HA VAL 84 -3.145 -4.365 1.366 624 HB VAL 84 HB VAL 84 -2.124 -3.454 -0.665 625 HG11 VAL 84 HG11 VAL 84 -2.762 -1.096 -0.395 626 HG12 VAL 84 HG12 VAL 84 -2.779 -1.309 1.356 627 HG13 VAL 84 HG13 VAL 84 -3.931 -2.187 0.352 628 HG21 VAL 84 HG21 VAL 84 -0.281 -1.936 1.192 629 HG22 VAL 84 HG22 VAL 84 -0.381 -1.731 -0.558 630 HG23 VAL 84 HG23 VAL 84 0.188 -3.257 0.120 631 H PHE 85 H PHE 85 -2.151 -5.695 -0.480 632 HA PHE 85 HA PHE 85 -0.206 -7.546 0.550 633 HB2 PHE 85 HB2 PHE 85 -1.510 -7.308 -2.177 634 HB3 PHE 85 HB3 PHE 85 -0.406 -8.602 -1.732 635 HD1 PHE 85 HD1 PHE 85 -1.053 -10.090 0.242 636 HD2 PHE 85 HD2 PHE 85 -3.803 -7.497 -1.725 637 HE1 PHE 85 HE1 PHE 85 -2.928 -11.414 1.122 638 HE2 PHE 85 HE2 PHE 85 -5.681 -8.815 -0.843 639 HZ PHE 85 HZ PHE 85 -5.246 -10.777 0.584 640 H ALA 86 H ALA 86 1.939 -7.709 0.076 641 HA ALA 86 HA ALA 86 3.194 -5.458 -1.264 642 HB1 ALA 86 HB1 ALA 86 4.063 -6.283 0.874 643 HB2 ALA 86 HB2 ALA 86 5.277 -6.362 -0.402 644 HB3 ALA 86 HB3 ALA 86 4.447 -7.829 0.118 645 H LYS 87 H LYS 87 3.848 -5.443 -3.314 646 HA LYS 87 HA LYS 87 4.734 -7.966 -4.583 647 HB2 LYS 87 HB2 LYS 87 3.254 -5.682 -5.917 648 HB3 LYS 87 HB3 LYS 87 4.007 -7.013 -6.775 649 HG2 LYS 87 HG2 LYS 87 2.461 -8.540 -5.471 650 HG3 LYS 87 HG3 LYS 87 1.601 -7.073 -4.985 651 HD2 LYS 87 HD2 LYS 87 1.303 -6.485 -7.371 652 HD3 LYS 87 HD3 LYS 87 2.098 -7.995 -7.822 653 HE2 LYS 87 HE2 LYS 87 0.306 -9.186 -6.519 654 HE3 LYS 87 HE3 LYS 87 -0.521 -7.641 -6.387 655 HZ1 LYS 87 HZ1 LYS 87 0.205 -8.943 -8.954 656 HZ2 LYS 87 HZ2 LYS 87 -0.703 -7.528 -8.771 657 HZ3 LYS 87 HZ3 LYS 87 -1.328 -9.009 -8.246 658 H LYS 88 H LYS 88 6.530 -7.874 -5.848 659 HA LYS 88 HA LYS 88 8.267 -5.600 -5.435 660 HB2 LYS 88 HB2 LYS 88 8.897 -8.117 -5.392 661 HB3 LYS 88 HB3 LYS 88 8.898 -7.996 -7.151 662 HG2 LYS 88 HG2 LYS 88 10.570 -6.258 -7.053 663 HG3 LYS 88 HG3 LYS 88 10.528 -6.296 -5.292 664 HD2 LYS 88 HD2 LYS 88 11.395 -8.559 -7.101 665 HD3 LYS 88 HD3 LYS 88 12.464 -7.532 -6.144 666 HE2 LYS 88 HE2 LYS 88 11.280 -8.339 -4.094 667 HE3 LYS 88 HE3 LYS 88 10.388 -9.466 -5.115 668 HZ1 LYS 88 HZ1 LYS 88 12.269 -10.542 -4.089 669 HZ2 LYS 88 HZ2 LYS 88 13.334 -9.406 -4.752 670 HZ3 LYS 88 HZ3 LYS 88 12.494 -10.468 -5.762 671 H GLY 89 H GLY 89 8.635 -3.992 -6.895 672 HA2 GLY 89 HA2 GLY 89 7.280 -4.269 -9.521 673 HA3 GLY 89 HA3 GLY 89 7.261 -2.795 -8.574 674 H ASP 90 H ASP 90 7.924 -2.206 -10.896 675 HA ASP 90 HA ASP 90 10.799 -2.439 -11.394 676 HB2 ASP 90 HB2 ASP 90 8.917 -2.664 -13.162 677 HB3 ASP 90 HB3 ASP 90 8.795 -0.911 -13.066 678 H VAL 91 H VAL 91 9.180 -0.712 -9.331 679 HA VAL 91 HA VAL 91 9.759 2.015 -9.974 680 HB VAL 91 HB VAL 91 8.964 2.494 -7.679 681 HG11 VAL 91 HG11 VAL 91 7.218 0.529 -9.181 682 HG12 VAL 91 HG12 VAL 91 7.332 2.262 -9.494 683 HG13 VAL 91 HG13 VAL 91 6.666 1.684 -7.966 684 HG21 VAL 91 HG21 VAL 91 8.786 -0.517 -7.419 685 HG22 VAL 91 HG22 VAL 91 8.146 0.647 -6.260 686 HG23 VAL 91 HG23 VAL 91 9.885 0.541 -6.533 687 HA PRO 92 HA PRO 92 13.873 2.439 -8.260 688 HB2 PRO 92 HB2 PRO 92 13.133 5.160 -7.398 689 HB3 PRO 92 HB3 PRO 92 14.325 4.649 -8.596 690 HG2 PRO 92 HG2 PRO 92 12.025 5.848 -9.316 691 HG3 PRO 92 HG3 PRO 92 12.773 4.582 -10.311 692 HD2 PRO 92 HD2 PRO 92 10.466 4.372 -8.398 693 HD3 PRO 92 HD3 PRO 92 10.648 3.672 -10.023 694 H LYS 93 H LYS 93 15.031 2.980 -6.218 695 HA LYS 93 HA LYS 93 13.711 1.904 -3.953 696 HB2 LYS 93 HB2 LYS 93 16.193 1.807 -4.390 697 HB3 LYS 93 HB3 LYS 93 16.280 3.503 -3.927 698 HG2 LYS 93 HG2 LYS 93 15.343 2.905 -1.712 699 HG3 LYS 93 HG3 LYS 93 15.380 1.208 -2.188 700 HD2 LYS 93 HD2 LYS 93 17.865 1.486 -2.554 701 HD3 LYS 93 HD3 LYS 93 17.721 3.070 -1.787 702 HE2 LYS 93 HE2 LYS 93 17.031 0.402 -0.559 703 HE3 LYS 93 HE3 LYS 93 18.424 1.404 -0.163 704 HZ1 LYS 93 HZ1 LYS 93 16.903 3.106 0.663 705 HZ2 LYS 93 HZ2 LYS 93 16.675 1.638 1.471 706 HZ3 LYS 93 HZ3 LYS 93 15.575 2.125 0.287 707 H GLY 94 H GLY 94 13.134 2.896 -1.957 708 HA2 GLY 94 HA2 GLY 94 12.044 4.508 -0.726 709 HA3 GLY 94 HA3 GLY 94 13.056 5.690 -1.540 710 H MET 95 H MET 95 10.929 3.606 -3.377 711 HA MET 95 HA MET 95 8.813 5.596 -3.521 712 HB2 MET 95 HB2 MET 95 10.657 6.229 -5.152 713 HB3 MET 95 HB3 MET 95 10.300 4.740 -6.014 714 HG2 MET 95 HG2 MET 95 8.104 5.502 -6.543 715 HG3 MET 95 HG3 MET 95 8.293 6.918 -5.511 716 HE1 MET 95 HE1 MET 95 7.293 7.404 -8.451 717 HE2 MET 95 HE2 MET 95 8.339 8.747 -8.912 718 HE3 MET 95 HE3 MET 95 7.669 8.669 -7.281 719 H ILE 96 H ILE 96 6.823 4.638 -4.005 720 HA ILE 96 HA ILE 96 6.838 1.860 -4.979 721 HB ILE 96 HB ILE 96 5.192 1.150 -3.311 722 HG12 ILE 96 HG12 ILE 96 5.656 3.847 -1.993 723 HG13 ILE 96 HG13 ILE 96 4.186 3.371 -2.838 724 HG21 ILE 96 HG21 ILE 96 7.544 0.735 -2.866 725 HG22 ILE 96 HG22 ILE 96 6.678 1.046 -1.362 726 HG23 ILE 96 HG23 ILE 96 7.691 2.303 -2.073 727 HD11 ILE 96 HD11 ILE 96 5.276 2.094 -0.336 728 HD12 ILE 96 HD12 ILE 96 3.805 1.615 -1.185 729 HD13 ILE 96 HD13 ILE 96 3.912 3.208 -0.437 730 H PHE 97 H PHE 97 5.100 1.258 -6.218 731 HA PHE 97 HA PHE 97 3.239 3.416 -6.965 732 HB2 PHE 97 HB2 PHE 97 4.477 2.508 -8.838 733 HB3 PHE 97 HB3 PHE 97 4.010 0.864 -8.411 734 HD1 PHE 97 HD2 PHE 97 2.722 4.107 -9.666 735 HD2 PHE 97 HD1 PHE 97 1.940 -0.053 -9.144 736 HE1 PHE 97 HE2 PHE 97 0.735 4.298 -11.100 737 HE2 PHE 97 HE1 PHE 97 -0.054 0.141 -10.575 738 HZ PHE 97 HZ PHE 97 -0.654 2.316 -11.557 739 H ILE 98 H ILE 98 1.127 3.306 -6.482 740 HA ILE 98 HA ILE 98 -0.092 0.672 -5.951 741 HB ILE 98 HB ILE 98 -0.733 3.272 -4.525 742 HG12 ILE 98 HG12 ILE 98 0.548 0.700 -3.560 743 HG13 ILE 98 HG13 ILE 98 1.308 2.284 -3.665 744 HG21 ILE 98 HG21 ILE 98 -2.007 0.545 -4.227 745 HG22 ILE 98 HG22 ILE 98 -2.765 1.988 -4.899 746 HG23 ILE 98 HG23 ILE 98 -2.324 1.940 -3.194 747 HD11 ILE 98 HD11 ILE 98 0.773 1.782 -1.378 748 HD12 ILE 98 HD12 ILE 98 -0.912 1.475 -1.798 749 HD13 ILE 98 HD13 ILE 98 -0.253 3.106 -1.935 750 HA PRO 99 HA PRO 99 -2.983 1.966 -9.166 751 HB2 PRO 99 HB2 PRO 99 -4.952 0.133 -8.570 752 HB3 PRO 99 HB3 PRO 99 -3.520 -0.233 -9.540 753 HG2 PRO 99 HG2 PRO 99 -4.031 -0.774 -6.637 754 HG3 PRO 99 HG3 PRO 99 -3.268 -1.815 -7.855 755 HD2 PRO 99 HD2 PRO 99 -1.821 -0.432 -6.051 756 HD3 PRO 99 HD3 PRO 99 -1.236 -0.715 -7.705 757 H MET 100 H MET 100 -4.449 3.582 -9.108 758 HA MET 100 HA MET 100 -5.299 4.857 -6.794 759 HB2 MET 100 HB2 MET 100 -5.228 5.686 -9.244 760 HB3 MET 100 HB3 MET 100 -6.831 4.986 -9.393 761 HG2 MET 100 HG2 MET 100 -5.986 7.221 -7.556 762 HG3 MET 100 HG3 MET 100 -6.998 7.350 -8.989 763 HE1 MET 100 HE1 MET 100 -6.712 5.784 -5.408 764 HE2 MET 100 HE2 MET 100 -8.266 6.322 -4.760 765 HE3 MET 100 HE3 MET 100 -7.084 7.508 -5.311 766 H GLY 101 H GLY 101 -6.451 3.815 -5.250 767 HA2 GLY 101 HA2 GLY 101 -9.174 2.983 -5.879 768 HA3 GLY 101 HA3 GLY 101 -8.112 1.686 -5.348 769 HA PRO 102 HA PRO 102 -10.340 3.758 -1.693 770 HB2 PRO 102 HB2 PRO 102 -10.856 1.313 -0.476 771 HB3 PRO 102 HB3 PRO 102 -11.988 2.185 -1.514 772 HG2 PRO 102 HG2 PRO 102 -10.150 -0.078 -2.198 773 HG3 PRO 102 HG3 PRO 102 -11.822 0.201 -2.716 774 HD2 PRO 102 HD2 PRO 102 -9.767 0.712 -4.355 775 HD3 PRO 102 HD3 PRO 102 -11.193 1.771 -4.322 776 H TYR 103 H TYR 103 -8.028 1.079 -1.873 777 HA TYR 103 HA TYR 103 -6.947 1.331 0.727 778 HB2 TYR 103 HB2 TYR 103 -5.723 0.237 -1.822 779 HB3 TYR 103 HB3 TYR 103 -5.005 0.064 -0.222 780 HD1 TYR 103 HD2 TYR 103 -8.159 -0.674 -2.095 781 HD2 TYR 103 HD1 TYR 103 -5.550 -1.801 1.078 782 HE1 TYR 103 HE2 TYR 103 -9.503 -2.696 -1.709 783 HE2 TYR 103 HE1 TYR 103 -6.884 -3.824 1.465 784 HH TYR 103 HH TYR 103 -8.954 -5.098 -0.651 785 H ALA 104 H ALA 104 -5.667 2.507 -2.401 786 HA ALA 104 HA ALA 104 -3.593 4.085 -1.393 787 HB1 ALA 104 HB1 ALA 104 -3.842 3.523 -3.772 788 HB2 ALA 104 HB2 ALA 104 -3.658 5.261 -3.534 789 HB3 ALA 104 HB3 ALA 104 -5.251 4.580 -3.873 790 H ASN 105 H ASN 105 -7.003 4.825 -1.873 791 HA ASN 105 HA ASN 105 -7.048 7.559 -1.408 792 HB2 ASN 105 HB2 ASN 105 -9.012 6.517 -2.214 793 HB3 ASN 105 HB3 ASN 105 -9.050 5.365 -0.887 794 HD21 ASN 105 HD21 ASN 105 -9.948 5.955 1.047 795 HD22 ASN 105 HD22 ASN 105 -10.848 7.415 1.258 796 H MET 106 H MET 106 -6.449 5.018 0.870 797 HA MET 106 HA MET 106 -7.165 6.515 3.228 798 HB2 MET 106 HB2 MET 106 -5.490 4.007 2.965 799 HB3 MET 106 HB3 MET 106 -6.178 4.640 4.456 800 HG2 MET 106 HG2 MET 106 -7.791 3.736 2.081 801 HG3 MET 106 HG3 MET 106 -7.447 2.744 3.498 802 HE1 MET 106 HE1 MET 106 -8.726 2.869 5.724 803 HE2 MET 106 HE2 MET 106 -9.487 4.349 6.312 804 HE3 MET 106 HE3 MET 106 -7.752 4.320 5.987 805 H VAL 107 H VAL 107 -4.449 6.528 1.170 806 HA VAL 107 HA VAL 107 -2.811 7.849 3.243 807 HB VAL 107 HB VAL 107 -0.776 6.865 2.188 808 HG11 VAL 107 HG11 VAL 107 -1.704 5.904 4.228 809 HG12 VAL 107 HG12 VAL 107 -1.018 4.644 3.202 810 HG13 VAL 107 HG13 VAL 107 -2.767 4.867 3.273 811 HG21 VAL 107 HG21 VAL 107 -1.718 6.347 -0.015 812 HG22 VAL 107 HG22 VAL 107 -2.758 5.121 0.710 813 HG23 VAL 107 HG23 VAL 107 -1.007 4.911 0.727 814 H ILE 108 H ILE 108 -4.029 8.007 0.015 815 HA ILE 108 HA ILE 108 -2.002 9.972 -0.782 816 HB ILE 108 HB ILE 108 -2.733 9.786 -3.006 817 HG12 ILE 108 HG12 ILE 108 -5.088 8.097 -2.126 818 HG13 ILE 108 HG13 ILE 108 -5.203 9.827 -2.442 819 HG21 ILE 108 HG21 ILE 108 -2.797 7.068 -1.691 820 HG22 ILE 108 HG22 ILE 108 -1.391 7.910 -2.344 821 HG23 ILE 108 HG23 ILE 108 -2.655 7.327 -3.428 822 HD11 ILE 108 HD11 ILE 108 -4.392 9.422 -4.723 823 HD12 ILE 108 HD12 ILE 108 -5.923 8.615 -4.369 824 HD13 ILE 108 HD13 ILE 108 -4.419 7.691 -4.393 825 H ASP 109 H ASP 109 -2.952 11.805 -2.220 826 HA ASP 109 HA ASP 109 -5.076 13.156 -0.713 827 HB2 ASP 109 HB2 ASP 109 -2.971 14.374 -0.864 828 HB3 ASP 109 HB3 ASP 109 -2.986 14.237 -2.619 829 HA PRO 110 HA PRO 110 -7.567 12.253 -4.391 830 HB2 PRO 110 HB2 PRO 110 -9.973 12.723 -3.292 831 HB3 PRO 110 HB3 PRO 110 -9.039 11.273 -2.902 832 HG2 PRO 110 HG2 PRO 110 -9.343 13.811 -1.333 833 HG3 PRO 110 HG3 PRO 110 -9.360 12.133 -0.760 834 HD2 PRO 110 HD2 PRO 110 -7.166 13.795 -0.618 835 HD3 PRO 110 HD3 PRO 110 -7.071 12.023 -0.660 836 H SER 111 H SER 111 -6.860 15.181 -2.955 837 HA SER 111 HA SER 111 -8.792 16.871 -4.271 838 HB2 SER 111 HB2 SER 111 -6.150 17.691 -3.037 839 HB3 SER 111 HB3 SER 111 -7.568 18.705 -3.307 840 HG SER 111 HG SER 111 -6.975 17.047 -1.230 841 H THR 112 H THR 112 -7.876 15.421 -6.321 842 HA THR 112 HA THR 112 -5.579 16.794 -7.539 843 HB THR 112 HB THR 112 -5.537 14.930 -9.160 844 HG1 THR 112 HG1 THR 112 -8.019 14.517 -8.358 845 HG21 THR 112 HG21 THR 112 -4.235 14.755 -7.088 846 HG22 THR 112 HG22 THR 112 -4.822 13.173 -7.601 847 HG23 THR 112 HG23 THR 112 -5.617 14.022 -6.275 848 H ASP 113 H ASP 113 -6.481 18.686 -8.327 849 HA ASP 113 HA ASP 113 -8.544 18.458 -10.407 850 HB2 ASP 113 HB2 ASP 113 -7.291 20.901 -9.122 851 HB3 ASP 113 HB3 ASP 113 -8.540 20.949 -10.364 852 H GLY 114 H GLY 114 -8.157 18.916 -12.557 853 HA2 GLY 114 HA2 GLY 114 -6.424 20.098 -14.065 854 HA3 GLY 114 HA3 GLY 114 -5.299 18.970 -13.318 855 H THR 115 H THR 115 -5.761 19.104 -16.110 856 HA THR 115 HA THR 115 -7.692 17.120 -16.894 857 HB THR 115 HB THR 115 -6.719 17.376 -19.175 858 HG1 THR 115 HG1 THR 115 -5.229 19.419 -19.105 859 HG21 THR 115 HG21 THR 115 -7.387 19.947 -17.729 860 HG22 THR 115 HG22 THR 115 -8.539 18.835 -18.470 861 HG23 THR 115 HG23 THR 115 -7.402 19.730 -19.480 862 H GLY 116 H GLY 116 -4.409 16.934 -15.868 863 HA2 GLY 116 HA2 GLY 116 -4.385 14.076 -16.587 864 HA3 GLY 116 HA3 GLY 116 -3.041 15.075 -17.108 865 H MET 117 H MET 117 -3.479 12.749 -15.127 866 HA MET 117 HA MET 117 -2.383 13.883 -12.669 867 HB2 MET 117 HB2 MET 117 -3.021 11.019 -13.422 868 HB3 MET 117 HB3 MET 117 -2.504 11.556 -11.828 869 HG2 MET 117 HG2 MET 117 -4.535 12.908 -11.628 870 HG3 MET 117 HG3 MET 117 -5.048 12.368 -13.225 871 HE1 MET 117 HE1 MET 117 -3.243 10.214 -10.437 872 HE2 MET 117 HE2 MET 117 -4.635 9.552 -9.580 873 HE3 MET 117 HE3 MET 117 -4.305 11.283 -9.517 874 HA PRO 118 HA PRO 118 1.911 12.982 -13.561 875 HB2 PRO 118 HB2 PRO 118 2.790 12.077 -11.115 876 HB3 PRO 118 HB3 PRO 118 2.542 13.783 -11.505 877 HG2 PRO 118 HG2 PRO 118 0.733 11.893 -10.038 878 HG3 PRO 118 HG3 PRO 118 1.121 13.585 -9.670 879 HD2 PRO 118 HD2 PRO 118 -1.188 12.886 -10.875 880 HD3 PRO 118 HD3 PRO 118 -0.349 14.401 -11.271 881 H GLN 119 H GLN 119 2.206 11.284 -14.907 882 HA GLN 119 HA GLN 119 1.020 8.750 -14.529 883 HB2 GLN 119 HB2 GLN 119 1.574 9.851 -16.722 884 HB3 GLN 119 HB3 GLN 119 3.256 9.416 -16.447 885 HG2 GLN 119 HG2 GLN 119 2.606 7.037 -16.394 886 HG3 GLN 119 HG3 GLN 119 0.940 7.503 -16.733 887 HE21 GLN 119 HE21 GLN 119 0.440 8.355 -18.777 888 HE22 GLN 119 HE22 GLN 119 1.460 8.074 -20.139 889 H PHE 120 H PHE 120 3.933 9.924 -13.211 890 HA PHE 120 HA PHE 120 4.667 7.213 -12.402 891 HB2 PHE 120 HB2 PHE 120 7.015 7.489 -13.039 892 HB3 PHE 120 HB3 PHE 120 5.956 7.618 -14.440 893 HD1 PHE 120 HD1 PHE 120 5.446 9.909 -15.376 894 HD2 PHE 120 HD2 PHE 120 8.484 9.239 -12.461 895 HE1 PHE 120 HE1 PHE 120 6.486 12.059 -15.967 896 HE2 PHE 120 HE2 PHE 120 9.525 11.387 -13.050 897 HZ PHE 120 HZ PHE 120 8.527 12.800 -14.802 898 H LYS 121 H LYS 121 3.727 9.894 -11.177 899 HA LYS 121 HA LYS 121 5.551 9.745 -8.880 900 HB2 LYS 121 HB2 LYS 121 4.675 12.307 -10.195 901 HB3 LYS 121 HB3 LYS 121 5.386 12.219 -8.587 902 HG2 LYS 121 HG2 LYS 121 7.268 10.875 -9.904 903 HG3 LYS 121 HG3 LYS 121 6.649 11.839 -11.246 904 HD2 LYS 121 HD2 LYS 121 8.438 13.057 -10.267 905 HD3 LYS 121 HD3 LYS 121 6.945 13.861 -9.800 906 HE2 LYS 121 HE2 LYS 121 7.033 12.689 -7.620 907 HE3 LYS 121 HE3 LYS 121 8.578 11.982 -8.093 908 HZ1 LYS 121 HZ1 LYS 121 8.010 14.881 -7.762 909 HZ2 LYS 121 HZ2 LYS 121 9.488 14.228 -8.255 910 HZ3 LYS 121 HZ3 LYS 121 8.907 13.915 -6.703 911 H GLY 122 H GLY 122 4.583 10.505 -6.845 912 HA2 GLY 122 HA2 GLY 122 1.668 10.760 -6.850 913 HA3 GLY 122 HA3 GLY 122 2.322 9.307 -6.122 914 H VAL 123 H VAL 123 1.452 9.801 -4.124 915 HA VAL 123 HA VAL 123 2.273 12.263 -2.746 916 HB VAL 123 HB VAL 123 0.436 10.032 -1.830 917 HG11 VAL 123 HG11 VAL 123 -0.251 11.579 -0.048 918 HG12 VAL 123 HG12 VAL 123 0.970 12.735 -0.582 919 HG13 VAL 123 HG13 VAL 123 1.462 11.171 0.073 920 HG21 VAL 123 HG21 VAL 123 -1.382 11.617 -2.272 921 HG22 VAL 123 HG22 VAL 123 -0.467 11.263 -3.738 922 HG23 VAL 123 HG23 VAL 123 -0.213 12.788 -2.889 923 H LYS 124 H LYS 124 3.962 12.326 -1.387 924 HA LYS 124 HA LYS 124 5.569 9.993 -0.959 925 HB2 LYS 124 HB2 LYS 124 5.840 12.779 0.195 926 HB3 LYS 124 HB3 LYS 124 7.071 11.519 0.269 927 HG2 LYS 124 HG2 LYS 124 7.203 11.505 -2.176 928 HG3 LYS 124 HG3 LYS 124 5.971 12.764 -2.250 929 HD2 LYS 124 HD2 LYS 124 7.466 14.287 -1.028 930 HD3 LYS 124 HD3 LYS 124 8.699 13.024 -0.971 931 HE2 LYS 124 HE2 LYS 124 8.814 13.011 -3.413 932 HE3 LYS 124 HE3 LYS 124 7.550 14.240 -3.488 933 HZ1 LYS 124 HZ1 LYS 124 10.232 14.584 -2.263 934 HZ2 LYS 124 HZ2 LYS 124 9.022 15.766 -2.336 935 HZ3 LYS 124 HZ3 LYS 124 9.738 15.203 -3.759 936 H GLY 125 H GLY 125 6.195 9.043 1.023 937 HA2 GLY 125 HA2 GLY 125 5.068 9.623 3.544 938 HA3 GLY 125 HA3 GLY 125 4.100 8.386 2.756 939 H THR 126 H THR 126 4.600 6.625 4.008 940 HA THR 126 HA THR 126 7.360 5.623 3.893 941 HB THR 126 HB THR 126 7.326 4.963 6.277 942 HG1 THR 126 HG1 THR 126 4.916 6.484 6.321 943 HG21 THR 126 HG21 THR 126 8.442 7.059 5.647 944 HG22 THR 126 HG22 THR 126 7.730 7.171 7.256 945 HG23 THR 126 HG23 THR 126 6.928 7.935 5.885 946 H VAL 127 H VAL 127 7.536 3.331 4.529 947 HA VAL 127 HA VAL 127 5.036 1.801 4.571 948 HB VAL 127 HB VAL 127 5.777 1.908 2.194 949 HG11 VAL 127 HG11 VAL 127 7.790 0.701 1.485 950 HG12 VAL 127 HG12 VAL 127 8.213 0.410 3.172 951 HG13 VAL 127 HG13 VAL 127 8.189 2.057 2.541 952 HG21 VAL 127 HG21 VAL 127 4.476 -0.006 2.986 953 HG22 VAL 127 HG22 VAL 127 5.962 -0.841 3.438 954 HG23 VAL 127 HG23 VAL 127 5.627 -0.498 1.741 955 H GLU 128 H GLU 128 5.182 -0.181 5.654 956 HA GLU 128 HA GLU 128 7.757 -1.139 6.621 957 HB2 GLU 128 HB2 GLU 128 6.957 -1.111 9.009 958 HB3 GLU 128 HB3 GLU 128 7.287 0.478 8.325 959 HG2 GLU 128 HG2 GLU 128 4.939 0.889 8.004 960 HG3 GLU 128 HG3 GLU 128 4.542 -0.751 8.507 961 H LYS 129 H LYS 129 7.724 -3.282 7.408 962 HA LYS 129 HA LYS 129 5.711 -5.071 6.568 963 HB2 LYS 129 HB2 LYS 129 7.885 -5.963 6.917 964 HB3 LYS 129 HB3 LYS 129 7.996 -5.289 8.532 965 HG2 LYS 129 HG2 LYS 129 7.645 -7.500 9.026 966 HG3 LYS 129 HG3 LYS 129 5.988 -6.912 9.030 967 HD2 LYS 129 HD2 LYS 129 5.938 -8.930 7.804 968 HD3 LYS 129 HD3 LYS 129 5.872 -7.646 6.593 969 HE2 LYS 129 HE2 LYS 129 8.187 -7.931 6.060 970 HE3 LYS 129 HE3 LYS 129 8.428 -9.020 7.425 971 HZ1 LYS 129 HZ1 LYS 129 8.277 -10.270 5.405 972 HZ2 LYS 129 HZ2 LYS 129 6.796 -9.560 5.009 973 HZ3 LYS 129 HZ3 LYS 129 6.910 -10.592 6.346 974 H THR 130 H THR 130 3.887 -5.893 7.585 975 HA THR 130 HA THR 130 3.459 -5.195 10.419 976 HB THR 130 HB THR 130 2.165 -3.556 9.157 977 HG1 THR 130 HG1 THR 130 1.077 -4.053 10.972 978 HG21 THR 130 HG21 THR 130 1.844 -4.841 7.080 979 HG22 THR 130 HG22 THR 130 0.318 -4.221 7.704 980 HG23 THR 130 HG23 THR 130 0.733 -5.920 7.926 981 H ASP 131 H ASP 131 2.018 -6.550 11.571 982 HA ASP 131 HA ASP 131 1.833 -9.267 10.461 983 HB2 ASP 131 HB2 ASP 131 3.039 -8.919 12.611 984 HB3 ASP 131 HB3 ASP 131 1.552 -8.310 13.326 985 H GLU 132 H GLU 132 -0.048 -6.675 10.431 986 HA GLU 132 HA GLU 132 -2.561 -7.768 11.347 987 HB2 GLU 132 HB2 GLU 132 -1.744 -5.235 9.945 988 HB3 GLU 132 HB3 GLU 132 -3.442 -5.673 10.075 989 HG2 GLU 132 HG2 GLU 132 -1.570 -5.354 12.413 990 HG3 GLU 132 HG3 GLU 132 -2.679 -4.114 11.831 991 H LYS 133 H LYS 133 -4.434 -7.271 9.598 992 HA LYS 133 HA LYS 133 -3.860 -9.027 7.310 993 HB2 LYS 133 HB2 LYS 133 -6.276 -9.346 7.159 994 HB3 LYS 133 HB3 LYS 133 -5.729 -9.678 8.798 995 HG2 LYS 133 HG2 LYS 133 -6.555 -7.550 9.568 996 HG3 LYS 133 HG3 LYS 133 -6.958 -7.064 7.922 997 HD2 LYS 133 HD2 LYS 133 -8.605 -8.906 7.809 998 HD3 LYS 133 HD3 LYS 133 -8.228 -9.325 9.482 999 HE2 LYS 133 HE2 LYS 133 -9.318 -6.663 8.555 1000 HE3 LYS 133 HE3 LYS 133 -10.279 -7.957 9.269 1001 HZ1 LYS 133 HZ1 LYS 133 -9.703 -6.279 10.900 1002 HZ2 LYS 133 HZ2 LYS 133 -8.053 -6.512 10.610 1003 HZ3 LYS 133 HZ3 LYS 133 -8.975 -7.755 11.295 1004 H VAL 134 H VAL 134 -4.561 -8.447 5.187 1005 HA VAL 134 HA VAL 134 -4.403 -5.721 4.454 1006 HB VAL 134 HB VAL 134 -5.535 -8.072 2.915 1007 HG11 VAL 134 HG11 VAL 134 -4.738 -5.343 1.882 1008 HG12 VAL 134 HG12 VAL 134 -6.387 -5.955 2.017 1009 HG13 VAL 134 HG13 VAL 134 -5.256 -6.715 0.900 1010 HG21 VAL 134 HG21 VAL 134 -3.204 -8.383 3.491 1011 HG22 VAL 134 HG22 VAL 134 -2.804 -6.780 2.875 1012 HG23 VAL 134 HG23 VAL 134 -3.345 -8.040 1.766 1013 H LEU 135 H LEU 135 -5.908 -4.151 4.592 1014 HA LEU 135 HA LEU 135 -8.421 -4.630 5.780 1015 HB2 LEU 135 HB2 LEU 135 -6.921 -2.310 4.887 1016 HB3 LEU 135 HB3 LEU 135 -8.623 -2.132 4.512 1017 HG LEU 135 HG LEU 135 -7.388 -2.540 7.239 1018 HD11 LEU 135 HD11 LEU 135 -8.487 -0.397 7.717 1019 HD12 LEU 135 HD12 LEU 135 -9.031 -0.310 6.040 1020 HD13 LEU 135 HD13 LEU 135 -7.306 -0.260 6.413 1021 HD21 LEU 135 HD21 LEU 135 -9.707 -2.441 8.102 1022 HD22 LEU 135 HD22 LEU 135 -9.386 -3.890 7.153 1023 HD23 LEU 135 HD23 LEU 135 -10.304 -2.560 6.444 1024 H SER 136 H SER 136 -9.615 -6.093 4.613 1025 HA SER 136 HA SER 136 -10.043 -6.332 1.924 1026 HB2 SER 136 HB2 SER 136 -12.211 -6.692 4.012 1027 HB3 SER 136 HB3 SER 136 -12.121 -7.476 2.433 1028 HG SER 136 HG SER 136 -9.934 -8.205 3.387 1029 H VAL 137 H VAL 137 -11.619 -5.603 0.436 1030 HA VAL 137 HA VAL 137 -11.816 -2.901 0.185 1031 HB VAL 137 HB VAL 137 -13.723 -4.947 -0.967 1032 HG11 VAL 137 HG11 VAL 137 -14.141 -3.267 -2.733 1033 HG12 VAL 137 HG12 VAL 137 -13.194 -2.092 -1.818 1034 HG13 VAL 137 HG13 VAL 137 -14.699 -2.727 -1.147 1035 HG21 VAL 137 HG21 VAL 137 -11.366 -5.368 -1.494 1036 HG22 VAL 137 HG22 VAL 137 -11.200 -3.720 -2.101 1037 HG23 VAL 137 HG23 VAL 137 -12.258 -4.864 -2.930 1038 H LYS 138 H LYS 138 -14.539 -4.951 1.332 1039 HA LYS 138 HA LYS 138 -16.166 -2.669 1.930 1040 HB2 LYS 138 HB2 LYS 138 -17.247 -4.758 1.387 1041 HB3 LYS 138 HB3 LYS 138 -16.450 -5.568 2.727 1042 HG2 LYS 138 HG2 LYS 138 -18.645 -5.187 3.448 1043 HG3 LYS 138 HG3 LYS 138 -17.678 -3.965 4.257 1044 HD2 LYS 138 HD2 LYS 138 -19.719 -2.963 3.481 1045 HD3 LYS 138 HD3 LYS 138 -18.378 -2.333 2.530 1046 HE2 LYS 138 HE2 LYS 138 -18.941 -3.745 0.677 1047 HE3 LYS 138 HE3 LYS 138 -20.140 -4.613 1.635 1048 HZ1 LYS 138 HZ1 LYS 138 -21.362 -2.478 1.832 1049 HZ2 LYS 138 HZ2 LYS 138 -21.275 -3.071 0.255 1050 HZ3 LYS 138 HZ3 LYS 138 -20.284 -1.787 0.725 1051 H GLU 139 H GLU 139 -14.094 -4.792 3.882 1052 HA GLU 139 HA GLU 139 -14.694 -3.845 6.444 1053 HB2 GLU 139 HB2 GLU 139 -13.231 -5.789 5.947 1054 HB3 GLU 139 HB3 GLU 139 -11.994 -4.694 5.349 1055 HG2 GLU 139 HG2 GLU 139 -11.367 -5.361 7.537 1056 HG3 GLU 139 HG3 GLU 139 -11.888 -3.678 7.630 1057 H LEU 140 H LEU 140 -12.526 -2.584 3.989 1058 HA LEU 140 HA LEU 140 -11.444 -0.385 5.351 1059 HB2 LEU 140 HB2 LEU 140 -10.944 -1.557 3.033 1060 HB3 LEU 140 HB3 LEU 140 -12.017 -0.318 2.415 1061 HG LEU 140 HG LEU 140 -9.642 0.386 4.112 1062 HD11 LEU 140 HD11 LEU 140 -9.685 0.043 1.116 1063 HD12 LEU 140 HD12 LEU 140 -8.826 -0.979 2.269 1064 HD13 LEU 140 HD13 LEU 140 -8.354 0.708 2.067 1065 HD21 LEU 140 HD21 LEU 140 -9.805 2.510 2.890 1066 HD22 LEU 140 HD22 LEU 140 -11.287 2.139 3.768 1067 HD23 LEU 140 HD23 LEU 140 -11.214 1.894 2.022 1068 H LEU 141 H LEU 141 -14.387 -0.761 3.386 1069 HA LEU 141 HA LEU 141 -15.298 1.906 3.458 1070 HB2 LEU 141 HB2 LEU 141 -17.038 -0.569 3.488 1071 HB3 LEU 141 HB3 LEU 141 -17.481 1.025 2.902 1072 HG LEU 141 HG LEU 141 -15.399 -0.763 1.638 1073 HD11 LEU 141 HD11 LEU 141 -17.612 -1.729 1.414 1074 HD12 LEU 141 HD12 LEU 141 -17.052 -1.098 -0.142 1075 HD13 LEU 141 HD13 LEU 141 -18.240 -0.193 0.797 1076 HD21 LEU 141 HD21 LEU 141 -15.486 0.810 -0.230 1077 HD22 LEU 141 HD22 LEU 141 -14.953 1.603 1.252 1078 HD23 LEU 141 HD23 LEU 141 -16.605 1.835 0.674 1079 H GLU 142 H GLU 142 -15.846 -0.820 5.645 1080 HA GLU 142 HA GLU 142 -17.551 0.422 7.496 1081 HB2 GLU 142 HB2 GLU 142 -15.436 -1.665 8.095 1082 HB3 GLU 142 HB3 GLU 142 -16.876 -1.328 9.045 1083 HG2 GLU 142 HG2 GLU 142 -16.998 -2.294 6.198 1084 HG3 GLU 142 HG3 GLU 142 -16.922 -3.387 7.572 1085 H ALA 143 H ALA 143 -14.012 0.184 7.410 1086 HA ALA 143 HA ALA 143 -13.409 1.490 9.795 1087 HB1 ALA 143 HB1 ALA 143 -11.813 1.473 7.235 1088 HB2 ALA 143 HB2 ALA 143 -11.771 0.237 8.492 1089 HB3 ALA 143 HB3 ALA 143 -11.190 1.866 8.838 1090 H ILE 144 H ILE 144 -13.887 2.893 6.543 1091 HA ILE 144 HA ILE 144 -13.304 5.552 7.448 1092 HB ILE 144 HB ILE 144 -13.983 6.322 5.223 1093 HG12 ILE 144 HG12 ILE 144 -14.375 4.317 3.535 1094 HG13 ILE 144 HG13 ILE 144 -14.999 3.512 4.966 1095 HG21 ILE 144 HG21 ILE 144 -12.248 5.159 3.955 1096 HG22 ILE 144 HG22 ILE 144 -12.206 3.886 5.173 1097 HG23 ILE 144 HG23 ILE 144 -11.714 5.528 5.595 1098 HD11 ILE 144 HD11 ILE 144 -16.020 6.091 3.791 1099 HD12 ILE 144 HD12 ILE 144 -16.646 5.308 5.243 1100 HD13 ILE 144 HD13 ILE 144 -16.790 4.509 3.678 1101 H GLY 145 H GLY 145 -16.166 3.625 7.430 1102 HA2 GLY 145 HA2 GLY 145 -17.649 5.281 9.050 1103 HA3 GLY 145 HA3 GLY 145 -18.040 5.806 7.423 1104 H SER 146 H SER 146 -18.167 3.411 6.046 1105 HA SER 146 HA SER 146 -19.901 1.550 7.400 1106 HB2 SER 146 HB2 SER 146 -21.489 3.412 7.088 1107 HB3 SER 146 HB3 SER 146 -21.165 3.399 5.354 1108 HG SER 146 HG SER 146 -23.067 2.227 5.932 Start of MODEL 10 1 H1 MET 1 H1 MET 1 -27.977 -15.045 38.754 2 H2 MET 1 H2 MET 1 -28.697 -16.529 39.118 3 H3 MET 1 H3 MET 1 -29.581 -15.343 38.300 4 HA MET 1 HA MET 1 -28.884 -17.060 36.774 5 HB2 MET 1 HB2 MET 1 -27.366 -14.465 36.392 6 HB3 MET 1 HB3 MET 1 -27.720 -15.629 35.123 7 HG2 MET 1 HG2 MET 1 -30.120 -15.236 35.449 8 HG3 MET 1 HG3 MET 1 -29.748 -14.048 36.699 9 HE1 MET 1 HE1 MET 1 -27.133 -12.658 35.435 10 HE2 MET 1 HE2 MET 1 -28.437 -11.753 36.203 11 HE3 MET 1 HE3 MET 1 -27.871 -11.288 34.601 12 H GLY 2 H GLY 2 -27.653 -18.814 37.335 13 HA2 GLY 2 HA2 GLY 2 -24.796 -18.439 37.935 14 HA3 GLY 2 HA3 GLY 2 -25.729 -19.904 38.199 15 H SER 3 H SER 3 -23.542 -18.332 36.147 16 HA SER 3 HA SER 3 -23.498 -20.613 34.348 17 HB2 SER 3 HB2 SER 3 -23.652 -19.265 32.290 18 HB3 SER 3 HB3 SER 3 -25.130 -19.132 33.243 19 HG SER 3 HG SER 3 -24.774 -17.065 32.973 20 H SER 4 H SER 4 -21.515 -20.858 33.235 21 HA SER 4 HA SER 4 -19.415 -18.888 33.719 22 HB2 SER 4 HB2 SER 4 -17.898 -20.637 34.701 23 HB3 SER 4 HB3 SER 4 -19.264 -20.211 35.734 24 HG SER 4 HG SER 4 -18.625 -22.593 35.147 25 H HIS 5 H HIS 5 -18.234 -18.662 31.945 26 HA HIS 5 HA HIS 5 -17.613 -21.050 30.309 27 HB2 HIS 5 HB2 HIS 5 -17.991 -18.180 29.405 28 HB3 HIS 5 HB3 HIS 5 -17.297 -19.437 28.390 29 HD1 HIS 5 HD1 HIS 5 -20.081 -17.795 28.021 30 HD2 HIS 5 HD2 HIS 5 -19.599 -21.765 29.163 31 HE1 HIS 5 HE1 HIS 5 -22.220 -18.943 27.386 32 HE2 HIS 5 HE2 HIS 5 -21.921 -21.334 28.104 33 H HIS 6 H HIS 6 -15.467 -21.381 29.759 34 HA HIS 6 HA HIS 6 -13.569 -19.881 31.402 35 HB2 HIS 6 HB2 HIS 6 -13.241 -22.485 29.896 36 HB3 HIS 6 HB3 HIS 6 -12.032 -21.763 30.960 37 HD1 HIS 6 HD1 HIS 6 -15.271 -23.611 30.996 38 HD2 HIS 6 HD2 HIS 6 -12.615 -21.940 33.721 39 HE1 HIS 6 HE1 HIS 6 -15.979 -24.468 33.245 40 HE2 HIS 6 HE2 HIS 6 -14.477 -23.302 34.880 41 H HIS 7 H HIS 7 -11.716 -18.908 30.665 42 HA HIS 7 HA HIS 7 -11.856 -18.031 27.871 43 HB2 HIS 7 HB2 HIS 7 -10.289 -16.830 30.167 44 HB3 HIS 7 HB3 HIS 7 -10.521 -16.121 28.571 45 HD1 HIS 7 HD1 HIS 7 -12.272 -16.699 31.829 46 HD2 HIS 7 HD2 HIS 7 -13.032 -14.939 28.140 47 HE1 HIS 7 HE1 HIS 7 -14.382 -15.379 32.134 48 HE2 HIS 7 HE2 HIS 7 -14.695 -14.166 29.960 49 H HIS 8 H HIS 8 -10.899 -20.197 27.304 50 HA HIS 8 HA HIS 8 -8.156 -20.734 27.837 51 HB2 HIS 8 HB2 HIS 8 -8.380 -22.339 25.883 52 HB3 HIS 8 HB3 HIS 8 -9.493 -22.590 27.218 53 HD1 HIS 8 HD1 HIS 8 -10.648 -23.956 25.087 54 HD2 HIS 8 HD2 HIS 8 -10.947 -19.809 25.115 55 HE1 HIS 8 HE1 HIS 8 -12.561 -23.405 23.563 56 HE2 HIS 8 HE2 HIS 8 -12.697 -20.896 23.554 57 H HIS 9 H HIS 9 -6.319 -20.056 26.849 58 HA HIS 9 HA HIS 9 -6.553 -18.466 24.374 59 HB2 HIS 9 HB2 HIS 9 -6.535 -16.945 26.339 60 HB3 HIS 9 HB3 HIS 9 -4.989 -17.622 26.834 61 HD1 HIS 9 HD1 HIS 9 -6.521 -15.582 24.033 62 HD2 HIS 9 HD2 HIS 9 -2.801 -16.448 25.667 63 HE1 HIS 9 HE1 HIS 9 -4.906 -14.056 22.870 64 HE2 HIS 9 HE2 HIS 9 -2.646 -14.791 23.688 65 H HIS 10 H HIS 10 -4.619 -18.325 23.094 66 HA HIS 10 HA HIS 10 -2.836 -20.578 23.320 67 HB2 HIS 10 HB2 HIS 10 -2.699 -18.185 21.464 68 HB3 HIS 10 HB3 HIS 10 -1.755 -19.665 21.304 69 HD1 HIS 10 HD1 HIS 10 -3.992 -18.417 19.292 70 HD2 HIS 10 HD2 HIS 10 -4.352 -21.739 21.764 71 HE1 HIS 10 HE1 HIS 10 -5.811 -19.822 18.277 72 HE2 HIS 10 HE2 HIS 10 -5.987 -21.837 19.767 73 H SER 11 H SER 11 -0.966 -20.670 24.401 74 HA SER 11 HA SER 11 -0.195 -18.490 26.078 75 HB2 SER 11 HB2 SER 11 1.241 -21.114 25.587 76 HB3 SER 11 HB3 SER 11 1.524 -20.008 26.930 77 HG SER 11 HG SER 11 -0.013 -21.962 27.107 78 H SER 12 H SER 12 0.441 -16.793 24.661 79 HA SER 12 HA SER 12 2.709 -17.109 22.904 80 HB2 SER 12 HB2 SER 12 0.984 -15.388 22.460 81 HB3 SER 12 HB3 SER 12 1.437 -14.556 23.947 82 HG SER 12 HG SER 12 2.552 -14.392 21.505 83 H GLY 13 H GLY 13 4.846 -16.517 23.260 84 HA2 GLY 13 HA2 GLY 13 5.568 -16.374 26.113 85 HA3 GLY 13 HA3 GLY 13 6.589 -16.988 24.828 86 H ARG 14 H ARG 14 8.111 -15.585 26.085 87 HA ARG 14 HA ARG 14 7.926 -12.726 25.410 88 HB2 ARG 14 HB2 ARG 14 9.753 -14.226 27.306 89 HB3 ARG 14 HB3 ARG 14 9.909 -12.513 26.954 90 HG2 ARG 14 HG2 ARG 14 8.785 -12.817 29.060 91 HG3 ARG 14 HG3 ARG 14 7.664 -12.126 27.890 92 HD2 ARG 14 HD2 ARG 14 6.452 -14.121 27.694 93 HD3 ARG 14 HD3 ARG 14 7.761 -15.093 28.362 94 HE ARG 14 HE ARG 14 7.202 -14.290 30.534 95 HH11 ARG 14 HH11 ARG 14 4.932 -13.312 28.120 96 HH12 ARG 14 HH12 ARG 14 3.673 -13.057 29.274 97 HH21 ARG 14 HH21 ARG 14 5.566 -13.978 31.978 98 HH22 ARG 14 HH22 ARG 14 4.028 -13.403 31.427 99 H GLU 15 H GLU 15 8.900 -12.107 23.571 100 HA GLU 15 HA GLU 15 11.258 -13.627 22.638 101 HB2 GLU 15 HB2 GLU 15 9.145 -12.176 21.027 102 HB3 GLU 15 HB3 GLU 15 10.598 -12.887 20.338 103 HG2 GLU 15 HG2 GLU 15 9.872 -15.102 21.167 104 HG3 GLU 15 HG3 GLU 15 8.382 -14.364 21.756 105 H ASN 16 H ASN 16 11.908 -11.803 20.541 106 HA ASN 16 HA ASN 16 13.806 -10.191 21.684 107 HB2 ASN 16 HB2 ASN 16 13.660 -10.792 19.277 108 HB3 ASN 16 HB3 ASN 16 12.347 -9.637 19.088 109 HD21 ASN 16 HD21 ASN 16 13.462 -8.396 17.620 110 HD22 ASN 16 HD22 ASN 16 14.819 -7.425 18.048 111 H LEU 17 H LEU 17 13.446 -8.723 23.238 112 HA LEU 17 HA LEU 17 11.082 -7.146 23.457 113 HB2 LEU 17 HB2 LEU 17 13.725 -6.924 24.878 114 HB3 LEU 17 HB3 LEU 17 12.283 -6.016 25.298 115 HG LEU 17 HG LEU 17 12.727 -8.989 25.536 116 HD11 LEU 17 HD11 LEU 17 12.183 -8.574 27.877 117 HD12 LEU 17 HD12 LEU 17 11.976 -6.859 27.522 118 HD13 LEU 17 HD13 LEU 17 13.562 -7.608 27.353 119 HD21 LEU 17 HD21 LEU 17 10.388 -9.160 26.285 120 HD22 LEU 17 HD22 LEU 17 10.504 -8.677 24.595 121 HD23 LEU 17 HD23 LEU 17 10.126 -7.475 25.829 122 H TYR 18 H TYR 18 11.058 -4.764 23.581 123 HA TYR 18 HA TYR 18 11.255 -2.715 22.633 124 HB2 TYR 18 HB2 TYR 18 14.125 -3.587 22.241 125 HB3 TYR 18 HB3 TYR 18 13.534 -1.950 22.005 126 HD1 TYR 18 HD2 TYR 18 12.776 -0.606 23.946 127 HD2 TYR 18 HD1 TYR 18 14.508 -4.464 24.457 128 HE1 TYR 18 HE2 TYR 18 13.126 -0.128 26.330 129 HE2 TYR 18 HE1 TYR 18 14.861 -3.994 26.846 130 HH TYR 18 HH TYR 18 15.139 -1.876 28.293 131 H PHE 19 H PHE 19 10.847 -5.255 20.947 132 HA PHE 19 HA PHE 19 11.803 -5.005 18.371 133 HB2 PHE 19 HB2 PHE 19 10.546 -6.954 19.116 134 HB3 PHE 19 HB3 PHE 19 9.084 -5.986 19.272 135 HD1 PHE 19 HD2 PHE 19 11.621 -7.015 16.738 136 HD2 PHE 19 HD1 PHE 19 7.578 -5.912 17.499 137 HE1 PHE 19 HE2 PHE 19 11.046 -7.524 14.405 138 HE2 PHE 19 HE1 PHE 19 6.999 -6.418 15.162 139 HZ PHE 19 HZ PHE 19 8.732 -7.226 13.610 140 H GLN 20 H GLN 20 11.523 -3.616 16.764 141 HA GLN 20 HA GLN 20 9.086 -2.015 16.537 142 HB2 GLN 20 HB2 GLN 20 10.595 -0.655 17.914 143 HB3 GLN 20 HB3 GLN 20 11.857 -0.798 16.698 144 HG2 GLN 20 HG2 GLN 20 10.564 0.499 15.133 145 HG3 GLN 20 HG3 GLN 20 9.188 0.528 16.235 146 HE21 GLN 20 HE21 GLN 20 10.754 2.720 15.056 147 HE22 GLN 20 HE22 GLN 20 11.315 3.659 16.392 148 H GLY 21 H GLY 21 12.020 -3.302 15.145 149 HA2 GLY 21 HA2 GLY 21 12.316 -4.061 12.970 150 HA3 GLY 21 HA3 GLY 21 10.791 -3.318 12.522 151 H HIS 22 H HIS 22 11.248 -2.042 10.828 152 HA HIS 22 HA HIS 22 12.866 0.287 11.103 153 HB2 HIS 22 HB2 HIS 22 14.716 -1.251 10.783 154 HB3 HIS 22 HB3 HIS 22 13.936 -1.969 9.382 155 HD1 HIS 22 HD1 HIS 22 15.703 1.178 10.467 156 HD2 HIS 22 HD2 HIS 22 14.408 -0.679 6.982 157 HE1 HIS 22 HE1 HIS 22 16.697 2.510 8.590 158 HE2 HIS 22 HE2 HIS 22 16.064 1.251 6.506 159 H MET 23 H MET 23 11.016 1.370 10.350 160 HA MET 23 HA MET 23 9.773 0.639 7.863 161 HB2 MET 23 HB2 MET 23 8.405 2.656 8.232 162 HB3 MET 23 HB3 MET 23 8.441 1.607 9.641 163 HG2 MET 23 HG2 MET 23 10.263 3.121 10.552 164 HG3 MET 23 HG3 MET 23 9.845 4.233 9.248 165 HE1 MET 23 HE1 MET 23 6.665 3.234 9.226 166 HE2 MET 23 HE2 MET 23 7.168 4.882 8.851 167 HE3 MET 23 HE3 MET 23 5.936 4.592 10.082 168 H LEU 24 H LEU 24 9.763 1.813 5.926 169 HA LEU 24 HA LEU 24 12.127 3.547 5.518 170 HB2 LEU 24 HB2 LEU 24 10.913 1.384 3.834 171 HB3 LEU 24 HB3 LEU 24 11.847 2.662 3.076 172 HG LEU 24 HG LEU 24 13.042 1.113 5.351 173 HD11 LEU 24 HD11 LEU 24 12.234 -0.602 3.830 174 HD12 LEU 24 HD12 LEU 24 13.988 -0.476 3.728 175 HD13 LEU 24 HD13 LEU 24 12.980 0.228 2.465 176 HD21 LEU 24 HD21 LEU 24 15.123 1.662 4.199 177 HD22 LEU 24 HD22 LEU 24 14.183 3.115 4.532 178 HD23 LEU 24 HD23 LEU 24 14.212 2.439 2.901 179 H GLU 25 H GLU 25 11.810 5.519 4.724 180 HA GLU 25 HA GLU 25 9.189 6.447 4.061 181 HB2 GLU 25 HB2 GLU 25 11.900 7.716 4.029 182 HB3 GLU 25 HB3 GLU 25 10.549 8.521 3.239 183 HG2 GLU 25 HG2 GLU 25 10.478 9.448 5.323 184 HG3 GLU 25 HG3 GLU 25 9.328 8.136 5.493 185 H VAL 26 H VAL 26 8.293 6.930 2.168 186 HA VAL 26 HA VAL 26 9.642 6.257 -0.334 187 HB VAL 26 HB VAL 26 7.797 4.657 -0.974 188 HG11 VAL 26 HG11 VAL 26 9.537 3.806 1.349 189 HG12 VAL 26 HG12 VAL 26 10.010 3.823 -0.349 190 HG13 VAL 26 HG13 VAL 26 8.746 2.725 0.203 191 HG21 VAL 26 HG21 VAL 26 7.202 4.782 1.987 192 HG22 VAL 26 HG22 VAL 26 6.536 3.589 0.869 193 HG23 VAL 26 HG23 VAL 26 6.139 5.296 0.673 194 H GLU 27 H GLU 27 8.444 6.888 -2.227 195 HA GLU 27 HA GLU 27 6.274 8.793 -1.681 196 HB2 GLU 27 HB2 GLU 27 8.177 9.531 -3.109 197 HB3 GLU 27 HB3 GLU 27 7.733 8.303 -4.290 198 HG2 GLU 27 HG2 GLU 27 5.625 9.383 -4.707 199 HG3 GLU 27 HG3 GLU 27 5.904 10.526 -3.392 200 H VAL 28 H VAL 28 4.293 8.028 -1.739 201 HA VAL 28 HA VAL 28 3.696 5.482 -3.010 202 HB VAL 28 HB VAL 28 1.894 7.221 -1.311 203 HG11 VAL 28 HG11 VAL 28 1.694 4.313 -2.102 204 HG12 VAL 28 HG12 VAL 28 0.650 5.627 -2.644 205 HG13 VAL 28 HG13 VAL 28 0.633 5.128 -0.952 206 HG21 VAL 28 HG21 VAL 28 2.486 5.732 0.556 207 HG22 VAL 28 HG22 VAL 28 3.887 6.616 -0.052 208 HG23 VAL 28 HG23 VAL 28 3.665 4.919 -0.476 209 H ILE 29 H ILE 29 3.183 5.577 -5.113 210 HA ILE 29 HA ILE 29 1.754 7.889 -6.190 211 HB ILE 29 HB ILE 29 2.575 5.523 -7.853 212 HG12 ILE 29 HG12 ILE 29 4.424 7.773 -7.000 213 HG13 ILE 29 HG13 ILE 29 4.517 6.124 -6.399 214 HG21 ILE 29 HG21 ILE 29 1.265 7.277 -8.912 215 HG22 ILE 29 HG22 ILE 29 2.912 7.300 -9.547 216 HG23 ILE 29 HG23 ILE 29 2.407 8.504 -8.355 217 HD11 ILE 29 HD11 ILE 29 4.985 5.339 -8.669 218 HD12 ILE 29 HD12 ILE 29 6.176 6.503 -8.091 219 HD13 ILE 29 HD13 ILE 29 4.938 7.009 -9.241 220 H SER 30 H SER 30 -0.194 7.677 -7.443 221 HA SER 30 HA SER 30 -1.671 5.156 -7.093 222 HB2 SER 30 HB2 SER 30 -2.388 6.810 -5.357 223 HB3 SER 30 HB3 SER 30 -2.906 7.886 -6.654 224 HG SER 30 HG SER 30 -3.870 5.251 -6.199 225 H GLY 31 H GLY 31 -1.794 4.455 -9.148 226 HA2 GLY 31 HA2 GLY 31 -2.298 6.371 -11.323 227 HA3 GLY 31 HA3 GLY 31 -1.778 4.705 -11.508 228 H ARG 32 H ARG 32 -4.364 6.783 -11.877 229 HA ARG 32 HA ARG 32 -6.449 4.854 -11.327 230 HB2 ARG 32 HB2 ARG 32 -7.985 6.581 -12.295 231 HB3 ARG 32 HB3 ARG 32 -7.047 7.116 -10.910 232 HG2 ARG 32 HG2 ARG 32 -5.575 8.391 -12.325 233 HG3 ARG 32 HG3 ARG 32 -6.333 7.735 -13.776 234 HD2 ARG 32 HD2 ARG 32 -8.423 8.840 -13.229 235 HD3 ARG 32 HD3 ARG 32 -7.753 9.414 -11.703 236 HE ARG 32 HE ARG 32 -6.548 11.034 -12.849 237 HH11 ARG 32 HH11 ARG 32 -8.173 8.969 -15.083 238 HH12 ARG 32 HH12 ARG 32 -7.998 10.074 -16.397 239 HH21 ARG 32 HH21 ARG 32 -6.340 12.441 -14.532 240 HH22 ARG 32 HH22 ARG 32 -6.971 12.021 -16.088 241 H THR 33 H THR 33 -5.512 3.206 -12.744 242 HA THR 33 HA THR 33 -6.100 3.566 -15.598 243 HB THR 33 HB THR 33 -3.962 2.501 -15.057 244 HG1 THR 33 HG1 THR 33 -5.622 0.461 -16.133 245 HG21 THR 33 HG21 THR 33 -5.612 0.289 -13.828 246 HG22 THR 33 HG22 THR 33 -4.614 1.436 -12.936 247 HG23 THR 33 HG23 THR 33 -3.861 0.286 -14.042 248 H LEU 34 H LEU 34 -7.333 1.953 -12.773 249 HA LEU 34 HA LEU 34 -9.352 0.553 -14.383 250 HB2 LEU 34 HB2 LEU 34 -9.733 -0.857 -12.416 251 HB3 LEU 34 HB3 LEU 34 -8.086 -0.929 -13.005 252 HG LEU 34 HG LEU 34 -7.716 0.931 -11.134 253 HD11 LEU 34 HD11 LEU 34 -9.055 0.517 -9.161 254 HD12 LEU 34 HD12 LEU 34 -10.015 -0.678 -10.035 255 HD13 LEU 34 HD13 LEU 34 -10.077 1.020 -10.508 256 HD21 LEU 34 HD21 LEU 34 -6.550 -1.216 -11.309 257 HD22 LEU 34 HD22 LEU 34 -7.910 -2.016 -10.522 258 HD23 LEU 34 HD23 LEU 34 -6.958 -0.821 -9.640 259 H ASN 35 H ASN 35 -9.048 2.651 -11.526 260 HA ASN 35 HA ASN 35 -11.902 3.092 -11.401 261 HB2 ASN 35 HB2 ASN 35 -10.482 3.143 -9.358 262 HB3 ASN 35 HB3 ASN 35 -9.657 4.566 -9.986 263 HD21 ASN 35 HD21 ASN 35 -10.764 6.536 -10.039 264 HD22 ASN 35 HD22 ASN 35 -12.193 6.797 -9.108 265 H GLN 36 H GLN 36 -12.357 3.874 -13.490 266 HA GLN 36 HA GLN 36 -11.208 6.508 -14.196 267 HB2 GLN 36 HB2 GLN 36 -12.369 4.389 -16.020 268 HB3 GLN 36 HB3 GLN 36 -11.693 5.929 -16.537 269 HG2 GLN 36 HG2 GLN 36 -9.503 5.269 -15.707 270 HG3 GLN 36 HG3 GLN 36 -10.167 3.740 -15.132 271 HE21 GLN 36 HE21 GLN 36 -9.240 5.588 -17.918 272 HE22 GLN 36 HE22 GLN 36 -9.255 4.280 -19.041 273 H GLY 37 H GLY 37 -13.715 5.811 -12.567 274 HA2 GLY 37 HA2 GLY 37 -15.317 7.925 -13.039 275 HA3 GLY 37 HA3 GLY 37 -15.878 6.790 -14.257 276 H ALA 38 H ALA 38 -16.037 4.414 -13.091 277 HA ALA 38 HA ALA 38 -18.238 4.673 -11.272 278 HB1 ALA 38 HB1 ALA 38 -18.059 2.866 -12.976 279 HB2 ALA 38 HB2 ALA 38 -18.355 2.264 -11.344 280 HB3 ALA 38 HB3 ALA 38 -16.735 2.163 -12.039 281 H THR 39 H THR 39 -18.230 4.615 -9.086 282 HA THR 39 HA THR 39 -15.744 4.603 -7.649 283 HB THR 39 HB THR 39 -16.993 4.998 -5.663 284 HG1 THR 39 HG1 THR 39 -19.480 4.450 -6.898 285 HG21 THR 39 HG21 THR 39 -18.506 6.277 -7.950 286 HG22 THR 39 HG22 THR 39 -17.035 6.900 -7.202 287 HG23 THR 39 HG23 THR 39 -18.531 6.822 -6.273 288 H VAL 40 H VAL 40 -15.774 3.204 -5.491 289 HA VAL 40 HA VAL 40 -15.428 0.522 -6.240 290 HB VAL 40 HB VAL 40 -15.012 0.017 -3.942 291 HG11 VAL 40 HG11 VAL 40 -13.289 1.336 -5.035 292 HG12 VAL 40 HG12 VAL 40 -13.387 1.754 -3.325 293 HG13 VAL 40 HG13 VAL 40 -14.085 2.830 -4.536 294 HG21 VAL 40 HG21 VAL 40 -15.510 1.581 -2.113 295 HG22 VAL 40 HG22 VAL 40 -16.970 1.016 -2.921 296 HG23 VAL 40 HG23 VAL 40 -16.351 2.635 -3.251 297 H GLU 41 H GLU 41 -18.270 2.236 -5.194 298 HA GLU 41 HA GLU 41 -19.736 -0.021 -4.225 299 HB2 GLU 41 HB2 GLU 41 -20.108 2.542 -3.808 300 HB3 GLU 41 HB3 GLU 41 -21.060 2.469 -5.281 301 HG2 GLU 41 HG2 GLU 41 -21.578 0.680 -2.912 302 HG3 GLU 41 HG3 GLU 41 -22.318 2.265 -3.091 303 H GLU 42 H GLU 42 -19.940 1.844 -7.280 304 HA GLU 42 HA GLU 42 -21.709 0.156 -8.643 305 HB2 GLU 42 HB2 GLU 42 -19.451 1.854 -9.735 306 HB3 GLU 42 HB3 GLU 42 -20.628 1.035 -10.747 307 HG2 GLU 42 HG2 GLU 42 -21.361 3.249 -10.608 308 HG3 GLU 42 HG3 GLU 42 -22.411 2.346 -9.520 309 H LYS 43 H LYS 43 -18.458 -0.408 -7.721 310 HA LYS 43 HA LYS 43 -18.274 -2.746 -9.516 311 HB2 LYS 43 HB2 LYS 43 -16.043 -0.865 -8.733 312 HB3 LYS 43 HB3 LYS 43 -15.859 -2.318 -9.711 313 HG2 LYS 43 HG2 LYS 43 -17.251 -1.366 -11.454 314 HG3 LYS 43 HG3 LYS 43 -17.567 0.056 -10.462 315 HD2 LYS 43 HD2 LYS 43 -15.906 0.621 -12.103 316 HD3 LYS 43 HD3 LYS 43 -15.127 0.569 -10.524 317 HE2 LYS 43 HE2 LYS 43 -13.775 -0.473 -12.302 318 HE3 LYS 43 HE3 LYS 43 -14.190 -1.606 -11.016 319 HZ1 LYS 43 HZ1 LYS 43 -15.647 -1.399 -13.595 320 HZ2 LYS 43 HZ2 LYS 43 -15.869 -2.568 -12.395 321 HZ3 LYS 43 HZ3 LYS 43 -14.429 -2.530 -13.277 322 H LEU 44 H LEU 44 -19.170 -2.580 -6.672 323 HA LEU 44 HA LEU 44 -17.174 -3.687 -4.993 324 HB2 LEU 44 HB2 LEU 44 -20.182 -3.761 -4.882 325 HB3 LEU 44 HB3 LEU 44 -19.208 -4.615 -3.703 326 HG LEU 44 HG LEU 44 -19.122 -1.633 -4.185 327 HD11 LEU 44 HD11 LEU 44 -20.374 -3.211 -1.936 328 HD12 LEU 44 HD12 LEU 44 -21.234 -2.310 -3.186 329 HD13 LEU 44 HD13 LEU 44 -20.236 -1.453 -2.011 330 HD21 LEU 44 HD21 LEU 44 -16.978 -2.502 -3.408 331 HD22 LEU 44 HD22 LEU 44 -17.781 -3.331 -2.074 332 HD23 LEU 44 HD23 LEU 44 -17.767 -1.568 -2.137 333 H THR 45 H THR 45 -16.110 -5.268 -6.242 334 HA THR 45 HA THR 45 -17.319 -7.914 -6.028 335 HB THR 45 HB THR 45 -17.981 -7.387 -8.273 336 HG1 THR 45 HG1 THR 45 -17.290 -9.258 -8.978 337 HG21 THR 45 HG21 THR 45 -15.095 -6.643 -8.806 338 HG22 THR 45 HG22 THR 45 -16.450 -5.519 -8.712 339 HG23 THR 45 HG23 THR 45 -16.380 -6.708 -10.013 340 H GLU 46 H GLU 46 -15.777 -9.662 -6.222 341 HA GLU 46 HA GLU 46 -13.299 -9.263 -5.000 342 HB2 GLU 46 HB2 GLU 46 -14.533 -11.430 -5.148 343 HB3 GLU 46 HB3 GLU 46 -14.058 -11.548 -6.835 344 HG2 GLU 46 HG2 GLU 46 -11.736 -11.714 -6.231 345 HG3 GLU 46 HG3 GLU 46 -12.116 -11.418 -4.534 346 H GLU 47 H GLU 47 -14.195 -9.145 -8.372 347 HA GLU 47 HA GLU 47 -11.696 -9.123 -9.624 348 HB2 GLU 47 HB2 GLU 47 -13.814 -9.181 -10.852 349 HB3 GLU 47 HB3 GLU 47 -14.205 -7.562 -10.295 350 HG2 GLU 47 HG2 GLU 47 -12.252 -6.698 -11.545 351 HG3 GLU 47 HG3 GLU 47 -11.961 -8.325 -12.161 352 H TYR 48 H TYR 48 -13.529 -6.448 -8.167 353 HA TYR 48 HA TYR 48 -11.650 -4.385 -8.697 354 HB2 TYR 48 HB2 TYR 48 -14.158 -4.269 -7.936 355 HB3 TYR 48 HB3 TYR 48 -13.500 -4.374 -6.311 356 HD1 TYR 48 HD1 TYR 48 -11.999 -2.516 -5.471 357 HD2 TYR 48 HD2 TYR 48 -14.081 -2.255 -9.178 358 HE1 TYR 48 HE1 TYR 48 -11.637 -0.089 -5.501 359 HE2 TYR 48 HE2 TYR 48 -13.731 0.176 -9.215 360 HH TYR 48 HH TYR 48 -13.210 1.998 -7.746 361 H PHE 49 H PHE 49 -12.088 -6.655 -6.048 362 HA PHE 49 HA PHE 49 -10.338 -5.578 -4.156 363 HB2 PHE 49 HB2 PHE 49 -11.953 -7.369 -3.674 364 HB3 PHE 49 HB3 PHE 49 -11.045 -8.480 -4.689 365 HD1 PHE 49 HD1 PHE 49 -11.145 -6.736 -1.467 366 HD2 PHE 49 HD2 PHE 49 -8.966 -9.472 -3.904 367 HE1 PHE 49 HE1 PHE 49 -9.843 -7.448 0.495 368 HE2 PHE 49 HE2 PHE 49 -7.660 -10.179 -1.944 369 HZ PHE 49 HZ PHE 49 -8.101 -9.171 0.260 370 H ASN 50 H ASN 50 -9.682 -8.307 -6.370 371 HA ASN 50 HA ASN 50 -6.989 -8.595 -5.783 372 HB2 ASN 50 HB2 ASN 50 -8.437 -9.209 -8.368 373 HB3 ASN 50 HB3 ASN 50 -6.820 -9.785 -7.972 374 HD21 ASN 50 HD21 ASN 50 -9.277 -11.285 -8.485 375 HD22 ASN 50 HD22 ASN 50 -9.526 -12.262 -7.084 376 H ALA 51 H ALA 51 -8.483 -6.173 -7.740 377 HA ALA 51 HA ALA 51 -6.130 -5.549 -9.293 378 HB1 ALA 51 HB1 ALA 51 -8.376 -5.291 -10.228 379 HB2 ALA 51 HB2 ALA 51 -7.486 -3.768 -10.248 380 HB3 ALA 51 HB3 ALA 51 -8.733 -4.042 -9.031 381 H VAL 52 H VAL 52 -7.749 -4.106 -6.461 382 HA VAL 52 HA VAL 52 -5.684 -1.983 -6.416 383 HB VAL 52 HB VAL 52 -7.219 -0.676 -5.026 384 HG11 VAL 52 HG11 VAL 52 -7.315 -0.408 -7.445 385 HG12 VAL 52 HG12 VAL 52 -8.916 -0.204 -6.735 386 HG13 VAL 52 HG13 VAL 52 -8.503 -1.709 -7.557 387 HG21 VAL 52 HG21 VAL 52 -9.144 -2.978 -5.393 388 HG22 VAL 52 HG22 VAL 52 -9.534 -1.421 -4.663 389 HG23 VAL 52 HG23 VAL 52 -8.376 -2.496 -3.880 390 H ASN 53 H ASN 53 -5.729 -4.842 -5.126 391 HA ASN 53 HA ASN 53 -5.338 -4.048 -2.313 392 HB2 ASN 53 HB2 ASN 53 -6.250 -6.541 -3.649 393 HB3 ASN 53 HB3 ASN 53 -5.320 -6.734 -2.167 394 HD21 ASN 53 HD21 ASN 53 -8.089 -4.993 -3.504 395 HD22 ASN 53 HD22 ASN 53 -8.990 -4.960 -2.032 396 H TYR 54 H TYR 54 -3.230 -3.724 -4.456 397 HA TYR 54 HA TYR 54 -1.119 -5.023 -2.907 398 HB2 TYR 54 HB2 TYR 54 0.003 -5.986 -4.807 399 HB3 TYR 54 HB3 TYR 54 -1.652 -6.582 -4.776 400 HD1 TYR 54 HD1 TYR 54 0.751 -4.458 -6.564 401 HD2 TYR 54 HD2 TYR 54 -3.235 -5.956 -6.524 402 HE1 TYR 54 HE1 TYR 54 0.462 -3.727 -8.891 403 HE2 TYR 54 HE2 TYR 54 -3.534 -5.225 -8.856 404 HH TYR 54 HH TYR 54 -0.931 -4.277 -10.827 405 H ALA 55 H ALA 55 1.009 -4.191 -3.293 406 HA ALA 55 HA ALA 55 1.161 -1.614 -4.722 407 HB1 ALA 55 HB1 ALA 55 0.907 -1.154 -2.323 408 HB2 ALA 55 HB2 ALA 55 2.498 -0.667 -2.907 409 HB3 ALA 55 HB3 ALA 55 2.318 -2.156 -1.979 410 H GLU 56 H GLU 56 3.154 -1.171 -5.710 411 HA GLU 56 HA GLU 56 5.009 -3.434 -5.907 412 HB2 GLU 56 HB2 GLU 56 4.791 -0.913 -7.569 413 HB3 GLU 56 HB3 GLU 56 5.978 -2.181 -7.829 414 HG2 GLU 56 HG2 GLU 56 3.954 -3.749 -8.080 415 HG3 GLU 56 HG3 GLU 56 3.011 -2.270 -8.258 416 H ILE 57 H ILE 57 6.744 -3.464 -4.641 417 HA ILE 57 HA ILE 57 7.930 -0.907 -3.744 418 HB ILE 57 HB ILE 57 8.205 -3.647 -2.465 419 HG12 ILE 57 HG12 ILE 57 6.914 -2.394 -0.563 420 HG13 ILE 57 HG13 ILE 57 6.411 -1.301 -1.845 421 HG21 ILE 57 HG21 ILE 57 10.168 -2.252 -2.098 422 HG22 ILE 57 HG22 ILE 57 9.259 -2.451 -0.601 423 HG23 ILE 57 HG23 ILE 57 9.146 -0.942 -1.506 424 HD11 ILE 57 HD11 ILE 57 5.376 -3.151 -3.032 425 HD12 ILE 57 HD12 ILE 57 4.745 -3.016 -1.390 426 HD13 ILE 57 HD13 ILE 57 5.923 -4.270 -1.782 427 H ASN 58 H ASN 58 10.161 -0.569 -3.909 428 HA ASN 58 HA ASN 58 11.612 -1.854 -5.967 429 HB2 ASN 58 HB2 ASN 58 12.086 0.445 -5.238 430 HB3 ASN 58 HB3 ASN 58 12.616 -0.148 -3.668 431 HD21 ASN 58 HD21 ASN 58 13.440 0.249 -6.993 432 HD22 ASN 58 HD22 ASN 58 15.096 -0.221 -6.850 433 H GLU 59 H GLU 59 13.356 -3.332 -5.879 434 HA GLU 59 HA GLU 59 13.015 -5.481 -4.128 435 HB2 GLU 59 HB2 GLU 59 13.998 -5.753 -6.328 436 HB3 GLU 59 HB3 GLU 59 15.399 -4.799 -5.855 437 HG2 GLU 59 HG2 GLU 59 16.118 -6.483 -4.320 438 HG3 GLU 59 HG3 GLU 59 14.622 -7.385 -4.532 439 H GLU 60 H GLU 60 15.419 -2.861 -3.989 440 HA GLU 60 HA GLU 60 16.963 -3.900 -1.888 441 HB2 GLU 60 HB2 GLU 60 16.441 -1.040 -2.710 442 HB3 GLU 60 HB3 GLU 60 17.629 -1.502 -1.496 443 HG2 GLU 60 HG2 GLU 60 17.628 -2.329 -4.395 444 HG3 GLU 60 HG3 GLU 60 18.685 -1.134 -3.647 445 H ASP 61 H ASP 61 14.252 -1.553 -1.708 446 HA ASP 61 HA ASP 61 14.147 -1.474 1.126 447 HB2 ASP 61 HB2 ASP 61 11.863 -0.992 -0.804 448 HB3 ASP 61 HB3 ASP 61 11.996 -0.391 0.847 449 H TRP 62 H TRP 62 12.594 -3.491 -1.283 450 HA TRP 62 HA TRP 62 10.786 -4.965 0.191 451 HB2 TRP 62 HB2 TRP 62 11.037 -5.154 -2.236 452 HB3 TRP 62 HB3 TRP 62 12.630 -5.872 -2.041 453 HD1 TRP 62 HD1 TRP 62 12.703 -8.439 -1.125 454 HE1 TRP 62 HE1 TRP 62 10.952 -10.316 -1.278 455 HE3 TRP 62 HE3 TRP 62 8.607 -5.610 -2.249 456 HZ2 TRP 62 HZ2 TRP 62 8.197 -10.556 -1.831 457 HZ3 TRP 62 HZ3 TRP 62 6.450 -6.739 -2.575 458 HH2 TRP 62 HH2 TRP 62 6.248 -9.166 -2.370 459 H ASN 63 H ASN 63 14.213 -5.770 -0.387 460 HA ASN 63 HA ASN 63 14.239 -7.975 1.422 461 HB2 ASN 63 HB2 ASN 63 16.519 -6.387 0.212 462 HB3 ASN 63 HB3 ASN 63 16.703 -7.910 1.079 463 HD21 ASN 63 HD21 ASN 63 17.228 -7.114 -1.747 464 HD22 ASN 63 HD22 ASN 63 16.380 -8.281 -2.695 465 H ALA 64 H ALA 64 14.885 -4.544 1.768 466 HA ALA 64 HA ALA 64 16.196 -4.589 4.270 467 HB1 ALA 64 HB1 ALA 64 16.160 -2.618 2.823 468 HB2 ALA 64 HB2 ALA 64 15.558 -2.230 4.436 469 HB3 ALA 64 HB3 ALA 64 14.426 -2.439 3.098 470 H LEU 65 H LEU 65 12.771 -4.616 3.404 471 HA LEU 65 HA LEU 65 11.924 -4.530 6.193 472 HB2 LEU 65 HB2 LEU 65 10.323 -4.842 3.644 473 HB3 LEU 65 HB3 LEU 65 9.641 -4.629 5.246 474 HG LEU 65 HG LEU 65 11.376 -2.593 3.834 475 HD11 LEU 65 HD11 LEU 65 9.330 -1.311 3.516 476 HD12 LEU 65 HD12 LEU 65 8.384 -2.620 4.228 477 HD13 LEU 65 HD13 LEU 65 9.232 -2.871 2.700 478 HD21 LEU 65 HD21 LEU 65 11.538 -2.434 6.256 479 HD22 LEU 65 HD22 LEU 65 9.779 -2.415 6.393 480 HD23 LEU 65 HD23 LEU 65 10.617 -1.075 5.610 481 H GLY 66 H GLY 66 13.211 -6.898 4.371 482 HA2 GLY 66 HA2 GLY 66 13.162 -9.197 4.368 483 HA3 GLY 66 HA3 GLY 66 12.411 -9.062 5.953 484 H LEU 67 H LEU 67 11.191 -7.993 2.815 485 HA LEU 67 HA LEU 67 8.592 -9.058 3.355 486 HB2 LEU 67 HB2 LEU 67 9.851 -7.548 1.093 487 HB3 LEU 67 HB3 LEU 67 8.246 -8.233 0.904 488 HG LEU 67 HG LEU 67 8.867 -6.430 3.236 489 HD11 LEU 67 HD11 LEU 67 9.539 -5.200 1.222 490 HD12 LEU 67 HD12 LEU 67 8.060 -4.531 1.910 491 HD13 LEU 67 HD13 LEU 67 7.981 -5.554 0.473 492 HD21 LEU 67 HD21 LEU 67 6.327 -6.954 1.691 493 HD22 LEU 67 HD22 LEU 67 6.498 -6.041 3.193 494 HD23 LEU 67 HD23 LEU 67 6.789 -7.779 3.180 495 H GLN 68 H GLN 68 7.564 -10.781 2.548 496 HA GLN 68 HA GLN 68 8.943 -12.482 0.570 497 HB2 GLN 68 HB2 GLN 68 8.292 -13.609 2.658 498 HB3 GLN 68 HB3 GLN 68 6.625 -13.096 2.429 499 HG2 GLN 68 HG2 GLN 68 6.444 -14.476 0.439 500 HG3 GLN 68 HG3 GLN 68 8.139 -14.942 0.583 501 HE21 GLN 68 HE21 GLN 68 4.942 -15.331 1.898 502 HE22 GLN 68 HE22 GLN 68 5.299 -16.721 2.861 503 H GLU 69 H GLU 69 7.831 -13.093 -1.354 504 HA GLU 69 HA GLU 69 6.099 -11.134 -2.425 505 HB2 GLU 69 HB2 GLU 69 6.835 -13.895 -3.399 506 HB3 GLU 69 HB3 GLU 69 5.845 -12.774 -4.331 507 HG2 GLU 69 HG2 GLU 69 7.603 -11.215 -4.527 508 HG3 GLU 69 HG3 GLU 69 8.563 -12.025 -3.293 509 H GLY 70 H GLY 70 4.158 -10.774 -1.659 510 HA2 GLY 70 HA2 GLY 70 1.817 -11.471 -1.579 511 HA3 GLY 70 HA3 GLY 70 2.365 -13.067 -1.088 512 H ASP 71 H ASP 71 4.247 -10.796 0.455 513 HA ASP 71 HA ASP 71 3.122 -11.280 3.034 514 HB2 ASP 71 HB2 ASP 71 5.587 -10.583 2.140 515 HB3 ASP 71 HB3 ASP 71 5.013 -9.005 2.661 516 H ARG 72 H ARG 72 2.763 -9.264 4.558 517 HA ARG 72 HA ARG 72 0.882 -7.464 3.166 518 HB2 ARG 72 HB2 ARG 72 0.948 -8.295 6.076 519 HB3 ARG 72 HB3 ARG 72 -0.147 -7.092 5.410 520 HG2 ARG 72 HG2 ARG 72 -1.540 -8.858 5.267 521 HG3 ARG 72 HG3 ARG 72 -0.688 -9.126 3.747 522 HD2 ARG 72 HD2 ARG 72 -0.744 -11.218 4.838 523 HD3 ARG 72 HD3 ARG 72 0.897 -10.612 5.052 524 HE ARG 72 HE ARG 72 -0.295 -9.767 7.299 525 HH11 ARG 72 HH11 ARG 72 -0.264 -12.845 5.757 526 HH12 ARG 72 HH12 ARG 72 -0.469 -13.715 7.236 527 HH21 ARG 72 HH21 ARG 72 -0.586 -10.891 9.203 528 HH22 ARG 72 HH22 ARG 72 -0.684 -12.621 9.160 529 H VAL 73 H VAL 73 1.389 -5.400 2.956 530 HA VAL 73 HA VAL 73 3.388 -4.215 4.783 531 HB VAL 73 HB VAL 73 3.774 -2.509 2.973 532 HG11 VAL 73 HG11 VAL 73 5.312 -4.381 3.323 533 HG12 VAL 73 HG12 VAL 73 5.207 -3.940 1.619 534 HG13 VAL 73 HG13 VAL 73 4.363 -5.371 2.212 535 HG21 VAL 73 HG21 VAL 73 1.683 -2.807 1.737 536 HG22 VAL 73 HG22 VAL 73 2.173 -4.439 1.282 537 HG23 VAL 73 HG23 VAL 73 3.078 -3.048 0.683 538 H LYS 74 H LYS 74 2.820 -2.530 6.002 539 HA LYS 74 HA LYS 74 0.199 -1.292 5.564 540 HB2 LYS 74 HB2 LYS 74 0.687 -2.276 7.797 541 HB3 LYS 74 HB3 LYS 74 1.995 -1.119 7.997 542 HG2 LYS 74 HG2 LYS 74 0.586 0.624 8.405 543 HG3 LYS 74 HG3 LYS 74 -0.692 -0.020 7.374 544 HD2 LYS 74 HD2 LYS 74 -1.392 -0.078 9.696 545 HD3 LYS 74 HD3 LYS 74 -1.197 -1.720 9.088 546 HE2 LYS 74 HE2 LYS 74 -0.285 -1.572 11.318 547 HE3 LYS 74 HE3 LYS 74 1.028 -1.817 10.167 548 HZ1 LYS 74 HZ1 LYS 74 0.288 0.909 11.013 549 HZ2 LYS 74 HZ2 LYS 74 1.774 0.334 10.431 550 HZ3 LYS 74 HZ3 LYS 74 1.274 -0.049 11.999 551 H VAL 75 H VAL 75 0.220 0.460 4.401 552 HA VAL 75 HA VAL 75 2.630 2.084 4.105 553 HB VAL 75 HB VAL 75 0.027 2.199 2.551 554 HG11 VAL 75 HG11 VAL 75 1.331 3.505 0.910 555 HG12 VAL 75 HG12 VAL 75 2.708 3.493 2.014 556 HG13 VAL 75 HG13 VAL 75 1.215 4.316 2.472 557 HG21 VAL 75 HG21 VAL 75 1.229 1.028 0.770 558 HG22 VAL 75 HG22 VAL 75 1.181 0.056 2.241 559 HG23 VAL 75 HG23 VAL 75 2.659 0.910 1.797 560 H LYS 76 H LYS 76 2.793 4.108 4.940 561 HA LYS 76 HA LYS 76 0.419 5.237 6.279 562 HB2 LYS 76 HB2 LYS 76 3.136 4.794 7.534 563 HB3 LYS 76 HB3 LYS 76 1.776 5.610 8.302 564 HG2 LYS 76 HG2 LYS 76 0.572 3.667 8.568 565 HG3 LYS 76 HG3 LYS 76 1.398 2.843 7.248 566 HD2 LYS 76 HD2 LYS 76 2.081 1.860 9.293 567 HD3 LYS 76 HD3 LYS 76 3.432 2.784 8.643 568 HE2 LYS 76 HE2 LYS 76 2.959 4.617 10.183 569 HE3 LYS 76 HE3 LYS 76 1.556 3.748 10.809 570 HZ1 LYS 76 HZ1 LYS 76 3.038 2.019 11.619 571 HZ2 LYS 76 HZ2 LYS 76 3.463 3.516 12.269 572 HZ3 LYS 76 HZ3 LYS 76 4.382 2.845 11.015 573 H THR 77 H THR 77 0.159 7.299 5.920 574 HA THR 77 HA THR 77 2.477 9.020 5.260 575 HB THR 77 HB THR 77 1.294 10.135 3.489 576 HG1 THR 77 HG1 THR 77 -0.850 9.501 2.935 577 HG21 THR 77 HG21 THR 77 2.417 8.071 2.797 578 HG22 THR 77 HG22 THR 77 0.956 8.336 1.845 579 HG23 THR 77 HG23 THR 77 0.955 7.147 3.148 580 H GLU 78 H GLU 78 1.335 11.416 4.969 581 HA GLU 78 HA GLU 78 0.393 12.098 7.597 582 HB2 GLU 78 HB2 GLU 78 0.336 14.423 6.674 583 HB3 GLU 78 HB3 GLU 78 1.888 13.617 6.494 584 HG2 GLU 78 HG2 GLU 78 1.179 13.043 4.134 585 HG3 GLU 78 HG3 GLU 78 -0.179 14.141 4.371 586 H PHE 79 H PHE 79 -1.215 10.791 5.031 587 HA PHE 79 HA PHE 79 -3.732 12.241 5.536 588 HB2 PHE 79 HB2 PHE 79 -2.992 10.290 3.336 589 HB3 PHE 79 HB3 PHE 79 -4.575 11.036 3.521 590 HD1 PHE 79 HD1 PHE 79 -1.022 11.694 2.770 591 HD2 PHE 79 HD2 PHE 79 -4.979 13.274 2.804 592 HE1 PHE 79 HE1 PHE 79 -0.266 13.618 1.441 593 HE2 PHE 79 HE2 PHE 79 -4.224 15.194 1.470 594 HZ PHE 79 HZ PHE 79 -1.866 15.369 0.787 595 H GLY 80 H GLY 80 -2.273 9.028 5.767 596 HA2 GLY 80 HA2 GLY 80 -3.765 8.090 7.881 597 HA3 GLY 80 HA3 GLY 80 -4.691 7.649 6.451 598 H GLU 81 H GLU 81 -4.201 5.422 7.397 599 HA GLU 81 HA GLU 81 -1.862 4.392 5.977 600 HB2 GLU 81 HB2 GLU 81 -1.112 3.016 7.833 601 HB3 GLU 81 HB3 GLU 81 -1.069 4.717 8.258 602 HG2 GLU 81 HG2 GLU 81 -3.117 4.447 9.568 603 HG3 GLU 81 HG3 GLU 81 -3.179 2.741 9.122 604 H VAL 82 H VAL 82 -1.988 2.287 5.243 605 HA VAL 82 HA VAL 82 -4.468 0.772 5.700 606 HB VAL 82 HB VAL 82 -4.894 2.286 3.780 607 HG11 VAL 82 HG11 VAL 82 -3.716 1.954 1.658 608 HG12 VAL 82 HG12 VAL 82 -2.639 0.795 2.437 609 HG13 VAL 82 HG13 VAL 82 -2.621 2.487 2.934 610 HG21 VAL 82 HG21 VAL 82 -5.697 0.587 2.195 611 HG22 VAL 82 HG22 VAL 82 -6.070 0.159 3.867 612 HG23 VAL 82 HG23 VAL 82 -4.735 -0.638 3.029 613 H VAL 83 H VAL 83 -4.318 -1.476 5.148 614 HA VAL 83 HA VAL 83 -1.550 -2.455 4.779 615 HB VAL 83 HB VAL 83 -3.900 -4.046 5.843 616 HG11 VAL 83 HG11 VAL 83 -2.119 -5.420 4.913 617 HG12 VAL 83 HG12 VAL 83 -2.149 -5.574 6.671 618 HG13 VAL 83 HG13 VAL 83 -0.921 -4.573 5.896 619 HG21 VAL 83 HG21 VAL 83 -3.457 -2.208 7.373 620 HG22 VAL 83 HG22 VAL 83 -1.743 -2.622 7.410 621 HG23 VAL 83 HG23 VAL 83 -2.935 -3.739 8.080 622 H VAL 84 H VAL 84 -1.053 -3.301 2.841 623 HA VAL 84 HA VAL 84 -3.153 -4.660 1.257 624 HB VAL 84 HB VAL 84 -2.214 -3.729 -0.816 625 HG11 VAL 84 HG11 VAL 84 -4.105 -2.594 0.217 626 HG12 VAL 84 HG12 VAL 84 -3.045 -1.434 -0.585 627 HG13 VAL 84 HG13 VAL 84 -3.008 -1.598 1.172 628 HG21 VAL 84 HG21 VAL 84 -0.455 -2.069 1.003 629 HG22 VAL 84 HG22 VAL 84 -0.613 -1.857 -0.741 630 HG23 VAL 84 HG23 VAL 84 0.083 -3.341 -0.092 631 H PHE 85 H PHE 85 -2.097 -5.937 -0.642 632 HA PHE 85 HA PHE 85 -0.074 -7.690 0.437 633 HB2 PHE 85 HB2 PHE 85 -1.459 -7.630 -2.254 634 HB3 PHE 85 HB3 PHE 85 -0.278 -8.852 -1.797 635 HD1 PHE 85 HD1 PHE 85 -0.790 -10.334 0.202 636 HD2 PHE 85 HD2 PHE 85 -3.725 -7.861 -1.655 637 HE1 PHE 85 HE1 PHE 85 -2.579 -11.695 1.201 638 HE2 PHE 85 HE2 PHE 85 -5.510 -9.221 -0.651 639 HZ PHE 85 HZ PHE 85 -4.939 -11.142 0.778 640 H ALA 86 H ALA 86 2.048 -7.923 -0.197 641 HA ALA 86 HA ALA 86 3.220 -5.614 -1.559 642 HB1 ALA 86 HB1 ALA 86 4.098 -6.275 0.629 643 HB2 ALA 86 HB2 ALA 86 5.334 -6.375 -0.626 644 HB3 ALA 86 HB3 ALA 86 4.560 -7.844 -0.030 645 H LYS 87 H LYS 87 3.863 -5.672 -3.621 646 HA LYS 87 HA LYS 87 4.904 -8.209 -4.735 647 HB2 LYS 87 HB2 LYS 87 3.421 -6.046 -6.254 648 HB3 LYS 87 HB3 LYS 87 4.167 -7.458 -6.977 649 HG2 LYS 87 HG2 LYS 87 2.580 -8.865 -5.650 650 HG3 LYS 87 HG3 LYS 87 1.766 -7.372 -5.166 651 HD2 LYS 87 HD2 LYS 87 1.492 -6.831 -7.602 652 HD3 LYS 87 HD3 LYS 87 2.118 -8.438 -7.974 653 HE2 LYS 87 HE2 LYS 87 0.272 -9.409 -6.648 654 HE3 LYS 87 HE3 LYS 87 -0.375 -7.790 -6.411 655 HZ1 LYS 87 HZ1 LYS 87 -0.082 -9.232 -8.989 656 HZ2 LYS 87 HZ2 LYS 87 -0.526 -7.606 -8.865 657 HZ3 LYS 87 HZ3 LYS 87 -1.526 -8.804 -8.218 658 H LYS 88 H LYS 88 6.753 -8.102 -5.969 659 HA LYS 88 HA LYS 88 8.393 -5.761 -5.538 660 HB2 LYS 88 HB2 LYS 88 9.084 -8.287 -5.475 661 HB3 LYS 88 HB3 LYS 88 9.206 -8.115 -7.224 662 HG2 LYS 88 HG2 LYS 88 10.760 -6.223 -6.874 663 HG3 LYS 88 HG3 LYS 88 10.689 -6.544 -5.140 664 HD2 LYS 88 HD2 LYS 88 11.650 -8.487 -7.254 665 HD3 LYS 88 HD3 LYS 88 12.691 -7.537 -6.193 666 HE2 LYS 88 HE2 LYS 88 11.763 -8.673 -4.241 667 HE3 LYS 88 HE3 LYS 88 10.673 -9.593 -5.278 668 HZ1 LYS 88 HZ1 LYS 88 13.632 -9.756 -5.194 669 HZ2 LYS 88 HZ2 LYS 88 12.689 -10.502 -6.385 670 HZ3 LYS 88 HZ3 LYS 88 12.524 -10.960 -4.766 671 H GLY 89 H GLY 89 8.303 -4.052 -6.912 672 HA2 GLY 89 HA2 GLY 89 7.436 -4.587 -9.699 673 HA3 GLY 89 HA3 GLY 89 6.794 -3.258 -8.756 674 H ASP 90 H ASP 90 7.765 -2.715 -11.185 675 HA ASP 90 HA ASP 90 10.551 -1.980 -11.124 676 HB2 ASP 90 HB2 ASP 90 8.390 -1.312 -13.140 677 HB3 ASP 90 HB3 ASP 90 10.123 -1.087 -13.374 678 H VAL 91 H VAL 91 10.284 -0.653 -9.141 679 HA VAL 91 HA VAL 91 9.670 2.142 -9.860 680 HB VAL 91 HB VAL 91 8.862 2.524 -7.525 681 HG11 VAL 91 HG11 VAL 91 7.249 2.226 -9.324 682 HG12 VAL 91 HG12 VAL 91 6.644 1.502 -7.834 683 HG13 VAL 91 HG13 VAL 91 7.301 0.475 -9.110 684 HG21 VAL 91 HG21 VAL 91 8.912 -0.495 -7.346 685 HG22 VAL 91 HG22 VAL 91 8.211 0.600 -6.150 686 HG23 VAL 91 HG23 VAL 91 9.950 0.615 -6.450 687 HA PRO 92 HA PRO 92 13.752 3.094 -8.296 688 HB2 PRO 92 HB2 PRO 92 12.560 5.609 -7.243 689 HB3 PRO 92 HB3 PRO 92 13.897 5.385 -8.375 690 HG2 PRO 92 HG2 PRO 92 11.515 6.236 -9.228 691 HG3 PRO 92 HG3 PRO 92 12.486 5.112 -10.200 692 HD2 PRO 92 HD2 PRO 92 10.105 4.547 -8.459 693 HD3 PRO 92 HD3 PRO 92 10.508 3.894 -10.062 694 H LYS 93 H LYS 93 14.929 3.333 -6.287 695 HA LYS 93 HA LYS 93 13.716 2.056 -4.081 696 HB2 LYS 93 HB2 LYS 93 16.188 2.071 -4.589 697 HB3 LYS 93 HB3 LYS 93 16.241 3.719 -3.970 698 HG2 LYS 93 HG2 LYS 93 15.376 2.903 -1.806 699 HG3 LYS 93 HG3 LYS 93 15.417 1.257 -2.435 700 HD2 LYS 93 HD2 LYS 93 17.877 1.529 -2.786 701 HD3 LYS 93 HD3 LYS 93 17.767 3.098 -1.977 702 HE2 LYS 93 HE2 LYS 93 17.103 0.398 -0.805 703 HE3 LYS 93 HE3 LYS 93 18.466 1.431 -0.379 704 HZ1 LYS 93 HZ1 LYS 93 16.761 1.642 1.266 705 HZ2 LYS 93 HZ2 LYS 93 15.589 1.998 0.098 706 HZ3 LYS 93 HZ3 LYS 93 16.841 3.096 0.401 707 H GLY 94 H GLY 94 13.131 2.842 -2.012 708 HA2 GLY 94 HA2 GLY 94 11.987 4.285 -0.634 709 HA3 GLY 94 HA3 GLY 94 13.005 5.563 -1.282 710 H MET 95 H MET 95 10.947 3.674 -3.362 711 HA MET 95 HA MET 95 8.820 5.667 -3.397 712 HB2 MET 95 HB2 MET 95 10.668 6.364 -5.001 713 HB3 MET 95 HB3 MET 95 10.325 4.903 -5.917 714 HG2 MET 95 HG2 MET 95 8.066 5.685 -6.333 715 HG3 MET 95 HG3 MET 95 8.382 7.137 -5.385 716 HE1 MET 95 HE1 MET 95 7.908 8.958 -7.127 717 HE2 MET 95 HE2 MET 95 7.247 7.691 -8.159 718 HE3 MET 95 HE3 MET 95 8.387 8.860 -8.822 719 H ILE 96 H ILE 96 6.830 4.722 -3.952 720 HA ILE 96 HA ILE 96 6.866 1.975 -5.002 721 HB ILE 96 HB ILE 96 5.227 1.209 -3.335 722 HG12 ILE 96 HG12 ILE 96 5.783 3.843 -1.926 723 HG13 ILE 96 HG13 ILE 96 4.274 3.410 -2.726 724 HG21 ILE 96 HG21 ILE 96 6.783 1.000 -1.428 725 HG22 ILE 96 HG22 ILE 96 7.813 2.235 -2.152 726 HG23 ILE 96 HG23 ILE 96 7.568 0.697 -2.978 727 HD11 ILE 96 HD11 ILE 96 4.088 3.147 -0.331 728 HD12 ILE 96 HD12 ILE 96 5.460 2.038 -0.322 729 HD13 ILE 96 HD13 ILE 96 3.961 1.581 -1.133 730 H PHE 97 H PHE 97 5.073 1.337 -6.164 731 HA PHE 97 HA PHE 97 3.167 3.488 -6.840 732 HB2 PHE 97 HB2 PHE 97 4.416 2.703 -8.758 733 HB3 PHE 97 HB3 PHE 97 4.013 1.028 -8.393 734 HD1 PHE 97 HD2 PHE 97 2.630 4.260 -9.544 735 HD2 PHE 97 HD1 PHE 97 1.954 0.073 -9.115 736 HE1 PHE 97 HE2 PHE 97 0.622 4.442 -10.952 737 HE2 PHE 97 HE1 PHE 97 -0.058 0.250 -10.524 738 HZ PHE 97 HZ PHE 97 -0.725 2.439 -11.445 739 H ILE 98 H ILE 98 1.049 3.281 -6.406 740 HA ILE 98 HA ILE 98 -0.047 0.587 -5.879 741 HB ILE 98 HB ILE 98 -0.789 3.131 -4.400 742 HG12 ILE 98 HG12 ILE 98 0.643 0.623 -3.475 743 HG13 ILE 98 HG13 ILE 98 1.337 2.235 -3.618 744 HG21 ILE 98 HG21 ILE 98 -1.887 0.330 -4.085 745 HG22 ILE 98 HG22 ILE 98 -2.745 1.716 -4.759 746 HG23 ILE 98 HG23 ILE 98 -2.279 1.711 -3.059 747 HD11 ILE 98 HD11 ILE 98 -0.814 1.384 -1.686 748 HD12 ILE 98 HD12 ILE 98 -0.168 3.017 -1.845 749 HD13 ILE 98 HD13 ILE 98 0.878 1.705 -1.309 750 HA PRO 99 HA PRO 99 -2.989 1.776 -9.088 751 HB2 PRO 99 HB2 PRO 99 -4.918 -0.103 -8.444 752 HB3 PRO 99 HB3 PRO 99 -3.519 -0.412 -9.475 753 HG2 PRO 99 HG2 PRO 99 -3.908 -1.034 -6.573 754 HG3 PRO 99 HG3 PRO 99 -3.129 -2.007 -7.835 755 HD2 PRO 99 HD2 PRO 99 -1.694 -0.611 -6.033 756 HD3 PRO 99 HD3 PRO 99 -1.147 -0.815 -7.712 757 H MET 100 H MET 100 -4.618 3.254 -9.104 758 HA MET 100 HA MET 100 -5.423 4.563 -6.768 759 HB2 MET 100 HB2 MET 100 -5.432 5.326 -9.268 760 HB3 MET 100 HB3 MET 100 -7.058 4.666 -9.292 761 HG2 MET 100 HG2 MET 100 -6.051 6.910 -7.546 762 HG3 MET 100 HG3 MET 100 -7.117 7.053 -8.939 763 HE1 MET 100 HE1 MET 100 -7.010 7.207 -5.252 764 HE2 MET 100 HE2 MET 100 -6.759 5.463 -5.354 765 HE3 MET 100 HE3 MET 100 -8.243 6.101 -4.646 766 H GLY 101 H GLY 101 -6.588 3.624 -5.199 767 HA2 GLY 101 HA2 GLY 101 -9.269 2.652 -5.798 768 HA3 GLY 101 HA3 GLY 101 -8.172 1.430 -5.170 769 HA PRO 102 HA PRO 102 -10.393 3.755 -1.703 770 HB2 PRO 102 HB2 PRO 102 -11.077 1.490 -0.283 771 HB3 PRO 102 HB3 PRO 102 -12.119 2.258 -1.486 772 HG2 PRO 102 HG2 PRO 102 -10.346 -0.135 -1.762 773 HG3 PRO 102 HG3 PRO 102 -11.963 0.148 -2.431 774 HD2 PRO 102 HD2 PRO 102 -9.706 0.366 -3.916 775 HD3 PRO 102 HD3 PRO 102 -11.144 1.370 -4.217 776 H TYR 103 H TYR 103 -8.046 1.184 -1.819 777 HA TYR 103 HA TYR 103 -7.023 1.437 0.832 778 HB2 TYR 103 HB2 TYR 103 -5.704 0.317 -1.663 779 HB3 TYR 103 HB3 TYR 103 -5.142 0.079 -0.011 780 HD1 TYR 103 HD2 TYR 103 -8.291 -0.356 -1.991 781 HD2 TYR 103 HD1 TYR 103 -5.702 -1.939 0.995 782 HE1 TYR 103 HE2 TYR 103 -9.731 -2.331 -1.800 783 HE2 TYR 103 HE1 TYR 103 -7.137 -3.923 1.190 784 HH TYR 103 HH TYR 103 -8.948 -4.958 0.456 785 H ALA 104 H ALA 104 -5.709 2.470 -2.331 786 HA ALA 104 HA ALA 104 -3.639 4.075 -1.327 787 HB1 ALA 104 HB1 ALA 104 -3.586 5.105 -3.553 788 HB2 ALA 104 HB2 ALA 104 -5.158 4.397 -3.926 789 HB3 ALA 104 HB3 ALA 104 -3.760 3.353 -3.673 790 H ASN 105 H ASN 105 -7.043 4.695 -1.817 791 HA ASN 105 HA ASN 105 -7.100 7.491 -1.736 792 HB2 ASN 105 HB2 ASN 105 -9.041 6.310 -2.438 793 HB3 ASN 105 HB3 ASN 105 -9.101 5.368 -0.956 794 HD21 ASN 105 HD21 ASN 105 -10.013 6.239 0.856 795 HD22 ASN 105 HD22 ASN 105 -10.919 7.706 0.834 796 H MET 106 H MET 106 -6.508 5.210 0.791 797 HA MET 106 HA MET 106 -7.250 6.935 2.980 798 HB2 MET 106 HB2 MET 106 -5.431 4.530 3.154 799 HB3 MET 106 HB3 MET 106 -6.469 5.200 4.408 800 HG2 MET 106 HG2 MET 106 -8.439 4.531 3.054 801 HG3 MET 106 HG3 MET 106 -7.343 3.766 1.912 802 HE1 MET 106 HE1 MET 106 -7.927 2.341 6.271 803 HE2 MET 106 HE2 MET 106 -8.810 3.684 5.546 804 HE3 MET 106 HE3 MET 106 -7.085 3.843 5.881 805 H VAL 107 H VAL 107 -4.378 6.412 1.071 806 HA VAL 107 HA VAL 107 -2.735 7.845 3.069 807 HB VAL 107 HB VAL 107 -0.760 6.741 2.077 808 HG11 VAL 107 HG11 VAL 107 -1.169 4.506 2.995 809 HG12 VAL 107 HG12 VAL 107 -2.904 4.820 2.991 810 HG13 VAL 107 HG13 VAL 107 -1.842 5.761 4.036 811 HG21 VAL 107 HG21 VAL 107 -1.069 4.837 0.540 812 HG22 VAL 107 HG22 VAL 107 -1.589 6.361 -0.179 813 HG23 VAL 107 HG23 VAL 107 -2.788 5.219 0.432 814 H ILE 108 H ILE 108 -3.945 7.969 -0.143 815 HA ILE 108 HA ILE 108 -1.959 9.944 -0.973 816 HB ILE 108 HB ILE 108 -2.789 9.796 -3.167 817 HG12 ILE 108 HG12 ILE 108 -5.097 8.082 -2.240 818 HG13 ILE 108 HG13 ILE 108 -5.232 9.824 -2.462 819 HG21 ILE 108 HG21 ILE 108 -1.429 7.890 -2.623 820 HG22 ILE 108 HG22 ILE 108 -2.760 7.341 -3.651 821 HG23 ILE 108 HG23 ILE 108 -2.810 7.049 -1.912 822 HD11 ILE 108 HD11 ILE 108 -4.557 7.776 -4.541 823 HD12 ILE 108 HD12 ILE 108 -4.487 9.519 -4.796 824 HD13 ILE 108 HD13 ILE 108 -6.029 8.741 -4.422 825 H ASP 109 H ASP 109 -3.047 11.785 -2.375 826 HA ASP 109 HA ASP 109 -4.903 13.206 -0.629 827 HB2 ASP 109 HB2 ASP 109 -2.914 14.408 -1.388 828 HB3 ASP 109 HB3 ASP 109 -3.349 14.116 -3.068 829 HA PRO 110 HA PRO 110 -8.096 11.811 -3.540 830 HB2 PRO 110 HB2 PRO 110 -10.234 12.360 -1.982 831 HB3 PRO 110 HB3 PRO 110 -9.193 10.958 -1.696 832 HG2 PRO 110 HG2 PRO 110 -9.205 13.623 -0.319 833 HG3 PRO 110 HG3 PRO 110 -9.061 12.000 0.384 834 HD2 PRO 110 HD2 PRO 110 -6.917 13.644 -0.069 835 HD3 PRO 110 HD3 PRO 110 -6.805 11.873 -0.067 836 H SER 111 H SER 111 -7.390 14.962 -2.473 837 HA SER 111 HA SER 111 -9.592 16.350 -3.676 838 HB2 SER 111 HB2 SER 111 -8.279 17.443 -1.931 839 HB3 SER 111 HB3 SER 111 -6.821 17.337 -2.917 840 HG SER 111 HG SER 111 -8.077 19.402 -2.900 841 H THR 112 H THR 112 -6.347 15.434 -4.738 842 HA THR 112 HA THR 112 -6.585 16.760 -7.296 843 HB THR 112 HB THR 112 -4.389 16.497 -6.197 844 HG1 THR 112 HG1 THR 112 -3.511 16.465 -8.121 845 HG21 THR 112 HG21 THR 112 -4.686 13.553 -6.835 846 HG22 THR 112 HG22 THR 112 -4.744 14.260 -5.221 847 HG23 THR 112 HG23 THR 112 -3.255 14.338 -6.163 848 H ASP 113 H ASP 113 -5.600 15.068 -9.138 849 HA ASP 113 HA ASP 113 -7.133 12.612 -9.265 850 HB2 ASP 113 HB2 ASP 113 -8.867 14.065 -9.985 851 HB3 ASP 113 HB3 ASP 113 -7.769 15.015 -10.980 852 H GLY 114 H GLY 114 -4.770 14.804 -10.590 853 HA2 GLY 114 HA2 GLY 114 -2.889 14.295 -11.886 854 HA3 GLY 114 HA3 GLY 114 -3.512 12.667 -12.121 855 H THR 115 H THR 115 -3.942 16.043 -13.096 856 HA THR 115 HA THR 115 -5.863 15.643 -15.105 857 HB THR 115 HB THR 115 -3.754 17.818 -15.028 858 HG1 THR 115 HG1 THR 115 -6.229 18.529 -14.145 859 HG21 THR 115 HG21 THR 115 -6.472 17.705 -16.361 860 HG22 THR 115 HG22 THR 115 -4.907 17.729 -17.175 861 HG23 THR 115 HG23 THR 115 -5.451 19.139 -16.266 862 H GLY 116 H GLY 116 -5.359 13.915 -16.449 863 HA2 GLY 116 HA2 GLY 116 -4.584 13.028 -18.439 864 HA3 GLY 116 HA3 GLY 116 -3.633 14.485 -18.674 865 H MET 117 H MET 117 -1.758 14.616 -16.943 866 HA MET 117 HA MET 117 -0.513 11.982 -16.567 867 HB2 MET 117 HB2 MET 117 0.677 14.350 -18.002 868 HB3 MET 117 HB3 MET 117 1.686 13.096 -17.293 869 HG2 MET 117 HG2 MET 117 -0.449 12.615 -19.363 870 HG3 MET 117 HG3 MET 117 1.279 12.761 -19.697 871 HE1 MET 117 HE1 MET 117 -0.663 10.260 -20.464 872 HE2 MET 117 HE2 MET 117 0.425 8.912 -20.140 873 HE3 MET 117 HE3 MET 117 1.028 10.358 -20.952 874 HA PRO 118 HA PRO 118 0.605 13.856 -12.652 875 HB2 PRO 118 HB2 PRO 118 1.846 11.755 -11.553 876 HB3 PRO 118 HB3 PRO 118 0.108 11.721 -11.872 877 HG2 PRO 118 HG2 PRO 118 2.343 10.458 -13.408 878 HG3 PRO 118 HG3 PRO 118 0.725 9.823 -13.056 879 HD2 PRO 118 HD2 PRO 118 1.513 11.046 -15.448 880 HD3 PRO 118 HD3 PRO 118 -0.165 10.808 -14.918 881 H GLN 119 H GLN 119 2.847 12.796 -15.033 882 HA GLN 119 HA GLN 119 5.037 13.166 -15.478 883 HB2 GLN 119 HB2 GLN 119 4.548 15.595 -13.735 884 HB3 GLN 119 HB3 GLN 119 5.953 15.371 -14.771 885 HG2 GLN 119 HG2 GLN 119 4.472 15.273 -16.735 886 HG3 GLN 119 HG3 GLN 119 3.083 15.547 -15.686 887 HE21 GLN 119 HE21 GLN 119 4.114 17.121 -17.922 888 HE22 GLN 119 HE22 GLN 119 4.401 18.705 -17.293 889 H PHE 120 H PHE 120 5.085 11.176 -13.927 890 HA PHE 120 HA PHE 120 6.009 9.983 -12.216 891 HB2 PHE 120 HB2 PHE 120 8.280 11.866 -12.883 892 HB3 PHE 120 HB3 PHE 120 8.455 10.421 -11.892 893 HD1 PHE 120 HD1 PHE 120 8.169 8.186 -12.896 894 HD2 PHE 120 HD2 PHE 120 8.096 11.725 -15.270 895 HE1 PHE 120 HE1 PHE 120 8.510 6.834 -14.923 896 HE2 PHE 120 HE2 PHE 120 8.434 10.375 -17.296 897 HZ PHE 120 HZ PHE 120 8.641 7.928 -17.123 898 H LYS 121 H LYS 121 4.554 10.707 -10.573 899 HA LYS 121 HA LYS 121 5.795 11.932 -8.313 900 HB2 LYS 121 HB2 LYS 121 5.429 13.972 -9.495 901 HB3 LYS 121 HB3 LYS 121 3.775 13.520 -9.882 902 HG2 LYS 121 HG2 LYS 121 3.016 13.931 -7.728 903 HG3 LYS 121 HG3 LYS 121 4.633 13.825 -7.031 904 HD2 LYS 121 HD2 LYS 121 3.813 16.137 -7.081 905 HD3 LYS 121 HD3 LYS 121 5.252 15.926 -8.074 906 HE2 LYS 121 HE2 LYS 121 2.459 15.871 -9.216 907 HE3 LYS 121 HE3 LYS 121 3.389 17.357 -9.048 908 HZ1 LYS 121 HZ1 LYS 121 3.723 16.597 -11.232 909 HZ2 LYS 121 HZ2 LYS 121 4.019 15.009 -10.747 910 HZ3 LYS 121 HZ3 LYS 121 5.152 16.218 -10.411 911 H GLY 122 H GLY 122 4.853 11.234 -6.513 912 HA2 GLY 122 HA2 GLY 122 1.959 10.708 -6.502 913 HA3 GLY 122 HA3 GLY 122 3.054 9.451 -5.942 914 H VAL 123 H VAL 123 1.436 9.942 -4.043 915 HA VAL 123 HA VAL 123 2.169 12.253 -2.440 916 HB VAL 123 HB VAL 123 0.399 9.904 -1.746 917 HG11 VAL 123 HG11 VAL 123 0.765 12.551 -0.326 918 HG12 VAL 123 HG12 VAL 123 1.272 10.969 0.270 919 HG13 VAL 123 HG13 VAL 123 -0.443 11.330 0.076 920 HG21 VAL 123 HG21 VAL 123 -1.451 11.500 -2.164 921 HG22 VAL 123 HG22 VAL 123 -0.499 11.157 -3.609 922 HG23 VAL 123 HG23 VAL 123 -0.270 12.678 -2.743 923 H LYS 124 H LYS 124 3.845 12.324 -1.093 924 HA LYS 124 HA LYS 124 5.498 10.035 -0.646 925 HB2 LYS 124 HB2 LYS 124 5.681 12.812 0.544 926 HB3 LYS 124 HB3 LYS 124 6.930 11.576 0.640 927 HG2 LYS 124 HG2 LYS 124 7.089 11.591 -1.829 928 HG3 LYS 124 HG3 LYS 124 5.911 12.905 -1.865 929 HD2 LYS 124 HD2 LYS 124 7.445 14.296 -0.517 930 HD3 LYS 124 HD3 LYS 124 8.627 12.985 -0.534 931 HE2 LYS 124 HE2 LYS 124 8.728 13.128 -2.989 932 HE3 LYS 124 HE3 LYS 124 7.578 14.464 -2.952 933 HZ1 LYS 124 HZ1 LYS 124 10.298 14.454 -1.760 934 HZ2 LYS 124 HZ2 LYS 124 9.189 15.726 -1.637 935 HZ3 LYS 124 HZ3 LYS 124 9.809 15.293 -3.147 936 H GLY 125 H GLY 125 6.163 9.155 1.378 937 HA2 GLY 125 HA2 GLY 125 5.056 9.729 3.881 938 HA3 GLY 125 HA3 GLY 125 4.054 8.496 3.131 939 H THR 126 H THR 126 4.560 6.745 4.379 940 HA THR 126 HA THR 126 7.336 5.754 4.292 941 HB THR 126 HB THR 126 7.211 4.981 6.623 942 HG1 THR 126 HG1 THR 126 4.713 6.363 6.666 943 HG21 THR 126 HG21 THR 126 7.368 7.143 7.779 944 HG22 THR 126 HG22 THR 126 6.633 7.940 6.388 945 HG23 THR 126 HG23 THR 126 8.215 7.177 6.233 946 H VAL 127 H VAL 127 7.508 3.440 4.682 947 HA VAL 127 HA VAL 127 4.997 1.920 4.612 948 HB VAL 127 HB VAL 127 5.871 2.046 2.287 949 HG11 VAL 127 HG11 VAL 127 7.935 0.881 1.676 950 HG12 VAL 127 HG12 VAL 127 8.264 0.555 3.379 951 HG13 VAL 127 HG13 VAL 127 8.258 2.216 2.784 952 HG21 VAL 127 HG21 VAL 127 4.545 0.118 2.991 953 HG22 VAL 127 HG22 VAL 127 6.009 -0.712 3.518 954 HG23 VAL 127 HG23 VAL 127 5.764 -0.356 1.808 955 H GLU 128 H GLU 128 5.034 0.002 5.711 956 HA GLU 128 HA GLU 128 7.543 -1.070 6.761 957 HB2 GLU 128 HB2 GLU 128 6.508 -1.210 9.066 958 HB3 GLU 128 HB3 GLU 128 6.920 0.419 8.540 959 HG2 GLU 128 HG2 GLU 128 4.602 0.852 7.964 960 HG3 GLU 128 HG3 GLU 128 4.163 -0.797 8.403 961 H LYS 129 H LYS 129 7.442 -3.305 7.153 962 HA LYS 129 HA LYS 129 5.129 -4.677 6.088 963 HB2 LYS 129 HB2 LYS 129 7.549 -5.406 5.748 964 HB3 LYS 129 HB3 LYS 129 7.512 -5.975 7.411 965 HG2 LYS 129 HG2 LYS 129 5.734 -7.520 6.905 966 HG3 LYS 129 HG3 LYS 129 5.597 -6.879 5.267 967 HD2 LYS 129 HD2 LYS 129 6.892 -8.700 4.837 968 HD3 LYS 129 HD3 LYS 129 8.161 -7.532 5.183 969 HE2 LYS 129 HE2 LYS 129 8.610 -9.619 6.314 970 HE3 LYS 129 HE3 LYS 129 8.257 -8.356 7.497 971 HZ1 LYS 129 HZ1 LYS 129 7.137 -10.638 7.760 972 HZ2 LYS 129 HZ2 LYS 129 6.107 -10.128 6.513 973 HZ3 LYS 129 HZ3 LYS 129 6.188 -9.250 7.961 974 H THR 130 H THR 130 3.773 -6.146 7.276 975 HA THR 130 HA THR 130 3.745 -5.565 10.178 976 HB THR 130 HB THR 130 2.257 -3.926 9.222 977 HG1 THR 130 HG1 THR 130 1.514 -4.787 11.169 978 HG21 THR 130 HG21 THR 130 0.779 -6.243 7.955 979 HG22 THR 130 HG22 THR 130 1.740 -5.038 7.098 980 HG23 THR 130 HG23 THR 130 0.263 -4.556 7.934 981 H ASP 131 H ASP 131 2.472 -6.907 11.491 982 HA ASP 131 HA ASP 131 2.295 -9.667 10.628 983 HB2 ASP 131 HB2 ASP 131 3.160 -8.982 12.866 984 HB3 ASP 131 HB3 ASP 131 1.567 -8.363 13.273 985 H GLU 132 H GLU 132 0.255 -6.954 10.727 986 HA GLU 132 HA GLU 132 -2.242 -8.149 11.370 987 HB2 GLU 132 HB2 GLU 132 -1.670 -5.601 9.838 988 HB3 GLU 132 HB3 GLU 132 -3.216 -6.048 10.551 989 HG2 GLU 132 HG2 GLU 132 -0.657 -5.537 12.064 990 HG3 GLU 132 HG3 GLU 132 -2.013 -4.420 11.913 991 H LYS 133 H LYS 133 -4.121 -7.689 9.684 992 HA LYS 133 HA LYS 133 -3.517 -9.352 7.344 993 HB2 LYS 133 HB2 LYS 133 -5.917 -9.754 7.220 994 HB3 LYS 133 HB3 LYS 133 -5.345 -10.076 8.854 995 HG2 LYS 133 HG2 LYS 133 -6.247 -8.012 9.657 996 HG3 LYS 133 HG3 LYS 133 -6.614 -7.472 8.018 997 HD2 LYS 133 HD2 LYS 133 -8.216 -9.376 7.815 998 HD3 LYS 133 HD3 LYS 133 -7.916 -9.756 9.514 999 HE2 LYS 133 HE2 LYS 133 -8.782 -7.602 10.197 1000 HE3 LYS 133 HE3 LYS 133 -8.948 -7.093 8.517 1001 HZ1 LYS 133 HZ1 LYS 133 -11.072 -7.746 9.348 1002 HZ2 LYS 133 HZ2 LYS 133 -10.478 -9.234 9.888 1003 HZ3 LYS 133 HZ3 LYS 133 -10.575 -8.913 8.228 1004 H VAL 134 H VAL 134 -4.476 -8.824 5.261 1005 HA VAL 134 HA VAL 134 -4.372 -6.043 4.568 1006 HB VAL 134 HB VAL 134 -5.277 -8.445 2.954 1007 HG11 VAL 134 HG11 VAL 134 -4.756 -5.608 2.042 1008 HG12 VAL 134 HG12 VAL 134 -6.312 -6.438 2.053 1009 HG13 VAL 134 HG13 VAL 134 -5.028 -6.987 0.976 1010 HG21 VAL 134 HG21 VAL 134 -2.681 -6.892 2.926 1011 HG22 VAL 134 HG22 VAL 134 -3.097 -8.229 1.853 1012 HG23 VAL 134 HG23 VAL 134 -2.917 -8.512 3.585 1013 H LEU 135 H LEU 135 -6.025 -4.602 4.264 1014 HA LEU 135 HA LEU 135 -8.564 -5.143 5.434 1015 HB2 LEU 135 HB2 LEU 135 -7.320 -2.830 4.038 1016 HB3 LEU 135 HB3 LEU 135 -9.073 -2.866 4.092 1017 HG LEU 135 HG LEU 135 -7.240 -2.924 6.502 1018 HD11 LEU 135 HD11 LEU 135 -8.107 -0.686 6.946 1019 HD12 LEU 135 HD12 LEU 135 -9.050 -0.741 5.457 1020 HD13 LEU 135 HD13 LEU 135 -7.286 -0.742 5.385 1021 HD21 LEU 135 HD21 LEU 135 -10.259 -2.884 6.287 1022 HD22 LEU 135 HD22 LEU 135 -9.346 -2.627 7.778 1023 HD23 LEU 135 HD23 LEU 135 -9.258 -4.179 6.948 1024 H SER 136 H SER 136 -10.505 -5.659 4.552 1025 HA SER 136 HA SER 136 -10.628 -6.363 1.726 1026 HB2 SER 136 HB2 SER 136 -12.772 -6.489 3.873 1027 HB3 SER 136 HB3 SER 136 -12.907 -7.158 2.247 1028 HG SER 136 HG SER 136 -12.160 -8.522 4.190 1029 H VAL 137 H VAL 137 -12.141 -5.396 0.234 1030 HA VAL 137 HA VAL 137 -11.930 -2.670 0.050 1031 HB VAL 137 HB VAL 137 -14.136 -4.375 -1.130 1032 HG11 VAL 137 HG11 VAL 137 -14.342 -2.601 -2.835 1033 HG12 VAL 137 HG12 VAL 137 -13.184 -1.617 -1.938 1034 HG13 VAL 137 HG13 VAL 137 -14.746 -2.016 -1.221 1035 HG21 VAL 137 HG21 VAL 137 -11.463 -3.530 -2.268 1036 HG22 VAL 137 HG22 VAL 137 -12.704 -4.435 -3.134 1037 HG23 VAL 137 HG23 VAL 137 -11.901 -5.156 -1.740 1038 H LYS 138 H LYS 138 -14.885 -4.365 1.163 1039 HA LYS 138 HA LYS 138 -16.246 -1.937 1.810 1040 HB2 LYS 138 HB2 LYS 138 -17.439 -4.017 1.215 1041 HB3 LYS 138 HB3 LYS 138 -16.866 -4.764 2.701 1042 HG2 LYS 138 HG2 LYS 138 -18.078 -3.039 4.000 1043 HG3 LYS 138 HG3 LYS 138 -18.704 -2.379 2.488 1044 HD2 LYS 138 HD2 LYS 138 -20.370 -3.815 3.493 1045 HD3 LYS 138 HD3 LYS 138 -19.767 -4.565 2.013 1046 HE2 LYS 138 HE2 LYS 138 -18.315 -6.021 3.321 1047 HE3 LYS 138 HE3 LYS 138 -18.848 -5.244 4.811 1048 HZ1 LYS 138 HZ1 LYS 138 -21.083 -6.049 4.390 1049 HZ2 LYS 138 HZ2 LYS 138 -19.992 -7.336 4.436 1050 HZ3 LYS 138 HZ3 LYS 138 -20.581 -6.781 2.952 1051 H GLU 139 H GLU 139 -14.404 -4.307 3.733 1052 HA GLU 139 HA GLU 139 -14.995 -3.331 6.297 1053 HB2 GLU 139 HB2 GLU 139 -13.854 -5.445 5.990 1054 HB3 GLU 139 HB3 GLU 139 -12.498 -4.651 5.204 1055 HG2 GLU 139 HG2 GLU 139 -11.877 -3.572 7.284 1056 HG3 GLU 139 HG3 GLU 139 -13.290 -4.265 8.086 1057 H LEU 140 H LEU 140 -12.608 -2.354 3.920 1058 HA LEU 140 HA LEU 140 -11.304 -0.306 5.299 1059 HB2 LEU 140 HB2 LEU 140 -10.875 -1.467 3.014 1060 HB3 LEU 140 HB3 LEU 140 -11.933 -0.229 2.363 1061 HG LEU 140 HG LEU 140 -9.524 0.482 4.003 1062 HD11 LEU 140 HD11 LEU 140 -9.609 0.060 1.021 1063 HD12 LEU 140 HD12 LEU 140 -8.773 -0.959 2.194 1064 HD13 LEU 140 HD13 LEU 140 -8.251 0.706 1.944 1065 HD21 LEU 140 HD21 LEU 140 -11.095 1.972 1.896 1066 HD22 LEU 140 HD22 LEU 140 -9.653 2.576 2.714 1067 HD23 LEU 140 HD23 LEU 140 -11.126 2.272 3.635 1068 H LEU 141 H LEU 141 -14.257 -0.270 3.283 1069 HA LEU 141 HA LEU 141 -14.796 2.479 3.336 1070 HB2 LEU 141 HB2 LEU 141 -16.846 0.255 3.391 1071 HB3 LEU 141 HB3 LEU 141 -17.111 1.899 2.845 1072 HG LEU 141 HG LEU 141 -15.351 -0.158 1.502 1073 HD11 LEU 141 HD11 LEU 141 -17.734 -0.609 1.224 1074 HD12 LEU 141 HD12 LEU 141 -17.012 -0.077 -0.295 1075 HD13 LEU 141 HD13 LEU 141 -17.992 1.043 0.654 1076 HD21 LEU 141 HD21 LEU 141 -15.971 2.689 0.710 1077 HD22 LEU 141 HD22 LEU 141 -15.119 1.510 -0.288 1078 HD23 LEU 141 HD23 LEU 141 -14.406 2.057 1.228 1079 H GLU 142 H GLU 142 -15.801 -0.085 5.570 1080 HA GLU 142 HA GLU 142 -17.308 1.460 7.358 1081 HB2 GLU 142 HB2 GLU 142 -15.603 -0.954 8.024 1082 HB3 GLU 142 HB3 GLU 142 -16.954 -0.338 8.966 1083 HG2 GLU 142 HG2 GLU 142 -18.464 -0.845 7.079 1084 HG3 GLU 142 HG3 GLU 142 -17.098 -1.531 6.203 1085 H ALA 143 H ALA 143 -13.838 0.799 7.250 1086 HA ALA 143 HA ALA 143 -13.142 2.006 9.708 1087 HB1 ALA 143 HB1 ALA 143 -11.424 1.614 7.253 1088 HB2 ALA 143 HB2 ALA 143 -11.688 0.425 8.529 1089 HB3 ALA 143 HB3 ALA 143 -10.848 1.933 8.890 1090 H ILE 144 H ILE 144 -13.085 3.320 6.369 1091 HA ILE 144 HA ILE 144 -12.089 5.862 7.253 1092 HB ILE 144 HB ILE 144 -12.460 6.627 4.920 1093 HG12 ILE 144 HG12 ILE 144 -12.890 4.576 3.303 1094 HG13 ILE 144 HG13 ILE 144 -13.752 3.923 4.689 1095 HG21 ILE 144 HG21 ILE 144 -10.351 5.633 5.601 1096 HG22 ILE 144 HG22 ILE 144 -10.733 5.190 3.937 1097 HG23 ILE 144 HG23 ILE 144 -10.971 4.022 5.236 1098 HD11 ILE 144 HD11 ILE 144 -15.236 5.046 3.123 1099 HD12 ILE 144 HD12 ILE 144 -14.341 6.551 3.345 1100 HD13 ILE 144 HD13 ILE 144 -15.230 5.843 4.694 1101 H GLY 145 H GLY 145 -15.284 4.554 6.935 1102 HA2 GLY 145 HA2 GLY 145 -16.710 6.067 8.489 1103 HA3 GLY 145 HA3 GLY 145 -16.439 7.258 7.235 1104 H SER 146 H SER 146 -16.677 4.961 5.202 1105 HA SER 146 HA SER 146 -19.528 5.307 4.804 1106 HB2 SER 146 HB2 SER 146 -17.500 3.797 3.128 1107 HB3 SER 146 HB3 SER 146 -19.145 4.205 2.638 1108 HG SER 146 HG SER 146 -18.464 6.465 3.002 Start of MODEL 11 1 H1 MET 1 H1 MET 1 -27.079 23.052 62.309 2 H2 MET 1 H2 MET 1 -25.651 22.743 63.161 3 H3 MET 1 H3 MET 1 -26.989 23.388 63.965 4 HA MET 1 HA MET 1 -26.677 21.027 64.434 5 HB2 MET 1 HB2 MET 1 -29.171 21.757 62.883 6 HB3 MET 1 HB3 MET 1 -29.011 20.329 63.896 7 HG2 MET 1 HG2 MET 1 -30.205 22.140 65.024 8 HG3 MET 1 HG3 MET 1 -28.712 21.708 65.861 9 HE1 MET 1 HE1 MET 1 -28.899 23.963 67.242 10 HE2 MET 1 HE2 MET 1 -30.361 24.435 66.372 11 HE3 MET 1 HE3 MET 1 -29.009 25.561 66.508 12 H GLY 2 H GLY 2 -25.142 19.812 63.385 13 HA2 GLY 2 HA2 GLY 2 -25.324 17.697 62.028 14 HA3 GLY 2 HA3 GLY 2 -25.906 18.723 60.730 15 H SER 3 H SER 3 -23.990 17.329 59.860 16 HA SER 3 HA SER 3 -21.860 19.091 59.236 17 HB2 SER 3 HB2 SER 3 -19.980 17.771 60.221 18 HB3 SER 3 HB3 SER 3 -20.997 18.527 61.446 19 HG SER 3 HG SER 3 -22.139 16.335 61.316 20 H SER 4 H SER 4 -21.028 18.514 57.291 21 HA SER 4 HA SER 4 -22.175 16.258 55.931 22 HB2 SER 4 HB2 SER 4 -20.980 17.080 53.960 23 HB3 SER 4 HB3 SER 4 -21.769 18.418 54.793 24 HG SER 4 HG SER 4 -19.874 19.228 55.341 25 H HIS 5 H HIS 5 -20.708 14.865 54.472 26 HA HIS 5 HA HIS 5 -18.168 14.135 55.750 27 HB2 HIS 5 HB2 HIS 5 -19.968 12.692 56.717 28 HB3 HIS 5 HB3 HIS 5 -20.332 12.112 55.096 29 HD1 HIS 5 HD1 HIS 5 -17.134 12.382 57.160 30 HD2 HIS 5 HD2 HIS 5 -19.201 9.690 54.764 31 HE1 HIS 5 HE1 HIS 5 -15.741 10.304 57.136 32 HE2 HIS 5 HE2 HIS 5 -17.094 8.630 55.838 33 H HIS 6 H HIS 6 -16.680 14.253 54.169 34 HA HIS 6 HA HIS 6 -17.398 13.357 51.439 35 HB2 HIS 6 HB2 HIS 6 -15.962 15.889 52.248 36 HB3 HIS 6 HB3 HIS 6 -15.898 15.244 50.615 37 HD1 HIS 6 HD1 HIS 6 -17.488 16.379 49.126 38 HD2 HIS 6 HD2 HIS 6 -18.923 16.193 53.021 39 HE1 HIS 6 HE1 HIS 6 -19.711 17.541 49.082 40 HE2 HIS 6 HE2 HIS 6 -20.612 17.311 51.415 41 H HIS 7 H HIS 7 -16.117 11.725 50.826 42 HA HIS 7 HA HIS 7 -13.218 11.990 51.120 43 HB2 HIS 7 HB2 HIS 7 -14.804 9.634 52.141 44 HB3 HIS 7 HB3 HIS 7 -13.118 9.471 51.678 45 HD1 HIS 7 HD1 HIS 7 -14.593 9.295 54.616 46 HD2 HIS 7 HD2 HIS 7 -11.978 12.184 53.176 47 HE1 HIS 7 HE1 HIS 7 -13.575 10.358 56.648 48 HE2 HIS 7 HE2 HIS 7 -11.813 11.896 55.739 49 H HIS 8 H HIS 8 -12.277 11.627 49.204 50 HA HIS 8 HA HIS 8 -13.194 9.459 47.483 51 HB2 HIS 8 HB2 HIS 8 -13.065 12.339 46.565 52 HB3 HIS 8 HB3 HIS 8 -13.042 10.982 45.449 53 HD1 HIS 8 HD1 HIS 8 -15.252 9.484 45.412 54 HD2 HIS 8 HD2 HIS 8 -15.569 13.117 47.395 55 HE1 HIS 8 HE1 HIS 8 -17.711 9.907 45.644 56 HE2 HIS 8 HE2 HIS 8 -17.867 12.210 46.636 57 H HIS 9 H HIS 9 -11.562 8.607 46.156 58 HA HIS 9 HA HIS 9 -8.978 9.939 45.989 59 HB2 HIS 9 HB2 HIS 9 -8.916 8.727 48.163 60 HB3 HIS 9 HB3 HIS 9 -9.222 7.219 47.310 61 HD1 HIS 9 HD1 HIS 9 -7.217 6.010 46.391 62 HD2 HIS 9 HD2 HIS 9 -6.332 9.903 47.552 63 HE1 HIS 9 HE1 HIS 9 -4.720 6.209 46.235 64 HE2 HIS 9 HE2 HIS 9 -4.236 8.624 46.739 65 H HIS 10 H HIS 10 -7.775 9.290 44.206 66 HA HIS 10 HA HIS 10 -8.754 7.031 42.595 67 HB2 HIS 10 HB2 HIS 10 -9.883 9.165 41.868 68 HB3 HIS 10 HB3 HIS 10 -8.296 9.806 41.458 69 HD1 HIS 10 HD1 HIS 10 -7.172 8.912 39.317 70 HD2 HIS 10 HD2 HIS 10 -10.905 7.251 40.075 71 HE1 HIS 10 HE1 HIS 10 -7.835 7.755 37.196 72 HE2 HIS 10 HE2 HIS 10 -10.158 6.904 37.623 73 H SER 11 H SER 11 -7.179 6.076 41.246 74 HA SER 11 HA SER 11 -4.415 7.103 41.589 75 HB2 SER 11 HB2 SER 11 -4.850 5.040 42.895 76 HB3 SER 11 HB3 SER 11 -5.258 4.199 41.400 77 HG SER 11 HG SER 11 -2.759 5.192 42.268 78 H SER 12 H SER 12 -2.880 5.907 39.908 79 HA SER 12 HA SER 12 -4.002 6.560 37.277 80 HB2 SER 12 HB2 SER 12 -1.862 7.621 37.997 81 HB3 SER 12 HB3 SER 12 -1.111 6.026 38.014 82 HG SER 12 HG SER 12 -1.760 7.664 35.887 83 H GLY 13 H GLY 13 -2.673 5.161 35.459 84 HA2 GLY 13 HA2 GLY 13 -3.523 2.377 36.028 85 HA3 GLY 13 HA3 GLY 13 -3.786 3.181 34.493 86 H ARG 14 H ARG 14 -2.299 2.911 32.912 87 HA ARG 14 HA ARG 14 0.088 1.313 33.616 88 HB2 ARG 14 HB2 ARG 14 -0.262 -0.105 31.781 89 HB3 ARG 14 HB3 ARG 14 -1.852 0.102 32.492 90 HG2 ARG 14 HG2 ARG 14 -0.833 1.546 30.044 91 HG3 ARG 14 HG3 ARG 14 -1.881 0.134 30.034 92 HD2 ARG 14 HD2 ARG 14 -3.396 1.854 29.743 93 HD3 ARG 14 HD3 ARG 14 -3.459 1.616 31.488 94 HE ARG 14 HE ARG 14 -1.614 3.543 31.269 95 HH11 ARG 14 HH11 ARG 14 -4.697 3.256 29.742 96 HH12 ARG 14 HH12 ARG 14 -4.945 4.969 29.720 97 HH21 ARG 14 HH21 ARG 14 -1.957 5.723 31.214 98 HH22 ARG 14 HH22 ARG 14 -3.424 6.337 30.530 99 H GLU 15 H GLU 15 1.602 1.147 31.578 100 HA GLU 15 HA GLU 15 2.221 3.888 30.706 101 HB2 GLU 15 HB2 GLU 15 3.917 1.374 30.734 102 HB3 GLU 15 HB3 GLU 15 4.460 2.930 30.128 103 HG2 GLU 15 HG2 GLU 15 5.343 2.580 32.326 104 HG3 GLU 15 HG3 GLU 15 4.165 3.886 32.379 105 H ASN 16 H ASN 16 3.283 4.017 28.469 106 HA ASN 16 HA ASN 16 1.875 2.275 26.546 107 HB2 ASN 16 HB2 ASN 16 1.405 4.662 26.254 108 HB3 ASN 16 HB3 ASN 16 3.127 5.008 26.141 109 HD21 ASN 16 HD21 ASN 16 0.398 3.525 24.531 110 HD22 ASN 16 HD22 ASN 16 1.108 3.499 22.958 111 H LEU 17 H LEU 17 3.053 0.714 25.613 112 HA LEU 17 HA LEU 17 5.909 0.617 26.034 113 HB2 LEU 17 HB2 LEU 17 3.898 -1.288 24.881 114 HB3 LEU 17 HB3 LEU 17 5.614 -1.597 24.705 115 HG LEU 17 HG LEU 17 4.701 -2.826 26.598 116 HD11 LEU 17 HD11 LEU 17 6.522 -0.592 27.485 117 HD12 LEU 17 HD12 LEU 17 7.022 -2.094 26.705 118 HD13 LEU 17 HD13 LEU 17 6.289 -2.136 28.308 119 HD21 LEU 17 HD21 LEU 17 3.864 -1.695 28.590 120 HD22 LEU 17 HD22 LEU 17 2.854 -1.337 27.189 121 HD23 LEU 17 HD23 LEU 17 4.004 -0.135 27.776 122 H TYR 18 H TYR 18 7.334 -0.204 24.187 123 HA TYR 18 HA TYR 18 7.257 1.921 22.200 124 HB2 TYR 18 HB2 TYR 18 9.422 -0.107 22.820 125 HB3 TYR 18 HB3 TYR 18 9.591 1.276 21.745 126 HD1 TYR 18 HD1 TYR 18 9.360 0.196 25.250 127 HD2 TYR 18 HD2 TYR 18 9.816 3.530 22.641 128 HE1 TYR 18 HE1 TYR 18 10.078 1.578 27.152 129 HE2 TYR 18 HE2 TYR 18 10.534 4.919 24.535 130 HH TYR 18 HH TYR 18 11.336 3.607 27.594 131 H PHE 19 H PHE 19 6.888 1.674 20.068 132 HA PHE 19 HA PHE 19 6.492 -1.007 18.956 133 HB2 PHE 19 HB2 PHE 19 4.769 0.678 18.493 134 HB3 PHE 19 HB3 PHE 19 5.974 1.737 17.771 135 HD1 PHE 19 HD2 PHE 19 4.520 -1.678 17.405 136 HD2 PHE 19 HD1 PHE 19 6.306 1.672 15.471 137 HE1 PHE 19 HE2 PHE 19 4.113 -2.726 15.221 138 HE2 PHE 19 HE1 PHE 19 5.901 0.627 13.282 139 HZ PHE 19 HZ PHE 19 4.805 -1.575 13.154 140 H GLN 20 H GLN 20 8.454 -1.906 18.496 141 HA GLN 20 HA GLN 20 10.536 -0.325 17.198 142 HB2 GLN 20 HB2 GLN 20 11.090 -1.913 19.046 143 HB3 GLN 20 HB3 GLN 20 10.580 -3.243 18.015 144 HG2 GLN 20 HG2 GLN 20 12.341 -2.619 16.392 145 HG3 GLN 20 HG3 GLN 20 12.887 -1.366 17.509 146 HE21 GLN 20 HE21 GLN 20 12.756 -4.759 16.856 147 HE22 GLN 20 HE22 GLN 20 13.855 -5.250 18.091 148 H GLY 21 H GLY 21 9.764 0.049 15.126 149 HA2 GLY 21 HA2 GLY 21 9.767 -2.309 13.351 150 HA3 GLY 21 HA3 GLY 21 8.469 -1.130 13.235 151 H HIS 22 H HIS 22 11.301 -2.060 11.847 152 HA HIS 22 HA HIS 22 12.390 0.557 11.273 153 HB2 HIS 22 HB2 HIS 22 13.889 -1.382 11.494 154 HB3 HIS 22 HB3 HIS 22 13.106 -2.156 10.119 155 HD1 HIS 22 HD1 HIS 22 15.078 1.012 10.868 156 HD2 HIS 22 HD2 HIS 22 14.310 -1.602 7.728 157 HE1 HIS 22 HE1 HIS 22 16.560 1.767 8.991 158 HE2 HIS 22 HE2 HIS 22 16.226 0.057 7.183 159 H MET 23 H MET 23 10.599 1.588 10.274 160 HA MET 23 HA MET 23 9.569 0.587 7.761 161 HB2 MET 23 HB2 MET 23 8.330 2.751 7.683 162 HB3 MET 23 HB3 MET 23 8.051 1.827 9.151 163 HG2 MET 23 HG2 MET 23 9.279 3.294 10.467 164 HG3 MET 23 HG3 MET 23 10.120 3.988 9.083 165 HE1 MET 23 HE1 MET 23 6.331 3.263 8.858 166 HE2 MET 23 HE2 MET 23 5.596 4.698 9.574 167 HE3 MET 23 HE3 MET 23 6.460 3.551 10.595 168 H LEU 24 H LEU 24 9.539 2.014 5.814 169 HA LEU 24 HA LEU 24 12.100 3.447 5.451 170 HB2 LEU 24 HB2 LEU 24 10.678 1.490 3.682 171 HB3 LEU 24 HB3 LEU 24 11.704 2.715 2.963 172 HG LEU 24 HG LEU 24 12.755 0.891 5.111 173 HD11 LEU 24 HD11 LEU 24 13.616 -0.578 3.346 174 HD12 LEU 24 HD12 LEU 24 12.737 0.360 2.138 175 HD13 LEU 24 HD13 LEU 24 11.854 -0.553 3.361 176 HD21 LEU 24 HD21 LEU 24 14.064 2.437 2.869 177 HD22 LEU 24 HD22 LEU 24 14.902 1.409 4.036 178 HD23 LEU 24 HD23 LEU 24 14.074 2.866 4.584 179 H GLU 25 H GLU 25 12.058 5.407 4.494 180 HA GLU 25 HA GLU 25 9.508 6.679 4.007 181 HB2 GLU 25 HB2 GLU 25 12.343 7.587 4.108 182 HB3 GLU 25 HB3 GLU 25 11.220 8.554 3.155 183 HG2 GLU 25 HG2 GLU 25 9.823 8.935 5.050 184 HG3 GLU 25 HG3 GLU 25 10.734 7.781 6.017 185 H VAL 26 H VAL 26 8.461 6.645 2.190 186 HA VAL 26 HA VAL 26 9.881 6.244 -0.356 187 HB VAL 26 HB VAL 26 8.229 4.525 -1.057 188 HG11 VAL 26 HG11 VAL 26 10.414 3.812 -0.234 189 HG12 VAL 26 HG12 VAL 26 9.165 2.657 0.232 190 HG13 VAL 26 HG13 VAL 26 9.800 3.796 1.420 191 HG21 VAL 26 HG21 VAL 26 7.366 4.611 1.840 192 HG22 VAL 26 HG22 VAL 26 6.860 3.399 0.662 193 HG23 VAL 26 HG23 VAL 26 6.399 5.087 0.443 194 H GLU 27 H GLU 27 8.585 6.726 -2.259 195 HA GLU 27 HA GLU 27 6.469 8.689 -1.712 196 HB2 GLU 27 HB2 GLU 27 8.326 9.381 -3.185 197 HB3 GLU 27 HB3 GLU 27 7.923 8.079 -4.300 198 HG2 GLU 27 HG2 GLU 27 5.816 9.098 -4.828 199 HG3 GLU 27 HG3 GLU 27 6.031 10.309 -3.566 200 H VAL 28 H VAL 28 4.470 7.962 -1.697 201 HA VAL 28 HA VAL 28 3.762 5.419 -2.910 202 HB VAL 28 HB VAL 28 2.060 7.278 -1.231 203 HG11 VAL 28 HG11 VAL 28 1.698 4.358 -1.922 204 HG12 VAL 28 HG12 VAL 28 0.735 5.704 -2.534 205 HG13 VAL 28 HG13 VAL 28 0.680 5.288 -0.821 206 HG21 VAL 28 HG21 VAL 28 4.058 6.582 -0.002 207 HG22 VAL 28 HG22 VAL 28 3.701 4.891 -0.359 208 HG23 VAL 28 HG23 VAL 28 2.612 5.825 0.666 209 H ILE 29 H ILE 29 3.278 5.517 -5.040 210 HA ILE 29 HA ILE 29 1.867 7.837 -6.125 211 HB ILE 29 HB ILE 29 2.638 5.473 -7.804 212 HG12 ILE 29 HG12 ILE 29 4.582 7.634 -6.939 213 HG13 ILE 29 HG13 ILE 29 4.589 5.993 -6.311 214 HG21 ILE 29 HG21 ILE 29 2.581 8.465 -8.250 215 HG22 ILE 29 HG22 ILE 29 1.411 7.286 -8.848 216 HG23 ILE 29 HG23 ILE 29 3.065 7.271 -9.460 217 HD11 ILE 29 HD11 ILE 29 5.058 5.134 -8.537 218 HD12 ILE 29 HD12 ILE 29 6.280 6.293 -8.011 219 HD13 ILE 29 HD13 ILE 29 5.048 6.779 -9.176 220 H SER 30 H SER 30 0.032 7.465 -7.666 221 HA SER 30 HA SER 30 -1.559 5.079 -7.009 222 HB2 SER 30 HB2 SER 30 -2.297 7.017 -5.602 223 HB3 SER 30 HB3 SER 30 -2.730 7.868 -7.084 224 HG SER 30 HG SER 30 -3.777 5.366 -6.243 225 H GLY 31 H GLY 31 -1.950 4.025 -8.861 226 HA2 GLY 31 HA2 GLY 31 -2.396 5.626 -11.325 227 HA3 GLY 31 HA3 GLY 31 -1.625 4.050 -11.311 228 H ARG 32 H ARG 32 -4.305 5.458 -12.318 229 HA ARG 32 HA ARG 32 -6.425 3.944 -11.184 230 HB2 ARG 32 HB2 ARG 32 -6.289 5.431 -13.819 231 HB3 ARG 32 HB3 ARG 32 -7.765 4.825 -13.075 232 HG2 ARG 32 HG2 ARG 32 -7.477 6.313 -11.190 233 HG3 ARG 32 HG3 ARG 32 -5.925 6.862 -11.819 234 HD2 ARG 32 HD2 ARG 32 -7.719 8.475 -12.266 235 HD3 ARG 32 HD3 ARG 32 -7.023 7.838 -13.757 236 HE ARG 32 HE ARG 32 -9.029 6.309 -13.775 237 HH11 ARG 32 HH11 ARG 32 -9.148 9.407 -12.258 238 HH12 ARG 32 HH12 ARG 32 -10.852 9.572 -12.510 239 HH21 ARG 32 HH21 ARG 32 -11.203 6.568 -14.111 240 HH22 ARG 32 HH22 ARG 32 -11.990 8.002 -13.540 241 H THR 33 H THR 33 -6.078 1.741 -11.270 242 HA THR 33 HA THR 33 -5.318 0.420 -13.728 243 HB THR 33 HB THR 33 -5.590 -1.696 -12.394 244 HG1 THR 33 HG1 THR 33 -5.810 -1.321 -10.066 245 HG21 THR 33 HG21 THR 33 -3.854 0.428 -11.123 246 HG22 THR 33 HG22 THR 33 -3.423 -0.535 -12.537 247 HG23 THR 33 HG23 THR 33 -3.641 -1.314 -10.969 248 H LEU 34 H LEU 34 -8.288 0.591 -11.760 249 HA LEU 34 HA LEU 34 -9.790 -1.295 -13.201 250 HB2 LEU 34 HB2 LEU 34 -10.593 1.036 -11.488 251 HB3 LEU 34 HB3 LEU 34 -11.797 0.051 -12.295 252 HG LEU 34 HG LEU 34 -11.569 -0.704 -10.030 253 HD11 LEU 34 HD11 LEU 34 -10.246 -2.654 -11.909 254 HD12 LEU 34 HD12 LEU 34 -11.982 -2.432 -11.676 255 HD13 LEU 34 HD13 LEU 34 -10.988 -3.055 -10.360 256 HD21 LEU 34 HD21 LEU 34 -9.473 -1.571 -9.124 257 HD22 LEU 34 HD22 LEU 34 -9.344 0.136 -9.544 258 HD23 LEU 34 HD23 LEU 34 -8.633 -1.087 -10.597 259 H ASN 35 H ASN 35 -11.468 -1.074 -14.738 260 HA ASN 35 HA ASN 35 -10.829 0.600 -16.930 261 HB2 ASN 35 HB2 ASN 35 -13.369 -0.979 -16.445 262 HB3 ASN 35 HB3 ASN 35 -12.811 -0.361 -17.999 263 HD21 ASN 35 HD21 ASN 35 -13.363 -3.100 -17.206 264 HD22 ASN 35 HD22 ASN 35 -11.897 -3.975 -17.451 265 H GLN 36 H GLN 36 -11.079 2.761 -16.791 266 HA GLN 36 HA GLN 36 -12.021 4.812 -16.660 267 HB2 GLN 36 HB2 GLN 36 -14.590 3.256 -16.977 268 HB3 GLN 36 HB3 GLN 36 -14.467 5.007 -17.087 269 HG2 GLN 36 HG2 GLN 36 -12.871 4.712 -18.981 270 HG3 GLN 36 HG3 GLN 36 -13.188 2.979 -18.914 271 HE21 GLN 36 HE21 GLN 36 -13.691 4.883 -21.069 272 HE22 GLN 36 HE22 GLN 36 -15.382 4.786 -21.402 273 H GLY 37 H GLY 37 -13.692 6.216 -15.467 274 HA2 GLY 37 HA2 GLY 37 -13.192 5.782 -12.655 275 HA3 GLY 37 HA3 GLY 37 -13.924 7.197 -13.385 276 H ALA 38 H ALA 38 -14.622 5.539 -11.005 277 HA ALA 38 HA ALA 38 -17.413 5.742 -11.086 278 HB1 ALA 38 HB1 ALA 38 -18.129 3.423 -11.126 279 HB2 ALA 38 HB2 ALA 38 -16.462 2.877 -11.314 280 HB3 ALA 38 HB3 ALA 38 -17.246 3.783 -12.610 281 H THR 39 H THR 39 -18.420 4.929 -9.060 282 HA THR 39 HA THR 39 -16.641 4.965 -6.797 283 HB THR 39 HB THR 39 -18.617 4.584 -5.414 284 HG1 THR 39 HG1 THR 39 -20.696 4.526 -6.828 285 HG21 THR 39 HG21 THR 39 -19.220 6.521 -7.654 286 HG22 THR 39 HG22 THR 39 -18.225 6.860 -6.238 287 HG23 THR 39 HG23 THR 39 -19.948 6.533 -6.048 288 H VAL 40 H VAL 40 -16.398 3.217 -5.242 289 HA VAL 40 HA VAL 40 -15.716 0.756 -6.374 290 HB VAL 40 HB VAL 40 -15.491 -0.132 -4.125 291 HG11 VAL 40 HG11 VAL 40 -14.622 2.761 -4.267 292 HG12 VAL 40 HG12 VAL 40 -13.758 1.381 -4.944 293 HG13 VAL 40 HG13 VAL 40 -13.948 1.529 -3.197 294 HG21 VAL 40 HG21 VAL 40 -16.178 1.162 -2.148 295 HG22 VAL 40 HG22 VAL 40 -17.559 0.703 -3.140 296 HG23 VAL 40 HG23 VAL 40 -16.944 2.354 -3.201 297 H GLU 41 H GLU 41 -18.761 1.844 -5.050 298 HA GLU 41 HA GLU 41 -20.130 -0.586 -4.806 299 HB2 GLU 41 HB2 GLU 41 -21.031 1.476 -3.902 300 HB3 GLU 41 HB3 GLU 41 -21.147 2.179 -5.510 301 HG2 GLU 41 HG2 GLU 41 -22.857 0.537 -6.113 302 HG3 GLU 41 HG3 GLU 41 -22.726 -0.195 -4.514 303 H GLU 42 H GLU 42 -19.576 1.475 -7.618 304 HA GLU 42 HA GLU 42 -21.323 0.150 -9.415 305 HB2 GLU 42 HB2 GLU 42 -18.860 1.838 -9.888 306 HB3 GLU 42 HB3 GLU 42 -19.906 1.263 -11.181 307 HG2 GLU 42 HG2 GLU 42 -20.766 3.048 -8.909 308 HG3 GLU 42 HG3 GLU 42 -20.365 3.589 -10.538 309 H LYS 43 H LYS 43 -18.328 -0.834 -8.099 310 HA LYS 43 HA LYS 43 -18.001 -2.896 -10.185 311 HB2 LYS 43 HB2 LYS 43 -15.730 -1.327 -8.970 312 HB3 LYS 43 HB3 LYS 43 -15.601 -2.578 -10.198 313 HG2 LYS 43 HG2 LYS 43 -16.906 -1.122 -11.736 314 HG3 LYS 43 HG3 LYS 43 -16.858 0.144 -10.504 315 HD2 LYS 43 HD2 LYS 43 -14.371 0.043 -10.571 316 HD3 LYS 43 HD3 LYS 43 -14.488 -1.123 -11.889 317 HE2 LYS 43 HE2 LYS 43 -15.798 0.613 -13.162 318 HE3 LYS 43 HE3 LYS 43 -15.376 1.757 -11.888 319 HZ1 LYS 43 HZ1 LYS 43 -13.863 1.889 -13.786 320 HZ2 LYS 43 HZ2 LYS 43 -13.424 0.270 -13.562 321 HZ3 LYS 43 HZ3 LYS 43 -13.051 1.419 -12.378 322 H LEU 44 H LEU 44 -19.149 -3.110 -7.476 323 HA LEU 44 HA LEU 44 -17.308 -4.367 -5.732 324 HB2 LEU 44 HB2 LEU 44 -20.129 -3.856 -5.776 325 HB3 LEU 44 HB3 LEU 44 -19.895 -5.544 -5.379 326 HG LEU 44 HG LEU 44 -20.062 -4.279 -3.341 327 HD11 LEU 44 HD11 LEU 44 -17.199 -5.089 -3.837 328 HD12 LEU 44 HD12 LEU 44 -18.506 -6.141 -3.291 329 HD13 LEU 44 HD13 LEU 44 -17.936 -4.833 -2.255 330 HD21 LEU 44 HD21 LEU 44 -19.433 -2.083 -4.198 331 HD22 LEU 44 HD22 LEU 44 -17.758 -2.613 -4.358 332 HD23 LEU 44 HD23 LEU 44 -18.497 -2.492 -2.761 333 H THR 45 H THR 45 -16.033 -5.741 -7.031 334 HA THR 45 HA THR 45 -17.104 -8.433 -7.285 335 HB THR 45 HB THR 45 -17.659 -7.578 -9.486 336 HG1 THR 45 HG1 THR 45 -16.962 -9.392 -10.325 337 HG21 THR 45 HG21 THR 45 -14.733 -6.834 -9.724 338 HG22 THR 45 HG22 THR 45 -16.085 -5.707 -9.613 339 HG23 THR 45 HG23 THR 45 -15.922 -6.748 -11.025 340 H GLU 46 H GLU 46 -15.319 -9.952 -8.157 341 HA GLU 46 HA GLU 46 -13.164 -9.916 -6.384 342 HB2 GLU 46 HB2 GLU 46 -14.024 -11.949 -7.482 343 HB3 GLU 46 HB3 GLU 46 -13.383 -11.394 -9.022 344 HG2 GLU 46 HG2 GLU 46 -11.112 -11.549 -8.161 345 HG3 GLU 46 HG3 GLU 46 -11.729 -12.032 -6.581 346 H GLU 47 H GLU 47 -13.387 -8.673 -9.685 347 HA GLU 47 HA GLU 47 -10.716 -8.166 -10.258 348 HB2 GLU 47 HB2 GLU 47 -13.145 -6.493 -10.947 349 HB3 GLU 47 HB3 GLU 47 -11.552 -6.263 -11.659 350 HG2 GLU 47 HG2 GLU 47 -11.646 -8.509 -12.613 351 HG3 GLU 47 HG3 GLU 47 -13.234 -8.757 -11.886 352 H TYR 48 H TYR 48 -13.007 -6.113 -8.465 353 HA TYR 48 HA TYR 48 -11.155 -4.005 -7.988 354 HB2 TYR 48 HB2 TYR 48 -13.875 -4.299 -7.701 355 HB3 TYR 48 HB3 TYR 48 -13.342 -4.318 -6.024 356 HD1 TYR 48 HD1 TYR 48 -11.986 -2.340 -5.160 357 HD2 TYR 48 HD2 TYR 48 -13.990 -2.283 -8.918 358 HE1 TYR 48 HE1 TYR 48 -11.825 0.111 -5.211 359 HE2 TYR 48 HE2 TYR 48 -13.831 0.171 -8.973 360 HH TYR 48 HH TYR 48 -11.832 1.936 -6.909 361 H PHE 49 H PHE 49 -11.728 -7.066 -6.471 362 HA PHE 49 HA PHE 49 -10.371 -6.327 -4.004 363 HB2 PHE 49 HB2 PHE 49 -12.344 -7.874 -4.011 364 HB3 PHE 49 HB3 PHE 49 -11.357 -9.064 -4.852 365 HD1 PHE 49 HD1 PHE 49 -11.153 -6.906 -1.797 366 HD2 PHE 49 HD2 PHE 49 -10.398 -10.716 -3.549 367 HE1 PHE 49 HE1 PHE 49 -10.331 -7.738 0.368 368 HE2 PHE 49 HE2 PHE 49 -9.574 -11.548 -1.388 369 HZ PHE 49 HZ PHE 49 -9.542 -10.061 0.573 370 H ASN 50 H ASN 50 -9.250 -7.118 -7.035 371 HA ASN 50 HA ASN 50 -6.710 -7.953 -5.782 372 HB2 ASN 50 HB2 ASN 50 -6.047 -9.072 -7.855 373 HB3 ASN 50 HB3 ASN 50 -7.530 -9.756 -7.207 374 HD21 ASN 50 HD21 ASN 50 -9.393 -9.622 -8.398 375 HD22 ASN 50 HD22 ASN 50 -9.425 -9.043 -10.027 376 H ALA 51 H ALA 51 -8.109 -6.041 -8.431 377 HA ALA 51 HA ALA 51 -5.762 -5.139 -9.592 378 HB1 ALA 51 HB1 ALA 51 -8.400 -3.682 -9.500 379 HB2 ALA 51 HB2 ALA 51 -7.974 -4.971 -10.624 380 HB3 ALA 51 HB3 ALA 51 -7.106 -3.437 -10.676 381 H VAL 52 H VAL 52 -7.162 -4.013 -6.610 382 HA VAL 52 HA VAL 52 -5.166 -1.827 -6.522 383 HB VAL 52 HB VAL 52 -6.800 -0.456 -5.212 384 HG11 VAL 52 HG11 VAL 52 -7.652 -1.181 -8.018 385 HG12 VAL 52 HG12 VAL 52 -6.430 0.012 -7.572 386 HG13 VAL 52 HG13 VAL 52 -8.121 0.281 -7.149 387 HG21 VAL 52 HG21 VAL 52 -8.779 -2.552 -6.125 388 HG22 VAL 52 HG22 VAL 52 -9.191 -1.021 -5.350 389 HG23 VAL 52 HG23 VAL 52 -8.280 -2.242 -4.460 390 H ASN 53 H ASN 53 -5.389 -4.645 -5.270 391 HA ASN 53 HA ASN 53 -5.479 -3.895 -2.415 392 HB2 ASN 53 HB2 ASN 53 -5.691 -6.600 -3.750 393 HB3 ASN 53 HB3 ASN 53 -5.635 -6.367 -2.007 394 HD21 ASN 53 HD21 ASN 53 -7.341 -4.307 -4.307 395 HD22 ASN 53 HD22 ASN 53 -8.918 -4.687 -3.734 396 H TYR 54 H TYR 54 -3.109 -3.639 -4.376 397 HA TYR 54 HA TYR 54 -1.135 -4.887 -2.604 398 HB2 TYR 54 HB2 TYR 54 0.174 -5.730 -4.539 399 HB3 TYR 54 HB3 TYR 54 -1.394 -6.513 -4.386 400 HD1 TYR 54 HD1 TYR 54 0.575 -4.097 -6.380 401 HD2 TYR 54 HD2 TYR 54 -3.070 -6.277 -6.090 402 HE1 TYR 54 HE1 TYR 54 0.050 -3.524 -8.715 403 HE2 TYR 54 HE2 TYR 54 -3.603 -5.704 -8.418 404 HH TYR 54 HH TYR 54 -3.057 -4.133 -10.103 405 H ALA 55 H ALA 55 1.048 -4.075 -2.901 406 HA ALA 55 HA ALA 55 1.218 -1.448 -4.249 407 HB1 ALA 55 HB1 ALA 55 2.690 -0.675 -2.464 408 HB2 ALA 55 HB2 ALA 55 2.541 -2.229 -1.643 409 HB3 ALA 55 HB3 ALA 55 1.134 -1.177 -1.803 410 H GLU 56 H GLU 56 2.810 -1.323 -5.743 411 HA GLU 56 HA GLU 56 4.695 -3.532 -5.972 412 HB2 GLU 56 HB2 GLU 56 4.200 -1.170 -7.802 413 HB3 GLU 56 HB3 GLU 56 5.325 -2.484 -8.137 414 HG2 GLU 56 HG2 GLU 56 3.382 -4.069 -7.966 415 HG3 GLU 56 HG3 GLU 56 2.327 -2.661 -7.880 416 H ILE 57 H ILE 57 6.656 -3.499 -5.209 417 HA ILE 57 HA ILE 57 7.767 -0.980 -4.141 418 HB ILE 57 HB ILE 57 8.066 -3.778 -3.017 419 HG12 ILE 57 HG12 ILE 57 6.376 -1.546 -1.868 420 HG13 ILE 57 HG13 ILE 57 5.715 -2.769 -2.948 421 HG21 ILE 57 HG21 ILE 57 8.809 -1.088 -1.853 422 HG22 ILE 57 HG22 ILE 57 9.927 -2.324 -2.431 423 HG23 ILE 57 HG23 ILE 57 8.926 -2.636 -1.014 424 HD11 ILE 57 HD11 ILE 57 6.267 -4.511 -1.377 425 HD12 ILE 57 HD12 ILE 57 5.306 -3.259 -0.585 426 HD13 ILE 57 HD13 ILE 57 7.047 -3.338 -0.310 427 H ASN 58 H ASN 58 10.074 -0.774 -4.081 428 HA ASN 58 HA ASN 58 11.515 -2.052 -6.213 429 HB2 ASN 58 HB2 ASN 58 11.951 0.284 -5.599 430 HB3 ASN 58 HB3 ASN 58 12.480 -0.223 -3.998 431 HD21 ASN 58 HD21 ASN 58 13.281 -0.121 -7.371 432 HD22 ASN 58 HD22 ASN 58 14.951 -0.522 -7.190 433 H GLU 59 H GLU 59 13.241 -3.529 -6.045 434 HA GLU 59 HA GLU 59 12.920 -5.514 -4.069 435 HB2 GLU 59 HB2 GLU 59 13.720 -6.079 -6.279 436 HB3 GLU 59 HB3 GLU 59 15.169 -5.109 -6.043 437 HG2 GLU 59 HG2 GLU 59 16.085 -6.625 -4.516 438 HG3 GLU 59 HG3 GLU 59 14.537 -7.412 -4.223 439 H GLU 60 H GLU 60 15.296 -2.897 -4.310 440 HA GLU 60 HA GLU 60 17.034 -3.804 -2.285 441 HB2 GLU 60 HB2 GLU 60 16.440 -0.962 -3.150 442 HB3 GLU 60 HB3 GLU 60 17.809 -1.454 -2.159 443 HG2 GLU 60 HG2 GLU 60 17.283 -2.346 -4.992 444 HG3 GLU 60 HG3 GLU 60 18.445 -1.116 -4.498 445 H ASP 61 H ASP 61 14.268 -1.524 -2.064 446 HA ASP 61 HA ASP 61 14.344 -1.285 0.768 447 HB2 ASP 61 HB2 ASP 61 11.961 -0.971 -1.076 448 HB3 ASP 61 HB3 ASP 61 12.079 -0.374 0.577 449 H TRP 62 H TRP 62 12.711 -3.483 -1.427 450 HA TRP 62 HA TRP 62 11.093 -4.945 0.274 451 HB2 TRP 62 HB2 TRP 62 11.251 -5.184 -2.200 452 HB3 TRP 62 HB3 TRP 62 12.797 -5.997 -2.008 453 HD1 TRP 62 HD1 TRP 62 12.715 -8.489 -0.874 454 HE1 TRP 62 HE1 TRP 62 10.843 -10.252 -0.916 455 HE3 TRP 62 HE3 TRP 62 8.800 -5.494 -2.249 456 HZ2 TRP 62 HZ2 TRP 62 8.086 -10.354 -1.464 457 HZ3 TRP 62 HZ3 TRP 62 6.576 -6.508 -2.506 458 HH2 TRP 62 HH2 TRP 62 6.229 -8.895 -2.124 459 H ASN 63 H ASN 63 14.543 -5.410 -0.430 460 HA ASN 63 HA ASN 63 14.989 -7.582 1.331 461 HB2 ASN 63 HB2 ASN 63 16.944 -5.468 0.389 462 HB3 ASN 63 HB3 ASN 63 17.371 -7.031 1.077 463 HD21 ASN 63 HD21 ASN 63 17.864 -5.760 -1.580 464 HD22 ASN 63 HD22 ASN 63 17.305 -6.917 -2.732 465 H ALA 64 H ALA 64 15.246 -4.068 1.752 466 HA ALA 64 HA ALA 64 16.420 -4.024 4.303 467 HB1 ALA 64 HB1 ALA 64 14.530 -2.003 3.095 468 HB2 ALA 64 HB2 ALA 64 16.276 -2.056 2.844 469 HB3 ALA 64 HB3 ALA 64 15.626 -1.723 4.450 470 H LEU 65 H LEU 65 13.014 -4.190 3.342 471 HA LEU 65 HA LEU 65 12.091 -4.215 6.095 472 HB2 LEU 65 HB2 LEU 65 10.617 -4.657 3.489 473 HB3 LEU 65 HB3 LEU 65 9.855 -4.532 5.065 474 HG LEU 65 HG LEU 65 11.459 -2.315 3.772 475 HD11 LEU 65 HD11 LEU 65 9.316 -1.232 3.340 476 HD12 LEU 65 HD12 LEU 65 8.464 -2.643 3.970 477 HD13 LEU 65 HD13 LEU 65 9.424 -2.777 2.496 478 HD21 LEU 65 HD21 LEU 65 11.427 -2.230 6.223 479 HD22 LEU 65 HD22 LEU 65 9.664 -2.313 6.205 480 HD23 LEU 65 HD23 LEU 65 10.489 -0.911 5.522 481 H GLY 66 H GLY 66 13.268 -6.518 3.886 482 HA2 GLY 66 HA2 GLY 66 13.444 -8.813 3.964 483 HA3 GLY 66 HA3 GLY 66 12.897 -8.720 5.632 484 H LEU 67 H LEU 67 11.327 -7.917 2.543 485 HA LEU 67 HA LEU 67 8.851 -9.097 3.479 486 HB2 LEU 67 HB2 LEU 67 9.556 -7.662 0.918 487 HB3 LEU 67 HB3 LEU 67 7.940 -8.199 1.342 488 HG LEU 67 HG LEU 67 9.530 -6.206 2.972 489 HD11 LEU 67 HD11 LEU 67 8.106 -4.484 1.997 490 HD12 LEU 67 HD12 LEU 67 7.339 -5.686 0.957 491 HD13 LEU 67 HD13 LEU 67 9.047 -5.299 0.747 492 HD21 LEU 67 HD21 LEU 67 7.853 -7.402 4.255 493 HD22 LEU 67 HD22 LEU 67 6.625 -7.026 3.046 494 HD23 LEU 67 HD23 LEU 67 7.348 -5.731 4.002 495 H GLN 68 H GLN 68 7.541 -10.448 2.012 496 HA GLN 68 HA GLN 68 9.096 -12.262 0.288 497 HB2 GLN 68 HB2 GLN 68 8.792 -13.249 2.584 498 HB3 GLN 68 HB3 GLN 68 7.055 -13.185 2.321 499 HG2 GLN 68 HG2 GLN 68 7.330 -14.685 0.377 500 HG3 GLN 68 HG3 GLN 68 9.052 -14.802 0.744 501 HE21 GLN 68 HE21 GLN 68 5.859 -15.728 1.694 502 HE22 GLN 68 HE22 GLN 68 6.324 -16.894 2.875 503 H GLU 69 H GLU 69 8.112 -12.536 -1.632 504 HA GLU 69 HA GLU 69 6.015 -10.934 -2.416 505 HB2 GLU 69 HB2 GLU 69 7.128 -13.430 -3.677 506 HB3 GLU 69 HB3 GLU 69 5.858 -12.481 -4.445 507 HG2 GLU 69 HG2 GLU 69 7.307 -10.512 -4.405 508 HG3 GLU 69 HG3 GLU 69 8.587 -11.467 -3.660 509 H GLY 70 H GLY 70 4.174 -10.956 -1.294 510 HA2 GLY 70 HA2 GLY 70 1.899 -12.006 -1.711 511 HA3 GLY 70 HA3 GLY 70 2.648 -13.492 -1.157 512 H ASP 71 H ASP 71 3.986 -11.089 0.726 513 HA ASP 71 HA ASP 71 2.148 -11.706 2.910 514 HB2 ASP 71 HB2 ASP 71 3.858 -10.612 4.359 515 HB3 ASP 71 HB3 ASP 71 4.471 -11.976 3.437 516 H ARG 72 H ARG 72 2.350 -9.533 4.575 517 HA ARG 72 HA ARG 72 0.676 -7.574 3.123 518 HB2 ARG 72 HB2 ARG 72 0.601 -8.202 6.078 519 HB3 ARG 72 HB3 ARG 72 -0.552 -7.243 5.158 520 HG2 ARG 72 HG2 ARG 72 -1.301 -9.214 3.968 521 HG3 ARG 72 HG3 ARG 72 -0.080 -10.198 4.781 522 HD2 ARG 72 HD2 ARG 72 -1.145 -9.550 6.963 523 HD3 ARG 72 HD3 ARG 72 -2.438 -8.794 6.034 524 HE ARG 72 HE ARG 72 -2.887 -11.055 5.123 525 HH11 ARG 72 HH11 ARG 72 -1.149 -10.755 8.080 526 HH12 ARG 72 HH12 ARG 72 -1.716 -12.269 8.698 527 HH21 ARG 72 HH21 ARG 72 -3.593 -13.006 5.913 528 HH22 ARG 72 HH22 ARG 72 -3.088 -13.529 7.481 529 H VAL 73 H VAL 73 1.266 -5.491 3.103 530 HA VAL 73 HA VAL 73 3.175 -4.508 5.134 531 HB VAL 73 HB VAL 73 4.029 -2.893 3.448 532 HG11 VAL 73 HG11 VAL 73 5.253 -4.943 3.894 533 HG12 VAL 73 HG12 VAL 73 5.391 -4.500 2.192 534 HG13 VAL 73 HG13 VAL 73 4.299 -5.798 2.680 535 HG21 VAL 73 HG21 VAL 73 2.106 -2.833 1.943 536 HG22 VAL 73 HG22 VAL 73 2.394 -4.513 1.485 537 HG23 VAL 73 HG23 VAL 73 3.570 -3.269 1.062 538 H LYS 74 H LYS 74 2.719 -2.574 6.118 539 HA LYS 74 HA LYS 74 0.176 -1.281 5.426 540 HB2 LYS 74 HB2 LYS 74 0.340 -1.841 7.766 541 HB3 LYS 74 HB3 LYS 74 1.913 -1.062 7.896 542 HG2 LYS 74 HG2 LYS 74 0.901 1.112 7.505 543 HG3 LYS 74 HG3 LYS 74 -0.677 0.364 7.282 544 HD2 LYS 74 HD2 LYS 74 0.907 0.109 9.839 545 HD3 LYS 74 HD3 LYS 74 -0.234 1.423 9.550 546 HE2 LYS 74 HE2 LYS 74 -2.015 -0.259 9.184 547 HE3 LYS 74 HE3 LYS 74 -0.858 -1.529 9.582 548 HZ1 LYS 74 HZ1 LYS 74 -0.654 -0.693 11.779 549 HZ2 LYS 74 HZ2 LYS 74 -2.305 -0.842 11.454 550 HZ3 LYS 74 HZ3 LYS 74 -1.569 0.685 11.424 551 H VAL 75 H VAL 75 0.081 0.673 4.556 552 HA VAL 75 HA VAL 75 2.567 2.187 4.097 553 HB VAL 75 HB VAL 75 -0.073 2.337 2.610 554 HG11 VAL 75 HG11 VAL 75 1.148 3.728 0.988 555 HG12 VAL 75 HG12 VAL 75 2.572 3.683 2.028 556 HG13 VAL 75 HG13 VAL 75 1.097 4.475 2.585 557 HG21 VAL 75 HG21 VAL 75 2.557 1.100 1.773 558 HG22 VAL 75 HG22 VAL 75 1.118 1.247 0.763 559 HG23 VAL 75 HG23 VAL 75 1.087 0.225 2.200 560 H LYS 76 H LYS 76 2.766 4.194 4.986 561 HA LYS 76 HA LYS 76 0.420 5.309 6.385 562 HB2 LYS 76 HB2 LYS 76 3.180 4.864 7.540 563 HB3 LYS 76 HB3 LYS 76 1.884 5.746 8.348 564 HG2 LYS 76 HG2 LYS 76 0.684 3.857 8.803 565 HG3 LYS 76 HG3 LYS 76 1.275 3.005 7.380 566 HD2 LYS 76 HD2 LYS 76 2.222 1.885 9.199 567 HD3 LYS 76 HD3 LYS 76 3.516 2.892 8.555 568 HE2 LYS 76 HE2 LYS 76 3.180 4.519 10.318 569 HE3 LYS 76 HE3 LYS 76 1.783 3.628 10.919 570 HZ1 LYS 76 HZ1 LYS 76 3.730 3.182 12.254 571 HZ2 LYS 76 HZ2 LYS 76 4.592 2.655 10.898 572 HZ3 LYS 76 HZ3 LYS 76 3.263 1.769 11.446 573 H THR 77 H THR 77 0.117 7.372 6.133 574 HA THR 77 HA THR 77 2.319 9.186 5.373 575 HB THR 77 HB THR 77 1.023 10.260 3.647 576 HG1 THR 77 HG1 THR 77 -1.081 9.493 3.121 577 HG21 THR 77 HG21 THR 77 2.271 8.272 2.920 578 HG22 THR 77 HG22 THR 77 0.798 8.483 1.975 579 HG23 THR 77 HG23 THR 77 0.861 7.263 3.248 580 H GLU 78 H GLU 78 0.995 11.536 5.130 581 HA GLU 78 HA GLU 78 0.133 12.132 7.809 582 HB2 GLU 78 HB2 GLU 78 -0.086 14.431 7.024 583 HB3 GLU 78 HB3 GLU 78 1.444 13.742 6.499 584 HG2 GLU 78 HG2 GLU 78 0.544 13.383 4.263 585 HG3 GLU 78 HG3 GLU 78 -1.021 14.015 4.778 586 H PHE 79 H PHE 79 -1.477 11.035 5.023 587 HA PHE 79 HA PHE 79 -4.051 12.224 5.689 588 HB2 PHE 79 HB2 PHE 79 -3.248 10.263 3.522 589 HB3 PHE 79 HB3 PHE 79 -4.874 10.910 3.719 590 HD1 PHE 79 HD2 PHE 79 -5.284 13.336 3.368 591 HD2 PHE 79 HD1 PHE 79 -1.528 11.539 2.466 592 HE1 PHE 79 HE2 PHE 79 -4.689 15.279 1.982 593 HE2 PHE 79 HE1 PHE 79 -0.929 13.479 1.083 594 HZ PHE 79 HZ PHE 79 -2.512 15.352 0.838 595 H GLY 80 H GLY 80 -2.473 9.053 5.842 596 HA2 GLY 80 HA2 GLY 80 -3.816 8.167 8.101 597 HA3 GLY 80 HA3 GLY 80 -4.775 7.621 6.735 598 H GLU 81 H GLU 81 -4.336 5.458 7.455 599 HA GLU 81 HA GLU 81 -1.846 4.403 6.342 600 HB2 GLU 81 HB2 GLU 81 -1.541 2.911 8.331 601 HB3 GLU 81 HB3 GLU 81 -1.269 4.615 8.664 602 HG2 GLU 81 HG2 GLU 81 -3.394 4.816 9.756 603 HG3 GLU 81 HG3 GLU 81 -3.849 3.184 9.272 604 H VAL 82 H VAL 82 -2.024 2.365 5.447 605 HA VAL 82 HA VAL 82 -4.525 0.863 5.807 606 HB VAL 82 HB VAL 82 -4.878 2.350 3.859 607 HG11 VAL 82 HG11 VAL 82 -3.621 1.995 1.782 608 HG12 VAL 82 HG12 VAL 82 -2.563 0.860 2.618 609 HG13 VAL 82 HG13 VAL 82 -2.576 2.561 3.087 610 HG21 VAL 82 HG21 VAL 82 -5.679 0.652 2.312 611 HG22 VAL 82 HG22 VAL 82 -5.999 0.164 3.976 612 HG23 VAL 82 HG23 VAL 82 -4.660 -0.563 3.087 613 H VAL 83 H VAL 83 -4.362 -1.373 5.397 614 HA VAL 83 HA VAL 83 -1.605 -2.387 5.084 615 HB VAL 83 HB VAL 83 -4.003 -3.883 6.187 616 HG11 VAL 83 HG11 VAL 83 -2.286 -5.360 5.309 617 HG12 VAL 83 HG12 VAL 83 -2.303 -5.440 7.072 618 HG13 VAL 83 HG13 VAL 83 -1.047 -4.517 6.243 619 HG21 VAL 83 HG21 VAL 83 -3.472 -1.991 7.646 620 HG22 VAL 83 HG22 VAL 83 -1.784 -2.498 7.711 621 HG23 VAL 83 HG23 VAL 83 -3.040 -3.516 8.419 622 H VAL 84 H VAL 84 -1.105 -3.209 3.141 623 HA VAL 84 HA VAL 84 -3.203 -4.533 1.526 624 HB VAL 84 HB VAL 84 -2.199 -3.625 -0.515 625 HG11 VAL 84 HG11 VAL 84 -2.896 -1.477 1.494 626 HG12 VAL 84 HG12 VAL 84 -4.029 -2.379 0.487 627 HG13 VAL 84 HG13 VAL 84 -2.876 -1.272 -0.258 628 HG21 VAL 84 HG21 VAL 84 -0.470 -1.881 -0.421 629 HG22 VAL 84 HG22 VAL 84 0.111 -3.396 0.267 630 HG23 VAL 84 HG23 VAL 84 -0.368 -2.072 1.329 631 H PHE 85 H PHE 85 -2.056 -5.771 -0.412 632 HA PHE 85 HA PHE 85 -0.071 -7.556 0.734 633 HB2 PHE 85 HB2 PHE 85 -1.406 -7.514 -1.988 634 HB3 PHE 85 HB3 PHE 85 -0.248 -8.739 -1.482 635 HD1 PHE 85 HD1 PHE 85 -0.836 -10.040 0.706 636 HD2 PHE 85 HD2 PHE 85 -3.675 -7.859 -1.614 637 HE1 PHE 85 HE1 PHE 85 -2.659 -11.365 1.691 638 HE2 PHE 85 HE2 PHE 85 -5.497 -9.186 -0.629 639 HZ PHE 85 HZ PHE 85 -4.991 -10.941 1.024 640 H ALA 86 H ALA 86 2.055 -7.852 0.025 641 HA ALA 86 HA ALA 86 3.252 -5.481 -1.184 642 HB1 ALA 86 HB1 ALA 86 5.366 -6.334 -0.386 643 HB2 ALA 86 HB2 ALA 86 4.619 -7.871 0.051 644 HB3 ALA 86 HB3 ALA 86 4.171 -6.398 0.909 645 H LYS 87 H LYS 87 4.179 -5.366 -3.151 646 HA LYS 87 HA LYS 87 4.858 -7.841 -4.593 647 HB2 LYS 87 HB2 LYS 87 3.348 -5.474 -5.698 648 HB3 LYS 87 HB3 LYS 87 4.211 -6.590 -6.736 649 HG2 LYS 87 HG2 LYS 87 2.762 -8.408 -5.661 650 HG3 LYS 87 HG3 LYS 87 1.765 -7.069 -5.075 651 HD2 LYS 87 HD2 LYS 87 1.528 -6.254 -7.389 652 HD3 LYS 87 HD3 LYS 87 2.496 -7.613 -7.959 653 HE2 LYS 87 HE2 LYS 87 0.759 -9.114 -6.903 654 HE3 LYS 87 HE3 LYS 87 -0.233 -7.677 -6.702 655 HZ1 LYS 87 HZ1 LYS 87 0.781 -8.760 -9.274 656 HZ2 LYS 87 HZ2 LYS 87 -0.088 -7.322 -9.113 657 HZ3 LYS 87 HZ3 LYS 87 -0.822 -8.798 -8.733 658 H LYS 88 H LYS 88 6.449 -7.650 -6.186 659 HA LYS 88 HA LYS 88 8.310 -5.409 -5.811 660 HB2 LYS 88 HB2 LYS 88 8.909 -7.890 -5.365 661 HB3 LYS 88 HB3 LYS 88 8.899 -8.065 -7.116 662 HG2 LYS 88 HG2 LYS 88 10.606 -6.317 -7.279 663 HG3 LYS 88 HG3 LYS 88 10.630 -6.213 -5.517 664 HD2 LYS 88 HD2 LYS 88 11.295 -8.688 -7.132 665 HD3 LYS 88 HD3 LYS 88 12.479 -7.609 -6.392 666 HE2 LYS 88 HE2 LYS 88 11.568 -8.136 -4.169 667 HE3 LYS 88 HE3 LYS 88 10.382 -9.210 -4.913 668 HZ1 LYS 88 HZ1 LYS 88 13.317 -9.570 -5.148 669 HZ2 LYS 88 HZ2 LYS 88 12.114 -10.651 -5.642 670 HZ3 LYS 88 HZ3 LYS 88 12.358 -10.355 -3.999 671 H GLY 89 H GLY 89 7.816 -3.858 -7.410 672 HA2 GLY 89 HA2 GLY 89 7.352 -4.863 -10.143 673 HA3 GLY 89 HA3 GLY 89 6.076 -3.957 -9.366 674 H ASP 90 H ASP 90 9.415 -3.713 -10.541 675 HA ASP 90 HA ASP 90 10.286 -2.282 -12.051 676 HB2 ASP 90 HB2 ASP 90 7.487 -1.173 -12.264 677 HB3 ASP 90 HB3 ASP 90 8.789 -0.951 -13.427 678 H VAL 91 H VAL 91 8.870 -0.907 -9.248 679 HA VAL 91 HA VAL 91 9.443 1.837 -9.914 680 HB VAL 91 HB VAL 91 8.777 2.355 -7.597 681 HG11 VAL 91 HG11 VAL 91 7.051 2.151 -9.323 682 HG12 VAL 91 HG12 VAL 91 6.445 1.616 -7.756 683 HG13 VAL 91 HG13 VAL 91 6.897 0.427 -8.980 684 HG21 VAL 91 HG21 VAL 91 8.510 -0.639 -7.286 685 HG22 VAL 91 HG22 VAL 91 7.987 0.570 -6.113 686 HG23 VAL 91 HG23 VAL 91 9.701 0.388 -6.487 687 HA PRO 92 HA PRO 92 13.651 2.077 -8.415 688 HB2 PRO 92 HB2 PRO 92 13.817 4.721 -7.856 689 HB3 PRO 92 HB3 PRO 92 13.745 4.107 -9.511 690 HG2 PRO 92 HG2 PRO 92 11.542 5.240 -7.816 691 HG3 PRO 92 HG3 PRO 92 11.926 5.571 -9.518 692 HD2 PRO 92 HD2 PRO 92 9.960 3.851 -8.768 693 HD3 PRO 92 HD3 PRO 92 10.905 3.631 -10.255 694 H LYS 93 H LYS 93 14.925 2.863 -6.483 695 HA LYS 93 HA LYS 93 13.696 1.871 -4.124 696 HB2 LYS 93 HB2 LYS 93 16.158 1.722 -4.714 697 HB3 LYS 93 HB3 LYS 93 16.289 3.417 -4.255 698 HG2 LYS 93 HG2 LYS 93 15.533 2.877 -1.998 699 HG3 LYS 93 HG3 LYS 93 15.367 1.182 -2.455 700 HD2 LYS 93 HD2 LYS 93 17.814 1.155 -2.965 701 HD3 LYS 93 HD3 LYS 93 17.915 2.796 -2.317 702 HE2 LYS 93 HE2 LYS 93 17.061 0.308 -0.836 703 HE3 LYS 93 HE3 LYS 93 18.555 1.214 -0.602 704 HZ1 LYS 93 HZ1 LYS 93 17.093 1.845 1.113 705 HZ2 LYS 93 HZ2 LYS 93 15.792 2.054 0.052 706 HZ3 LYS 93 HZ3 LYS 93 17.092 3.140 0.022 707 H GLY 94 H GLY 94 13.223 2.941 -2.149 708 HA2 GLY 94 HA2 GLY 94 12.292 4.624 -0.882 709 HA3 GLY 94 HA3 GLY 94 13.204 5.770 -1.850 710 H MET 95 H MET 95 11.077 3.669 -3.577 711 HA MET 95 HA MET 95 8.887 5.600 -3.583 712 HB2 MET 95 HB2 MET 95 10.704 6.152 -5.339 713 HB3 MET 95 HB3 MET 95 10.141 4.720 -6.187 714 HG2 MET 95 HG2 MET 95 7.951 5.669 -6.422 715 HG3 MET 95 HG3 MET 95 8.415 7.066 -5.449 716 HE1 MET 95 HE1 MET 95 7.894 8.966 -7.101 717 HE2 MET 95 HE2 MET 95 7.109 7.780 -8.145 718 HE3 MET 95 HE3 MET 95 8.269 8.921 -8.822 719 H ILE 96 H ILE 96 6.893 4.609 -3.936 720 HA ILE 96 HA ILE 96 6.876 1.842 -4.959 721 HB ILE 96 HB ILE 96 5.268 1.124 -3.243 722 HG12 ILE 96 HG12 ILE 96 5.857 3.761 -1.868 723 HG13 ILE 96 HG13 ILE 96 4.352 3.377 -2.693 724 HG21 ILE 96 HG21 ILE 96 7.828 2.196 -2.058 725 HG22 ILE 96 HG22 ILE 96 7.643 0.663 -2.912 726 HG23 ILE 96 HG23 ILE 96 6.823 0.917 -1.371 727 HD11 ILE 96 HD11 ILE 96 4.133 3.138 -0.288 728 HD12 ILE 96 HD12 ILE 96 5.446 1.961 -0.267 729 HD13 ILE 96 HD13 ILE 96 3.933 1.581 -1.091 730 H PHE 97 H PHE 97 5.016 1.209 -6.040 731 HA PHE 97 HA PHE 97 3.177 3.411 -6.749 732 HB2 PHE 97 HB2 PHE 97 4.471 2.513 -8.625 733 HB3 PHE 97 HB3 PHE 97 3.895 0.888 -8.273 734 HD1 PHE 97 HD2 PHE 97 3.011 4.163 -9.664 735 HD2 PHE 97 HD1 PHE 97 1.640 0.208 -8.861 736 HE1 PHE 97 HE2 PHE 97 1.085 4.526 -11.155 737 HE2 PHE 97 HE1 PHE 97 -0.285 0.567 -10.347 738 HZ PHE 97 HZ PHE 97 -0.563 2.727 -11.498 739 H ILE 98 H ILE 98 1.133 3.286 -5.989 740 HA ILE 98 HA ILE 98 -0.024 0.607 -5.509 741 HB ILE 98 HB ILE 98 -0.659 3.171 -4.025 742 HG12 ILE 98 HG12 ILE 98 0.768 0.636 -3.167 743 HG13 ILE 98 HG13 ILE 98 1.478 2.239 -3.329 744 HG21 ILE 98 HG21 ILE 98 -1.803 0.392 -3.676 745 HG22 ILE 98 HG22 ILE 98 -2.662 1.807 -4.288 746 HG23 ILE 98 HG23 ILE 98 -2.113 1.766 -2.613 747 HD11 ILE 98 HD11 ILE 98 1.127 1.726 -1.014 748 HD12 ILE 98 HD12 ILE 98 -0.576 1.376 -1.306 749 HD13 ILE 98 HD13 ILE 98 0.030 3.022 -1.494 750 HA PRO 99 HA PRO 99 -2.912 1.710 -8.763 751 HB2 PRO 99 HB2 PRO 99 -4.560 -0.372 -7.407 752 HB3 PRO 99 HB3 PRO 99 -4.106 -0.227 -9.107 753 HG2 PRO 99 HG2 PRO 99 -2.925 -2.032 -7.560 754 HG3 PRO 99 HG3 PRO 99 -1.986 -1.115 -8.754 755 HD2 PRO 99 HD2 PRO 99 -2.161 -0.736 -5.784 756 HD3 PRO 99 HD3 PRO 99 -0.745 -0.633 -6.854 757 H MET 100 H MET 100 -4.547 3.156 -8.878 758 HA MET 100 HA MET 100 -5.416 4.582 -6.634 759 HB2 MET 100 HB2 MET 100 -5.323 5.245 -9.152 760 HB3 MET 100 HB3 MET 100 -6.937 4.560 -9.232 761 HG2 MET 100 HG2 MET 100 -6.020 6.914 -7.594 762 HG3 MET 100 HG3 MET 100 -7.127 6.920 -8.962 763 HE1 MET 100 HE1 MET 100 -6.633 5.567 -5.271 764 HE2 MET 100 HE2 MET 100 -8.104 6.256 -4.583 765 HE3 MET 100 HE3 MET 100 -6.895 7.310 -5.315 766 H GLY 101 H GLY 101 -6.600 3.630 -5.069 767 HA2 GLY 101 HA2 GLY 101 -9.306 2.788 -5.688 768 HA3 GLY 101 HA3 GLY 101 -8.271 1.482 -5.128 769 HA PRO 102 HA PRO 102 -10.416 3.642 -1.501 770 HB2 PRO 102 HB2 PRO 102 -10.899 1.216 -0.219 771 HB3 PRO 102 HB3 PRO 102 -12.061 2.090 -1.225 772 HG2 PRO 102 HG2 PRO 102 -10.288 -0.213 -1.944 773 HG3 PRO 102 HG3 PRO 102 -11.964 0.105 -2.426 774 HD2 PRO 102 HD2 PRO 102 -9.919 0.550 -4.106 775 HD3 PRO 102 HD3 PRO 102 -11.334 1.623 -4.076 776 H TYR 103 H TYR 103 -8.137 0.953 -1.676 777 HA TYR 103 HA TYR 103 -6.944 1.199 0.858 778 HB2 TYR 103 HB2 TYR 103 -5.721 0.229 -1.747 779 HB3 TYR 103 HB3 TYR 103 -5.058 -0.059 -0.142 780 HD1 TYR 103 HD2 TYR 103 -8.061 -0.726 -2.256 781 HD2 TYR 103 HD1 TYR 103 -5.735 -1.942 1.098 782 HE1 TYR 103 HE2 TYR 103 -9.416 -2.770 -2.066 783 HE2 TYR 103 HE1 TYR 103 -7.078 -3.990 1.292 784 HH TYR 103 HH TYR 103 -9.030 -5.160 -1.085 785 H ALA 104 H ALA 104 -5.815 2.442 -2.304 786 HA ALA 104 HA ALA 104 -3.709 4.017 -1.290 787 HB1 ALA 104 HB1 ALA 104 -3.696 5.097 -3.478 788 HB2 ALA 104 HB2 ALA 104 -5.286 4.421 -3.838 789 HB3 ALA 104 HB3 ALA 104 -3.895 3.352 -3.652 790 H ASN 105 H ASN 105 -7.131 4.644 -1.664 791 HA ASN 105 HA ASN 105 -7.117 7.457 -1.540 792 HB2 ASN 105 HB2 ASN 105 -9.064 6.398 -2.374 793 HB3 ASN 105 HB3 ASN 105 -9.203 5.354 -0.965 794 HD21 ASN 105 HD21 ASN 105 -10.200 6.092 0.835 795 HD22 ASN 105 HD22 ASN 105 -11.048 7.596 0.915 796 H MET 106 H MET 106 -6.468 5.155 0.882 797 HA MET 106 HA MET 106 -7.308 6.781 3.133 798 HB2 MET 106 HB2 MET 106 -5.500 4.358 3.209 799 HB3 MET 106 HB3 MET 106 -6.487 5.010 4.511 800 HG2 MET 106 HG2 MET 106 -8.508 4.414 3.205 801 HG3 MET 106 HG3 MET 106 -7.463 3.662 2.007 802 HE1 MET 106 HE1 MET 106 -7.806 2.170 6.363 803 HE2 MET 106 HE2 MET 106 -8.709 3.545 5.733 804 HE3 MET 106 HE3 MET 106 -6.958 3.652 5.922 805 H VAL 107 H VAL 107 -4.489 6.506 1.160 806 HA VAL 107 HA VAL 107 -2.859 7.891 3.204 807 HB VAL 107 HB VAL 107 -0.867 6.722 2.329 808 HG11 VAL 107 HG11 VAL 107 -1.991 5.844 4.300 809 HG12 VAL 107 HG12 VAL 107 -1.341 4.526 3.322 810 HG13 VAL 107 HG13 VAL 107 -3.069 4.886 3.282 811 HG21 VAL 107 HG21 VAL 107 -1.125 4.767 0.871 812 HG22 VAL 107 HG22 VAL 107 -1.662 6.242 0.067 813 HG23 VAL 107 HG23 VAL 107 -2.848 5.108 0.712 814 H ILE 108 H ILE 108 -3.963 7.934 -0.061 815 HA ILE 108 HA ILE 108 -1.819 9.749 -0.897 816 HB ILE 108 HB ILE 108 -2.505 9.496 -3.127 817 HG12 ILE 108 HG12 ILE 108 -4.973 7.979 -2.255 818 HG13 ILE 108 HG13 ILE 108 -4.984 9.708 -2.598 819 HG21 ILE 108 HG21 ILE 108 -1.310 7.554 -2.334 820 HG22 ILE 108 HG22 ILE 108 -2.561 7.035 -3.469 821 HG23 ILE 108 HG23 ILE 108 -2.805 6.833 -1.735 822 HD11 ILE 108 HD11 ILE 108 -4.343 7.476 -4.487 823 HD12 ILE 108 HD12 ILE 108 -4.075 9.180 -4.848 824 HD13 ILE 108 HD13 ILE 108 -5.713 8.588 -4.548 825 H ASP 109 H ASP 109 -2.670 11.549 -2.444 826 HA ASP 109 HA ASP 109 -4.717 13.093 -1.026 827 HB2 ASP 109 HB2 ASP 109 -2.548 14.177 -1.383 828 HB3 ASP 109 HB3 ASP 109 -2.685 13.916 -3.121 829 HA PRO 110 HA PRO 110 -7.207 11.757 -4.581 830 HB2 PRO 110 HB2 PRO 110 -9.610 11.894 -3.415 831 HB3 PRO 110 HB3 PRO 110 -8.447 10.642 -2.958 832 HG2 PRO 110 HG2 PRO 110 -9.110 13.212 -1.560 833 HG3 PRO 110 HG3 PRO 110 -8.867 11.596 -0.870 834 HD2 PRO 110 HD2 PRO 110 -6.940 13.577 -0.932 835 HD3 PRO 110 HD3 PRO 110 -6.588 11.842 -0.813 836 H SER 111 H SER 111 -6.366 14.671 -4.047 837 HA SER 111 HA SER 111 -8.665 15.932 -5.420 838 HB2 SER 111 HB2 SER 111 -8.339 16.822 -3.126 839 HB3 SER 111 HB3 SER 111 -6.702 17.308 -3.563 840 HG SER 111 HG SER 111 -8.810 18.762 -3.801 841 H THR 112 H THR 112 -5.184 15.486 -5.356 842 HA THR 112 HA THR 112 -4.521 17.401 -7.342 843 HB THR 112 HB THR 112 -2.733 16.565 -6.007 844 HG1 THR 112 HG1 THR 112 -2.265 15.331 -8.523 845 HG21 THR 112 HG21 THR 112 -3.321 13.808 -7.106 846 HG22 THR 112 HG22 THR 112 -3.649 14.353 -5.461 847 HG23 THR 112 HG23 THR 112 -1.985 14.233 -6.034 848 H ASP 113 H ASP 113 -5.681 17.377 -9.182 849 HA ASP 113 HA ASP 113 -6.454 16.796 -11.230 850 HB2 ASP 113 HB2 ASP 113 -4.262 14.710 -11.159 851 HB3 ASP 113 HB3 ASP 113 -5.107 15.276 -12.597 852 H GLY 114 H GLY 114 -5.475 13.465 -10.486 853 HA2 GLY 114 HA2 GLY 114 -6.860 11.681 -9.785 854 HA3 GLY 114 HA3 GLY 114 -8.270 12.689 -10.056 855 H THR 115 H THR 115 -6.858 13.343 -12.777 856 HA THR 115 HA THR 115 -8.268 11.267 -14.249 857 HB THR 115 HB THR 115 -7.819 12.637 -16.249 858 HG1 THR 115 HG1 THR 115 -6.666 14.572 -16.056 859 HG21 THR 115 HG21 THR 115 -9.796 13.167 -14.913 860 HG22 THR 115 HG22 THR 115 -9.105 14.639 -15.596 861 HG23 THR 115 HG23 THR 115 -8.840 14.248 -13.898 862 H GLY 116 H GLY 116 -7.050 10.765 -16.511 863 HA2 GLY 116 HA2 GLY 116 -4.803 9.122 -15.782 864 HA3 GLY 116 HA3 GLY 116 -5.492 9.293 -17.385 865 H MET 117 H MET 117 -3.510 11.083 -15.029 866 HA MET 117 HA MET 117 -2.334 12.754 -17.058 867 HB2 MET 117 HB2 MET 117 -1.758 12.396 -14.112 868 HB3 MET 117 HB3 MET 117 -0.859 13.514 -15.132 869 HG2 MET 117 HG2 MET 117 -3.822 13.593 -14.592 870 HG3 MET 117 HG3 MET 117 -2.603 14.671 -13.911 871 HE1 MET 117 HE1 MET 117 -5.175 15.790 -15.329 872 HE2 MET 117 HE2 MET 117 -4.500 17.045 -16.366 873 HE3 MET 117 HE3 MET 117 -3.891 16.841 -14.726 874 HA PRO 118 HA PRO 118 1.247 10.170 -17.826 875 HB2 PRO 118 HB2 PRO 118 2.590 11.798 -19.458 876 HB3 PRO 118 HB3 PRO 118 1.013 11.155 -19.926 877 HG2 PRO 118 HG2 PRO 118 1.730 13.884 -18.957 878 HG3 PRO 118 HG3 PRO 118 0.514 13.400 -20.150 879 HD2 PRO 118 HD2 PRO 118 0.060 13.996 -17.422 880 HD3 PRO 118 HD3 PRO 118 -1.095 13.257 -18.548 881 H GLN 119 H GLN 119 1.215 12.285 -15.483 882 HA GLN 119 HA GLN 119 4.103 12.798 -15.277 883 HB2 GLN 119 HB2 GLN 119 1.824 13.888 -13.605 884 HB3 GLN 119 HB3 GLN 119 3.514 14.355 -13.468 885 HG2 GLN 119 HG2 GLN 119 1.733 14.816 -15.859 886 HG3 GLN 119 HG3 GLN 119 2.226 16.024 -14.675 887 HE21 GLN 119 HE21 GLN 119 2.648 16.014 -17.542 888 HE22 GLN 119 HE22 GLN 119 4.357 16.092 -17.779 889 H PHE 120 H PHE 120 5.361 11.719 -13.854 890 HA PHE 120 HA PHE 120 4.178 9.628 -12.227 891 HB2 PHE 120 HB2 PHE 120 7.076 10.413 -12.645 892 HB3 PHE 120 HB3 PHE 120 6.537 9.005 -11.736 893 HD1 PHE 120 HD2 PHE 120 6.840 10.497 -15.087 894 HD2 PHE 120 HD1 PHE 120 5.741 7.028 -12.863 895 HE1 PHE 120 HE2 PHE 120 6.836 9.173 -17.160 896 HE2 PHE 120 HE1 PHE 120 5.737 5.702 -14.936 897 HZ PHE 120 HZ PHE 120 6.283 6.772 -17.087 898 H LYS 121 H LYS 121 3.050 11.419 -10.943 899 HA LYS 121 HA LYS 121 4.785 12.405 -8.759 900 HB2 LYS 121 HB2 LYS 121 3.478 14.116 -9.986 901 HB3 LYS 121 HB3 LYS 121 1.997 13.314 -9.467 902 HG2 LYS 121 HG2 LYS 121 2.489 13.773 -7.153 903 HG3 LYS 121 HG3 LYS 121 4.075 14.421 -7.580 904 HD2 LYS 121 HD2 LYS 121 2.602 16.258 -7.165 905 HD3 LYS 121 HD3 LYS 121 2.932 16.185 -8.895 906 HE2 LYS 121 HE2 LYS 121 0.787 15.147 -9.305 907 HE3 LYS 121 HE3 LYS 121 0.460 15.059 -7.574 908 HZ1 LYS 121 HZ1 LYS 121 0.457 17.479 -7.498 909 HZ2 LYS 121 HZ2 LYS 121 -0.697 16.907 -8.588 910 HZ3 LYS 121 HZ3 LYS 121 0.758 17.553 -9.162 911 H GLY 122 H GLY 122 4.691 11.334 -6.877 912 HA2 GLY 122 HA2 GLY 122 2.140 10.021 -6.142 913 HA3 GLY 122 HA3 GLY 122 3.709 9.313 -5.787 914 H VAL 123 H VAL 123 1.660 9.858 -3.892 915 HA VAL 123 HA VAL 123 2.385 12.219 -2.390 916 HB VAL 123 HB VAL 123 0.714 9.840 -1.547 917 HG11 VAL 123 HG11 VAL 123 0.922 12.598 -0.318 918 HG12 VAL 123 HG12 VAL 123 1.554 11.105 0.380 919 HG13 VAL 123 HG13 VAL 123 -0.185 11.320 0.188 920 HG21 VAL 123 HG21 VAL 123 -1.214 11.232 -2.109 921 HG22 VAL 123 HG22 VAL 123 -0.190 10.984 -3.521 922 HG23 VAL 123 HG23 VAL 123 -0.142 12.522 -2.656 923 H LYS 124 H LYS 124 4.034 12.409 -1.010 924 HA LYS 124 HA LYS 124 5.841 10.252 -0.537 925 HB2 LYS 124 HB2 LYS 124 5.710 13.080 0.516 926 HB3 LYS 124 HB3 LYS 124 6.961 11.954 1.020 927 HG2 LYS 124 HG2 LYS 124 7.754 13.435 -0.750 928 HG3 LYS 124 HG3 LYS 124 7.743 11.753 -1.284 929 HD2 LYS 124 HD2 LYS 124 5.645 12.141 -2.491 930 HD3 LYS 124 HD3 LYS 124 5.617 13.812 -1.924 931 HE2 LYS 124 HE2 LYS 124 7.599 14.331 -3.182 932 HE3 LYS 124 HE3 LYS 124 7.827 12.636 -3.616 933 HZ1 LYS 124 HZ1 LYS 124 5.760 12.720 -4.869 934 HZ2 LYS 124 HZ2 LYS 124 6.849 13.885 -5.433 935 HZ3 LYS 124 HZ3 LYS 124 5.547 14.349 -4.459 936 H GLY 125 H GLY 125 6.014 8.868 1.134 937 HA2 GLY 125 HA2 GLY 125 4.898 9.441 3.737 938 HA3 GLY 125 HA3 GLY 125 4.027 8.202 2.851 939 H THR 126 H THR 126 4.524 6.529 4.243 940 HA THR 126 HA THR 126 7.289 5.521 4.107 941 HB THR 126 HB THR 126 7.145 4.783 6.506 942 HG1 THR 126 HG1 THR 126 4.809 6.405 6.415 943 HG21 THR 126 HG21 THR 126 7.697 6.968 7.490 944 HG22 THR 126 HG22 THR 126 7.012 7.776 6.079 945 HG23 THR 126 HG23 THR 126 8.453 6.772 5.906 946 H VAL 127 H VAL 127 7.467 3.209 4.637 947 HA VAL 127 HA VAL 127 4.947 1.701 4.575 948 HB VAL 127 HB VAL 127 5.757 1.870 2.234 949 HG11 VAL 127 HG11 VAL 127 8.154 2.011 2.649 950 HG12 VAL 127 HG12 VAL 127 7.792 0.678 1.552 951 HG13 VAL 127 HG13 VAL 127 8.165 0.350 3.244 952 HG21 VAL 127 HG21 VAL 127 4.428 -0.056 2.923 953 HG22 VAL 127 HG22 VAL 127 5.890 -0.914 3.409 954 HG23 VAL 127 HG23 VAL 127 5.619 -0.524 1.710 955 H GLU 128 H GLU 128 4.987 -0.262 5.605 956 HA GLU 128 HA GLU 128 7.490 -1.402 6.585 957 HB2 GLU 128 HB2 GLU 128 6.572 -1.472 8.936 958 HB3 GLU 128 HB3 GLU 128 7.005 0.135 8.366 959 HG2 GLU 128 HG2 GLU 128 4.654 0.611 7.882 960 HG3 GLU 128 HG3 GLU 128 4.211 -1.003 8.435 961 H LYS 129 H LYS 129 7.228 -3.614 7.396 962 HA LYS 129 HA LYS 129 4.835 -4.936 6.357 963 HB2 LYS 129 HB2 LYS 129 6.941 -6.015 5.826 964 HB3 LYS 129 HB3 LYS 129 7.381 -6.090 7.528 965 HG2 LYS 129 HG2 LYS 129 5.734 -7.729 7.986 966 HG3 LYS 129 HG3 LYS 129 4.926 -7.459 6.442 967 HD2 LYS 129 HD2 LYS 129 6.202 -9.553 6.456 968 HD3 LYS 129 HD3 LYS 129 6.815 -8.418 5.255 969 HE2 LYS 129 HE2 LYS 129 8.646 -9.513 6.418 970 HE3 LYS 129 HE3 LYS 129 8.627 -7.789 6.781 971 HZ1 LYS 129 HZ1 LYS 129 9.019 -9.129 8.758 972 HZ2 LYS 129 HZ2 LYS 129 7.544 -9.928 8.535 973 HZ3 LYS 129 HZ3 LYS 129 7.566 -8.279 8.887 974 H THR 130 H THR 130 3.321 -5.990 7.595 975 HA THR 130 HA THR 130 3.536 -5.738 10.524 976 HB THR 130 HB THR 130 2.408 -3.692 9.859 977 HG1 THR 130 HG1 THR 130 0.654 -3.912 11.191 978 HG21 THR 130 HG21 THR 130 0.422 -5.487 8.447 979 HG22 THR 130 HG22 THR 130 1.550 -4.371 7.677 980 HG23 THR 130 HG23 THR 130 0.239 -3.748 8.679 981 H ASP 131 H ASP 131 1.992 -6.983 11.725 982 HA ASP 131 HA ASP 131 1.266 -9.477 10.448 983 HB2 ASP 131 HB2 ASP 131 0.865 -8.531 13.300 984 HB3 ASP 131 HB3 ASP 131 0.616 -10.177 12.724 985 H GLU 132 H GLU 132 -0.214 -6.539 10.672 986 HA GLU 132 HA GLU 132 -2.898 -7.247 11.311 987 HB2 GLU 132 HB2 GLU 132 -1.752 -4.848 9.859 988 HB3 GLU 132 HB3 GLU 132 -3.430 -4.989 10.381 989 HG2 GLU 132 HG2 GLU 132 -2.804 -5.015 12.669 990 HG3 GLU 132 HG3 GLU 132 -1.101 -5.200 12.265 991 H LYS 133 H LYS 133 -4.676 -7.522 9.972 992 HA LYS 133 HA LYS 133 -4.174 -8.945 7.551 993 HB2 LYS 133 HB2 LYS 133 -6.456 -9.475 7.541 994 HB3 LYS 133 HB3 LYS 133 -6.086 -9.294 9.247 995 HG2 LYS 133 HG2 LYS 133 -7.461 -7.253 7.494 996 HG3 LYS 133 HG3 LYS 133 -8.224 -8.274 8.712 997 HD2 LYS 133 HD2 LYS 133 -6.944 -7.167 10.470 998 HD3 LYS 133 HD3 LYS 133 -6.103 -6.190 9.265 999 HE2 LYS 133 HE2 LYS 133 -7.817 -4.838 10.236 1000 HE3 LYS 133 HE3 LYS 133 -8.314 -5.239 8.594 1001 HZ1 LYS 133 HZ1 LYS 133 -9.278 -6.553 11.078 1002 HZ2 LYS 133 HZ2 LYS 133 -9.747 -6.973 9.511 1003 HZ3 LYS 133 HZ3 LYS 133 -10.146 -5.453 10.136 1004 H VAL 134 H VAL 134 -4.815 -8.440 5.410 1005 HA VAL 134 HA VAL 134 -4.633 -5.742 4.572 1006 HB VAL 134 HB VAL 134 -5.679 -8.175 3.100 1007 HG11 VAL 134 HG11 VAL 134 -4.984 -5.436 2.021 1008 HG12 VAL 134 HG12 VAL 134 -6.584 -6.183 2.050 1009 HG13 VAL 134 HG13 VAL 134 -5.311 -6.863 1.037 1010 HG21 VAL 134 HG21 VAL 134 -3.461 -8.129 2.009 1011 HG22 VAL 134 HG22 VAL 134 -3.355 -8.391 3.749 1012 HG23 VAL 134 HG23 VAL 134 -2.985 -6.804 3.073 1013 H LEU 135 H LEU 135 -6.128 -4.189 4.619 1014 HA LEU 135 HA LEU 135 -8.709 -4.599 5.675 1015 HB2 LEU 135 HB2 LEU 135 -7.245 -2.295 4.517 1016 HB3 LEU 135 HB3 LEU 135 -8.994 -2.174 4.533 1017 HG LEU 135 HG LEU 135 -7.195 -2.539 6.932 1018 HD11 LEU 135 HD11 LEU 135 -8.091 -0.344 7.567 1019 HD12 LEU 135 HD12 LEU 135 -8.989 -0.278 6.050 1020 HD13 LEU 135 HD13 LEU 135 -7.224 -0.277 6.033 1021 HD21 LEU 135 HD21 LEU 135 -10.211 -2.495 6.725 1022 HD22 LEU 135 HD22 LEU 135 -9.306 -2.342 8.235 1023 HD23 LEU 135 HD23 LEU 135 -9.199 -3.827 7.291 1024 H SER 136 H SER 136 -9.909 -6.037 4.527 1025 HA SER 136 HA SER 136 -10.267 -6.203 1.774 1026 HB2 SER 136 HB2 SER 136 -12.334 -6.785 3.915 1027 HB3 SER 136 HB3 SER 136 -12.370 -7.382 2.257 1028 HG SER 136 HG SER 136 -10.401 -7.961 4.225 1029 H VAL 137 H VAL 137 -11.991 -5.481 0.389 1030 HA VAL 137 HA VAL 137 -12.125 -2.771 0.199 1031 HB VAL 137 HB VAL 137 -14.198 -4.717 -0.844 1032 HG11 VAL 137 HG11 VAL 137 -15.025 -2.422 -0.960 1033 HG12 VAL 137 HG12 VAL 137 -14.637 -3.018 -2.574 1034 HG13 VAL 137 HG13 VAL 137 -13.537 -1.907 -1.756 1035 HG21 VAL 137 HG21 VAL 137 -11.649 -3.670 -2.090 1036 HG22 VAL 137 HG22 VAL 137 -12.850 -4.670 -2.912 1037 HG23 VAL 137 HG23 VAL 137 -11.948 -5.319 -1.541 1038 H LYS 138 H LYS 138 -14.731 -4.797 1.618 1039 HA LYS 138 HA LYS 138 -16.380 -2.540 2.259 1040 HB2 LYS 138 HB2 LYS 138 -17.307 -4.807 1.907 1041 HB3 LYS 138 HB3 LYS 138 -16.487 -5.362 3.359 1042 HG2 LYS 138 HG2 LYS 138 -17.821 -3.583 4.612 1043 HG3 LYS 138 HG3 LYS 138 -18.788 -3.433 3.143 1044 HD2 LYS 138 HD2 LYS 138 -19.875 -4.959 4.681 1045 HD3 LYS 138 HD3 LYS 138 -19.301 -5.852 3.271 1046 HE2 LYS 138 HE2 LYS 138 -17.346 -6.602 4.524 1047 HE3 LYS 138 HE3 LYS 138 -17.871 -5.675 5.926 1048 HZ1 LYS 138 HZ1 LYS 138 -19.323 -7.971 4.719 1049 HZ2 LYS 138 HZ2 LYS 138 -19.851 -7.068 6.043 1050 HZ3 LYS 138 HZ3 LYS 138 -18.444 -7.997 6.165 1051 H GLU 139 H GLU 139 -14.156 -4.585 4.161 1052 HA GLU 139 HA GLU 139 -14.645 -3.542 6.706 1053 HB2 GLU 139 HB2 GLU 139 -13.295 -5.559 6.254 1054 HB3 GLU 139 HB3 GLU 139 -12.046 -4.565 5.520 1055 HG2 GLU 139 HG2 GLU 139 -11.403 -5.226 7.751 1056 HG3 GLU 139 HG3 GLU 139 -11.645 -3.482 7.674 1057 H LEU 140 H LEU 140 -12.489 -2.488 4.146 1058 HA LEU 140 HA LEU 140 -11.241 -0.335 5.386 1059 HB2 LEU 140 HB2 LEU 140 -10.923 -1.543 3.074 1060 HB3 LEU 140 HB3 LEU 140 -11.992 -0.283 2.486 1061 HG LEU 140 HG LEU 140 -9.515 0.385 4.039 1062 HD11 LEU 140 HD11 LEU 140 -9.701 -0.007 1.062 1063 HD12 LEU 140 HD12 LEU 140 -8.838 -1.049 2.192 1064 HD13 LEU 140 HD13 LEU 140 -8.308 0.616 1.948 1065 HD21 LEU 140 HD21 LEU 140 -11.137 1.909 1.997 1066 HD22 LEU 140 HD22 LEU 140 -9.668 2.491 2.779 1067 HD23 LEU 140 HD23 LEU 140 -11.116 2.193 3.739 1068 H LEU 141 H LEU 141 -14.314 -0.500 3.586 1069 HA LEU 141 HA LEU 141 -15.019 2.205 3.599 1070 HB2 LEU 141 HB2 LEU 141 -16.942 -0.096 3.998 1071 HB3 LEU 141 HB3 LEU 141 -17.319 1.490 3.354 1072 HG LEU 141 HG LEU 141 -15.593 -0.590 1.997 1073 HD11 LEU 141 HD11 LEU 141 -17.948 -1.232 2.051 1074 HD12 LEU 141 HD12 LEU 141 -17.442 -0.804 0.416 1075 HD13 LEU 141 HD13 LEU 141 -18.397 0.332 1.369 1076 HD21 LEU 141 HD21 LEU 141 -14.885 1.668 1.423 1077 HD22 LEU 141 HD22 LEU 141 -16.545 2.099 1.010 1078 HD23 LEU 141 HD23 LEU 141 -15.681 0.894 0.054 1079 H GLU 142 H GLU 142 -15.831 -0.321 5.968 1080 HA GLU 142 HA GLU 142 -17.172 1.363 7.796 1081 HB2 GLU 142 HB2 GLU 142 -15.781 -1.277 8.308 1082 HB3 GLU 142 HB3 GLU 142 -16.947 -0.511 9.379 1083 HG2 GLU 142 HG2 GLU 142 -18.649 -0.689 7.585 1084 HG3 GLU 142 HG3 GLU 142 -17.473 -1.560 6.603 1085 H ALA 143 H ALA 143 -13.786 0.591 7.373 1086 HA ALA 143 HA ALA 143 -12.868 1.572 9.886 1087 HB1 ALA 143 HB1 ALA 143 -11.353 1.227 7.299 1088 HB2 ALA 143 HB2 ALA 143 -11.571 -0.003 8.544 1089 HB3 ALA 143 HB3 ALA 143 -10.639 1.453 8.897 1090 H ILE 144 H ILE 144 -13.182 3.090 6.673 1091 HA ILE 144 HA ILE 144 -12.154 5.614 7.731 1092 HB ILE 144 HB ILE 144 -12.396 6.480 5.419 1093 HG12 ILE 144 HG12 ILE 144 -12.653 4.516 3.669 1094 HG13 ILE 144 HG13 ILE 144 -13.557 3.743 4.964 1095 HG21 ILE 144 HG21 ILE 144 -10.297 5.527 6.172 1096 HG22 ILE 144 HG22 ILE 144 -10.562 5.150 4.471 1097 HG23 ILE 144 HG23 ILE 144 -10.833 3.915 5.699 1098 HD11 ILE 144 HD11 ILE 144 -14.196 6.428 3.759 1099 HD12 ILE 144 HD12 ILE 144 -15.134 5.578 4.988 1100 HD13 ILE 144 HD13 ILE 144 -14.994 4.905 3.365 1101 H GLY 145 H GLY 145 -15.185 4.128 7.360 1102 HA2 GLY 145 HA2 GLY 145 -16.867 5.523 8.700 1103 HA3 GLY 145 HA3 GLY 145 -16.575 6.737 7.466 1104 H SER 146 H SER 146 -16.805 5.707 5.130 1105 HA SER 146 HA SER 146 -18.767 3.640 4.826 1106 HB2 SER 146 HB2 SER 146 -20.294 5.396 5.551 1107 HB3 SER 146 HB3 SER 146 -19.650 6.499 4.333 1108 HG SER 146 HG SER 146 -21.699 5.111 3.961 Start of MODEL 12 1 H1 MET 1 H1 MET 1 48.747 3.633 -6.369 2 H2 MET 1 H2 MET 1 47.363 2.920 -5.715 3 H3 MET 1 H3 MET 1 47.579 4.593 -5.607 4 HA MET 1 HA MET 1 47.445 4.785 -8.013 5 HB2 MET 1 HB2 MET 1 46.830 1.823 -7.876 6 HB3 MET 1 HB3 MET 1 46.659 2.819 -9.314 7 HG2 MET 1 HG2 MET 1 49.061 3.270 -9.293 8 HG3 MET 1 HG3 MET 1 49.234 2.276 -7.846 9 HE1 MET 1 HE1 MET 1 50.952 1.874 -10.505 10 HE2 MET 1 HE2 MET 1 50.932 0.118 -10.663 11 HE3 MET 1 HE3 MET 1 51.149 0.858 -9.076 12 H GLY 2 H GLY 2 45.282 2.402 -6.427 13 HA2 GLY 2 HA2 GLY 2 43.176 4.387 -6.211 14 HA3 GLY 2 HA3 GLY 2 42.857 3.107 -7.371 15 H SER 3 H SER 3 41.075 2.345 -6.166 16 HA SER 3 HA SER 3 39.950 1.136 -4.596 17 HB2 SER 3 HB2 SER 3 41.507 -0.625 -5.319 18 HB3 SER 3 HB3 SER 3 42.690 -0.085 -4.129 19 HG SER 3 HG SER 3 41.394 -1.909 -3.463 20 H SER 4 H SER 4 42.014 0.293 -2.148 21 HA SER 4 HA SER 4 42.489 1.058 -0.052 22 HB2 SER 4 HB2 SER 4 44.000 2.529 -1.313 23 HB3 SER 4 HB3 SER 4 42.705 3.707 -1.513 24 HG SER 4 HG SER 4 43.556 4.510 0.241 25 H HIS 5 H HIS 5 39.626 1.038 -0.833 26 HA HIS 5 HA HIS 5 38.355 3.367 0.226 27 HB2 HIS 5 HB2 HIS 5 37.245 0.595 -0.276 28 HB3 HIS 5 HB3 HIS 5 36.277 2.017 0.103 29 HD1 HIS 5 HD1 HIS 5 37.571 0.146 -2.702 30 HD2 HIS 5 HD2 HIS 5 36.600 4.119 -1.970 31 HE1 HIS 5 HE1 HIS 5 37.327 1.208 -4.964 32 HE2 HIS 5 HE2 HIS 5 36.566 3.558 -4.494 33 H HIS 6 H HIS 6 38.696 3.896 2.322 34 HA HIS 6 HA HIS 6 38.154 1.818 4.354 35 HB2 HIS 6 HB2 HIS 6 40.078 4.150 4.523 36 HB3 HIS 6 HB3 HIS 6 39.663 3.103 5.875 37 HD1 HIS 6 HD1 HIS 6 40.134 0.405 5.247 38 HD2 HIS 6 HD2 HIS 6 42.330 3.331 3.267 39 HE1 HIS 6 HE1 HIS 6 42.164 -0.766 4.348 40 HE2 HIS 6 HE2 HIS 6 43.555 1.051 3.313 41 H HIS 7 H HIS 7 37.798 3.104 6.595 42 HA HIS 7 HA HIS 7 36.406 4.333 7.893 43 HB2 HIS 7 HB2 HIS 7 36.145 6.047 5.416 44 HB3 HIS 7 HB3 HIS 7 35.332 6.422 6.930 45 HD1 HIS 7 HD1 HIS 7 38.601 5.050 7.661 46 HD2 HIS 7 HD2 HIS 7 37.099 8.781 6.623 47 HE1 HIS 7 HE1 HIS 7 40.376 6.695 8.320 48 HE2 HIS 7 HE2 HIS 7 39.361 8.947 7.866 49 H HIS 8 H HIS 8 34.050 4.973 8.135 50 HA HIS 8 HA HIS 8 31.859 4.375 8.163 51 HB2 HIS 8 HB2 HIS 8 32.352 3.540 5.294 52 HB3 HIS 8 HB3 HIS 8 30.769 3.658 6.049 53 HD1 HIS 8 HD1 HIS 8 32.730 5.448 3.804 54 HD2 HIS 8 HD2 HIS 8 30.569 6.551 7.180 55 HE1 HIS 8 HE1 HIS 8 32.299 7.907 3.557 56 HE2 HIS 8 HE2 HIS 8 31.169 8.581 5.694 57 H HIS 9 H HIS 9 30.315 2.462 7.752 58 HA HIS 9 HA HIS 9 31.698 -0.144 7.737 59 HB2 HIS 9 HB2 HIS 9 29.368 0.618 9.532 60 HB3 HIS 9 HB3 HIS 9 30.072 -0.991 9.402 61 HD1 HIS 9 HD1 HIS 9 32.316 -1.407 10.584 62 HD2 HIS 9 HD2 HIS 9 30.885 2.467 11.032 63 HE1 HIS 9 HE1 HIS 9 33.722 -0.373 12.385 64 HE2 HIS 9 HE2 HIS 9 32.938 2.010 12.530 65 H HIS 10 H HIS 10 28.440 1.322 7.617 66 HA HIS 10 HA HIS 10 28.051 0.156 4.958 67 HB2 HIS 10 HB2 HIS 10 26.088 -0.183 7.245 68 HB3 HIS 10 HB3 HIS 10 25.696 -0.495 5.556 69 HD1 HIS 10 HD1 HIS 10 27.188 -2.435 4.394 70 HD2 HIS 10 HD2 HIS 10 27.235 -2.307 8.550 71 HE1 HIS 10 HE1 HIS 10 28.074 -4.663 5.127 72 HE2 HIS 10 HE2 HIS 10 27.928 -4.628 7.636 73 H SER 11 H SER 11 26.622 2.264 7.460 74 HA SER 11 HA SER 11 26.083 4.270 5.350 75 HB2 SER 11 HB2 SER 11 24.108 5.016 6.614 76 HB3 SER 11 HB3 SER 11 23.957 3.312 6.190 77 HG SER 11 HG SER 11 24.069 2.778 8.241 78 H SER 12 H SER 12 25.511 6.488 6.782 79 HA SER 12 HA SER 12 27.968 7.368 7.837 80 HB2 SER 12 HB2 SER 12 26.691 9.349 8.648 81 HB3 SER 12 HB3 SER 12 26.345 8.957 6.965 82 HG SER 12 HG SER 12 24.343 8.594 7.475 83 H GLY 13 H GLY 13 24.992 6.339 9.507 84 HA2 GLY 13 HA2 GLY 13 25.639 4.865 11.512 85 HA3 GLY 13 HA3 GLY 13 26.480 6.303 12.064 86 H ARG 14 H ARG 14 23.847 4.570 12.672 87 HA ARG 14 HA ARG 14 21.939 6.747 13.022 88 HB2 ARG 14 HB2 ARG 14 21.770 3.817 13.771 89 HB3 ARG 14 HB3 ARG 14 20.459 4.976 13.947 90 HG2 ARG 14 HG2 ARG 14 20.388 5.291 11.530 91 HG3 ARG 14 HG3 ARG 14 21.744 4.175 11.336 92 HD2 ARG 14 HD2 ARG 14 20.395 2.372 12.310 93 HD3 ARG 14 HD3 ARG 14 19.036 3.482 12.494 94 HE ARG 14 HE ARG 14 19.377 3.681 9.909 95 HH11 ARG 14 HH11 ARG 14 19.596 0.818 11.833 96 HH12 ARG 14 HH12 ARG 14 19.099 -0.209 10.530 97 HH21 ARG 14 HH21 ARG 14 18.735 2.341 8.271 98 HH22 ARG 14 HH22 ARG 14 18.628 0.637 8.550 99 H GLU 15 H GLU 15 22.061 8.030 14.766 100 HA GLU 15 HA GLU 15 23.700 7.440 17.016 101 HB2 GLU 15 HB2 GLU 15 23.107 9.737 16.080 102 HB3 GLU 15 HB3 GLU 15 21.558 9.575 16.889 103 HG2 GLU 15 HG2 GLU 15 24.172 9.375 18.368 104 HG3 GLU 15 HG3 GLU 15 23.379 10.917 18.067 105 H ASN 16 H ASN 16 20.204 8.209 17.159 106 HA ASN 16 HA ASN 16 19.923 6.133 19.247 107 HB2 ASN 16 HB2 ASN 16 19.560 8.420 20.084 108 HB3 ASN 16 HB3 ASN 16 18.310 8.674 18.871 109 HD21 ASN 16 HD21 ASN 16 19.149 6.989 21.800 110 HD22 ASN 16 HD22 ASN 16 17.537 6.551 22.232 111 H LEU 17 H LEU 17 18.326 4.622 19.076 112 HA LEU 17 HA LEU 17 16.518 4.792 16.741 113 HB2 LEU 17 HB2 LEU 17 18.508 3.022 16.870 114 HB3 LEU 17 HB3 LEU 17 17.349 2.132 17.833 115 HG LEU 17 HG LEU 17 17.375 1.455 15.444 116 HD11 LEU 17 HD11 LEU 17 15.353 1.119 16.784 117 HD12 LEU 17 HD12 LEU 17 14.976 1.440 15.093 118 HD13 LEU 17 HD13 LEU 17 14.769 2.712 16.297 119 HD21 LEU 17 HD21 LEU 17 17.904 3.647 14.480 120 HD22 LEU 17 HD22 LEU 17 16.298 4.229 14.920 121 HD23 LEU 17 HD23 LEU 17 16.473 2.933 13.736 122 H TYR 18 H TYR 18 14.382 4.592 17.171 123 HA TYR 18 HA TYR 18 13.599 4.588 19.963 124 HB2 TYR 18 HB2 TYR 18 11.957 4.961 17.444 125 HB3 TYR 18 HB3 TYR 18 11.381 5.225 19.087 126 HD1 TYR 18 HD1 TYR 18 13.975 6.376 16.665 127 HD2 TYR 18 HD2 TYR 18 11.622 7.342 20.086 128 HE1 TYR 18 HE1 TYR 18 14.778 8.697 16.558 129 HE2 TYR 18 HE2 TYR 18 12.423 9.664 19.984 130 HH TYR 18 HH TYR 18 14.316 10.928 19.093 131 H PHE 19 H PHE 19 14.281 2.078 18.172 132 HA PHE 19 HA PHE 19 13.724 -0.122 18.091 133 HB2 PHE 19 HB2 PHE 19 12.188 0.533 20.621 134 HB3 PHE 19 HB3 PHE 19 12.687 -1.075 20.103 135 HD1 PHE 19 HD1 PHE 19 15.259 -1.402 19.724 136 HD2 PHE 19 HD2 PHE 19 13.565 1.736 22.060 137 HE1 PHE 19 HE1 PHE 19 17.401 -1.120 20.899 138 HE2 PHE 19 HE2 PHE 19 15.708 2.019 23.232 139 HZ PHE 19 HZ PHE 19 17.627 0.591 22.655 140 H GLN 20 H GLN 20 12.018 1.723 16.653 141 HA GLN 20 HA GLN 20 9.351 0.525 16.778 142 HB2 GLN 20 HB2 GLN 20 9.642 2.996 16.531 143 HB3 GLN 20 HB3 GLN 20 10.413 2.721 14.975 144 HG2 GLN 20 HG2 GLN 20 8.302 1.651 14.189 145 HG3 GLN 20 HG3 GLN 20 7.551 2.118 15.714 146 HE21 GLN 20 HE21 GLN 20 8.796 3.228 12.678 147 HE22 GLN 20 HE22 GLN 20 8.143 4.824 12.767 148 H GLY 21 H GLY 21 8.326 -0.177 14.679 149 HA2 GLY 21 HA2 GLY 21 9.713 -2.181 13.344 150 HA3 GLY 21 HA3 GLY 21 8.264 -1.396 12.737 151 H HIS 22 H HIS 22 11.057 -2.280 11.638 152 HA HIS 22 HA HIS 22 12.386 0.028 10.724 153 HB2 HIS 22 HB2 HIS 22 13.390 -2.241 10.775 154 HB3 HIS 22 HB3 HIS 22 12.341 -2.718 9.446 155 HD1 HIS 22 HD1 HIS 22 15.326 -0.571 10.215 156 HD2 HIS 22 HD2 HIS 22 13.178 -1.898 6.916 157 HE1 HIS 22 HE1 HIS 22 16.713 0.039 8.222 158 HE2 HIS 22 HE2 HIS 22 15.517 -1.006 6.281 159 H MET 23 H MET 23 11.081 1.530 9.756 160 HA MET 23 HA MET 23 9.527 0.725 7.391 161 HB2 MET 23 HB2 MET 23 8.476 2.965 7.560 162 HB3 MET 23 HB3 MET 23 8.250 1.989 9.006 163 HG2 MET 23 HG2 MET 23 9.835 3.259 10.224 164 HG3 MET 23 HG3 MET 23 10.414 4.065 8.765 165 HE1 MET 23 HE1 MET 23 6.613 3.400 9.187 166 HE2 MET 23 HE2 MET 23 6.095 4.734 10.215 167 HE3 MET 23 HE3 MET 23 7.122 3.462 10.876 168 H LEU 24 H LEU 24 9.558 2.150 5.510 169 HA LEU 24 HA LEU 24 12.119 3.573 5.128 170 HB2 LEU 24 HB2 LEU 24 10.653 1.696 3.293 171 HB3 LEU 24 HB3 LEU 24 11.765 2.892 2.652 172 HG LEU 24 HG LEU 24 12.659 0.979 4.784 173 HD11 LEU 24 HD11 LEU 24 13.458 -0.529 3.035 174 HD12 LEU 24 HD12 LEU 24 12.692 0.477 1.806 175 HD13 LEU 24 HD13 LEU 24 11.702 -0.383 2.986 176 HD21 LEU 24 HD21 LEU 24 14.851 1.390 3.796 177 HD22 LEU 24 HD22 LEU 24 14.080 2.905 4.267 178 HD23 LEU 24 HD23 LEU 24 14.115 2.424 2.566 179 H GLU 25 H GLU 25 12.041 5.551 4.244 180 HA GLU 25 HA GLU 25 9.484 6.811 3.796 181 HB2 GLU 25 HB2 GLU 25 12.330 7.737 3.794 182 HB3 GLU 25 HB3 GLU 25 11.113 8.739 3.006 183 HG2 GLU 25 HG2 GLU 25 9.928 9.079 4.984 184 HG3 GLU 25 HG3 GLU 25 10.702 7.721 5.788 185 H VAL 26 H VAL 26 8.392 6.516 2.071 186 HA VAL 26 HA VAL 26 9.736 6.218 -0.552 187 HB VAL 26 HB VAL 26 8.191 4.405 -1.169 188 HG11 VAL 26 HG11 VAL 26 10.384 3.803 -0.277 189 HG12 VAL 26 HG12 VAL 26 9.168 2.615 0.196 190 HG13 VAL 26 HG13 VAL 26 9.735 3.813 1.363 191 HG21 VAL 26 HG21 VAL 26 7.274 4.552 1.710 192 HG22 VAL 26 HG22 VAL 26 6.814 3.303 0.552 193 HG23 VAL 26 HG23 VAL 26 6.320 4.976 0.285 194 H GLU 27 H GLU 27 8.366 6.663 -2.418 195 HA GLU 27 HA GLU 27 6.150 8.481 -1.769 196 HB2 GLU 27 HB2 GLU 27 7.955 9.273 -3.300 197 HB3 GLU 27 HB3 GLU 27 7.472 8.038 -4.455 198 HG2 GLU 27 HG2 GLU 27 5.329 9.056 -4.757 199 HG3 GLU 27 HG3 GLU 27 5.621 10.185 -3.438 200 H VAL 28 H VAL 28 4.151 7.759 -1.833 201 HA VAL 28 HA VAL 28 3.496 5.193 -3.048 202 HB VAL 28 HB VAL 28 1.728 7.023 -1.406 203 HG11 VAL 28 HG11 VAL 28 0.418 4.986 -0.982 204 HG12 VAL 28 HG12 VAL 28 1.472 4.089 -2.078 205 HG13 VAL 28 HG13 VAL 28 0.469 5.405 -2.695 206 HG21 VAL 28 HG21 VAL 28 3.716 6.419 -0.123 207 HG22 VAL 28 HG22 VAL 28 3.429 4.710 -0.463 208 HG23 VAL 28 HG23 VAL 28 2.281 5.620 0.522 209 H ILE 29 H ILE 29 2.968 5.263 -5.177 210 HA ILE 29 HA ILE 29 1.593 7.616 -6.251 211 HB ILE 29 HB ILE 29 2.366 5.280 -7.966 212 HG12 ILE 29 HG12 ILE 29 4.307 7.392 -6.979 213 HG13 ILE 29 HG13 ILE 29 4.324 5.705 -6.492 214 HG21 ILE 29 HG21 ILE 29 1.167 7.102 -9.001 215 HG22 ILE 29 HG22 ILE 29 2.839 7.135 -9.566 216 HG23 ILE 29 HG23 ILE 29 2.299 8.280 -8.333 217 HD11 ILE 29 HD11 ILE 29 4.754 5.067 -8.826 218 HD12 ILE 29 HD12 ILE 29 6.010 6.105 -8.147 219 HD13 ILE 29 HD13 ILE 29 4.816 6.778 -9.257 220 H SER 30 H SER 30 -0.387 7.530 -7.354 221 HA SER 30 HA SER 30 -1.974 5.072 -6.953 222 HB2 SER 30 HB2 SER 30 -2.898 7.944 -7.232 223 HB3 SER 30 HB3 SER 30 -3.982 6.553 -7.172 224 HG SER 30 HG SER 30 -2.204 6.473 -5.145 225 H GLY 31 H GLY 31 -1.944 3.873 -8.738 226 HA2 GLY 31 HA2 GLY 31 -1.731 5.090 -11.377 227 HA3 GLY 31 HA3 GLY 31 -1.693 3.376 -11.011 228 H ARG 32 H ARG 32 -3.634 6.011 -12.004 229 HA ARG 32 HA ARG 32 -6.175 4.805 -11.535 230 HB2 ARG 32 HB2 ARG 32 -7.032 6.571 -13.157 231 HB3 ARG 32 HB3 ARG 32 -6.276 7.143 -11.684 232 HG2 ARG 32 HG2 ARG 32 -4.718 6.962 -14.248 233 HG3 ARG 32 HG3 ARG 32 -5.753 8.347 -13.899 234 HD2 ARG 32 HD2 ARG 32 -4.486 8.594 -11.722 235 HD3 ARG 32 HD3 ARG 32 -3.357 7.387 -12.329 236 HE ARG 32 HE ARG 32 -3.752 10.089 -13.406 237 HH11 ARG 32 HH11 ARG 32 -1.961 7.142 -13.407 238 HH12 ARG 32 HH12 ARG 32 -0.582 7.863 -14.153 239 HH21 ARG 32 HH21 ARG 32 -1.947 10.992 -14.339 240 HH22 ARG 32 HH22 ARG 32 -0.556 10.005 -14.640 241 H THR 33 H THR 33 -6.385 2.832 -12.374 242 HA THR 33 HA THR 33 -6.071 2.465 -15.284 243 HB THR 33 HB THR 33 -6.183 0.042 -14.835 244 HG1 THR 33 HG1 THR 33 -7.480 0.187 -12.895 245 HG21 THR 33 HG21 THR 33 -4.051 -0.200 -13.622 246 HG22 THR 33 HG22 THR 33 -4.167 1.480 -13.095 247 HG23 THR 33 HG23 THR 33 -3.982 1.103 -14.809 248 H LEU 34 H LEU 34 -7.765 0.873 -16.217 249 HA LEU 34 HA LEU 34 -9.893 0.623 -16.954 250 HB2 LEU 34 HB2 LEU 34 -10.421 0.815 -13.990 251 HB3 LEU 34 HB3 LEU 34 -11.716 0.570 -15.147 252 HG LEU 34 HG LEU 34 -10.628 -1.538 -15.888 253 HD11 LEU 34 HD11 LEU 34 -8.832 -2.521 -14.555 254 HD12 LEU 34 HD12 LEU 34 -8.719 -1.037 -13.606 255 HD13 LEU 34 HD13 LEU 34 -8.318 -1.021 -15.323 256 HD21 LEU 34 HD21 LEU 34 -11.213 -1.366 -12.929 257 HD22 LEU 34 HD22 LEU 34 -11.177 -2.851 -13.885 258 HD23 LEU 34 HD23 LEU 34 -12.392 -1.615 -14.217 259 H ASN 35 H ASN 35 -10.159 2.341 -18.241 260 HA ASN 35 HA ASN 35 -10.191 5.023 -17.494 261 HB2 ASN 35 HB2 ASN 35 -11.334 3.752 -19.991 262 HB3 ASN 35 HB3 ASN 35 -10.952 5.461 -19.795 263 HD21 ASN 35 HD21 ASN 35 -9.473 5.380 -21.504 264 HD22 ASN 35 HD22 ASN 35 -7.932 4.616 -21.343 265 H GLN 36 H GLN 36 -12.135 6.437 -18.541 266 HA GLN 36 HA GLN 36 -14.188 7.343 -18.243 267 HB2 GLN 36 HB2 GLN 36 -15.038 4.581 -17.329 268 HB3 GLN 36 HB3 GLN 36 -16.128 5.935 -17.591 269 HG2 GLN 36 HG2 GLN 36 -15.350 5.987 -19.974 270 HG3 GLN 36 HG3 GLN 36 -14.485 4.483 -19.654 271 HE21 GLN 36 HE21 GLN 36 -17.587 5.982 -19.973 272 HE22 GLN 36 HE22 GLN 36 -18.507 4.529 -20.116 273 H GLY 37 H GLY 37 -13.841 5.037 -15.517 274 HA2 GLY 37 HA2 GLY 37 -13.132 5.741 -13.340 275 HA3 GLY 37 HA3 GLY 37 -13.718 7.353 -13.696 276 H ALA 38 H ALA 38 -14.222 5.476 -11.452 277 HA ALA 38 HA ALA 38 -16.980 6.057 -11.040 278 HB1 ALA 38 HB1 ALA 38 -17.235 4.083 -12.514 279 HB2 ALA 38 HB2 ALA 38 -17.839 3.779 -10.886 280 HB3 ALA 38 HB3 ALA 38 -16.273 3.127 -11.380 281 H THR 39 H THR 39 -17.678 5.366 -8.823 282 HA THR 39 HA THR 39 -15.407 5.228 -7.015 283 HB THR 39 HB THR 39 -16.891 5.494 -5.191 284 HG1 THR 39 HG1 THR 39 -19.168 5.055 -6.841 285 HG21 THR 39 HG21 THR 39 -18.274 7.425 -5.801 286 HG22 THR 39 HG22 THR 39 -18.071 7.034 -7.508 287 HG23 THR 39 HG23 THR 39 -16.678 7.516 -6.540 288 H VAL 40 H VAL 40 -15.530 3.587 -5.173 289 HA VAL 40 HA VAL 40 -15.069 1.052 -6.223 290 HB VAL 40 HB VAL 40 -15.875 1.597 -3.360 291 HG11 VAL 40 HG11 VAL 40 -14.410 -0.305 -2.848 292 HG12 VAL 40 HG12 VAL 40 -14.125 -0.541 -4.571 293 HG13 VAL 40 HG13 VAL 40 -15.742 -0.766 -3.908 294 HG21 VAL 40 HG21 VAL 40 -13.156 1.892 -4.639 295 HG22 VAL 40 HG22 VAL 40 -13.485 1.976 -2.908 296 HG23 VAL 40 HG23 VAL 40 -14.160 3.192 -3.994 297 H GLU 41 H GLU 41 -18.012 2.443 -4.914 298 HA GLU 41 HA GLU 41 -19.481 0.076 -4.540 299 HB2 GLU 41 HB2 GLU 41 -20.079 2.281 -3.581 300 HB3 GLU 41 HB3 GLU 41 -20.548 2.829 -5.186 301 HG2 GLU 41 HG2 GLU 41 -22.284 1.104 -5.269 302 HG3 GLU 41 HG3 GLU 41 -21.815 0.559 -3.659 303 H GLU 42 H GLU 42 -19.292 2.225 -7.396 304 HA GLU 42 HA GLU 42 -21.223 0.859 -8.946 305 HB2 GLU 42 HB2 GLU 42 -18.886 2.584 -9.764 306 HB3 GLU 42 HB3 GLU 42 -19.984 1.877 -10.936 307 HG2 GLU 42 HG2 GLU 42 -20.771 4.044 -10.643 308 HG3 GLU 42 HG3 GLU 42 -21.850 3.059 -9.659 309 H LYS 43 H LYS 43 -17.925 0.088 -8.214 310 HA LYS 43 HA LYS 43 -17.920 -2.014 -10.296 311 HB2 LYS 43 HB2 LYS 43 -15.505 -0.594 -9.164 312 HB3 LYS 43 HB3 LYS 43 -15.531 -1.732 -10.505 313 HG2 LYS 43 HG2 LYS 43 -16.789 -0.156 -11.861 314 HG3 LYS 43 HG3 LYS 43 -16.874 0.972 -10.508 315 HD2 LYS 43 HD2 LYS 43 -15.137 1.748 -11.932 316 HD3 LYS 43 HD3 LYS 43 -14.350 1.024 -10.531 317 HE2 LYS 43 HE2 LYS 43 -13.172 0.331 -12.497 318 HE3 LYS 43 HE3 LYS 43 -14.044 -1.063 -11.865 319 HZ1 LYS 43 HZ1 LYS 43 -15.756 -0.704 -13.533 320 HZ2 LYS 43 HZ2 LYS 43 -14.248 -0.894 -14.268 321 HZ3 LYS 43 HZ3 LYS 43 -14.928 0.645 -14.130 322 H LEU 44 H LEU 44 -18.907 -2.307 -7.549 323 HA LEU 44 HA LEU 44 -17.022 -3.698 -5.950 324 HB2 LEU 44 HB2 LEU 44 -20.038 -3.747 -5.999 325 HB3 LEU 44 HB3 LEU 44 -19.101 -4.683 -4.851 326 HG LEU 44 HG LEU 44 -19.050 -1.668 -5.085 327 HD11 LEU 44 HD11 LEU 44 -20.343 -3.445 -3.012 328 HD12 LEU 44 HD12 LEU 44 -21.185 -2.471 -4.218 329 HD13 LEU 44 HD13 LEU 44 -20.247 -1.685 -2.949 330 HD21 LEU 44 HD21 LEU 44 -17.781 -1.757 -2.985 331 HD22 LEU 44 HD22 LEU 44 -16.923 -2.562 -4.298 332 HD23 LEU 44 HD23 LEU 44 -17.760 -3.519 -3.075 333 H THR 45 H THR 45 -15.951 -5.091 -7.394 334 HA THR 45 HA THR 45 -17.294 -7.687 -7.696 335 HB THR 45 HB THR 45 -17.496 -6.743 -9.919 336 HG1 THR 45 HG1 THR 45 -16.660 -8.464 -10.940 337 HG21 THR 45 HG21 THR 45 -14.507 -6.280 -9.807 338 HG22 THR 45 HG22 THR 45 -15.751 -5.030 -9.779 339 HG23 THR 45 HG23 THR 45 -15.536 -6.027 -11.217 340 H GLU 46 H GLU 46 -15.692 -9.441 -8.240 341 HA GLU 46 HA GLU 46 -13.664 -9.653 -6.365 342 HB2 GLU 46 HB2 GLU 46 -14.695 -11.521 -7.724 343 HB3 GLU 46 HB3 GLU 46 -13.663 -11.034 -9.061 344 HG2 GLU 46 HG2 GLU 46 -12.474 -12.778 -8.121 345 HG3 GLU 46 HG3 GLU 46 -11.719 -11.370 -7.375 346 H GLU 47 H GLU 47 -13.437 -8.587 -9.744 347 HA GLU 47 HA GLU 47 -10.667 -8.374 -9.960 348 HB2 GLU 47 HB2 GLU 47 -12.822 -6.746 -11.308 349 HB3 GLU 47 HB3 GLU 47 -11.126 -6.729 -11.780 350 HG2 GLU 47 HG2 GLU 47 -13.022 -9.068 -11.889 351 HG3 GLU 47 HG3 GLU 47 -12.326 -8.187 -13.245 352 H TYR 48 H TYR 48 -12.969 -6.121 -8.517 353 HA TYR 48 HA TYR 48 -11.094 -3.973 -8.230 354 HB2 TYR 48 HB2 TYR 48 -13.782 -4.075 -8.027 355 HB3 TYR 48 HB3 TYR 48 -13.378 -4.200 -6.318 356 HD1 TYR 48 HD1 TYR 48 -11.737 -2.370 -5.391 357 HD2 TYR 48 HD2 TYR 48 -13.923 -1.976 -9.026 358 HE1 TYR 48 HE1 TYR 48 -11.430 0.063 -5.313 359 HE2 TYR 48 HE2 TYR 48 -13.626 0.467 -8.948 360 HH TYR 48 HH TYR 48 -11.402 1.984 -7.061 361 H PHE 49 H PHE 49 -11.887 -6.833 -6.436 362 HA PHE 49 HA PHE 49 -10.251 -6.107 -4.135 363 HB2 PHE 49 HB2 PHE 49 -12.369 -7.369 -3.851 364 HB3 PHE 49 HB3 PHE 49 -11.697 -8.695 -4.791 365 HD1 PHE 49 HD1 PHE 49 -11.014 -6.673 -1.727 366 HD2 PHE 49 HD2 PHE 49 -10.640 -10.441 -3.685 367 HE1 PHE 49 HE1 PHE 49 -10.081 -7.645 0.330 368 HE2 PHE 49 HE2 PHE 49 -9.714 -11.415 -1.628 369 HZ PHE 49 HZ PHE 49 -9.431 -10.020 0.381 370 H ASN 50 H ASN 50 -9.637 -7.215 -7.197 371 HA ASN 50 HA ASN 50 -7.317 -8.833 -6.401 372 HB2 ASN 50 HB2 ASN 50 -8.591 -8.402 -9.116 373 HB3 ASN 50 HB3 ASN 50 -7.158 -9.384 -8.835 374 HD21 ASN 50 HD21 ASN 50 -9.757 -10.165 -9.896 375 HD22 ASN 50 HD22 ASN 50 -10.343 -11.401 -8.845 376 H ALA 51 H ALA 51 -8.131 -5.914 -8.270 377 HA ALA 51 HA ALA 51 -5.406 -5.516 -9.115 378 HB1 ALA 51 HB1 ALA 51 -7.346 -4.928 -10.527 379 HB2 ALA 51 HB2 ALA 51 -6.232 -3.583 -10.289 380 HB3 ALA 51 HB3 ALA 51 -7.751 -3.639 -9.394 381 H VAL 52 H VAL 52 -7.580 -3.407 -7.152 382 HA VAL 52 HA VAL 52 -5.351 -1.662 -6.580 383 HB VAL 52 HB VAL 52 -6.968 -0.282 -5.363 384 HG11 VAL 52 HG11 VAL 52 -8.443 0.255 -7.238 385 HG12 VAL 52 HG12 VAL 52 -8.050 -1.287 -8.001 386 HG13 VAL 52 HG13 VAL 52 -6.801 -0.061 -7.794 387 HG21 VAL 52 HG21 VAL 52 -8.932 -2.516 -5.916 388 HG22 VAL 52 HG22 VAL 52 -9.337 -0.938 -5.238 389 HG23 VAL 52 HG23 VAL 52 -8.308 -2.047 -4.333 390 H ASN 53 H ASN 53 -5.308 -4.450 -5.369 391 HA ASN 53 HA ASN 53 -5.520 -3.779 -2.501 392 HB2 ASN 53 HB2 ASN 53 -5.660 -6.470 -3.873 393 HB3 ASN 53 HB3 ASN 53 -5.701 -6.234 -2.129 394 HD21 ASN 53 HD21 ASN 53 -7.311 -4.325 -4.644 395 HD22 ASN 53 HD22 ASN 53 -8.907 -4.655 -4.099 396 H TYR 54 H TYR 54 -3.103 -3.652 -4.562 397 HA TYR 54 HA TYR 54 -1.192 -4.884 -2.688 398 HB2 TYR 54 HB2 TYR 54 0.159 -5.779 -4.485 399 HB3 TYR 54 HB3 TYR 54 -1.481 -6.391 -4.646 400 HD1 TYR 54 HD1 TYR 54 1.014 -4.068 -6.084 401 HD2 TYR 54 HD2 TYR 54 -2.822 -5.850 -6.561 402 HE1 TYR 54 HE1 TYR 54 0.929 -3.255 -8.405 403 HE2 TYR 54 HE2 TYR 54 -2.910 -5.042 -8.880 404 HH TYR 54 HH TYR 54 -0.201 -3.784 -10.509 405 H ALA 55 H ALA 55 1.022 -4.127 -2.936 406 HA ALA 55 HA ALA 55 1.308 -1.506 -4.262 407 HB1 ALA 55 HB1 ALA 55 2.477 -2.298 -1.586 408 HB2 ALA 55 HB2 ALA 55 1.156 -1.156 -1.843 409 HB3 ALA 55 HB3 ALA 55 2.776 -0.778 -2.434 410 H GLU 56 H GLU 56 3.096 -1.336 -5.551 411 HA GLU 56 HA GLU 56 4.888 -3.645 -5.712 412 HB2 GLU 56 HB2 GLU 56 4.464 -1.289 -7.562 413 HB3 GLU 56 HB3 GLU 56 5.710 -2.505 -7.814 414 HG2 GLU 56 HG2 GLU 56 3.954 -4.241 -7.909 415 HG3 GLU 56 HG3 GLU 56 2.733 -2.979 -7.754 416 H ILE 57 H ILE 57 6.710 -3.627 -4.602 417 HA ILE 57 HA ILE 57 8.018 -1.062 -3.947 418 HB ILE 57 HB ILE 57 8.312 -3.733 -2.532 419 HG12 ILE 57 HG12 ILE 57 7.153 -2.323 -0.635 420 HG13 ILE 57 HG13 ILE 57 6.567 -1.342 -1.970 421 HG21 ILE 57 HG21 ILE 57 9.345 -0.995 -1.783 422 HG22 ILE 57 HG22 ILE 57 10.311 -2.357 -2.355 423 HG23 ILE 57 HG23 ILE 57 9.485 -2.454 -0.799 424 HD11 ILE 57 HD11 ILE 57 4.933 -2.997 -1.287 425 HD12 ILE 57 HD12 ILE 57 6.086 -4.290 -1.611 426 HD13 ILE 57 HD13 ILE 57 5.481 -3.297 -2.936 427 H ASN 58 H ASN 58 10.302 -0.891 -4.146 428 HA ASN 58 HA ASN 58 11.487 -2.313 -6.320 429 HB2 ASN 58 HB2 ASN 58 12.012 0.046 -5.817 430 HB3 ASN 58 HB3 ASN 58 12.759 -0.445 -4.299 431 HD21 ASN 58 HD21 ASN 58 13.071 -0.350 -7.733 432 HD22 ASN 58 HD22 ASN 58 14.742 -0.769 -7.798 433 H GLU 59 H GLU 59 13.467 -3.575 -6.245 434 HA GLU 59 HA GLU 59 13.463 -5.726 -4.487 435 HB2 GLU 59 HB2 GLU 59 14.598 -5.680 -6.697 436 HB3 GLU 59 HB3 GLU 59 15.846 -4.649 -6.013 437 HG2 GLU 59 HG2 GLU 59 16.673 -6.882 -6.100 438 HG3 GLU 59 HG3 GLU 59 16.399 -6.463 -4.411 439 H GLU 60 H GLU 60 15.531 -2.832 -4.382 440 HA GLU 60 HA GLU 60 17.123 -3.477 -2.192 441 HB2 GLU 60 HB2 GLU 60 16.156 -0.847 -3.294 442 HB3 GLU 60 HB3 GLU 60 17.232 -0.920 -1.908 443 HG2 GLU 60 HG2 GLU 60 17.889 -2.221 -4.540 444 HG3 GLU 60 HG3 GLU 60 18.313 -0.551 -4.162 445 H ASP 61 H ASP 61 14.108 -1.563 -2.194 446 HA ASP 61 HA ASP 61 13.959 -1.280 0.621 447 HB2 ASP 61 HB2 ASP 61 11.696 -1.168 -1.392 448 HB3 ASP 61 HB3 ASP 61 11.696 -0.467 0.225 449 H TRP 62 H TRP 62 12.645 -3.661 -1.617 450 HA TRP 62 HA TRP 62 10.967 -5.131 0.043 451 HB2 TRP 62 HB2 TRP 62 11.192 -5.469 -2.398 452 HB3 TRP 62 HB3 TRP 62 12.793 -6.154 -2.155 453 HD1 TRP 62 HD1 TRP 62 12.906 -8.641 -1.078 454 HE1 TRP 62 HE1 TRP 62 11.165 -10.535 -1.026 455 HE3 TRP 62 HE3 TRP 62 8.723 -5.937 -2.249 456 HZ2 TRP 62 HZ2 TRP 62 8.392 -10.843 -1.440 457 HZ3 TRP 62 HZ3 TRP 62 6.568 -7.110 -2.406 458 HH2 TRP 62 HH2 TRP 62 6.408 -9.512 -2.009 459 H ASN 63 H ASN 63 14.453 -5.613 -0.548 460 HA ASN 63 HA ASN 63 14.814 -7.663 1.378 461 HB2 ASN 63 HB2 ASN 63 16.799 -5.711 0.181 462 HB3 ASN 63 HB3 ASN 63 17.245 -7.096 1.175 463 HD21 ASN 63 HD21 ASN 63 17.868 -6.470 -1.624 464 HD22 ASN 63 HD22 ASN 63 17.316 -7.830 -2.532 465 H ALA 64 H ALA 64 15.096 -4.140 1.556 466 HA ALA 64 HA ALA 64 16.230 -3.930 4.119 467 HB1 ALA 64 HB1 ALA 64 14.353 -1.996 2.757 468 HB2 ALA 64 HB2 ALA 64 16.103 -2.065 2.533 469 HB3 ALA 64 HB3 ALA 64 15.432 -1.629 4.105 470 H LEU 65 H LEU 65 12.872 -4.310 3.111 471 HA LEU 65 HA LEU 65 11.884 -4.026 5.841 472 HB2 LEU 65 HB2 LEU 65 10.443 -4.671 3.264 473 HB3 LEU 65 HB3 LEU 65 9.659 -4.407 4.811 474 HG LEU 65 HG LEU 65 11.297 -2.333 3.337 475 HD11 LEU 65 HD11 LEU 65 9.241 -2.882 2.132 476 HD12 LEU 65 HD12 LEU 65 9.188 -1.256 2.811 477 HD13 LEU 65 HD13 LEU 65 8.300 -2.569 3.589 478 HD21 LEU 65 HD21 LEU 65 11.320 -1.993 5.743 479 HD22 LEU 65 HD22 LEU 65 9.561 -2.119 5.799 480 HD23 LEU 65 HD23 LEU 65 10.324 -0.766 4.962 481 H GLY 66 H GLY 66 13.121 -6.552 3.958 482 HA2 GLY 66 HA2 GLY 66 13.181 -8.838 4.221 483 HA3 GLY 66 HA3 GLY 66 12.627 -8.567 5.865 484 H LEU 67 H LEU 67 11.119 -8.069 2.677 485 HA LEU 67 HA LEU 67 8.590 -9.065 3.711 486 HB2 LEU 67 HB2 LEU 67 9.378 -7.809 1.082 487 HB3 LEU 67 HB3 LEU 67 7.750 -8.359 1.436 488 HG LEU 67 HG LEU 67 9.199 -6.261 3.062 489 HD11 LEU 67 HD11 LEU 67 8.852 -5.468 0.770 490 HD12 LEU 67 HD12 LEU 67 7.806 -4.620 1.909 491 HD13 LEU 67 HD13 LEU 67 7.140 -5.889 0.878 492 HD21 LEU 67 HD21 LEU 67 6.967 -5.781 3.933 493 HD22 LEU 67 HD22 LEU 67 7.447 -7.443 4.267 494 HD23 LEU 67 HD23 LEU 67 6.302 -7.102 2.970 495 H GLN 68 H GLN 68 7.522 -10.880 3.076 496 HA GLN 68 HA GLN 68 8.893 -12.788 1.327 497 HB2 GLN 68 HB2 GLN 68 7.904 -13.538 3.491 498 HB3 GLN 68 HB3 GLN 68 6.313 -13.086 2.896 499 HG2 GLN 68 HG2 GLN 68 6.530 -14.752 1.097 500 HG3 GLN 68 HG3 GLN 68 8.107 -15.218 1.732 501 HE21 GLN 68 HE21 GLN 68 8.201 -16.331 3.714 502 HE22 GLN 68 HE22 GLN 68 6.818 -17.125 4.378 503 H GLU 69 H GLU 69 7.895 -13.642 -0.576 504 HA GLU 69 HA GLU 69 6.513 -11.770 -2.151 505 HB2 GLU 69 HB2 GLU 69 6.897 -14.743 -2.538 506 HB3 GLU 69 HB3 GLU 69 6.213 -13.671 -3.758 507 HG2 GLU 69 HG2 GLU 69 8.255 -12.381 -3.825 508 HG3 GLU 69 HG3 GLU 69 8.949 -13.364 -2.538 509 H GLY 70 H GLY 70 4.599 -11.053 -1.563 510 HA2 GLY 70 HA2 GLY 70 2.222 -11.247 -1.537 511 HA3 GLY 70 HA3 GLY 70 2.384 -12.956 -1.167 512 H ASP 71 H ASP 71 4.242 -10.536 0.562 513 HA ASP 71 HA ASP 71 3.007 -11.291 3.067 514 HB2 ASP 71 HB2 ASP 71 5.527 -10.495 2.407 515 HB3 ASP 71 HB3 ASP 71 4.871 -8.982 3.020 516 H ARG 72 H ARG 72 2.790 -9.158 4.635 517 HA ARG 72 HA ARG 72 0.747 -7.455 3.330 518 HB2 ARG 72 HB2 ARG 72 0.819 -8.269 6.247 519 HB3 ARG 72 HB3 ARG 72 -0.502 -7.487 5.385 520 HG2 ARG 72 HG2 ARG 72 -0.953 -9.469 4.127 521 HG3 ARG 72 HG3 ARG 72 0.506 -10.252 4.734 522 HD2 ARG 72 HD2 ARG 72 -1.977 -9.537 6.290 523 HD3 ARG 72 HD3 ARG 72 -1.386 -11.151 5.906 524 HE ARG 72 HE ARG 72 -0.664 -9.594 8.132 525 HH11 ARG 72 HH11 ARG 72 0.840 -11.637 5.783 526 HH12 ARG 72 HH12 ARG 72 2.101 -12.115 6.861 527 HH21 ARG 72 HH21 ARG 72 0.951 -10.262 9.498 528 HH22 ARG 72 HH22 ARG 72 2.152 -11.370 8.943 529 H VAL 73 H VAL 73 1.196 -5.326 3.313 530 HA VAL 73 HA VAL 73 3.088 -4.253 5.323 531 HB VAL 73 HB VAL 73 3.865 -2.629 3.623 532 HG11 VAL 73 HG11 VAL 73 5.125 -4.682 4.009 533 HG12 VAL 73 HG12 VAL 73 5.227 -4.187 2.319 534 HG13 VAL 73 HG13 VAL 73 4.163 -5.516 2.787 535 HG21 VAL 73 HG21 VAL 73 3.337 -2.968 1.256 536 HG22 VAL 73 HG22 VAL 73 1.882 -2.607 2.182 537 HG23 VAL 73 HG23 VAL 73 2.217 -4.265 1.681 538 H LYS 74 H LYS 74 2.594 -2.349 6.326 539 HA LYS 74 HA LYS 74 0.087 -1.020 5.516 540 HB2 LYS 74 HB2 LYS 74 -0.170 -1.771 7.765 541 HB3 LYS 74 HB3 LYS 74 1.420 -1.170 8.224 542 HG2 LYS 74 HG2 LYS 74 0.698 1.105 8.047 543 HG3 LYS 74 HG3 LYS 74 -0.838 0.624 7.331 544 HD2 LYS 74 HD2 LYS 74 -0.025 -0.235 10.100 545 HD3 LYS 74 HD3 LYS 74 -0.837 1.303 9.797 546 HE2 LYS 74 HE2 LYS 74 -2.659 0.006 8.650 547 HE3 LYS 74 HE3 LYS 74 -1.875 -1.468 9.217 548 HZ1 LYS 74 HZ1 LYS 74 -3.714 -0.686 10.647 549 HZ2 LYS 74 HZ2 LYS 74 -2.815 0.700 11.011 550 HZ3 LYS 74 HZ3 LYS 74 -2.241 -0.825 11.466 551 H VAL 75 H VAL 75 0.194 0.924 4.681 552 HA VAL 75 HA VAL 75 2.692 2.477 4.884 553 HB VAL 75 HB VAL 75 0.334 2.922 3.033 554 HG11 VAL 75 HG11 VAL 75 1.840 4.390 1.788 555 HG12 VAL 75 HG12 VAL 75 3.114 4.108 2.975 556 HG13 VAL 75 HG13 VAL 75 1.638 4.950 3.448 557 HG21 VAL 75 HG21 VAL 75 1.740 1.953 1.268 558 HG22 VAL 75 HG22 VAL 75 1.409 0.787 2.548 559 HG23 VAL 75 HG23 VAL 75 2.982 1.579 2.466 560 H LYS 76 H LYS 76 2.784 4.332 6.047 561 HA LYS 76 HA LYS 76 0.251 5.631 6.839 562 HB2 LYS 76 HB2 LYS 76 2.836 5.395 8.386 563 HB3 LYS 76 HB3 LYS 76 1.629 6.612 8.768 564 HG2 LYS 76 HG2 LYS 76 1.071 4.966 10.250 565 HG3 LYS 76 HG3 LYS 76 0.008 4.569 8.901 566 HD2 LYS 76 HD2 LYS 76 1.024 2.547 9.732 567 HD3 LYS 76 HD3 LYS 76 1.678 2.901 8.131 568 HE2 LYS 76 HE2 LYS 76 3.735 3.650 9.029 569 HE3 LYS 76 HE3 LYS 76 3.075 3.756 10.660 570 HZ1 LYS 76 HZ1 LYS 76 2.905 1.364 10.734 571 HZ2 LYS 76 HZ2 LYS 76 4.494 1.814 10.364 572 HZ3 LYS 76 HZ3 LYS 76 3.477 1.233 9.148 573 H THR 77 H THR 77 -0.068 7.612 6.117 574 HA THR 77 HA THR 77 2.246 9.340 5.447 575 HB THR 77 HB THR 77 1.017 10.327 3.611 576 HG1 THR 77 HG1 THR 77 -1.068 9.577 3.061 577 HG21 THR 77 HG21 THR 77 2.283 8.322 3.036 578 HG22 THR 77 HG22 THR 77 0.814 8.418 2.065 579 HG23 THR 77 HG23 THR 77 0.894 7.308 3.435 580 H GLU 78 H GLU 78 1.018 11.708 5.011 581 HA GLU 78 HA GLU 78 0.125 12.522 7.600 582 HB2 GLU 78 HB2 GLU 78 -0.121 14.751 6.642 583 HB3 GLU 78 HB3 GLU 78 1.424 14.042 6.204 584 HG2 GLU 78 HG2 GLU 78 -0.862 13.773 4.304 585 HG3 GLU 78 HG3 GLU 78 -0.058 15.330 4.457 586 H PHE 79 H PHE 79 -1.503 11.102 5.016 587 HA PHE 79 HA PHE 79 -4.064 12.404 5.600 588 HB2 PHE 79 HB2 PHE 79 -3.321 10.406 3.448 589 HB3 PHE 79 HB3 PHE 79 -4.897 11.178 3.618 590 HD1 PHE 79 HD2 PHE 79 -4.984 13.736 3.504 591 HD2 PHE 79 HD1 PHE 79 -1.620 11.460 2.209 592 HE1 PHE 79 HE2 PHE 79 -4.200 15.647 2.172 593 HE2 PHE 79 HE1 PHE 79 -0.833 13.376 0.888 594 HZ PHE 79 HZ PHE 79 -2.123 15.470 0.866 595 H GLY 80 H GLY 80 -2.582 9.165 5.713 596 HA2 GLY 80 HA2 GLY 80 -4.005 8.337 7.973 597 HA3 GLY 80 HA3 GLY 80 -4.920 7.800 6.574 598 H GLU 81 H GLU 81 -4.629 5.617 6.898 599 HA GLU 81 HA GLU 81 -2.025 4.521 6.235 600 HB2 GLU 81 HB2 GLU 81 -1.914 3.072 8.215 601 HB3 GLU 81 HB3 GLU 81 -1.867 4.771 8.663 602 HG2 GLU 81 HG2 GLU 81 -4.305 4.634 9.176 603 HG3 GLU 81 HG3 GLU 81 -4.216 2.897 8.887 604 H VAL 82 H VAL 82 -2.093 2.283 5.630 605 HA VAL 82 HA VAL 82 -4.626 0.863 5.622 606 HB VAL 82 HB VAL 82 -4.814 2.383 3.656 607 HG11 VAL 82 HG11 VAL 82 -2.446 2.499 3.048 608 HG12 VAL 82 HG12 VAL 82 -3.443 2.016 1.677 609 HG13 VAL 82 HG13 VAL 82 -2.493 0.809 2.543 610 HG21 VAL 82 HG21 VAL 82 -5.459 0.642 2.015 611 HG22 VAL 82 HG22 VAL 82 -6.070 0.324 3.639 612 HG23 VAL 82 HG23 VAL 82 -4.673 -0.568 3.032 613 H VAL 83 H VAL 83 -4.419 -1.365 5.141 614 HA VAL 83 HA VAL 83 -1.644 -2.360 4.915 615 HB VAL 83 HB VAL 83 -4.039 -3.962 5.854 616 HG11 VAL 83 HG11 VAL 83 -2.235 -5.345 5.059 617 HG12 VAL 83 HG12 VAL 83 -2.280 -5.437 6.821 618 HG13 VAL 83 HG13 VAL 83 -1.062 -4.443 6.017 619 HG21 VAL 83 HG21 VAL 83 -3.709 -2.114 7.407 620 HG22 VAL 83 HG22 VAL 83 -1.997 -2.515 7.548 621 HG23 VAL 83 HG23 VAL 83 -3.220 -3.640 8.147 622 H VAL 84 H VAL 84 -1.077 -3.192 2.986 623 HA VAL 84 HA VAL 84 -3.150 -4.452 1.290 624 HB VAL 84 HB VAL 84 -2.112 -3.525 -0.717 625 HG11 VAL 84 HG11 VAL 84 -3.923 -2.251 0.300 626 HG12 VAL 84 HG12 VAL 84 -2.750 -1.171 -0.452 627 HG13 VAL 84 HG13 VAL 84 -2.766 -1.373 1.299 628 HG21 VAL 84 HG21 VAL 84 0.190 -3.350 0.049 629 HG22 VAL 84 HG22 VAL 84 -0.257 -2.063 1.170 630 HG23 VAL 84 HG23 VAL 84 -0.366 -1.795 -0.570 631 H PHE 85 H PHE 85 -2.101 -5.772 -0.541 632 HA PHE 85 HA PHE 85 -0.197 -7.619 0.586 633 HB2 PHE 85 HB2 PHE 85 -1.461 -7.450 -2.163 634 HB3 PHE 85 HB3 PHE 85 -0.366 -8.734 -1.672 635 HD1 PHE 85 HD1 PHE 85 -1.037 -10.211 0.283 636 HD2 PHE 85 HD2 PHE 85 -3.755 -7.567 -1.665 637 HE1 PHE 85 HE1 PHE 85 -2.930 -11.489 1.196 638 HE2 PHE 85 HE2 PHE 85 -5.651 -8.844 -0.753 639 HZ PHE 85 HZ PHE 85 -5.241 -10.807 0.678 640 H ALA 86 H ALA 86 1.923 -7.999 -0.043 641 HA ALA 86 HA ALA 86 3.278 -5.701 -1.245 642 HB1 ALA 86 HB1 ALA 86 5.323 -6.651 -0.323 643 HB2 ALA 86 HB2 ALA 86 4.444 -8.096 0.181 644 HB3 ALA 86 HB3 ALA 86 4.073 -6.536 0.915 645 H LYS 87 H LYS 87 3.859 -5.686 -3.317 646 HA LYS 87 HA LYS 87 4.778 -8.194 -4.593 647 HB2 LYS 87 HB2 LYS 87 3.342 -5.871 -5.908 648 HB3 LYS 87 HB3 LYS 87 4.079 -7.202 -6.780 649 HG2 LYS 87 HG2 LYS 87 2.510 -8.724 -5.512 650 HG3 LYS 87 HG3 LYS 87 1.675 -7.258 -4.986 651 HD2 LYS 87 HD2 LYS 87 1.381 -6.621 -7.369 652 HD3 LYS 87 HD3 LYS 87 2.122 -8.152 -7.839 653 HE2 LYS 87 HE2 LYS 87 0.315 -9.312 -6.558 654 HE3 LYS 87 HE3 LYS 87 -0.456 -7.748 -6.340 655 HZ1 LYS 87 HZ1 LYS 87 0.061 -9.129 -8.913 656 HZ2 LYS 87 HZ2 LYS 87 -0.519 -7.549 -8.791 657 HZ3 LYS 87 HZ3 LYS 87 -1.447 -8.837 -8.204 658 H LYS 88 H LYS 88 6.420 -7.942 -6.217 659 HA LYS 88 HA LYS 88 8.240 -5.746 -5.533 660 HB2 LYS 88 HB2 LYS 88 8.907 -8.204 -5.266 661 HB3 LYS 88 HB3 LYS 88 8.952 -8.271 -7.027 662 HG2 LYS 88 HG2 LYS 88 10.567 -6.415 -7.014 663 HG3 LYS 88 HG3 LYS 88 10.562 -6.469 -5.252 664 HD2 LYS 88 HD2 LYS 88 11.381 -8.746 -7.066 665 HD3 LYS 88 HD3 LYS 88 12.495 -7.664 -6.232 666 HE2 LYS 88 HE2 LYS 88 11.546 -8.421 -4.068 667 HE3 LYS 88 HE3 LYS 88 10.536 -9.571 -4.946 668 HZ1 LYS 88 HZ1 LYS 88 12.542 -10.616 -4.095 669 HZ2 LYS 88 HZ2 LYS 88 13.509 -9.523 -4.948 670 HZ3 LYS 88 HZ3 LYS 88 12.537 -10.631 -5.785 671 H GLY 89 H GLY 89 8.107 -4.072 -6.936 672 HA2 GLY 89 HA2 GLY 89 7.298 -4.663 -9.724 673 HA3 GLY 89 HA3 GLY 89 6.918 -3.181 -8.866 674 H ASP 90 H ASP 90 7.789 -2.513 -11.089 675 HA ASP 90 HA ASP 90 10.701 -2.443 -11.284 676 HB2 ASP 90 HB2 ASP 90 8.641 -1.214 -13.131 677 HB3 ASP 90 HB3 ASP 90 10.345 -1.499 -13.482 678 H VAL 91 H VAL 91 8.988 -0.870 -9.269 679 HA VAL 91 HA VAL 91 9.225 1.895 -9.959 680 HB VAL 91 HB VAL 91 8.628 2.313 -7.586 681 HG11 VAL 91 HG11 VAL 91 6.943 0.219 -8.970 682 HG12 VAL 91 HG12 VAL 91 6.858 1.962 -9.221 683 HG13 VAL 91 HG13 VAL 91 6.396 1.272 -7.666 684 HG21 VAL 91 HG21 VAL 91 8.137 0.423 -6.099 685 HG22 VAL 91 HG22 VAL 91 9.834 0.429 -6.577 686 HG23 VAL 91 HG23 VAL 91 8.711 -0.704 -7.330 687 HA PRO 92 HA PRO 92 13.433 2.704 -8.657 688 HB2 PRO 92 HB2 PRO 92 12.528 5.324 -7.632 689 HB3 PRO 92 HB3 PRO 92 13.665 4.962 -8.935 690 HG2 PRO 92 HG2 PRO 92 11.223 5.957 -9.443 691 HG3 PRO 92 HG3 PRO 92 11.987 4.777 -10.526 692 HD2 PRO 92 HD2 PRO 92 9.875 4.337 -8.433 693 HD3 PRO 92 HD3 PRO 92 9.978 3.681 -10.083 694 H LYS 93 H LYS 93 14.732 2.861 -6.767 695 HA LYS 93 HA LYS 93 13.712 1.812 -4.395 696 HB2 LYS 93 HB2 LYS 93 16.092 1.732 -5.051 697 HB3 LYS 93 HB3 LYS 93 16.229 3.460 -4.752 698 HG2 LYS 93 HG2 LYS 93 15.767 3.109 -2.389 699 HG3 LYS 93 HG3 LYS 93 15.546 1.380 -2.673 700 HD2 LYS 93 HD2 LYS 93 17.901 1.273 -3.487 701 HD3 LYS 93 HD3 LYS 93 18.100 2.966 -3.024 702 HE2 LYS 93 HE2 LYS 93 17.656 2.414 -0.699 703 HE3 LYS 93 HE3 LYS 93 17.327 0.735 -1.135 704 HZ1 LYS 93 HZ1 LYS 93 19.563 1.050 -0.236 705 HZ2 LYS 93 HZ2 LYS 93 19.937 2.103 -1.506 706 HZ3 LYS 93 HZ3 LYS 93 19.602 0.477 -1.825 707 H GLY 94 H GLY 94 13.018 2.673 -2.433 708 HA2 GLY 94 HA2 GLY 94 12.085 4.246 -1.023 709 HA3 GLY 94 HA3 GLY 94 13.023 5.474 -1.857 710 H MET 95 H MET 95 10.810 3.433 -3.637 711 HA MET 95 HA MET 95 8.660 5.391 -3.566 712 HB2 MET 95 HB2 MET 95 10.435 5.997 -5.352 713 HB3 MET 95 HB3 MET 95 9.850 4.588 -6.225 714 HG2 MET 95 HG2 MET 95 7.634 5.561 -6.342 715 HG3 MET 95 HG3 MET 95 8.181 6.950 -5.407 716 HE1 MET 95 HE1 MET 95 6.742 7.698 -7.977 717 HE2 MET 95 HE2 MET 95 7.874 8.792 -8.769 718 HE3 MET 95 HE3 MET 95 7.642 8.877 -7.023 719 H ILE 96 H ILE 96 6.648 4.417 -3.948 720 HA ILE 96 HA ILE 96 6.667 1.642 -4.940 721 HB ILE 96 HB ILE 96 5.059 0.927 -3.244 722 HG12 ILE 96 HG12 ILE 96 5.533 3.631 -1.948 723 HG13 ILE 96 HG13 ILE 96 4.042 3.134 -2.743 724 HG21 ILE 96 HG21 ILE 96 7.453 0.554 -2.871 725 HG22 ILE 96 HG22 ILE 96 6.591 0.785 -1.350 726 HG23 ILE 96 HG23 ILE 96 7.561 2.097 -2.021 727 HD11 ILE 96 HD11 ILE 96 5.235 1.882 -0.275 728 HD12 ILE 96 HD12 ILE 96 3.743 1.375 -1.070 729 HD13 ILE 96 HD13 ILE 96 3.850 2.973 -0.331 730 H PHE 97 H PHE 97 4.854 0.943 -6.024 731 HA PHE 97 HA PHE 97 3.016 3.087 -6.898 732 HB2 PHE 97 HB2 PHE 97 4.364 2.096 -8.682 733 HB3 PHE 97 HB3 PHE 97 3.806 0.487 -8.245 734 HD1 PHE 97 HD2 PHE 97 2.918 3.643 -9.875 735 HD2 PHE 97 HD1 PHE 97 1.585 -0.274 -8.855 736 HE1 PHE 97 HE2 PHE 97 1.050 3.865 -11.460 737 HE2 PHE 97 HE1 PHE 97 -0.279 -0.056 -10.438 738 HZ PHE 97 HZ PHE 97 -0.551 2.015 -11.743 739 H ILE 98 H ILE 98 0.925 2.982 -6.292 740 HA ILE 98 HA ILE 98 -0.289 0.337 -5.780 741 HB ILE 98 HB ILE 98 -0.874 2.912 -4.286 742 HG12 ILE 98 HG12 ILE 98 0.390 0.305 -3.394 743 HG13 ILE 98 HG13 ILE 98 1.186 1.869 -3.514 744 HG21 ILE 98 HG21 ILE 98 -2.159 0.190 -4.005 745 HG22 ILE 98 HG22 ILE 98 -2.924 1.648 -4.642 746 HG23 ILE 98 HG23 ILE 98 -2.443 1.573 -2.947 747 HD11 ILE 98 HD11 ILE 98 0.698 1.331 -1.212 748 HD12 ILE 98 HD12 ILE 98 -1.012 1.130 -1.590 749 HD13 ILE 98 HD13 ILE 98 -0.260 2.720 -1.722 750 HA PRO 99 HA PRO 99 -3.064 1.624 -9.098 751 HB2 PRO 99 HB2 PRO 99 -4.853 -0.411 -7.857 752 HB3 PRO 99 HB3 PRO 99 -4.314 -0.258 -9.532 753 HG2 PRO 99 HG2 PRO 99 -3.298 -2.146 -7.949 754 HG3 PRO 99 HG3 PRO 99 -2.267 -1.280 -9.107 755 HD2 PRO 99 HD2 PRO 99 -2.516 -0.910 -6.140 756 HD3 PRO 99 HD3 PRO 99 -1.064 -0.870 -7.165 757 H MET 100 H MET 100 -4.799 3.000 -9.261 758 HA MET 100 HA MET 100 -5.554 4.538 -7.043 759 HB2 MET 100 HB2 MET 100 -5.601 5.400 -9.326 760 HB3 MET 100 HB3 MET 100 -6.882 4.277 -9.751 761 HG2 MET 100 HG2 MET 100 -7.905 6.375 -9.471 762 HG3 MET 100 HG3 MET 100 -8.319 5.444 -8.035 763 HE1 MET 100 HE1 MET 100 -7.947 6.261 -5.661 764 HE2 MET 100 HE2 MET 100 -6.576 7.250 -5.166 765 HE3 MET 100 HE3 MET 100 -6.302 5.653 -5.859 766 H GLY 101 H GLY 101 -6.610 3.637 -5.352 767 HA2 GLY 101 HA2 GLY 101 -9.346 2.749 -5.748 768 HA3 GLY 101 HA3 GLY 101 -8.259 1.472 -5.222 769 HA PRO 102 HA PRO 102 -10.205 3.830 -1.570 770 HB2 PRO 102 HB2 PRO 102 -10.797 1.500 -0.184 771 HB3 PRO 102 HB3 PRO 102 -11.928 2.355 -1.240 772 HG2 PRO 102 HG2 PRO 102 -10.207 -0.026 -1.837 773 HG3 PRO 102 HG3 PRO 102 -11.897 0.276 -2.289 774 HD2 PRO 102 HD2 PRO 102 -9.917 0.599 -4.061 775 HD3 PRO 102 HD3 PRO 102 -11.300 1.714 -4.032 776 H TYR 103 H TYR 103 -8.082 1.005 -1.746 777 HA TYR 103 HA TYR 103 -6.774 1.244 0.716 778 HB2 TYR 103 HB2 TYR 103 -5.649 0.281 -1.933 779 HB3 TYR 103 HB3 TYR 103 -4.935 -0.022 -0.353 780 HD1 TYR 103 HD2 TYR 103 -8.078 -0.601 -2.297 781 HD2 TYR 103 HD1 TYR 103 -5.519 -1.964 0.822 782 HE1 TYR 103 HE2 TYR 103 -9.433 -2.640 -2.083 783 HE2 TYR 103 HE1 TYR 103 -6.866 -4.004 1.038 784 HH TYR 103 HH TYR 103 -9.023 -5.048 -1.228 785 H ALA 104 H ALA 104 -5.881 2.590 -2.457 786 HA ALA 104 HA ALA 104 -3.690 4.119 -1.593 787 HB1 ALA 104 HB1 ALA 104 -3.919 5.321 -3.713 788 HB2 ALA 104 HB2 ALA 104 -5.524 4.624 -3.943 789 HB3 ALA 104 HB3 ALA 104 -4.100 3.583 -3.947 790 H ASN 105 H ASN 105 -7.145 4.960 -1.873 791 HA ASN 105 HA ASN 105 -6.908 7.703 -1.285 792 HB2 ASN 105 HB2 ASN 105 -9.194 5.764 -1.002 793 HB3 ASN 105 HB3 ASN 105 -9.360 7.449 -0.531 794 HD21 ASN 105 HD21 ASN 105 -9.138 5.242 -3.156 795 HD22 ASN 105 HD22 ASN 105 -9.429 6.387 -4.410 796 H MET 106 H MET 106 -6.283 5.110 0.765 797 HA MET 106 HA MET 106 -7.021 6.435 3.236 798 HB2 MET 106 HB2 MET 106 -5.341 3.967 2.724 799 HB3 MET 106 HB3 MET 106 -5.869 4.519 4.309 800 HG2 MET 106 HG2 MET 106 -7.760 3.792 2.087 801 HG3 MET 106 HG3 MET 106 -7.210 2.658 3.317 802 HE1 MET 106 HE1 MET 106 -8.133 2.507 5.698 803 HE2 MET 106 HE2 MET 106 -8.839 3.877 6.557 804 HE3 MET 106 HE3 MET 106 -7.167 3.954 5.996 805 H VAL 107 H VAL 107 -4.341 6.501 1.094 806 HA VAL 107 HA VAL 107 -2.660 7.782 3.152 807 HB VAL 107 HB VAL 107 -0.656 6.705 2.150 808 HG11 VAL 107 HG11 VAL 107 -1.671 5.806 4.185 809 HG12 VAL 107 HG12 VAL 107 -0.980 4.521 3.199 810 HG13 VAL 107 HG13 VAL 107 -2.725 4.776 3.217 811 HG21 VAL 107 HG21 VAL 107 -0.933 4.741 0.709 812 HG22 VAL 107 HG22 VAL 107 -1.576 6.191 -0.063 813 HG23 VAL 107 HG23 VAL 107 -2.675 5.016 0.660 814 H ILE 108 H ILE 108 -3.968 8.034 0.020 815 HA ILE 108 HA ILE 108 -1.834 9.816 -0.902 816 HB ILE 108 HB ILE 108 -2.727 9.732 -3.068 817 HG12 ILE 108 HG12 ILE 108 -5.136 8.168 -2.145 818 HG13 ILE 108 HG13 ILE 108 -5.159 9.928 -2.231 819 HG21 ILE 108 HG21 ILE 108 -2.869 7.026 -1.746 820 HG22 ILE 108 HG22 ILE 108 -1.508 7.750 -2.604 821 HG23 ILE 108 HG23 ILE 108 -2.949 7.251 -3.493 822 HD11 ILE 108 HD11 ILE 108 -6.090 9.048 -4.226 823 HD12 ILE 108 HD12 ILE 108 -4.688 8.006 -4.476 824 HD13 ILE 108 HD13 ILE 108 -4.515 9.758 -4.605 825 H ASP 109 H ASP 109 -2.862 11.686 -2.373 826 HA ASP 109 HA ASP 109 -4.366 13.370 -0.529 827 HB2 ASP 109 HB2 ASP 109 -2.320 14.279 -1.505 828 HB3 ASP 109 HB3 ASP 109 -2.948 14.015 -3.131 829 HA PRO 110 HA PRO 110 -7.969 12.443 -3.146 830 HB2 PRO 110 HB2 PRO 110 -9.862 13.002 -1.329 831 HB3 PRO 110 HB3 PRO 110 -8.882 11.534 -1.218 832 HG2 PRO 110 HG2 PRO 110 -8.589 14.123 0.269 833 HG3 PRO 110 HG3 PRO 110 -8.469 12.463 0.883 834 HD2 PRO 110 HD2 PRO 110 -6.298 14.031 0.233 835 HD3 PRO 110 HD3 PRO 110 -6.279 12.256 0.228 836 H SER 111 H SER 111 -6.659 15.367 -2.303 837 HA SER 111 HA SER 111 -8.892 17.108 -2.785 838 HB2 SER 111 HB2 SER 111 -6.974 17.902 -1.478 839 HB3 SER 111 HB3 SER 111 -5.920 17.709 -2.877 840 HG SER 111 HG SER 111 -6.448 19.742 -3.162 841 H THR 112 H THR 112 -6.286 15.782 -4.770 842 HA THR 112 HA THR 112 -7.163 17.179 -7.158 843 HB THR 112 HB THR 112 -4.802 16.689 -7.001 844 HG1 THR 112 HG1 THR 112 -4.807 16.356 -9.088 845 HG21 THR 112 HG21 THR 112 -4.902 14.694 -5.576 846 HG22 THR 112 HG22 THR 112 -3.936 14.391 -7.019 847 HG23 THR 112 HG23 THR 112 -5.581 13.763 -6.913 848 H ASP 113 H ASP 113 -7.981 16.164 -9.063 849 HA ASP 113 HA ASP 113 -9.496 13.678 -8.537 850 HB2 ASP 113 HB2 ASP 113 -10.036 15.710 -10.718 851 HB3 ASP 113 HB3 ASP 113 -11.083 14.392 -10.200 852 H GLY 114 H GLY 114 -6.668 14.534 -9.882 853 HA2 GLY 114 HA2 GLY 114 -5.284 13.675 -11.505 854 HA3 GLY 114 HA3 GLY 114 -6.304 12.245 -11.466 855 H THR 115 H THR 115 -6.885 15.601 -12.523 856 HA THR 115 HA THR 115 -8.198 14.574 -14.939 857 HB THR 115 HB THR 115 -8.208 17.377 -13.773 858 HG1 THR 115 HG1 THR 115 -9.956 16.781 -12.701 859 HG21 THR 115 HG21 THR 115 -8.603 17.386 -16.198 860 HG22 THR 115 HG22 THR 115 -10.072 17.803 -15.316 861 HG23 THR 115 HG23 THR 115 -9.881 16.187 -15.999 862 H GLY 116 H GLY 116 -7.491 14.995 -16.997 863 HA2 GLY 116 HA2 GLY 116 -6.549 16.493 -18.606 864 HA3 GLY 116 HA3 GLY 116 -5.463 17.102 -17.373 865 H MET 117 H MET 117 -3.414 16.526 -17.635 866 HA MET 117 HA MET 117 -2.758 14.516 -19.617 867 HB2 MET 117 HB2 MET 117 -1.049 16.491 -18.090 868 HB3 MET 117 HB3 MET 117 -0.415 15.370 -19.293 869 HG2 MET 117 HG2 MET 117 -2.481 17.509 -19.781 870 HG3 MET 117 HG3 MET 117 -0.782 17.570 -20.257 871 HE1 MET 117 HE1 MET 117 -3.613 17.797 -22.057 872 HE2 MET 117 HE2 MET 117 -3.038 17.053 -23.549 873 HE3 MET 117 HE3 MET 117 -2.018 18.207 -22.690 874 HA PRO 118 HA PRO 118 -1.783 11.309 -16.770 875 HB2 PRO 118 HB2 PRO 118 -0.285 9.702 -18.345 876 HB3 PRO 118 HB3 PRO 118 -2.021 9.919 -18.588 877 HG2 PRO 118 HG2 PRO 118 0.269 11.143 -20.071 878 HG3 PRO 118 HG3 PRO 118 -1.281 10.550 -20.692 879 HD2 PRO 118 HD2 PRO 118 -0.693 13.209 -20.219 880 HD3 PRO 118 HD3 PRO 118 -2.336 12.543 -20.273 881 H GLN 119 H GLN 119 -0.514 12.368 -15.204 882 HA GLN 119 HA GLN 119 2.377 12.486 -15.563 883 HB2 GLN 119 HB2 GLN 119 0.623 13.201 -13.194 884 HB3 GLN 119 HB3 GLN 119 2.364 13.438 -13.256 885 HG2 GLN 119 HG2 GLN 119 2.128 15.032 -15.060 886 HG3 GLN 119 HG3 GLN 119 0.392 14.737 -15.133 887 HE21 GLN 119 HE21 GLN 119 1.867 17.226 -14.626 888 HE22 GLN 119 HE22 GLN 119 1.295 17.806 -13.105 889 H PHE 120 H PHE 120 3.613 11.752 -13.433 890 HA PHE 120 HA PHE 120 2.709 9.030 -12.724 891 HB2 PHE 120 HB2 PHE 120 4.683 9.428 -14.513 892 HB3 PHE 120 HB3 PHE 120 5.638 9.517 -13.037 893 HD1 PHE 120 HD2 PHE 120 3.278 7.398 -14.933 894 HD2 PHE 120 HD1 PHE 120 6.259 7.544 -11.890 895 HE1 PHE 120 HE2 PHE 120 3.323 4.932 -14.856 896 HE2 PHE 120 HE1 PHE 120 6.311 5.084 -11.813 897 HZ PHE 120 HZ PHE 120 4.841 3.775 -13.296 898 H LYS 121 H LYS 121 2.803 11.759 -11.378 899 HA LYS 121 HA LYS 121 4.719 11.444 -9.224 900 HB2 LYS 121 HB2 LYS 121 4.142 13.671 -10.196 901 HB3 LYS 121 HB3 LYS 121 2.512 13.494 -9.563 902 HG2 LYS 121 HG2 LYS 121 3.753 14.919 -8.097 903 HG3 LYS 121 HG3 LYS 121 3.463 13.387 -7.270 904 HD2 LYS 121 HD2 LYS 121 5.753 12.659 -7.911 905 HD3 LYS 121 HD3 LYS 121 6.026 14.249 -8.626 906 HE2 LYS 121 HE2 LYS 121 6.995 14.130 -6.391 907 HE3 LYS 121 HE3 LYS 121 5.668 15.292 -6.431 908 HZ1 LYS 121 HZ1 LYS 121 5.413 12.491 -5.473 909 HZ2 LYS 121 HZ2 LYS 121 4.233 13.701 -5.389 910 HZ3 LYS 121 HZ3 LYS 121 5.641 13.829 -4.464 911 H GLY 122 H GLY 122 4.281 10.871 -7.118 912 HA2 GLY 122 HA2 GLY 122 1.480 10.179 -6.457 913 HA3 GLY 122 HA3 GLY 122 2.820 9.124 -6.036 914 H VAL 123 H VAL 123 1.400 9.627 -3.963 915 HA VAL 123 HA VAL 123 2.337 12.040 -2.571 916 HB VAL 123 HB VAL 123 0.371 9.914 -1.690 917 HG11 VAL 123 HG11 VAL 123 -0.220 11.471 0.128 918 HG12 VAL 123 HG12 VAL 123 1.098 12.533 -0.365 919 HG13 VAL 123 HG13 VAL 123 1.451 10.919 0.250 920 HG21 VAL 123 HG21 VAL 123 -1.318 11.682 -2.068 921 HG22 VAL 123 HG22 VAL 123 -0.480 11.216 -3.546 922 HG23 VAL 123 HG23 VAL 123 -0.056 12.722 -2.729 923 H LYS 124 H LYS 124 4.031 12.018 -1.213 924 HA LYS 124 HA LYS 124 5.467 9.583 -0.722 925 HB2 LYS 124 HB2 LYS 124 5.973 12.387 0.300 926 HB3 LYS 124 HB3 LYS 124 7.085 11.032 0.465 927 HG2 LYS 124 HG2 LYS 124 7.125 10.872 -2.039 928 HG3 LYS 124 HG3 LYS 124 6.203 12.373 -2.085 929 HD2 LYS 124 HD2 LYS 124 8.901 12.056 -0.759 930 HD3 LYS 124 HD3 LYS 124 8.657 12.684 -2.388 931 HE2 LYS 124 HE2 LYS 124 7.295 14.517 -1.448 932 HE3 LYS 124 HE3 LYS 124 7.606 13.895 0.173 933 HZ1 LYS 124 HZ1 LYS 124 9.083 15.735 -0.452 934 HZ2 LYS 124 HZ2 LYS 124 9.711 14.804 -1.715 935 HZ3 LYS 124 HZ3 LYS 124 9.938 14.318 -0.112 936 H GLY 125 H GLY 125 5.941 8.587 1.231 937 HA2 GLY 125 HA2 GLY 125 4.920 9.431 3.761 938 HA3 GLY 125 HA3 GLY 125 3.922 8.166 3.061 939 H THR 126 H THR 126 4.544 6.836 4.904 940 HA THR 126 HA THR 126 7.233 5.637 4.589 941 HB THR 126 HB THR 126 7.185 5.099 7.035 942 HG1 THR 126 HG1 THR 126 4.870 6.768 6.947 943 HG21 THR 126 HG21 THR 126 7.755 7.369 7.812 944 HG22 THR 126 HG22 THR 126 7.042 8.045 6.347 945 HG23 THR 126 HG23 THR 126 8.473 7.018 6.239 946 H VAL 127 H VAL 127 7.358 3.425 4.527 947 HA VAL 127 HA VAL 127 4.854 1.913 4.993 948 HB VAL 127 HB VAL 127 5.283 2.136 2.576 949 HG11 VAL 127 HG11 VAL 127 7.214 1.050 1.534 950 HG12 VAL 127 HG12 VAL 127 7.856 0.651 3.126 951 HG13 VAL 127 HG13 VAL 127 7.720 2.338 2.630 952 HG21 VAL 127 HG21 VAL 127 4.162 0.128 3.449 953 HG22 VAL 127 HG22 VAL 127 5.724 -0.685 3.573 954 HG23 VAL 127 HG23 VAL 127 5.092 -0.221 1.992 955 H GLU 128 H GLU 128 5.021 -0.058 5.996 956 HA GLU 128 HA GLU 128 7.580 -1.388 6.292 957 HB2 GLU 128 HB2 GLU 128 7.458 -1.531 8.757 958 HB3 GLU 128 HB3 GLU 128 7.671 0.123 8.201 959 HG2 GLU 128 HG2 GLU 128 5.377 0.640 8.622 960 HG3 GLU 128 HG3 GLU 128 5.006 -1.050 8.967 961 H LYS 129 H LYS 129 7.378 -3.565 7.143 962 HA LYS 129 HA LYS 129 4.983 -4.867 6.276 963 HB2 LYS 129 HB2 LYS 129 7.123 -5.964 5.992 964 HB3 LYS 129 HB3 LYS 129 7.424 -5.915 7.723 965 HG2 LYS 129 HG2 LYS 129 5.785 -7.555 8.164 966 HG3 LYS 129 HG3 LYS 129 5.095 -7.414 6.546 967 HD2 LYS 129 HD2 LYS 129 6.457 -9.461 6.845 968 HD3 LYS 129 HD3 LYS 129 7.069 -8.412 5.565 969 HE2 LYS 129 HE2 LYS 129 8.913 -9.266 6.904 970 HE3 LYS 129 HE3 LYS 129 8.760 -7.524 7.119 971 HZ1 LYS 129 HZ1 LYS 129 7.670 -9.553 9.001 972 HZ2 LYS 129 HZ2 LYS 129 7.689 -7.876 9.228 973 HZ3 LYS 129 HZ3 LYS 129 9.139 -8.743 9.211 974 H THR 130 H THR 130 3.388 -5.912 7.484 975 HA THR 130 HA THR 130 3.359 -5.343 10.385 976 HB THR 130 HB THR 130 2.010 -3.590 9.366 977 HG1 THR 130 HG1 THR 130 0.806 -3.900 11.068 978 HG21 THR 130 HG21 THR 130 0.372 -5.830 8.153 979 HG22 THR 130 HG22 THR 130 1.417 -4.719 7.264 980 HG23 THR 130 HG23 THR 130 -0.021 -4.112 8.087 981 H ASP 131 H ASP 131 1.771 -6.581 11.592 982 HA ASP 131 HA ASP 131 1.560 -9.312 10.577 983 HB2 ASP 131 HB2 ASP 131 0.924 -8.241 13.341 984 HB3 ASP 131 HB3 ASP 131 1.106 -9.934 12.882 985 H GLU 132 H GLU 132 -0.363 -6.554 10.762 986 HA GLU 132 HA GLU 132 -2.907 -7.638 11.385 987 HB2 GLU 132 HB2 GLU 132 -2.223 -5.212 9.707 988 HB3 GLU 132 HB3 GLU 132 -3.810 -5.582 10.369 989 HG2 GLU 132 HG2 GLU 132 -2.834 -5.446 12.645 990 HG3 GLU 132 HG3 GLU 132 -1.312 -4.940 11.911 991 H LYS 133 H LYS 133 -4.768 -7.645 9.813 992 HA LYS 133 HA LYS 133 -4.064 -9.161 7.438 993 HB2 LYS 133 HB2 LYS 133 -6.541 -9.466 7.195 994 HB3 LYS 133 HB3 LYS 133 -5.888 -10.059 8.710 995 HG2 LYS 133 HG2 LYS 133 -7.906 -9.020 9.292 996 HG3 LYS 133 HG3 LYS 133 -6.659 -7.858 9.741 997 HD2 LYS 133 HD2 LYS 133 -7.106 -6.540 7.762 998 HD3 LYS 133 HD3 LYS 133 -8.230 -7.755 7.157 999 HE2 LYS 133 HE2 LYS 133 -8.609 -6.189 9.713 1000 HE3 LYS 133 HE3 LYS 133 -9.341 -5.770 8.165 1001 HZ1 LYS 133 HZ1 LYS 133 -10.415 -7.995 8.201 1002 HZ2 LYS 133 HZ2 LYS 133 -10.931 -6.970 9.439 1003 HZ3 LYS 133 HZ3 LYS 133 -9.838 -8.215 9.778 1004 H VAL 134 H VAL 134 -4.732 -8.603 5.302 1005 HA VAL 134 HA VAL 134 -4.472 -5.882 4.593 1006 HB VAL 134 HB VAL 134 -5.600 -8.200 2.998 1007 HG11 VAL 134 HG11 VAL 134 -4.736 -5.471 2.024 1008 HG12 VAL 134 HG12 VAL 134 -6.390 -6.085 2.060 1009 HG13 VAL 134 HG13 VAL 134 -5.193 -6.829 0.999 1010 HG21 VAL 134 HG21 VAL 134 -3.376 -8.238 1.947 1011 HG22 VAL 134 HG22 VAL 134 -3.280 -8.520 3.685 1012 HG23 VAL 134 HG23 VAL 134 -2.849 -6.943 3.023 1013 H LEU 135 H LEU 135 -5.939 -4.254 4.460 1014 HA LEU 135 HA LEU 135 -8.545 -4.600 5.528 1015 HB2 LEU 135 HB2 LEU 135 -7.020 -2.322 4.394 1016 HB3 LEU 135 HB3 LEU 135 -8.767 -2.172 4.382 1017 HG LEU 135 HG LEU 135 -6.970 -2.495 6.789 1018 HD11 LEU 135 HD11 LEU 135 -7.973 -0.366 7.447 1019 HD12 LEU 135 HD12 LEU 135 -8.916 -0.347 5.955 1020 HD13 LEU 135 HD13 LEU 135 -7.156 -0.240 5.890 1021 HD21 LEU 135 HD21 LEU 135 -9.989 -2.643 6.635 1022 HD22 LEU 135 HD22 LEU 135 -9.068 -2.431 8.129 1023 HD23 LEU 135 HD23 LEU 135 -8.883 -3.906 7.181 1024 H SER 136 H SER 136 -9.649 -6.095 4.311 1025 HA SER 136 HA SER 136 -9.994 -6.260 1.588 1026 HB2 SER 136 HB2 SER 136 -12.163 -6.727 3.659 1027 HB3 SER 136 HB3 SER 136 -12.114 -7.406 2.032 1028 HG SER 136 HG SER 136 -10.691 -8.853 2.666 1029 H VAL 137 H VAL 137 -11.565 -5.452 0.106 1030 HA VAL 137 HA VAL 137 -11.851 -2.746 -0.013 1031 HB VAL 137 HB VAL 137 -13.722 -4.807 -1.205 1032 HG11 VAL 137 HG11 VAL 137 -14.299 -3.063 -2.857 1033 HG12 VAL 137 HG12 VAL 137 -13.378 -1.891 -1.913 1034 HG13 VAL 137 HG13 VAL 137 -14.817 -2.643 -1.224 1035 HG21 VAL 137 HG21 VAL 137 -11.399 -5.105 -1.881 1036 HG22 VAL 137 HG22 VAL 137 -11.300 -3.409 -2.355 1037 HG23 VAL 137 HG23 VAL 137 -12.361 -4.510 -3.234 1038 H LYS 138 H LYS 138 -14.287 -4.996 1.268 1039 HA LYS 138 HA LYS 138 -16.170 -2.964 1.971 1040 HB2 LYS 138 HB2 LYS 138 -16.855 -5.271 1.557 1041 HB3 LYS 138 HB3 LYS 138 -15.897 -5.827 2.919 1042 HG2 LYS 138 HG2 LYS 138 -17.346 -4.487 4.429 1043 HG3 LYS 138 HG3 LYS 138 -18.350 -4.075 3.037 1044 HD2 LYS 138 HD2 LYS 138 -17.811 -6.863 4.080 1045 HD3 LYS 138 HD3 LYS 138 -19.307 -5.951 4.292 1046 HE2 LYS 138 HE2 LYS 138 -19.772 -6.024 1.948 1047 HE3 LYS 138 HE3 LYS 138 -18.169 -6.664 1.589 1048 HZ1 LYS 138 HZ1 LYS 138 -20.264 -8.087 3.138 1049 HZ2 LYS 138 HZ2 LYS 138 -18.744 -8.697 2.722 1050 HZ3 LYS 138 HZ3 LYS 138 -19.884 -8.373 1.514 1051 H GLU 139 H GLU 139 -13.703 -4.753 3.830 1052 HA GLU 139 HA GLU 139 -14.372 -3.771 6.381 1053 HB2 GLU 139 HB2 GLU 139 -12.876 -5.718 5.951 1054 HB3 GLU 139 HB3 GLU 139 -11.645 -4.613 5.356 1055 HG2 GLU 139 HG2 GLU 139 -10.989 -5.080 7.538 1056 HG3 GLU 139 HG3 GLU 139 -11.765 -3.502 7.654 1057 H LEU 140 H LEU 140 -12.405 -2.495 3.797 1058 HA LEU 140 HA LEU 140 -11.218 -0.329 5.147 1059 HB2 LEU 140 HB2 LEU 140 -10.868 -1.458 2.769 1060 HB3 LEU 140 HB3 LEU 140 -11.925 -0.156 2.252 1061 HG LEU 140 HG LEU 140 -9.469 0.403 3.885 1062 HD11 LEU 140 HD11 LEU 140 -9.602 0.146 0.886 1063 HD12 LEU 140 HD12 LEU 140 -8.725 -0.912 1.992 1064 HD13 LEU 140 HD13 LEU 140 -8.235 0.772 1.811 1065 HD21 LEU 140 HD21 LEU 140 -11.077 2.212 3.649 1066 HD22 LEU 140 HD22 LEU 140 -11.034 2.046 1.892 1067 HD23 LEU 140 HD23 LEU 140 -9.596 2.576 2.765 1068 H LEU 141 H LEU 141 -14.310 -0.684 3.424 1069 HA LEU 141 HA LEU 141 -15.191 1.990 3.558 1070 HB2 LEU 141 HB2 LEU 141 -16.986 -0.425 3.861 1071 HB3 LEU 141 HB3 LEU 141 -17.414 1.150 3.223 1072 HG LEU 141 HG LEU 141 -15.647 -0.910 1.895 1073 HD11 LEU 141 HD11 LEU 141 -18.016 -1.467 1.824 1074 HD12 LEU 141 HD12 LEU 141 -17.421 -1.022 0.224 1075 HD13 LEU 141 HD13 LEU 141 -18.381 0.127 1.157 1076 HD21 LEU 141 HD21 LEU 141 -14.809 1.306 1.387 1077 HD22 LEU 141 HD22 LEU 141 -16.429 1.843 0.938 1078 HD23 LEU 141 HD23 LEU 141 -15.607 0.615 -0.025 1079 H GLU 142 H GLU 142 -15.548 -0.711 5.810 1080 HA GLU 142 HA GLU 142 -16.952 0.683 7.841 1081 HB2 GLU 142 HB2 GLU 142 -15.174 -1.754 8.083 1082 HB3 GLU 142 HB3 GLU 142 -16.420 -1.256 9.221 1083 HG2 GLU 142 HG2 GLU 142 -16.900 -2.076 6.361 1084 HG3 GLU 142 HG3 GLU 142 -17.134 -3.106 7.767 1085 H ALA 143 H ALA 143 -13.523 0.126 7.231 1086 HA ALA 143 HA ALA 143 -12.461 1.088 9.638 1087 HB1 ALA 143 HB1 ALA 143 -11.211 1.275 6.891 1088 HB2 ALA 143 HB2 ALA 143 -11.151 -0.136 7.948 1089 HB3 ALA 143 HB3 ALA 143 -10.367 1.366 8.437 1090 H ILE 144 H ILE 144 -13.120 2.853 6.592 1091 HA ILE 144 HA ILE 144 -12.471 5.390 7.805 1092 HB ILE 144 HB ILE 144 -13.244 6.399 5.674 1093 HG12 ILE 144 HG12 ILE 144 -13.487 4.529 3.788 1094 HG13 ILE 144 HG13 ILE 144 -14.103 3.577 5.133 1095 HG21 ILE 144 HG21 ILE 144 -10.927 5.712 5.988 1096 HG22 ILE 144 HG22 ILE 144 -11.425 5.502 4.309 1097 HG23 ILE 144 HG23 ILE 144 -11.310 4.101 5.377 1098 HD11 ILE 144 HD11 ILE 144 -15.893 4.622 3.875 1099 HD12 ILE 144 HD12 ILE 144 -15.201 6.216 4.188 1100 HD13 ILE 144 HD13 ILE 144 -15.832 5.249 5.524 1101 H GLY 145 H GLY 145 -15.338 3.481 7.381 1102 HA2 GLY 145 HA2 GLY 145 -17.359 3.625 8.461 1103 HA3 GLY 145 HA3 GLY 145 -16.680 4.926 9.419 1104 H SER 146 H SER 146 -17.450 4.646 5.929 1105 HA SER 146 HA SER 146 -19.705 6.411 6.122 1106 HB2 SER 146 HB2 SER 146 -17.903 8.083 6.359 1107 HB3 SER 146 HB3 SER 146 -17.188 7.530 4.845 1108 HG SER 146 HG SER 146 -18.804 9.448 4.985 Start of MODEL 13 1 H1 MET 1 H1 MET 1 -44.257 -32.438 21.483 2 H2 MET 1 H2 MET 1 -43.908 -33.984 20.892 3 H3 MET 1 H3 MET 1 -43.934 -32.664 19.835 4 HA MET 1 HA MET 1 -42.026 -33.073 22.065 5 HB2 MET 1 HB2 MET 1 -40.336 -33.343 20.244 6 HB3 MET 1 HB3 MET 1 -41.530 -34.629 20.304 7 HG2 MET 1 HG2 MET 1 -41.616 -32.299 18.399 8 HG3 MET 1 HG3 MET 1 -40.996 -33.901 18.011 9 HE1 MET 1 HE1 MET 1 -43.271 -32.465 16.283 10 HE2 MET 1 HE2 MET 1 -44.368 -33.820 16.024 11 HE3 MET 1 HE3 MET 1 -42.626 -34.068 15.928 12 H GLY 2 H GLY 2 -40.011 -31.642 21.631 13 HA2 GLY 2 HA2 GLY 2 -40.072 -29.244 20.235 14 HA3 GLY 2 HA3 GLY 2 -40.863 -28.922 21.771 15 H SER 3 H SER 3 -37.847 -29.685 20.197 16 HA SER 3 HA SER 3 -36.238 -30.175 22.458 17 HB2 SER 3 HB2 SER 3 -34.318 -29.714 20.962 18 HB3 SER 3 HB3 SER 3 -35.503 -30.777 20.204 19 HG SER 3 HG SER 3 -35.254 -27.969 19.782 20 H SER 4 H SER 4 -36.049 -28.798 24.106 21 HA SER 4 HA SER 4 -35.682 -25.917 23.541 22 HB2 SER 4 HB2 SER 4 -36.795 -27.237 26.036 23 HB3 SER 4 HB3 SER 4 -36.584 -25.500 25.809 24 HG SER 4 HG SER 4 -38.127 -27.037 24.004 25 H HIS 5 H HIS 5 -33.830 -24.955 24.166 26 HA HIS 5 HA HIS 5 -32.340 -25.931 26.467 27 HB2 HIS 5 HB2 HIS 5 -31.255 -26.022 23.665 28 HB3 HIS 5 HB3 HIS 5 -30.163 -25.702 25.008 29 HD1 HIS 5 HD1 HIS 5 -31.140 -28.407 23.036 30 HD2 HIS 5 HD2 HIS 5 -30.716 -27.891 27.132 31 HE1 HIS 5 HE1 HIS 5 -30.863 -30.715 23.976 32 HE2 HIS 5 HE2 HIS 5 -30.382 -30.349 26.416 33 H HIS 6 H HIS 6 -30.690 -24.407 27.206 34 HA HIS 6 HA HIS 6 -30.838 -21.708 26.065 35 HB2 HIS 6 HB2 HIS 6 -31.568 -22.396 28.920 36 HB3 HIS 6 HB3 HIS 6 -31.173 -20.760 28.395 37 HD1 HIS 6 HD1 HIS 6 -33.911 -23.226 28.474 38 HD2 HIS 6 HD2 HIS 6 -33.074 -19.647 26.533 39 HE1 HIS 6 HE1 HIS 6 -36.093 -22.450 27.520 40 HE2 HIS 6 HE2 HIS 6 -35.529 -20.380 26.214 41 H HIS 7 H HIS 7 -28.911 -20.742 26.008 42 HA HIS 7 HA HIS 7 -26.736 -21.665 27.756 43 HB2 HIS 7 HB2 HIS 7 -25.278 -21.756 25.614 44 HB3 HIS 7 HB3 HIS 7 -26.352 -23.108 25.955 45 HD1 HIS 7 HD1 HIS 7 -26.618 -19.848 23.990 46 HD2 HIS 7 HD2 HIS 7 -27.757 -23.834 23.762 47 HE1 HIS 7 HE1 HIS 7 -27.794 -20.083 21.788 48 HE2 HIS 7 HE2 HIS 7 -28.672 -22.435 21.793 49 H HIS 8 H HIS 8 -25.358 -20.087 28.368 50 HA HIS 8 HA HIS 8 -25.758 -17.384 27.319 51 HB2 HIS 8 HB2 HIS 8 -24.377 -16.671 29.253 52 HB3 HIS 8 HB3 HIS 8 -25.772 -17.626 29.738 53 HD1 HIS 8 HD1 HIS 8 -25.319 -19.726 31.082 54 HD2 HIS 8 HD2 HIS 8 -21.868 -18.049 29.486 55 HE1 HIS 8 HE1 HIS 8 -23.413 -20.982 32.127 56 HE2 HIS 8 HE2 HIS 8 -21.340 -19.841 31.269 57 H HIS 9 H HIS 9 -23.624 -15.995 27.256 58 HA HIS 9 HA HIS 9 -21.381 -17.500 26.102 59 HB2 HIS 9 HB2 HIS 9 -22.834 -15.266 24.669 60 HB3 HIS 9 HB3 HIS 9 -21.268 -15.897 24.177 61 HD1 HIS 9 HD1 HIS 9 -24.850 -16.437 23.778 62 HD2 HIS 9 HD2 HIS 9 -21.388 -18.678 23.319 63 HE1 HIS 9 HE1 HIS 9 -25.508 -18.400 22.369 64 HE2 HIS 9 HE2 HIS 9 -23.342 -19.588 21.900 65 H HIS 10 H HIS 10 -19.413 -16.647 26.476 66 HA HIS 10 HA HIS 10 -19.176 -13.784 27.142 67 HB2 HIS 10 HB2 HIS 10 -17.727 -16.078 28.496 68 HB3 HIS 10 HB3 HIS 10 -17.267 -14.388 28.672 69 HD1 HIS 10 HD1 HIS 10 -18.916 -12.842 30.015 70 HD2 HIS 10 HD2 HIS 10 -19.919 -16.878 30.010 71 HE1 HIS 10 HE1 HIS 10 -20.627 -13.116 31.829 72 HE2 HIS 10 HE2 HIS 10 -21.159 -15.573 31.866 73 H SER 11 H SER 11 -18.061 -12.824 25.557 74 HA SER 11 HA SER 11 -16.976 -14.314 23.430 75 HB2 SER 11 HB2 SER 11 -16.766 -11.359 24.019 76 HB3 SER 11 HB3 SER 11 -16.316 -12.108 22.487 77 HG SER 11 HG SER 11 -18.407 -11.398 22.271 78 H SER 12 H SER 12 -15.096 -11.872 25.289 79 HA SER 12 HA SER 12 -12.886 -11.722 25.806 80 HB2 SER 12 HB2 SER 12 -13.093 -13.897 26.912 81 HB3 SER 12 HB3 SER 12 -12.834 -14.725 25.378 82 HG SER 12 HG SER 12 -10.790 -14.608 25.827 83 H GLY 13 H GLY 13 -11.930 -10.521 24.257 84 HA2 GLY 13 HA2 GLY 13 -10.635 -11.910 22.020 85 HA3 GLY 13 HA3 GLY 13 -11.801 -10.661 21.610 86 H ARG 14 H ARG 14 -8.676 -11.304 23.088 87 HA ARG 14 HA ARG 14 -8.109 -8.461 23.408 88 HB2 ARG 14 HB2 ARG 14 -7.443 -10.108 25.160 89 HB3 ARG 14 HB3 ARG 14 -6.341 -10.845 24.008 90 HG2 ARG 14 HG2 ARG 14 -5.033 -8.810 23.895 91 HG3 ARG 14 HG3 ARG 14 -6.173 -7.987 24.959 92 HD2 ARG 14 HD2 ARG 14 -5.619 -9.555 26.764 93 HD3 ARG 14 HD3 ARG 14 -4.492 -10.391 25.694 94 HE ARG 14 HE ARG 14 -3.805 -7.668 25.813 95 HH11 ARG 14 HH11 ARG 14 -3.847 -10.444 27.847 96 HH12 ARG 14 HH12 ARG 14 -2.451 -9.948 28.737 97 HH21 ARG 14 HH21 ARG 14 -2.050 -7.010 26.986 98 HH22 ARG 14 HH22 ARG 14 -1.444 -8.012 28.260 99 H GLU 15 H GLU 15 -6.590 -7.306 22.259 100 HA GLU 15 HA GLU 15 -5.844 -8.405 19.656 101 HB2 GLU 15 HB2 GLU 15 -5.206 -6.018 19.161 102 HB3 GLU 15 HB3 GLU 15 -6.902 -6.273 19.557 103 HG2 GLU 15 HG2 GLU 15 -6.463 -5.501 21.854 104 HG3 GLU 15 HG3 GLU 15 -4.783 -5.197 21.413 105 H ASN 16 H ASN 16 -3.723 -8.343 18.796 106 HA ASN 16 HA ASN 16 -1.594 -8.394 20.847 107 HB2 ASN 16 HB2 ASN 16 -0.385 -9.903 19.240 108 HB3 ASN 16 HB3 ASN 16 -1.889 -10.566 19.868 109 HD21 ASN 16 HD21 ASN 16 -0.281 -9.292 17.057 110 HD22 ASN 16 HD22 ASN 16 -1.465 -9.796 15.908 111 H LEU 17 H LEU 17 -0.309 -6.638 20.818 112 HA LEU 17 HA LEU 17 0.433 -5.483 18.200 113 HB2 LEU 17 HB2 LEU 17 -0.071 -4.082 20.811 114 HB3 LEU 17 HB3 LEU 17 0.815 -3.333 19.493 115 HG LEU 17 HG LEU 17 -1.258 -3.847 18.052 116 HD11 LEU 17 HD11 LEU 17 -2.353 -5.372 19.605 117 HD12 LEU 17 HD12 LEU 17 -3.375 -3.987 19.230 118 HD13 LEU 17 HD13 LEU 17 -2.530 -4.066 20.777 119 HD21 LEU 17 HD21 LEU 17 -0.583 -1.612 18.707 120 HD22 LEU 17 HD22 LEU 17 -1.426 -1.790 20.247 121 HD23 LEU 17 HD23 LEU 17 -2.337 -1.773 18.736 122 H TYR 18 H TYR 18 2.528 -4.313 18.196 123 HA TYR 18 HA TYR 18 4.532 -5.458 20.032 124 HB2 TYR 18 HB2 TYR 18 4.823 -5.291 17.014 125 HB3 TYR 18 HB3 TYR 18 6.056 -5.849 18.138 126 HD1 TYR 18 HD1 TYR 18 2.849 -6.680 16.532 127 HD2 TYR 18 HD2 TYR 18 5.951 -8.073 19.100 128 HE1 TYR 18 HE1 TYR 18 1.988 -8.970 16.324 129 HE2 TYR 18 HE2 TYR 18 5.089 -10.368 18.902 130 HH TYR 18 HH TYR 18 2.619 -11.208 16.605 131 H PHE 19 H PHE 19 6.701 -4.262 19.786 132 HA PHE 19 HA PHE 19 6.160 -1.386 19.445 133 HB2 PHE 19 HB2 PHE 19 8.135 -2.895 21.136 134 HB3 PHE 19 HB3 PHE 19 8.416 -1.203 20.733 135 HD1 PHE 19 HD2 PHE 19 6.278 -3.540 22.593 136 HD2 PHE 19 HD1 PHE 19 7.025 0.548 21.641 137 HE1 PHE 19 HE2 PHE 19 4.793 -2.839 24.424 138 HE2 PHE 19 HE1 PHE 19 5.540 1.247 23.471 139 HZ PHE 19 HZ PHE 19 4.423 -0.447 24.862 140 H GLN 20 H GLN 20 6.679 -0.632 17.545 141 HA GLN 20 HA GLN 20 7.892 0.088 15.797 142 HB2 GLN 20 HB2 GLN 20 10.096 -0.878 17.567 143 HB3 GLN 20 HB3 GLN 20 10.474 -0.438 15.907 144 HG2 GLN 20 HG2 GLN 20 10.871 1.446 17.311 145 HG3 GLN 20 HG3 GLN 20 9.465 1.773 16.298 146 HE21 GLN 20 HE21 GLN 20 7.416 1.867 17.260 147 HE22 GLN 20 HE22 GLN 20 7.218 2.043 18.967 148 H GLY 21 H GLY 21 9.076 -0.505 13.907 149 HA2 GLY 21 HA2 GLY 21 9.735 -3.235 13.361 150 HA3 GLY 21 HA3 GLY 21 8.252 -2.725 12.564 151 H HIS 22 H HIS 22 10.346 -3.501 10.968 152 HA HIS 22 HA HIS 22 12.040 -1.255 10.325 153 HB2 HIS 22 HB2 HIS 22 12.670 -3.723 10.067 154 HB3 HIS 22 HB3 HIS 22 11.667 -3.725 8.619 155 HD1 HIS 22 HD1 HIS 22 15.047 -3.193 9.677 156 HD2 HIS 22 HD2 HIS 22 12.627 -1.623 6.691 157 HE1 HIS 22 HE1 HIS 22 16.615 -2.132 8.036 158 HE2 HIS 22 HE2 HIS 22 15.121 -1.031 6.343 159 H MET 23 H MET 23 10.970 0.484 9.519 160 HA MET 23 HA MET 23 9.269 0.068 7.141 161 HB2 MET 23 HB2 MET 23 8.294 2.259 7.573 162 HB3 MET 23 HB3 MET 23 8.110 1.208 8.970 163 HG2 MET 23 HG2 MET 23 9.711 2.376 10.209 164 HG3 MET 23 HG3 MET 23 10.371 3.168 8.778 165 HE1 MET 23 HE1 MET 23 6.947 2.722 10.682 166 HE2 MET 23 HE2 MET 23 6.515 2.862 8.975 167 HE3 MET 23 HE3 MET 23 6.073 4.143 10.106 168 H LEU 24 H LEU 24 9.327 1.854 5.534 169 HA LEU 24 HA LEU 24 11.957 3.156 5.294 170 HB2 LEU 24 HB2 LEU 24 10.583 1.382 3.301 171 HB3 LEU 24 HB3 LEU 24 11.661 2.649 2.748 172 HG LEU 24 HG LEU 24 12.581 0.625 4.773 173 HD11 LEU 24 HD11 LEU 24 12.729 0.347 1.770 174 HD12 LEU 24 HD12 LEU 24 11.733 -0.631 2.847 175 HD13 LEU 24 HD13 LEU 24 13.490 -0.719 2.951 176 HD21 LEU 24 HD21 LEU 24 14.783 1.199 3.882 177 HD22 LEU 24 HD22 LEU 24 13.941 2.639 4.456 178 HD23 LEU 24 HD23 LEU 24 14.036 2.304 2.727 179 H GLU 25 H GLU 25 11.949 5.180 4.503 180 HA GLU 25 HA GLU 25 9.390 6.489 4.091 181 HB2 GLU 25 HB2 GLU 25 12.212 7.438 4.451 182 HB3 GLU 25 HB3 GLU 25 11.008 8.536 3.780 183 HG2 GLU 25 HG2 GLU 25 9.715 8.504 5.712 184 HG3 GLU 25 HG3 GLU 25 10.471 7.035 6.310 185 H VAL 26 H VAL 26 8.466 6.642 2.237 186 HA VAL 26 HA VAL 26 10.046 6.547 -0.260 187 HB VAL 26 HB VAL 26 8.500 4.881 -1.218 188 HG11 VAL 26 HG11 VAL 26 10.574 4.085 -0.215 189 HG12 VAL 26 HG12 VAL 26 9.280 2.914 0.038 190 HG13 VAL 26 HG13 VAL 26 9.789 3.965 1.360 191 HG21 VAL 26 HG21 VAL 26 7.327 4.734 1.569 192 HG22 VAL 26 HG22 VAL 26 6.925 3.663 0.224 193 HG23 VAL 26 HG23 VAL 26 6.525 5.378 0.135 194 H GLU 27 H GLU 27 8.737 7.079 -2.229 195 HA GLU 27 HA GLU 27 6.531 8.934 -1.614 196 HB2 GLU 27 HB2 GLU 27 8.371 9.779 -3.064 197 HB3 GLU 27 HB3 GLU 27 7.982 8.534 -4.247 198 HG2 GLU 27 HG2 GLU 27 5.708 9.497 -4.460 199 HG3 GLU 27 HG3 GLU 27 6.183 10.791 -3.362 200 H VAL 28 H VAL 28 4.463 8.500 -2.185 201 HA VAL 28 HA VAL 28 3.916 5.876 -3.415 202 HB VAL 28 HB VAL 28 2.101 7.568 -1.677 203 HG11 VAL 28 HG11 VAL 28 0.859 6.105 -3.180 204 HG12 VAL 28 HG12 VAL 28 0.717 5.549 -1.512 205 HG13 VAL 28 HG13 VAL 28 1.799 4.716 -2.629 206 HG21 VAL 28 HG21 VAL 28 4.008 6.791 -0.382 207 HG22 VAL 28 HG22 VAL 28 3.744 5.137 -0.935 208 HG23 VAL 28 HG23 VAL 28 2.550 5.922 0.103 209 H ILE 29 H ILE 29 3.442 6.055 -5.541 210 HA ILE 29 HA ILE 29 1.725 8.276 -6.445 211 HB ILE 29 HB ILE 29 2.185 7.286 -8.781 212 HG12 ILE 29 HG12 ILE 29 3.256 5.174 -7.709 213 HG13 ILE 29 HG13 ILE 29 4.006 5.870 -9.140 214 HG21 ILE 29 HG21 ILE 29 3.070 9.413 -8.076 215 HG22 ILE 29 HG22 ILE 29 4.288 8.533 -8.994 216 HG23 ILE 29 HG23 ILE 29 4.400 8.618 -7.237 217 HD11 ILE 29 HD11 ILE 29 5.639 5.210 -7.447 218 HD12 ILE 29 HD12 ILE 29 4.906 6.342 -6.309 219 HD13 ILE 29 HD13 ILE 29 5.683 6.942 -7.776 220 H SER 30 H SER 30 -0.162 7.897 -7.679 221 HA SER 30 HA SER 30 -1.297 5.186 -7.393 222 HB2 SER 30 HB2 SER 30 -2.694 7.832 -6.957 223 HB3 SER 30 HB3 SER 30 -3.523 6.275 -7.041 224 HG SER 30 HG SER 30 -1.472 6.117 -5.314 225 H GLY 31 H GLY 31 -1.435 4.328 -9.355 226 HA2 GLY 31 HA2 GLY 31 -2.036 6.017 -11.685 227 HA3 GLY 31 HA3 GLY 31 -1.494 4.347 -11.726 228 H ARG 32 H ARG 32 -4.031 6.162 -12.560 229 HA ARG 32 HA ARG 32 -6.201 4.759 -11.311 230 HB2 ARG 32 HB2 ARG 32 -6.455 7.091 -11.974 231 HB3 ARG 32 HB3 ARG 32 -6.199 6.664 -13.662 232 HG2 ARG 32 HG2 ARG 32 -8.267 5.446 -13.737 233 HG3 ARG 32 HG3 ARG 32 -8.490 5.626 -11.996 234 HD2 ARG 32 HD2 ARG 32 -9.894 7.185 -13.299 235 HD3 ARG 32 HD3 ARG 32 -8.763 8.019 -12.234 236 HE ARG 32 HE ARG 32 -7.744 7.680 -14.892 237 HH11 ARG 32 HH11 ARG 32 -9.757 9.655 -12.914 238 HH12 ARG 32 HH12 ARG 32 -9.554 11.053 -13.905 239 HH21 ARG 32 HH21 ARG 32 -7.478 9.479 -16.149 240 HH22 ARG 32 HH22 ARG 32 -8.270 10.958 -15.716 241 H THR 33 H THR 33 -6.281 2.638 -11.745 242 HA THR 33 HA THR 33 -6.916 1.867 -14.522 243 HB THR 33 HB THR 33 -4.670 1.012 -14.082 244 HG1 THR 33 HG1 THR 33 -5.136 -1.216 -14.448 245 HG21 THR 33 HG21 THR 33 -4.240 -0.599 -12.282 246 HG22 THR 33 HG22 THR 33 -5.890 -0.389 -11.695 247 HG23 THR 33 HG23 THR 33 -4.755 0.958 -11.630 248 H LEU 34 H LEU 34 -7.903 -0.514 -14.392 249 HA LEU 34 HA LEU 34 -9.690 -1.799 -13.819 250 HB2 LEU 34 HB2 LEU 34 -8.572 -2.125 -11.687 251 HB3 LEU 34 HB3 LEU 34 -9.221 -0.613 -11.080 252 HG LEU 34 HG LEU 34 -11.529 -1.608 -11.318 253 HD11 LEU 34 HD11 LEU 34 -10.998 -3.372 -12.914 254 HD12 LEU 34 HD12 LEU 34 -11.730 -4.034 -11.453 255 HD13 LEU 34 HD13 LEU 34 -9.991 -4.177 -11.708 256 HD21 LEU 34 HD21 LEU 34 -11.376 -2.905 -9.255 257 HD22 LEU 34 HD22 LEU 34 -10.403 -1.440 -9.156 258 HD23 LEU 34 HD23 LEU 34 -9.625 -2.997 -9.429 259 H ASN 35 H ASN 35 -10.260 1.067 -11.754 260 HA ASN 35 HA ASN 35 -12.937 1.301 -12.950 261 HB2 ASN 35 HB2 ASN 35 -12.914 0.968 -10.532 262 HB3 ASN 35 HB3 ASN 35 -11.857 2.362 -10.325 263 HD21 ASN 35 HD21 ASN 35 -13.455 3.216 -8.923 264 HD22 ASN 35 HD22 ASN 35 -14.849 4.003 -9.567 265 H GLN 36 H GLN 36 -13.057 2.740 -14.540 266 HA GLN 36 HA GLN 36 -11.431 5.201 -14.412 267 HB2 GLN 36 HB2 GLN 36 -12.773 3.933 -16.816 268 HB3 GLN 36 HB3 GLN 36 -11.735 5.352 -16.840 269 HG2 GLN 36 HG2 GLN 36 -9.852 3.974 -16.068 270 HG3 GLN 36 HG3 GLN 36 -10.898 2.555 -16.080 271 HE21 GLN 36 HE21 GLN 36 -11.592 1.719 -18.079 272 HE22 GLN 36 HE22 GLN 36 -10.779 2.116 -19.553 273 H GLY 37 H GLY 37 -14.715 3.981 -14.624 274 HA2 GLY 37 HA2 GLY 37 -15.743 6.683 -14.191 275 HA3 GLY 37 HA3 GLY 37 -16.254 5.895 -15.673 276 H ALA 38 H ALA 38 -15.830 4.494 -12.420 277 HA ALA 38 HA ALA 38 -18.744 4.365 -12.084 278 HB1 ALA 38 HB1 ALA 38 -18.134 2.232 -13.139 279 HB2 ALA 38 HB2 ALA 38 -18.690 1.991 -11.482 280 HB3 ALA 38 HB3 ALA 38 -16.965 1.926 -11.851 281 H THR 39 H THR 39 -19.184 3.297 -9.789 282 HA THR 39 HA THR 39 -17.346 4.543 -7.861 283 HB THR 39 HB THR 39 -19.068 4.351 -6.207 284 HG1 THR 39 HG1 THR 39 -20.747 3.006 -6.372 285 HG21 THR 39 HG21 THR 39 -20.370 5.128 -8.827 286 HG22 THR 39 HG22 THR 39 -19.389 6.186 -7.811 287 HG23 THR 39 HG23 THR 39 -20.935 5.578 -7.218 288 H VAL 40 H VAL 40 -17.275 3.167 -5.689 289 HA VAL 40 HA VAL 40 -15.768 0.851 -6.302 290 HB VAL 40 HB VAL 40 -16.894 1.656 -3.608 291 HG11 VAL 40 HG11 VAL 40 -15.022 0.360 -2.687 292 HG12 VAL 40 HG12 VAL 40 -14.570 -0.135 -4.320 293 HG13 VAL 40 HG13 VAL 40 -16.113 -0.647 -3.637 294 HG21 VAL 40 HG21 VAL 40 -15.593 3.474 -4.576 295 HG22 VAL 40 HG22 VAL 40 -14.252 2.374 -4.892 296 HG23 VAL 40 HG23 VAL 40 -14.719 2.743 -3.231 297 H GLU 41 H GLU 41 -19.077 1.323 -5.143 298 HA GLU 41 HA GLU 41 -19.647 -1.398 -4.598 299 HB2 GLU 41 HB2 GLU 41 -21.744 0.595 -5.454 300 HB3 GLU 41 HB3 GLU 41 -21.914 -0.772 -4.362 301 HG2 GLU 41 HG2 GLU 41 -21.849 0.844 -2.794 302 HG3 GLU 41 HG3 GLU 41 -20.105 0.655 -2.983 303 H GLU 42 H GLU 42 -20.132 0.600 -7.494 304 HA GLU 42 HA GLU 42 -21.585 -1.137 -9.093 305 HB2 GLU 42 HB2 GLU 42 -19.384 0.750 -9.966 306 HB3 GLU 42 HB3 GLU 42 -20.599 0.046 -11.026 307 HG2 GLU 42 HG2 GLU 42 -21.119 1.943 -8.740 308 HG3 GLU 42 HG3 GLU 42 -21.135 2.349 -10.455 309 H LYS 43 H LYS 43 -18.188 -1.224 -8.286 310 HA LYS 43 HA LYS 43 -17.829 -3.604 -10.008 311 HB2 LYS 43 HB2 LYS 43 -15.740 -1.515 -9.339 312 HB3 LYS 43 HB3 LYS 43 -15.549 -2.877 -10.437 313 HG2 LYS 43 HG2 LYS 43 -17.066 -1.920 -12.016 314 HG3 LYS 43 HG3 LYS 43 -17.556 -0.669 -10.875 315 HD2 LYS 43 HD2 LYS 43 -16.045 0.279 -12.503 316 HD3 LYS 43 HD3 LYS 43 -15.249 0.237 -10.928 317 HE2 LYS 43 HE2 LYS 43 -13.704 -0.459 -12.649 318 HE3 LYS 43 HE3 LYS 43 -14.082 -1.829 -11.605 319 HZ1 LYS 43 HZ1 LYS 43 -14.133 -2.553 -13.856 320 HZ2 LYS 43 HZ2 LYS 43 -15.162 -1.296 -14.314 321 HZ3 LYS 43 HZ3 LYS 43 -15.730 -2.523 -13.302 322 H LEU 44 H LEU 44 -18.576 -3.359 -7.132 323 HA LEU 44 HA LEU 44 -16.493 -3.707 -5.321 324 HB2 LEU 44 HB2 LEU 44 -19.142 -3.462 -5.112 325 HB3 LEU 44 HB3 LEU 44 -19.051 -5.196 -4.907 326 HG LEU 44 HG LEU 44 -19.166 -3.932 -2.769 327 HD11 LEU 44 HD11 LEU 44 -16.575 -5.434 -3.102 328 HD12 LEU 44 HD12 LEU 44 -18.154 -6.164 -2.814 329 HD13 LEU 44 HD13 LEU 44 -17.427 -5.128 -1.588 330 HD21 LEU 44 HD21 LEU 44 -17.934 -1.951 -3.411 331 HD22 LEU 44 HD22 LEU 44 -16.453 -2.896 -3.576 332 HD23 LEU 44 HD23 LEU 44 -17.200 -2.694 -1.991 333 H THR 45 H THR 45 -17.408 -5.883 -7.754 334 HA THR 45 HA THR 45 -17.133 -8.400 -6.575 335 HB THR 45 HB THR 45 -18.061 -8.068 -8.826 336 HG1 THR 45 HG1 THR 45 -17.049 -9.901 -9.766 337 HG21 THR 45 HG21 THR 45 -16.500 -6.371 -9.652 338 HG22 THR 45 HG22 THR 45 -16.576 -7.743 -10.754 339 HG23 THR 45 HG23 THR 45 -15.199 -7.561 -9.669 340 H GLU 46 H GLU 46 -15.339 -9.969 -7.522 341 HA GLU 46 HA GLU 46 -13.083 -9.725 -5.995 342 HB2 GLU 46 HB2 GLU 46 -13.747 -11.825 -6.986 343 HB3 GLU 46 HB3 GLU 46 -13.456 -11.208 -8.605 344 HG2 GLU 46 HG2 GLU 46 -11.683 -12.707 -7.973 345 HG3 GLU 46 HG3 GLU 46 -11.045 -11.070 -8.103 346 H GLU 47 H GLU 47 -13.499 -8.539 -9.304 347 HA GLU 47 HA GLU 47 -10.858 -7.943 -9.939 348 HB2 GLU 47 HB2 GLU 47 -13.473 -6.739 -10.783 349 HB3 GLU 47 HB3 GLU 47 -11.954 -6.074 -11.368 350 HG2 GLU 47 HG2 GLU 47 -12.998 -7.699 -12.912 351 HG3 GLU 47 HG3 GLU 47 -11.366 -8.135 -12.423 352 H TYR 48 H TYR 48 -13.113 -6.055 -7.958 353 HA TYR 48 HA TYR 48 -11.290 -3.841 -7.673 354 HB2 TYR 48 HB2 TYR 48 -14.005 -4.248 -7.086 355 HB3 TYR 48 HB3 TYR 48 -13.244 -4.037 -5.515 356 HD1 TYR 48 HD1 TYR 48 -12.200 -1.897 -4.915 357 HD2 TYR 48 HD2 TYR 48 -14.063 -2.428 -8.705 358 HE1 TYR 48 HE1 TYR 48 -12.158 0.532 -5.273 359 HE2 TYR 48 HE2 TYR 48 -14.034 0.006 -9.071 360 HH TYR 48 HH TYR 48 -12.186 2.119 -7.189 361 H PHE 49 H PHE 49 -11.698 -6.907 -6.174 362 HA PHE 49 HA PHE 49 -10.191 -6.188 -3.785 363 HB2 PHE 49 HB2 PHE 49 -12.185 -7.693 -3.677 364 HB3 PHE 49 HB3 PHE 49 -11.289 -8.890 -4.604 365 HD1 PHE 49 HD1 PHE 49 -11.066 -6.879 -1.470 366 HD2 PHE 49 HD2 PHE 49 -10.046 -10.503 -3.470 367 HE1 PHE 49 HE1 PHE 49 -10.137 -7.772 0.626 368 HE2 PHE 49 HE2 PHE 49 -9.116 -11.399 -1.375 369 HZ PHE 49 HZ PHE 49 -9.161 -10.034 0.676 370 H ASN 50 H ASN 50 -9.310 -6.966 -6.892 371 HA ASN 50 HA ASN 50 -6.770 -8.118 -5.906 372 HB2 ASN 50 HB2 ASN 50 -6.503 -9.225 -8.119 373 HB3 ASN 50 HB3 ASN 50 -7.877 -9.809 -7.194 374 HD21 ASN 50 HD21 ASN 50 -9.024 -10.567 -8.907 375 HD22 ASN 50 HD22 ASN 50 -9.692 -9.557 -10.137 376 H ALA 51 H ALA 51 -8.160 -5.917 -8.347 377 HA ALA 51 HA ALA 51 -5.655 -5.249 -9.511 378 HB1 ALA 51 HB1 ALA 51 -7.764 -5.072 -10.728 379 HB2 ALA 51 HB2 ALA 51 -6.878 -3.548 -10.746 380 HB3 ALA 51 HB3 ALA 51 -8.264 -3.749 -9.676 381 H VAL 52 H VAL 52 -7.422 -3.798 -6.817 382 HA VAL 52 HA VAL 52 -5.363 -1.666 -6.702 383 HB VAL 52 HB VAL 52 -7.004 -0.252 -5.515 384 HG11 VAL 52 HG11 VAL 52 -8.003 -1.248 -8.184 385 HG12 VAL 52 HG12 VAL 52 -6.760 -0.025 -7.934 386 HG13 VAL 52 HG13 VAL 52 -8.419 0.291 -7.430 387 HG21 VAL 52 HG21 VAL 52 -8.980 -2.458 -6.131 388 HG22 VAL 52 HG22 VAL 52 -9.376 -0.878 -5.456 389 HG23 VAL 52 HG23 VAL 52 -8.393 -2.010 -4.528 390 H ASN 53 H ASN 53 -5.575 -4.462 -5.337 391 HA ASN 53 HA ASN 53 -5.625 -3.583 -2.515 392 HB2 ASN 53 HB2 ASN 53 -5.980 -6.320 -3.739 393 HB3 ASN 53 HB3 ASN 53 -5.849 -6.038 -2.007 394 HD21 ASN 53 HD21 ASN 53 -7.534 -3.938 -4.273 395 HD22 ASN 53 HD22 ASN 53 -9.108 -4.241 -3.653 396 H TYR 54 H TYR 54 -3.267 -3.532 -4.521 397 HA TYR 54 HA TYR 54 -1.331 -4.749 -2.682 398 HB2 TYR 54 HB2 TYR 54 -0.108 -5.864 -4.456 399 HB3 TYR 54 HB3 TYR 54 -1.777 -6.418 -4.469 400 HD1 TYR 54 HD2 TYR 54 -3.355 -5.479 -6.217 401 HD2 TYR 54 HD1 TYR 54 0.852 -4.869 -6.375 402 HE1 TYR 54 HE2 TYR 54 -3.540 -4.866 -8.589 403 HE2 TYR 54 HE1 TYR 54 0.680 -4.247 -8.751 404 HH TYR 54 HH TYR 54 -2.268 -3.547 -10.257 405 H ALA 55 H ALA 55 0.951 -4.120 -3.254 406 HA ALA 55 HA ALA 55 1.136 -1.523 -4.637 407 HB1 ALA 55 HB1 ALA 55 0.953 -1.029 -2.260 408 HB2 ALA 55 HB2 ALA 55 2.578 -0.657 -2.839 409 HB3 ALA 55 HB3 ALA 55 2.287 -2.128 -1.910 410 H GLU 56 H GLU 56 3.071 -1.144 -5.700 411 HA GLU 56 HA GLU 56 4.878 -3.438 -5.973 412 HB2 GLU 56 HB2 GLU 56 4.593 -0.923 -7.636 413 HB3 GLU 56 HB3 GLU 56 5.770 -2.192 -7.951 414 HG2 GLU 56 HG2 GLU 56 3.879 -3.789 -8.245 415 HG3 GLU 56 HG3 GLU 56 2.765 -2.431 -8.078 416 H ILE 57 H ILE 57 6.598 -3.463 -4.683 417 HA ILE 57 HA ILE 57 7.919 -0.918 -3.954 418 HB ILE 57 HB ILE 57 8.115 -3.594 -2.532 419 HG12 ILE 57 HG12 ILE 57 6.906 -2.216 -0.675 420 HG13 ILE 57 HG13 ILE 57 6.423 -1.154 -1.991 421 HG21 ILE 57 HG21 ILE 57 10.132 -2.281 -2.254 422 HG22 ILE 57 HG22 ILE 57 9.226 -2.310 -0.742 423 HG23 ILE 57 HG23 ILE 57 9.184 -0.875 -1.769 424 HD11 ILE 57 HD11 ILE 57 4.695 -2.770 -1.442 425 HD12 ILE 57 HD12 ILE 57 5.806 -4.093 -1.792 426 HD13 ILE 57 HD13 ILE 57 5.290 -3.008 -3.084 427 H ASN 58 H ASN 58 10.170 -0.716 -4.175 428 HA ASN 58 HA ASN 58 11.461 -2.183 -6.228 429 HB2 ASN 58 HB2 ASN 58 12.073 0.125 -5.726 430 HB3 ASN 58 HB3 ASN 58 12.615 -0.337 -4.117 431 HD21 ASN 58 HD21 ASN 58 13.298 -0.535 -7.528 432 HD22 ASN 58 HD22 ASN 58 14.950 -1.009 -7.367 433 H GLU 59 H GLU 59 13.105 -3.766 -6.131 434 HA GLU 59 HA GLU 59 12.714 -5.733 -4.192 435 HB2 GLU 59 HB2 GLU 59 13.536 -6.275 -6.406 436 HB3 GLU 59 HB3 GLU 59 15.035 -5.410 -6.095 437 HG2 GLU 59 HG2 GLU 59 15.784 -7.021 -4.553 438 HG3 GLU 59 HG3 GLU 59 14.180 -7.730 -4.388 439 H GLU 60 H GLU 60 15.298 -3.273 -4.333 440 HA GLU 60 HA GLU 60 16.840 -4.283 -2.206 441 HB2 GLU 60 HB2 GLU 60 16.451 -1.426 -3.117 442 HB3 GLU 60 HB3 GLU 60 17.620 -1.909 -1.896 443 HG2 GLU 60 HG2 GLU 60 18.602 -3.463 -3.645 444 HG3 GLU 60 HG3 GLU 60 17.597 -2.612 -4.819 445 H ASP 61 H ASP 61 14.192 -1.898 -2.153 446 HA ASP 61 HA ASP 61 14.077 -1.607 0.655 447 HB2 ASP 61 HB2 ASP 61 11.866 -1.281 -1.394 448 HB3 ASP 61 HB3 ASP 61 11.809 -0.703 0.270 449 H TRP 62 H TRP 62 12.495 -3.834 -1.567 450 HA TRP 62 HA TRP 62 10.745 -5.192 0.091 451 HB2 TRP 62 HB2 TRP 62 10.962 -5.528 -2.351 452 HB3 TRP 62 HB3 TRP 62 12.507 -6.328 -2.102 453 HD1 TRP 62 HD1 TRP 62 12.415 -8.805 -0.932 454 HE1 TRP 62 HE1 TRP 62 10.554 -10.582 -0.968 455 HE3 TRP 62 HE3 TRP 62 8.503 -5.856 -2.385 456 HZ2 TRP 62 HZ2 TRP 62 7.800 -10.713 -1.536 457 HZ3 TRP 62 HZ3 TRP 62 6.289 -6.888 -2.654 458 HH2 TRP 62 HH2 TRP 62 5.944 -9.266 -2.239 459 H ASN 63 H ASN 63 14.164 -5.972 -0.531 460 HA ASN 63 HA ASN 63 14.342 -8.048 1.398 461 HB2 ASN 63 HB2 ASN 63 16.477 -6.366 0.064 462 HB3 ASN 63 HB3 ASN 63 16.822 -7.755 1.093 463 HD21 ASN 63 HD21 ASN 63 17.335 -7.268 -1.780 464 HD22 ASN 63 HD22 ASN 63 16.613 -8.607 -2.597 465 H ALA 64 H ALA 64 14.959 -4.571 1.530 466 HA ALA 64 HA ALA 64 16.178 -4.432 4.064 467 HB1 ALA 64 HB1 ALA 64 16.129 -2.561 2.471 468 HB2 ALA 64 HB2 ALA 64 15.540 -2.083 4.063 469 HB3 ALA 64 HB3 ALA 64 14.396 -2.376 2.750 470 H LEU 65 H LEU 65 12.769 -4.417 3.127 471 HA LEU 65 HA LEU 65 11.796 -4.077 5.821 472 HB2 LEU 65 HB2 LEU 65 10.365 -4.894 3.286 473 HB3 LEU 65 HB3 LEU 65 9.578 -4.467 4.796 474 HG LEU 65 HG LEU 65 11.301 -2.570 3.187 475 HD11 LEU 65 HD11 LEU 65 8.290 -2.738 3.309 476 HD12 LEU 65 HD12 LEU 65 9.295 -3.194 1.933 477 HD13 LEU 65 HD13 LEU 65 9.239 -1.515 2.462 478 HD21 LEU 65 HD21 LEU 65 11.195 -2.026 5.560 479 HD22 LEU 65 HD22 LEU 65 9.432 -2.084 5.506 480 HD23 LEU 65 HD23 LEU 65 10.304 -0.845 4.602 481 H GLY 66 H GLY 66 12.957 -6.729 4.037 482 HA2 GLY 66 HA2 GLY 66 12.935 -9.005 4.391 483 HA3 GLY 66 HA3 GLY 66 12.297 -8.675 5.998 484 H LEU 67 H LEU 67 11.082 -8.260 2.669 485 HA LEU 67 HA LEU 67 8.439 -9.122 3.544 486 HB2 LEU 67 HB2 LEU 67 9.385 -8.004 0.904 487 HB3 LEU 67 HB3 LEU 67 7.715 -8.380 1.293 488 HG LEU 67 HG LEU 67 9.410 -6.293 2.678 489 HD11 LEU 67 HD11 LEU 67 7.102 -5.973 0.760 490 HD12 LEU 67 HD12 LEU 67 8.798 -5.666 0.388 491 HD13 LEU 67 HD13 LEU 67 7.963 -4.673 1.581 492 HD21 LEU 67 HD21 LEU 67 6.487 -6.966 3.025 493 HD22 LEU 67 HD22 LEU 67 7.357 -5.648 3.814 494 HD23 LEU 67 HD23 LEU 67 7.773 -7.321 4.180 495 H GLN 68 H GLN 68 7.150 -10.561 2.269 496 HA GLN 68 HA GLN 68 8.618 -12.674 0.825 497 HB2 GLN 68 HB2 GLN 68 8.063 -13.423 3.136 498 HB3 GLN 68 HB3 GLN 68 6.370 -13.070 2.821 499 HG2 GLN 68 HG2 GLN 68 6.313 -14.792 1.096 500 HG3 GLN 68 HG3 GLN 68 8.019 -15.136 1.368 501 HE21 GLN 68 HE21 GLN 68 4.801 -15.438 2.650 502 HE22 GLN 68 HE22 GLN 68 5.187 -16.605 3.864 503 H GLU 69 H GLU 69 7.685 -13.184 -1.107 504 HA GLU 69 HA GLU 69 5.946 -11.397 -2.276 505 HB2 GLU 69 HB2 GLU 69 6.620 -14.212 -3.107 506 HB3 GLU 69 HB3 GLU 69 5.690 -13.100 -4.111 507 HG2 GLU 69 HG2 GLU 69 7.578 -11.500 -4.004 508 HG3 GLU 69 HG3 GLU 69 8.519 -12.717 -3.142 509 H GLY 70 H GLY 70 4.044 -10.945 -1.400 510 HA2 GLY 70 HA2 GLY 70 1.667 -11.431 -1.687 511 HA3 GLY 70 HA3 GLY 70 2.017 -13.105 -1.297 512 H ASP 71 H ASP 71 3.713 -10.876 0.701 513 HA ASP 71 HA ASP 71 1.980 -11.590 2.932 514 HB2 ASP 71 HB2 ASP 71 3.742 -10.634 4.360 515 HB3 ASP 71 HB3 ASP 71 4.368 -11.852 3.256 516 H ARG 72 H ARG 72 2.368 -9.437 4.668 517 HA ARG 72 HA ARG 72 0.500 -7.503 3.447 518 HB2 ARG 72 HB2 ARG 72 0.782 -8.319 6.353 519 HB3 ARG 72 HB3 ARG 72 -0.325 -7.095 5.755 520 HG2 ARG 72 HG2 ARG 72 -1.615 -9.037 6.084 521 HG3 ARG 72 HG3 ARG 72 -1.383 -8.904 4.341 522 HD2 ARG 72 HD2 ARG 72 0.431 -10.559 4.468 523 HD3 ARG 72 HD3 ARG 72 0.175 -10.698 6.208 524 HE ARG 72 HE ARG 72 -2.038 -11.617 5.699 525 HH11 ARG 72 HH11 ARG 72 0.245 -11.539 3.118 526 HH12 ARG 72 HH12 ARG 72 -0.479 -12.865 2.291 527 HH21 ARG 72 HH21 ARG 72 -2.962 -13.312 4.612 528 HH22 ARG 72 HH22 ARG 72 -2.272 -13.852 3.117 529 H VAL 73 H VAL 73 1.130 -5.437 3.257 530 HA VAL 73 HA VAL 73 3.170 -4.396 5.130 531 HB VAL 73 HB VAL 73 3.898 -2.827 3.326 532 HG11 VAL 73 HG11 VAL 73 5.209 -4.813 3.814 533 HG12 VAL 73 HG12 VAL 73 5.232 -4.478 2.082 534 HG13 VAL 73 HG13 VAL 73 4.210 -5.768 2.717 535 HG21 VAL 73 HG21 VAL 73 1.911 -2.885 1.923 536 HG22 VAL 73 HG22 VAL 73 2.193 -4.587 1.557 537 HG23 VAL 73 HG23 VAL 73 3.328 -3.364 0.989 538 H LYS 74 H LYS 74 2.763 -2.466 6.101 539 HA LYS 74 HA LYS 74 0.174 -1.192 5.516 540 HB2 LYS 74 HB2 LYS 74 0.419 -1.914 7.830 541 HB3 LYS 74 HB3 LYS 74 1.926 -1.019 7.984 542 HG2 LYS 74 HG2 LYS 74 0.749 1.088 7.754 543 HG3 LYS 74 HG3 LYS 74 -0.767 0.240 7.452 544 HD2 LYS 74 HD2 LYS 74 0.818 0.005 10.016 545 HD3 LYS 74 HD3 LYS 74 -0.505 1.146 9.776 546 HE2 LYS 74 HE2 LYS 74 -2.026 -0.737 9.320 547 HE3 LYS 74 HE3 LYS 74 -0.699 -1.864 9.616 548 HZ1 LYS 74 HZ1 LYS 74 -2.125 -1.597 11.561 549 HZ2 LYS 74 HZ2 LYS 74 -1.789 0.059 11.598 550 HZ3 LYS 74 HZ3 LYS 74 -0.552 -1.061 11.876 551 H VAL 75 H VAL 75 0.119 0.702 4.541 552 HA VAL 75 HA VAL 75 2.572 2.318 4.316 553 HB VAL 75 HB VAL 75 0.045 2.489 2.643 554 HG11 VAL 75 HG11 VAL 75 1.401 3.868 1.131 555 HG12 VAL 75 HG12 VAL 75 2.761 3.764 2.250 556 HG13 VAL 75 HG13 VAL 75 1.281 4.594 2.733 557 HG21 VAL 75 HG21 VAL 75 1.174 0.351 2.280 558 HG22 VAL 75 HG22 VAL 75 2.694 1.190 1.969 559 HG23 VAL 75 HG23 VAL 75 1.333 1.392 0.865 560 H LYS 76 H LYS 76 2.621 4.354 5.184 561 HA LYS 76 HA LYS 76 0.150 5.383 6.424 562 HB2 LYS 76 HB2 LYS 76 2.821 4.995 7.787 563 HB3 LYS 76 HB3 LYS 76 1.458 5.860 8.490 564 HG2 LYS 76 HG2 LYS 76 0.295 3.960 8.939 565 HG3 LYS 76 HG3 LYS 76 0.918 3.112 7.524 566 HD2 LYS 76 HD2 LYS 76 1.766 2.050 9.490 567 HD3 LYS 76 HD3 LYS 76 3.092 2.880 8.677 568 HE2 LYS 76 HE2 LYS 76 2.940 4.724 10.261 569 HE3 LYS 76 HE3 LYS 76 1.558 3.957 11.045 570 HZ1 LYS 76 HZ1 LYS 76 4.236 2.695 10.870 571 HZ2 LYS 76 HZ2 LYS 76 2.924 2.200 11.814 572 HZ3 LYS 76 HZ3 LYS 76 3.736 3.634 12.186 573 H THR 77 H THR 77 -0.135 7.511 6.294 574 HA THR 77 HA THR 77 2.133 9.273 5.614 575 HB THR 77 HB THR 77 0.955 10.375 3.828 576 HG1 THR 77 HG1 THR 77 -1.138 9.475 3.157 577 HG21 THR 77 HG21 THR 77 2.199 8.378 3.153 578 HG22 THR 77 HG22 THR 77 0.765 8.591 2.147 579 HG23 THR 77 HG23 THR 77 0.770 7.380 3.431 580 H GLU 78 H GLU 78 0.950 11.628 5.281 581 HA GLU 78 HA GLU 78 0.068 12.478 7.823 582 HB2 GLU 78 HB2 GLU 78 -0.388 14.637 6.684 583 HB3 GLU 78 HB3 GLU 78 1.208 13.993 6.314 584 HG2 GLU 78 HG2 GLU 78 0.352 13.135 4.172 585 HG3 GLU 78 HG3 GLU 78 -1.225 13.831 4.540 586 H PHE 79 H PHE 79 -1.657 11.069 5.207 587 HA PHE 79 HA PHE 79 -4.236 12.201 5.946 588 HB2 PHE 79 HB2 PHE 79 -3.491 10.134 3.858 589 HB3 PHE 79 HB3 PHE 79 -5.109 10.796 4.083 590 HD1 PHE 79 HD2 PHE 79 -5.534 13.196 3.611 591 HD2 PHE 79 HD1 PHE 79 -1.807 11.357 2.676 592 HE1 PHE 79 HE2 PHE 79 -4.984 15.069 2.121 593 HE2 PHE 79 HE1 PHE 79 -1.256 13.233 1.186 594 HZ PHE 79 HZ PHE 79 -2.845 15.090 0.908 595 H GLY 80 H GLY 80 -2.867 8.899 5.739 596 HA2 GLY 80 HA2 GLY 80 -3.914 8.081 8.247 597 HA3 GLY 80 HA3 GLY 80 -4.990 7.551 6.964 598 H GLU 81 H GLU 81 -4.528 5.346 7.531 599 HA GLU 81 HA GLU 81 -2.025 4.412 6.304 600 HB2 GLU 81 HB2 GLU 81 -1.608 2.801 8.047 601 HB3 GLU 81 HB3 GLU 81 -1.719 4.397 8.770 602 HG2 GLU 81 HG2 GLU 81 -3.951 2.367 8.757 603 HG3 GLU 81 HG3 GLU 81 -2.815 2.603 10.084 604 H VAL 82 H VAL 82 -2.086 2.279 5.452 605 HA VAL 82 HA VAL 82 -4.601 0.803 5.506 606 HB VAL 82 HB VAL 82 -4.841 2.396 3.603 607 HG11 VAL 82 HG11 VAL 82 -3.494 2.125 1.588 608 HG12 VAL 82 HG12 VAL 82 -2.515 0.897 2.391 609 HG13 VAL 82 HG13 VAL 82 -2.484 2.565 2.965 610 HG21 VAL 82 HG21 VAL 82 -5.563 0.747 1.941 611 HG22 VAL 82 HG22 VAL 82 -6.035 0.263 3.572 612 HG23 VAL 82 HG23 VAL 82 -4.654 -0.510 2.786 613 H VAL 83 H VAL 83 -4.350 -1.404 5.069 614 HA VAL 83 HA VAL 83 -1.567 -2.314 4.674 615 HB VAL 83 HB VAL 83 -3.830 -3.899 5.911 616 HG11 VAL 83 HG11 VAL 83 -2.084 -5.273 4.871 617 HG12 VAL 83 HG12 VAL 83 -2.053 -5.425 6.628 618 HG13 VAL 83 HG13 VAL 83 -0.852 -4.424 5.810 619 HG21 VAL 83 HG21 VAL 83 -1.570 -2.421 7.269 620 HG22 VAL 83 HG22 VAL 83 -2.711 -3.506 8.067 621 HG23 VAL 83 HG23 VAL 83 -3.285 -2.004 7.341 622 H VAL 84 H VAL 84 -1.127 -3.121 2.753 623 HA VAL 84 HA VAL 84 -3.238 -4.516 1.216 624 HB VAL 84 HB VAL 84 -2.266 -3.618 -0.863 625 HG11 VAL 84 HG11 VAL 84 -3.029 -1.447 1.099 626 HG12 VAL 84 HG12 VAL 84 -4.145 -2.432 0.155 627 HG13 VAL 84 HG13 VAL 84 -3.061 -1.307 -0.660 628 HG21 VAL 84 HG21 VAL 84 -0.499 -1.978 0.965 629 HG22 VAL 84 HG22 VAL 84 -0.628 -1.780 -0.783 630 HG23 VAL 84 HG23 VAL 84 0.029 -3.273 -0.111 631 H PHE 85 H PHE 85 -2.176 -5.827 -0.660 632 HA PHE 85 HA PHE 85 -0.212 -7.605 0.477 633 HB2 PHE 85 HB2 PHE 85 -1.507 -7.541 -2.261 634 HB3 PHE 85 HB3 PHE 85 -0.413 -8.807 -1.718 635 HD1 PHE 85 HD1 PHE 85 -1.080 -10.224 0.264 636 HD2 PHE 85 HD2 PHE 85 -3.805 -7.606 -1.711 637 HE1 PHE 85 HE1 PHE 85 -2.970 -11.458 1.238 638 HE2 PHE 85 HE2 PHE 85 -5.698 -8.835 -0.730 639 HZ PHE 85 HZ PHE 85 -5.282 -10.765 0.746 640 H ALA 86 H ALA 86 1.940 -7.691 0.095 641 HA ALA 86 HA ALA 86 3.158 -5.502 -1.359 642 HB1 ALA 86 HB1 ALA 86 4.033 -6.195 0.821 643 HB2 ALA 86 HB2 ALA 86 5.258 -6.310 -0.442 644 HB3 ALA 86 HB3 ALA 86 4.459 -7.769 0.150 645 H LYS 87 H LYS 87 3.849 -5.567 -3.405 646 HA LYS 87 HA LYS 87 4.743 -8.133 -4.546 647 HB2 LYS 87 HB2 LYS 87 3.063 -6.081 -6.023 648 HB3 LYS 87 HB3 LYS 87 3.748 -7.542 -6.722 649 HG2 LYS 87 HG2 LYS 87 2.392 -8.828 -5.009 650 HG3 LYS 87 HG3 LYS 87 1.552 -7.308 -4.685 651 HD2 LYS 87 HD2 LYS 87 0.992 -7.187 -7.127 652 HD3 LYS 87 HD3 LYS 87 1.684 -8.803 -7.311 653 HE2 LYS 87 HE2 LYS 87 0.067 -9.530 -5.497 654 HE3 LYS 87 HE3 LYS 87 -0.715 -7.973 -5.710 655 HZ1 LYS 87 HZ1 LYS 87 -0.320 -9.927 -7.905 656 HZ2 LYS 87 HZ2 LYS 87 -1.233 -8.504 -7.952 657 HZ3 LYS 87 HZ3 LYS 87 -1.740 -9.799 -6.995 658 H LYS 88 H LYS 88 6.283 -7.975 -6.227 659 HA LYS 88 HA LYS 88 8.138 -5.809 -5.665 660 HB2 LYS 88 HB2 LYS 88 8.664 -8.336 -5.620 661 HB3 LYS 88 HB3 LYS 88 8.685 -8.228 -7.377 662 HG2 LYS 88 HG2 LYS 88 10.455 -6.578 -7.278 663 HG3 LYS 88 HG3 LYS 88 10.397 -6.607 -5.517 664 HD2 LYS 88 HD2 LYS 88 11.098 -8.975 -7.266 665 HD3 LYS 88 HD3 LYS 88 12.268 -7.946 -6.436 666 HE2 LYS 88 HE2 LYS 88 11.270 -8.580 -4.274 667 HE3 LYS 88 HE3 LYS 88 10.131 -9.629 -5.117 668 HZ1 LYS 88 HZ1 LYS 88 11.954 -10.976 -5.890 669 HZ2 LYS 88 HZ2 LYS 88 12.041 -10.834 -4.209 670 HZ3 LYS 88 HZ3 LYS 88 13.086 -9.935 -5.185 671 H GLY 89 H GLY 89 8.455 -4.137 -7.016 672 HA2 GLY 89 HA2 GLY 89 7.418 -4.375 -9.788 673 HA3 GLY 89 HA3 GLY 89 7.201 -2.939 -8.805 674 H ASP 90 H ASP 90 8.164 -2.268 -11.049 675 HA ASP 90 HA ASP 90 11.083 -2.430 -11.132 676 HB2 ASP 90 HB2 ASP 90 9.096 -1.222 -13.077 677 HB3 ASP 90 HB3 ASP 90 10.832 -1.353 -13.347 678 H VAL 91 H VAL 91 9.141 -0.612 -9.388 679 HA VAL 91 HA VAL 91 9.739 2.073 -10.027 680 HB VAL 91 HB VAL 91 9.028 2.581 -7.697 681 HG11 VAL 91 HG11 VAL 91 7.254 0.615 -9.156 682 HG12 VAL 91 HG12 VAL 91 7.346 2.352 -9.455 683 HG13 VAL 91 HG13 VAL 91 6.725 1.753 -7.916 684 HG21 VAL 91 HG21 VAL 91 8.243 0.741 -6.253 685 HG22 VAL 91 HG22 VAL 91 9.977 0.647 -6.564 686 HG23 VAL 91 HG23 VAL 91 8.870 -0.427 -7.420 687 HA PRO 92 HA PRO 92 13.896 2.598 -8.433 688 HB2 PRO 92 HB2 PRO 92 13.830 5.201 -7.643 689 HB3 PRO 92 HB3 PRO 92 13.876 4.720 -9.342 690 HG2 PRO 92 HG2 PRO 92 11.527 5.539 -7.668 691 HG3 PRO 92 HG3 PRO 92 11.943 6.020 -9.325 692 HD2 PRO 92 HD2 PRO 92 10.092 4.113 -8.794 693 HD3 PRO 92 HD3 PRO 92 11.125 4.054 -10.238 694 H LYS 93 H LYS 93 15.091 2.896 -6.435 695 HA LYS 93 HA LYS 93 13.729 1.853 -4.189 696 HB2 LYS 93 HB2 LYS 93 16.184 1.554 -4.683 697 HB3 LYS 93 HB3 LYS 93 16.432 3.213 -4.141 698 HG2 LYS 93 HG2 LYS 93 15.441 2.603 -1.955 699 HG3 LYS 93 HG3 LYS 93 15.337 0.931 -2.506 700 HD2 LYS 93 HD2 LYS 93 17.805 0.931 -2.796 701 HD3 LYS 93 HD3 LYS 93 17.848 2.562 -2.115 702 HE2 LYS 93 HE2 LYS 93 16.902 0.042 -0.753 703 HE3 LYS 93 HE3 LYS 93 18.349 0.976 -0.369 704 HZ1 LYS 93 HZ1 LYS 93 15.522 1.820 -0.003 705 HZ2 LYS 93 HZ2 LYS 93 16.856 2.849 0.216 706 HZ3 LYS 93 HZ3 LYS 93 16.662 1.498 1.209 707 H GLY 94 H GLY 94 13.152 2.777 -2.198 708 HA2 GLY 94 HA2 GLY 94 12.319 4.446 -0.824 709 HA3 GLY 94 HA3 GLY 94 13.320 5.599 -1.697 710 H MET 95 H MET 95 11.040 3.609 -3.421 711 HA MET 95 HA MET 95 8.946 5.612 -3.434 712 HB2 MET 95 HB2 MET 95 10.672 6.392 -5.075 713 HB3 MET 95 HB3 MET 95 10.437 4.901 -5.973 714 HG2 MET 95 HG2 MET 95 8.173 5.502 -6.468 715 HG3 MET 95 HG3 MET 95 8.289 6.933 -5.446 716 HE1 MET 95 HE1 MET 95 8.151 8.656 -8.905 717 HE2 MET 95 HE2 MET 95 7.454 8.503 -7.289 718 HE3 MET 95 HE3 MET 95 7.271 7.194 -8.459 719 H ILE 96 H ILE 96 6.949 4.676 -3.916 720 HA ILE 96 HA ILE 96 6.951 1.912 -4.957 721 HB ILE 96 HB ILE 96 5.295 1.208 -3.295 722 HG12 ILE 96 HG12 ILE 96 5.798 3.869 -1.925 723 HG13 ILE 96 HG13 ILE 96 4.347 3.482 -2.843 724 HG21 ILE 96 HG21 ILE 96 7.627 0.741 -2.832 725 HG22 ILE 96 HG22 ILE 96 6.782 1.105 -1.329 726 HG23 ILE 96 HG23 ILE 96 7.824 2.319 -2.070 727 HD11 ILE 96 HD11 ILE 96 5.278 2.097 -0.335 728 HD12 ILE 96 HD12 ILE 96 3.830 1.693 -1.260 729 HD13 ILE 96 HD13 ILE 96 3.958 3.262 -0.466 730 H PHE 97 H PHE 97 5.129 1.266 -6.096 731 HA PHE 97 HA PHE 97 3.302 3.441 -6.892 732 HB2 PHE 97 HB2 PHE 97 4.585 2.434 -8.725 733 HB3 PHE 97 HB3 PHE 97 3.963 0.842 -8.307 734 HD1 PHE 97 HD2 PHE 97 3.151 4.092 -9.806 735 HD2 PHE 97 HD1 PHE 97 1.700 0.191 -8.887 736 HE1 PHE 97 HE2 PHE 97 1.233 4.453 -11.303 737 HE2 PHE 97 HE1 PHE 97 -0.220 0.551 -10.382 738 HZ PHE 97 HZ PHE 97 -0.453 2.682 -11.592 739 H ILE 98 H ILE 98 1.160 3.323 -6.517 740 HA ILE 98 HA ILE 98 -0.022 0.723 -5.780 741 HB ILE 98 HB ILE 98 -0.606 3.383 -4.442 742 HG12 ILE 98 HG12 ILE 98 0.648 0.828 -3.399 743 HG13 ILE 98 HG13 ILE 98 1.455 2.376 -3.621 744 HG21 ILE 98 HG21 ILE 98 -1.886 0.693 -3.936 745 HG22 ILE 98 HG22 ILE 98 -2.654 2.061 -4.742 746 HG23 ILE 98 HG23 ILE 98 -2.200 2.180 -3.041 747 HD11 ILE 98 HD11 ILE 98 -0.718 1.751 -1.632 748 HD12 ILE 98 HD12 ILE 98 -0.002 3.343 -1.881 749 HD13 ILE 98 HD13 ILE 98 0.993 2.013 -1.291 750 HA PRO 99 HA PRO 99 -2.917 1.805 -9.062 751 HB2 PRO 99 HB2 PRO 99 -4.663 -0.162 -7.673 752 HB3 PRO 99 HB3 PRO 99 -4.134 -0.120 -9.359 753 HG2 PRO 99 HG2 PRO 99 -3.102 -1.898 -7.665 754 HG3 PRO 99 HG3 PRO 99 -2.079 -1.105 -8.878 755 HD2 PRO 99 HD2 PRO 99 -2.343 -0.512 -5.946 756 HD3 PRO 99 HD3 PRO 99 -0.879 -0.587 -6.952 757 H MET 100 H MET 100 -4.333 3.461 -9.100 758 HA MET 100 HA MET 100 -5.097 4.856 -6.803 759 HB2 MET 100 HB2 MET 100 -4.944 5.612 -9.299 760 HB3 MET 100 HB3 MET 100 -6.619 5.101 -9.389 761 HG2 MET 100 HG2 MET 100 -5.472 7.253 -7.619 762 HG3 MET 100 HG3 MET 100 -6.505 7.475 -9.025 763 HE1 MET 100 HE1 MET 100 -7.766 6.528 -4.754 764 HE2 MET 100 HE2 MET 100 -6.465 7.584 -5.294 765 HE3 MET 100 HE3 MET 100 -6.309 5.837 -5.467 766 H GLY 101 H GLY 101 -6.362 3.950 -5.271 767 HA2 GLY 101 HA2 GLY 101 -9.125 3.328 -5.930 768 HA3 GLY 101 HA3 GLY 101 -8.184 1.943 -5.397 769 HA PRO 102 HA PRO 102 -10.228 4.165 -1.733 770 HB2 PRO 102 HB2 PRO 102 -10.944 1.755 -0.534 771 HB3 PRO 102 HB3 PRO 102 -12.002 2.748 -1.539 772 HG2 PRO 102 HG2 PRO 102 -10.412 0.324 -2.281 773 HG3 PRO 102 HG3 PRO 102 -12.048 0.792 -2.785 774 HD2 PRO 102 HD2 PRO 102 -9.942 1.106 -4.419 775 HD3 PRO 102 HD3 PRO 102 -11.260 2.295 -4.382 776 H TYR 103 H TYR 103 -8.118 1.326 -1.965 777 HA TYR 103 HA TYR 103 -6.970 1.496 0.606 778 HB2 TYR 103 HB2 TYR 103 -5.814 0.424 -1.988 779 HB3 TYR 103 HB3 TYR 103 -5.105 0.165 -0.397 780 HD1 TYR 103 HD2 TYR 103 -8.233 -0.421 -2.355 781 HD2 TYR 103 HD1 TYR 103 -5.781 -1.684 0.892 782 HE1 TYR 103 HE2 TYR 103 -9.669 -2.389 -2.037 783 HE2 TYR 103 HE1 TYR 103 -7.206 -3.659 1.211 784 HH TYR 103 HH TYR 103 -9.290 -4.797 -0.999 785 H ALA 104 H ALA 104 -5.819 2.752 -2.531 786 HA ALA 104 HA ALA 104 -3.628 4.208 -1.584 787 HB1 ALA 104 HB1 ALA 104 -3.762 5.456 -3.690 788 HB2 ALA 104 HB2 ALA 104 -5.373 4.797 -3.979 789 HB3 ALA 104 HB3 ALA 104 -3.974 3.725 -3.949 790 H ASN 105 H ASN 105 -7.026 5.205 -1.952 791 HA ASN 105 HA ASN 105 -6.840 7.911 -1.370 792 HB2 ASN 105 HB2 ASN 105 -9.001 5.912 -0.702 793 HB3 ASN 105 HB3 ASN 105 -9.183 7.635 -0.401 794 HD21 ASN 105 HD21 ASN 105 -10.624 5.822 -2.169 795 HD22 ASN 105 HD22 ASN 105 -10.533 6.533 -3.741 796 H MET 106 H MET 106 -6.604 5.196 0.809 797 HA MET 106 HA MET 106 -6.989 6.557 3.265 798 HB2 MET 106 HB2 MET 106 -5.352 4.081 2.671 799 HB3 MET 106 HB3 MET 106 -5.846 4.608 4.275 800 HG2 MET 106 HG2 MET 106 -7.799 3.964 2.082 801 HG3 MET 106 HG3 MET 106 -7.219 2.772 3.243 802 HE1 MET 106 HE1 MET 106 -7.072 4.010 5.969 803 HE2 MET 106 HE2 MET 106 -8.023 2.555 5.667 804 HE3 MET 106 HE3 MET 106 -8.720 3.889 6.587 805 H VAL 107 H VAL 107 -4.289 6.533 1.089 806 HA VAL 107 HA VAL 107 -2.589 7.776 3.159 807 HB VAL 107 HB VAL 107 -0.610 6.674 2.153 808 HG11 VAL 107 HG11 VAL 107 -1.667 5.734 4.142 809 HG12 VAL 107 HG12 VAL 107 -1.012 4.459 3.115 810 HG13 VAL 107 HG13 VAL 107 -2.748 4.774 3.129 811 HG21 VAL 107 HG21 VAL 107 -0.929 4.748 0.651 812 HG22 VAL 107 HG22 VAL 107 -1.473 6.254 -0.086 813 HG23 VAL 107 HG23 VAL 107 -2.653 5.112 0.557 814 H ILE 108 H ILE 108 -3.905 8.085 0.027 815 HA ILE 108 HA ILE 108 -1.832 10.039 -0.740 816 HB ILE 108 HB ILE 108 -2.397 9.803 -2.989 817 HG12 ILE 108 HG12 ILE 108 -4.816 8.118 -2.309 818 HG13 ILE 108 HG13 ILE 108 -4.909 9.861 -2.558 819 HG21 ILE 108 HG21 ILE 108 -1.126 7.899 -2.258 820 HG22 ILE 108 HG22 ILE 108 -2.332 7.340 -3.424 821 HG23 ILE 108 HG23 ILE 108 -2.585 7.078 -1.701 822 HD11 ILE 108 HD11 ILE 108 -4.057 7.777 -4.527 823 HD12 ILE 108 HD12 ILE 108 -3.881 9.513 -4.787 824 HD13 ILE 108 HD13 ILE 108 -5.490 8.807 -4.591 825 H ASP 109 H ASP 109 -2.877 11.797 -2.283 826 HA ASP 109 HA ASP 109 -5.203 12.953 -0.897 827 HB2 ASP 109 HB2 ASP 109 -3.278 14.421 -0.902 828 HB3 ASP 109 HB3 ASP 109 -3.100 14.252 -2.647 829 HA PRO 110 HA PRO 110 -7.257 11.661 -4.727 830 HB2 PRO 110 HB2 PRO 110 -9.770 11.650 -3.784 831 HB3 PRO 110 HB3 PRO 110 -8.602 10.408 -3.313 832 HG2 PRO 110 HG2 PRO 110 -9.475 12.852 -1.809 833 HG3 PRO 110 HG3 PRO 110 -9.237 11.199 -1.213 834 HD2 PRO 110 HD2 PRO 110 -7.380 13.210 -0.938 835 HD3 PRO 110 HD3 PRO 110 -6.970 11.483 -0.975 836 H SER 111 H SER 111 -6.856 14.659 -3.634 837 HA SER 111 HA SER 111 -9.144 16.004 -4.778 838 HB2 SER 111 HB2 SER 111 -6.514 17.220 -3.889 839 HB3 SER 111 HB3 SER 111 -8.040 18.067 -4.143 840 HG SER 111 HG SER 111 -7.156 16.896 -1.931 841 H THR 112 H THR 112 -6.163 14.830 -5.987 842 HA THR 112 HA THR 112 -6.214 16.646 -8.299 843 HB THR 112 HB THR 112 -4.021 16.429 -7.377 844 HG1 THR 112 HG1 THR 112 -3.072 15.053 -9.291 845 HG21 THR 112 HG21 THR 112 -4.281 14.321 -6.163 846 HG22 THR 112 HG22 THR 112 -2.844 14.275 -7.184 847 HG23 THR 112 HG23 THR 112 -4.308 13.431 -7.685 848 H ASP 113 H ASP 113 -7.560 16.033 -9.876 849 HA ASP 113 HA ASP 113 -8.211 13.292 -10.412 850 HB2 ASP 113 HB2 ASP 113 -8.874 15.871 -11.838 851 HB3 ASP 113 HB3 ASP 113 -9.407 14.299 -12.425 852 H GLY 114 H GLY 114 -5.975 12.568 -10.720 853 HA2 GLY 114 HA2 GLY 114 -4.375 11.669 -12.098 854 HA3 GLY 114 HA3 GLY 114 -5.460 12.011 -13.432 855 H THR 115 H THR 115 -3.323 12.317 -14.507 856 HA THR 115 HA THR 115 -2.582 15.168 -14.404 857 HB THR 115 HB THR 115 -0.199 14.605 -14.812 858 HG1 THR 115 HG1 THR 115 -0.449 12.006 -13.892 859 HG21 THR 115 HG21 THR 115 -0.904 15.107 -12.522 860 HG22 THR 115 HG22 THR 115 0.366 13.882 -12.526 861 HG23 THR 115 HG23 THR 115 -1.312 13.409 -12.264 862 H GLY 116 H GLY 116 -1.913 12.178 -16.240 863 HA2 GLY 116 HA2 GLY 116 -2.787 11.944 -18.519 864 HA3 GLY 116 HA3 GLY 116 -2.494 13.662 -18.742 865 H MET 117 H MET 117 -1.302 10.632 -19.416 866 HA MET 117 HA MET 117 0.648 9.802 -20.237 867 HB2 MET 117 HB2 MET 117 1.523 12.704 -20.367 868 HB3 MET 117 HB3 MET 117 2.353 11.358 -21.137 869 HG2 MET 117 HG2 MET 117 0.382 10.941 -22.530 870 HG3 MET 117 HG3 MET 117 -0.446 12.292 -21.758 871 HE1 MET 117 HE1 MET 117 3.291 12.729 -24.433 872 HE2 MET 117 HE2 MET 117 2.474 11.195 -24.131 873 HE3 MET 117 HE3 MET 117 3.335 12.008 -22.824 874 HA PRO 118 HA PRO 118 3.319 8.945 -16.846 875 HB2 PRO 118 HB2 PRO 118 5.708 9.247 -18.607 876 HB3 PRO 118 HB3 PRO 118 5.201 7.869 -17.621 877 HG2 PRO 118 HG2 PRO 118 4.911 7.817 -20.267 878 HG3 PRO 118 HG3 PRO 118 3.665 7.135 -19.206 879 HD2 PRO 118 HD2 PRO 118 3.683 9.748 -20.676 880 HD3 PRO 118 HD3 PRO 118 2.345 8.606 -20.424 881 H GLN 119 H GLN 119 3.021 10.864 -15.615 882 HA GLN 119 HA GLN 119 5.215 12.830 -15.817 883 HB2 GLN 119 HB2 GLN 119 2.443 13.144 -14.645 884 HB3 GLN 119 HB3 GLN 119 3.711 14.360 -14.526 885 HG2 GLN 119 HG2 GLN 119 3.785 14.462 -17.003 886 HG3 GLN 119 HG3 GLN 119 2.426 13.340 -17.055 887 HE21 GLN 119 HE21 GLN 119 1.125 14.836 -18.102 888 HE22 GLN 119 HE22 GLN 119 0.470 16.221 -17.307 889 H PHE 120 H PHE 120 3.738 10.482 -13.716 890 HA PHE 120 HA PHE 120 4.343 9.607 -11.691 891 HB2 PHE 120 HB2 PHE 120 6.941 11.088 -12.207 892 HB3 PHE 120 HB3 PHE 120 6.704 9.836 -10.993 893 HD1 PHE 120 HD1 PHE 120 6.321 7.491 -11.695 894 HD2 PHE 120 HD2 PHE 120 7.280 10.545 -14.510 895 HE1 PHE 120 HE1 PHE 120 6.923 5.776 -13.350 896 HE2 PHE 120 HE2 PHE 120 7.882 8.829 -16.167 897 HZ PHE 120 HZ PHE 120 7.703 6.443 -15.588 898 H LYS 121 H LYS 121 5.947 10.658 -9.609 899 HA LYS 121 HA LYS 121 6.081 12.126 -7.895 900 HB2 LYS 121 HB2 LYS 121 4.546 14.028 -9.657 901 HB3 LYS 121 HB3 LYS 121 5.286 14.435 -8.112 902 HG2 LYS 121 HG2 LYS 121 7.374 13.277 -9.468 903 HG3 LYS 121 HG3 LYS 121 6.507 14.119 -10.753 904 HD2 LYS 121 HD2 LYS 121 8.166 15.594 -9.835 905 HD3 LYS 121 HD3 LYS 121 6.569 16.176 -9.371 906 HE2 LYS 121 HE2 LYS 121 6.820 15.230 -7.157 907 HE3 LYS 121 HE3 LYS 121 8.364 14.508 -7.610 908 HZ1 LYS 121 HZ1 LYS 121 7.814 17.422 -7.541 909 HZ2 LYS 121 HZ2 LYS 121 9.304 16.689 -7.867 910 HZ3 LYS 121 HZ3 LYS 121 8.615 16.560 -6.329 911 H GLY 122 H GLY 122 4.982 11.003 -6.398 912 HA2 GLY 122 HA2 GLY 122 2.046 11.342 -6.238 913 HA3 GLY 122 HA3 GLY 122 2.921 9.954 -5.633 914 H VAL 123 H VAL 123 1.778 10.273 -3.640 915 HA VAL 123 HA VAL 123 2.457 12.622 -2.025 916 HB VAL 123 HB VAL 123 0.686 10.250 -1.371 917 HG11 VAL 123 HG11 VAL 123 -0.196 11.674 0.443 918 HG12 VAL 123 HG12 VAL 123 1.030 12.886 0.064 919 HG13 VAL 123 HG13 VAL 123 1.515 11.294 0.652 920 HG21 VAL 123 HG21 VAL 123 -1.195 11.790 -1.800 921 HG22 VAL 123 HG22 VAL 123 -0.220 11.501 -3.241 922 HG23 VAL 123 HG23 VAL 123 -0.048 13.014 -2.350 923 H LYS 124 H LYS 124 3.903 12.592 -0.348 924 HA LYS 124 HA LYS 124 5.662 10.341 -0.085 925 HB2 LYS 124 HB2 LYS 124 5.530 13.038 1.234 926 HB3 LYS 124 HB3 LYS 124 6.629 11.808 1.840 927 HG2 LYS 124 HG2 LYS 124 7.830 13.249 0.360 928 HG3 LYS 124 HG3 LYS 124 7.658 11.672 -0.408 929 HD2 LYS 124 HD2 LYS 124 5.756 12.562 -1.727 930 HD3 LYS 124 HD3 LYS 124 6.027 14.147 -0.997 931 HE2 LYS 124 HE2 LYS 124 7.991 12.608 -2.697 932 HE3 LYS 124 HE3 LYS 124 7.044 14.003 -3.210 933 HZ1 LYS 124 HZ1 LYS 124 8.226 15.397 -1.725 934 HZ2 LYS 124 HZ2 LYS 124 9.383 14.491 -2.563 935 HZ3 LYS 124 HZ3 LYS 124 8.987 14.088 -0.974 936 H GLY 125 H GLY 125 5.914 8.883 1.535 937 HA2 GLY 125 HA2 GLY 125 4.696 9.125 4.110 938 HA3 GLY 125 HA3 GLY 125 3.815 8.000 3.088 939 H THR 126 H THR 126 4.451 6.501 4.871 940 HA THR 126 HA THR 126 7.136 5.362 4.379 941 HB THR 126 HB THR 126 7.096 4.485 6.700 942 HG1 THR 126 HG1 THR 126 5.355 5.979 7.920 943 HG21 THR 126 HG21 THR 126 7.538 6.598 7.851 944 HG22 THR 126 HG22 THR 126 6.749 7.487 6.550 945 HG23 THR 126 HG23 THR 126 8.244 6.606 6.235 946 H VAL 127 H VAL 127 7.317 3.072 4.456 947 HA VAL 127 HA VAL 127 4.783 1.552 4.562 948 HB VAL 127 HB VAL 127 5.594 1.761 2.204 949 HG11 VAL 127 HG11 VAL 127 7.612 0.564 1.502 950 HG12 VAL 127 HG12 VAL 127 7.977 0.181 3.186 951 HG13 VAL 127 HG13 VAL 127 7.994 1.860 2.638 952 HG21 VAL 127 HG21 VAL 127 4.239 -0.158 2.861 953 HG22 VAL 127 HG22 VAL 127 5.691 -1.039 3.338 954 HG23 VAL 127 HG23 VAL 127 5.429 -0.621 1.643 955 H GLU 128 H GLU 128 4.925 -0.471 5.631 956 HA GLU 128 HA GLU 128 7.525 -1.177 6.790 957 HB2 GLU 128 HB2 GLU 128 6.472 -1.330 9.068 958 HB3 GLU 128 HB3 GLU 128 6.647 0.305 8.445 959 HG2 GLU 128 HG2 GLU 128 4.316 0.410 7.884 960 HG3 GLU 128 HG3 GLU 128 4.093 -1.289 8.298 961 H LYS 129 H LYS 129 7.805 -3.288 7.367 962 HA LYS 129 HA LYS 129 5.832 -5.265 6.674 963 HB2 LYS 129 HB2 LYS 129 8.032 -6.025 6.368 964 HB3 LYS 129 HB3 LYS 129 8.583 -5.355 7.893 965 HG2 LYS 129 HG2 LYS 129 8.485 -7.836 7.859 966 HG3 LYS 129 HG3 LYS 129 7.512 -7.107 9.134 967 HD2 LYS 129 HD2 LYS 129 6.256 -8.907 8.144 968 HD3 LYS 129 HD3 LYS 129 5.504 -7.382 7.685 969 HE2 LYS 129 HE2 LYS 129 5.530 -8.769 5.764 970 HE3 LYS 129 HE3 LYS 129 6.745 -7.516 5.524 971 HZ1 LYS 129 HZ1 LYS 129 7.446 -9.787 4.874 972 HZ2 LYS 129 HZ2 LYS 129 7.373 -10.246 6.502 973 HZ3 LYS 129 HZ3 LYS 129 8.471 -9.062 6.009 974 H THR 130 H THR 130 4.082 -5.557 7.893 975 HA THR 130 HA THR 130 4.313 -5.231 10.823 976 HB THR 130 HB THR 130 3.133 -3.310 9.896 977 HG1 THR 130 HG1 THR 130 1.840 -3.412 11.563 978 HG21 THR 130 HG21 THR 130 1.151 -5.313 8.789 979 HG22 THR 130 HG22 THR 130 2.279 -4.346 7.836 980 HG23 THR 130 HG23 THR 130 0.987 -3.557 8.743 981 H ASP 131 H ASP 131 2.627 -6.286 12.075 982 HA ASP 131 HA ASP 131 2.182 -9.013 11.241 983 HB2 ASP 131 HB2 ASP 131 2.846 -8.469 13.539 984 HB3 ASP 131 HB3 ASP 131 1.393 -7.497 13.745 985 H GLU 132 H GLU 132 0.493 -6.127 10.886 986 HA GLU 132 HA GLU 132 -2.185 -6.805 11.362 987 HB2 GLU 132 HB2 GLU 132 -1.081 -4.847 9.339 988 HB3 GLU 132 HB3 GLU 132 -2.727 -4.868 9.959 989 HG2 GLU 132 HG2 GLU 132 -0.382 -4.560 11.794 990 HG3 GLU 132 HG3 GLU 132 -1.055 -3.183 10.935 991 H LYS 133 H LYS 133 -3.911 -7.105 9.850 992 HA LYS 133 HA LYS 133 -3.232 -8.863 7.597 993 HB2 LYS 133 HB2 LYS 133 -5.559 -9.500 7.596 994 HB3 LYS 133 HB3 LYS 133 -4.982 -9.535 9.258 995 HG2 LYS 133 HG2 LYS 133 -6.059 -7.441 9.745 996 HG3 LYS 133 HG3 LYS 133 -6.493 -7.220 8.051 997 HD2 LYS 133 HD2 LYS 133 -7.886 -9.303 8.224 998 HD3 LYS 133 HD3 LYS 133 -7.564 -9.302 9.960 999 HE2 LYS 133 HE2 LYS 133 -8.584 -7.076 10.143 1000 HE3 LYS 133 HE3 LYS 133 -8.908 -7.083 8.411 1001 HZ1 LYS 133 HZ1 LYS 133 -10.071 -8.894 10.451 1002 HZ2 LYS 133 HZ2 LYS 133 -10.290 -9.078 8.783 1003 HZ3 LYS 133 HZ3 LYS 133 -10.876 -7.698 9.561 1004 H VAL 134 H VAL 134 -4.295 -8.548 5.497 1005 HA VAL 134 HA VAL 134 -4.377 -5.824 4.621 1006 HB VAL 134 HB VAL 134 -5.205 -8.378 3.211 1007 HG11 VAL 134 HG11 VAL 134 -4.945 -5.585 2.076 1008 HG12 VAL 134 HG12 VAL 134 -6.442 -6.497 2.264 1009 HG13 VAL 134 HG13 VAL 134 -5.208 -7.053 1.134 1010 HG21 VAL 134 HG21 VAL 134 -2.817 -8.232 3.682 1011 HG22 VAL 134 HG22 VAL 134 -2.753 -6.634 2.936 1012 HG23 VAL 134 HG23 VAL 134 -3.118 -8.052 1.952 1013 H LEU 135 H LEU 135 -6.096 -4.494 4.306 1014 HA LEU 135 HA LEU 135 -8.592 -5.140 5.564 1015 HB2 LEU 135 HB2 LEU 135 -7.493 -2.757 4.134 1016 HB3 LEU 135 HB3 LEU 135 -9.232 -2.868 4.333 1017 HG LEU 135 HG LEU 135 -7.209 -2.872 6.586 1018 HD11 LEU 135 HD11 LEU 135 -9.168 -0.737 5.731 1019 HD12 LEU 135 HD12 LEU 135 -7.427 -0.689 5.461 1020 HD13 LEU 135 HD13 LEU 135 -8.064 -0.659 7.104 1021 HD21 LEU 135 HD21 LEU 135 -10.232 -2.917 6.605 1022 HD22 LEU 135 HD22 LEU 135 -9.212 -2.663 8.025 1023 HD23 LEU 135 HD23 LEU 135 -9.151 -4.198 7.160 1024 H SER 136 H SER 136 -10.401 -5.996 4.678 1025 HA SER 136 HA SER 136 -10.599 -6.556 1.866 1026 HB2 SER 136 HB2 SER 136 -11.749 -7.965 3.554 1027 HB3 SER 136 HB3 SER 136 -12.784 -6.603 3.979 1028 HG SER 136 HG SER 136 -13.092 -8.387 2.014 1029 H VAL 137 H VAL 137 -12.049 -5.551 0.353 1030 HA VAL 137 HA VAL 137 -11.783 -2.841 0.161 1031 HB VAL 137 HB VAL 137 -14.006 -4.512 -1.037 1032 HG11 VAL 137 HG11 VAL 137 -14.189 -2.730 -2.734 1033 HG12 VAL 137 HG12 VAL 137 -13.036 -1.756 -1.824 1034 HG13 VAL 137 HG13 VAL 137 -14.604 -2.146 -1.123 1035 HG21 VAL 137 HG21 VAL 137 -11.766 -5.293 -1.626 1036 HG22 VAL 137 HG22 VAL 137 -11.322 -3.666 -2.148 1037 HG23 VAL 137 HG23 VAL 137 -12.559 -4.568 -3.027 1038 H LYS 138 H LYS 138 -14.789 -4.454 1.276 1039 HA LYS 138 HA LYS 138 -16.028 -1.958 1.928 1040 HB2 LYS 138 HB2 LYS 138 -17.236 -4.132 1.368 1041 HB3 LYS 138 HB3 LYS 138 -16.872 -4.646 3.012 1042 HG2 LYS 138 HG2 LYS 138 -18.056 -2.619 3.846 1043 HG3 LYS 138 HG3 LYS 138 -18.513 -2.253 2.183 1044 HD2 LYS 138 HD2 LYS 138 -20.368 -3.358 3.198 1045 HD3 LYS 138 HD3 LYS 138 -19.619 -4.512 2.089 1046 HE2 LYS 138 HE2 LYS 138 -18.480 -5.589 3.947 1047 HE3 LYS 138 HE3 LYS 138 -19.145 -4.404 5.072 1048 HZ1 LYS 138 HZ1 LYS 138 -20.417 -6.422 5.160 1049 HZ2 LYS 138 HZ2 LYS 138 -20.685 -6.388 3.492 1050 HZ3 LYS 138 HZ3 LYS 138 -21.374 -5.200 4.482 1051 H GLU 139 H GLU 139 -14.173 -4.334 3.799 1052 HA GLU 139 HA GLU 139 -14.755 -3.369 6.380 1053 HB2 GLU 139 HB2 GLU 139 -13.654 -5.522 5.980 1054 HB3 GLU 139 HB3 GLU 139 -12.242 -4.702 5.332 1055 HG2 GLU 139 HG2 GLU 139 -11.728 -3.763 7.488 1056 HG3 GLU 139 HG3 GLU 139 -13.227 -4.399 8.165 1057 H LEU 140 H LEU 140 -12.406 -2.407 3.964 1058 HA LEU 140 HA LEU 140 -11.044 -0.391 5.317 1059 HB2 LEU 140 HB2 LEU 140 -10.733 -1.465 2.974 1060 HB3 LEU 140 HB3 LEU 140 -11.853 -0.231 2.424 1061 HG LEU 140 HG LEU 140 -9.361 0.488 3.931 1062 HD11 LEU 140 HD11 LEU 140 -8.227 0.792 1.799 1063 HD12 LEU 140 HD12 LEU 140 -9.629 0.136 0.951 1064 HD13 LEU 140 HD13 LEU 140 -8.693 -0.892 2.037 1065 HD21 LEU 140 HD21 LEU 140 -11.093 1.979 1.959 1066 HD22 LEU 140 HD22 LEU 140 -9.619 2.604 2.702 1067 HD23 LEU 140 HD23 LEU 140 -11.024 2.243 3.704 1068 H LEU 141 H LEU 141 -14.099 -0.299 3.477 1069 HA LEU 141 HA LEU 141 -14.652 2.448 3.796 1070 HB2 LEU 141 HB2 LEU 141 -16.722 0.246 3.648 1071 HB3 LEU 141 HB3 LEU 141 -16.925 1.926 3.185 1072 HG LEU 141 HG LEU 141 -15.287 -0.174 1.760 1073 HD11 LEU 141 HD11 LEU 141 -17.672 -0.325 1.348 1074 HD12 LEU 141 HD12 LEU 141 -16.834 0.253 -0.091 1075 HD13 LEU 141 HD13 LEU 141 -17.729 1.388 0.921 1076 HD21 LEU 141 HD21 LEU 141 -14.071 1.926 1.683 1077 HD22 LEU 141 HD22 LEU 141 -15.517 2.771 1.130 1078 HD23 LEU 141 HD23 LEU 141 -14.758 1.553 0.103 1079 H GLU 142 H GLU 142 -15.480 -0.368 5.782 1080 HA GLU 142 HA GLU 142 -16.934 0.982 7.789 1081 HB2 GLU 142 HB2 GLU 142 -15.292 -1.561 8.000 1082 HB3 GLU 142 HB3 GLU 142 -16.502 -1.029 9.162 1083 HG2 GLU 142 HG2 GLU 142 -18.246 -1.234 7.465 1084 HG3 GLU 142 HG3 GLU 142 -17.042 -1.723 6.274 1085 H ALA 143 H ALA 143 -13.483 0.418 7.344 1086 HA ALA 143 HA ALA 143 -12.604 1.329 9.874 1087 HB1 ALA 143 HB1 ALA 143 -11.127 1.365 7.242 1088 HB2 ALA 143 HB2 ALA 143 -11.190 0.013 8.374 1089 HB3 ALA 143 HB3 ALA 143 -10.401 1.519 8.843 1090 H ILE 144 H ILE 144 -13.279 3.048 6.846 1091 HA ILE 144 HA ILE 144 -12.457 5.593 7.991 1092 HB ILE 144 HB ILE 144 -12.978 6.594 5.870 1093 HG12 ILE 144 HG12 ILE 144 -13.958 3.853 5.034 1094 HG13 ILE 144 HG13 ILE 144 -14.976 5.251 5.348 1095 HG21 ILE 144 HG21 ILE 144 -10.810 5.514 6.131 1096 HG22 ILE 144 HG22 ILE 144 -11.383 5.380 4.469 1097 HG23 ILE 144 HG23 ILE 144 -11.487 3.991 5.551 1098 HD11 ILE 144 HD11 ILE 144 -14.648 4.950 2.975 1099 HD12 ILE 144 HD12 ILE 144 -12.901 5.023 3.197 1100 HD13 ILE 144 HD13 ILE 144 -13.890 6.444 3.523 1101 H GLY 145 H GLY 145 -15.334 3.745 7.797 1102 HA2 GLY 145 HA2 GLY 145 -17.196 4.308 9.195 1103 HA3 GLY 145 HA3 GLY 145 -16.836 6.008 8.951 1104 H SER 146 H SER 146 -16.555 4.779 5.948 1105 HA SER 146 HA SER 146 -19.319 5.529 5.272 1106 HB2 SER 146 HB2 SER 146 -17.665 6.811 4.073 1107 HB3 SER 146 HB3 SER 146 -16.828 5.344 3.560 1108 HG SER 146 HG SER 146 -18.634 6.582 2.206 Start of MODEL 14 1 H1 MET 1 H1 MET 1 46.032 -0.695 23.070 2 H2 MET 1 H2 MET 1 45.042 0.521 23.695 3 H3 MET 1 H3 MET 1 45.820 0.745 22.209 4 HA MET 1 HA MET 1 44.554 -1.065 21.237 5 HB2 MET 1 HB2 MET 1 43.165 -1.084 23.931 6 HB3 MET 1 HB3 MET 1 42.598 -1.950 22.507 7 HG2 MET 1 HG2 MET 1 45.182 -2.413 23.988 8 HG3 MET 1 HG3 MET 1 43.767 -3.464 23.965 9 HE1 MET 1 HE1 MET 1 42.951 -4.799 21.756 10 HE2 MET 1 HE2 MET 1 43.746 -4.625 20.191 11 HE3 MET 1 HE3 MET 1 42.891 -3.256 20.903 12 H GLY 2 H GLY 2 43.199 1.398 23.463 13 HA2 GLY 2 HA2 GLY 2 42.380 3.209 21.574 14 HA3 GLY 2 HA3 GLY 2 41.056 2.057 21.655 15 H SER 3 H SER 3 42.146 4.939 22.826 16 HA SER 3 HA SER 3 40.911 4.745 25.463 17 HB2 SER 3 HB2 SER 3 41.611 7.116 25.708 18 HB3 SER 3 HB3 SER 3 42.958 6.072 25.256 19 HG SER 3 HG SER 3 41.450 7.732 23.504 20 H SER 4 H SER 4 38.719 4.556 25.246 21 HA SER 4 HA SER 4 37.113 5.737 23.276 22 HB2 SER 4 HB2 SER 4 36.286 4.889 26.069 23 HB3 SER 4 HB3 SER 4 35.203 5.145 24.705 24 HG SER 4 HG SER 4 36.289 2.907 25.360 25 H HIS 5 H HIS 5 36.485 7.775 22.965 26 HA HIS 5 HA HIS 5 36.779 9.761 25.097 27 HB2 HIS 5 HB2 HIS 5 36.068 10.158 22.176 28 HB3 HIS 5 HB3 HIS 5 36.480 11.425 23.328 29 HD1 HIS 5 HD1 HIS 5 37.968 8.991 21.001 30 HD2 HIS 5 HD2 HIS 5 39.261 11.435 24.102 31 HE1 HIS 5 HE1 HIS 5 40.466 9.071 20.793 32 HE2 HIS 5 HE2 HIS 5 41.213 10.685 22.572 33 H HIS 6 H HIS 6 35.048 11.273 25.603 34 HA HIS 6 HA HIS 6 32.344 10.231 25.030 35 HB2 HIS 6 HB2 HIS 6 33.341 11.214 27.719 36 HB3 HIS 6 HB3 HIS 6 31.690 10.723 27.356 37 HD1 HIS 6 HD1 HIS 6 35.026 9.385 28.219 38 HD2 HIS 6 HD2 HIS 6 31.349 7.917 26.974 39 HE1 HIS 6 HE1 HIS 6 35.115 6.916 28.643 40 HE2 HIS 6 HE2 HIS 6 32.806 6.090 28.081 41 H HIS 7 H HIS 7 30.774 11.706 24.614 42 HA HIS 7 HA HIS 7 31.483 14.567 24.760 43 HB2 HIS 7 HB2 HIS 7 29.771 14.804 22.862 44 HB3 HIS 7 HB3 HIS 7 31.312 14.052 22.465 45 HD1 HIS 7 HD1 HIS 7 31.297 11.524 21.915 46 HD2 HIS 7 HD2 HIS 7 27.532 13.123 22.629 47 HE1 HIS 7 HE1 HIS 7 29.668 9.784 21.132 48 HE2 HIS 7 HE2 HIS 7 27.405 10.703 21.724 49 H HIS 8 H HIS 8 30.473 15.529 26.381 50 HA HIS 8 HA HIS 8 28.211 14.377 27.701 51 HB2 HIS 8 HB2 HIS 8 28.410 16.224 29.269 52 HB3 HIS 8 HB3 HIS 8 30.005 15.578 28.907 53 HD1 HIS 8 HD1 HIS 8 28.967 18.610 29.795 54 HD2 HIS 8 HD2 HIS 8 30.654 17.356 26.213 55 HE1 HIS 8 HE1 HIS 8 29.945 20.671 28.755 56 HE2 HIS 8 HE2 HIS 8 30.789 19.916 26.509 57 H HIS 9 H HIS 9 26.165 15.340 28.127 58 HA HIS 9 HA HIS 9 25.298 17.545 26.361 59 HB2 HIS 9 HB2 HIS 9 23.742 15.001 26.918 60 HB3 HIS 9 HB3 HIS 9 23.113 16.397 26.054 61 HD1 HIS 9 HD1 HIS 9 25.462 13.510 25.687 62 HD2 HIS 9 HD2 HIS 9 23.904 16.593 23.384 63 HE1 HIS 9 HE1 HIS 9 26.065 12.951 23.323 64 HE2 HIS 9 HE2 HIS 9 24.920 14.701 21.939 65 H HIS 10 H HIS 10 23.009 18.312 27.133 66 HA HIS 10 HA HIS 10 23.113 18.774 30.008 67 HB2 HIS 10 HB2 HIS 10 21.318 19.843 27.823 68 HB3 HIS 10 HB3 HIS 10 21.099 20.239 29.525 69 HD1 HIS 10 HD1 HIS 10 22.624 21.993 30.524 70 HD2 HIS 10 HD2 HIS 10 23.677 20.964 26.642 71 HE1 HIS 10 HE1 HIS 10 24.296 23.716 29.804 72 HE2 HIS 10 HE2 HIS 10 24.813 23.158 27.411 73 H SER 11 H SER 11 21.110 18.561 31.326 74 HA SER 11 HA SER 11 20.017 15.917 31.055 75 HB2 SER 11 HB2 SER 11 19.274 18.093 33.036 76 HB3 SER 11 HB3 SER 11 18.848 16.387 33.162 77 HG SER 11 HG SER 11 20.799 15.939 33.851 78 H SER 12 H SER 12 18.874 16.098 29.027 79 HA SER 12 HA SER 12 16.382 17.659 29.121 80 HB2 SER 12 HB2 SER 12 16.147 17.155 26.742 81 HB3 SER 12 HB3 SER 12 17.753 17.813 27.058 82 HG SER 12 HG SER 12 18.109 16.071 25.801 83 H GLY 13 H GLY 13 14.498 16.368 27.896 84 HA2 GLY 13 HA2 GLY 13 14.196 13.869 29.455 85 HA3 GLY 13 HA3 GLY 13 12.882 14.962 29.062 86 H ARG 14 H ARG 14 15.095 14.326 26.483 87 HA ARG 14 HA ARG 14 12.993 13.104 24.965 88 HB2 ARG 14 HB2 ARG 14 15.751 14.027 24.367 89 HB3 ARG 14 HB3 ARG 14 15.087 12.787 23.310 90 HG2 ARG 14 HG2 ARG 14 13.096 14.257 22.950 91 HG3 ARG 14 HG3 ARG 14 13.929 15.514 23.866 92 HD2 ARG 14 HD2 ARG 14 15.643 15.696 22.236 93 HD3 ARG 14 HD3 ARG 14 15.133 14.211 21.429 94 HE ARG 14 HE ARG 14 12.969 15.640 21.065 95 HH11 ARG 14 HH11 ARG 14 16.237 16.705 20.846 96 HH12 ARG 14 HH12 ARG 14 15.876 17.923 19.674 97 HH21 ARG 14 HH21 ARG 14 12.529 17.198 19.536 98 HH22 ARG 14 HH22 ARG 14 13.817 18.176 18.922 99 H GLU 15 H GLU 15 12.400 11.164 25.586 100 HA GLU 15 HA GLU 15 14.243 9.015 26.168 101 HB2 GLU 15 HB2 GLU 15 12.104 7.683 26.350 102 HB3 GLU 15 HB3 GLU 15 12.206 9.076 27.421 103 HG2 GLU 15 HG2 GLU 15 10.787 10.369 25.940 104 HG3 GLU 15 HG3 GLU 15 10.743 9.039 24.785 105 H ASN 16 H ASN 16 13.031 6.812 25.023 106 HA ASN 16 HA ASN 16 12.813 7.225 22.138 107 HB2 ASN 16 HB2 ASN 16 15.224 6.839 22.507 108 HB3 ASN 16 HB3 ASN 16 14.857 5.337 23.349 109 HD21 ASN 16 HD21 ASN 16 15.938 4.031 21.932 110 HD22 ASN 16 HD22 ASN 16 15.409 3.746 20.317 111 H LEU 17 H LEU 17 13.217 4.541 24.449 112 HA LEU 17 HA LEU 17 11.993 2.709 24.944 113 HB2 LEU 17 HB2 LEU 17 9.842 4.385 23.730 114 HB3 LEU 17 HB3 LEU 17 9.524 2.707 24.133 115 HG LEU 17 HG LEU 17 10.260 3.201 26.483 116 HD11 LEU 17 HD11 LEU 17 10.306 5.542 27.216 117 HD12 LEU 17 HD12 LEU 17 10.179 6.063 25.534 118 HD13 LEU 17 HD13 LEU 17 11.605 5.178 26.079 119 HD21 LEU 17 HD21 LEU 17 7.917 3.074 25.852 120 HD22 LEU 17 HD22 LEU 17 7.921 4.792 25.455 121 HD23 LEU 17 HD23 LEU 17 8.177 4.270 27.120 122 H TYR 18 H TYR 18 12.560 0.889 24.075 123 HA TYR 18 HA TYR 18 12.760 -0.898 22.721 124 HB2 TYR 18 HB2 TYR 18 10.624 0.461 21.065 125 HB3 TYR 18 HB3 TYR 18 11.170 -1.198 20.859 126 HD1 TYR 18 HD2 TYR 18 10.818 -2.839 22.758 127 HD2 TYR 18 HD1 TYR 18 8.969 0.998 22.675 128 HE1 TYR 18 HE2 TYR 18 9.181 -3.596 24.428 129 HE2 TYR 18 HE1 TYR 18 7.329 0.251 24.346 130 HH TYR 18 HH TYR 18 7.706 -2.603 26.137 131 H PHE 19 H PHE 19 13.348 -1.617 20.459 132 HA PHE 19 HA PHE 19 14.590 0.429 18.777 133 HB2 PHE 19 HB2 PHE 19 16.276 -0.280 20.526 134 HB3 PHE 19 HB3 PHE 19 16.196 -1.908 19.865 135 HD1 PHE 19 HD2 PHE 19 16.742 1.596 18.670 136 HD2 PHE 19 HD1 PHE 19 17.847 -2.509 18.366 137 HE1 PHE 19 HE2 PHE 19 18.501 2.190 17.055 138 HE2 PHE 19 HE1 PHE 19 19.608 -1.918 16.752 139 HZ PHE 19 HZ PHE 19 19.938 0.433 16.096 140 H GLN 20 H GLN 20 12.325 -1.217 18.337 141 HA GLN 20 HA GLN 20 13.251 -2.888 16.100 142 HB2 GLN 20 HB2 GLN 20 11.660 -4.665 16.700 143 HB3 GLN 20 HB3 GLN 20 12.851 -4.417 17.970 144 HG2 GLN 20 HG2 GLN 20 11.210 -3.121 19.252 145 HG3 GLN 20 HG3 GLN 20 10.016 -3.377 17.982 146 HE21 GLN 20 HE21 GLN 20 9.131 -5.440 17.713 147 HE22 GLN 20 HE22 GLN 20 9.239 -6.645 18.945 148 H GLY 21 H GLY 21 11.511 -3.418 14.542 149 HA2 GLY 21 HA2 GLY 21 9.609 -2.961 13.309 150 HA3 GLY 21 HA3 GLY 21 9.020 -1.979 14.639 151 H HIS 22 H HIS 22 11.405 -1.936 11.982 152 HA HIS 22 HA HIS 22 11.250 0.997 11.925 153 HB2 HIS 22 HB2 HIS 22 13.496 -0.027 11.944 154 HB3 HIS 22 HB3 HIS 22 13.128 -0.858 10.437 155 HD1 HIS 22 HD1 HIS 22 13.621 2.631 11.799 156 HD2 HIS 22 HD2 HIS 22 13.574 0.638 8.150 157 HE1 HIS 22 HE1 HIS 22 14.368 4.318 10.105 158 HE2 HIS 22 HE2 HIS 22 14.093 3.161 7.892 159 H MET 23 H MET 23 10.331 2.127 10.317 160 HA MET 23 HA MET 23 9.222 0.670 8.003 161 HB2 MET 23 HB2 MET 23 7.861 2.760 7.664 162 HB3 MET 23 HB3 MET 23 7.530 1.902 9.163 163 HG2 MET 23 HG2 MET 23 8.754 3.500 10.440 164 HG3 MET 23 HG3 MET 23 9.379 4.269 8.984 165 HE1 MET 23 HE1 MET 23 5.720 3.039 8.922 166 HE2 MET 23 HE2 MET 23 4.841 4.326 9.746 167 HE3 MET 23 HE3 MET 23 5.917 3.269 10.662 168 H LEU 24 H LEU 24 9.445 1.575 5.884 169 HA LEU 24 HA LEU 24 11.888 3.185 5.557 170 HB2 LEU 24 HB2 LEU 24 10.623 1.022 3.961 171 HB3 LEU 24 HB3 LEU 24 11.438 2.288 3.060 172 HG LEU 24 HG LEU 24 12.791 0.764 5.285 173 HD11 LEU 24 HD11 LEU 24 13.838 -0.617 3.582 174 HD12 LEU 24 HD12 LEU 24 12.881 0.169 2.327 175 HD13 LEU 24 HD13 LEU 24 12.086 -0.819 3.552 176 HD21 LEU 24 HD21 LEU 24 13.877 2.408 2.992 177 HD22 LEU 24 HD22 LEU 24 14.833 1.581 4.223 178 HD23 LEU 24 HD23 LEU 24 13.785 2.924 4.679 179 H GLU 25 H GLU 25 11.785 5.181 4.836 180 HA GLU 25 HA GLU 25 9.311 6.427 4.178 181 HB2 GLU 25 HB2 GLU 25 12.165 7.327 4.256 182 HB3 GLU 25 HB3 GLU 25 10.950 8.356 3.501 183 HG2 GLU 25 HG2 GLU 25 9.737 8.582 5.490 184 HG3 GLU 25 HG3 GLU 25 10.601 7.255 6.259 185 H VAL 26 H VAL 26 8.300 6.305 2.391 186 HA VAL 26 HA VAL 26 9.734 6.082 -0.181 187 HB VAL 26 HB VAL 26 8.146 4.368 -0.967 188 HG11 VAL 26 HG11 VAL 26 10.284 3.623 -0.072 189 HG12 VAL 26 HG12 VAL 26 9.018 2.461 0.324 190 HG13 VAL 26 HG13 VAL 26 9.609 3.574 1.559 191 HG21 VAL 26 HG21 VAL 26 7.154 4.340 1.889 192 HG22 VAL 26 HG22 VAL 26 6.673 3.213 0.622 193 HG23 VAL 26 HG23 VAL 26 6.258 4.921 0.485 194 H GLU 27 H GLU 27 8.485 6.723 -2.057 195 HA GLU 27 HA GLU 27 6.304 8.573 -1.391 196 HB2 GLU 27 HB2 GLU 27 8.198 9.415 -2.758 197 HB3 GLU 27 HB3 GLU 27 7.787 8.252 -4.013 198 HG2 GLU 27 HG2 GLU 27 5.655 9.325 -4.376 199 HG3 GLU 27 HG3 GLU 27 5.938 10.418 -3.022 200 H VAL 28 H VAL 28 4.274 7.973 -1.651 201 HA VAL 28 HA VAL 28 3.657 5.425 -2.930 202 HB VAL 28 HB VAL 28 1.840 7.218 -1.303 203 HG11 VAL 28 HG11 VAL 28 1.613 4.301 -2.057 204 HG12 VAL 28 HG12 VAL 28 0.626 5.626 -2.674 205 HG13 VAL 28 HG13 VAL 28 0.519 5.165 -0.974 206 HG21 VAL 28 HG21 VAL 28 2.336 5.741 0.601 207 HG22 VAL 28 HG22 VAL 28 3.777 6.586 0.034 208 HG23 VAL 28 HG23 VAL 28 3.532 4.890 -0.380 209 H ILE 29 H ILE 29 3.126 5.499 -5.055 210 HA ILE 29 HA ILE 29 1.798 7.890 -6.119 211 HB ILE 29 HB ILE 29 2.570 5.592 -7.876 212 HG12 ILE 29 HG12 ILE 29 4.537 7.624 -6.774 213 HG13 ILE 29 HG13 ILE 29 4.498 5.918 -6.346 214 HG21 ILE 29 HG21 ILE 29 1.423 7.510 -8.846 215 HG22 ILE 29 HG22 ILE 29 3.087 7.455 -9.433 216 HG23 ILE 29 HG23 ILE 29 2.629 8.607 -8.171 217 HD11 ILE 29 HD11 ILE 29 4.971 5.339 -8.676 218 HD12 ILE 29 HD12 ILE 29 6.235 6.330 -7.948 219 HD13 ILE 29 HD13 ILE 29 5.076 7.058 -9.064 220 H SER 30 H SER 30 -0.012 7.653 -7.640 221 HA SER 30 HA SER 30 -1.716 5.314 -7.043 222 HB2 SER 30 HB2 SER 30 -2.506 7.389 -5.902 223 HB3 SER 30 HB3 SER 30 -2.696 8.145 -7.484 224 HG SER 30 HG SER 30 -3.988 5.745 -6.691 225 H GLY 31 H GLY 31 -1.888 4.108 -8.818 226 HA2 GLY 31 HA2 GLY 31 -1.411 5.129 -11.457 227 HA3 GLY 31 HA3 GLY 31 -1.910 3.497 -11.047 228 H ARG 32 H ARG 32 -2.817 6.156 -12.728 229 HA ARG 32 HA ARG 32 -5.602 6.324 -12.017 230 HB2 ARG 32 HB2 ARG 32 -4.012 7.536 -14.280 231 HB3 ARG 32 HB3 ARG 32 -5.723 7.847 -14.029 232 HG2 ARG 32 HG2 ARG 32 -3.490 8.508 -12.112 233 HG3 ARG 32 HG3 ARG 32 -4.378 9.649 -13.125 234 HD2 ARG 32 HD2 ARG 32 -5.563 7.943 -10.928 235 HD3 ARG 32 HD3 ARG 32 -5.191 9.662 -10.807 236 HE ARG 32 HE ARG 32 -6.934 10.084 -12.422 237 HH11 ARG 32 HH11 ARG 32 -6.891 6.896 -11.116 238 HH12 ARG 32 HH12 ARG 32 -8.559 6.607 -11.458 239 HH21 ARG 32 HH21 ARG 32 -9.090 9.702 -12.849 240 HH22 ARG 32 HH22 ARG 32 -9.776 8.166 -12.441 241 H THR 33 H THR 33 -4.317 3.769 -13.298 242 HA THR 33 HA THR 33 -5.680 3.280 -15.719 243 HB THR 33 HB THR 33 -3.855 1.841 -15.082 244 HG1 THR 33 HG1 THR 33 -5.287 0.770 -16.380 245 HG21 THR 33 HG21 THR 33 -5.583 0.946 -12.771 246 HG22 THR 33 HG22 THR 33 -4.096 1.887 -12.659 247 HG23 THR 33 HG23 THR 33 -4.045 0.219 -13.236 248 H LEU 34 H LEU 34 -6.639 2.694 -12.346 249 HA LEU 34 HA LEU 34 -9.349 2.005 -13.292 250 HB2 LEU 34 HB2 LEU 34 -7.785 1.124 -10.898 251 HB3 LEU 34 HB3 LEU 34 -9.532 1.210 -10.774 252 HG LEU 34 HG LEU 34 -9.682 -0.333 -12.749 253 HD11 LEU 34 HD11 LEU 34 -7.488 0.075 -13.726 254 HD12 LEU 34 HD12 LEU 34 -7.725 -1.638 -13.377 255 HD13 LEU 34 HD13 LEU 34 -6.715 -0.654 -12.316 256 HD21 LEU 34 HD21 LEU 34 -9.949 -1.151 -10.469 257 HD22 LEU 34 HD22 LEU 34 -8.207 -1.385 -10.334 258 HD23 LEU 34 HD23 LEU 34 -9.143 -2.349 -11.479 259 H ASN 35 H ASN 35 -11.134 2.660 -11.865 260 HA ASN 35 HA ASN 35 -12.445 4.230 -10.927 261 HB2 ASN 35 HB2 ASN 35 -11.117 3.765 -8.925 262 HB3 ASN 35 HB3 ASN 35 -9.934 4.977 -9.410 263 HD21 ASN 35 HD21 ASN 35 -10.308 6.107 -7.467 264 HD22 ASN 35 HD22 ASN 35 -11.726 7.064 -7.243 265 H GLN 36 H GLN 36 -12.897 5.411 -12.758 266 HA GLN 36 HA GLN 36 -11.323 7.798 -13.351 267 HB2 GLN 36 HB2 GLN 36 -13.776 6.590 -14.657 268 HB3 GLN 36 HB3 GLN 36 -13.035 8.093 -15.185 269 HG2 GLN 36 HG2 GLN 36 -12.332 6.277 -16.604 270 HG3 GLN 36 HG3 GLN 36 -10.958 6.893 -15.690 271 HE21 GLN 36 HE21 GLN 36 -9.777 5.015 -15.897 272 HE22 GLN 36 HE22 GLN 36 -10.196 3.540 -15.109 273 H GLY 37 H GLY 37 -13.421 7.090 -11.032 274 HA2 GLY 37 HA2 GLY 37 -14.174 9.106 -9.716 275 HA3 GLY 37 HA3 GLY 37 -14.971 9.610 -11.200 276 H ALA 38 H ALA 38 -14.761 6.473 -9.505 277 HA ALA 38 HA ALA 38 -17.700 6.419 -9.330 278 HB1 ALA 38 HB1 ALA 38 -17.029 5.203 -11.359 279 HB2 ALA 38 HB2 ALA 38 -17.762 4.136 -10.164 280 HB3 ALA 38 HB3 ALA 38 -16.012 4.142 -10.382 281 H THR 39 H THR 39 -18.529 5.386 -7.546 282 HA THR 39 HA THR 39 -16.850 4.860 -5.313 283 HB THR 39 HB THR 39 -19.144 5.530 -4.916 284 HG1 THR 39 HG1 THR 39 -19.042 4.353 -3.172 285 HG21 THR 39 HG21 THR 39 -19.964 2.916 -6.209 286 HG22 THR 39 HG22 THR 39 -20.204 4.526 -6.893 287 HG23 THR 39 HG23 THR 39 -21.046 4.061 -5.415 288 H VAL 40 H VAL 40 -16.568 2.798 -4.191 289 HA VAL 40 HA VAL 40 -15.667 0.719 -5.846 290 HB VAL 40 HB VAL 40 -15.383 -0.621 -3.857 291 HG11 VAL 40 HG11 VAL 40 -14.823 2.295 -3.292 292 HG12 VAL 40 HG12 VAL 40 -13.790 1.187 -4.195 293 HG13 VAL 40 HG13 VAL 40 -14.068 0.927 -2.473 294 HG21 VAL 40 HG21 VAL 40 -16.246 0.094 -1.665 295 HG22 VAL 40 HG22 VAL 40 -17.544 -0.268 -2.802 296 HG23 VAL 40 HG23 VAL 40 -17.125 1.409 -2.450 297 H GLU 41 H GLU 41 -18.808 1.353 -4.485 298 HA GLU 41 HA GLU 41 -19.992 -1.206 -4.815 299 HB2 GLU 41 HB2 GLU 41 -20.757 1.092 -3.622 300 HB3 GLU 41 HB3 GLU 41 -21.655 1.254 -5.123 301 HG2 GLU 41 HG2 GLU 41 -21.838 -1.076 -3.223 302 HG3 GLU 41 HG3 GLU 41 -22.973 0.265 -3.304 303 H GLU 42 H GLU 42 -19.523 1.538 -6.942 304 HA GLU 42 HA GLU 42 -21.213 1.032 -9.064 305 HB2 GLU 42 HB2 GLU 42 -19.651 2.990 -8.784 306 HB3 GLU 42 HB3 GLU 42 -18.338 1.951 -9.315 307 HG2 GLU 42 HG2 GLU 42 -18.911 3.126 -11.230 308 HG3 GLU 42 HG3 GLU 42 -19.742 1.586 -11.438 309 H LYS 43 H LYS 43 -18.089 -0.469 -8.350 310 HA LYS 43 HA LYS 43 -18.474 -2.358 -10.576 311 HB2 LYS 43 HB2 LYS 43 -16.000 -1.682 -9.006 312 HB3 LYS 43 HB3 LYS 43 -16.085 -2.971 -10.195 313 HG2 LYS 43 HG2 LYS 43 -15.070 -1.131 -11.273 314 HG3 LYS 43 HG3 LYS 43 -16.714 -1.214 -11.899 315 HD2 LYS 43 HD2 LYS 43 -17.393 0.640 -10.536 316 HD3 LYS 43 HD3 LYS 43 -15.863 0.623 -9.658 317 HE2 LYS 43 HE2 LYS 43 -15.921 2.434 -11.298 318 HE3 LYS 43 HE3 LYS 43 -14.671 1.259 -11.692 319 HZ1 LYS 43 HZ1 LYS 43 -16.131 0.314 -13.362 320 HZ2 LYS 43 HZ2 LYS 43 -15.913 1.967 -13.646 321 HZ3 LYS 43 HZ3 LYS 43 -17.353 1.412 -12.961 322 H LEU 44 H LEU 44 -17.082 -2.481 -7.296 323 HA LEU 44 HA LEU 44 -17.450 -3.750 -5.484 324 HB2 LEU 44 HB2 LEU 44 -19.827 -3.237 -5.962 325 HB3 LEU 44 HB3 LEU 44 -19.940 -4.743 -6.860 326 HG LEU 44 HG LEU 44 -19.350 -5.983 -4.783 327 HD11 LEU 44 HD11 LEU 44 -19.614 -3.283 -3.457 328 HD12 LEU 44 HD12 LEU 44 -18.131 -4.225 -3.621 329 HD13 LEU 44 HD13 LEU 44 -19.453 -4.832 -2.626 330 HD21 LEU 44 HD21 LEU 44 -21.776 -4.200 -4.554 331 HD22 LEU 44 HD22 LEU 44 -21.516 -5.713 -3.681 332 HD23 LEU 44 HD23 LEU 44 -21.685 -5.726 -5.437 333 H THR 45 H THR 45 -17.587 -5.517 -8.532 334 HA THR 45 HA THR 45 -17.486 -8.136 -7.628 335 HB THR 45 HB THR 45 -17.737 -7.648 -9.989 336 HG1 THR 45 HG1 THR 45 -15.907 -9.101 -10.731 337 HG21 THR 45 HG21 THR 45 -14.846 -6.738 -9.912 338 HG22 THR 45 HG22 THR 45 -16.253 -5.700 -10.161 339 HG23 THR 45 HG23 THR 45 -15.831 -6.918 -11.367 340 H GLU 46 H GLU 46 -15.730 -9.658 -7.400 341 HA GLU 46 HA GLU 46 -13.721 -8.843 -5.642 342 HB2 GLU 46 HB2 GLU 46 -14.509 -11.155 -5.770 343 HB3 GLU 46 HB3 GLU 46 -13.803 -11.325 -7.373 344 HG2 GLU 46 HG2 GLU 46 -11.569 -10.999 -6.423 345 HG3 GLU 46 HG3 GLU 46 -12.273 -10.814 -4.821 346 H GLU 47 H GLU 47 -13.684 -8.986 -9.143 347 HA GLU 47 HA GLU 47 -10.955 -8.791 -9.639 348 HB2 GLU 47 HB2 GLU 47 -13.291 -7.580 -11.121 349 HB3 GLU 47 HB3 GLU 47 -11.637 -7.481 -11.707 350 HG2 GLU 47 HG2 GLU 47 -12.618 -9.286 -12.846 351 HG3 GLU 47 HG3 GLU 47 -11.563 -9.997 -11.632 352 H TYR 48 H TYR 48 -13.237 -6.278 -8.668 353 HA TYR 48 HA TYR 48 -11.567 -4.022 -8.817 354 HB2 TYR 48 HB2 TYR 48 -14.092 -4.165 -8.292 355 HB3 TYR 48 HB3 TYR 48 -13.616 -4.497 -6.635 356 HD1 TYR 48 HD1 TYR 48 -12.028 -2.693 -5.525 357 HD2 TYR 48 HD2 TYR 48 -14.440 -1.987 -8.967 358 HE1 TYR 48 HE1 TYR 48 -11.924 -0.275 -5.103 359 HE2 TYR 48 HE2 TYR 48 -14.340 0.425 -8.555 360 HH TYR 48 HH TYR 48 -12.153 1.844 -6.447 361 H PHE 49 H PHE 49 -12.003 -6.465 -6.322 362 HA PHE 49 HA PHE 49 -10.376 -5.361 -4.296 363 HB2 PHE 49 HB2 PHE 49 -12.064 -7.130 -3.942 364 HB3 PHE 49 HB3 PHE 49 -11.111 -8.247 -4.902 365 HD1 PHE 49 HD2 PHE 49 -8.974 -9.139 -3.996 366 HD2 PHE 49 HD1 PHE 49 -11.592 -6.737 -1.644 367 HE1 PHE 49 HE2 PHE 49 -7.873 -9.948 -1.951 368 HE2 PHE 49 HE1 PHE 49 -10.496 -7.548 0.402 369 HZ PHE 49 HZ PHE 49 -8.637 -9.154 0.252 370 H ASN 50 H ASN 50 -9.656 -8.143 -6.429 371 HA ASN 50 HA ASN 50 -6.964 -8.379 -5.726 372 HB2 ASN 50 HB2 ASN 50 -8.407 -9.234 -8.241 373 HB3 ASN 50 HB3 ASN 50 -6.761 -9.723 -7.843 374 HD21 ASN 50 HD21 ASN 50 -9.287 -11.267 -8.140 375 HD22 ASN 50 HD22 ASN 50 -9.420 -12.166 -6.675 376 H ALA 51 H ALA 51 -8.434 -6.093 -7.865 377 HA ALA 51 HA ALA 51 -6.060 -5.594 -9.431 378 HB1 ALA 51 HB1 ALA 51 -8.597 -3.974 -9.275 379 HB2 ALA 51 HB2 ALA 51 -8.319 -5.328 -10.370 380 HB3 ALA 51 HB3 ALA 51 -7.348 -3.862 -10.517 381 H VAL 52 H VAL 52 -7.510 -4.146 -6.550 382 HA VAL 52 HA VAL 52 -5.431 -2.034 -6.634 383 HB VAL 52 HB VAL 52 -6.909 -0.586 -5.331 384 HG11 VAL 52 HG11 VAL 52 -8.574 -0.116 -7.067 385 HG12 VAL 52 HG12 VAL 52 -8.249 -1.684 -7.807 386 HG13 VAL 52 HG13 VAL 52 -6.989 -0.449 -7.768 387 HG21 VAL 52 HG21 VAL 52 -8.930 -2.825 -5.569 388 HG22 VAL 52 HG22 VAL 52 -9.268 -1.204 -4.955 389 HG23 VAL 52 HG23 VAL 52 -8.156 -2.265 -4.085 390 H ASN 53 H ASN 53 -5.908 -4.859 -5.096 391 HA ASN 53 HA ASN 53 -5.345 -3.891 -2.384 392 HB2 ASN 53 HB2 ASN 53 -6.086 -6.595 -3.477 393 HB3 ASN 53 HB3 ASN 53 -5.461 -6.410 -1.841 394 HD21 ASN 53 HD21 ASN 53 -7.621 -4.257 -3.633 395 HD22 ASN 53 HD22 ASN 53 -8.940 -4.409 -2.532 396 H TYR 54 H TYR 54 -3.221 -3.732 -4.513 397 HA TYR 54 HA TYR 54 -1.160 -5.008 -2.871 398 HB2 TYR 54 HB2 TYR 54 -0.012 -6.056 -4.706 399 HB3 TYR 54 HB3 TYR 54 -1.678 -6.618 -4.703 400 HD1 TYR 54 HD2 TYR 54 -3.312 -5.403 -6.349 401 HD2 TYR 54 HD1 TYR 54 0.935 -5.231 -6.668 402 HE1 TYR 54 HE2 TYR 54 -3.515 -4.772 -8.718 403 HE2 TYR 54 HE1 TYR 54 0.734 -4.603 -9.033 404 HH TYR 54 HH TYR 54 -2.089 -3.539 -10.430 405 H ALA 55 H ALA 55 0.905 -4.107 -3.026 406 HA ALA 55 HA ALA 55 1.110 -1.557 -4.511 407 HB1 ALA 55 HB1 ALA 55 2.434 -0.657 -2.650 408 HB2 ALA 55 HB2 ALA 55 2.187 -2.154 -1.751 409 HB3 ALA 55 HB3 ALA 55 0.813 -1.115 -2.126 410 H GLU 56 H GLU 56 3.010 -1.185 -5.596 411 HA GLU 56 HA GLU 56 4.882 -3.427 -5.742 412 HB2 GLU 56 HB2 GLU 56 4.591 -1.005 -7.534 413 HB3 GLU 56 HB3 GLU 56 5.715 -2.334 -7.799 414 HG2 GLU 56 HG2 GLU 56 3.755 -3.878 -7.917 415 HG3 GLU 56 HG3 GLU 56 2.701 -2.470 -7.834 416 H ILE 57 H ILE 57 6.592 -3.372 -4.447 417 HA ILE 57 HA ILE 57 7.822 -0.786 -3.729 418 HB ILE 57 HB ILE 57 8.163 -3.444 -2.302 419 HG12 ILE 57 HG12 ILE 57 6.782 -2.155 -0.476 420 HG13 ILE 57 HG13 ILE 57 6.198 -1.209 -1.841 421 HG21 ILE 57 HG21 ILE 57 8.956 -0.643 -1.496 422 HG22 ILE 57 HG22 ILE 57 10.038 -1.952 -1.970 423 HG23 ILE 57 HG23 ILE 57 9.103 -2.079 -0.482 424 HD11 ILE 57 HD11 ILE 57 4.660 -3.000 -1.306 425 HD12 ILE 57 HD12 ILE 57 5.943 -4.193 -1.508 426 HD13 ILE 57 HD13 ILE 57 5.377 -3.263 -2.897 427 H ASN 58 H ASN 58 10.055 -0.513 -3.925 428 HA ASN 58 HA ASN 58 11.369 -1.829 -6.027 429 HB2 ASN 58 HB2 ASN 58 11.943 0.444 -5.387 430 HB3 ASN 58 HB3 ASN 58 12.504 -0.108 -3.811 431 HD21 ASN 58 HD21 ASN 58 13.162 -0.108 -7.234 432 HD22 ASN 58 HD22 ASN 58 14.831 -0.523 -7.111 433 H GLU 59 H GLU 59 13.229 -3.153 -6.029 434 HA GLU 59 HA GLU 59 13.058 -5.469 -4.502 435 HB2 GLU 59 HB2 GLU 59 14.139 -5.187 -6.745 436 HB3 GLU 59 HB3 GLU 59 15.501 -4.418 -5.949 437 HG2 GLU 59 HG2 GLU 59 14.628 -7.196 -5.246 438 HG3 GLU 59 HG3 GLU 59 15.695 -6.874 -6.600 439 H GLU 60 H GLU 60 15.518 -2.909 -4.243 440 HA GLU 60 HA GLU 60 16.929 -3.903 -2.067 441 HB2 GLU 60 HB2 GLU 60 16.451 -1.016 -2.834 442 HB3 GLU 60 HB3 GLU 60 17.653 -1.550 -1.665 443 HG2 GLU 60 HG2 GLU 60 18.708 -2.912 -3.475 444 HG3 GLU 60 HG3 GLU 60 17.577 -2.179 -4.612 445 H ASP 61 H ASP 61 14.238 -1.520 -1.935 446 HA ASP 61 HA ASP 61 14.145 -1.313 0.881 447 HB2 ASP 61 HB2 ASP 61 11.856 -0.979 -1.079 448 HB3 ASP 61 HB3 ASP 61 11.914 -0.349 0.566 449 H TRP 62 H TRP 62 12.618 -3.506 -1.369 450 HA TRP 62 HA TRP 62 10.791 -4.862 0.181 451 HB2 TRP 62 HB2 TRP 62 11.155 -5.161 -2.248 452 HB3 TRP 62 HB3 TRP 62 12.663 -5.999 -1.912 453 HD1 TRP 62 HD1 TRP 62 12.461 -8.493 -0.862 454 HE1 TRP 62 HE1 TRP 62 10.553 -10.209 -0.993 455 HE3 TRP 62 HE3 TRP 62 8.692 -5.376 -2.308 456 HZ2 TRP 62 HZ2 TRP 62 7.807 -10.227 -1.645 457 HZ3 TRP 62 HZ3 TRP 62 6.451 -6.318 -2.666 458 HH2 TRP 62 HH2 TRP 62 6.020 -8.699 -2.339 459 H ASN 63 H ASN 63 14.226 -5.735 -0.279 460 HA ASN 63 HA ASN 63 14.141 -7.833 1.672 461 HB2 ASN 63 HB2 ASN 63 16.485 -6.482 0.311 462 HB3 ASN 63 HB3 ASN 63 16.614 -7.906 1.344 463 HD21 ASN 63 HD21 ASN 63 15.483 -6.680 -1.710 464 HD22 ASN 63 HD22 ASN 63 15.253 -8.220 -2.450 465 H ALA 64 H ALA 64 15.006 -4.432 1.748 466 HA ALA 64 HA ALA 64 16.373 -4.320 4.190 467 HB1 ALA 64 HB1 ALA 64 14.507 -2.258 3.008 468 HB2 ALA 64 HB2 ALA 64 16.223 -2.436 2.639 469 HB3 ALA 64 HB3 ALA 64 15.715 -1.965 4.261 470 H LEU 65 H LEU 65 12.908 -4.418 3.524 471 HA LEU 65 HA LEU 65 12.210 -4.285 6.354 472 HB2 LEU 65 HB2 LEU 65 10.507 -4.719 3.893 473 HB3 LEU 65 HB3 LEU 65 9.883 -4.518 5.520 474 HG LEU 65 HG LEU 65 11.486 -2.419 4.045 475 HD11 LEU 65 HD11 LEU 65 9.364 -2.793 2.918 476 HD12 LEU 65 HD12 LEU 65 9.367 -1.238 3.750 477 HD13 LEU 65 HD13 LEU 65 8.500 -2.609 4.446 478 HD21 LEU 65 HD21 LEU 65 11.646 -2.254 6.479 479 HD22 LEU 65 HD22 LEU 65 9.886 -2.270 6.604 480 HD23 LEU 65 HD23 LEU 65 10.702 -0.920 5.814 481 H GLY 66 H GLY 66 13.095 -6.684 4.128 482 HA2 GLY 66 HA2 GLY 66 13.294 -8.973 4.375 483 HA3 GLY 66 HA3 GLY 66 12.599 -8.823 5.982 484 H LEU 67 H LEU 67 11.272 -7.952 2.807 485 HA LEU 67 HA LEU 67 8.781 -9.291 3.445 486 HB2 LEU 67 HB2 LEU 67 9.679 -7.692 1.046 487 HB3 LEU 67 HB3 LEU 67 8.068 -8.359 1.229 488 HG LEU 67 HG LEU 67 9.286 -6.343 3.130 489 HD11 LEU 67 HD11 LEU 67 7.322 -5.900 0.875 490 HD12 LEU 67 HD12 LEU 67 8.997 -5.349 0.910 491 HD13 LEU 67 HD13 LEU 67 7.828 -4.691 2.057 492 HD21 LEU 67 HD21 LEU 67 6.454 -7.345 2.801 493 HD22 LEU 67 HD22 LEU 67 6.985 -6.094 3.926 494 HD23 LEU 67 HD23 LEU 67 7.550 -7.752 4.121 495 H GLN 68 H GLN 68 7.867 -10.993 2.338 496 HA GLN 68 HA GLN 68 9.519 -12.369 0.313 497 HB2 GLN 68 HB2 GLN 68 9.053 -13.736 2.339 498 HB3 GLN 68 HB3 GLN 68 7.327 -13.537 2.058 499 HG2 GLN 68 HG2 GLN 68 7.578 -14.695 -0.115 500 HG3 GLN 68 HG3 GLN 68 9.283 -14.947 0.246 501 HE21 GLN 68 HE21 GLN 68 9.100 -17.180 0.196 502 HE22 GLN 68 HE22 GLN 68 8.287 -18.068 1.430 503 H GLU 69 H GLU 69 8.500 -12.994 -1.636 504 HA GLU 69 HA GLU 69 6.569 -11.178 -2.574 505 HB2 GLU 69 HB2 GLU 69 7.618 -13.749 -3.757 506 HB3 GLU 69 HB3 GLU 69 6.549 -12.647 -4.625 507 HG2 GLU 69 HG2 GLU 69 8.148 -10.898 -4.573 508 HG3 GLU 69 HG3 GLU 69 9.149 -11.749 -3.403 509 H GLY 70 H GLY 70 4.732 -11.135 -1.487 510 HA2 GLY 70 HA2 GLY 70 2.419 -12.202 -1.883 511 HA3 GLY 70 HA3 GLY 70 3.156 -13.611 -1.142 512 H ASP 71 H ASP 71 4.599 -11.231 0.507 513 HA ASP 71 HA ASP 71 3.028 -11.564 2.850 514 HB2 ASP 71 HB2 ASP 71 5.355 -9.771 2.179 515 HB3 ASP 71 HB3 ASP 71 4.561 -9.700 3.747 516 H ARG 72 H ARG 72 2.582 -9.464 4.229 517 HA ARG 72 HA ARG 72 0.874 -7.651 2.632 518 HB2 ARG 72 HB2 ARG 72 0.593 -8.301 5.575 519 HB3 ARG 72 HB3 ARG 72 -0.558 -7.441 4.561 520 HG2 ARG 72 HG2 ARG 72 -1.081 -9.453 3.349 521 HG3 ARG 72 HG3 ARG 72 0.201 -10.335 4.183 522 HD2 ARG 72 HD2 ARG 72 -2.352 -9.244 5.356 523 HD3 ARG 72 HD3 ARG 72 -1.866 -10.934 5.218 524 HE ARG 72 HE ARG 72 -1.042 -9.034 7.226 525 HH11 ARG 72 HH11 ARG 72 -0.343 -12.048 5.708 526 HH12 ARG 72 HH12 ARG 72 0.613 -12.609 7.033 527 HH21 ARG 72 HH21 ARG 72 0.208 -9.766 8.901 528 HH22 ARG 72 HH22 ARG 72 0.925 -11.337 8.815 529 H VAL 73 H VAL 73 1.084 -5.429 2.937 530 HA VAL 73 HA VAL 73 3.185 -4.555 4.820 531 HB VAL 73 HB VAL 73 3.851 -2.808 3.179 532 HG11 VAL 73 HG11 VAL 73 5.140 -4.873 3.386 533 HG12 VAL 73 HG12 VAL 73 5.141 -4.295 1.721 534 HG13 VAL 73 HG13 VAL 73 4.111 -5.650 2.183 535 HG21 VAL 73 HG21 VAL 73 1.791 -2.716 1.855 536 HG22 VAL 73 HG22 VAL 73 2.090 -4.350 1.261 537 HG23 VAL 73 HG23 VAL 73 3.188 -3.038 0.828 538 H LYS 74 H LYS 74 2.829 -2.792 6.010 539 HA LYS 74 HA LYS 74 0.281 -1.382 5.836 540 HB2 LYS 74 HB2 LYS 74 1.024 -2.037 8.058 541 HB3 LYS 74 HB3 LYS 74 2.569 -1.235 7.823 542 HG2 LYS 74 HG2 LYS 74 1.395 0.237 9.185 543 HG3 LYS 74 HG3 LYS 74 1.197 0.928 7.577 544 HD2 LYS 74 HD2 LYS 74 -0.932 1.050 8.603 545 HD3 LYS 74 HD3 LYS 74 -1.031 -0.301 7.473 546 HE2 LYS 74 HE2 LYS 74 -0.831 -1.895 9.238 547 HE3 LYS 74 HE3 LYS 74 -0.390 -0.648 10.403 548 HZ1 LYS 74 HZ1 LYS 74 -3.043 -1.028 9.122 549 HZ2 LYS 74 HZ2 LYS 74 -2.635 0.307 10.077 550 HZ3 LYS 74 HZ3 LYS 74 -2.656 -1.237 10.754 551 H VAL 75 H VAL 75 0.060 0.638 5.025 552 HA VAL 75 HA VAL 75 2.484 2.126 4.214 553 HB VAL 75 HB VAL 75 -0.188 2.100 2.775 554 HG11 VAL 75 HG11 VAL 75 0.990 4.230 2.558 555 HG12 VAL 75 HG12 VAL 75 0.988 3.359 1.024 556 HG13 VAL 75 HG13 VAL 75 2.444 3.386 2.019 557 HG21 VAL 75 HG21 VAL 75 0.947 -0.040 2.493 558 HG22 VAL 75 HG22 VAL 75 2.424 0.787 1.995 559 HG23 VAL 75 HG23 VAL 75 0.982 0.878 0.985 560 H LYS 76 H LYS 76 2.628 4.172 5.017 561 HA LYS 76 HA LYS 76 0.226 5.328 6.279 562 HB2 LYS 76 HB2 LYS 76 2.913 4.886 7.588 563 HB3 LYS 76 HB3 LYS 76 1.641 5.895 8.273 564 HG2 LYS 76 HG2 LYS 76 0.214 4.062 8.616 565 HG3 LYS 76 HG3 LYS 76 1.162 3.017 7.559 566 HD2 LYS 76 HD2 LYS 76 1.520 2.439 9.881 567 HD3 LYS 76 HD3 LYS 76 3.000 3.060 9.158 568 HE2 LYS 76 HE2 LYS 76 2.677 3.955 11.417 569 HE3 LYS 76 HE3 LYS 76 2.615 5.239 10.211 570 HZ1 LYS 76 HZ1 LYS 76 0.877 5.417 11.925 571 HZ2 LYS 76 HZ2 LYS 76 0.221 3.947 11.406 572 HZ3 LYS 76 HZ3 LYS 76 0.237 5.277 10.368 573 H THR 77 H THR 77 -0.050 7.416 6.016 574 HA THR 77 HA THR 77 2.221 9.193 5.402 575 HB THR 77 HB THR 77 1.095 10.288 3.577 576 HG1 THR 77 HG1 THR 77 -0.973 9.504 2.861 577 HG21 THR 77 HG21 THR 77 2.359 8.306 2.905 578 HG22 THR 77 HG22 THR 77 0.934 8.501 1.884 579 HG23 THR 77 HG23 THR 77 0.940 7.291 3.168 580 H GLU 78 H GLU 78 1.133 11.568 5.144 581 HA GLU 78 HA GLU 78 0.043 12.221 7.693 582 HB2 GLU 78 HB2 GLU 78 -0.078 14.518 6.827 583 HB3 GLU 78 HB3 GLU 78 1.480 13.778 6.486 584 HG2 GLU 78 HG2 GLU 78 0.719 13.311 4.180 585 HG3 GLU 78 HG3 GLU 78 -0.793 14.144 4.535 586 H PHE 79 H PHE 79 -1.437 11.071 4.874 587 HA PHE 79 HA PHE 79 -4.020 12.326 5.373 588 HB2 PHE 79 HB2 PHE 79 -3.123 10.314 3.294 589 HB3 PHE 79 HB3 PHE 79 -4.764 10.941 3.408 590 HD1 PHE 79 HD1 PHE 79 -1.275 11.783 2.610 591 HD2 PHE 79 HD2 PHE 79 -5.308 13.158 2.674 592 HE1 PHE 79 HE1 PHE 79 -0.641 13.705 1.209 593 HE2 PHE 79 HE2 PHE 79 -4.677 15.078 1.273 594 HZ PHE 79 HZ PHE 79 -2.343 15.352 0.538 595 H GLY 80 H GLY 80 -2.532 9.116 5.636 596 HA2 GLY 80 HA2 GLY 80 -3.982 8.278 7.848 597 HA3 GLY 80 HA3 GLY 80 -4.915 7.767 6.448 598 H GLU 81 H GLU 81 -4.604 5.547 6.822 599 HA GLU 81 HA GLU 81 -2.101 4.544 5.788 600 HB2 GLU 81 HB2 GLU 81 -1.667 3.005 7.667 601 HB3 GLU 81 HB3 GLU 81 -1.504 4.695 8.122 602 HG2 GLU 81 HG2 GLU 81 -3.659 4.643 9.224 603 HG3 GLU 81 HG3 GLU 81 -3.916 2.980 8.694 604 H VAL 82 H VAL 82 -2.145 2.320 5.195 605 HA VAL 82 HA VAL 82 -4.688 0.894 5.337 606 HB VAL 82 HB VAL 82 -4.834 2.375 3.326 607 HG11 VAL 82 HG11 VAL 82 -2.482 2.413 2.696 608 HG12 VAL 82 HG12 VAL 82 -3.482 1.871 1.349 609 HG13 VAL 82 HG13 VAL 82 -2.549 0.699 2.282 610 HG21 VAL 82 HG21 VAL 82 -5.582 0.633 1.761 611 HG22 VAL 82 HG22 VAL 82 -6.140 0.335 3.405 612 HG23 VAL 82 HG23 VAL 82 -4.786 -0.591 2.753 613 H VAL 83 H VAL 83 -4.510 -1.364 4.731 614 HA VAL 83 HA VAL 83 -1.724 -2.354 4.597 615 HB VAL 83 HB VAL 83 -4.112 -3.854 5.705 616 HG11 VAL 83 HG11 VAL 83 -2.383 -5.317 4.801 617 HG12 VAL 83 HG12 VAL 83 -2.422 -5.424 6.562 618 HG13 VAL 83 HG13 VAL 83 -1.157 -4.489 5.762 619 HG21 VAL 83 HG21 VAL 83 -3.581 -1.968 7.153 620 HG22 VAL 83 HG22 VAL 83 -1.886 -2.456 7.197 621 HG23 VAL 83 HG23 VAL 83 -3.120 -3.488 7.920 622 H VAL 84 H VAL 84 -1.208 -3.175 2.672 623 HA VAL 84 HA VAL 84 -3.274 -4.590 1.090 624 HB VAL 84 HB VAL 84 -2.224 -3.742 -0.982 625 HG11 VAL 84 HG11 VAL 84 -4.157 -2.554 -0.093 626 HG12 VAL 84 HG12 VAL 84 -3.038 -1.424 -0.856 627 HG13 VAL 84 HG13 VAL 84 -3.104 -1.548 0.903 628 HG21 VAL 84 HG21 VAL 84 -0.555 -2.023 0.865 629 HG22 VAL 84 HG22 VAL 84 -0.609 -1.893 -0.893 630 HG23 VAL 84 HG23 VAL 84 0.037 -3.349 -0.137 631 H PHE 85 H PHE 85 -2.111 -5.894 -0.765 632 HA PHE 85 HA PHE 85 -0.195 -7.656 0.465 633 HB2 PHE 85 HB2 PHE 85 -1.425 -7.600 -2.298 634 HB3 PHE 85 HB3 PHE 85 -0.244 -8.808 -1.800 635 HD1 PHE 85 HD1 PHE 85 -0.804 -10.240 0.246 636 HD2 PHE 85 HD2 PHE 85 -3.706 -7.917 -1.839 637 HE1 PHE 85 HE1 PHE 85 -2.598 -11.621 1.208 638 HE2 PHE 85 HE2 PHE 85 -5.503 -9.296 -0.874 639 HZ PHE 85 HZ PHE 85 -4.949 -11.150 0.649 640 H ALA 86 H ALA 86 1.834 -8.297 -0.674 641 HA ALA 86 HA ALA 86 3.302 -5.833 -1.326 642 HB1 ALA 86 HB1 ALA 86 4.000 -6.981 0.717 643 HB2 ALA 86 HB2 ALA 86 5.289 -6.980 -0.487 644 HB3 ALA 86 HB3 ALA 86 4.341 -8.442 -0.211 645 H LYS 87 H LYS 87 4.184 -5.566 -3.258 646 HA LYS 87 HA LYS 87 4.682 -7.891 -5.007 647 HB2 LYS 87 HB2 LYS 87 2.761 -5.748 -5.354 648 HB3 LYS 87 HB3 LYS 87 3.944 -5.708 -6.649 649 HG2 LYS 87 HG2 LYS 87 2.939 -8.396 -6.114 650 HG3 LYS 87 HG3 LYS 87 1.668 -7.261 -6.565 651 HD2 LYS 87 HD2 LYS 87 4.187 -7.898 -8.117 652 HD3 LYS 87 HD3 LYS 87 2.536 -8.329 -8.568 653 HE2 LYS 87 HE2 LYS 87 1.973 -5.982 -8.847 654 HE3 LYS 87 HE3 LYS 87 3.574 -5.505 -8.292 655 HZ1 LYS 87 HZ1 LYS 87 3.513 -5.376 -10.650 656 HZ2 LYS 87 HZ2 LYS 87 2.911 -6.950 -10.795 657 HZ3 LYS 87 HZ3 LYS 87 4.488 -6.697 -10.243 658 H LYS 88 H LYS 88 6.586 -7.924 -5.964 659 HA LYS 88 HA LYS 88 8.467 -5.859 -5.280 660 HB2 LYS 88 HB2 LYS 88 8.959 -8.331 -5.226 661 HB3 LYS 88 HB3 LYS 88 8.923 -8.317 -6.988 662 HG2 LYS 88 HG2 LYS 88 10.760 -6.772 -7.051 663 HG3 LYS 88 HG3 LYS 88 10.748 -6.645 -5.295 664 HD2 LYS 88 HD2 LYS 88 11.317 -9.178 -6.849 665 HD3 LYS 88 HD3 LYS 88 12.547 -8.135 -6.130 666 HE2 LYS 88 HE2 LYS 88 11.623 -8.557 -3.910 667 HE3 LYS 88 HE3 LYS 88 10.360 -9.565 -4.612 668 HZ1 LYS 88 HZ1 LYS 88 12.086 -11.075 -5.412 669 HZ2 LYS 88 HZ2 LYS 88 12.145 -10.913 -3.731 670 HZ3 LYS 88 HZ3 LYS 88 13.277 -10.116 -4.696 671 H GLY 89 H GLY 89 8.227 -4.017 -6.427 672 HA2 GLY 89 HA2 GLY 89 7.566 -4.169 -9.285 673 HA3 GLY 89 HA3 GLY 89 7.403 -2.757 -8.262 674 H ASP 90 H ASP 90 8.546 -2.735 -10.810 675 HA ASP 90 HA ASP 90 11.430 -2.535 -10.483 676 HB2 ASP 90 HB2 ASP 90 11.338 -1.856 -12.914 677 HB3 ASP 90 HB3 ASP 90 10.682 -3.447 -12.558 678 H VAL 91 H VAL 91 9.271 -0.691 -9.256 679 HA VAL 91 HA VAL 91 9.800 1.945 -10.207 680 HB VAL 91 HB VAL 91 8.695 2.692 -8.119 681 HG11 VAL 91 HG11 VAL 91 7.272 0.407 -9.501 682 HG12 VAL 91 HG12 VAL 91 7.328 2.082 -10.055 683 HG13 VAL 91 HG13 VAL 91 6.504 1.679 -8.550 684 HG21 VAL 91 HG21 VAL 91 7.810 1.035 -6.532 685 HG22 VAL 91 HG22 VAL 91 9.573 0.990 -6.590 686 HG23 VAL 91 HG23 VAL 91 8.632 -0.252 -7.416 687 HA PRO 92 HA PRO 92 13.660 3.017 -8.348 688 HB2 PRO 92 HB2 PRO 92 12.465 5.508 -7.254 689 HB3 PRO 92 HB3 PRO 92 13.807 5.302 -8.387 690 HG2 PRO 92 HG2 PRO 92 11.431 6.172 -9.236 691 HG3 PRO 92 HG3 PRO 92 12.397 5.053 -10.219 692 HD2 PRO 92 HD2 PRO 92 10.022 4.474 -8.472 693 HD3 PRO 92 HD3 PRO 92 10.399 3.858 -10.096 694 H LYS 93 H LYS 93 14.842 3.246 -6.383 695 HA LYS 93 HA LYS 93 13.767 1.949 -4.127 696 HB2 LYS 93 HB2 LYS 93 16.183 2.041 -4.751 697 HB3 LYS 93 HB3 LYS 93 16.221 3.721 -4.234 698 HG2 LYS 93 HG2 LYS 93 15.735 3.072 -1.953 699 HG3 LYS 93 HG3 LYS 93 15.543 1.387 -2.444 700 HD2 LYS 93 HD2 LYS 93 17.919 1.395 -3.199 701 HD3 LYS 93 HD3 LYS 93 18.080 3.026 -2.544 702 HE2 LYS 93 HE2 LYS 93 17.556 2.200 -0.310 703 HE3 LYS 93 HE3 LYS 93 17.328 0.570 -0.951 704 HZ1 LYS 93 HZ1 LYS 93 19.507 0.814 0.039 705 HZ2 LYS 93 HZ2 LYS 93 19.865 2.113 -0.979 706 HZ3 LYS 93 HZ3 LYS 93 19.660 0.569 -1.629 707 H GLY 94 H GLY 94 13.205 2.726 -2.029 708 HA2 GLY 94 HA2 GLY 94 12.087 4.146 -0.605 709 HA3 GLY 94 HA3 GLY 94 13.056 5.442 -1.287 710 H MET 95 H MET 95 10.828 3.447 -3.137 711 HA MET 95 HA MET 95 8.783 5.505 -3.249 712 HB2 MET 95 HB2 MET 95 10.643 6.133 -4.853 713 HB3 MET 95 HB3 MET 95 10.282 4.661 -5.740 714 HG2 MET 95 HG2 MET 95 8.094 5.463 -6.283 715 HG3 MET 95 HG3 MET 95 8.321 6.885 -5.264 716 HE1 MET 95 HE1 MET 95 7.392 7.409 -8.225 717 HE2 MET 95 HE2 MET 95 8.502 8.711 -8.651 718 HE3 MET 95 HE3 MET 95 7.801 8.644 -7.036 719 H ILE 96 H ILE 96 6.770 4.596 -3.758 720 HA ILE 96 HA ILE 96 6.742 1.828 -4.773 721 HB ILE 96 HB ILE 96 5.055 1.133 -3.159 722 HG12 ILE 96 HG12 ILE 96 5.483 3.818 -1.807 723 HG13 ILE 96 HG13 ILE 96 4.055 3.371 -2.735 724 HG21 ILE 96 HG21 ILE 96 6.468 1.004 -1.156 725 HG22 ILE 96 HG22 ILE 96 7.509 2.270 -1.813 726 HG23 ILE 96 HG23 ILE 96 7.396 0.710 -2.629 727 HD11 ILE 96 HD11 ILE 96 4.994 2.076 -0.187 728 HD12 ILE 96 HD12 ILE 96 3.585 1.585 -1.128 729 HD13 ILE 96 HD13 ILE 96 3.628 3.175 -0.369 730 H PHE 97 H PHE 97 4.832 1.164 -5.808 731 HA PHE 97 HA PHE 97 3.109 3.386 -6.725 732 HB2 PHE 97 HB2 PHE 97 4.504 2.397 -8.489 733 HB3 PHE 97 HB3 PHE 97 3.859 0.800 -8.128 734 HD1 PHE 97 HD1 PHE 97 1.555 0.221 -8.748 735 HD2 PHE 97 HD2 PHE 97 3.248 4.000 -9.767 736 HE1 PHE 97 HE1 PHE 97 -0.250 0.586 -10.381 737 HE2 PHE 97 HE2 PHE 97 1.444 4.364 -11.400 738 HZ PHE 97 HZ PHE 97 -0.304 2.659 -11.709 739 H ILE 98 H ILE 98 0.966 3.276 -6.292 740 HA ILE 98 HA ILE 98 -0.255 0.631 -5.777 741 HB ILE 98 HB ILE 98 -0.894 3.185 -4.269 742 HG12 ILE 98 HG12 ILE 98 0.428 0.609 -3.370 743 HG13 ILE 98 HG13 ILE 98 1.194 2.188 -3.497 744 HG21 ILE 98 HG21 ILE 98 -2.103 0.425 -4.015 745 HG22 ILE 98 HG22 ILE 98 -2.905 1.866 -4.645 746 HG23 ILE 98 HG23 ILE 98 -2.435 1.789 -2.946 747 HD11 ILE 98 HD11 ILE 98 -0.971 1.386 -1.562 748 HD12 ILE 98 HD12 ILE 98 -0.318 3.018 -1.727 749 HD13 ILE 98 HD13 ILE 98 0.726 1.699 -1.198 750 HA PRO 99 HA PRO 99 -3.033 1.901 -9.107 751 HB2 PRO 99 HB2 PRO 99 -4.792 -0.131 -7.806 752 HB3 PRO 99 HB3 PRO 99 -4.312 0.020 -9.499 753 HG2 PRO 99 HG2 PRO 99 -3.233 -1.862 -7.958 754 HG3 PRO 99 HG3 PRO 99 -2.239 -0.977 -9.135 755 HD2 PRO 99 HD2 PRO 99 -2.413 -0.636 -6.159 756 HD3 PRO 99 HD3 PRO 99 -0.990 -0.564 -7.221 757 H MET 100 H MET 100 -4.716 3.370 -9.241 758 HA MET 100 HA MET 100 -5.503 4.812 -6.968 759 HB2 MET 100 HB2 MET 100 -5.520 5.492 -9.475 760 HB3 MET 100 HB3 MET 100 -7.123 4.778 -9.510 761 HG2 MET 100 HG2 MET 100 -6.187 7.146 -7.908 762 HG3 MET 100 HG3 MET 100 -7.364 7.122 -9.215 763 HE1 MET 100 HE1 MET 100 -6.633 5.825 -5.553 764 HE2 MET 100 HE2 MET 100 -8.092 6.455 -4.790 765 HE3 MET 100 HE3 MET 100 -6.969 7.556 -5.589 766 H GLY 101 H GLY 101 -6.615 3.885 -5.353 767 HA2 GLY 101 HA2 GLY 101 -9.342 3.002 -5.882 768 HA3 GLY 101 HA3 GLY 101 -8.275 1.743 -5.274 769 HA PRO 102 HA PRO 102 -10.295 4.109 -1.710 770 HB2 PRO 102 HB2 PRO 102 -11.010 1.821 -0.338 771 HB3 PRO 102 HB3 PRO 102 -12.072 2.677 -1.462 772 HG2 PRO 102 HG2 PRO 102 -10.394 0.239 -1.923 773 HG3 PRO 102 HG3 PRO 102 -12.043 0.585 -2.475 774 HD2 PRO 102 HD2 PRO 102 -9.921 0.812 -4.118 775 HD3 PRO 102 HD3 PRO 102 -11.312 1.914 -4.234 776 H TYR 103 H TYR 103 -8.100 1.414 -2.002 777 HA TYR 103 HA TYR 103 -6.919 1.538 0.577 778 HB2 TYR 103 HB2 TYR 103 -5.811 0.459 -2.034 779 HB3 TYR 103 HB3 TYR 103 -5.129 0.157 -0.438 780 HD1 TYR 103 HD2 TYR 103 -8.443 -0.118 -2.167 781 HD2 TYR 103 HD1 TYR 103 -5.681 -1.867 0.557 782 HE1 TYR 103 HE2 TYR 103 -9.935 -2.047 -1.905 783 HE2 TYR 103 HE1 TYR 103 -7.164 -3.804 0.826 784 HH TYR 103 HH TYR 103 -9.103 -4.736 0.260 785 H ALA 104 H ALA 104 -5.737 2.673 -2.603 786 HA ALA 104 HA ALA 104 -3.587 4.193 -1.649 787 HB1 ALA 104 HB1 ALA 104 -3.700 5.384 -3.798 788 HB2 ALA 104 HB2 ALA 104 -5.282 4.668 -4.108 789 HB3 ALA 104 HB3 ALA 104 -3.853 3.640 -4.011 790 H ASN 105 H ASN 105 -6.997 5.019 -2.095 791 HA ASN 105 HA ASN 105 -6.945 7.758 -1.660 792 HB2 ASN 105 HB2 ASN 105 -8.935 6.693 -2.443 793 HB3 ASN 105 HB3 ASN 105 -9.027 5.665 -1.018 794 HD21 ASN 105 HD21 ASN 105 -9.910 6.453 0.834 795 HD22 ASN 105 HD22 ASN 105 -10.739 7.968 0.910 796 H MET 106 H MET 106 -6.564 5.176 0.650 797 HA MET 106 HA MET 106 -7.103 6.620 3.028 798 HB2 MET 106 HB2 MET 106 -5.283 4.241 2.575 799 HB3 MET 106 HB3 MET 106 -5.817 4.820 4.148 800 HG2 MET 106 HG2 MET 106 -7.698 3.897 1.996 801 HG3 MET 106 HG3 MET 106 -7.053 2.842 3.250 802 HE1 MET 106 HE1 MET 106 -7.891 2.715 5.644 803 HE2 MET 106 HE2 MET 106 -8.705 4.040 6.477 804 HE3 MET 106 HE3 MET 106 -7.052 4.247 5.898 805 H VAL 107 H VAL 107 -4.317 6.512 0.930 806 HA VAL 107 HA VAL 107 -2.703 7.945 2.952 807 HB VAL 107 HB VAL 107 -0.689 6.857 2.020 808 HG11 VAL 107 HG11 VAL 107 -1.783 5.935 4.005 809 HG12 VAL 107 HG12 VAL 107 -1.050 4.659 3.033 810 HG13 VAL 107 HG13 VAL 107 -2.795 4.915 2.980 811 HG21 VAL 107 HG21 VAL 107 -0.900 4.929 0.532 812 HG22 VAL 107 HG22 VAL 107 -1.551 6.378 -0.234 813 HG23 VAL 107 HG23 VAL 107 -2.645 5.170 0.443 814 H ILE 108 H ILE 108 -3.964 8.090 -0.214 815 HA ILE 108 HA ILE 108 -1.908 10.008 -1.083 816 HB ILE 108 HB ILE 108 -2.585 9.730 -3.308 817 HG12 ILE 108 HG12 ILE 108 -4.954 8.051 -2.469 818 HG13 ILE 108 HG13 ILE 108 -5.071 9.787 -2.749 819 HG21 ILE 108 HG21 ILE 108 -2.516 7.268 -3.690 820 HG22 ILE 108 HG22 ILE 108 -2.698 7.036 -1.951 821 HG23 ILE 108 HG23 ILE 108 -1.270 7.855 -2.583 822 HD11 ILE 108 HD11 ILE 108 -4.309 7.667 -4.713 823 HD12 ILE 108 HD12 ILE 108 -4.151 9.397 -5.017 824 HD13 ILE 108 HD13 ILE 108 -5.743 8.692 -4.725 825 H ASP 109 H ASP 109 -2.959 11.740 -2.650 826 HA ASP 109 HA ASP 109 -5.280 12.949 -1.294 827 HB2 ASP 109 HB2 ASP 109 -3.329 14.386 -1.237 828 HB3 ASP 109 HB3 ASP 109 -3.101 14.212 -2.972 829 HA PRO 110 HA PRO 110 -7.139 11.591 -5.236 830 HB2 PRO 110 HB2 PRO 110 -9.694 11.470 -4.367 831 HB3 PRO 110 HB3 PRO 110 -8.509 10.222 -3.961 832 HG2 PRO 110 HG2 PRO 110 -9.443 12.550 -2.308 833 HG3 PRO 110 HG3 PRO 110 -9.212 10.858 -1.825 834 HD2 PRO 110 HD2 PRO 110 -7.368 12.805 -1.322 835 HD3 PRO 110 HD3 PRO 110 -6.926 11.105 -1.583 836 H SER 111 H SER 111 -7.336 14.519 -3.578 837 HA SER 111 HA SER 111 -9.391 15.843 -5.029 838 HB2 SER 111 HB2 SER 111 -8.537 16.748 -2.920 839 HB3 SER 111 HB3 SER 111 -6.952 17.005 -3.650 840 HG SER 111 HG SER 111 -7.896 18.937 -3.860 841 H THR 112 H THR 112 -6.077 15.097 -5.777 842 HA THR 112 HA THR 112 -6.108 16.913 -8.101 843 HB THR 112 HB THR 112 -4.175 17.198 -6.638 844 HG1 THR 112 HG1 THR 112 -3.185 15.856 -8.941 845 HG21 THR 112 HG21 THR 112 -4.080 14.930 -5.696 846 HG22 THR 112 HG22 THR 112 -2.515 15.416 -6.353 847 HG23 THR 112 HG23 THR 112 -3.545 14.303 -7.257 848 H ASP 113 H ASP 113 -5.413 16.199 -10.153 849 HA ASP 113 HA ASP 113 -5.558 13.290 -10.637 850 HB2 ASP 113 HB2 ASP 113 -5.986 15.634 -12.513 851 HB3 ASP 113 HB3 ASP 113 -5.951 13.952 -13.032 852 H GLY 114 H GLY 114 -4.200 12.876 -12.875 853 HA2 GLY 114 HA2 GLY 114 -1.444 13.347 -12.153 854 HA3 GLY 114 HA3 GLY 114 -2.023 12.441 -13.541 855 H THR 115 H THR 115 -2.295 15.846 -12.477 856 HA THR 115 HA THR 115 -1.940 16.754 -15.217 857 HB THR 115 HB THR 115 -2.321 19.029 -14.280 858 HG1 THR 115 HG1 THR 115 -1.458 18.526 -12.140 859 HG21 THR 115 HG21 THR 115 -4.675 18.686 -13.647 860 HG22 THR 115 HG22 THR 115 -4.366 16.963 -13.436 861 HG23 THR 115 HG23 THR 115 -4.233 17.692 -15.036 862 H GLY 116 H GLY 116 0.104 16.706 -15.938 863 HA2 GLY 116 HA2 GLY 116 2.075 18.376 -15.717 864 HA3 GLY 116 HA3 GLY 116 2.291 17.583 -14.163 865 H MET 117 H MET 117 3.445 15.715 -14.085 866 HA MET 117 HA MET 117 4.636 14.733 -16.554 867 HB2 MET 117 HB2 MET 117 5.098 13.970 -13.656 868 HB3 MET 117 HB3 MET 117 5.996 13.305 -15.015 869 HG2 MET 117 HG2 MET 117 6.868 15.500 -15.554 870 HG3 MET 117 HG3 MET 117 5.914 16.219 -14.262 871 HE1 MET 117 HE1 MET 117 7.919 12.814 -14.265 872 HE2 MET 117 HE2 MET 117 9.459 13.332 -13.573 873 HE3 MET 117 HE3 MET 117 8.964 13.915 -15.164 874 HA PRO 118 HA PRO 118 1.809 11.467 -17.406 875 HB2 PRO 118 HB2 PRO 118 4.209 9.765 -17.919 876 HB3 PRO 118 HB3 PRO 118 2.827 10.108 -18.965 877 HG2 PRO 118 HG2 PRO 118 5.176 11.270 -19.413 878 HG3 PRO 118 HG3 PRO 118 3.667 12.182 -19.611 879 HD2 PRO 118 HD2 PRO 118 5.660 12.273 -17.373 880 HD3 PRO 118 HD3 PRO 118 4.738 13.594 -18.121 881 H GLN 119 H GLN 119 1.323 11.328 -15.036 882 HA GLN 119 HA GLN 119 0.897 10.163 -13.159 883 HB2 GLN 119 HB2 GLN 119 0.147 8.533 -14.934 884 HB3 GLN 119 HB3 GLN 119 1.698 7.725 -14.755 885 HG2 GLN 119 HG2 GLN 119 1.159 7.346 -12.368 886 HG3 GLN 119 HG3 GLN 119 -0.439 8.026 -12.658 887 HE21 GLN 119 HE21 GLN 119 1.679 5.341 -13.308 888 HE22 GLN 119 HE22 GLN 119 0.458 4.266 -13.887 889 H PHE 120 H PHE 120 3.608 11.148 -13.593 890 HA PHE 120 HA PHE 120 5.265 9.269 -12.076 891 HB2 PHE 120 HB2 PHE 120 5.810 11.781 -13.620 892 HB3 PHE 120 HB3 PHE 120 6.978 11.220 -12.429 893 HD1 PHE 120 HD2 PHE 120 5.358 10.470 -15.641 894 HD2 PHE 120 HD1 PHE 120 8.302 9.251 -12.813 895 HE1 PHE 120 HE2 PHE 120 6.305 8.915 -17.299 896 HE2 PHE 120 HE1 PHE 120 9.251 7.692 -14.465 897 HZ PHE 120 HZ PHE 120 8.254 7.521 -16.711 898 H LYS 121 H LYS 121 6.126 9.715 -10.082 899 HA LYS 121 HA LYS 121 6.284 10.509 -7.978 900 HB2 LYS 121 HB2 LYS 121 5.418 13.110 -9.232 901 HB3 LYS 121 HB3 LYS 121 5.873 12.940 -7.541 902 HG2 LYS 121 HG2 LYS 121 8.080 11.966 -8.440 903 HG3 LYS 121 HG3 LYS 121 7.590 12.672 -9.984 904 HD2 LYS 121 HD2 LYS 121 7.427 14.871 -8.945 905 HD3 LYS 121 HD3 LYS 121 7.851 14.177 -7.379 906 HE2 LYS 121 HE2 LYS 121 10.029 13.463 -8.355 907 HE3 LYS 121 HE3 LYS 121 9.601 14.316 -9.837 908 HZ1 LYS 121 HZ1 LYS 121 9.445 16.368 -8.533 909 HZ2 LYS 121 HZ2 LYS 121 10.993 15.688 -8.460 910 HZ3 LYS 121 HZ3 LYS 121 9.941 15.531 -7.151 911 H GLY 122 H GLY 122 5.080 10.449 -6.162 912 HA2 GLY 122 HA2 GLY 122 2.165 10.872 -6.422 913 HA3 GLY 122 HA3 GLY 122 2.787 9.389 -5.719 914 H VAL 123 H VAL 123 1.575 9.905 -3.830 915 HA VAL 123 HA VAL 123 2.349 12.238 -2.266 916 HB VAL 123 HB VAL 123 0.521 9.941 -1.537 917 HG11 VAL 123 HG11 VAL 123 0.919 12.622 -0.196 918 HG12 VAL 123 HG12 VAL 123 1.399 11.050 0.449 919 HG13 VAL 123 HG13 VAL 123 -0.311 11.432 0.236 920 HG21 VAL 123 HG21 VAL 123 -1.306 11.525 -2.035 921 HG22 VAL 123 HG22 VAL 123 -0.326 11.176 -3.456 922 HG23 VAL 123 HG23 VAL 123 -0.117 12.702 -2.594 923 H LYS 124 H LYS 124 4.046 12.263 -0.945 924 HA LYS 124 HA LYS 124 5.658 9.970 -0.483 925 HB2 LYS 124 HB2 LYS 124 5.761 12.702 0.816 926 HB3 LYS 124 HB3 LYS 124 7.002 11.465 0.982 927 HG2 LYS 124 HG2 LYS 124 7.384 11.546 -1.450 928 HG3 LYS 124 HG3 LYS 124 6.175 12.827 -1.582 929 HD2 LYS 124 HD2 LYS 124 7.530 14.260 -0.125 930 HD3 LYS 124 HD3 LYS 124 8.732 12.977 0.030 931 HE2 LYS 124 HE2 LYS 124 7.959 14.416 -2.512 932 HE3 LYS 124 HE3 LYS 124 9.455 14.631 -1.605 933 HZ1 LYS 124 HZ1 LYS 124 8.578 12.195 -3.050 934 HZ2 LYS 124 HZ2 LYS 124 9.937 12.255 -2.049 935 HZ3 LYS 124 HZ3 LYS 124 9.877 13.202 -3.448 936 H GLY 125 H GLY 125 6.156 8.861 1.422 937 HA2 GLY 125 HA2 GLY 125 4.989 9.341 3.954 938 HA3 GLY 125 HA3 GLY 125 4.028 8.149 3.094 939 H THR 126 H THR 126 4.490 6.376 4.377 940 HA THR 126 HA THR 126 7.242 5.323 4.230 941 HB THR 126 HB THR 126 7.112 4.533 6.581 942 HG1 THR 126 HG1 THR 126 5.376 6.020 7.732 943 HG21 THR 126 HG21 THR 126 6.812 7.527 6.296 944 HG22 THR 126 HG22 THR 126 8.310 6.615 6.104 945 HG23 THR 126 HG23 THR 126 7.515 6.689 7.678 946 H VAL 127 H VAL 127 7.391 3.002 4.604 947 HA VAL 127 HA VAL 127 4.881 1.495 4.673 948 HB VAL 127 HB VAL 127 5.421 1.799 2.265 949 HG11 VAL 127 HG11 VAL 127 7.362 0.678 1.287 950 HG12 VAL 127 HG12 VAL 127 7.915 0.216 2.898 951 HG13 VAL 127 HG13 VAL 127 7.857 1.919 2.439 952 HG21 VAL 127 HG21 VAL 127 4.180 -0.171 2.994 953 HG22 VAL 127 HG22 VAL 127 5.691 -1.044 3.259 954 HG23 VAL 127 HG23 VAL 127 5.224 -0.564 1.626 955 H GLU 128 H GLU 128 5.054 -0.545 5.578 956 HA GLU 128 HA GLU 128 7.630 -1.785 6.087 957 HB2 GLU 128 HB2 GLU 128 7.282 -1.936 8.537 958 HB3 GLU 128 HB3 GLU 128 7.505 -0.278 7.996 959 HG2 GLU 128 HG2 GLU 128 5.190 0.209 8.240 960 HG3 GLU 128 HG3 GLU 128 4.789 -1.490 8.483 961 H LYS 129 H LYS 129 7.374 -4.023 6.989 962 HA LYS 129 HA LYS 129 4.868 -5.218 6.158 963 HB2 LYS 129 HB2 LYS 129 6.850 -6.532 5.758 964 HB3 LYS 129 HB3 LYS 129 7.302 -6.465 7.458 965 HG2 LYS 129 HG2 LYS 129 5.668 -7.979 8.099 966 HG3 LYS 129 HG3 LYS 129 4.657 -7.644 6.696 967 HD2 LYS 129 HD2 LYS 129 5.658 -9.875 6.579 968 HD3 LYS 129 HD3 LYS 129 6.211 -8.847 5.259 969 HE2 LYS 129 HE2 LYS 129 8.317 -8.466 6.389 970 HE3 LYS 129 HE3 LYS 129 7.761 -9.374 7.797 971 HZ1 LYS 129 HZ1 LYS 129 7.966 -10.570 5.093 972 HZ2 LYS 129 HZ2 LYS 129 7.769 -11.368 6.566 973 HZ3 LYS 129 HZ3 LYS 129 9.234 -10.610 6.210 974 H THR 130 H THR 130 3.208 -5.862 7.420 975 HA THR 130 HA THR 130 3.394 -5.097 10.270 976 HB THR 130 HB THR 130 2.046 -3.481 9.048 977 HG1 THR 130 HG1 THR 130 1.150 -3.634 10.993 978 HG21 THR 130 HG21 THR 130 -0.040 -4.121 7.940 979 HG22 THR 130 HG22 THR 130 0.286 -5.820 8.277 980 HG23 THR 130 HG23 THR 130 1.336 -4.922 7.181 981 H ASP 131 H ASP 131 2.070 -6.196 11.769 982 HA ASP 131 HA ASP 131 1.587 -8.978 11.239 983 HB2 ASP 131 HB2 ASP 131 0.660 -7.374 13.637 984 HB3 ASP 131 HB3 ASP 131 0.956 -9.110 13.554 985 H GLU 132 H GLU 132 -0.122 -6.133 10.726 986 HA GLU 132 HA GLU 132 -2.800 -6.965 11.161 987 HB2 GLU 132 HB2 GLU 132 -1.449 -4.655 9.854 988 HB3 GLU 132 HB3 GLU 132 -3.123 -4.956 9.411 989 HG2 GLU 132 HG2 GLU 132 -2.223 -4.701 12.271 990 HG3 GLU 132 HG3 GLU 132 -2.723 -3.320 11.294 991 H LYS 133 H LYS 133 -4.356 -7.615 9.795 992 HA LYS 133 HA LYS 133 -3.671 -9.057 7.416 993 HB2 LYS 133 HB2 LYS 133 -5.992 -9.680 7.326 994 HB3 LYS 133 HB3 LYS 133 -5.496 -9.731 9.009 995 HG2 LYS 133 HG2 LYS 133 -7.045 -7.477 7.725 996 HG3 LYS 133 HG3 LYS 133 -7.745 -8.768 8.699 997 HD2 LYS 133 HD2 LYS 133 -6.523 -8.011 10.652 998 HD3 LYS 133 HD3 LYS 133 -5.667 -6.804 9.690 999 HE2 LYS 133 HE2 LYS 133 -7.841 -5.713 9.210 1000 HE3 LYS 133 HE3 LYS 133 -8.625 -6.872 10.286 1001 HZ1 LYS 133 HZ1 LYS 133 -6.536 -4.901 11.061 1002 HZ2 LYS 133 HZ2 LYS 133 -7.237 -6.035 12.102 1003 HZ3 LYS 133 HZ3 LYS 133 -8.184 -4.808 11.431 1004 H VAL 134 H VAL 134 -4.577 -8.666 5.280 1005 HA VAL 134 HA VAL 134 -4.500 -5.948 4.434 1006 HB VAL 134 HB VAL 134 -5.450 -8.429 2.978 1007 HG11 VAL 134 HG11 VAL 134 -4.951 -5.654 1.877 1008 HG12 VAL 134 HG12 VAL 134 -6.514 -6.459 1.998 1009 HG13 VAL 134 HG13 VAL 134 -5.280 -7.094 0.911 1010 HG21 VAL 134 HG21 VAL 134 -3.299 -8.295 1.831 1011 HG22 VAL 134 HG22 VAL 134 -3.064 -8.409 3.575 1012 HG23 VAL 134 HG23 VAL 134 -2.877 -6.856 2.760 1013 H LEU 135 H LEU 135 -6.078 -4.473 4.269 1014 HA LEU 135 HA LEU 135 -8.645 -4.917 5.390 1015 HB2 LEU 135 HB2 LEU 135 -7.441 -2.657 3.810 1016 HB3 LEU 135 HB3 LEU 135 -9.134 -2.636 4.264 1017 HG LEU 135 HG LEU 135 -6.806 -2.743 6.191 1018 HD11 LEU 135 HD11 LEU 135 -7.471 -0.459 6.767 1019 HD12 LEU 135 HD12 LEU 135 -8.721 -0.500 5.522 1020 HD13 LEU 135 HD13 LEU 135 -7.018 -0.573 5.065 1021 HD21 LEU 135 HD21 LEU 135 -9.795 -2.617 6.635 1022 HD22 LEU 135 HD22 LEU 135 -8.586 -2.326 7.890 1023 HD23 LEU 135 HD23 LEU 135 -8.694 -3.910 7.122 1024 H SER 136 H SER 136 -10.261 -6.059 4.444 1025 HA SER 136 HA SER 136 -10.616 -6.343 1.640 1026 HB2 SER 136 HB2 SER 136 -11.747 -7.896 3.127 1027 HB3 SER 136 HB3 SER 136 -12.628 -6.578 3.898 1028 HG SER 136 HG SER 136 -13.148 -7.906 1.554 1029 H VAL 137 H VAL 137 -12.053 -5.241 0.227 1030 HA VAL 137 HA VAL 137 -12.051 -2.510 0.260 1031 HB VAL 137 HB VAL 137 -14.218 -4.240 -0.965 1032 HG11 VAL 137 HG11 VAL 137 -14.890 -1.896 -0.893 1033 HG12 VAL 137 HG12 VAL 137 -14.538 -2.387 -2.549 1034 HG13 VAL 137 HG13 VAL 137 -13.370 -1.417 -1.651 1035 HG21 VAL 137 HG21 VAL 137 -11.986 -4.919 -1.686 1036 HG22 VAL 137 HG22 VAL 137 -11.608 -3.256 -2.130 1037 HG23 VAL 137 HG23 VAL 137 -12.857 -4.138 -3.009 1038 H LYS 138 H LYS 138 -14.538 -4.621 1.636 1039 HA LYS 138 HA LYS 138 -16.302 -2.509 2.416 1040 HB2 LYS 138 HB2 LYS 138 -17.069 -4.813 2.010 1041 HB3 LYS 138 HB3 LYS 138 -16.139 -5.369 3.394 1042 HG2 LYS 138 HG2 LYS 138 -17.526 -3.983 4.876 1043 HG3 LYS 138 HG3 LYS 138 -18.466 -3.448 3.480 1044 HD2 LYS 138 HD2 LYS 138 -19.620 -5.243 4.666 1045 HD3 LYS 138 HD3 LYS 138 -19.144 -5.766 3.049 1046 HE2 LYS 138 HE2 LYS 138 -17.183 -6.900 4.007 1047 HE3 LYS 138 HE3 LYS 138 -17.686 -6.395 5.619 1048 HZ1 LYS 138 HZ1 LYS 138 -19.256 -8.147 3.801 1049 HZ2 LYS 138 HZ2 LYS 138 -19.696 -7.694 5.371 1050 HZ3 LYS 138 HZ3 LYS 138 -18.341 -8.674 5.124 1051 H GLU 139 H GLU 139 -13.854 -4.432 4.190 1052 HA GLU 139 HA GLU 139 -14.356 -3.373 6.754 1053 HB2 GLU 139 HB2 GLU 139 -13.014 -5.398 6.364 1054 HB3 GLU 139 HB3 GLU 139 -11.774 -4.440 5.570 1055 HG2 GLU 139 HG2 GLU 139 -11.086 -5.010 7.812 1056 HG3 GLU 139 HG3 GLU 139 -11.332 -3.270 7.683 1057 H LEU 140 H LEU 140 -12.318 -2.295 4.098 1058 HA LEU 140 HA LEU 140 -11.054 -0.117 5.307 1059 HB2 LEU 140 HB2 LEU 140 -10.823 -1.280 2.959 1060 HB3 LEU 140 HB3 LEU 140 -11.934 -0.023 2.448 1061 HG LEU 140 HG LEU 140 -9.383 0.619 3.902 1062 HD11 LEU 140 HD11 LEU 140 -9.754 0.359 0.925 1063 HD12 LEU 140 HD12 LEU 140 -8.785 -0.698 1.952 1064 HD13 LEU 140 HD13 LEU 140 -8.322 0.991 1.742 1065 HD21 LEU 140 HD21 LEU 140 -11.021 2.410 3.792 1066 HD22 LEU 140 HD22 LEU 140 -11.142 2.222 2.042 1067 HD23 LEU 140 HD23 LEU 140 -9.636 2.783 2.768 1068 H LEU 141 H LEU 141 -14.245 -0.389 3.759 1069 HA LEU 141 HA LEU 141 -15.038 2.300 3.869 1070 HB2 LEU 141 HB2 LEU 141 -16.832 -0.086 4.375 1071 HB3 LEU 141 HB3 LEU 141 -17.323 1.496 3.801 1072 HG LEU 141 HG LEU 141 -15.633 -0.481 2.262 1073 HD11 LEU 141 HD11 LEU 141 -17.929 -1.248 2.486 1074 HD12 LEU 141 HD12 LEU 141 -17.601 -0.738 0.830 1075 HD13 LEU 141 HD13 LEU 141 -18.522 0.310 1.910 1076 HD21 LEU 141 HD21 LEU 141 -15.069 1.800 1.665 1077 HD22 LEU 141 HD22 LEU 141 -16.774 2.184 1.429 1078 HD23 LEU 141 HD23 LEU 141 -15.973 1.031 0.362 1079 H GLU 142 H GLU 142 -15.407 -0.303 6.256 1080 HA GLU 142 HA GLU 142 -16.623 1.248 8.281 1081 HB2 GLU 142 HB2 GLU 142 -14.966 -1.279 8.524 1082 HB3 GLU 142 HB3 GLU 142 -16.007 -0.623 9.782 1083 HG2 GLU 142 HG2 GLU 142 -17.950 -0.910 8.287 1084 HG3 GLU 142 HG3 GLU 142 -16.888 -1.633 7.079 1085 H ALA 143 H ALA 143 -13.273 0.733 7.402 1086 HA ALA 143 HA ALA 143 -12.089 1.789 9.757 1087 HB1 ALA 143 HB1 ALA 143 -10.933 1.656 6.969 1088 HB2 ALA 143 HB2 ALA 143 -10.872 0.362 8.169 1089 HB3 ALA 143 HB3 ALA 143 -10.030 1.885 8.469 1090 H ILE 144 H ILE 144 -13.011 3.310 6.667 1091 HA ILE 144 HA ILE 144 -12.036 5.894 7.543 1092 HB ILE 144 HB ILE 144 -12.928 6.763 5.398 1093 HG12 ILE 144 HG12 ILE 144 -13.488 4.779 3.725 1094 HG13 ILE 144 HG13 ILE 144 -14.012 3.972 5.195 1095 HG21 ILE 144 HG21 ILE 144 -10.647 5.951 5.551 1096 HG22 ILE 144 HG22 ILE 144 -11.324 5.585 3.964 1097 HG23 ILE 144 HG23 ILE 144 -11.180 4.309 5.176 1098 HD11 ILE 144 HD11 ILE 144 -15.600 5.766 5.620 1099 HD12 ILE 144 HD12 ILE 144 -15.860 5.043 4.032 1100 HD13 ILE 144 HD13 ILE 144 -15.051 6.604 4.168 1101 H GLY 145 H GLY 145 -14.993 4.167 7.782 1102 HA2 GLY 145 HA2 GLY 145 -16.301 5.451 9.648 1103 HA3 GLY 145 HA3 GLY 145 -16.519 6.619 8.357 1104 H SER 146 H SER 146 -16.997 4.983 6.193 1105 HA SER 146 HA SER 146 -19.735 4.516 6.364 1106 HB2 SER 146 HB2 SER 146 -17.838 3.195 4.402 1107 HB3 SER 146 HB3 SER 146 -19.566 3.470 4.178 1108 HG SER 146 HG SER 146 -18.928 5.799 4.504 Start of MODEL 15 1 H1 MET 1 H1 MET 1 36.823 23.874 65.930 2 H2 MET 1 H2 MET 1 35.874 22.932 66.963 3 H3 MET 1 H3 MET 1 37.123 23.876 67.598 4 HA MET 1 HA MET 1 34.963 24.866 68.014 5 HB2 MET 1 HB2 MET 1 35.482 27.120 67.021 6 HB3 MET 1 HB3 MET 1 36.811 26.375 67.897 7 HG2 MET 1 HG2 MET 1 37.736 25.611 65.705 8 HG3 MET 1 HG3 MET 1 36.477 26.553 64.909 9 HE1 MET 1 HE1 MET 1 36.337 29.089 66.950 10 HE2 MET 1 HE2 MET 1 36.243 29.208 65.192 11 HE3 MET 1 HE3 MET 1 37.398 30.200 66.086 12 H GLY 2 H GLY 2 33.148 23.832 67.160 13 HA2 GLY 2 HA2 GLY 2 31.264 23.722 65.833 14 HA3 GLY 2 HA3 GLY 2 31.895 25.068 64.896 15 H SER 3 H SER 3 30.545 22.699 63.874 16 HA SER 3 HA SER 3 32.347 22.043 61.758 17 HB2 SER 3 HB2 SER 3 32.539 19.611 62.166 18 HB3 SER 3 HB3 SER 3 33.321 20.550 63.436 19 HG SER 3 HG SER 3 30.665 19.966 63.937 20 H SER 4 H SER 4 31.056 21.954 60.042 21 HA SER 4 HA SER 4 28.293 21.067 60.288 22 HB2 SER 4 HB2 SER 4 28.079 21.750 57.923 23 HB3 SER 4 HB3 SER 4 28.755 23.045 58.911 24 HG SER 4 HG SER 4 30.637 22.863 57.914 25 H HIS 5 H HIS 5 27.898 18.961 60.247 26 HA HIS 5 HA HIS 5 29.722 17.066 59.058 27 HB2 HIS 5 HB2 HIS 5 27.984 15.382 59.833 28 HB3 HIS 5 HB3 HIS 5 28.716 16.372 61.090 29 HD1 HIS 5 HD1 HIS 5 27.139 17.481 62.638 30 HD2 HIS 5 HD2 HIS 5 25.299 16.425 59.065 31 HE1 HIS 5 HE1 HIS 5 24.714 18.032 62.941 32 HE2 HIS 5 HE2 HIS 5 23.601 17.236 60.836 33 H HIS 6 H HIS 6 29.168 15.487 57.430 34 HA HIS 6 HA HIS 6 27.170 16.495 55.488 35 HB2 HIS 6 HB2 HIS 6 28.701 15.694 53.696 36 HB3 HIS 6 HB3 HIS 6 29.407 16.973 54.678 37 HD1 HIS 6 HD1 HIS 6 31.444 16.380 56.119 38 HD2 HIS 6 HD2 HIS 6 29.955 13.166 53.947 39 HE1 HIS 6 HE1 HIS 6 33.179 14.584 56.309 40 HE2 HIS 6 HE2 HIS 6 32.339 12.715 54.853 41 H HIS 7 H HIS 7 26.415 14.843 53.910 42 HA HIS 7 HA HIS 7 26.587 12.051 54.802 43 HB2 HIS 7 HB2 HIS 7 23.938 13.417 54.232 44 HB3 HIS 7 HB3 HIS 7 24.168 11.735 54.696 45 HD1 HIS 7 HD1 HIS 7 23.434 14.984 56.090 46 HD2 HIS 7 HD2 HIS 7 25.300 11.524 57.441 47 HE1 HIS 7 HE1 HIS 7 23.429 15.156 58.594 48 HE2 HIS 7 HE2 HIS 7 24.679 13.117 59.386 49 H HIS 8 H HIS 8 25.316 10.625 53.082 50 HA HIS 8 HA HIS 8 25.557 11.782 50.391 51 HB2 HIS 8 HB2 HIS 8 26.812 9.801 49.581 52 HB3 HIS 8 HB3 HIS 8 27.714 10.749 50.756 53 HD1 HIS 8 HD1 HIS 8 28.053 9.679 53.124 54 HD2 HIS 8 HD2 HIS 8 26.281 7.179 50.315 55 HE1 HIS 8 HE1 HIS 8 28.236 7.367 54.071 56 HE2 HIS 8 HE2 HIS 8 27.008 5.901 52.443 57 H HIS 9 H HIS 9 24.265 10.862 48.802 58 HA HIS 9 HA HIS 9 22.206 8.976 49.786 59 HB2 HIS 9 HB2 HIS 9 21.878 11.061 47.610 60 HB3 HIS 9 HB3 HIS 9 20.615 10.049 48.302 61 HD1 HIS 9 HD1 HIS 9 19.767 10.683 50.698 62 HD2 HIS 9 HD2 HIS 9 22.505 13.349 49.059 63 HE1 HIS 9 HE1 HIS 9 19.628 12.749 52.110 64 HE2 HIS 9 HE2 HIS 9 21.091 14.417 50.939 65 H HIS 10 H HIS 10 21.671 7.217 48.541 66 HA HIS 10 HA HIS 10 23.369 6.629 46.225 67 HB2 HIS 10 HB2 HIS 10 22.473 4.338 46.405 68 HB3 HIS 10 HB3 HIS 10 23.154 4.885 47.931 69 HD1 HIS 10 HD1 HIS 10 19.947 3.879 46.322 70 HD2 HIS 10 HD2 HIS 10 21.287 5.239 50.013 71 HE1 HIS 10 HE1 HIS 10 18.037 3.519 47.902 72 HE2 HIS 10 HE2 HIS 10 18.807 4.508 50.078 73 H SER 11 H SER 11 22.606 6.378 44.133 74 HA SER 11 HA SER 11 19.758 6.489 43.576 75 HB2 SER 11 HB2 SER 11 19.897 8.540 42.197 76 HB3 SER 11 HB3 SER 11 20.261 8.864 43.890 77 HG SER 11 HG SER 11 21.783 9.306 41.727 78 H SER 12 H SER 12 19.322 5.270 41.856 79 HA SER 12 HA SER 12 20.779 5.482 39.399 80 HB2 SER 12 HB2 SER 12 22.287 3.905 40.538 81 HB3 SER 12 HB3 SER 12 20.933 2.820 40.854 82 HG SER 12 HG SER 12 21.283 2.010 38.948 83 H GLY 13 H GLY 13 19.483 4.970 37.679 84 HA2 GLY 13 HA2 GLY 13 17.281 3.101 37.939 85 HA3 GLY 13 HA3 GLY 13 16.775 4.779 37.817 86 H ARG 14 H ARG 14 18.683 2.281 36.165 87 HA ARG 14 HA ARG 14 18.192 3.662 33.596 88 HB2 ARG 14 HB2 ARG 14 20.313 1.595 34.239 89 HB3 ARG 14 HB3 ARG 14 20.128 2.456 32.718 90 HG2 ARG 14 HG2 ARG 14 20.786 3.757 35.361 91 HG3 ARG 14 HG3 ARG 14 21.968 3.312 34.134 92 HD2 ARG 14 HD2 ARG 14 21.595 5.599 33.784 93 HD3 ARG 14 HD3 ARG 14 20.630 4.804 32.543 94 HE ARG 14 HE ARG 14 18.666 5.257 33.922 95 HH11 ARG 14 HH11 ARG 14 21.535 6.994 34.694 96 HH12 ARG 14 HH12 ARG 14 20.680 8.311 35.413 97 HH21 ARG 14 HH21 ARG 14 17.572 6.943 34.871 98 HH22 ARG 14 HH22 ARG 14 18.458 8.277 35.527 99 H GLU 15 H GLU 15 16.662 2.768 32.345 100 HA GLU 15 HA GLU 15 15.959 -0.066 32.782 101 HB2 GLU 15 HB2 GLU 15 14.266 2.169 31.644 102 HB3 GLU 15 HB3 GLU 15 13.737 0.511 31.891 103 HG2 GLU 15 HG2 GLU 15 14.501 2.510 34.012 104 HG3 GLU 15 HG3 GLU 15 12.891 1.880 33.670 105 H ASN 16 H ASN 16 14.581 -0.789 30.636 106 HA ASN 16 HA ASN 16 16.484 -0.517 28.386 107 HB2 ASN 16 HB2 ASN 16 16.846 -2.658 29.465 108 HB3 ASN 16 HB3 ASN 16 15.123 -3.016 29.424 109 HD21 ASN 16 HD21 ASN 16 15.257 -4.845 28.210 110 HD22 ASN 16 HD22 ASN 16 15.758 -4.863 26.557 111 H LEU 17 H LEU 17 15.568 0.184 26.554 112 HA LEU 17 HA LEU 17 12.771 -0.573 25.963 113 HB2 LEU 17 HB2 LEU 17 14.339 1.850 25.113 114 HB3 LEU 17 HB3 LEU 17 12.857 1.356 24.314 115 HG LEU 17 HG LEU 17 11.780 1.463 26.654 116 HD11 LEU 17 HD11 LEU 17 12.806 3.044 28.209 117 HD12 LEU 17 HD12 LEU 17 14.238 3.125 27.181 118 HD13 LEU 17 HD13 LEU 17 13.803 1.610 27.972 119 HD21 LEU 17 HD21 LEU 17 11.280 3.005 24.848 120 HD22 LEU 17 HD22 LEU 17 12.669 3.998 25.295 121 HD23 LEU 17 HD23 LEU 17 11.309 3.832 26.405 122 H TYR 18 H TYR 18 12.422 -1.843 24.202 123 HA TYR 18 HA TYR 18 14.788 -2.551 22.593 124 HB2 TYR 18 HB2 TYR 18 13.579 -4.714 22.169 125 HB3 TYR 18 HB3 TYR 18 14.034 -4.435 23.844 126 HD1 TYR 18 HD2 TYR 18 12.316 -3.925 25.536 127 HD2 TYR 18 HD1 TYR 18 11.248 -4.819 21.509 128 HE1 TYR 18 HE2 TYR 18 9.998 -4.322 26.245 129 HE2 TYR 18 HE1 TYR 18 8.924 -5.217 22.211 130 HH TYR 18 HH TYR 18 7.746 -4.306 25.268 131 H PHE 19 H PHE 19 14.536 -3.087 20.367 132 HA PHE 19 HA PHE 19 12.252 -1.765 19.030 133 HB2 PHE 19 HB2 PHE 19 15.137 -1.932 18.104 134 HB3 PHE 19 HB3 PHE 19 13.817 -1.211 17.188 135 HD1 PHE 19 HD1 PHE 19 12.778 0.883 17.937 136 HD2 PHE 19 HD2 PHE 19 16.150 -0.774 19.947 137 HE1 PHE 19 HE1 PHE 19 13.157 3.028 19.067 138 HE2 PHE 19 HE2 PHE 19 16.536 1.376 21.075 139 HZ PHE 19 HZ PHE 19 15.039 3.283 20.636 140 H GLN 20 H GLN 20 11.913 -2.641 16.712 141 HA GLN 20 HA GLN 20 12.528 -5.521 16.599 142 HB2 GLN 20 HB2 GLN 20 10.217 -5.984 15.834 143 HB3 GLN 20 HB3 GLN 20 10.303 -5.393 17.486 144 HG2 GLN 20 HG2 GLN 20 9.585 -3.190 16.775 145 HG3 GLN 20 HG3 GLN 20 9.594 -3.707 15.088 146 HE21 GLN 20 HE21 GLN 20 7.931 -3.927 18.139 147 HE22 GLN 20 HE22 GLN 20 6.487 -4.644 17.519 148 H GLY 21 H GLY 21 11.456 -2.702 14.695 149 HA2 GLY 21 HA2 GLY 21 12.964 -3.661 12.414 150 HA3 GLY 21 HA3 GLY 21 11.223 -3.741 12.185 151 H HIS 22 H HIS 22 12.708 -2.221 10.469 152 HA HIS 22 HA HIS 22 12.181 0.552 11.349 153 HB2 HIS 22 HB2 HIS 22 14.016 1.284 9.884 154 HB3 HIS 22 HB3 HIS 22 14.572 0.177 11.130 155 HD1 HIS 22 HD1 HIS 22 15.247 -2.246 10.327 156 HD2 HIS 22 HD2 HIS 22 14.458 0.473 7.284 157 HE1 HIS 22 HE1 HIS 22 16.224 -3.258 8.250 158 HE2 HIS 22 HE2 HIS 22 15.907 -1.508 6.474 159 H MET 23 H MET 23 10.577 1.523 10.299 160 HA MET 23 HA MET 23 9.615 0.632 7.728 161 HB2 MET 23 HB2 MET 23 7.978 2.442 8.006 162 HB3 MET 23 HB3 MET 23 8.086 1.461 9.461 163 HG2 MET 23 HG2 MET 23 9.697 3.224 10.350 164 HG3 MET 23 HG3 MET 23 9.165 4.225 9.001 165 HE1 MET 23 HE1 MET 23 6.136 2.891 8.963 166 HE2 MET 23 HE2 MET 23 6.435 4.588 8.583 167 HE3 MET 23 HE3 MET 23 5.237 4.160 9.802 168 H LEU 24 H LEU 24 9.839 1.709 5.742 169 HA LEU 24 HA LEU 24 11.990 3.731 5.686 170 HB2 LEU 24 HB2 LEU 24 11.052 1.799 3.572 171 HB3 LEU 24 HB3 LEU 24 12.180 3.107 3.254 172 HG LEU 24 HG LEU 24 13.302 1.813 5.447 173 HD11 LEU 24 HD11 LEU 24 12.263 -0.279 3.539 174 HD12 LEU 24 HD12 LEU 24 11.765 -0.058 5.217 175 HD13 LEU 24 HD13 LEU 24 13.419 -0.545 4.846 176 HD21 LEU 24 HD21 LEU 24 15.013 1.107 3.868 177 HD22 LEU 24 HD22 LEU 24 14.484 2.761 3.550 178 HD23 LEU 24 HD23 LEU 24 13.923 1.440 2.520 179 H GLU 25 H GLU 25 11.798 5.642 4.599 180 HA GLU 25 HA GLU 25 9.147 6.653 4.196 181 HB2 GLU 25 HB2 GLU 25 11.107 7.854 5.276 182 HB3 GLU 25 HB3 GLU 25 11.788 8.017 3.662 183 HG2 GLU 25 HG2 GLU 25 9.839 9.260 2.954 184 HG3 GLU 25 HG3 GLU 25 9.134 9.077 4.556 185 H VAL 26 H VAL 26 8.096 6.356 2.319 186 HA VAL 26 HA VAL 26 9.629 6.309 -0.211 187 HB VAL 26 HB VAL 26 8.128 4.544 -1.064 188 HG11 VAL 26 HG11 VAL 26 9.522 3.746 1.496 189 HG12 VAL 26 HG12 VAL 26 10.295 3.940 -0.076 190 HG13 VAL 26 HG13 VAL 26 9.092 2.675 0.161 191 HG21 VAL 26 HG21 VAL 26 7.065 4.452 1.768 192 HG22 VAL 26 HG22 VAL 26 6.686 3.292 0.494 193 HG23 VAL 26 HG23 VAL 26 6.175 4.973 0.336 194 H GLU 27 H GLU 27 8.374 6.863 -2.143 195 HA GLU 27 HA GLU 27 6.126 8.658 -1.546 196 HB2 GLU 27 HB2 GLU 27 8.006 9.532 -2.913 197 HB3 GLU 27 HB3 GLU 27 7.658 8.321 -4.138 198 HG2 GLU 27 HG2 GLU 27 5.522 9.315 -4.608 199 HG3 GLU 27 HG3 GLU 27 5.690 10.427 -3.251 200 H VAL 28 H VAL 28 4.153 7.911 -1.730 201 HA VAL 28 HA VAL 28 3.602 5.378 -3.047 202 HB VAL 28 HB VAL 28 1.731 7.126 -1.429 203 HG11 VAL 28 HG11 VAL 28 1.553 4.210 -2.201 204 HG12 VAL 28 HG12 VAL 28 0.567 5.522 -2.848 205 HG13 VAL 28 HG13 VAL 28 0.424 5.065 -1.150 206 HG21 VAL 28 HG21 VAL 28 3.644 6.520 -0.068 207 HG22 VAL 28 HG22 VAL 28 3.464 4.824 -0.517 208 HG23 VAL 28 HG23 VAL 28 2.224 5.614 0.459 209 H ILE 29 H ILE 29 3.010 5.373 -5.130 210 HA ILE 29 HA ILE 29 1.694 7.736 -6.275 211 HB ILE 29 HB ILE 29 2.543 5.384 -7.935 212 HG12 ILE 29 HG12 ILE 29 4.440 7.565 -7.022 213 HG13 ILE 29 HG13 ILE 29 4.421 5.942 -6.342 214 HG21 ILE 29 HG21 ILE 29 2.474 8.380 -8.358 215 HG22 ILE 29 HG22 ILE 29 1.350 7.193 -9.026 216 HG23 ILE 29 HG23 ILE 29 3.032 7.207 -9.556 217 HD11 ILE 29 HD11 ILE 29 4.970 5.022 -8.532 218 HD12 ILE 29 HD12 ILE 29 6.177 6.183 -7.979 219 HD13 ILE 29 HD13 ILE 29 5.000 6.654 -9.206 220 H SER 30 H SER 30 -0.124 7.442 -7.769 221 HA SER 30 HA SER 30 -1.721 5.009 -7.263 222 HB2 SER 30 HB2 SER 30 -2.727 7.862 -7.400 223 HB3 SER 30 HB3 SER 30 -3.770 6.440 -7.377 224 HG SER 30 HG SER 30 -1.985 6.283 -5.381 225 H GLY 31 H GLY 31 -1.677 3.901 -9.116 226 HA2 GLY 31 HA2 GLY 31 -1.597 5.346 -11.674 227 HA3 GLY 31 HA3 GLY 31 -1.245 3.646 -11.432 228 H ARG 32 H ARG 32 -3.290 5.555 -12.985 229 HA ARG 32 HA ARG 32 -5.819 4.385 -12.282 230 HB2 ARG 32 HB2 ARG 32 -5.793 6.641 -13.143 231 HB3 ARG 32 HB3 ARG 32 -5.002 6.118 -14.624 232 HG2 ARG 32 HG2 ARG 32 -6.985 4.856 -15.268 233 HG3 ARG 32 HG3 ARG 32 -7.778 5.302 -13.757 234 HD2 ARG 32 HD2 ARG 32 -6.826 7.301 -15.808 235 HD3 ARG 32 HD3 ARG 32 -8.464 6.648 -15.764 236 HE ARG 32 HE ARG 32 -7.569 7.852 -13.294 237 HH11 ARG 32 HH11 ARG 32 -9.111 8.404 -16.319 238 HH12 ARG 32 HH12 ARG 32 -10.005 9.769 -15.741 239 HH21 ARG 32 HH21 ARG 32 -8.726 9.594 -12.553 240 HH22 ARG 32 HH22 ARG 32 -9.812 10.415 -13.619 241 H THR 33 H THR 33 -5.170 2.131 -12.487 242 HA THR 33 HA THR 33 -5.220 1.082 -15.233 243 HB THR 33 HB THR 33 -3.660 -0.036 -13.733 244 HG1 THR 33 HG1 THR 33 -5.065 -2.197 -13.705 245 HG21 THR 33 HG21 THR 33 -6.070 -0.623 -12.002 246 HG22 THR 33 HG22 THR 33 -4.729 0.448 -11.593 247 HG23 THR 33 HG23 THR 33 -4.452 -1.286 -11.759 248 H LEU 34 H LEU 34 -7.266 1.796 -12.631 249 HA LEU 34 HA LEU 34 -9.606 0.752 -14.013 250 HB2 LEU 34 HB2 LEU 34 -8.945 -1.070 -12.498 251 HB3 LEU 34 HB3 LEU 34 -8.925 0.044 -11.146 252 HG LEU 34 HG LEU 34 -11.380 0.367 -11.410 253 HD11 LEU 34 HD11 LEU 34 -11.583 -0.162 -13.786 254 HD12 LEU 34 HD12 LEU 34 -12.655 -1.170 -12.816 255 HD13 LEU 34 HD13 LEU 34 -11.156 -1.842 -13.457 256 HD21 LEU 34 HD21 LEU 34 -12.031 -1.835 -10.532 257 HD22 LEU 34 HD22 LEU 34 -10.542 -1.246 -9.795 258 HD23 LEU 34 HD23 LEU 34 -10.475 -2.492 -11.043 259 H ASN 35 H ASN 35 -11.571 1.822 -13.339 260 HA ASN 35 HA ASN 35 -12.896 3.468 -12.503 261 HB2 ASN 35 HB2 ASN 35 -10.663 3.834 -10.496 262 HB3 ASN 35 HB3 ASN 35 -12.206 4.678 -10.423 263 HD21 ASN 35 HD21 ASN 35 -10.954 2.792 -8.573 264 HD22 ASN 35 HD22 ASN 35 -12.098 1.523 -8.352 265 H GLN 36 H GLN 36 -13.018 4.907 -14.151 266 HA GLN 36 HA GLN 36 -11.034 7.003 -14.515 267 HB2 GLN 36 HB2 GLN 36 -13.808 6.655 -15.698 268 HB3 GLN 36 HB3 GLN 36 -12.662 7.900 -16.173 269 HG2 GLN 36 HG2 GLN 36 -11.129 6.212 -17.003 270 HG3 GLN 36 HG3 GLN 36 -12.213 4.931 -16.460 271 HE21 GLN 36 HE21 GLN 36 -14.623 6.380 -17.281 272 HE22 GLN 36 HE22 GLN 36 -14.677 6.266 -19.002 273 H GLY 37 H GLY 37 -14.017 6.466 -12.855 274 HA2 GLY 37 HA2 GLY 37 -13.729 8.522 -10.993 275 HA3 GLY 37 HA3 GLY 37 -14.785 9.123 -12.268 276 H ALA 38 H ALA 38 -14.366 6.264 -10.161 277 HA ALA 38 HA ALA 38 -17.299 6.097 -9.894 278 HB1 ALA 38 HB1 ALA 38 -16.610 4.498 -11.632 279 HB2 ALA 38 HB2 ALA 38 -17.248 3.678 -10.206 280 HB3 ALA 38 HB3 ALA 38 -15.506 3.732 -10.488 281 H THR 39 H THR 39 -18.013 4.773 -8.074 282 HA THR 39 HA THR 39 -16.263 4.948 -5.751 283 HB THR 39 HB THR 39 -18.180 4.217 -4.444 284 HG1 THR 39 HG1 THR 39 -20.210 3.849 -5.716 285 HG21 THR 39 HG21 THR 39 -19.803 5.973 -4.975 286 HG22 THR 39 HG22 THR 39 -19.058 6.193 -6.559 287 HG23 THR 39 HG23 THR 39 -18.152 6.583 -5.095 288 H VAL 40 H VAL 40 -16.189 2.958 -4.251 289 HA VAL 40 HA VAL 40 -15.151 0.719 -5.679 290 HB VAL 40 HB VAL 40 -14.766 -0.334 -3.588 291 HG11 VAL 40 HG11 VAL 40 -13.677 1.437 -2.265 292 HG12 VAL 40 HG12 VAL 40 -14.521 2.653 -3.227 293 HG13 VAL 40 HG13 VAL 40 -13.347 1.580 -3.992 294 HG21 VAL 40 HG21 VAL 40 -15.763 0.409 -1.467 295 HG22 VAL 40 HG22 VAL 40 -16.985 -0.146 -2.609 296 HG23 VAL 40 HG23 VAL 40 -16.749 1.581 -2.345 297 H GLU 41 H GLU 41 -18.243 1.461 -4.214 298 HA GLU 41 HA GLU 41 -19.394 -1.130 -4.483 299 HB2 GLU 41 HB2 GLU 41 -20.166 0.585 -2.872 300 HB3 GLU 41 HB3 GLU 41 -20.746 1.565 -4.208 301 HG2 GLU 41 HG2 GLU 41 -21.782 -1.219 -3.947 302 HG3 GLU 41 HG3 GLU 41 -22.349 -0.002 -2.809 303 H GLU 42 H GLU 42 -19.119 1.647 -6.575 304 HA GLU 42 HA GLU 42 -20.951 1.071 -8.578 305 HB2 GLU 42 HB2 GLU 42 -18.977 2.931 -8.178 306 HB3 GLU 42 HB3 GLU 42 -18.309 2.015 -9.514 307 HG2 GLU 42 HG2 GLU 42 -21.053 3.259 -9.519 308 HG3 GLU 42 HG3 GLU 42 -19.612 4.049 -10.147 309 H LYS 43 H LYS 43 -17.871 -0.455 -7.870 310 HA LYS 43 HA LYS 43 -18.232 -2.310 -10.136 311 HB2 LYS 43 HB2 LYS 43 -15.825 -1.390 -8.663 312 HB3 LYS 43 HB3 LYS 43 -15.825 -3.031 -9.277 313 HG2 LYS 43 HG2 LYS 43 -14.933 -2.072 -11.101 314 HG3 LYS 43 HG3 LYS 43 -16.610 -1.726 -11.499 315 HD2 LYS 43 HD2 LYS 43 -15.036 0.242 -9.881 316 HD3 LYS 43 HD3 LYS 43 -14.792 0.152 -11.624 317 HE2 LYS 43 HE2 LYS 43 -17.411 0.652 -10.222 318 HE3 LYS 43 HE3 LYS 43 -16.429 1.853 -11.054 319 HZ1 LYS 43 HZ1 LYS 43 -18.206 1.125 -12.468 320 HZ2 LYS 43 HZ2 LYS 43 -17.750 -0.491 -12.297 321 HZ3 LYS 43 HZ3 LYS 43 -16.737 0.588 -13.108 322 H LEU 44 H LEU 44 -16.739 -2.688 -6.920 323 HA LEU 44 HA LEU 44 -16.702 -4.398 -5.442 324 HB2 LEU 44 HB2 LEU 44 -19.605 -4.307 -6.176 325 HB3 LEU 44 HB3 LEU 44 -19.014 -5.495 -5.031 326 HG LEU 44 HG LEU 44 -18.858 -2.494 -4.735 327 HD11 LEU 44 HD11 LEU 44 -20.375 -2.869 -2.834 328 HD12 LEU 44 HD12 LEU 44 -20.463 -4.580 -3.257 329 HD13 LEU 44 HD13 LEU 44 -21.092 -3.363 -4.367 330 HD21 LEU 44 HD21 LEU 44 -17.946 -2.937 -2.499 331 HD22 LEU 44 HD22 LEU 44 -16.876 -3.531 -3.769 332 HD23 LEU 44 HD23 LEU 44 -17.887 -4.661 -2.868 333 H THR 45 H THR 45 -16.620 -5.152 -8.538 334 HA THR 45 HA THR 45 -17.251 -7.944 -8.522 335 HB THR 45 HB THR 45 -17.093 -6.778 -10.654 336 HG1 THR 45 HG1 THR 45 -15.636 -8.290 -11.694 337 HG21 THR 45 HG21 THR 45 -14.155 -6.423 -10.006 338 HG22 THR 45 HG22 THR 45 -15.360 -5.137 -10.106 339 HG23 THR 45 HG23 THR 45 -14.915 -6.045 -11.552 340 H GLU 46 H GLU 46 -15.585 -9.703 -8.720 341 HA GLU 46 HA GLU 46 -13.865 -9.685 -6.498 342 HB2 GLU 46 HB2 GLU 46 -14.715 -11.769 -7.488 343 HB3 GLU 46 HB3 GLU 46 -13.736 -11.495 -8.926 344 HG2 GLU 46 HG2 GLU 46 -11.702 -11.724 -7.634 345 HG3 GLU 46 HG3 GLU 46 -12.628 -11.862 -6.141 346 H GLU 47 H GLU 47 -13.236 -8.962 -9.892 347 HA GLU 47 HA GLU 47 -10.466 -8.780 -9.908 348 HB2 GLU 47 HB2 GLU 47 -12.431 -6.945 -11.307 349 HB3 GLU 47 HB3 GLU 47 -10.741 -7.162 -11.746 350 HG2 GLU 47 HG2 GLU 47 -11.125 -9.419 -12.422 351 HG3 GLU 47 HG3 GLU 47 -12.757 -9.398 -11.756 352 H TYR 48 H TYR 48 -12.827 -6.514 -8.618 353 HA TYR 48 HA TYR 48 -11.101 -4.312 -8.193 354 HB2 TYR 48 HB2 TYR 48 -13.738 -4.534 -8.051 355 HB3 TYR 48 HB3 TYR 48 -13.417 -4.858 -6.352 356 HD1 TYR 48 HD1 TYR 48 -11.890 -3.077 -5.135 357 HD2 TYR 48 HD2 TYR 48 -14.029 -2.336 -8.752 358 HE1 TYR 48 HE1 TYR 48 -11.744 -0.662 -4.726 359 HE2 TYR 48 HE2 TYR 48 -13.876 0.085 -8.343 360 HH TYR 48 HH TYR 48 -13.564 1.623 -6.471 361 H PHE 49 H PHE 49 -11.767 -7.216 -6.335 362 HA PHE 49 HA PHE 49 -10.305 -6.277 -3.997 363 HB2 PHE 49 HB2 PHE 49 -12.382 -7.693 -3.834 364 HB3 PHE 49 HB3 PHE 49 -11.464 -9.031 -4.513 365 HD1 PHE 49 HD1 PHE 49 -11.444 -6.621 -1.666 366 HD2 PHE 49 HD2 PHE 49 -10.302 -10.476 -3.081 367 HE1 PHE 49 HE1 PHE 49 -10.685 -7.223 0.596 368 HE2 PHE 49 HE2 PHE 49 -9.540 -11.081 -0.819 369 HZ PHE 49 HZ PHE 49 -9.732 -9.456 1.021 370 H ASN 50 H ASN 50 -9.262 -7.313 -6.901 371 HA ASN 50 HA ASN 50 -6.869 -8.590 -5.718 372 HB2 ASN 50 HB2 ASN 50 -8.159 -9.121 -8.403 373 HB3 ASN 50 HB3 ASN 50 -6.549 -9.691 -7.970 374 HD21 ASN 50 HD21 ASN 50 -9.951 -10.038 -7.399 375 HD22 ASN 50 HD22 ASN 50 -9.854 -11.513 -6.511 376 H ALA 51 H ALA 51 -8.060 -6.274 -8.091 377 HA ALA 51 HA ALA 51 -5.554 -5.709 -9.299 378 HB1 ALA 51 HB1 ALA 51 -8.061 -4.026 -9.248 379 HB2 ALA 51 HB2 ALA 51 -7.679 -5.281 -10.427 380 HB3 ALA 51 HB3 ALA 51 -6.694 -3.820 -10.344 381 H VAL 52 H VAL 52 -7.466 -3.797 -6.942 382 HA VAL 52 HA VAL 52 -5.202 -1.952 -6.647 383 HB VAL 52 HB VAL 52 -6.793 -0.476 -5.489 384 HG11 VAL 52 HG11 VAL 52 -6.581 -0.325 -7.913 385 HG12 VAL 52 HG12 VAL 52 -8.235 0.020 -7.407 386 HG13 VAL 52 HG13 VAL 52 -7.838 -1.548 -8.115 387 HG21 VAL 52 HG21 VAL 52 -9.182 -1.067 -5.387 388 HG22 VAL 52 HG22 VAL 52 -8.197 -2.168 -4.424 389 HG23 VAL 52 HG23 VAL 52 -8.805 -2.680 -5.999 390 H ASN 53 H ASN 53 -5.462 -4.718 -5.281 391 HA ASN 53 HA ASN 53 -5.518 -3.865 -2.458 392 HB2 ASN 53 HB2 ASN 53 -5.821 -6.597 -3.713 393 HB3 ASN 53 HB3 ASN 53 -5.730 -6.327 -1.978 394 HD21 ASN 53 HD21 ASN 53 -7.411 -4.286 -4.319 395 HD22 ASN 53 HD22 ASN 53 -8.989 -4.589 -3.706 396 H TYR 54 H TYR 54 -3.125 -3.725 -4.421 397 HA TYR 54 HA TYR 54 -1.210 -4.831 -2.508 398 HB2 TYR 54 HB2 TYR 54 0.118 -5.965 -4.185 399 HB3 TYR 54 HB3 TYR 54 -1.529 -6.582 -4.246 400 HD1 TYR 54 HD1 TYR 54 0.969 -4.496 -5.995 401 HD2 TYR 54 HD2 TYR 54 -2.890 -6.283 -6.216 402 HE1 TYR 54 HE1 TYR 54 0.884 -4.005 -8.402 403 HE2 TYR 54 HE2 TYR 54 -2.984 -5.784 -8.621 404 HH TYR 54 HH TYR 54 -1.989 -4.270 -10.231 405 H ALA 55 H ALA 55 1.079 -4.172 -3.086 406 HA ALA 55 HA ALA 55 1.194 -1.590 -4.514 407 HB1 ALA 55 HB1 ALA 55 2.640 -0.671 -2.779 408 HB2 ALA 55 HB2 ALA 55 2.509 -2.169 -1.855 409 HB3 ALA 55 HB3 ALA 55 1.087 -1.156 -2.099 410 H GLU 56 H GLU 56 2.922 -1.356 -5.857 411 HA GLU 56 HA GLU 56 4.845 -3.525 -6.078 412 HB2 GLU 56 HB2 GLU 56 4.414 -1.024 -7.729 413 HB3 GLU 56 HB3 GLU 56 5.714 -2.165 -8.035 414 HG2 GLU 56 HG2 GLU 56 3.981 -3.941 -8.344 415 HG3 GLU 56 HG3 GLU 56 2.754 -2.680 -8.230 416 H ILE 57 H ILE 57 6.692 -3.541 -5.032 417 HA ILE 57 HA ILE 57 7.741 -1.032 -3.876 418 HB ILE 57 HB ILE 57 8.072 -3.859 -2.845 419 HG12 ILE 57 HG12 ILE 57 6.304 -1.721 -1.644 420 HG13 ILE 57 HG13 ILE 57 5.696 -2.849 -2.850 421 HG21 ILE 57 HG21 ILE 57 8.705 -1.191 -1.568 422 HG22 ILE 57 HG22 ILE 57 9.878 -2.373 -2.151 423 HG23 ILE 57 HG23 ILE 57 8.842 -2.762 -0.778 424 HD11 ILE 57 HD11 ILE 57 6.189 -4.712 -1.405 425 HD12 ILE 57 HD12 ILE 57 5.171 -3.536 -0.571 426 HD13 ILE 57 HD13 ILE 57 6.894 -3.625 -0.206 427 H ASN 58 H ASN 58 9.933 -0.558 -4.054 428 HA ASN 58 HA ASN 58 11.520 -1.798 -6.053 429 HB2 ASN 58 HB2 ASN 58 11.843 0.547 -5.401 430 HB3 ASN 58 HB3 ASN 58 12.335 0.047 -3.786 431 HD21 ASN 58 HD21 ASN 58 13.285 0.315 -7.096 432 HD22 ASN 58 HD22 ASN 58 14.948 -0.064 -6.857 433 H GLU 59 H GLU 59 13.341 -3.187 -5.859 434 HA GLU 59 HA GLU 59 13.043 -5.226 -3.937 435 HB2 GLU 59 HB2 GLU 59 13.993 -5.671 -6.137 436 HB3 GLU 59 HB3 GLU 59 15.403 -4.690 -5.752 437 HG2 GLU 59 HG2 GLU 59 16.230 -6.247 -4.231 438 HG3 GLU 59 HG3 GLU 59 14.671 -7.042 -4.049 439 H GLU 60 H GLU 60 15.191 -2.439 -3.970 440 HA GLU 60 HA GLU 60 16.900 -3.136 -1.863 441 HB2 GLU 60 HB2 GLU 60 15.837 -0.445 -2.737 442 HB3 GLU 60 HB3 GLU 60 17.074 -0.634 -1.502 443 HG2 GLU 60 HG2 GLU 60 17.386 -1.731 -4.284 444 HG3 GLU 60 HG3 GLU 60 17.866 -0.094 -3.843 445 H ASP 61 H ASP 61 13.937 -1.119 -1.646 446 HA ASP 61 HA ASP 61 13.777 -1.110 1.168 447 HB2 ASP 61 HB2 ASP 61 11.502 -0.874 -0.824 448 HB3 ASP 61 HB3 ASP 61 11.492 -0.304 0.843 449 H TRP 62 H TRP 62 12.442 -3.281 -1.258 450 HA TRP 62 HA TRP 62 10.851 -4.994 0.233 451 HB2 TRP 62 HB2 TRP 62 11.119 -5.038 -2.228 452 HB3 TRP 62 HB3 TRP 62 12.747 -5.666 -2.041 453 HD1 TRP 62 HD1 TRP 62 12.984 -8.261 -1.345 454 HE1 TRP 62 HE1 TRP 62 11.348 -10.228 -1.593 455 HE3 TRP 62 HE3 TRP 62 8.670 -5.631 -2.124 456 HZ2 TRP 62 HZ2 TRP 62 8.594 -10.614 -2.062 457 HZ3 TRP 62 HZ3 TRP 62 6.576 -6.878 -2.463 458 HH2 TRP 62 HH2 TRP 62 6.540 -9.317 -2.433 459 H ASN 63 H ASN 63 14.331 -5.331 -0.439 460 HA ASN 63 HA ASN 63 14.816 -7.511 1.303 461 HB2 ASN 63 HB2 ASN 63 16.658 -5.410 0.133 462 HB3 ASN 63 HB3 ASN 63 17.224 -6.815 1.035 463 HD21 ASN 63 HD21 ASN 63 18.383 -7.276 -0.934 464 HD22 ASN 63 HD22 ASN 63 17.580 -8.097 -2.220 465 H ALA 64 H ALA 64 15.026 -4.008 1.720 466 HA ALA 64 HA ALA 64 16.290 -3.920 4.220 467 HB1 ALA 64 HB1 ALA 64 14.267 -1.985 3.085 468 HB2 ALA 64 HB2 ALA 64 16.003 -1.967 2.768 469 HB3 ALA 64 HB3 ALA 64 15.401 -1.655 4.396 470 H LEU 65 H LEU 65 12.893 -4.397 3.389 471 HA LEU 65 HA LEU 65 12.122 -4.445 6.216 472 HB2 LEU 65 HB2 LEU 65 10.497 -4.692 3.682 473 HB3 LEU 65 HB3 LEU 65 9.814 -4.762 5.295 474 HG LEU 65 HG LEU 65 11.296 -2.374 4.174 475 HD11 LEU 65 HD11 LEU 65 9.200 -2.754 2.968 476 HD12 LEU 65 HD12 LEU 65 9.122 -1.304 3.968 477 HD13 LEU 65 HD13 LEU 65 8.322 -2.785 4.498 478 HD21 LEU 65 HD21 LEU 65 10.378 -1.196 6.113 479 HD22 LEU 65 HD22 LEU 65 11.415 -2.534 6.604 480 HD23 LEU 65 HD23 LEU 65 9.661 -2.700 6.694 481 H GLY 66 H GLY 66 13.315 -6.647 4.001 482 HA2 GLY 66 HA2 GLY 66 13.444 -8.946 3.964 483 HA3 GLY 66 HA3 GLY 66 12.834 -8.924 5.612 484 H LEU 67 H LEU 67 11.388 -7.960 2.507 485 HA LEU 67 HA LEU 67 8.893 -9.245 3.246 486 HB2 LEU 67 HB2 LEU 67 9.707 -7.569 0.873 487 HB3 LEU 67 HB3 LEU 67 8.095 -8.228 1.086 488 HG LEU 67 HG LEU 67 9.394 -6.364 3.079 489 HD11 LEU 67 HD11 LEU 67 9.159 -5.215 0.932 490 HD12 LEU 67 HD12 LEU 67 8.011 -4.592 2.117 491 HD13 LEU 67 HD13 LEU 67 7.461 -5.693 0.852 492 HD21 LEU 67 HD21 LEU 67 6.533 -7.248 2.687 493 HD22 LEU 67 HD22 LEU 67 7.096 -6.072 3.877 494 HD23 LEU 67 HD23 LEU 67 7.615 -7.753 3.986 495 H GLN 68 H GLN 68 7.969 -10.976 2.306 496 HA GLN 68 HA GLN 68 9.411 -12.387 0.149 497 HB2 GLN 68 HB2 GLN 68 9.134 -13.695 2.215 498 HB3 GLN 68 HB3 GLN 68 7.398 -13.430 2.166 499 HG2 GLN 68 HG2 GLN 68 7.315 -14.676 0.020 500 HG3 GLN 68 HG3 GLN 68 9.037 -15.019 0.195 501 HE21 GLN 68 HE21 GLN 68 6.756 -14.951 2.860 502 HE22 GLN 68 HE22 GLN 68 6.838 -16.641 3.207 503 H GLU 69 H GLU 69 8.130 -13.218 -1.629 504 HA GLU 69 HA GLU 69 6.198 -11.377 -2.549 505 HB2 GLU 69 HB2 GLU 69 6.919 -14.126 -3.586 506 HB3 GLU 69 HB3 GLU 69 5.893 -12.975 -4.440 507 HG2 GLU 69 HG2 GLU 69 7.680 -11.423 -4.664 508 HG3 GLU 69 HG3 GLU 69 8.711 -12.355 -3.583 509 H GLY 70 H GLY 70 4.307 -11.141 -1.594 510 HA2 GLY 70 HA2 GLY 70 2.009 -12.064 -1.539 511 HA3 GLY 70 HA3 GLY 70 2.710 -13.567 -0.966 512 H ASP 71 H ASP 71 4.426 -11.221 0.579 513 HA ASP 71 HA ASP 71 3.152 -11.559 3.090 514 HB2 ASP 71 HB2 ASP 71 5.318 -9.687 2.134 515 HB3 ASP 71 HB3 ASP 71 4.719 -9.648 3.787 516 H ARG 72 H ARG 72 2.601 -9.585 4.484 517 HA ARG 72 HA ARG 72 0.805 -7.783 2.987 518 HB2 ARG 72 HB2 ARG 72 0.708 -8.544 5.918 519 HB3 ARG 72 HB3 ARG 72 -0.470 -7.559 5.057 520 HG2 ARG 72 HG2 ARG 72 -1.162 -9.448 3.728 521 HG3 ARG 72 HG3 ARG 72 0.123 -10.448 4.409 522 HD2 ARG 72 HD2 ARG 72 -0.914 -10.150 6.651 523 HD3 ARG 72 HD3 ARG 72 -2.243 -9.289 5.879 524 HE ARG 72 HE ARG 72 -3.009 -11.299 4.982 525 HH11 ARG 72 HH11 ARG 72 -0.061 -11.774 6.707 526 HH12 ARG 72 HH12 ARG 72 -0.275 -13.487 6.812 527 HH21 ARG 72 HH21 ARG 72 -3.286 -13.477 5.138 528 HH22 ARG 72 HH22 ARG 72 -2.092 -14.447 5.925 529 H VAL 73 H VAL 73 1.304 -5.671 2.914 530 HA VAL 73 HA VAL 73 3.250 -4.618 4.870 531 HB VAL 73 HB VAL 73 3.794 -2.871 3.147 532 HG11 VAL 73 HG11 VAL 73 5.254 -4.786 3.538 533 HG12 VAL 73 HG12 VAL 73 5.257 -4.331 1.834 534 HG13 VAL 73 HG13 VAL 73 4.340 -5.740 2.371 535 HG21 VAL 73 HG21 VAL 73 1.783 -3.047 1.773 536 HG22 VAL 73 HG22 VAL 73 2.217 -4.695 1.316 537 HG23 VAL 73 HG23 VAL 73 3.223 -3.342 0.798 538 H LYS 74 H LYS 74 3.014 -2.478 5.589 539 HA LYS 74 HA LYS 74 0.269 -1.406 5.436 540 HB2 LYS 74 HB2 LYS 74 0.870 -2.593 7.593 541 HB3 LYS 74 HB3 LYS 74 2.073 -1.348 7.864 542 HG2 LYS 74 HG2 LYS 74 0.321 0.330 7.969 543 HG3 LYS 74 HG3 LYS 74 -0.896 -0.907 7.623 544 HD2 LYS 74 HD2 LYS 74 -0.167 -2.127 9.659 545 HD3 LYS 74 HD3 LYS 74 0.933 -0.796 10.024 546 HE2 LYS 74 HE2 LYS 74 -0.952 -0.390 11.322 547 HE3 LYS 74 HE3 LYS 74 -1.122 0.693 9.949 548 HZ1 LYS 74 HZ1 LYS 74 -2.524 -1.884 10.372 549 HZ2 LYS 74 HZ2 LYS 74 -2.632 -0.960 8.956 550 HZ3 LYS 74 HZ3 LYS 74 -3.207 -0.336 10.414 551 H VAL 75 H VAL 75 0.227 0.604 4.623 552 HA VAL 75 HA VAL 75 2.716 2.189 4.603 553 HB VAL 75 HB VAL 75 0.214 2.560 2.931 554 HG11 VAL 75 HG11 VAL 75 1.591 4.052 1.566 555 HG12 VAL 75 HG12 VAL 75 2.946 3.825 2.671 556 HG13 VAL 75 HG13 VAL 75 1.480 4.632 3.229 557 HG21 VAL 75 HG21 VAL 75 1.336 0.446 2.406 558 HG22 VAL 75 HG22 VAL 75 2.862 1.303 2.179 559 HG23 VAL 75 HG23 VAL 75 1.511 1.601 1.084 560 H LYS 76 H LYS 76 2.898 4.034 5.750 561 HA LYS 76 HA LYS 76 0.439 5.327 6.792 562 HB2 LYS 76 HB2 LYS 76 3.198 5.272 8.053 563 HB3 LYS 76 HB3 LYS 76 1.840 6.207 8.653 564 HG2 LYS 76 HG2 LYS 76 1.896 4.338 10.037 565 HG3 LYS 76 HG3 LYS 76 0.620 3.960 8.877 566 HD2 LYS 76 HD2 LYS 76 2.056 2.483 7.664 567 HD3 LYS 76 HD3 LYS 76 3.476 3.021 8.563 568 HE2 LYS 76 HE2 LYS 76 1.115 1.614 9.806 569 HE3 LYS 76 HE3 LYS 76 2.579 0.795 9.269 570 HZ1 LYS 76 HZ1 LYS 76 2.555 1.303 11.665 571 HZ2 LYS 76 HZ2 LYS 76 2.523 2.956 11.308 572 HZ3 LYS 76 HZ3 LYS 76 3.860 2.017 10.860 573 H THR 77 H THR 77 0.089 7.368 6.104 574 HA THR 77 HA THR 77 2.396 9.010 5.237 575 HB THR 77 HB THR 77 1.184 9.935 3.391 576 HG1 THR 77 HG1 THR 77 -0.996 9.080 2.946 577 HG21 THR 77 HG21 THR 77 2.252 7.774 2.920 578 HG22 THR 77 HG22 THR 77 0.798 7.998 1.949 579 HG23 THR 77 HG23 THR 77 0.760 6.939 3.359 580 H GLU 78 H GLU 78 1.292 11.382 4.756 581 HA GLU 78 HA GLU 78 0.522 12.412 7.283 582 HB2 GLU 78 HB2 GLU 78 0.248 14.552 6.107 583 HB3 GLU 78 HB3 GLU 78 1.756 13.760 5.668 584 HG2 GLU 78 HG2 GLU 78 0.676 12.941 3.592 585 HG3 GLU 78 HG3 GLU 78 -0.769 13.857 4.023 586 H PHE 79 H PHE 79 -1.310 10.947 4.791 587 HA PHE 79 HA PHE 79 -3.798 12.288 5.549 588 HB2 PHE 79 HB2 PHE 79 -3.179 10.255 3.391 589 HB3 PHE 79 HB3 PHE 79 -4.789 10.899 3.698 590 HD1 PHE 79 HD2 PHE 79 -5.202 13.359 3.405 591 HD2 PHE 79 HD1 PHE 79 -1.600 11.483 2.111 592 HE1 PHE 79 HE2 PHE 79 -4.716 15.289 1.960 593 HE2 PHE 79 HE1 PHE 79 -1.115 13.411 0.666 594 HZ PHE 79 HZ PHE 79 -2.671 15.316 0.590 595 H GLY 80 H GLY 80 -2.466 8.964 5.507 596 HA2 GLY 80 HA2 GLY 80 -3.678 8.201 7.928 597 HA3 GLY 80 HA3 GLY 80 -4.730 7.694 6.615 598 H GLU 81 H GLU 81 -4.367 5.508 7.297 599 HA GLU 81 HA GLU 81 -1.840 4.398 6.257 600 HB2 GLU 81 HB2 GLU 81 -1.805 2.751 8.088 601 HB3 GLU 81 HB3 GLU 81 -1.662 4.398 8.688 602 HG2 GLU 81 HG2 GLU 81 -3.784 4.394 9.615 603 HG3 GLU 81 HG3 GLU 81 -4.348 3.098 8.566 604 H VAL 82 H VAL 82 -1.971 2.116 5.652 605 HA VAL 82 HA VAL 82 -4.536 0.804 5.567 606 HB VAL 82 HB VAL 82 -4.627 2.390 3.612 607 HG11 VAL 82 HG11 VAL 82 -2.270 2.286 2.955 608 HG12 VAL 82 HG12 VAL 82 -3.337 1.893 1.609 609 HG13 VAL 82 HG13 VAL 82 -2.481 0.606 2.459 610 HG21 VAL 82 HG21 VAL 82 -5.495 0.727 2.019 611 HG22 VAL 82 HG22 VAL 82 -6.045 0.421 3.667 612 HG23 VAL 82 HG23 VAL 82 -4.752 -0.560 2.970 613 H VAL 83 H VAL 83 -4.352 -1.420 5.276 614 HA VAL 83 HA VAL 83 -1.616 -2.484 4.958 615 HB VAL 83 HB VAL 83 -4.063 -3.933 6.020 616 HG11 VAL 83 HG11 VAL 83 -2.441 -5.467 5.077 617 HG12 VAL 83 HG12 VAL 83 -2.407 -5.586 6.838 618 HG13 VAL 83 HG13 VAL 83 -1.139 -4.699 5.990 619 HG21 VAL 83 HG21 VAL 83 -3.438 -2.135 7.548 620 HG22 VAL 83 HG22 VAL 83 -1.767 -2.697 7.557 621 HG23 VAL 83 HG23 VAL 83 -3.040 -3.706 8.244 622 H VAL 84 H VAL 84 -1.102 -3.336 3.019 623 HA VAL 84 HA VAL 84 -3.209 -4.611 1.383 624 HB VAL 84 HB VAL 84 -2.206 -3.687 -0.663 625 HG11 VAL 84 HG11 VAL 84 -4.059 -2.485 0.415 626 HG12 VAL 84 HG12 VAL 84 -2.973 -1.388 -0.437 627 HG13 VAL 84 HG13 VAL 84 -2.899 -1.515 1.321 628 HG21 VAL 84 HG21 VAL 84 0.092 -3.407 0.095 629 HG22 VAL 84 HG22 VAL 84 -0.405 -2.135 1.211 630 HG23 VAL 84 HG23 VAL 84 -0.529 -1.881 -0.530 631 H PHE 85 H PHE 85 -2.052 -5.814 -0.573 632 HA PHE 85 HA PHE 85 -0.177 -7.688 0.580 633 HB2 PHE 85 HB2 PHE 85 -1.415 -7.504 -2.174 634 HB3 PHE 85 HB3 PHE 85 -0.289 -8.772 -1.704 635 HD1 PHE 85 HD1 PHE 85 -0.937 -10.107 0.461 636 HD2 PHE 85 HD2 PHE 85 -3.697 -7.871 -1.900 637 HE1 PHE 85 HE1 PHE 85 -2.795 -11.447 1.363 638 HE2 PHE 85 HE2 PHE 85 -5.554 -9.205 -0.994 639 HZ PHE 85 HZ PHE 85 -5.105 -10.996 0.636 640 H ALA 86 H ALA 86 1.948 -8.071 -0.037 641 HA ALA 86 HA ALA 86 3.344 -5.750 -1.143 642 HB1 ALA 86 HB1 ALA 86 5.351 -6.740 -0.187 643 HB2 ALA 86 HB2 ALA 86 4.447 -8.193 0.246 644 HB3 ALA 86 HB3 ALA 86 4.066 -6.656 1.019 645 H LYS 87 H LYS 87 3.910 -5.715 -3.230 646 HA LYS 87 HA LYS 87 4.945 -8.192 -4.449 647 HB2 LYS 87 HB2 LYS 87 3.177 -6.176 -5.866 648 HB3 LYS 87 HB3 LYS 87 3.926 -7.577 -6.609 649 HG2 LYS 87 HG2 LYS 87 2.612 -8.998 -5.005 650 HG3 LYS 87 HG3 LYS 87 1.737 -7.531 -4.553 651 HD2 LYS 87 HD2 LYS 87 1.140 -7.240 -6.973 652 HD3 LYS 87 HD3 LYS 87 1.861 -8.821 -7.286 653 HE2 LYS 87 HE2 LYS 87 0.281 -9.753 -5.573 654 HE3 LYS 87 HE3 LYS 87 -0.510 -8.185 -5.550 655 HZ1 LYS 87 HZ1 LYS 87 -0.906 -8.442 -7.953 656 HZ2 LYS 87 HZ2 LYS 87 -1.680 -9.631 -7.033 657 HZ3 LYS 87 HZ3 LYS 87 -0.265 -10.003 -7.878 658 H LYS 88 H LYS 88 6.525 -7.913 -6.063 659 HA LYS 88 HA LYS 88 8.177 -5.591 -5.467 660 HB2 LYS 88 HB2 LYS 88 8.979 -8.018 -5.345 661 HB3 LYS 88 HB3 LYS 88 8.966 -7.995 -7.108 662 HG2 LYS 88 HG2 LYS 88 10.481 -6.038 -7.031 663 HG3 LYS 88 HG3 LYS 88 10.567 -6.234 -5.282 664 HD2 LYS 88 HD2 LYS 88 11.388 -8.311 -7.321 665 HD3 LYS 88 HD3 LYS 88 12.496 -7.263 -6.435 666 HE2 LYS 88 HE2 LYS 88 11.836 -8.270 -4.337 667 HE3 LYS 88 HE3 LYS 88 10.600 -9.233 -5.146 668 HZ1 LYS 88 HZ1 LYS 88 12.618 -10.499 -4.670 669 HZ2 LYS 88 HZ2 LYS 88 13.518 -9.453 -5.644 670 HZ3 LYS 88 HZ3 LYS 88 12.307 -10.420 -6.330 671 H GLY 89 H GLY 89 8.387 -3.932 -6.843 672 HA2 GLY 89 HA2 GLY 89 7.484 -4.314 -9.641 673 HA3 GLY 89 HA3 GLY 89 7.131 -2.871 -8.708 674 H ASP 90 H ASP 90 8.204 -2.444 -11.072 675 HA ASP 90 HA ASP 90 11.098 -2.368 -11.001 676 HB2 ASP 90 HB2 ASP 90 9.128 -1.246 -13.006 677 HB3 ASP 90 HB3 ASP 90 10.874 -1.330 -13.232 678 H VAL 91 H VAL 91 9.082 -0.621 -9.298 679 HA VAL 91 HA VAL 91 9.589 2.085 -9.929 680 HB VAL 91 HB VAL 91 8.819 2.564 -7.612 681 HG11 VAL 91 HG11 VAL 91 7.132 0.534 -9.085 682 HG12 VAL 91 HG12 VAL 91 7.205 2.261 -9.435 683 HG13 VAL 91 HG13 VAL 91 6.553 1.702 -7.895 684 HG21 VAL 91 HG21 VAL 91 8.743 -0.450 -7.345 685 HG22 VAL 91 HG22 VAL 91 8.080 0.700 -6.183 686 HG23 VAL 91 HG23 VAL 91 9.818 0.646 -6.476 687 HA PRO 92 HA PRO 92 13.696 2.756 -8.340 688 HB2 PRO 92 HB2 PRO 92 13.556 5.354 -7.560 689 HB3 PRO 92 HB3 PRO 92 13.566 4.864 -9.258 690 HG2 PRO 92 HG2 PRO 92 11.233 5.604 -7.521 691 HG3 PRO 92 HG3 PRO 92 11.586 6.094 -9.189 692 HD2 PRO 92 HD2 PRO 92 9.828 4.119 -8.597 693 HD3 PRO 92 HD3 PRO 92 10.819 4.106 -10.072 694 H LYS 93 H LYS 93 14.943 3.325 -6.389 695 HA LYS 93 HA LYS 93 13.871 2.099 -4.085 696 HB2 LYS 93 HB2 LYS 93 16.281 2.132 -4.672 697 HB3 LYS 93 HB3 LYS 93 16.334 3.847 -4.294 698 HG2 LYS 93 HG2 LYS 93 15.817 3.392 -1.975 699 HG3 LYS 93 HG3 LYS 93 15.627 1.673 -2.329 700 HD2 LYS 93 HD2 LYS 93 18.019 1.644 -3.084 701 HD3 LYS 93 HD3 LYS 93 18.167 3.305 -2.505 702 HE2 LYS 93 HE2 LYS 93 17.690 2.615 -0.246 703 HE3 LYS 93 HE3 LYS 93 17.328 0.971 -0.777 704 HZ1 LYS 93 HZ1 LYS 93 19.981 2.301 -0.963 705 HZ2 LYS 93 HZ2 LYS 93 19.627 0.727 -1.468 706 HZ3 LYS 93 HZ3 LYS 93 19.542 1.126 0.170 707 H GLY 94 H GLY 94 12.918 2.880 -2.262 708 HA2 GLY 94 HA2 GLY 94 12.028 4.408 -0.767 709 HA3 GLY 94 HA3 GLY 94 12.960 5.672 -1.551 710 H MET 95 H MET 95 10.853 3.694 -3.480 711 HA MET 95 HA MET 95 8.634 5.568 -3.308 712 HB2 MET 95 HB2 MET 95 10.340 6.410 -5.005 713 HB3 MET 95 HB3 MET 95 9.961 4.991 -5.967 714 HG2 MET 95 HG2 MET 95 7.703 5.712 -6.248 715 HG3 MET 95 HG3 MET 95 7.939 7.041 -5.115 716 HE1 MET 95 HE1 MET 95 6.652 7.862 -7.782 717 HE2 MET 95 HE2 MET 95 7.663 9.213 -8.289 718 HE3 MET 95 HE3 MET 95 7.227 9.025 -6.591 719 H ILE 96 H ILE 96 6.661 4.568 -3.766 720 HA ILE 96 HA ILE 96 6.769 1.832 -4.871 721 HB ILE 96 HB ILE 96 5.066 1.070 -3.272 722 HG12 ILE 96 HG12 ILE 96 5.507 3.731 -1.881 723 HG13 ILE 96 HG13 ILE 96 4.055 3.285 -2.773 724 HG21 ILE 96 HG21 ILE 96 6.513 0.911 -1.298 725 HG22 ILE 96 HG22 ILE 96 7.535 2.194 -1.944 726 HG23 ILE 96 HG23 ILE 96 7.419 0.650 -2.790 727 HD11 ILE 96 HD11 ILE 96 5.079 1.948 -0.272 728 HD12 ILE 96 HD12 ILE 96 3.630 1.487 -1.168 729 HD13 ILE 96 HD13 ILE 96 3.717 3.064 -0.384 730 H PHE 97 H PHE 97 5.024 1.145 -6.066 731 HA PHE 97 HA PHE 97 3.188 3.281 -6.954 732 HB2 PHE 97 HB2 PHE 97 4.637 2.419 -8.715 733 HB3 PHE 97 HB3 PHE 97 4.127 0.772 -8.373 734 HD1 PHE 97 HD2 PHE 97 3.128 3.991 -9.851 735 HD2 PHE 97 HD1 PHE 97 2.013 -0.069 -9.182 736 HE1 PHE 97 HE2 PHE 97 1.326 4.208 -11.514 737 HE2 PHE 97 HE1 PHE 97 0.207 0.149 -10.835 738 HZ PHE 97 HZ PHE 97 -0.137 2.287 -12.005 739 H ILE 98 H ILE 98 1.144 3.121 -6.226 740 HA ILE 98 HA ILE 98 -0.010 0.426 -5.867 741 HB ILE 98 HB ILE 98 -0.799 2.977 -4.429 742 HG12 ILE 98 HG12 ILE 98 0.631 0.483 -3.465 743 HG13 ILE 98 HG13 ILE 98 1.311 2.101 -3.583 744 HG21 ILE 98 HG21 ILE 98 -1.882 0.166 -4.144 745 HG22 ILE 98 HG22 ILE 98 -2.737 1.550 -4.827 746 HG23 ILE 98 HG23 ILE 98 -2.308 1.537 -3.118 747 HD11 ILE 98 HD11 ILE 98 -0.227 2.865 -1.841 748 HD12 ILE 98 HD12 ILE 98 0.790 1.535 -1.288 749 HD13 ILE 98 HD13 ILE 98 -0.893 1.236 -1.721 750 HA PRO 99 HA PRO 99 -2.737 1.598 -9.266 751 HB2 PRO 99 HB2 PRO 99 -4.594 -0.407 -8.757 752 HB3 PRO 99 HB3 PRO 99 -3.149 -0.597 -9.755 753 HG2 PRO 99 HG2 PRO 99 -3.588 -1.346 -6.890 754 HG3 PRO 99 HG3 PRO 99 -2.716 -2.228 -8.158 755 HD2 PRO 99 HD2 PRO 99 -1.411 -0.836 -6.271 756 HD3 PRO 99 HD3 PRO 99 -0.817 -0.903 -7.945 757 H MET 100 H MET 100 -4.354 3.071 -9.277 758 HA MET 100 HA MET 100 -5.280 4.296 -6.984 759 HB2 MET 100 HB2 MET 100 -5.457 5.603 -8.890 760 HB3 MET 100 HB3 MET 100 -6.220 4.327 -9.827 761 HG2 MET 100 HG2 MET 100 -7.641 6.341 -9.148 762 HG3 MET 100 HG3 MET 100 -8.322 4.736 -8.905 763 HE1 MET 100 HE1 MET 100 -5.566 6.503 -6.731 764 HE2 MET 100 HE2 MET 100 -6.528 7.224 -5.439 765 HE3 MET 100 HE3 MET 100 -6.644 7.854 -7.085 766 H GLY 101 H GLY 101 -6.525 3.597 -5.415 767 HA2 GLY 101 HA2 GLY 101 -9.157 2.559 -5.901 768 HA3 GLY 101 HA3 GLY 101 -8.061 1.293 -5.363 769 HA PRO 102 HA PRO 102 -10.220 3.633 -1.777 770 HB2 PRO 102 HB2 PRO 102 -10.708 1.238 -0.410 771 HB3 PRO 102 HB3 PRO 102 -11.879 2.102 -1.411 772 HG2 PRO 102 HG2 PRO 102 -10.132 -0.226 -2.119 773 HG3 PRO 102 HG3 PRO 102 -11.824 0.082 -2.560 774 HD2 PRO 102 HD2 PRO 102 -9.865 0.482 -4.327 775 HD3 PRO 102 HD3 PRO 102 -11.232 1.614 -4.232 776 H TYR 103 H TYR 103 -7.944 0.951 -1.910 777 HA TYR 103 HA TYR 103 -6.786 1.282 0.648 778 HB2 TYR 103 HB2 TYR 103 -5.568 0.137 -1.884 779 HB3 TYR 103 HB3 TYR 103 -4.944 -0.090 -0.252 780 HD1 TYR 103 HD2 TYR 103 -7.871 -0.792 -2.438 781 HD2 TYR 103 HD1 TYR 103 -5.787 -1.819 1.130 782 HE1 TYR 103 HE2 TYR 103 -9.323 -2.752 -2.161 783 HE2 TYR 103 HE1 TYR 103 -7.235 -3.782 1.415 784 HH TYR 103 HH TYR 103 -9.101 -5.059 -0.961 785 H ALA 104 H ALA 104 -5.772 2.461 -2.566 786 HA ALA 104 HA ALA 104 -3.600 4.022 -1.674 787 HB1 ALA 104 HB1 ALA 104 -3.934 3.374 -4.030 788 HB2 ALA 104 HB2 ALA 104 -3.698 5.113 -3.848 789 HB3 ALA 104 HB3 ALA 104 -5.317 4.466 -4.125 790 H ASN 105 H ASN 105 -7.036 4.787 -2.079 791 HA ASN 105 HA ASN 105 -6.851 7.564 -1.609 792 HB2 ASN 105 HB2 ASN 105 -9.116 5.591 -1.431 793 HB3 ASN 105 HB3 ASN 105 -9.347 7.270 -0.956 794 HD21 ASN 105 HD21 ASN 105 -8.642 5.137 -3.623 795 HD22 ASN 105 HD22 ASN 105 -8.983 6.274 -4.871 796 H MET 106 H MET 106 -6.309 5.039 0.548 797 HA MET 106 HA MET 106 -7.080 6.447 2.958 798 HB2 MET 106 HB2 MET 106 -5.322 4.011 2.553 799 HB3 MET 106 HB3 MET 106 -5.851 4.623 4.115 800 HG2 MET 106 HG2 MET 106 -7.716 3.703 1.946 801 HG3 MET 106 HG3 MET 106 -7.150 2.688 3.273 802 HE1 MET 106 HE1 MET 106 -7.123 4.379 5.805 803 HE2 MET 106 HE2 MET 106 -7.959 2.829 5.710 804 HE3 MET 106 HE3 MET 106 -8.779 4.233 6.395 805 H VAL 107 H VAL 107 -4.341 6.381 0.851 806 HA VAL 107 HA VAL 107 -2.650 7.644 2.927 807 HB VAL 107 HB VAL 107 -0.678 6.613 1.817 808 HG11 VAL 107 HG11 VAL 107 -1.634 5.597 3.817 809 HG12 VAL 107 HG12 VAL 107 -1.020 4.355 2.726 810 HG13 VAL 107 HG13 VAL 107 -2.754 4.661 2.825 811 HG21 VAL 107 HG21 VAL 107 -1.637 6.241 -0.403 812 HG22 VAL 107 HG22 VAL 107 -2.747 5.044 0.263 813 HG23 VAL 107 HG23 VAL 107 -1.010 4.733 0.267 814 H ILE 108 H ILE 108 -3.959 7.918 -0.218 815 HA ILE 108 HA ILE 108 -2.033 10.005 -0.973 816 HB ILE 108 HB ILE 108 -2.714 9.816 -3.193 817 HG12 ILE 108 HG12 ILE 108 -5.072 8.084 -2.438 818 HG13 ILE 108 HG13 ILE 108 -5.198 9.836 -2.597 819 HG21 ILE 108 HG21 ILE 108 -1.396 7.904 -2.639 820 HG22 ILE 108 HG22 ILE 108 -2.710 7.341 -3.683 821 HG23 ILE 108 HG23 ILE 108 -2.787 7.071 -1.943 822 HD11 ILE 108 HD11 ILE 108 -4.365 9.644 -4.893 823 HD12 ILE 108 HD12 ILE 108 -5.893 8.800 -4.626 824 HD13 ILE 108 HD13 ILE 108 -4.384 7.890 -4.719 825 H ASP 109 H ASP 109 -3.236 11.794 -2.390 826 HA ASP 109 HA ASP 109 -5.348 12.948 -0.730 827 HB2 ASP 109 HB2 ASP 109 -3.412 14.344 -1.409 828 HB3 ASP 109 HB3 ASP 109 -3.876 14.138 -3.097 829 HA PRO 110 HA PRO 110 -8.208 11.460 -3.919 830 HB2 PRO 110 HB2 PRO 110 -10.402 11.348 -2.410 831 HB3 PRO 110 HB3 PRO 110 -9.069 10.214 -2.154 832 HG2 PRO 110 HG2 PRO 110 -9.806 12.653 -0.585 833 HG3 PRO 110 HG3 PRO 110 -9.212 11.086 -0.010 834 HD2 PRO 110 HD2 PRO 110 -7.653 13.383 -0.391 835 HD3 PRO 110 HD3 PRO 110 -7.033 11.728 -0.222 836 H SER 111 H SER 111 -7.667 14.501 -3.129 837 HA SER 111 HA SER 111 -10.199 15.532 -4.280 838 HB2 SER 111 HB2 SER 111 -9.900 16.162 -1.881 839 HB3 SER 111 HB3 SER 111 -8.390 16.966 -2.308 840 HG SER 111 HG SER 111 -9.511 18.629 -2.918 841 H THR 112 H THR 112 -7.660 14.697 -5.577 842 HA THR 112 HA THR 112 -6.237 17.071 -6.341 843 HB THR 112 HB THR 112 -5.032 15.589 -7.927 844 HG1 THR 112 HG1 THR 112 -5.651 13.216 -7.441 845 HG21 THR 112 HG21 THR 112 -5.343 14.467 -5.136 846 HG22 THR 112 HG22 THR 112 -4.244 15.758 -5.623 847 HG23 THR 112 HG23 THR 112 -4.004 14.120 -6.234 848 H ASP 113 H ASP 113 -7.152 18.558 -7.633 849 HA ASP 113 HA ASP 113 -8.361 17.612 -10.162 850 HB2 ASP 113 HB2 ASP 113 -9.587 19.679 -10.315 851 HB3 ASP 113 HB3 ASP 113 -9.861 19.010 -8.711 852 H GLY 114 H GLY 114 -5.663 19.070 -8.763 853 HA2 GLY 114 HA2 GLY 114 -4.822 20.901 -10.724 854 HA3 GLY 114 HA3 GLY 114 -3.769 20.036 -9.617 855 H THR 115 H THR 115 -3.265 20.709 -12.397 856 HA THR 115 HA THR 115 -3.658 18.376 -14.009 857 HB THR 115 HB THR 115 -1.776 20.695 -14.517 858 HG1 THR 115 HG1 THR 115 -3.720 21.208 -15.963 859 HG21 THR 115 HG21 THR 115 -2.028 20.044 -16.889 860 HG22 THR 115 HG22 THR 115 -2.985 18.647 -16.395 861 HG23 THR 115 HG23 THR 115 -1.286 18.761 -15.935 862 H GLY 116 H GLY 116 -2.740 16.896 -12.354 863 HA2 GLY 116 HA2 GLY 116 0.187 16.640 -12.486 864 HA3 GLY 116 HA3 GLY 116 -0.891 15.702 -11.460 865 H MET 117 H MET 117 -2.625 14.484 -12.922 866 HA MET 117 HA MET 117 -3.143 12.923 -14.486 867 HB2 MET 117 HB2 MET 117 -0.915 14.204 -16.090 868 HB3 MET 117 HB3 MET 117 -2.131 13.107 -16.726 869 HG2 MET 117 HG2 MET 117 -2.667 15.831 -15.546 870 HG3 MET 117 HG3 MET 117 -2.615 15.446 -17.262 871 HE1 MET 117 HE1 MET 117 -6.058 14.529 -14.341 872 HE2 MET 117 HE2 MET 117 -4.768 15.708 -14.105 873 HE3 MET 117 HE3 MET 117 -4.424 13.984 -13.963 874 HA PRO 118 HA PRO 118 -0.642 9.229 -14.111 875 HB2 PRO 118 HB2 PRO 118 -0.387 9.047 -17.086 876 HB3 PRO 118 HB3 PRO 118 -0.894 7.818 -15.919 877 HG2 PRO 118 HG2 PRO 118 -2.713 9.048 -17.396 878 HG3 PRO 118 HG3 PRO 118 -3.025 8.751 -15.674 879 HD2 PRO 118 HD2 PRO 118 -2.226 11.299 -17.043 880 HD3 PRO 118 HD3 PRO 118 -3.382 11.044 -15.720 881 H GLN 119 H GLN 119 0.916 11.932 -14.760 882 HA GLN 119 HA GLN 119 3.441 10.981 -15.721 883 HB2 GLN 119 HB2 GLN 119 2.735 13.471 -14.141 884 HB3 GLN 119 HB3 GLN 119 4.310 13.151 -14.855 885 HG2 GLN 119 HG2 GLN 119 3.280 13.124 -17.085 886 HG3 GLN 119 HG3 GLN 119 1.715 13.487 -16.360 887 HE21 GLN 119 HE21 GLN 119 1.351 15.559 -15.523 888 HE22 GLN 119 HE22 GLN 119 2.360 16.899 -15.935 889 H PHE 120 H PHE 120 5.425 11.482 -14.115 890 HA PHE 120 HA PHE 120 5.099 9.367 -12.168 891 HB2 PHE 120 HB2 PHE 120 7.099 9.875 -13.840 892 HB3 PHE 120 HB3 PHE 120 7.691 10.822 -12.479 893 HD1 PHE 120 HD2 PHE 120 6.249 7.462 -13.188 894 HD2 PHE 120 HD1 PHE 120 9.065 9.744 -10.949 895 HE1 PHE 120 HE2 PHE 120 7.119 5.391 -12.172 896 HE2 PHE 120 HE1 PHE 120 9.940 7.680 -9.932 897 HZ PHE 120 HZ PHE 120 8.966 5.499 -10.544 898 H LYS 121 H LYS 121 3.567 11.117 -11.088 899 HA LYS 121 HA LYS 121 5.105 12.300 -8.854 900 HB2 LYS 121 HB2 LYS 121 2.840 13.418 -10.443 901 HB3 LYS 121 HB3 LYS 121 2.818 13.723 -8.715 902 HG2 LYS 121 HG2 LYS 121 3.836 15.587 -9.806 903 HG3 LYS 121 HG3 LYS 121 5.077 14.728 -8.899 904 HD2 LYS 121 HD2 LYS 121 5.864 13.669 -10.960 905 HD3 LYS 121 HD3 LYS 121 4.594 14.485 -11.875 906 HE2 LYS 121 HE2 LYS 121 6.753 15.628 -12.105 907 HE3 LYS 121 HE3 LYS 121 5.557 16.654 -11.318 908 HZ1 LYS 121 HZ1 LYS 121 7.712 16.783 -10.230 909 HZ2 LYS 121 HZ2 LYS 121 7.690 15.123 -9.929 910 HZ3 LYS 121 HZ3 LYS 121 6.557 16.132 -9.184 911 H GLY 122 H GLY 122 4.484 11.729 -6.801 912 HA2 GLY 122 HA2 GLY 122 1.898 10.359 -6.440 913 HA3 GLY 122 HA3 GLY 122 3.365 9.529 -5.953 914 H VAL 123 H VAL 123 1.548 9.823 -4.037 915 HA VAL 123 HA VAL 123 2.227 12.205 -2.457 916 HB VAL 123 HB VAL 123 0.316 9.938 -1.861 917 HG11 VAL 123 HG11 VAL 123 -0.498 11.348 -0.010 918 HG12 VAL 123 HG12 VAL 123 0.806 12.494 -0.326 919 HG13 VAL 123 HG13 VAL 123 1.181 10.858 0.215 920 HG21 VAL 123 HG21 VAL 123 -1.431 11.643 -2.264 921 HG22 VAL 123 HG22 VAL 123 -0.453 11.327 -3.697 922 HG23 VAL 123 HG23 VAL 123 -0.175 12.787 -2.745 923 H LYS 124 H LYS 124 3.869 12.192 -1.034 924 HA LYS 124 HA LYS 124 5.439 9.886 -0.546 925 HB2 LYS 124 HB2 LYS 124 5.444 12.635 0.664 926 HB3 LYS 124 HB3 LYS 124 6.504 11.375 1.277 927 HG2 LYS 124 HG2 LYS 124 7.320 11.134 -1.142 928 HG3 LYS 124 HG3 LYS 124 6.511 12.677 -1.428 929 HD2 LYS 124 HD2 LYS 124 8.871 13.034 -0.914 930 HD3 LYS 124 HD3 LYS 124 7.856 13.704 0.365 931 HE2 LYS 124 HE2 LYS 124 8.233 11.638 1.688 932 HE3 LYS 124 HE3 LYS 124 9.325 11.063 0.431 933 HZ1 LYS 124 HZ1 LYS 124 9.697 13.533 2.034 934 HZ2 LYS 124 HZ2 LYS 124 10.759 12.951 0.859 935 HZ3 LYS 124 HZ3 LYS 124 10.511 12.074 2.280 936 H GLY 125 H GLY 125 5.981 8.899 1.447 937 HA2 GLY 125 HA2 GLY 125 4.532 9.118 3.849 938 HA3 GLY 125 HA3 GLY 125 3.797 7.860 2.863 939 H THR 126 H THR 126 4.375 6.229 4.351 940 HA THR 126 HA THR 126 7.185 5.374 4.175 941 HB THR 126 HB THR 126 7.159 4.705 6.589 942 HG1 THR 126 HG1 THR 126 4.805 6.326 6.643 943 HG21 THR 126 HG21 THR 126 7.568 6.955 7.497 944 HG22 THR 126 HG22 THR 126 6.819 7.667 6.067 945 HG23 THR 126 HG23 THR 126 8.317 6.750 5.912 946 H VAL 127 H VAL 127 7.505 3.115 4.327 947 HA VAL 127 HA VAL 127 5.043 1.477 4.379 948 HB VAL 127 HB VAL 127 5.909 1.736 2.067 949 HG11 VAL 127 HG11 VAL 127 8.013 0.665 1.412 950 HG12 VAL 127 HG12 VAL 127 8.352 0.289 3.102 951 HG13 VAL 127 HG13 VAL 127 8.287 1.969 2.568 952 HG21 VAL 127 HG21 VAL 127 6.157 -1.073 3.160 953 HG22 VAL 127 HG22 VAL 127 5.883 -0.639 1.473 954 HG23 VAL 127 HG23 VAL 127 4.656 -0.275 2.686 955 H GLU 128 H GLU 128 5.126 -0.491 5.378 956 HA GLU 128 HA GLU 128 7.629 -1.654 6.306 957 HB2 GLU 128 HB2 GLU 128 6.777 -1.792 8.673 958 HB3 GLU 128 HB3 GLU 128 7.187 -0.161 8.149 959 HG2 GLU 128 HG2 GLU 128 4.872 0.384 7.824 960 HG3 GLU 128 HG3 GLU 128 4.389 -1.283 8.138 961 H LYS 129 H LYS 129 7.162 -3.839 7.428 962 HA LYS 129 HA LYS 129 4.787 -5.075 6.209 963 HB2 LYS 129 HB2 LYS 129 6.833 -6.250 5.691 964 HB3 LYS 129 HB3 LYS 129 7.263 -6.350 7.394 965 HG2 LYS 129 HG2 LYS 129 5.523 -7.905 7.846 966 HG3 LYS 129 HG3 LYS 129 4.760 -7.616 6.285 967 HD2 LYS 129 HD2 LYS 129 5.947 -9.770 6.366 968 HD3 LYS 129 HD3 LYS 129 6.612 -8.690 5.142 969 HE2 LYS 129 HE2 LYS 129 8.462 -8.123 6.604 970 HE3 LYS 129 HE3 LYS 129 7.771 -9.101 7.902 971 HZ1 LYS 129 HZ1 LYS 129 8.638 -10.173 5.272 972 HZ2 LYS 129 HZ2 LYS 129 8.112 -11.075 6.602 973 HZ3 LYS 129 HZ3 LYS 129 9.573 -10.225 6.682 974 H THR 130 H THR 130 3.205 -6.080 7.379 975 HA THR 130 HA THR 130 3.405 -5.963 10.324 976 HB THR 130 HB THR 130 2.095 -4.015 9.690 977 HG1 THR 130 HG1 THR 130 0.386 -4.442 11.044 978 HG21 THR 130 HG21 THR 130 0.237 -5.951 8.284 979 HG22 THR 130 HG22 THR 130 1.309 -4.799 7.488 980 HG23 THR 130 HG23 THR 130 -0.025 -4.216 8.484 981 H ASP 131 H ASP 131 1.847 -7.302 11.452 982 HA ASP 131 HA ASP 131 1.354 -9.818 10.063 983 HB2 ASP 131 HB2 ASP 131 1.077 -9.034 12.976 984 HB3 ASP 131 HB3 ASP 131 0.828 -10.661 12.343 985 H GLU 132 H GLU 132 -0.303 -6.994 10.526 986 HA GLU 132 HA GLU 132 -2.961 -7.889 11.010 987 HB2 GLU 132 HB2 GLU 132 -1.950 -5.431 9.558 988 HB3 GLU 132 HB3 GLU 132 -3.624 -5.694 10.030 989 HG2 GLU 132 HG2 GLU 132 -3.085 -5.563 12.337 990 HG3 GLU 132 HG3 GLU 132 -1.354 -5.623 11.999 991 H LYS 133 H LYS 133 -4.693 -8.128 9.510 992 HA LYS 133 HA LYS 133 -3.866 -9.177 6.929 993 HB2 LYS 133 HB2 LYS 133 -6.161 -9.986 6.713 994 HB3 LYS 133 HB3 LYS 133 -5.475 -10.457 8.257 995 HG2 LYS 133 HG2 LYS 133 -7.528 -9.799 8.965 996 HG3 LYS 133 HG3 LYS 133 -6.695 -8.249 9.074 997 HD2 LYS 133 HD2 LYS 133 -7.599 -7.580 6.911 998 HD3 LYS 133 HD3 LYS 133 -8.355 -9.161 6.711 999 HE2 LYS 133 HE2 LYS 133 -10.050 -7.636 7.412 1000 HE3 LYS 133 HE3 LYS 133 -9.692 -8.687 8.781 1001 HZ1 LYS 133 HZ1 LYS 133 -8.649 -5.936 8.397 1002 HZ2 LYS 133 HZ2 LYS 133 -8.326 -6.933 9.722 1003 HZ3 LYS 133 HZ3 LYS 133 -9.899 -6.374 9.443 1004 H VAL 134 H VAL 134 -4.946 -8.565 4.936 1005 HA VAL 134 HA VAL 134 -4.713 -5.815 4.427 1006 HB VAL 134 HB VAL 134 -6.057 -7.967 2.768 1007 HG11 VAL 134 HG11 VAL 134 -5.131 -5.209 1.937 1008 HG12 VAL 134 HG12 VAL 134 -6.803 -5.763 2.036 1009 HG13 VAL 134 HG13 VAL 134 -5.710 -6.468 0.845 1010 HG21 VAL 134 HG21 VAL 134 -3.712 -8.439 3.257 1011 HG22 VAL 134 HG22 VAL 134 -3.250 -6.840 2.671 1012 HG23 VAL 134 HG23 VAL 134 -3.920 -8.030 1.554 1013 H LEU 135 H LEU 135 -6.110 -4.146 4.484 1014 HA LEU 135 HA LEU 135 -8.586 -4.335 5.818 1015 HB2 LEU 135 HB2 LEU 135 -6.936 -2.245 4.688 1016 HB3 LEU 135 HB3 LEU 135 -8.615 -1.950 4.287 1017 HG LEU 135 HG LEU 135 -7.427 -2.204 7.057 1018 HD11 LEU 135 HD11 LEU 135 -8.225 0.093 7.311 1019 HD12 LEU 135 HD12 LEU 135 -8.800 0.084 5.643 1020 HD13 LEU 135 HD13 LEU 135 -7.072 -0.043 5.983 1021 HD21 LEU 135 HD21 LEU 135 -10.321 -1.930 6.228 1022 HD22 LEU 135 HD22 LEU 135 -9.713 -1.752 7.876 1023 HD23 LEU 135 HD23 LEU 135 -9.581 -3.304 7.054 1024 H SER 136 H SER 136 -10.185 -5.590 4.921 1025 HA SER 136 HA SER 136 -10.682 -6.042 2.222 1026 HB2 SER 136 HB2 SER 136 -12.720 -5.995 4.474 1027 HB3 SER 136 HB3 SER 136 -12.958 -6.750 2.899 1028 HG SER 136 HG SER 136 -11.822 -8.409 3.526 1029 H VAL 137 H VAL 137 -12.082 -5.117 0.678 1030 HA VAL 137 HA VAL 137 -11.919 -2.414 0.372 1031 HB VAL 137 HB VAL 137 -14.096 -4.172 -0.776 1032 HG11 VAL 137 HG11 VAL 137 -14.663 -1.815 -1.024 1033 HG12 VAL 137 HG12 VAL 137 -14.219 -2.504 -2.585 1034 HG13 VAL 137 HG13 VAL 137 -13.074 -1.484 -1.713 1035 HG21 VAL 137 HG21 VAL 137 -11.843 -5.010 -1.249 1036 HG22 VAL 137 HG22 VAL 137 -11.382 -3.431 -1.887 1037 HG23 VAL 137 HG23 VAL 137 -12.609 -4.391 -2.713 1038 H LYS 138 H LYS 138 -14.911 -4.067 1.502 1039 HA LYS 138 HA LYS 138 -16.247 -1.596 2.020 1040 HB2 LYS 138 HB2 LYS 138 -17.464 -3.666 1.515 1041 HB3 LYS 138 HB3 LYS 138 -16.890 -4.378 3.015 1042 HG2 LYS 138 HG2 LYS 138 -18.133 -2.738 4.309 1043 HG3 LYS 138 HG3 LYS 138 -18.653 -1.934 2.825 1044 HD2 LYS 138 HD2 LYS 138 -20.411 -3.398 3.709 1045 HD3 LYS 138 HD3 LYS 138 -19.844 -3.949 2.130 1046 HE2 LYS 138 HE2 LYS 138 -18.359 -5.574 3.305 1047 HE3 LYS 138 HE3 LYS 138 -19.104 -5.086 4.827 1048 HZ1 LYS 138 HZ1 LYS 138 -20.081 -7.109 3.882 1049 HZ2 LYS 138 HZ2 LYS 138 -20.565 -6.239 2.517 1050 HZ3 LYS 138 HZ3 LYS 138 -21.220 -5.867 4.029 1051 H GLU 139 H GLU 139 -14.503 -3.896 4.111 1052 HA GLU 139 HA GLU 139 -14.983 -2.730 6.601 1053 HB2 GLU 139 HB2 GLU 139 -13.867 -4.857 6.425 1054 HB3 GLU 139 HB3 GLU 139 -12.551 -4.154 5.498 1055 HG2 GLU 139 HG2 GLU 139 -11.857 -2.871 7.480 1056 HG3 GLU 139 HG3 GLU 139 -13.159 -3.627 8.405 1057 H LEU 140 H LEU 140 -12.679 -1.888 4.099 1058 HA LEU 140 HA LEU 140 -11.255 0.148 5.364 1059 HB2 LEU 140 HB2 LEU 140 -10.947 -1.116 3.109 1060 HB3 LEU 140 HB3 LEU 140 -11.969 0.140 2.441 1061 HG LEU 140 HG LEU 140 -9.531 0.885 4.002 1062 HD11 LEU 140 HD11 LEU 140 -9.546 0.129 1.079 1063 HD12 LEU 140 HD12 LEU 140 -8.765 -0.774 2.377 1064 HD13 LEU 140 HD13 LEU 140 -8.196 0.842 1.963 1065 HD21 LEU 140 HD21 LEU 140 -11.079 2.651 3.387 1066 HD22 LEU 140 HD22 LEU 140 -11.004 2.155 1.694 1067 HD23 LEU 140 HD23 LEU 140 -9.573 2.816 2.485 1068 H LEU 141 H LEU 141 -14.296 0.216 3.504 1069 HA LEU 141 HA LEU 141 -14.796 2.986 3.646 1070 HB2 LEU 141 HB2 LEU 141 -16.925 0.843 3.754 1071 HB3 LEU 141 HB3 LEU 141 -17.084 2.476 3.134 1072 HG LEU 141 HG LEU 141 -15.493 0.234 1.874 1073 HD11 LEU 141 HD11 LEU 141 -18.045 1.581 0.988 1074 HD12 LEU 141 HD12 LEU 141 -17.910 -0.043 1.665 1075 HD13 LEU 141 HD13 LEU 141 -17.168 0.328 0.108 1076 HD21 LEU 141 HD21 LEU 141 -14.396 2.363 1.472 1077 HD22 LEU 141 HD22 LEU 141 -15.916 3.074 0.929 1078 HD23 LEU 141 HD23 LEU 141 -15.160 1.782 -0.007 1079 H GLU 142 H GLU 142 -15.686 0.325 5.818 1080 HA GLU 142 HA GLU 142 -17.093 1.853 7.736 1081 HB2 GLU 142 HB2 GLU 142 -15.561 -0.724 8.185 1082 HB3 GLU 142 HB3 GLU 142 -16.857 -0.089 9.192 1083 HG2 GLU 142 HG2 GLU 142 -18.442 -0.383 7.358 1084 HG3 GLU 142 HG3 GLU 142 -17.148 -0.992 6.328 1085 H ALA 143 H ALA 143 -13.687 1.169 7.295 1086 HA ALA 143 HA ALA 143 -12.742 2.037 9.819 1087 HB1 ALA 143 HB1 ALA 143 -11.290 2.048 7.170 1088 HB2 ALA 143 HB2 ALA 143 -11.417 0.671 8.263 1089 HB3 ALA 143 HB3 ALA 143 -10.552 2.120 8.772 1090 H ILE 144 H ILE 144 -12.933 3.751 6.684 1091 HA ILE 144 HA ILE 144 -12.101 6.247 7.840 1092 HB ILE 144 HB ILE 144 -12.581 7.238 5.648 1093 HG12 ILE 144 HG12 ILE 144 -13.119 5.338 3.831 1094 HG13 ILE 144 HG13 ILE 144 -13.962 4.621 5.196 1095 HG21 ILE 144 HG21 ILE 144 -10.439 6.146 6.042 1096 HG22 ILE 144 HG22 ILE 144 -10.942 5.960 4.362 1097 HG23 ILE 144 HG23 ILE 144 -11.106 4.609 5.484 1098 HD11 ILE 144 HD11 ILE 144 -14.466 7.371 4.076 1099 HD12 ILE 144 HD12 ILE 144 -15.347 6.609 5.402 1100 HD13 ILE 144 HD13 ILE 144 -15.442 5.934 3.776 1101 H GLY 145 H GLY 145 -15.116 4.640 7.530 1102 HA2 GLY 145 HA2 GLY 145 -16.819 5.566 9.109 1103 HA3 GLY 145 HA3 GLY 145 -16.531 7.117 8.338 1104 H SER 146 H SER 146 -16.899 7.113 5.899 1105 HA SER 146 HA SER 146 -18.337 6.952 4.140 1106 HB2 SER 146 HB2 SER 146 -17.507 4.650 3.989 1107 HB3 SER 146 HB3 SER 146 -18.724 4.118 5.148 1108 HG SER 146 HG SER 146 -19.838 3.757 3.394 Start of MODEL 16 1 H1 MET 1 H1 MET 1 50.096 -47.337 42.285 2 H2 MET 1 H2 MET 1 51.125 -47.641 43.591 3 H3 MET 1 H3 MET 1 49.640 -46.884 43.850 4 HA MET 1 HA MET 1 50.043 -49.663 42.891 5 HB2 MET 1 HB2 MET 1 49.029 -48.616 45.549 6 HB3 MET 1 HB3 MET 1 49.044 -50.309 45.071 7 HG2 MET 1 HG2 MET 1 51.455 -48.541 45.458 8 HG3 MET 1 HG3 MET 1 50.903 -49.821 46.539 9 HE1 MET 1 HE1 MET 1 53.281 -50.957 46.541 10 HE2 MET 1 HE2 MET 1 53.895 -49.680 45.490 11 HE3 MET 1 HE3 MET 1 54.174 -51.371 45.079 12 H GLY 2 H GLY 2 47.539 -47.516 44.324 13 HA2 GLY 2 HA2 GLY 2 45.486 -48.982 42.830 14 HA3 GLY 2 HA3 GLY 2 45.207 -47.858 44.147 15 H SER 3 H SER 3 43.702 -47.801 41.833 16 HA SER 3 HA SER 3 44.717 -45.524 40.258 17 HB2 SER 3 HB2 SER 3 42.953 -46.150 38.612 18 HB3 SER 3 HB3 SER 3 44.108 -47.447 38.905 19 HG SER 3 HG SER 3 42.560 -48.395 40.322 20 H SER 4 H SER 4 43.513 -43.678 39.926 21 HA SER 4 HA SER 4 40.850 -43.231 40.720 22 HB2 SER 4 HB2 SER 4 41.675 -43.428 43.018 23 HB3 SER 4 HB3 SER 4 42.924 -42.226 42.699 24 HG SER 4 HG SER 4 40.161 -41.893 43.057 25 H HIS 5 H HIS 5 40.369 -41.823 39.126 26 HA HIS 5 HA HIS 5 41.655 -39.267 38.949 27 HB2 HIS 5 HB2 HIS 5 43.037 -41.233 37.639 28 HB3 HIS 5 HB3 HIS 5 41.987 -40.656 36.351 29 HD1 HIS 5 HD1 HIS 5 43.326 -39.099 34.957 30 HD2 HIS 5 HD2 HIS 5 44.100 -38.593 39.007 31 HE1 HIS 5 HE1 HIS 5 44.976 -37.222 35.099 32 HE2 HIS 5 HE2 HIS 5 45.539 -37.034 37.535 33 H HIS 6 H HIS 6 40.037 -37.888 38.435 34 HA HIS 6 HA HIS 6 38.169 -38.474 36.301 35 HB2 HIS 6 HB2 HIS 6 36.160 -38.159 37.854 36 HB3 HIS 6 HB3 HIS 6 36.993 -39.708 37.930 37 HD1 HIS 6 HD1 HIS 6 37.358 -40.496 40.232 38 HD2 HIS 6 HD2 HIS 6 37.274 -36.346 40.045 39 HE1 HIS 6 HE1 HIS 6 37.638 -39.710 42.599 40 HE2 HIS 6 HE2 HIS 6 37.463 -37.206 42.474 41 H HIS 7 H HIS 7 36.693 -36.705 35.812 42 HA HIS 7 HA HIS 7 36.816 -34.205 37.198 43 HB2 HIS 7 HB2 HIS 7 37.899 -32.860 35.478 44 HB3 HIS 7 HB3 HIS 7 38.997 -34.120 36.028 45 HD1 HIS 7 HD1 HIS 7 37.999 -32.545 33.050 46 HD2 HIS 7 HD2 HIS 7 38.744 -36.498 34.091 47 HE1 HIS 7 HE1 HIS 7 38.430 -33.737 30.889 48 HE2 HIS 7 HE2 HIS 7 39.054 -36.078 31.557 49 H HIS 8 H HIS 8 35.531 -32.466 35.980 50 HA HIS 8 HA HIS 8 33.569 -33.677 34.132 51 HB2 HIS 8 HB2 HIS 8 32.974 -32.089 36.629 52 HB3 HIS 8 HB3 HIS 8 31.794 -32.298 35.342 53 HD1 HIS 8 HD1 HIS 8 33.093 -33.887 38.344 54 HD2 HIS 8 HD2 HIS 8 31.048 -35.090 34.934 55 HE1 HIS 8 HE1 HIS 8 32.123 -36.131 38.901 56 HE2 HIS 8 HE2 HIS 8 30.725 -36.734 36.904 57 H HIS 9 H HIS 9 32.510 -32.308 32.705 58 HA HIS 9 HA HIS 9 33.441 -29.501 32.542 59 HB2 HIS 9 HB2 HIS 9 32.487 -31.356 30.336 60 HB3 HIS 9 HB3 HIS 9 32.785 -29.635 30.117 61 HD1 HIS 9 HD1 HIS 9 35.195 -28.876 29.875 62 HD2 HIS 9 HD2 HIS 9 34.816 -32.941 30.628 63 HE1 HIS 9 HE1 HIS 9 37.473 -29.844 29.480 64 HE2 HIS 9 HE2 HIS 9 37.131 -32.329 29.663 65 H HIS 10 H HIS 10 31.794 -27.933 31.833 66 HA HIS 10 HA HIS 10 29.024 -28.799 31.802 67 HB2 HIS 10 HB2 HIS 10 29.583 -28.480 34.235 68 HB3 HIS 10 HB3 HIS 10 29.891 -26.782 33.890 69 HD1 HIS 10 HD1 HIS 10 27.802 -25.310 33.271 70 HD2 HIS 10 HD2 HIS 10 26.913 -29.200 34.438 71 HE1 HIS 10 HE1 HIS 10 25.333 -25.333 33.711 72 HE2 HIS 10 HE2 HIS 10 24.825 -27.674 34.483 73 H SER 11 H SER 11 27.908 -27.632 30.380 74 HA SER 11 HA SER 11 28.337 -24.802 30.005 75 HB2 SER 11 HB2 SER 11 28.808 -25.012 27.537 76 HB3 SER 11 HB3 SER 11 30.128 -25.561 28.570 77 HG SER 11 HG SER 11 28.199 -27.208 27.276 78 H SER 12 H SER 12 26.214 -24.377 30.354 79 HA SER 12 HA SER 12 24.225 -25.714 28.611 80 HB2 SER 12 HB2 SER 12 23.786 -24.593 31.397 81 HB3 SER 12 HB3 SER 12 22.569 -25.385 30.398 82 HG SER 12 HG SER 12 23.895 -27.285 30.476 83 H GLY 13 H GLY 13 23.145 -24.432 27.222 84 HA2 GLY 13 HA2 GLY 13 21.567 -22.443 27.355 85 HA3 GLY 13 HA3 GLY 13 22.988 -21.537 27.839 86 H ARG 14 H ARG 14 21.010 -22.278 25.287 87 HA ARG 14 HA ARG 14 23.041 -21.461 23.310 88 HB2 ARG 14 HB2 ARG 14 20.216 -22.452 22.817 89 HB3 ARG 14 HB3 ARG 14 21.422 -22.092 21.585 90 HG2 ARG 14 HG2 ARG 14 22.858 -23.894 22.615 91 HG3 ARG 14 HG3 ARG 14 21.462 -24.331 23.604 92 HD2 ARG 14 HD2 ARG 14 21.516 -25.776 21.690 93 HD3 ARG 14 HD3 ARG 14 20.158 -24.664 21.503 94 HE ARG 14 HE ARG 14 22.442 -23.611 20.219 95 HH11 ARG 14 HH11 ARG 14 20.091 -26.112 19.851 96 HH12 ARG 14 HH12 ARG 14 20.247 -26.146 18.132 97 HH21 ARG 14 HH21 ARG 14 22.619 -23.673 18.004 98 HH22 ARG 14 HH22 ARG 14 21.666 -24.800 17.101 99 H GLU 15 H GLU 15 23.223 -19.301 23.245 100 HA GLU 15 HA GLU 15 20.947 -17.652 24.081 101 HB2 GLU 15 HB2 GLU 15 23.153 -17.486 25.245 102 HB3 GLU 15 HB3 GLU 15 23.855 -16.872 23.757 103 HG2 GLU 15 HG2 GLU 15 22.436 -14.909 23.856 104 HG3 GLU 15 HG3 GLU 15 21.617 -15.544 25.282 105 H ASN 16 H ASN 16 20.917 -15.395 23.084 106 HA ASN 16 HA ASN 16 20.921 -13.887 21.388 107 HB2 ASN 16 HB2 ASN 16 22.130 -16.086 19.710 108 HB3 ASN 16 HB3 ASN 16 21.739 -14.484 19.091 109 HD21 ASN 16 HD21 ASN 16 24.317 -15.820 19.346 110 HD22 ASN 16 HD22 ASN 16 25.296 -14.749 20.283 111 H LEU 17 H LEU 17 19.296 -13.174 20.171 112 HA LEU 17 HA LEU 17 17.343 -15.097 19.089 113 HB2 LEU 17 HB2 LEU 17 16.680 -14.160 21.350 114 HB3 LEU 17 HB3 LEU 17 16.618 -12.578 20.607 115 HG LEU 17 HG LEU 17 14.410 -13.822 20.958 116 HD11 LEU 17 HD11 LEU 17 15.027 -12.818 18.183 117 HD12 LEU 17 HD12 LEU 17 14.592 -11.820 19.570 118 HD13 LEU 17 HD13 LEU 17 13.426 -12.965 18.908 119 HD21 LEU 17 HD21 LEU 17 15.389 -15.351 18.548 120 HD22 LEU 17 HD22 LEU 17 13.762 -15.416 19.227 121 HD23 LEU 17 HD23 LEU 17 15.134 -16.008 20.165 122 H TYR 18 H TYR 18 16.263 -14.388 17.202 123 HA TYR 18 HA TYR 18 17.764 -12.474 15.648 124 HB2 TYR 18 HB2 TYR 18 15.301 -14.060 14.895 125 HB3 TYR 18 HB3 TYR 18 16.343 -13.183 13.781 126 HD1 TYR 18 HD2 TYR 18 18.636 -14.005 13.322 127 HD2 TYR 18 HD1 TYR 18 15.916 -16.234 15.724 128 HE1 TYR 18 HE2 TYR 18 20.032 -16.007 13.037 129 HE2 TYR 18 HE1 TYR 18 17.309 -18.240 15.449 130 HH TYR 18 HH TYR 18 20.463 -18.138 14.167 131 H PHE 19 H PHE 19 17.376 -10.360 15.912 132 HA PHE 19 HA PHE 19 14.672 -9.414 16.521 133 HB2 PHE 19 HB2 PHE 19 16.604 -8.581 17.852 134 HB3 PHE 19 HB3 PHE 19 17.267 -7.850 16.393 135 HD1 PHE 19 HD2 PHE 19 14.292 -7.803 18.627 136 HD2 PHE 19 HD1 PHE 19 16.622 -5.676 15.760 137 HE1 PHE 19 HE2 PHE 19 12.970 -5.775 19.057 138 HE2 PHE 19 HE1 PHE 19 15.302 -3.646 16.194 139 HZ PHE 19 HZ PHE 19 13.474 -3.695 17.843 140 H GLN 20 H GLN 20 13.642 -7.752 15.314 141 HA GLN 20 HA GLN 20 14.666 -7.172 12.620 142 HB2 GLN 20 HB2 GLN 20 13.251 -9.123 12.315 143 HB3 GLN 20 HB3 GLN 20 11.958 -8.381 13.241 144 HG2 GLN 20 HG2 GLN 20 11.878 -6.587 11.450 145 HG3 GLN 20 HG3 GLN 20 12.936 -7.626 10.498 146 HE21 GLN 20 HE21 GLN 20 12.110 -9.564 9.677 147 HE22 GLN 20 HE22 GLN 20 10.416 -9.893 9.627 148 H GLY 21 H GLY 21 14.401 -5.050 12.129 149 HA2 GLY 21 HA2 GLY 21 12.023 -3.594 12.642 150 HA3 GLY 21 HA3 GLY 21 13.217 -3.184 13.861 151 H HIS 22 H HIS 22 12.141 -2.629 10.654 152 HA HIS 22 HA HIS 22 13.879 -0.389 10.310 153 HB2 HIS 22 HB2 HIS 22 15.453 -2.229 9.741 154 HB3 HIS 22 HB3 HIS 22 14.356 -2.754 8.470 155 HD1 HIS 22 HD1 HIS 22 17.168 -0.547 9.117 156 HD2 HIS 22 HD2 HIS 22 14.100 -0.748 6.321 157 HE1 HIS 22 HE1 HIS 22 17.899 0.910 7.211 158 HE2 HIS 22 HE2 HIS 22 15.981 0.877 5.594 159 H MET 23 H MET 23 11.926 0.746 9.902 160 HA MET 23 HA MET 23 10.358 -0.001 7.566 161 HB2 MET 23 HB2 MET 23 8.927 1.865 8.183 162 HB3 MET 23 HB3 MET 23 9.238 0.852 9.585 163 HG2 MET 23 HG2 MET 23 11.001 2.479 10.280 164 HG3 MET 23 HG3 MET 23 10.479 3.521 8.954 165 HE1 MET 23 HE1 MET 23 7.339 2.469 9.184 166 HE2 MET 23 HE2 MET 23 7.797 4.100 8.692 167 HE3 MET 23 HE3 MET 23 6.638 3.869 10.004 168 H LEU 24 H LEU 24 9.828 1.790 5.956 169 HA LEU 24 HA LEU 24 12.265 3.336 5.318 170 HB2 LEU 24 HB2 LEU 24 10.639 1.533 3.550 171 HB3 LEU 24 HB3 LEU 24 11.634 2.811 2.873 172 HG LEU 24 HG LEU 24 12.775 0.712 4.701 173 HD11 LEU 24 HD11 LEU 24 13.502 -0.495 2.702 174 HD12 LEU 24 HD12 LEU 24 12.591 0.628 1.691 175 HD13 LEU 24 HD13 LEU 24 11.743 -0.436 2.815 176 HD21 LEU 24 HD21 LEU 24 14.028 2.513 2.629 177 HD22 LEU 24 HD22 LEU 24 14.879 1.352 3.649 178 HD23 LEU 24 HD23 LEU 24 14.094 2.753 4.377 179 H GLU 25 H GLU 25 12.042 5.273 4.311 180 HA GLU 25 HA GLU 25 9.368 6.447 4.162 181 HB2 GLU 25 HB2 GLU 25 12.151 7.538 4.125 182 HB3 GLU 25 HB3 GLU 25 10.873 8.486 3.372 183 HG2 GLU 25 HG2 GLU 25 9.653 8.607 5.414 184 HG3 GLU 25 HG3 GLU 25 10.727 7.449 6.183 185 H VAL 26 H VAL 26 8.256 6.564 2.374 186 HA VAL 26 HA VAL 26 9.608 6.261 -0.231 187 HB VAL 26 HB VAL 26 7.869 4.625 -0.961 188 HG11 VAL 26 HG11 VAL 26 10.068 3.817 -0.308 189 HG12 VAL 26 HG12 VAL 26 8.829 2.671 0.204 190 HG13 VAL 26 HG13 VAL 26 9.571 3.754 1.382 191 HG21 VAL 26 HG21 VAL 26 6.552 3.445 0.757 192 HG22 VAL 26 HG22 VAL 26 6.139 5.159 0.673 193 HG23 VAL 26 HG23 VAL 26 7.164 4.562 1.979 194 H GLU 27 H GLU 27 8.373 6.937 -2.068 195 HA GLU 27 HA GLU 27 6.163 8.764 -1.420 196 HB2 GLU 27 HB2 GLU 27 8.088 9.598 -2.806 197 HB3 GLU 27 HB3 GLU 27 7.610 8.469 -4.068 198 HG2 GLU 27 HG2 GLU 27 5.502 9.591 -4.352 199 HG3 GLU 27 HG3 GLU 27 5.825 10.638 -2.971 200 H VAL 28 H VAL 28 4.164 8.026 -1.621 201 HA VAL 28 HA VAL 28 3.655 5.484 -2.945 202 HB VAL 28 HB VAL 28 1.809 7.189 -1.256 203 HG11 VAL 28 HG11 VAL 28 0.580 5.670 -2.703 204 HG12 VAL 28 HG12 VAL 28 0.479 5.129 -1.027 205 HG13 VAL 28 HG13 VAL 28 1.565 4.312 -2.153 206 HG21 VAL 28 HG21 VAL 28 2.324 5.633 0.567 207 HG22 VAL 28 HG22 VAL 28 3.768 6.479 0.012 208 HG23 VAL 28 HG23 VAL 28 3.490 4.804 -0.467 209 H ILE 29 H ILE 29 2.993 5.441 -5.003 210 HA ILE 29 HA ILE 29 1.555 7.766 -6.102 211 HB ILE 29 HB ILE 29 2.437 5.560 -7.904 212 HG12 ILE 29 HG12 ILE 29 4.403 7.533 -6.705 213 HG13 ILE 29 HG13 ILE 29 4.338 5.821 -6.317 214 HG21 ILE 29 HG21 ILE 29 1.320 7.505 -8.825 215 HG22 ILE 29 HG22 ILE 29 3.004 7.506 -9.351 216 HG23 ILE 29 HG23 ILE 29 2.483 8.583 -8.049 217 HD11 ILE 29 HD11 ILE 29 4.889 5.272 -8.621 218 HD12 ILE 29 HD12 ILE 29 6.113 6.309 -7.885 219 HD13 ILE 29 HD13 ILE 29 4.947 6.989 -9.019 220 H SER 30 H SER 30 -0.299 7.442 -7.482 221 HA SER 30 HA SER 30 -1.649 4.834 -7.172 222 HB2 SER 30 HB2 SER 30 -2.903 7.579 -6.967 223 HB3 SER 30 HB3 SER 30 -3.830 6.088 -7.121 224 HG SER 30 HG SER 30 -2.017 5.820 -5.155 225 H GLY 31 H GLY 31 -1.509 3.928 -9.134 226 HA2 GLY 31 HA2 GLY 31 -1.715 5.630 -11.526 227 HA3 GLY 31 HA3 GLY 31 -1.076 3.998 -11.473 228 H ARG 32 H ARG 32 -2.939 4.979 -13.353 229 HA ARG 32 HA ARG 32 -5.595 4.139 -12.616 230 HB2 ARG 32 HB2 ARG 32 -6.090 4.617 -15.054 231 HB3 ARG 32 HB3 ARG 32 -5.475 5.971 -14.114 232 HG2 ARG 32 HG2 ARG 32 -3.209 5.511 -15.042 233 HG3 ARG 32 HG3 ARG 32 -3.931 4.277 -16.073 234 HD2 ARG 32 HD2 ARG 32 -5.259 5.923 -17.217 235 HD3 ARG 32 HD3 ARG 32 -4.762 7.182 -16.084 236 HE ARG 32 HE ARG 32 -2.502 6.035 -17.350 237 HH11 ARG 32 HH11 ARG 32 -5.121 8.207 -17.968 238 HH12 ARG 32 HH12 ARG 32 -4.244 9.084 -19.172 239 HH21 ARG 32 HH21 ARG 32 -1.388 7.201 -18.870 240 HH22 ARG 32 HH22 ARG 32 -2.144 8.550 -19.646 241 H THR 33 H THR 33 -4.783 1.920 -11.999 242 HA THR 33 HA THR 33 -4.352 0.004 -14.111 243 HB THR 33 HB THR 33 -4.712 -1.712 -12.353 244 HG1 THR 33 HG1 THR 33 -5.356 -1.146 -10.333 245 HG21 THR 33 HG21 THR 33 -2.476 -0.762 -12.611 246 HG22 THR 33 HG22 THR 33 -2.805 -1.103 -10.911 247 HG23 THR 33 HG23 THR 33 -2.890 0.554 -11.510 248 H LEU 34 H LEU 34 -7.080 1.013 -12.111 249 HA LEU 34 HA LEU 34 -8.941 -0.326 -13.966 250 HB2 LEU 34 HB2 LEU 34 -9.445 0.855 -11.224 251 HB3 LEU 34 HB3 LEU 34 -10.656 0.080 -12.230 252 HG LEU 34 HG LEU 34 -8.229 -1.286 -11.039 253 HD11 LEU 34 HD11 LEU 34 -9.909 -0.699 -9.355 254 HD12 LEU 34 HD12 LEU 34 -9.827 -2.442 -9.606 255 HD13 LEU 34 HD13 LEU 34 -11.152 -1.513 -10.308 256 HD21 LEU 34 HD21 LEU 34 -10.528 -2.421 -12.645 257 HD22 LEU 34 HD22 LEU 34 -9.262 -3.361 -11.854 258 HD23 LEU 34 HD23 LEU 34 -8.853 -2.274 -13.179 259 H ASN 35 H ASN 35 -10.917 0.937 -14.538 260 HA ASN 35 HA ASN 35 -10.260 3.465 -15.617 261 HB2 ASN 35 HB2 ASN 35 -11.917 2.114 -16.722 262 HB3 ASN 35 HB3 ASN 35 -12.929 2.078 -15.280 263 HD21 ASN 35 HD21 ASN 35 -11.726 4.104 -17.870 264 HD22 ASN 35 HD22 ASN 35 -12.950 5.315 -17.739 265 H GLN 36 H GLN 36 -9.894 5.233 -14.393 266 HA GLN 36 HA GLN 36 -11.209 5.748 -11.910 267 HB2 GLN 36 HB2 GLN 36 -9.674 7.655 -13.696 268 HB3 GLN 36 HB3 GLN 36 -10.135 7.964 -12.027 269 HG2 GLN 36 HG2 GLN 36 -8.727 6.093 -11.296 270 HG3 GLN 36 HG3 GLN 36 -8.259 5.801 -12.972 271 HE21 GLN 36 HE21 GLN 36 -6.939 7.310 -14.020 272 HE22 GLN 36 HE22 GLN 36 -5.982 8.442 -13.133 273 H GLY 37 H GLY 37 -13.329 6.068 -11.869 274 HA2 GLY 37 HA2 GLY 37 -14.686 8.288 -12.731 275 HA3 GLY 37 HA3 GLY 37 -14.813 7.160 -14.077 276 H ALA 38 H ALA 38 -15.079 4.748 -12.817 277 HA ALA 38 HA ALA 38 -17.714 4.940 -11.592 278 HB1 ALA 38 HB1 ALA 38 -17.270 3.237 -13.327 279 HB2 ALA 38 HB2 ALA 38 -17.800 2.528 -11.799 280 HB3 ALA 38 HB3 ALA 38 -16.094 2.476 -12.251 281 H THR 39 H THR 39 -18.080 4.848 -9.456 282 HA THR 39 HA THR 39 -15.936 4.660 -7.570 283 HB THR 39 HB THR 39 -17.670 4.772 -5.831 284 HG1 THR 39 HG1 THR 39 -19.917 5.068 -6.799 285 HG21 THR 39 HG21 THR 39 -18.200 6.664 -8.133 286 HG22 THR 39 HG22 THR 39 -16.952 6.859 -6.900 287 HG23 THR 39 HG23 THR 39 -18.657 6.938 -6.452 288 H VAL 40 H VAL 40 -15.848 3.078 -5.776 289 HA VAL 40 HA VAL 40 -15.750 0.440 -6.656 290 HB VAL 40 HB VAL 40 -14.496 1.210 -4.703 291 HG11 VAL 40 HG11 VAL 40 -17.158 1.253 -3.281 292 HG12 VAL 40 HG12 VAL 40 -16.152 2.651 -3.666 293 HG13 VAL 40 HG13 VAL 40 -15.582 1.443 -2.513 294 HG21 VAL 40 HG21 VAL 40 -14.827 -1.177 -4.989 295 HG22 VAL 40 HG22 VAL 40 -16.354 -1.096 -4.110 296 HG23 VAL 40 HG23 VAL 40 -14.838 -0.768 -3.273 297 H GLU 41 H GLU 41 -18.424 2.172 -5.114 298 HA GLU 41 HA GLU 41 -20.112 -0.039 -4.656 299 HB2 GLU 41 HB2 GLU 41 -20.561 2.189 -3.723 300 HB3 GLU 41 HB3 GLU 41 -20.863 2.814 -5.340 301 HG2 GLU 41 HG2 GLU 41 -22.827 1.464 -5.573 302 HG3 GLU 41 HG3 GLU 41 -22.480 0.609 -4.071 303 H GLU 42 H GLU 42 -19.576 1.930 -7.547 304 HA GLU 42 HA GLU 42 -21.472 0.679 -9.239 305 HB2 GLU 42 HB2 GLU 42 -18.959 2.256 -9.672 306 HB3 GLU 42 HB3 GLU 42 -19.693 1.432 -11.038 307 HG2 GLU 42 HG2 GLU 42 -21.151 3.399 -9.287 308 HG3 GLU 42 HG3 GLU 42 -20.330 3.823 -10.791 309 H LYS 43 H LYS 43 -18.231 -0.209 -8.251 310 HA LYS 43 HA LYS 43 -18.261 -2.515 -10.100 311 HB2 LYS 43 HB2 LYS 43 -15.847 -1.029 -9.056 312 HB3 LYS 43 HB3 LYS 43 -15.851 -2.317 -10.256 313 HG2 LYS 43 HG2 LYS 43 -17.001 -0.911 -11.839 314 HG3 LYS 43 HG3 LYS 43 -17.203 0.356 -10.631 315 HD2 LYS 43 HD2 LYS 43 -15.401 1.008 -12.049 316 HD3 LYS 43 HD3 LYS 43 -14.698 0.519 -10.509 317 HE2 LYS 43 HE2 LYS 43 -13.386 -0.341 -12.360 318 HE3 LYS 43 HE3 LYS 43 -14.138 -1.670 -11.478 319 HZ1 LYS 43 HZ1 LYS 43 -14.265 -1.892 -13.917 320 HZ2 LYS 43 HZ2 LYS 43 -15.224 -0.502 -13.980 321 HZ3 LYS 43 HZ3 LYS 43 -15.787 -1.880 -13.180 322 H LEU 44 H LEU 44 -19.363 -2.647 -7.432 323 HA LEU 44 HA LEU 44 -17.539 -3.836 -5.614 324 HB2 LEU 44 HB2 LEU 44 -20.543 -3.976 -5.837 325 HB3 LEU 44 HB3 LEU 44 -19.665 -4.831 -4.584 326 HG LEU 44 HG LEU 44 -19.659 -1.831 -4.979 327 HD11 LEU 44 HD11 LEU 44 -21.010 -3.519 -2.868 328 HD12 LEU 44 HD12 LEU 44 -21.815 -2.654 -4.178 329 HD13 LEU 44 HD13 LEU 44 -20.968 -1.755 -2.920 330 HD21 LEU 44 HD21 LEU 44 -18.498 -1.770 -2.815 331 HD22 LEU 44 HD22 LEU 44 -17.555 -2.621 -4.037 332 HD23 LEU 44 HD23 LEU 44 -18.427 -3.534 -2.804 333 H THR 45 H THR 45 -16.343 -5.257 -6.949 334 HA THR 45 HA THR 45 -17.513 -7.948 -7.076 335 HB THR 45 HB THR 45 -17.767 -7.234 -9.357 336 HG1 THR 45 HG1 THR 45 -16.316 -8.724 -10.395 337 HG21 THR 45 HG21 THR 45 -14.855 -6.416 -9.285 338 HG22 THR 45 HG22 THR 45 -16.238 -5.322 -9.342 339 HG23 THR 45 HG23 THR 45 -15.898 -6.387 -10.707 340 H GLU 46 H GLU 46 -15.829 -9.648 -7.289 341 HA GLU 46 HA GLU 46 -13.698 -9.237 -5.473 342 HB2 GLU 46 HB2 GLU 46 -14.784 -11.441 -5.913 343 HB3 GLU 46 HB3 GLU 46 -14.016 -11.477 -7.493 344 HG2 GLU 46 HG2 GLU 46 -12.759 -12.864 -6.015 345 HG3 GLU 46 HG3 GLU 46 -11.802 -11.431 -6.371 346 H GLU 47 H GLU 47 -13.942 -9.023 -8.943 347 HA GLU 47 HA GLU 47 -11.282 -8.946 -9.741 348 HB2 GLU 47 HB2 GLU 47 -13.561 -7.231 -10.751 349 HB3 GLU 47 HB3 GLU 47 -12.070 -7.571 -11.618 350 HG2 GLU 47 HG2 GLU 47 -12.653 -9.855 -11.905 351 HG3 GLU 47 HG3 GLU 47 -13.999 -9.721 -10.772 352 H TYR 48 H TYR 48 -13.290 -6.376 -8.365 353 HA TYR 48 HA TYR 48 -11.454 -4.245 -8.643 354 HB2 TYR 48 HB2 TYR 48 -14.003 -4.234 -8.058 355 HB3 TYR 48 HB3 TYR 48 -13.458 -4.405 -6.397 356 HD1 TYR 48 HD1 TYR 48 -11.787 -2.583 -5.523 357 HD2 TYR 48 HD2 TYR 48 -14.185 -2.120 -9.018 358 HE1 TYR 48 HE1 TYR 48 -11.511 -0.144 -5.393 359 HE2 TYR 48 HE2 TYR 48 -13.908 0.318 -8.893 360 HH TYR 48 HH TYR 48 -11.613 1.830 -7.116 361 H PHE 49 H PHE 49 -11.981 -6.641 -6.113 362 HA PHE 49 HA PHE 49 -10.327 -5.557 -4.109 363 HB2 PHE 49 HB2 PHE 49 -11.991 -7.353 -3.725 364 HB3 PHE 49 HB3 PHE 49 -11.009 -8.463 -4.670 365 HD1 PHE 49 HD2 PHE 49 -8.823 -9.245 -3.775 366 HD2 PHE 49 HD1 PHE 49 -11.491 -6.878 -1.440 367 HE1 PHE 49 HE2 PHE 49 -7.628 -9.915 -1.732 368 HE2 PHE 49 HE1 PHE 49 -10.297 -7.548 0.604 369 HZ PHE 49 HZ PHE 49 -8.365 -9.068 0.460 370 H ASN 50 H ASN 50 -9.618 -8.350 -6.208 371 HA ASN 50 HA ASN 50 -6.953 -8.620 -5.484 372 HB2 ASN 50 HB2 ASN 50 -8.264 -9.380 -8.102 373 HB3 ASN 50 HB3 ASN 50 -6.724 -10.003 -7.518 374 HD21 ASN 50 HD21 ASN 50 -9.284 -11.366 -8.121 375 HD22 ASN 50 HD22 ASN 50 -9.696 -12.218 -6.681 376 H ALA 51 H ALA 51 -8.334 -6.282 -7.614 377 HA ALA 51 HA ALA 51 -5.946 -5.795 -9.156 378 HB1 ALA 51 HB1 ALA 51 -8.162 -5.475 -10.133 379 HB2 ALA 51 HB2 ALA 51 -7.216 -3.986 -10.185 380 HB3 ALA 51 HB3 ALA 51 -8.491 -4.182 -8.979 381 H VAL 52 H VAL 52 -7.458 -4.301 -6.312 382 HA VAL 52 HA VAL 52 -5.327 -2.238 -6.331 383 HB VAL 52 HB VAL 52 -6.844 -0.741 -5.134 384 HG11 VAL 52 HG11 VAL 52 -6.784 -0.646 -7.573 385 HG12 VAL 52 HG12 VAL 52 -8.395 -0.263 -6.969 386 HG13 VAL 52 HG13 VAL 52 -8.070 -1.851 -7.665 387 HG21 VAL 52 HG21 VAL 52 -9.243 -1.312 -4.897 388 HG22 VAL 52 HG22 VAL 52 -8.204 -2.356 -3.927 389 HG23 VAL 52 HG23 VAL 52 -8.887 -2.952 -5.439 390 H ASN 53 H ASN 53 -5.542 -4.987 -4.925 391 HA ASN 53 HA ASN 53 -5.335 -4.101 -2.123 392 HB2 ASN 53 HB2 ASN 53 -6.135 -6.640 -3.445 393 HB3 ASN 53 HB3 ASN 53 -5.304 -6.784 -1.898 394 HD21 ASN 53 HD21 ASN 53 -7.932 -4.967 -3.430 395 HD22 ASN 53 HD22 ASN 53 -8.948 -4.949 -2.034 396 H TYR 54 H TYR 54 -3.115 -3.814 -4.141 397 HA TYR 54 HA TYR 54 -1.060 -4.983 -2.430 398 HB2 TYR 54 HB2 TYR 54 0.171 -6.047 -4.206 399 HB3 TYR 54 HB3 TYR 54 -1.470 -6.682 -4.199 400 HD1 TYR 54 HD2 TYR 54 -3.018 -6.149 -6.028 401 HD2 TYR 54 HD1 TYR 54 0.988 -4.711 -6.054 402 HE1 TYR 54 HE2 TYR 54 -3.237 -5.588 -8.414 403 HE2 TYR 54 HE1 TYR 54 0.782 -4.157 -8.439 404 HH TYR 54 HH TYR 54 -0.541 -4.777 -10.364 405 H ALA 55 H ALA 55 1.125 -4.195 -2.907 406 HA ALA 55 HA ALA 55 1.203 -1.633 -4.382 407 HB1 ALA 55 HB1 ALA 55 2.535 -2.221 -1.731 408 HB2 ALA 55 HB2 ALA 55 1.138 -1.173 -1.979 409 HB3 ALA 55 HB3 ALA 55 2.704 -0.731 -2.661 410 H GLU 56 H GLU 56 2.888 -1.421 -5.787 411 HA GLU 56 HA GLU 56 4.774 -3.632 -6.020 412 HB2 GLU 56 HB2 GLU 56 4.396 -1.212 -7.804 413 HB3 GLU 56 HB3 GLU 56 5.451 -2.580 -8.144 414 HG2 GLU 56 HG2 GLU 56 3.344 -4.021 -7.994 415 HG3 GLU 56 HG3 GLU 56 2.449 -2.505 -8.071 416 H ILE 57 H ILE 57 6.760 -3.598 -5.266 417 HA ILE 57 HA ILE 57 7.854 -1.065 -4.200 418 HB ILE 57 HB ILE 57 8.218 -3.860 -3.088 419 HG12 ILE 57 HG12 ILE 57 6.498 -1.649 -1.938 420 HG13 ILE 57 HG13 ILE 57 5.852 -2.897 -2.999 421 HG21 ILE 57 HG21 ILE 57 10.064 -2.380 -2.528 422 HG22 ILE 57 HG22 ILE 57 9.081 -2.685 -1.095 423 HG23 ILE 57 HG23 ILE 57 8.936 -1.150 -1.954 424 HD11 ILE 57 HD11 ILE 57 5.458 -3.386 -0.649 425 HD12 ILE 57 HD12 ILE 57 7.198 -3.385 -0.354 426 HD13 ILE 57 HD13 ILE 57 6.480 -4.607 -1.409 427 H ASN 58 H ASN 58 10.124 -0.738 -4.317 428 HA ASN 58 HA ASN 58 11.508 -1.974 -6.490 429 HB2 ASN 58 HB2 ASN 58 11.894 0.373 -5.876 430 HB3 ASN 58 HB3 ASN 58 12.526 -0.126 -4.312 431 HD21 ASN 58 HD21 ASN 58 13.157 0.057 -7.726 432 HD22 ASN 58 HD22 ASN 58 14.847 -0.280 -7.624 433 H GLU 59 H GLU 59 13.510 -3.187 -6.369 434 HA GLU 59 HA GLU 59 13.447 -5.395 -4.667 435 HB2 GLU 59 HB2 GLU 59 14.637 -5.258 -6.859 436 HB3 GLU 59 HB3 GLU 59 15.882 -4.291 -6.084 437 HG2 GLU 59 HG2 GLU 59 16.694 -6.511 -6.239 438 HG3 GLU 59 HG3 GLU 59 16.319 -6.215 -4.546 439 H GLU 60 H GLU 60 15.481 -2.482 -4.444 440 HA GLU 60 HA GLU 60 17.003 -3.154 -2.205 441 HB2 GLU 60 HB2 GLU 60 16.014 -0.486 -3.228 442 HB3 GLU 60 HB3 GLU 60 17.140 -0.632 -1.885 443 HG2 GLU 60 HG2 GLU 60 17.694 -1.808 -4.600 444 HG3 GLU 60 HG3 GLU 60 18.135 -0.157 -4.160 445 H ASP 61 H ASP 61 13.999 -1.218 -2.292 446 HA ASP 61 HA ASP 61 13.706 -0.973 0.494 447 HB2 ASP 61 HB2 ASP 61 11.568 -0.917 -1.653 448 HB3 ASP 61 HB3 ASP 61 11.382 -0.312 -0.009 449 H TRP 62 H TRP 62 12.600 -3.414 -1.772 450 HA TRP 62 HA TRP 62 10.859 -4.897 -0.192 451 HB2 TRP 62 HB2 TRP 62 11.195 -5.239 -2.608 452 HB3 TRP 62 HB3 TRP 62 12.801 -5.887 -2.299 453 HD1 TRP 62 HD1 TRP 62 12.949 -8.375 -1.302 454 HE1 TRP 62 HE1 TRP 62 11.251 -10.307 -1.262 455 HE3 TRP 62 HE3 TRP 62 8.710 -5.746 -2.406 456 HZ2 TRP 62 HZ2 TRP 62 8.486 -10.667 -1.657 457 HZ3 TRP 62 HZ3 TRP 62 6.575 -6.961 -2.554 458 HH2 TRP 62 HH2 TRP 62 6.466 -9.375 -2.187 459 H ASN 63 H ASN 63 14.370 -5.444 -0.643 460 HA ASN 63 HA ASN 63 14.463 -7.480 1.375 461 HB2 ASN 63 HB2 ASN 63 16.679 -5.985 -0.039 462 HB3 ASN 63 HB3 ASN 63 16.939 -7.336 1.062 463 HD21 ASN 63 HD21 ASN 63 15.881 -6.378 -2.066 464 HD22 ASN 63 HD22 ASN 63 15.693 -7.962 -2.722 465 H ALA 64 H ALA 64 14.970 -4.013 1.387 466 HA ALA 64 HA ALA 64 16.296 -3.781 3.868 467 HB1 ALA 64 HB1 ALA 64 15.549 -1.465 3.861 468 HB2 ALA 64 HB2 ALA 64 14.378 -1.830 2.590 469 HB3 ALA 64 HB3 ALA 64 16.108 -1.941 2.256 470 H LEU 65 H LEU 65 12.897 -4.154 3.054 471 HA LEU 65 HA LEU 65 12.042 -3.952 5.840 472 HB2 LEU 65 HB2 LEU 65 10.487 -4.593 3.326 473 HB3 LEU 65 HB3 LEU 65 9.783 -4.330 4.910 474 HG LEU 65 HG LEU 65 11.333 -2.237 3.373 475 HD11 LEU 65 HD11 LEU 65 8.349 -2.578 3.664 476 HD12 LEU 65 HD12 LEU 65 9.286 -2.796 2.185 477 HD13 LEU 65 HD13 LEU 65 9.164 -1.200 2.923 478 HD21 LEU 65 HD21 LEU 65 11.373 -1.907 5.791 479 HD22 LEU 65 HD22 LEU 65 9.613 -2.027 5.849 480 HD23 LEU 65 HD23 LEU 65 10.380 -0.681 5.003 481 H GLY 66 H GLY 66 13.424 -6.331 3.992 482 HA2 GLY 66 HA2 GLY 66 13.583 -8.620 4.131 483 HA3 GLY 66 HA3 GLY 66 12.938 -8.460 5.759 484 H LEU 67 H LEU 67 11.505 -7.823 2.561 485 HA LEU 67 HA LEU 67 9.041 -9.075 3.425 486 HB2 LEU 67 HB2 LEU 67 9.810 -7.608 0.908 487 HB3 LEU 67 HB3 LEU 67 8.217 -8.296 1.174 488 HG LEU 67 HG LEU 67 9.481 -6.183 2.931 489 HD11 LEU 67 HD11 LEU 67 7.901 -4.634 1.891 490 HD12 LEU 67 HD12 LEU 67 7.367 -5.906 0.793 491 HD13 LEU 67 HD13 LEU 67 9.021 -5.300 0.705 492 HD21 LEU 67 HD21 LEU 67 7.227 -5.961 3.866 493 HD22 LEU 67 HD22 LEU 67 7.877 -7.579 4.118 494 HD23 LEU 67 HD23 LEU 67 6.675 -7.301 2.858 495 H GLN 68 H GLN 68 7.897 -10.638 2.297 496 HA GLN 68 HA GLN 68 9.350 -12.316 0.353 497 HB2 GLN 68 HB2 GLN 68 9.257 -13.500 2.484 498 HB3 GLN 68 HB3 GLN 68 7.538 -13.173 2.633 499 HG2 GLN 68 HG2 GLN 68 7.129 -14.582 0.646 500 HG3 GLN 68 HG3 GLN 68 8.851 -14.959 0.592 501 HE21 GLN 68 HE21 GLN 68 6.527 -16.702 0.975 502 HE22 GLN 68 HE22 GLN 68 6.801 -17.533 2.462 503 H GLU 69 H GLU 69 8.030 -13.147 -1.362 504 HA GLU 69 HA GLU 69 5.997 -11.384 -2.198 505 HB2 GLU 69 HB2 GLU 69 6.886 -14.072 -3.229 506 HB3 GLU 69 HB3 GLU 69 5.611 -13.140 -4.005 507 HG2 GLU 69 HG2 GLU 69 7.085 -11.369 -4.529 508 HG3 GLU 69 HG3 GLU 69 8.345 -12.014 -3.482 509 H GLY 70 H GLY 70 4.201 -11.193 -1.050 510 HA2 GLY 70 HA2 GLY 70 1.907 -12.218 -0.969 511 HA3 GLY 70 HA3 GLY 70 2.697 -13.644 -0.315 512 H ASP 71 H ASP 71 4.418 -11.279 1.065 513 HA ASP 71 HA ASP 71 3.162 -11.461 3.601 514 HB2 ASP 71 HB2 ASP 71 5.366 -9.682 2.556 515 HB3 ASP 71 HB3 ASP 71 4.797 -9.594 4.218 516 H ARG 72 H ARG 72 2.367 -9.692 4.912 517 HA ARG 72 HA ARG 72 0.738 -7.796 3.358 518 HB2 ARG 72 HB2 ARG 72 0.465 -8.665 6.249 519 HB3 ARG 72 HB3 ARG 72 -0.654 -7.626 5.371 520 HG2 ARG 72 HG2 ARG 72 -1.282 -9.431 3.915 521 HG3 ARG 72 HG3 ARG 72 -0.038 -10.477 4.598 522 HD2 ARG 72 HD2 ARG 72 -2.486 -9.413 6.009 523 HD3 ARG 72 HD3 ARG 72 -2.192 -11.082 5.517 524 HE ARG 72 HE ARG 72 -1.131 -9.732 7.831 525 HH11 ARG 72 HH11 ARG 72 -0.825 -12.433 5.712 526 HH12 ARG 72 HH12 ARG 72 0.181 -13.317 6.804 527 HH21 ARG 72 HH21 ARG 72 0.134 -10.893 9.243 528 HH22 ARG 72 HH22 ARG 72 0.728 -12.449 8.778 529 H VAL 73 H VAL 73 1.161 -5.661 3.431 530 HA VAL 73 HA VAL 73 3.030 -4.661 5.496 531 HB VAL 73 HB VAL 73 3.939 -3.081 3.822 532 HG11 VAL 73 HG11 VAL 73 5.114 -5.162 4.260 533 HG12 VAL 73 HG12 VAL 73 5.270 -4.717 2.561 534 HG13 VAL 73 HG13 VAL 73 4.146 -5.989 3.040 535 HG21 VAL 73 HG21 VAL 73 2.019 -2.975 2.306 536 HG22 VAL 73 HG22 VAL 73 2.286 -4.654 1.836 537 HG23 VAL 73 HG23 VAL 73 3.485 -3.423 1.431 538 H LYS 74 H LYS 74 2.752 -2.538 6.228 539 HA LYS 74 HA LYS 74 0.196 -1.260 5.483 540 HB2 LYS 74 HB2 LYS 74 0.056 -1.900 7.786 541 HB3 LYS 74 HB3 LYS 74 1.658 -1.256 8.132 542 HG2 LYS 74 HG2 LYS 74 0.856 1.010 7.753 543 HG3 LYS 74 HG3 LYS 74 -0.740 0.396 7.330 544 HD2 LYS 74 HD2 LYS 74 0.530 -0.118 10.015 545 HD3 LYS 74 HD3 LYS 74 -0.437 1.319 9.686 546 HE2 LYS 74 HE2 LYS 74 -2.345 -0.096 9.100 547 HE3 LYS 74 HE3 LYS 74 -1.377 -1.538 9.413 548 HZ1 LYS 74 HZ1 LYS 74 -2.040 0.541 11.428 549 HZ2 LYS 74 HZ2 LYS 74 -1.170 -0.889 11.709 550 HZ3 LYS 74 HZ3 LYS 74 -2.804 -0.965 11.287 551 H VAL 75 H VAL 75 0.187 0.802 4.843 552 HA VAL 75 HA VAL 75 2.769 2.232 4.695 553 HB VAL 75 HB VAL 75 0.296 2.597 2.978 554 HG11 VAL 75 HG11 VAL 75 1.743 4.029 1.584 555 HG12 VAL 75 HG12 VAL 75 3.026 3.879 2.784 556 HG13 VAL 75 HG13 VAL 75 1.513 4.681 3.206 557 HG21 VAL 75 HG21 VAL 75 1.397 0.478 2.499 558 HG22 VAL 75 HG22 VAL 75 2.947 1.302 2.317 559 HG23 VAL 75 HG23 VAL 75 1.643 1.613 1.170 560 H LYS 76 H LYS 76 2.976 3.953 6.005 561 HA LYS 76 HA LYS 76 0.536 5.329 6.965 562 HB2 LYS 76 HB2 LYS 76 3.247 4.978 8.244 563 HB3 LYS 76 HB3 LYS 76 2.096 6.176 8.808 564 HG2 LYS 76 HG2 LYS 76 1.119 4.650 10.085 565 HG3 LYS 76 HG3 LYS 76 0.721 3.693 8.658 566 HD2 LYS 76 HD2 LYS 76 2.593 2.331 8.884 567 HD3 LYS 76 HD3 LYS 76 3.471 3.523 9.850 568 HE2 LYS 76 HE2 LYS 76 1.945 3.126 11.731 569 HE3 LYS 76 HE3 LYS 76 1.055 1.952 10.766 570 HZ1 LYS 76 HZ1 LYS 76 2.992 0.550 10.699 571 HZ2 LYS 76 HZ2 LYS 76 2.648 0.919 12.311 572 HZ3 LYS 76 HZ3 LYS 76 3.921 1.696 11.516 573 H THR 77 H THR 77 0.188 7.277 6.121 574 HA THR 77 HA THR 77 2.504 8.980 5.395 575 HB THR 77 HB THR 77 1.262 9.982 3.602 576 HG1 THR 77 HG1 THR 77 -0.909 9.371 3.175 577 HG21 THR 77 HG21 THR 77 2.326 7.866 3.002 578 HG22 THR 77 HG22 THR 77 0.820 8.067 2.108 579 HG23 THR 77 HG23 THR 77 0.883 6.981 3.495 580 H GLU 78 H GLU 78 1.553 11.390 5.120 581 HA GLU 78 HA GLU 78 0.662 12.224 7.694 582 HB2 GLU 78 HB2 GLU 78 0.588 14.491 6.686 583 HB3 GLU 78 HB3 GLU 78 2.108 13.656 6.400 584 HG2 GLU 78 HG2 GLU 78 1.288 13.053 4.128 585 HG3 GLU 78 HG3 GLU 78 -0.143 14.040 4.428 586 H PHE 79 H PHE 79 -1.053 11.028 5.031 587 HA PHE 79 HA PHE 79 -3.530 12.434 5.711 588 HB2 PHE 79 HB2 PHE 79 -2.852 10.503 3.482 589 HB3 PHE 79 HB3 PHE 79 -4.470 11.141 3.751 590 HD1 PHE 79 HD2 PHE 79 -4.986 13.476 3.293 591 HD2 PHE 79 HD1 PHE 79 -1.077 11.919 2.619 592 HE1 PHE 79 HE2 PHE 79 -4.422 15.470 1.969 593 HE2 PHE 79 HE1 PHE 79 -0.511 13.911 1.291 594 HZ PHE 79 HZ PHE 79 -2.182 15.693 0.967 595 H GLY 80 H GLY 80 -2.335 9.054 5.545 596 HA2 GLY 80 HA2 GLY 80 -3.852 8.287 7.845 597 HA3 GLY 80 HA3 GLY 80 -4.645 7.750 6.373 598 H GLU 81 H GLU 81 -4.355 5.562 7.036 599 HA GLU 81 HA GLU 81 -1.837 4.437 6.173 600 HB2 GLU 81 HB2 GLU 81 -1.468 3.103 8.216 601 HB3 GLU 81 HB3 GLU 81 -1.323 4.829 8.513 602 HG2 GLU 81 HG2 GLU 81 -3.574 4.859 9.474 603 HG3 GLU 81 HG3 GLU 81 -3.725 3.130 9.170 604 H VAL 82 H VAL 82 -2.009 2.336 5.425 605 HA VAL 82 HA VAL 82 -4.527 0.878 5.821 606 HB VAL 82 HB VAL 82 -4.867 2.322 3.833 607 HG11 VAL 82 HG11 VAL 82 -3.626 1.921 1.769 608 HG12 VAL 82 HG12 VAL 82 -2.600 0.749 2.597 609 HG13 VAL 82 HG13 VAL 82 -2.548 2.449 3.062 610 HG21 VAL 82 HG21 VAL 82 -5.639 0.567 2.290 611 HG22 VAL 82 HG22 VAL 82 -6.078 0.217 3.961 612 HG23 VAL 82 HG23 VAL 82 -4.727 -0.634 3.209 613 H VAL 83 H VAL 83 -4.386 -1.390 5.410 614 HA VAL 83 HA VAL 83 -1.638 -2.430 5.095 615 HB VAL 83 HB VAL 83 -4.032 -3.974 6.130 616 HG11 VAL 83 HG11 VAL 83 -2.291 -5.398 5.255 617 HG12 VAL 83 HG12 VAL 83 -2.287 -5.501 7.017 618 HG13 VAL 83 HG13 VAL 83 -1.063 -4.538 6.186 619 HG21 VAL 83 HG21 VAL 83 -3.595 -2.146 7.675 620 HG22 VAL 83 HG22 VAL 83 -1.884 -2.571 7.728 621 HG23 VAL 83 HG23 VAL 83 -3.087 -3.683 8.386 622 H VAL 84 H VAL 84 -1.135 -3.218 3.158 623 HA VAL 84 HA VAL 84 -3.183 -4.616 1.544 624 HB VAL 84 HB VAL 84 -2.165 -3.716 -0.510 625 HG11 VAL 84 HG11 VAL 84 -2.973 -1.402 -0.327 626 HG12 VAL 84 HG12 VAL 84 -3.020 -1.563 1.428 627 HG13 VAL 84 HG13 VAL 84 -4.082 -2.550 0.425 628 HG21 VAL 84 HG21 VAL 84 -0.471 -2.031 1.345 629 HG22 VAL 84 HG22 VAL 84 -0.543 -1.876 -0.409 630 HG23 VAL 84 HG23 VAL 84 0.108 -3.343 0.318 631 H PHE 85 H PHE 85 -1.967 -5.850 -0.363 632 HA PHE 85 HA PHE 85 0.001 -7.589 0.866 633 HB2 PHE 85 HB2 PHE 85 -1.312 -7.610 -1.861 634 HB3 PHE 85 HB3 PHE 85 -0.096 -8.785 -1.373 635 HD1 PHE 85 HD1 PHE 85 -0.575 -10.146 0.755 636 HD2 PHE 85 HD2 PHE 85 -3.568 -8.005 -1.393 637 HE1 PHE 85 HE1 PHE 85 -2.312 -11.555 1.776 638 HE2 PHE 85 HE2 PHE 85 -5.309 -9.411 -0.374 639 HZ PHE 85 HZ PHE 85 -4.683 -11.189 1.213 640 H ALA 86 H ALA 86 2.142 -7.853 0.278 641 HA ALA 86 HA ALA 86 3.377 -5.562 -1.049 642 HB1 ALA 86 HB1 ALA 86 4.235 -6.330 1.125 643 HB2 ALA 86 HB2 ALA 86 5.467 -6.403 -0.135 644 HB3 ALA 86 HB3 ALA 86 4.662 -7.880 0.399 645 H LYS 87 H LYS 87 3.900 -5.619 -3.155 646 HA LYS 87 HA LYS 87 4.923 -8.135 -4.300 647 HB2 LYS 87 HB2 LYS 87 3.086 -6.194 -5.731 648 HB3 LYS 87 HB3 LYS 87 3.840 -7.602 -6.459 649 HG2 LYS 87 HG2 LYS 87 2.572 -8.989 -4.758 650 HG3 LYS 87 HG3 LYS 87 1.670 -7.515 -4.380 651 HD2 LYS 87 HD2 LYS 87 1.097 -7.351 -6.824 652 HD3 LYS 87 HD3 LYS 87 1.821 -8.948 -7.039 653 HE2 LYS 87 HE2 LYS 87 0.217 -9.772 -5.277 654 HE3 LYS 87 HE3 LYS 87 -0.581 -8.213 -5.382 655 HZ1 LYS 87 HZ1 LYS 87 -0.255 -10.141 -7.615 656 HZ2 LYS 87 HZ2 LYS 87 -1.011 -8.634 -7.726 657 HZ3 LYS 87 HZ3 LYS 87 -1.686 -9.844 -6.762 658 H LYS 88 H LYS 88 6.342 -7.844 -6.141 659 HA LYS 88 HA LYS 88 7.990 -5.464 -5.761 660 HB2 LYS 88 HB2 LYS 88 8.808 -7.938 -5.687 661 HB3 LYS 88 HB3 LYS 88 8.754 -7.837 -7.444 662 HG2 LYS 88 HG2 LYS 88 10.266 -5.918 -7.367 663 HG3 LYS 88 HG3 LYS 88 10.325 -6.054 -5.609 664 HD2 LYS 88 HD2 LYS 88 11.240 -8.164 -7.574 665 HD3 LYS 88 HD3 LYS 88 12.294 -7.079 -6.668 666 HE2 LYS 88 HE2 LYS 88 11.479 -8.050 -4.565 667 HE3 LYS 88 HE3 LYS 88 10.434 -9.140 -5.473 668 HZ1 LYS 88 HZ1 LYS 88 13.401 -9.075 -5.557 669 HZ2 LYS 88 HZ2 LYS 88 12.429 -10.081 -6.508 670 HZ3 LYS 88 HZ3 LYS 88 12.441 -10.267 -4.828 671 H GLY 89 H GLY 89 8.520 -4.043 -7.420 672 HA2 GLY 89 HA2 GLY 89 7.281 -4.498 -10.062 673 HA3 GLY 89 HA3 GLY 89 6.852 -3.053 -9.164 674 H ASP 90 H ASP 90 7.692 -2.241 -11.361 675 HA ASP 90 HA ASP 90 10.617 -2.104 -11.515 676 HB2 ASP 90 HB2 ASP 90 8.496 -1.149 -13.460 677 HB3 ASP 90 HB3 ASP 90 10.231 -1.121 -13.751 678 H VAL 91 H VAL 91 9.246 -0.652 -9.412 679 HA VAL 91 HA VAL 91 9.350 2.158 -10.199 680 HB VAL 91 HB VAL 91 8.549 2.623 -7.908 681 HG11 VAL 91 HG11 VAL 91 6.973 0.499 -9.370 682 HG12 VAL 91 HG12 VAL 91 6.918 2.236 -9.666 683 HG13 VAL 91 HG13 VAL 91 6.327 1.583 -8.140 684 HG21 VAL 91 HG21 VAL 91 8.588 -0.384 -7.549 685 HG22 VAL 91 HG22 VAL 91 7.910 0.786 -6.416 686 HG23 VAL 91 HG23 VAL 91 9.644 0.769 -6.733 687 HA PRO 92 HA PRO 92 13.448 2.955 -8.644 688 HB2 PRO 92 HB2 PRO 92 12.504 5.563 -7.630 689 HB3 PRO 92 HB3 PRO 92 13.688 5.210 -8.892 690 HG2 PRO 92 HG2 PRO 92 11.267 6.207 -9.483 691 HG3 PRO 92 HG3 PRO 92 12.075 5.039 -10.545 692 HD2 PRO 92 HD2 PRO 92 9.879 4.577 -8.546 693 HD3 PRO 92 HD3 PRO 92 10.055 3.935 -10.194 694 H LYS 93 H LYS 93 14.694 3.462 -6.690 695 HA LYS 93 HA LYS 93 13.642 2.203 -4.376 696 HB2 LYS 93 HB2 LYS 93 16.051 2.190 -4.996 697 HB3 LYS 93 HB3 LYS 93 16.137 3.908 -4.627 698 HG2 LYS 93 HG2 LYS 93 15.664 3.479 -2.296 699 HG3 LYS 93 HG3 LYS 93 15.413 1.764 -2.630 700 HD2 LYS 93 HD2 LYS 93 17.795 1.639 -3.399 701 HD3 LYS 93 HD3 LYS 93 18.001 3.311 -2.872 702 HE2 LYS 93 HE2 LYS 93 17.512 2.704 -0.587 703 HE3 LYS 93 HE3 LYS 93 17.112 1.055 -1.071 704 HZ1 LYS 93 HZ1 LYS 93 19.329 1.230 -0.109 705 HZ2 LYS 93 HZ2 LYS 93 19.789 2.309 -1.323 706 HZ3 LYS 93 HZ3 LYS 93 19.398 0.711 -1.718 707 H GLY 94 H GLY 94 13.033 3.051 -2.352 708 HA2 GLY 94 HA2 GLY 94 12.115 4.595 -0.904 709 HA3 GLY 94 HA3 GLY 94 13.011 5.841 -1.756 710 H MET 95 H MET 95 10.864 3.860 -3.600 711 HA MET 95 HA MET 95 8.628 5.714 -3.402 712 HB2 MET 95 HB2 MET 95 10.350 6.527 -5.136 713 HB3 MET 95 HB3 MET 95 9.888 5.125 -6.088 714 HG2 MET 95 HG2 MET 95 7.635 5.919 -6.259 715 HG3 MET 95 HG3 MET 95 7.987 7.260 -5.169 716 HE1 MET 95 HE1 MET 95 7.652 9.375 -8.370 717 HE2 MET 95 HE2 MET 95 7.340 9.284 -6.638 718 HE3 MET 95 HE3 MET 95 6.603 8.113 -7.728 719 H ILE 96 H ILE 96 6.667 4.674 -3.833 720 HA ILE 96 HA ILE 96 6.813 1.935 -4.927 721 HB ILE 96 HB ILE 96 5.189 1.130 -3.256 722 HG12 ILE 96 HG12 ILE 96 5.668 3.783 -1.863 723 HG13 ILE 96 HG13 ILE 96 4.176 3.319 -2.672 724 HG21 ILE 96 HG21 ILE 96 7.547 0.701 -2.894 725 HG22 ILE 96 HG22 ILE 96 6.745 0.986 -1.349 726 HG23 ILE 96 HG23 ILE 96 7.733 2.253 -2.077 727 HD11 ILE 96 HD11 ILE 96 5.372 2.030 -0.227 728 HD12 ILE 96 HD12 ILE 96 3.921 1.470 -1.058 729 HD13 ILE 96 HD13 ILE 96 3.942 3.059 -0.292 730 H PHE 97 H PHE 97 5.041 1.194 -6.037 731 HA PHE 97 HA PHE 97 3.103 3.257 -6.855 732 HB2 PHE 97 HB2 PHE 97 4.418 2.302 -8.671 733 HB3 PHE 97 HB3 PHE 97 3.954 0.673 -8.197 734 HD1 PHE 97 HD1 PHE 97 1.716 -0.175 -8.673 735 HD2 PHE 97 HD2 PHE 97 2.894 3.745 -9.869 736 HE1 PHE 97 HE1 PHE 97 -0.225 -0.056 -10.176 737 HE2 PHE 97 HE2 PHE 97 0.954 3.861 -11.381 738 HZ PHE 97 HZ PHE 97 -0.607 1.962 -11.534 739 H ILE 98 H ILE 98 1.009 3.075 -6.261 740 HA ILE 98 HA ILE 98 -0.038 0.386 -5.637 741 HB ILE 98 HB ILE 98 -0.802 2.976 -4.258 742 HG12 ILE 98 HG12 ILE 98 0.727 0.536 -3.309 743 HG13 ILE 98 HG13 ILE 98 1.335 2.182 -3.447 744 HG21 ILE 98 HG21 ILE 98 -1.842 0.172 -3.808 745 HG22 ILE 98 HG22 ILE 98 -2.736 1.502 -4.543 746 HG23 ILE 98 HG23 ILE 98 -2.258 1.593 -2.848 747 HD11 ILE 98 HD11 ILE 98 -0.159 2.881 -1.649 748 HD12 ILE 98 HD12 ILE 98 0.914 1.578 -1.138 749 HD13 ILE 98 HD13 ILE 98 -0.772 1.232 -1.519 750 HA PRO 99 HA PRO 99 -2.976 1.208 -8.950 751 HB2 PRO 99 HB2 PRO 99 -4.618 -0.670 -7.299 752 HB3 PRO 99 HB3 PRO 99 -4.271 -0.712 -9.031 753 HG2 PRO 99 HG2 PRO 99 -3.037 -2.388 -7.389 754 HG3 PRO 99 HG3 PRO 99 -2.142 -1.611 -8.713 755 HD2 PRO 99 HD2 PRO 99 -2.136 -0.964 -5.784 756 HD3 PRO 99 HD3 PRO 99 -0.788 -0.964 -6.942 757 H MET 100 H MET 100 -4.295 2.933 -9.050 758 HA MET 100 HA MET 100 -5.152 4.460 -6.906 759 HB2 MET 100 HB2 MET 100 -5.047 4.973 -9.467 760 HB3 MET 100 HB3 MET 100 -6.704 4.394 -9.487 761 HG2 MET 100 HG2 MET 100 -5.636 6.739 -7.919 762 HG3 MET 100 HG3 MET 100 -6.639 6.807 -9.364 763 HE1 MET 100 HE1 MET 100 -6.563 5.478 -5.616 764 HE2 MET 100 HE2 MET 100 -7.989 6.348 -5.051 765 HE3 MET 100 HE3 MET 100 -6.612 7.240 -5.701 766 H GLY 101 H GLY 101 -6.307 3.534 -5.274 767 HA2 GLY 101 HA2 GLY 101 -9.029 2.628 -5.864 768 HA3 GLY 101 HA3 GLY 101 -7.952 1.419 -5.180 769 HA PRO 102 HA PRO 102 -10.202 3.882 -1.836 770 HB2 PRO 102 HB2 PRO 102 -11.035 1.688 -0.395 771 HB3 PRO 102 HB3 PRO 102 -11.990 2.462 -1.662 772 HG2 PRO 102 HG2 PRO 102 -10.311 -0.006 -1.796 773 HG3 PRO 102 HG3 PRO 102 -11.882 0.326 -2.547 774 HD2 PRO 102 HD2 PRO 102 -9.541 0.410 -3.920 775 HD3 PRO 102 HD3 PRO 102 -10.932 1.441 -4.332 776 H TYR 103 H TYR 103 -7.952 1.226 -1.795 777 HA TYR 103 HA TYR 103 -7.026 1.474 0.883 778 HB2 TYR 103 HB2 TYR 103 -5.617 0.349 -1.561 779 HB3 TYR 103 HB3 TYR 103 -5.113 0.110 0.111 780 HD1 TYR 103 HD2 TYR 103 -8.178 -0.322 -1.999 781 HD2 TYR 103 HD1 TYR 103 -5.734 -1.898 1.116 782 HE1 TYR 103 HE2 TYR 103 -9.633 -2.290 -1.859 783 HE2 TYR 103 HE1 TYR 103 -7.185 -3.874 1.255 784 HH TYR 103 HH TYR 103 -9.006 -4.870 0.497 785 H ALA 104 H ALA 104 -5.563 2.492 -2.215 786 HA ALA 104 HA ALA 104 -3.542 4.102 -1.122 787 HB1 ALA 104 HB1 ALA 104 -4.939 4.429 -3.788 788 HB2 ALA 104 HB2 ALA 104 -3.576 3.354 -3.471 789 HB3 ALA 104 HB3 ALA 104 -3.368 5.101 -3.343 790 H ASN 105 H ASN 105 -6.921 4.724 -1.797 791 HA ASN 105 HA ASN 105 -6.943 7.529 -1.702 792 HB2 ASN 105 HB2 ASN 105 -8.816 6.333 -2.602 793 HB3 ASN 105 HB3 ASN 105 -9.059 5.452 -1.101 794 HD21 ASN 105 HD21 ASN 105 -10.133 6.410 0.555 795 HD22 ASN 105 HD22 ASN 105 -10.988 7.905 0.395 796 H MET 106 H MET 106 -6.566 5.213 0.822 797 HA MET 106 HA MET 106 -7.407 6.902 2.993 798 HB2 MET 106 HB2 MET 106 -5.528 4.551 3.219 799 HB3 MET 106 HB3 MET 106 -6.627 5.182 4.437 800 HG2 MET 106 HG2 MET 106 -8.526 4.455 3.006 801 HG3 MET 106 HG3 MET 106 -7.359 3.718 1.918 802 HE1 MET 106 HE1 MET 106 -8.037 2.317 6.267 803 HE2 MET 106 HE2 MET 106 -8.945 3.623 5.505 804 HE3 MET 106 HE3 MET 106 -7.236 3.841 5.883 805 H VAL 107 H VAL 107 -4.470 6.501 1.173 806 HA VAL 107 HA VAL 107 -2.945 7.974 3.236 807 HB VAL 107 HB VAL 107 -0.910 6.878 2.386 808 HG11 VAL 107 HG11 VAL 107 -2.042 5.914 4.298 809 HG12 VAL 107 HG12 VAL 107 -1.352 4.636 3.298 810 HG13 VAL 107 HG13 VAL 107 -3.085 4.967 3.237 811 HG21 VAL 107 HG21 VAL 107 -1.597 6.430 0.091 812 HG22 VAL 107 HG22 VAL 107 -2.804 5.276 0.654 813 HG23 VAL 107 HG23 VAL 107 -1.088 4.937 0.878 814 H ILE 108 H ILE 108 -4.009 8.071 -0.030 815 HA ILE 108 HA ILE 108 -1.864 9.878 -0.854 816 HB ILE 108 HB ILE 108 -2.596 9.673 -3.087 817 HG12 ILE 108 HG12 ILE 108 -4.995 8.061 -2.203 818 HG13 ILE 108 HG13 ILE 108 -5.072 9.796 -2.500 819 HG21 ILE 108 HG21 ILE 108 -2.592 7.204 -3.450 820 HG22 ILE 108 HG22 ILE 108 -2.754 6.991 -1.707 821 HG23 ILE 108 HG23 ILE 108 -1.314 7.769 -2.368 822 HD11 ILE 108 HD11 ILE 108 -4.228 9.385 -4.779 823 HD12 ILE 108 HD12 ILE 108 -5.802 8.649 -4.452 824 HD13 ILE 108 HD13 ILE 108 -4.343 7.654 -4.464 825 H ASP 109 H ASP 109 -2.878 11.574 -2.569 826 HA ASP 109 HA ASP 109 -4.860 13.174 -1.086 827 HB2 ASP 109 HB2 ASP 109 -2.683 14.230 -1.012 828 HB3 ASP 109 HB3 ASP 109 -2.488 14.053 -2.754 829 HA PRO 110 HA PRO 110 -7.073 12.541 -4.971 830 HB2 PRO 110 HB2 PRO 110 -9.521 13.181 -4.093 831 HB3 PRO 110 HB3 PRO 110 -8.720 11.690 -3.580 832 HG2 PRO 110 HG2 PRO 110 -9.024 14.281 -2.110 833 HG3 PRO 110 HG3 PRO 110 -9.158 12.624 -1.496 834 HD2 PRO 110 HD2 PRO 110 -6.902 14.228 -1.260 835 HD3 PRO 110 HD3 PRO 110 -6.904 12.456 -1.147 836 H SER 111 H SER 111 -5.862 15.297 -3.970 837 HA SER 111 HA SER 111 -7.699 17.144 -5.314 838 HB2 SER 111 HB2 SER 111 -6.611 17.772 -3.148 839 HB3 SER 111 HB3 SER 111 -5.051 17.760 -3.971 840 HG SER 111 HG SER 111 -5.953 19.382 -5.400 841 H THR 112 H THR 112 -5.811 15.026 -6.604 842 HA THR 112 HA THR 112 -4.188 16.730 -8.348 843 HB THR 112 HB THR 112 -3.198 14.659 -9.180 844 HG1 THR 112 HG1 THR 112 -3.917 12.644 -8.214 845 HG21 THR 112 HG21 THR 112 -3.440 14.587 -6.165 846 HG22 THR 112 HG22 THR 112 -2.312 15.595 -7.075 847 HG23 THR 112 HG23 THR 112 -2.165 13.837 -7.125 848 H ASP 113 H ASP 113 -4.092 15.459 -10.707 849 HA ASP 113 HA ASP 113 -5.082 14.963 -12.683 850 HB2 ASP 113 HB2 ASP 113 -6.391 13.259 -11.627 851 HB3 ASP 113 HB3 ASP 113 -7.493 14.444 -10.932 852 H GLY 114 H GLY 114 -6.250 16.013 -14.381 853 HA2 GLY 114 HA2 GLY 114 -8.175 17.920 -14.295 854 HA3 GLY 114 HA3 GLY 114 -6.746 18.821 -13.818 855 H THR 115 H THR 115 -4.889 18.756 -15.382 856 HA THR 115 HA THR 115 -5.941 19.510 -17.955 857 HB THR 115 HB THR 115 -3.655 20.240 -18.490 858 HG1 THR 115 HG1 THR 115 -1.961 19.809 -17.168 859 HG21 THR 115 HG21 THR 115 -5.087 21.766 -17.234 860 HG22 THR 115 HG22 THR 115 -3.411 21.935 -16.711 861 HG23 THR 115 HG23 THR 115 -4.560 21.041 -15.716 862 H GLY 116 H GLY 116 -3.180 17.359 -17.154 863 HA2 GLY 116 HA2 GLY 116 -3.890 15.100 -18.523 864 HA3 GLY 116 HA3 GLY 116 -3.248 16.157 -19.771 865 H MET 117 H MET 117 -1.766 14.208 -19.895 866 HA MET 117 HA MET 117 0.341 13.378 -19.754 867 HB2 MET 117 HB2 MET 117 0.786 15.882 -18.132 868 HB3 MET 117 HB3 MET 117 2.059 14.693 -18.352 869 HG2 MET 117 HG2 MET 117 2.305 16.520 -19.921 870 HG3 MET 117 HG3 MET 117 1.965 15.016 -20.768 871 HE1 MET 117 HE1 MET 117 -0.709 14.421 -21.497 872 HE2 MET 117 HE2 MET 117 0.424 14.987 -22.726 873 HE3 MET 117 HE3 MET 117 -1.211 15.640 -22.673 874 HA PRO 118 HA PRO 118 0.120 10.561 -16.399 875 HB2 PRO 118 HB2 PRO 118 2.792 9.896 -16.069 876 HB3 PRO 118 HB3 PRO 118 1.725 9.212 -17.298 877 HG2 PRO 118 HG2 PRO 118 3.705 11.446 -17.543 878 HG3 PRO 118 HG3 PRO 118 3.366 10.118 -18.670 879 HD2 PRO 118 HD2 PRO 118 2.407 12.580 -19.110 880 HD3 PRO 118 HD3 PRO 118 1.435 11.139 -19.488 881 H GLN 119 H GLN 119 2.792 12.879 -16.057 882 HA GLN 119 HA GLN 119 3.593 14.095 -14.332 883 HB2 GLN 119 HB2 GLN 119 0.799 13.641 -13.288 884 HB3 GLN 119 HB3 GLN 119 1.972 14.648 -12.451 885 HG2 GLN 119 HG2 GLN 119 1.049 15.117 -15.282 886 HG3 GLN 119 HG3 GLN 119 0.351 15.896 -13.864 887 HE21 GLN 119 HE21 GLN 119 0.913 17.936 -14.540 888 HE22 GLN 119 HE22 GLN 119 2.541 18.509 -14.523 889 H PHE 120 H PHE 120 5.250 13.100 -13.349 890 HA PHE 120 HA PHE 120 4.905 10.782 -11.672 891 HB2 PHE 120 HB2 PHE 120 7.321 12.557 -12.136 892 HB3 PHE 120 HB3 PHE 120 7.344 11.060 -11.208 893 HD1 PHE 120 HD2 PHE 120 7.028 12.513 -14.571 894 HD2 PHE 120 HD1 PHE 120 7.266 8.916 -12.297 895 HE1 PHE 120 HE2 PHE 120 7.437 11.238 -16.631 896 HE2 PHE 120 HE1 PHE 120 7.676 7.641 -14.358 897 HZ PHE 120 HZ PHE 120 7.762 8.799 -16.527 898 H LYS 121 H LYS 121 3.253 11.929 -10.343 899 HA LYS 121 HA LYS 121 4.517 13.389 -8.108 900 HB2 LYS 121 HB2 LYS 121 2.701 14.482 -9.910 901 HB3 LYS 121 HB3 LYS 121 1.690 14.044 -8.542 902 HG2 LYS 121 HG2 LYS 121 4.121 15.830 -8.470 903 HG3 LYS 121 HG3 LYS 121 2.438 16.343 -8.358 904 HD2 LYS 121 HD2 LYS 121 2.197 15.129 -6.248 905 HD3 LYS 121 HD3 LYS 121 3.864 14.561 -6.372 906 HE2 LYS 121 HE2 LYS 121 4.635 16.911 -6.307 907 HE3 LYS 121 HE3 LYS 121 2.964 17.433 -6.101 908 HZ1 LYS 121 HZ1 LYS 121 2.871 16.196 -4.032 909 HZ2 LYS 121 HZ2 LYS 121 4.122 17.329 -3.997 910 HZ3 LYS 121 HZ3 LYS 121 4.474 15.690 -4.228 911 H GLY 122 H GLY 122 4.594 11.760 -6.630 912 HA2 GLY 122 HA2 GLY 122 2.069 10.348 -6.001 913 HA3 GLY 122 HA3 GLY 122 3.679 9.729 -5.655 914 H VAL 123 H VAL 123 1.545 9.976 -3.766 915 HA VAL 123 HA VAL 123 2.242 12.242 -2.065 916 HB VAL 123 HB VAL 123 0.336 9.945 -1.585 917 HG11 VAL 123 HG11 VAL 123 -0.524 11.286 0.282 918 HG12 VAL 123 HG12 VAL 123 0.740 12.485 0.002 919 HG13 VAL 123 HG13 VAL 123 1.171 10.853 0.521 920 HG21 VAL 123 HG21 VAL 123 -1.417 11.606 -2.042 921 HG22 VAL 123 HG22 VAL 123 -0.354 11.388 -3.431 922 HG23 VAL 123 HG23 VAL 123 -0.180 12.811 -2.403 923 H LYS 124 H LYS 124 3.816 12.186 -0.588 924 HA LYS 124 HA LYS 124 5.415 9.866 -0.240 925 HB2 LYS 124 HB2 LYS 124 5.451 12.523 1.183 926 HB3 LYS 124 HB3 LYS 124 6.633 11.250 1.466 927 HG2 LYS 124 HG2 LYS 124 7.150 11.353 -1.009 928 HG3 LYS 124 HG3 LYS 124 6.168 12.819 -1.056 929 HD2 LYS 124 HD2 LYS 124 8.499 13.418 -0.803 930 HD3 LYS 124 HD3 LYS 124 7.622 13.815 0.673 931 HE2 LYS 124 HE2 LYS 124 8.459 11.786 1.737 932 HE3 LYS 124 HE3 LYS 124 9.293 11.333 0.251 933 HZ1 LYS 124 HZ1 LYS 124 9.858 13.735 1.901 934 HZ2 LYS 124 HZ2 LYS 124 10.637 13.341 0.456 935 HZ3 LYS 124 HZ3 LYS 124 10.813 12.341 1.811 936 H GLY 125 H GLY 125 6.065 8.955 1.803 937 HA2 GLY 125 HA2 GLY 125 4.740 9.190 4.239 938 HA3 GLY 125 HA3 GLY 125 3.900 7.949 3.321 939 H THR 126 H THR 126 4.506 6.337 4.806 940 HA THR 126 HA THR 126 7.280 5.390 4.520 941 HB THR 126 HB THR 126 7.279 4.640 6.897 942 HG1 THR 126 HG1 THR 126 4.906 6.225 7.059 943 HG21 THR 126 HG21 THR 126 7.685 6.838 7.918 944 HG22 THR 126 HG22 THR 126 6.903 7.622 6.547 945 HG23 THR 126 HG23 THR 126 8.409 6.735 6.313 946 H VAL 127 H VAL 127 7.541 3.113 4.726 947 HA VAL 127 HA VAL 127 5.051 1.534 4.762 948 HB VAL 127 HB VAL 127 5.770 1.830 2.416 949 HG11 VAL 127 HG11 VAL 127 7.834 0.765 1.609 950 HG12 VAL 127 HG12 VAL 127 8.285 0.394 3.273 951 HG13 VAL 127 HG13 VAL 127 8.169 2.073 2.747 952 HG21 VAL 127 HG21 VAL 127 4.568 -0.199 3.070 953 HG22 VAL 127 HG22 VAL 127 6.096 -0.999 3.437 954 HG23 VAL 127 HG23 VAL 127 5.719 -0.535 1.777 955 H GLU 128 H GLU 128 5.175 -0.474 5.678 956 HA GLU 128 HA GLU 128 7.696 -1.687 6.427 957 HB2 GLU 128 HB2 GLU 128 7.138 -1.767 8.852 958 HB3 GLU 128 HB3 GLU 128 7.429 -0.128 8.283 959 HG2 GLU 128 HG2 GLU 128 5.049 0.315 8.208 960 HG3 GLU 128 HG3 GLU 128 4.698 -1.354 8.651 961 H LYS 129 H LYS 129 7.432 -3.911 7.084 962 HA LYS 129 HA LYS 129 4.957 -5.131 6.245 963 HB2 LYS 129 HB2 LYS 129 6.949 -6.353 5.732 964 HB3 LYS 129 HB3 LYS 129 7.483 -6.313 7.408 965 HG2 LYS 129 HG2 LYS 129 5.881 -7.888 8.084 966 HG3 LYS 129 HG3 LYS 129 4.911 -7.658 6.631 967 HD2 LYS 129 HD2 LYS 129 6.126 -9.809 6.650 968 HD3 LYS 129 HD3 LYS 129 6.568 -8.785 5.287 969 HE2 LYS 129 HE2 LYS 129 8.630 -8.157 6.362 970 HE3 LYS 129 HE3 LYS 129 8.168 -9.016 7.836 971 HZ1 LYS 129 HZ1 LYS 129 8.475 -10.356 5.211 972 HZ2 LYS 129 HZ2 LYS 129 8.337 -11.084 6.732 973 HZ3 LYS 129 HZ3 LYS 129 9.737 -10.224 6.331 974 H THR 130 H THR 130 3.395 -6.096 7.478 975 HA THR 130 HA THR 130 3.628 -5.892 10.410 976 HB THR 130 HB THR 130 2.413 -3.887 9.751 977 HG1 THR 130 HG1 THR 130 0.658 -4.215 11.085 978 HG21 THR 130 HG21 THR 130 1.582 -4.664 7.563 979 HG22 THR 130 HG22 THR 130 0.286 -3.992 8.553 980 HG23 THR 130 HG23 THR 130 0.447 -5.739 8.382 981 H ASP 131 H ASP 131 2.339 -7.336 11.599 982 HA ASP 131 HA ASP 131 1.598 -9.744 10.185 983 HB2 ASP 131 HB2 ASP 131 1.091 -10.640 12.429 984 HB3 ASP 131 HB3 ASP 131 2.700 -9.927 12.352 985 H GLU 132 H GLU 132 0.049 -6.869 10.705 986 HA GLU 132 HA GLU 132 -2.601 -7.647 11.334 987 HB2 GLU 132 HB2 GLU 132 -1.580 -5.277 9.749 988 HB3 GLU 132 HB3 GLU 132 -3.238 -5.459 10.310 989 HG2 GLU 132 HG2 GLU 132 -2.506 -5.407 12.610 990 HG3 GLU 132 HG3 GLU 132 -0.820 -5.343 12.100 991 H LYS 133 H LYS 133 -4.455 -7.788 9.945 992 HA LYS 133 HA LYS 133 -3.955 -9.240 7.509 993 HB2 LYS 133 HB2 LYS 133 -6.358 -9.554 7.408 994 HB3 LYS 133 HB3 LYS 133 -5.808 -9.832 9.056 995 HG2 LYS 133 HG2 LYS 133 -6.656 -7.723 9.785 996 HG3 LYS 133 HG3 LYS 133 -6.969 -7.210 8.128 997 HD2 LYS 133 HD2 LYS 133 -8.636 -9.078 7.951 998 HD3 LYS 133 HD3 LYS 133 -8.399 -9.375 9.677 999 HE2 LYS 133 HE2 LYS 133 -9.174 -7.139 10.202 1000 HE3 LYS 133 HE3 LYS 133 -9.299 -6.746 8.488 1001 HZ1 LYS 133 HZ1 LYS 133 -11.456 -7.249 9.278 1002 HZ2 LYS 133 HZ2 LYS 133 -10.945 -8.687 10.012 1003 HZ3 LYS 133 HZ3 LYS 133 -10.973 -8.561 8.325 1004 H VAL 134 H VAL 134 -4.584 -8.666 5.402 1005 HA VAL 134 HA VAL 134 -4.542 -5.895 4.704 1006 HB VAL 134 HB VAL 134 -5.264 -8.333 3.049 1007 HG11 VAL 134 HG11 VAL 134 -4.732 -5.498 2.128 1008 HG12 VAL 134 HG12 VAL 134 -6.291 -6.322 2.094 1009 HG13 VAL 134 HG13 VAL 134 -4.969 -6.896 1.079 1010 HG21 VAL 134 HG21 VAL 134 -3.016 -8.046 2.095 1011 HG22 VAL 134 HG22 VAL 134 -2.954 -8.330 3.837 1012 HG23 VAL 134 HG23 VAL 134 -2.725 -6.700 3.198 1013 H LEU 135 H LEU 135 -6.209 -4.488 4.508 1014 HA LEU 135 HA LEU 135 -8.756 -5.170 5.551 1015 HB2 LEU 135 HB2 LEU 135 -7.555 -2.751 4.314 1016 HB3 LEU 135 HB3 LEU 135 -9.306 -2.844 4.298 1017 HG LEU 135 HG LEU 135 -7.549 -2.942 6.757 1018 HD11 LEU 135 HD11 LEU 135 -8.583 -0.787 7.287 1019 HD12 LEU 135 HD12 LEU 135 -9.459 -0.827 5.755 1020 HD13 LEU 135 HD13 LEU 135 -7.698 -0.715 5.760 1021 HD21 LEU 135 HD21 LEU 135 -10.561 -3.054 6.482 1022 HD22 LEU 135 HD22 LEU 135 -9.680 -2.868 8.001 1023 HD23 LEU 135 HD23 LEU 135 -9.508 -4.348 7.060 1024 H SER 136 H SER 136 -10.567 -5.948 4.624 1025 HA SER 136 HA SER 136 -10.713 -6.481 1.811 1026 HB2 SER 136 HB2 SER 136 -11.926 -7.910 3.391 1027 HB3 SER 136 HB3 SER 136 -12.896 -6.537 3.920 1028 HG SER 136 HG SER 136 -14.164 -7.417 2.428 1029 H VAL 137 H VAL 137 -11.919 -5.412 0.229 1030 HA VAL 137 HA VAL 137 -11.743 -2.688 0.137 1031 HB VAL 137 HB VAL 137 -13.811 -4.340 -1.334 1032 HG11 VAL 137 HG11 VAL 137 -13.704 -2.561 -3.029 1033 HG12 VAL 137 HG12 VAL 137 -12.621 -1.639 -1.985 1034 HG13 VAL 137 HG13 VAL 137 -14.281 -1.954 -1.478 1035 HG21 VAL 137 HG21 VAL 137 -10.981 -3.618 -2.115 1036 HG22 VAL 137 HG22 VAL 137 -12.145 -4.475 -3.129 1037 HG23 VAL 137 HG23 VAL 137 -11.550 -5.220 -1.644 1038 H LYS 138 H LYS 138 -14.684 -4.513 1.040 1039 HA LYS 138 HA LYS 138 -16.263 -2.158 1.383 1040 HB2 LYS 138 HB2 LYS 138 -17.225 -4.376 0.828 1041 HB3 LYS 138 HB3 LYS 138 -16.790 -4.948 2.434 1042 HG2 LYS 138 HG2 LYS 138 -18.284 -3.299 3.442 1043 HG3 LYS 138 HG3 LYS 138 -18.699 -2.684 1.841 1044 HD2 LYS 138 HD2 LYS 138 -20.443 -4.170 2.622 1045 HD3 LYS 138 HD3 LYS 138 -19.609 -4.904 1.252 1046 HE2 LYS 138 HE2 LYS 138 -18.268 -6.253 2.831 1047 HE3 LYS 138 HE3 LYS 138 -19.170 -5.547 4.171 1048 HZ1 LYS 138 HZ1 LYS 138 -20.123 -7.648 3.659 1049 HZ2 LYS 138 HZ2 LYS 138 -20.228 -7.285 2.015 1050 HZ3 LYS 138 HZ3 LYS 138 -21.211 -6.470 3.123 1051 H GLU 139 H GLU 139 -14.482 -4.256 3.665 1052 HA GLU 139 HA GLU 139 -15.438 -3.008 6.024 1053 HB2 GLU 139 HB2 GLU 139 -14.357 -5.201 6.097 1054 HB3 GLU 139 HB3 GLU 139 -12.838 -4.495 5.561 1055 HG2 GLU 139 HG2 GLU 139 -12.503 -3.379 7.601 1056 HG3 GLU 139 HG3 GLU 139 -14.182 -3.596 8.094 1057 H LEU 140 H LEU 140 -12.751 -2.318 3.874 1058 HA LEU 140 HA LEU 140 -11.482 -0.267 5.235 1059 HB2 LEU 140 HB2 LEU 140 -11.025 -1.429 2.942 1060 HB3 LEU 140 HB3 LEU 140 -12.006 -0.133 2.284 1061 HG LEU 140 HG LEU 140 -9.615 0.425 4.015 1062 HD11 LEU 140 HD11 LEU 140 -9.647 0.103 1.020 1063 HD12 LEU 140 HD12 LEU 140 -8.860 -0.971 2.179 1064 HD13 LEU 140 HD13 LEU 140 -8.289 0.687 1.986 1065 HD21 LEU 140 HD21 LEU 140 -11.028 2.064 1.908 1066 HD22 LEU 140 HD22 LEU 140 -9.630 2.572 2.858 1067 HD23 LEU 140 HD23 LEU 140 -11.172 2.274 3.655 1068 H LEU 141 H LEU 141 -14.411 -0.193 3.219 1069 HA LEU 141 HA LEU 141 -14.917 2.572 3.288 1070 HB2 LEU 141 HB2 LEU 141 -17.041 0.421 3.323 1071 HB3 LEU 141 HB3 LEU 141 -17.179 2.044 2.674 1072 HG LEU 141 HG LEU 141 -15.481 -0.180 1.523 1073 HD11 LEU 141 HD11 LEU 141 -17.848 -0.587 1.195 1074 HD12 LEU 141 HD12 LEU 141 -17.085 -0.139 -0.333 1075 HD13 LEU 141 HD13 LEU 141 -18.062 1.041 0.545 1076 HD21 LEU 141 HD21 LEU 141 -14.466 2.003 1.141 1077 HD22 LEU 141 HD22 LEU 141 -15.983 2.608 0.477 1078 HD23 LEU 141 HD23 LEU 141 -15.102 1.327 -0.357 1079 H GLU 142 H GLU 142 -16.044 -0.035 5.426 1080 HA GLU 142 HA GLU 142 -17.513 1.525 7.238 1081 HB2 GLU 142 HB2 GLU 142 -15.980 -1.023 7.828 1082 HB3 GLU 142 HB3 GLU 142 -17.319 -0.373 8.765 1083 HG2 GLU 142 HG2 GLU 142 -18.814 -0.705 6.848 1084 HG3 GLU 142 HG3 GLU 142 -17.470 -1.379 5.926 1085 H ALA 143 H ALA 143 -14.095 0.594 7.229 1086 HA ALA 143 HA ALA 143 -13.361 1.545 9.749 1087 HB1 ALA 143 HB1 ALA 143 -11.631 1.430 7.275 1088 HB2 ALA 143 HB2 ALA 143 -11.964 0.074 8.352 1089 HB3 ALA 143 HB3 ALA 143 -11.073 1.474 8.950 1090 H ILE 144 H ILE 144 -13.308 3.248 6.605 1091 HA ILE 144 HA ILE 144 -12.288 5.662 7.796 1092 HB ILE 144 HB ILE 144 -12.628 6.704 5.576 1093 HG12 ILE 144 HG12 ILE 144 -13.128 4.911 3.706 1094 HG13 ILE 144 HG13 ILE 144 -13.978 4.078 5.000 1095 HG21 ILE 144 HG21 ILE 144 -10.551 5.554 6.124 1096 HG22 ILE 144 HG22 ILE 144 -10.937 5.370 4.413 1097 HG23 ILE 144 HG23 ILE 144 -11.220 4.033 5.530 1098 HD11 ILE 144 HD11 ILE 144 -15.469 5.438 3.623 1099 HD12 ILE 144 HD12 ILE 144 -14.557 6.881 4.061 1100 HD13 ILE 144 HD13 ILE 144 -15.442 5.987 5.296 1101 H GLY 145 H GLY 145 -15.352 4.316 7.773 1102 HA2 GLY 145 HA2 GLY 145 -16.832 5.699 9.302 1103 HA3 GLY 145 HA3 GLY 145 -16.625 6.973 8.116 1104 H SER 146 H SER 146 -16.810 5.028 5.861 1105 HA SER 146 HA SER 146 -19.694 5.153 5.603 1106 HB2 SER 146 HB2 SER 146 -18.300 5.772 3.687 1107 HB3 SER 146 HB3 SER 146 -17.585 4.162 3.664 1108 HG SER 146 HG SER 146 -20.154 4.994 2.896 Start of MODEL 17 1 H1 MET 1 H1 MET 1 34.440 -43.342 60.514 2 H2 MET 1 H2 MET 1 32.809 -43.097 60.136 3 H3 MET 1 H3 MET 1 33.721 -41.842 60.802 4 HA MET 1 HA MET 1 35.105 -41.729 58.852 5 HB2 MET 1 HB2 MET 1 33.283 -43.911 57.797 6 HB3 MET 1 HB3 MET 1 34.475 -43.044 56.838 7 HG2 MET 1 HG2 MET 1 36.263 -43.930 58.254 8 HG3 MET 1 HG3 MET 1 35.068 -44.799 59.214 9 HE1 MET 1 HE1 MET 1 35.915 -45.710 54.766 10 HE2 MET 1 HE2 MET 1 36.777 -44.474 55.680 11 HE3 MET 1 HE3 MET 1 35.063 -44.263 55.312 12 H GLY 2 H GLY 2 34.455 -40.552 56.864 13 HA2 GLY 2 HA2 GLY 2 32.846 -39.400 55.549 14 HA3 GLY 2 HA3 GLY 2 31.649 -39.670 56.806 15 H SER 3 H SER 3 32.662 -37.189 55.363 16 HA SER 3 HA SER 3 33.124 -35.573 57.793 17 HB2 SER 3 HB2 SER 3 34.594 -34.084 56.549 18 HB3 SER 3 HB3 SER 3 35.200 -35.733 56.414 19 HG SER 3 HG SER 3 35.187 -34.603 54.403 20 H SER 4 H SER 4 32.343 -33.352 57.663 21 HA SER 4 HA SER 4 29.786 -33.221 56.317 22 HB2 SER 4 HB2 SER 4 29.543 -31.052 57.528 23 HB3 SER 4 HB3 SER 4 29.912 -32.408 58.592 24 HG SER 4 HG SER 4 31.553 -31.293 59.236 25 H HIS 5 H HIS 5 29.535 -32.508 54.312 26 HA HIS 5 HA HIS 5 30.780 -30.082 53.391 27 HB2 HIS 5 HB2 HIS 5 31.744 -31.203 51.310 28 HB3 HIS 5 HB3 HIS 5 32.631 -31.433 52.811 29 HD1 HIS 5 HD1 HIS 5 33.087 -33.789 53.512 30 HD2 HIS 5 HD2 HIS 5 30.204 -33.561 50.521 31 HE1 HIS 5 HE1 HIS 5 32.663 -36.158 52.804 32 HE2 HIS 5 HE2 HIS 5 30.948 -35.999 50.972 33 H HIS 6 H HIS 6 29.634 -29.101 51.784 34 HA HIS 6 HA HIS 6 27.529 -30.497 50.348 35 HB2 HIS 6 HB2 HIS 6 25.764 -28.912 51.262 36 HB3 HIS 6 HB3 HIS 6 26.331 -30.148 52.382 37 HD1 HIS 6 HD1 HIS 6 26.698 -26.450 51.682 38 HD2 HIS 6 HD2 HIS 6 27.464 -29.195 54.703 39 HE1 HIS 6 HE1 HIS 6 27.389 -25.085 53.667 40 HE2 HIS 6 HE2 HIS 6 27.716 -26.753 55.517 41 H HIS 7 H HIS 7 26.645 -29.276 48.618 42 HA HIS 7 HA HIS 7 27.812 -26.633 48.114 43 HB2 HIS 7 HB2 HIS 7 28.464 -27.399 45.779 44 HB3 HIS 7 HB3 HIS 7 29.460 -28.003 47.099 45 HD1 HIS 7 HD1 HIS 7 26.599 -29.174 44.889 46 HD2 HIS 7 HD2 HIS 7 29.723 -30.716 47.157 47 HE1 HIS 7 HE1 HIS 7 26.610 -31.644 44.431 48 HE2 HIS 7 HE2 HIS 7 28.534 -32.548 45.771 49 H HIS 8 H HIS 8 26.330 -25.281 47.365 50 HA HIS 8 HA HIS 8 24.542 -25.952 45.232 51 HB2 HIS 8 HB2 HIS 8 23.233 -26.940 47.041 52 HB3 HIS 8 HB3 HIS 8 23.339 -25.451 47.973 53 HD1 HIS 8 HD1 HIS 8 21.349 -23.986 47.778 54 HD2 HIS 8 HD2 HIS 8 21.787 -26.422 44.435 55 HE1 HIS 8 HE1 HIS 8 19.364 -23.503 46.325 56 HE2 HIS 8 HE2 HIS 8 19.606 -25.034 44.347 57 H HIS 9 H HIS 9 24.383 -24.147 44.013 58 HA HIS 9 HA HIS 9 24.283 -21.524 45.360 59 HB2 HIS 9 HB2 HIS 9 26.012 -22.131 42.945 60 HB3 HIS 9 HB3 HIS 9 25.829 -20.561 43.718 61 HD1 HIS 9 HD1 HIS 9 26.484 -20.818 46.507 62 HD2 HIS 9 HD2 HIS 9 28.295 -23.321 43.726 63 HE1 HIS 9 HE1 HIS 9 28.562 -21.675 47.622 64 HE2 HIS 9 HE2 HIS 9 29.561 -23.288 45.979 65 H HIS 10 H HIS 10 23.111 -19.919 44.308 66 HA HIS 10 HA HIS 10 21.219 -20.869 42.298 67 HB2 HIS 10 HB2 HIS 10 20.436 -19.656 44.336 68 HB3 HIS 10 HB3 HIS 10 21.293 -18.224 43.780 69 HD1 HIS 10 HD1 HIS 10 18.429 -20.480 42.774 70 HD2 HIS 10 HD2 HIS 10 19.860 -16.648 42.028 71 HE1 HIS 10 HE1 HIS 10 16.629 -19.335 41.449 72 HE2 HIS 10 HE2 HIS 10 17.537 -17.042 40.951 73 H SER 11 H SER 11 21.629 -20.562 40.185 74 HA SER 11 HA SER 11 23.373 -18.310 39.380 75 HB2 SER 11 HB2 SER 11 22.834 -20.923 37.933 76 HB3 SER 11 HB3 SER 11 23.885 -19.632 37.352 77 HG SER 11 HG SER 11 25.040 -19.961 39.433 78 H SER 12 H SER 12 22.584 -16.754 38.058 79 HA SER 12 HA SER 12 20.285 -17.288 36.338 80 HB2 SER 12 HB2 SER 12 19.206 -16.598 38.426 81 HB3 SER 12 HB3 SER 12 20.190 -15.133 38.470 82 HG SER 12 HG SER 12 17.951 -15.034 37.549 83 H GLY 13 H GLY 13 20.204 -16.010 34.533 84 HA2 GLY 13 HA2 GLY 13 22.103 -13.749 34.341 85 HA3 GLY 13 HA3 GLY 13 22.052 -14.984 33.092 86 H ARG 14 H ARG 14 21.574 -12.145 32.739 87 HA ARG 14 HA ARG 14 18.716 -12.202 31.977 88 HB2 ARG 14 HB2 ARG 14 20.383 -9.781 32.685 89 HB3 ARG 14 HB3 ARG 14 18.701 -9.754 32.175 90 HG2 ARG 14 HG2 ARG 14 18.150 -11.136 34.189 91 HG3 ARG 14 HG3 ARG 14 19.819 -10.913 34.724 92 HD2 ARG 14 HD2 ARG 14 18.426 -9.277 35.821 93 HD3 ARG 14 HD3 ARG 14 19.455 -8.449 34.650 94 HE ARG 14 HE ARG 14 16.941 -9.136 33.516 95 HH11 ARG 14 HH11 ARG 14 18.477 -6.837 35.565 96 HH12 ARG 14 HH12 ARG 14 17.285 -5.620 35.272 97 HH21 ARG 14 HH21 ARG 14 15.413 -7.566 33.153 98 HH22 ARG 14 HH22 ARG 14 15.570 -6.029 33.931 99 H GLU 15 H GLU 15 18.746 -12.793 29.882 100 HA GLU 15 HA GLU 15 20.386 -11.214 28.020 101 HB2 GLU 15 HB2 GLU 15 19.886 -12.964 26.335 102 HB3 GLU 15 HB3 GLU 15 20.760 -13.573 27.726 103 HG2 GLU 15 HG2 GLU 15 17.787 -13.870 27.344 104 HG3 GLU 15 HG3 GLU 15 18.974 -15.077 26.864 105 H ASN 16 H ASN 16 19.162 -9.367 27.920 106 HA ASN 16 HA ASN 16 16.333 -9.589 27.150 107 HB2 ASN 16 HB2 ASN 16 17.902 -7.168 28.085 108 HB3 ASN 16 HB3 ASN 16 16.164 -7.228 27.797 109 HD21 ASN 16 HD21 ASN 16 14.853 -8.336 29.258 110 HD22 ASN 16 HD22 ASN 16 15.405 -8.773 30.832 111 H LEU 17 H LEU 17 16.186 -9.799 24.974 112 HA LEU 17 HA LEU 17 17.933 -8.289 23.214 113 HB2 LEU 17 HB2 LEU 17 15.781 -10.319 22.682 114 HB3 LEU 17 HB3 LEU 17 16.594 -9.435 21.399 115 HG LEU 17 HG LEU 17 18.783 -10.331 22.413 116 HD11 LEU 17 HD11 LEU 17 17.904 -11.118 24.530 117 HD12 LEU 17 HD12 LEU 17 18.601 -12.454 23.615 118 HD13 LEU 17 HD13 LEU 17 16.849 -12.257 23.694 119 HD21 LEU 17 HD21 LEU 17 18.583 -12.429 21.162 120 HD22 LEU 17 HD22 LEU 17 17.928 -11.048 20.284 121 HD23 LEU 17 HD23 LEU 17 16.836 -12.192 21.064 122 H TYR 18 H TYR 18 17.448 -6.498 22.155 123 HA TYR 18 HA TYR 18 14.714 -5.395 22.375 124 HB2 TYR 18 HB2 TYR 18 15.940 -3.131 22.243 125 HB3 TYR 18 HB3 TYR 18 16.054 -4.025 23.754 126 HD1 TYR 18 HD2 TYR 18 18.154 -5.166 24.371 127 HD2 TYR 18 HD1 TYR 18 17.905 -2.741 20.877 128 HE1 TYR 18 HE2 TYR 18 20.606 -5.087 24.258 129 HE2 TYR 18 HE1 TYR 18 20.359 -2.659 20.759 130 HH TYR 18 HH TYR 18 22.357 -4.701 22.652 131 H PHE 19 H PHE 19 13.771 -4.563 20.557 132 HA PHE 19 HA PHE 19 15.305 -4.300 18.087 133 HB2 PHE 19 HB2 PHE 19 14.716 -6.666 18.087 134 HB3 PHE 19 HB3 PHE 19 13.026 -6.275 18.393 135 HD1 PHE 19 HD2 PHE 19 15.754 -5.770 15.914 136 HD2 PHE 19 HD1 PHE 19 11.554 -5.971 16.605 137 HE1 PHE 19 HE2 PHE 19 15.352 -5.647 13.494 138 HE2 PHE 19 HE1 PHE 19 11.148 -5.854 14.182 139 HZ PHE 19 HZ PHE 19 13.048 -5.690 12.622 140 H GLN 20 H GLN 20 14.622 -2.546 17.030 141 HA GLN 20 HA GLN 20 11.924 -1.497 17.558 142 HB2 GLN 20 HB2 GLN 20 13.816 0.044 17.951 143 HB3 GLN 20 HB3 GLN 20 14.319 -0.147 16.277 144 HG2 GLN 20 HG2 GLN 20 12.112 0.799 15.581 145 HG3 GLN 20 HG3 GLN 20 11.775 1.126 17.280 146 HE21 GLN 20 HE21 GLN 20 12.008 2.980 15.048 147 HE22 GLN 20 HE22 GLN 20 13.264 4.088 15.471 148 H GLY 21 H GLY 21 10.377 -1.477 15.985 149 HA2 GLY 21 HA2 GLY 21 10.793 -2.785 13.484 150 HA3 GLY 21 HA3 GLY 21 9.359 -1.885 13.953 151 H HIS 22 H HIS 22 12.629 -1.559 12.624 152 HA HIS 22 HA HIS 22 12.446 1.191 11.998 153 HB2 HIS 22 HB2 HIS 22 14.607 0.039 12.107 154 HB3 HIS 22 HB3 HIS 22 14.173 -0.933 10.706 155 HD1 HIS 22 HD1 HIS 22 14.956 2.649 11.644 156 HD2 HIS 22 HD2 HIS 22 14.652 0.253 8.256 157 HE1 HIS 22 HE1 HIS 22 15.801 4.055 9.746 158 HE2 HIS 22 HE2 HIS 22 15.494 2.638 7.699 159 H MET 23 H MET 23 10.970 2.048 10.694 160 HA MET 23 HA MET 23 9.987 0.596 8.362 161 HB2 MET 23 HB2 MET 23 8.331 2.421 8.251 162 HB3 MET 23 HB3 MET 23 8.355 1.644 9.827 163 HG2 MET 23 HG2 MET 23 9.899 3.544 10.560 164 HG3 MET 23 HG3 MET 23 9.416 4.348 9.067 165 HE1 MET 23 HE1 MET 23 6.423 2.813 9.146 166 HE2 MET 23 HE2 MET 23 6.684 4.412 8.449 167 HE3 MET 23 HE3 MET 23 5.441 4.176 9.681 168 H LEU 24 H LEU 24 9.772 1.760 6.286 169 HA LEU 24 HA LEU 24 12.156 3.424 5.744 170 HB2 LEU 24 HB2 LEU 24 10.739 1.300 4.193 171 HB3 LEU 24 HB3 LEU 24 11.579 2.559 3.307 172 HG LEU 24 HG LEU 24 13.024 1.021 5.448 173 HD11 LEU 24 HD11 LEU 24 13.773 -0.583 3.770 174 HD12 LEU 24 HD12 LEU 24 12.685 0.139 2.581 175 HD13 LEU 24 HD13 LEU 24 12.030 -0.673 4.005 176 HD21 LEU 24 HD21 LEU 24 13.912 2.375 2.888 177 HD22 LEU 24 HD22 LEU 24 14.968 1.566 4.053 178 HD23 LEU 24 HD23 LEU 24 14.088 3.019 4.524 179 H GLU 25 H GLU 25 11.979 5.330 4.637 180 HA GLU 25 HA GLU 25 9.293 6.393 4.244 181 HB2 GLU 25 HB2 GLU 25 12.031 7.593 4.382 182 HB3 GLU 25 HB3 GLU 25 10.736 8.500 3.606 183 HG2 GLU 25 HG2 GLU 25 9.449 8.549 5.581 184 HG3 GLU 25 HG3 GLU 25 10.461 7.340 6.357 185 H VAL 26 H VAL 26 8.319 6.612 2.381 186 HA VAL 26 HA VAL 26 9.806 6.345 -0.143 187 HB VAL 26 HB VAL 26 8.240 4.652 -1.005 188 HG11 VAL 26 HG11 VAL 26 9.069 2.713 0.240 189 HG12 VAL 26 HG12 VAL 26 9.600 3.772 1.546 190 HG13 VAL 26 HG13 VAL 26 10.352 3.887 -0.046 191 HG21 VAL 26 HG21 VAL 26 7.145 4.585 1.813 192 HG22 VAL 26 HG22 VAL 26 6.720 3.460 0.521 193 HG23 VAL 26 HG23 VAL 26 6.302 5.168 0.374 194 H GLU 27 H GLU 27 8.499 6.908 -2.065 195 HA GLU 27 HA GLU 27 6.302 8.751 -1.422 196 HB2 GLU 27 HB2 GLU 27 8.072 9.646 -2.848 197 HB3 GLU 27 HB3 GLU 27 7.822 8.347 -4.009 198 HG2 GLU 27 HG2 GLU 27 5.707 9.188 -4.647 199 HG3 GLU 27 HG3 GLU 27 5.648 10.295 -3.277 200 H VAL 28 H VAL 28 4.285 8.071 -1.588 201 HA VAL 28 HA VAL 28 3.706 5.513 -2.858 202 HB VAL 28 HB VAL 28 1.868 7.247 -1.195 203 HG11 VAL 28 HG11 VAL 28 0.675 5.640 -2.561 204 HG12 VAL 28 HG12 VAL 28 0.611 5.148 -0.868 205 HG13 VAL 28 HG13 VAL 28 1.711 4.335 -1.982 206 HG21 VAL 28 HG21 VAL 28 2.427 5.777 0.693 207 HG22 VAL 28 HG22 VAL 28 3.840 6.657 0.111 208 HG23 VAL 28 HG23 VAL 28 3.629 4.955 -0.305 209 H ILE 29 H ILE 29 3.051 5.506 -4.921 210 HA ILE 29 HA ILE 29 1.542 7.809 -5.966 211 HB ILE 29 HB ILE 29 2.441 5.564 -7.736 212 HG12 ILE 29 HG12 ILE 29 4.243 7.731 -6.638 213 HG13 ILE 29 HG13 ILE 29 4.417 6.004 -6.375 214 HG21 ILE 29 HG21 ILE 29 2.241 8.565 -8.068 215 HG22 ILE 29 HG22 ILE 29 1.100 7.364 -8.677 216 HG23 ILE 29 HG23 ILE 29 2.736 7.434 -9.330 217 HD11 ILE 29 HD11 ILE 29 4.743 7.468 -8.978 218 HD12 ILE 29 HD12 ILE 29 4.812 5.715 -8.787 219 HD13 ILE 29 HD13 ILE 29 6.011 6.735 -7.996 220 H SER 30 H SER 30 -0.335 7.398 -7.330 221 HA SER 30 HA SER 30 -1.465 4.729 -7.255 222 HB2 SER 30 HB2 SER 30 -2.316 5.737 -5.178 223 HB3 SER 30 HB3 SER 30 -2.998 7.069 -6.109 224 HG SER 30 HG SER 30 -3.688 4.320 -6.359 225 H GLY 31 H GLY 31 -2.491 4.243 -9.099 226 HA2 GLY 31 HA2 GLY 31 -4.359 5.684 -10.445 227 HA3 GLY 31 HA3 GLY 31 -2.866 6.348 -11.071 228 H ARG 32 H ARG 32 -1.461 4.954 -12.280 229 HA ARG 32 HA ARG 32 -2.855 3.991 -14.427 230 HB2 ARG 32 HB2 ARG 32 -0.004 3.367 -13.665 231 HB3 ARG 32 HB3 ARG 32 -0.693 3.081 -15.256 232 HG2 ARG 32 HG2 ARG 32 -0.459 5.782 -13.927 233 HG3 ARG 32 HG3 ARG 32 0.649 5.143 -15.140 234 HD2 ARG 32 HD2 ARG 32 -0.851 6.592 -16.277 235 HD3 ARG 32 HD3 ARG 32 -1.325 4.946 -16.692 236 HE ARG 32 HE ARG 32 -2.777 6.006 -14.456 237 HH11 ARG 32 HH11 ARG 32 -2.638 5.938 -17.902 238 HH12 ARG 32 HH12 ARG 32 -4.329 6.262 -18.078 239 HH21 ARG 32 HH21 ARG 32 -4.934 6.405 -14.696 240 HH22 ARG 32 HH22 ARG 32 -5.606 6.559 -16.283 241 H THR 33 H THR 33 -4.417 2.503 -13.463 242 HA THR 33 HA THR 33 -3.612 -0.162 -14.336 243 HB THR 33 HB THR 33 -4.997 -1.258 -12.527 244 HG1 THR 33 HG1 THR 33 -5.747 -0.105 -10.875 245 HG21 THR 33 HG21 THR 33 -3.245 -1.236 -10.825 246 HG22 THR 33 HG22 THR 33 -2.539 0.207 -11.552 247 HG23 THR 33 HG23 THR 33 -2.545 -1.316 -12.442 248 H LEU 34 H LEU 34 -6.423 1.457 -12.852 249 HA LEU 34 HA LEU 34 -8.006 0.843 -15.272 250 HB2 LEU 34 HB2 LEU 34 -8.892 1.555 -12.464 251 HB3 LEU 34 HB3 LEU 34 -9.985 1.437 -13.829 252 HG LEU 34 HG LEU 34 -9.284 -0.987 -14.058 253 HD11 LEU 34 HD11 LEU 34 -8.301 -2.061 -12.080 254 HD12 LEU 34 HD12 LEU 34 -8.038 -0.473 -11.357 255 HD13 LEU 34 HD13 LEU 34 -7.191 -0.919 -12.838 256 HD21 LEU 34 HD21 LEU 34 -10.597 -0.194 -11.455 257 HD22 LEU 34 HD22 LEU 34 -10.756 -1.745 -12.280 258 HD23 LEU 34 HD23 LEU 34 -11.402 -0.284 -13.022 259 H ASN 35 H ASN 35 -8.194 2.527 -16.675 260 HA ASN 35 HA ASN 35 -7.402 5.172 -15.997 261 HB2 ASN 35 HB2 ASN 35 -8.910 4.120 -18.403 262 HB3 ASN 35 HB3 ASN 35 -8.353 5.783 -18.250 263 HD21 ASN 35 HD21 ASN 35 -7.422 2.500 -18.789 264 HD22 ASN 35 HD22 ASN 35 -5.775 2.819 -19.202 265 H GLN 36 H GLN 36 -10.588 3.631 -16.273 266 HA GLN 36 HA GLN 36 -11.877 6.075 -15.271 267 HB2 GLN 36 HB2 GLN 36 -13.098 3.422 -16.051 268 HB3 GLN 36 HB3 GLN 36 -13.988 4.864 -15.595 269 HG2 GLN 36 HG2 GLN 36 -12.221 4.575 -18.024 270 HG3 GLN 36 HG3 GLN 36 -13.984 4.561 -18.012 271 HE21 GLN 36 HE21 GLN 36 -12.111 6.362 -19.373 272 HE22 GLN 36 HE22 GLN 36 -12.508 7.952 -18.831 273 H GLY 37 H GLY 37 -11.749 6.342 -13.118 274 HA2 GLY 37 HA2 GLY 37 -11.220 4.130 -11.377 275 HA3 GLY 37 HA3 GLY 37 -11.436 5.804 -10.896 276 H ALA 38 H ALA 38 -13.937 6.467 -11.419 277 HA ALA 38 HA ALA 38 -16.024 6.406 -10.509 278 HB1 ALA 38 HB1 ALA 38 -17.274 4.319 -10.608 279 HB2 ALA 38 HB2 ALA 38 -15.778 3.406 -10.812 280 HB3 ALA 38 HB3 ALA 38 -16.313 4.513 -12.077 281 H THR 39 H THR 39 -17.301 4.764 -8.672 282 HA THR 39 HA THR 39 -15.471 4.795 -6.349 283 HB THR 39 HB THR 39 -17.370 4.906 -4.903 284 HG1 THR 39 HG1 THR 39 -19.309 4.956 -6.897 285 HG21 THR 39 HG21 THR 39 -18.527 6.957 -5.663 286 HG22 THR 39 HG22 THR 39 -17.835 6.736 -7.271 287 HG23 THR 39 HG23 THR 39 -16.781 7.052 -5.892 288 H VAL 40 H VAL 40 -15.989 3.056 -4.676 289 HA VAL 40 HA VAL 40 -15.664 0.477 -5.731 290 HB VAL 40 HB VAL 40 -16.755 1.188 -3.001 291 HG11 VAL 40 HG11 VAL 40 -17.090 -1.151 -3.547 292 HG12 VAL 40 HG12 VAL 40 -15.853 -0.977 -2.301 293 HG13 VAL 40 HG13 VAL 40 -15.383 -1.313 -3.969 294 HG21 VAL 40 HG21 VAL 40 -14.651 2.343 -3.379 295 HG22 VAL 40 HG22 VAL 40 -13.889 0.833 -3.886 296 HG23 VAL 40 HG23 VAL 40 -14.425 1.035 -2.217 297 H GLU 41 H GLU 41 -18.548 2.261 -4.839 298 HA GLU 41 HA GLU 41 -20.392 0.134 -4.789 299 HB2 GLU 41 HB2 GLU 41 -20.817 2.359 -3.823 300 HB3 GLU 41 HB3 GLU 41 -20.850 3.057 -5.435 301 HG2 GLU 41 HG2 GLU 41 -22.850 1.842 -5.984 302 HG3 GLU 41 HG3 GLU 41 -22.769 0.945 -4.466 303 H GLU 42 H GLU 42 -19.208 2.159 -7.443 304 HA GLU 42 HA GLU 42 -21.010 1.252 -9.419 305 HB2 GLU 42 HB2 GLU 42 -18.357 2.619 -9.481 306 HB3 GLU 42 HB3 GLU 42 -18.944 1.893 -10.968 307 HG2 GLU 42 HG2 GLU 42 -19.590 4.157 -11.025 308 HG3 GLU 42 HG3 GLU 42 -21.047 3.229 -10.688 309 H LYS 43 H LYS 43 -18.005 -0.167 -8.208 310 HA LYS 43 HA LYS 43 -18.477 -2.464 -9.997 311 HB2 LYS 43 HB2 LYS 43 -15.758 -1.304 -9.373 312 HB3 LYS 43 HB3 LYS 43 -16.054 -2.773 -10.293 313 HG2 LYS 43 HG2 LYS 43 -15.812 -1.349 -12.043 314 HG3 LYS 43 HG3 LYS 43 -17.529 -1.074 -11.748 315 HD2 LYS 43 HD2 LYS 43 -16.557 1.078 -11.962 316 HD3 LYS 43 HD3 LYS 43 -16.823 0.845 -10.233 317 HE2 LYS 43 HE2 LYS 43 -14.641 1.815 -10.583 318 HE3 LYS 43 HE3 LYS 43 -14.457 0.164 -9.994 319 HZ1 LYS 43 HZ1 LYS 43 -13.997 -0.573 -12.231 320 HZ2 LYS 43 HZ2 LYS 43 -12.941 0.685 -11.827 321 HZ3 LYS 43 HZ3 LYS 43 -14.256 0.983 -12.842 322 H LEU 44 H LEU 44 -19.560 -2.782 -7.634 323 HA LEU 44 HA LEU 44 -17.835 -3.983 -5.693 324 HB2 LEU 44 HB2 LEU 44 -20.815 -4.127 -6.141 325 HB3 LEU 44 HB3 LEU 44 -20.023 -5.012 -4.851 326 HG LEU 44 HG LEU 44 -19.950 -2.002 -5.154 327 HD11 LEU 44 HD11 LEU 44 -21.592 -3.687 -3.260 328 HD12 LEU 44 HD12 LEU 44 -22.213 -2.814 -4.661 329 HD13 LEU 44 HD13 LEU 44 -21.521 -1.925 -3.307 330 HD21 LEU 44 HD21 LEU 44 -19.065 -2.033 -2.871 331 HD22 LEU 44 HD22 LEU 44 -18.006 -2.903 -3.979 332 HD23 LEU 44 HD23 LEU 44 -19.066 -3.797 -2.886 333 H THR 45 H THR 45 -16.534 -5.403 -6.938 334 HA THR 45 HA THR 45 -17.732 -8.022 -7.407 335 HB THR 45 HB THR 45 -18.046 -7.073 -9.588 336 HG1 THR 45 HG1 THR 45 -16.965 -8.627 -10.730 337 HG21 THR 45 HG21 THR 45 -16.507 -5.198 -9.496 338 HG22 THR 45 HG22 THR 45 -16.142 -6.183 -10.914 339 HG23 THR 45 HG23 THR 45 -15.124 -6.292 -9.477 340 H GLU 46 H GLU 46 -16.082 -9.675 -8.027 341 HA GLU 46 HA GLU 46 -13.938 -9.806 -6.243 342 HB2 GLU 46 HB2 GLU 46 -14.966 -11.765 -7.327 343 HB3 GLU 46 HB3 GLU 46 -14.306 -11.266 -8.876 344 HG2 GLU 46 HG2 GLU 46 -12.968 -13.045 -8.019 345 HG3 GLU 46 HG3 GLU 46 -12.022 -11.558 -7.943 346 H GLU 47 H GLU 47 -14.054 -8.644 -9.580 347 HA GLU 47 HA GLU 47 -11.349 -8.389 -10.156 348 HB2 GLU 47 HB2 GLU 47 -13.616 -6.538 -10.922 349 HB3 GLU 47 HB3 GLU 47 -12.007 -6.473 -11.627 350 HG2 GLU 47 HG2 GLU 47 -12.315 -8.789 -12.446 351 HG3 GLU 47 HG3 GLU 47 -13.966 -8.755 -11.822 352 H TYR 48 H TYR 48 -13.446 -6.153 -8.362 353 HA TYR 48 HA TYR 48 -11.621 -4.040 -8.059 354 HB2 TYR 48 HB2 TYR 48 -14.231 -4.370 -7.443 355 HB3 TYR 48 HB3 TYR 48 -13.545 -4.581 -5.838 356 HD1 TYR 48 HD1 TYR 48 -12.051 -2.693 -4.924 357 HD2 TYR 48 HD2 TYR 48 -14.565 -2.218 -8.332 358 HE1 TYR 48 HE1 TYR 48 -11.921 -0.253 -4.679 359 HE2 TYR 48 HE2 TYR 48 -14.432 0.221 -8.095 360 HH TYR 48 HH TYR 48 -12.182 1.773 -6.188 361 H PHE 49 H PHE 49 -12.030 -7.038 -6.299 362 HA PHE 49 HA PHE 49 -10.281 -6.338 -4.120 363 HB2 PHE 49 HB2 PHE 49 -12.130 -7.956 -3.857 364 HB3 PHE 49 HB3 PHE 49 -11.336 -9.045 -4.987 365 HD1 PHE 49 HD1 PHE 49 -10.930 -7.381 -1.694 366 HD2 PHE 49 HD2 PHE 49 -9.736 -10.588 -4.233 367 HE1 PHE 49 HE1 PHE 49 -9.714 -8.409 0.181 368 HE2 PHE 49 HE2 PHE 49 -8.514 -11.617 -2.360 369 HZ PHE 49 HZ PHE 49 -8.504 -10.529 -0.150 370 H ASN 50 H ASN 50 -9.889 -7.860 -7.258 371 HA ASN 50 HA ASN 50 -7.117 -8.612 -6.616 372 HB2 ASN 50 HB2 ASN 50 -8.800 -9.236 -9.051 373 HB3 ASN 50 HB3 ASN 50 -7.145 -9.788 -8.802 374 HD21 ASN 50 HD21 ASN 50 -10.443 -10.157 -7.870 375 HD22 ASN 50 HD22 ASN 50 -10.241 -11.596 -6.947 376 H ALA 51 H ALA 51 -8.610 -5.901 -7.684 377 HA ALA 51 HA ALA 51 -6.658 -5.223 -9.757 378 HB1 ALA 51 HB1 ALA 51 -9.026 -4.759 -10.178 379 HB2 ALA 51 HB2 ALA 51 -8.054 -3.288 -10.204 380 HB3 ALA 51 HB3 ALA 51 -9.052 -3.662 -8.798 381 H VAL 52 H VAL 52 -7.638 -4.064 -6.517 382 HA VAL 52 HA VAL 52 -5.420 -2.100 -6.635 383 HB VAL 52 HB VAL 52 -6.829 -0.477 -5.438 384 HG11 VAL 52 HG11 VAL 52 -6.731 -0.368 -7.867 385 HG12 VAL 52 HG12 VAL 52 -8.338 0.090 -7.296 386 HG13 VAL 52 HG13 VAL 52 -8.069 -1.510 -7.994 387 HG21 VAL 52 HG21 VAL 52 -9.052 -2.498 -5.805 388 HG22 VAL 52 HG22 VAL 52 -9.239 -0.858 -5.182 389 HG23 VAL 52 HG23 VAL 52 -8.308 -2.046 -4.271 390 H ASN 53 H ASN 53 -5.797 -4.807 -5.098 391 HA ASN 53 HA ASN 53 -5.623 -3.773 -2.334 392 HB2 ASN 53 HB2 ASN 53 -6.049 -6.605 -3.322 393 HB3 ASN 53 HB3 ASN 53 -5.930 -6.141 -1.632 394 HD21 ASN 53 HD21 ASN 53 -7.605 -4.302 -4.127 395 HD22 ASN 53 HD22 ASN 53 -9.182 -4.537 -3.483 396 H TYR 54 H TYR 54 -3.400 -3.870 -4.473 397 HA TYR 54 HA TYR 54 -1.368 -5.067 -2.718 398 HB2 TYR 54 HB2 TYR 54 -0.195 -6.020 -4.714 399 HB3 TYR 54 HB3 TYR 54 -1.748 -6.780 -4.379 400 HD1 TYR 54 HD2 TYR 54 -3.680 -6.336 -5.838 401 HD2 TYR 54 HD1 TYR 54 0.171 -4.789 -6.764 402 HE1 TYR 54 HE2 TYR 54 -4.428 -5.884 -8.130 403 HE2 TYR 54 HE1 TYR 54 -0.568 -4.319 -9.065 404 HH TYR 54 HH TYR 54 -3.806 -4.312 -9.972 405 H ALA 55 H ALA 55 0.820 -4.293 -3.132 406 HA ALA 55 HA ALA 55 0.929 -1.702 -4.557 407 HB1 ALA 55 HB1 ALA 55 0.741 -1.290 -2.148 408 HB2 ALA 55 HB2 ALA 55 2.312 -0.782 -2.767 409 HB3 ALA 55 HB3 ALA 55 2.166 -2.289 -1.861 410 H GLU 56 H GLU 56 2.734 -1.333 -5.775 411 HA GLU 56 HA GLU 56 4.684 -3.491 -6.017 412 HB2 GLU 56 HB2 GLU 56 4.291 -0.976 -7.662 413 HB3 GLU 56 HB3 GLU 56 5.508 -2.203 -7.993 414 HG2 GLU 56 HG2 GLU 56 3.639 -3.865 -8.218 415 HG3 GLU 56 HG3 GLU 56 2.515 -2.511 -8.116 416 H ILE 57 H ILE 57 6.516 -3.472 -4.965 417 HA ILE 57 HA ILE 57 7.460 -0.978 -3.701 418 HB ILE 57 HB ILE 57 7.851 -3.839 -2.794 419 HG12 ILE 57 HG12 ILE 57 6.044 -1.779 -1.510 420 HG13 ILE 57 HG13 ILE 57 5.462 -2.879 -2.756 421 HG21 ILE 57 HG21 ILE 57 9.640 -2.373 -2.023 422 HG22 ILE 57 HG22 ILE 57 8.603 -2.833 -0.673 423 HG23 ILE 57 HG23 ILE 57 8.456 -1.228 -1.388 424 HD11 ILE 57 HD11 ILE 57 4.954 -3.663 -0.507 425 HD12 ILE 57 HD12 ILE 57 6.679 -3.716 -0.138 426 HD13 ILE 57 HD13 ILE 57 6.007 -4.779 -1.379 427 H ASN 58 H ASN 58 9.665 -0.481 -3.709 428 HA ASN 58 HA ASN 58 11.284 -1.485 -5.808 429 HB2 ASN 58 HB2 ASN 58 11.572 0.790 -4.966 430 HB3 ASN 58 HB3 ASN 58 12.045 0.172 -3.385 431 HD21 ASN 58 HD21 ASN 58 13.003 0.569 -6.701 432 HD22 ASN 58 HD22 ASN 58 14.683 0.246 -6.456 433 H GLU 59 H GLU 59 13.074 -2.848 -5.776 434 HA GLU 59 HA GLU 59 12.864 -5.075 -4.062 435 HB2 GLU 59 HB2 GLU 59 13.666 -5.261 -6.355 436 HB3 GLU 59 HB3 GLU 59 15.099 -4.324 -5.956 437 HG2 GLU 59 HG2 GLU 59 16.046 -6.055 -4.722 438 HG3 GLU 59 HG3 GLU 59 14.499 -6.865 -4.494 439 H GLU 60 H GLU 60 15.114 -2.318 -3.977 440 HA GLU 60 HA GLU 60 16.867 -3.320 -2.002 441 HB2 GLU 60 HB2 GLU 60 16.037 -0.455 -2.535 442 HB3 GLU 60 HB3 GLU 60 17.404 -0.939 -1.541 443 HG2 GLU 60 HG2 GLU 60 18.459 -1.965 -3.503 444 HG3 GLU 60 HG3 GLU 60 17.090 -1.459 -4.493 445 H ASP 61 H ASP 61 13.964 -1.284 -1.684 446 HA ASP 61 HA ASP 61 13.921 -1.259 1.149 447 HB2 ASP 61 HB2 ASP 61 11.666 -0.828 -0.833 448 HB3 ASP 61 HB3 ASP 61 11.614 -0.416 0.882 449 H TRP 62 H TRP 62 12.549 -3.409 -1.254 450 HA TRP 62 HA TRP 62 10.893 -5.013 0.303 451 HB2 TRP 62 HB2 TRP 62 11.094 -5.116 -2.171 452 HB3 TRP 62 HB3 TRP 62 12.680 -5.857 -2.003 453 HD1 TRP 62 HD1 TRP 62 12.735 -8.427 -1.111 454 HE1 TRP 62 HE1 TRP 62 10.942 -10.268 -1.196 455 HE3 TRP 62 HE3 TRP 62 8.635 -5.528 -2.066 456 HZ2 TRP 62 HZ2 TRP 62 8.166 -10.467 -1.631 457 HZ3 TRP 62 HZ3 TRP 62 6.447 -6.624 -2.304 458 HH2 TRP 62 HH2 TRP 62 6.218 -9.046 -2.090 459 H ASN 63 H ASN 63 14.344 -5.515 -0.464 460 HA ASN 63 HA ASN 63 14.700 -7.768 1.210 461 HB2 ASN 63 HB2 ASN 63 16.789 -5.795 0.245 462 HB3 ASN 63 HB3 ASN 63 17.103 -7.409 0.875 463 HD21 ASN 63 HD21 ASN 63 17.771 -6.277 -1.719 464 HD22 ASN 63 HD22 ASN 63 17.017 -7.299 -2.892 465 H ALA 64 H ALA 64 15.091 -4.306 1.775 466 HA ALA 64 HA ALA 64 16.486 -4.383 4.208 467 HB1 ALA 64 HB1 ALA 64 16.170 -2.348 2.854 468 HB2 ALA 64 HB2 ALA 64 15.730 -2.104 4.543 469 HB3 ALA 64 HB3 ALA 64 14.470 -2.316 3.325 470 H LEU 65 H LEU 65 12.969 -4.201 3.637 471 HA LEU 65 HA LEU 65 12.337 -4.468 6.436 472 HB2 LEU 65 HB2 LEU 65 10.588 -4.654 3.976 473 HB3 LEU 65 HB3 LEU 65 9.989 -4.635 5.626 474 HG LEU 65 HG LEU 65 11.527 -2.378 4.323 475 HD11 LEU 65 HD11 LEU 65 9.350 -2.637 3.287 476 HD12 LEU 65 HD12 LEU 65 9.385 -1.190 4.296 477 HD13 LEU 65 HD13 LEU 65 8.572 -2.649 4.871 478 HD21 LEU 65 HD21 LEU 65 11.839 -2.463 6.740 479 HD22 LEU 65 HD22 LEU 65 10.091 -2.525 6.976 480 HD23 LEU 65 HD23 LEU 65 10.837 -1.083 6.285 481 H GLY 66 H GLY 66 13.429 -6.685 4.232 482 HA2 GLY 66 HA2 GLY 66 13.489 -8.981 4.174 483 HA3 GLY 66 HA3 GLY 66 12.877 -8.954 5.820 484 H LEU 67 H LEU 67 11.414 -7.881 2.754 485 HA LEU 67 HA LEU 67 8.900 -9.101 3.489 486 HB2 LEU 67 HB2 LEU 67 9.709 -7.629 0.977 487 HB3 LEU 67 HB3 LEU 67 8.070 -8.098 1.393 488 HG LEU 67 HG LEU 67 9.775 -6.148 2.960 489 HD11 LEU 67 HD11 LEU 67 9.121 -5.234 0.804 490 HD12 LEU 67 HD12 LEU 67 8.243 -4.440 2.111 491 HD13 LEU 67 HD13 LEU 67 7.436 -5.653 1.116 492 HD21 LEU 67 HD21 LEU 67 8.194 -7.363 4.381 493 HD22 LEU 67 HD22 LEU 67 6.871 -6.928 3.296 494 HD23 LEU 67 HD23 LEU 67 7.721 -5.675 4.202 495 H GLN 68 H GLN 68 7.723 -10.604 2.169 496 HA GLN 68 HA GLN 68 9.344 -12.256 0.358 497 HB2 GLN 68 HB2 GLN 68 9.460 -13.221 2.674 498 HB3 GLN 68 HB3 GLN 68 7.714 -13.431 2.605 499 HG2 GLN 68 HG2 GLN 68 7.926 -14.957 0.746 500 HG3 GLN 68 HG3 GLN 68 9.667 -14.688 0.689 501 HE21 GLN 68 HE21 GLN 68 10.143 -16.844 1.010 502 HE22 GLN 68 HE22 GLN 68 9.905 -17.634 2.530 503 H GLU 69 H GLU 69 8.270 -12.477 -1.432 504 HA GLU 69 HA GLU 69 5.972 -11.276 -2.112 505 HB2 GLU 69 HB2 GLU 69 7.095 -13.810 -3.312 506 HB3 GLU 69 HB3 GLU 69 5.848 -12.824 -4.076 507 HG2 GLU 69 HG2 GLU 69 7.346 -10.935 -4.183 508 HG3 GLU 69 HG3 GLU 69 8.584 -11.824 -3.302 509 H GLY 70 H GLY 70 4.135 -11.362 -1.069 510 HA2 GLY 70 HA2 GLY 70 2.003 -12.743 -1.153 511 HA3 GLY 70 HA3 GLY 70 2.960 -13.991 -0.374 512 H ASP 71 H ASP 71 4.327 -11.644 1.163 513 HA ASP 71 HA ASP 71 2.553 -11.796 3.433 514 HB2 ASP 71 HB2 ASP 71 4.317 -10.588 4.640 515 HB3 ASP 71 HB3 ASP 71 4.957 -11.974 3.769 516 H ARG 72 H ARG 72 2.543 -9.534 4.780 517 HA ARG 72 HA ARG 72 1.004 -7.722 3.026 518 HB2 ARG 72 HB2 ARG 72 0.758 -8.149 6.014 519 HB3 ARG 72 HB3 ARG 72 -0.189 -7.011 5.072 520 HG2 ARG 72 HG2 ARG 72 -1.605 -8.835 5.390 521 HG3 ARG 72 HG3 ARG 72 -1.005 -9.033 3.742 522 HD2 ARG 72 HD2 ARG 72 0.547 -10.723 4.447 523 HD3 ARG 72 HD3 ARG 72 0.190 -10.421 6.147 524 HE ARG 72 HE ARG 72 -1.657 -11.662 4.216 525 HH11 ARG 72 HH11 ARG 72 -0.601 -11.121 7.447 526 HH12 ARG 72 HH12 ARG 72 -1.682 -12.291 8.118 527 HH21 ARG 72 HH21 ARG 72 -3.056 -13.151 5.087 528 HH22 ARG 72 HH22 ARG 72 -3.063 -13.423 6.797 529 H VAL 73 H VAL 73 1.538 -5.636 2.848 530 HA VAL 73 HA VAL 73 3.540 -4.520 4.712 531 HB VAL 73 HB VAL 73 4.086 -2.887 2.877 532 HG11 VAL 73 HG11 VAL 73 5.550 -4.760 3.370 533 HG12 VAL 73 HG12 VAL 73 5.501 -4.472 1.629 534 HG13 VAL 73 HG13 VAL 73 4.592 -5.813 2.326 535 HG21 VAL 73 HG21 VAL 73 2.059 -3.130 1.527 536 HG22 VAL 73 HG22 VAL 73 2.476 -4.806 1.172 537 HG23 VAL 73 HG23 VAL 73 3.490 -3.497 0.565 538 H LYS 74 H LYS 74 3.088 -2.678 5.756 539 HA LYS 74 HA LYS 74 0.427 -1.510 5.350 540 HB2 LYS 74 HB2 LYS 74 1.222 -2.453 7.613 541 HB3 LYS 74 HB3 LYS 74 2.221 -1.011 7.725 542 HG2 LYS 74 HG2 LYS 74 0.282 0.403 7.674 543 HG3 LYS 74 HG3 LYS 74 -0.768 -0.978 7.347 544 HD2 LYS 74 HD2 LYS 74 -0.027 -1.940 9.558 545 HD3 LYS 74 HD3 LYS 74 0.772 -0.397 9.881 546 HE2 LYS 74 HE2 LYS 74 -1.403 0.738 9.569 547 HE3 LYS 74 HE3 LYS 74 -2.167 -0.831 9.362 548 HZ1 LYS 74 HZ1 LYS 74 -2.350 0.157 11.627 549 HZ2 LYS 74 HZ2 LYS 74 -0.685 -0.065 11.812 550 HZ3 LYS 74 HZ3 LYS 74 -1.694 -1.403 11.591 551 H VAL 75 H VAL 75 0.151 0.681 5.022 552 HA VAL 75 HA VAL 75 2.585 2.210 4.357 553 HB VAL 75 HB VAL 75 -0.030 2.318 2.826 554 HG11 VAL 75 HG11 VAL 75 1.261 3.641 1.200 555 HG12 VAL 75 HG12 VAL 75 2.655 3.591 2.279 556 HG13 VAL 75 HG13 VAL 75 1.182 4.422 2.778 557 HG21 VAL 75 HG21 VAL 75 1.144 1.172 1.009 558 HG22 VAL 75 HG22 VAL 75 1.097 0.168 2.458 559 HG23 VAL 75 HG23 VAL 75 2.581 1.016 2.020 560 H LYS 76 H LYS 76 2.625 4.332 5.007 561 HA LYS 76 HA LYS 76 0.262 5.407 6.396 562 HB2 LYS 76 HB2 LYS 76 3.001 4.971 7.586 563 HB3 LYS 76 HB3 LYS 76 1.824 6.068 8.295 564 HG2 LYS 76 HG2 LYS 76 0.483 4.380 9.046 565 HG3 LYS 76 HG3 LYS 76 0.945 3.279 7.748 566 HD2 LYS 76 HD2 LYS 76 2.913 2.646 8.805 567 HD3 LYS 76 HD3 LYS 76 2.940 4.075 9.848 568 HE2 LYS 76 HE2 LYS 76 0.906 3.174 10.994 569 HE3 LYS 76 HE3 LYS 76 1.073 1.706 10.033 570 HZ1 LYS 76 HZ1 LYS 76 3.154 1.240 11.055 571 HZ2 LYS 76 HZ2 LYS 76 2.052 1.575 12.293 572 HZ3 LYS 76 HZ3 LYS 76 3.190 2.740 11.835 573 H THR 77 H THR 77 -0.090 7.463 5.874 574 HA THR 77 HA THR 77 2.189 9.272 5.376 575 HB THR 77 HB THR 77 1.113 10.335 3.496 576 HG1 THR 77 HG1 THR 77 -0.917 9.439 2.706 577 HG21 THR 77 HG21 THR 77 2.434 8.326 2.948 578 HG22 THR 77 HG22 THR 77 1.098 8.553 1.819 579 HG23 THR 77 HG23 THR 77 0.980 7.337 3.090 580 H GLU 78 H GLU 78 0.969 11.626 5.003 581 HA GLU 78 HA GLU 78 -0.116 12.350 7.509 582 HB2 GLU 78 HB2 GLU 78 -0.543 14.550 6.447 583 HB3 GLU 78 HB3 GLU 78 1.092 13.963 6.175 584 HG2 GLU 78 HG2 GLU 78 0.478 13.253 3.921 585 HG3 GLU 78 HG3 GLU 78 -1.177 13.794 4.191 586 H PHE 79 H PHE 79 -1.630 10.878 4.847 587 HA PHE 79 HA PHE 79 -4.262 12.025 5.378 588 HB2 PHE 79 HB2 PHE 79 -3.303 10.040 3.307 589 HB3 PHE 79 HB3 PHE 79 -4.980 10.552 3.460 590 HD1 PHE 79 HD2 PHE 79 -5.631 12.860 2.926 591 HD2 PHE 79 HD1 PHE 79 -1.637 11.499 2.347 592 HE1 PHE 79 HE2 PHE 79 -5.174 14.816 1.511 593 HE2 PHE 79 HE1 PHE 79 -1.177 13.455 0.931 594 HZ PHE 79 HZ PHE 79 -2.943 15.117 0.512 595 H GLY 80 H GLY 80 -2.545 8.975 5.842 596 HA2 GLY 80 HA2 GLY 80 -3.873 8.066 8.034 597 HA3 GLY 80 HA3 GLY 80 -4.896 7.536 6.709 598 H GLU 81 H GLU 81 -4.435 5.354 7.466 599 HA GLU 81 HA GLU 81 -1.957 4.317 6.282 600 HB2 GLU 81 HB2 GLU 81 -1.667 2.736 8.170 601 HB3 GLU 81 HB3 GLU 81 -1.462 4.417 8.639 602 HG2 GLU 81 HG2 GLU 81 -3.610 4.456 9.697 603 HG3 GLU 81 HG3 GLU 81 -4.011 2.862 9.058 604 H VAL 82 H VAL 82 -2.017 2.093 5.634 605 HA VAL 82 HA VAL 82 -4.560 0.670 5.707 606 HB VAL 82 HB VAL 82 -4.752 2.236 3.767 607 HG11 VAL 82 HG11 VAL 82 -2.470 0.632 2.619 608 HG12 VAL 82 HG12 VAL 82 -2.417 2.326 3.103 609 HG13 VAL 82 HG13 VAL 82 -3.428 1.830 1.745 610 HG21 VAL 82 HG21 VAL 82 -5.533 0.580 2.138 611 HG22 VAL 82 HG22 VAL 82 -6.032 0.161 3.778 612 HG23 VAL 82 HG23 VAL 82 -4.686 -0.691 3.021 613 H VAL 83 H VAL 83 -4.368 -1.575 5.206 614 HA VAL 83 HA VAL 83 -1.592 -2.570 4.906 615 HB VAL 83 HB VAL 83 -3.958 -4.131 5.982 616 HG11 VAL 83 HG11 VAL 83 -2.219 -5.536 5.008 617 HG12 VAL 83 HG12 VAL 83 -2.237 -5.713 6.762 618 HG13 VAL 83 HG13 VAL 83 -0.994 -4.730 5.990 619 HG21 VAL 83 HG21 VAL 83 -3.447 -2.318 7.527 620 HG22 VAL 83 HG22 VAL 83 -1.743 -2.776 7.529 621 HG23 VAL 83 HG23 VAL 83 -2.951 -3.869 8.207 622 H VAL 84 H VAL 84 -1.096 -3.436 2.976 623 HA VAL 84 HA VAL 84 -3.221 -4.726 1.375 624 HB VAL 84 HB VAL 84 -2.251 -3.791 -0.685 625 HG11 VAL 84 HG11 VAL 84 -3.015 -1.669 1.330 626 HG12 VAL 84 HG12 VAL 84 -4.130 -2.627 0.356 627 HG13 VAL 84 HG13 VAL 84 -3.041 -1.480 -0.424 628 HG21 VAL 84 HG21 VAL 84 0.046 -3.461 0.072 629 HG22 VAL 84 HG22 VAL 84 -0.481 -2.187 1.173 630 HG23 VAL 84 HG23 VAL 84 -0.610 -1.955 -0.572 631 H PHE 85 H PHE 85 -2.196 -5.985 -0.540 632 HA PHE 85 HA PHE 85 -0.281 -7.849 0.530 633 HB2 PHE 85 HB2 PHE 85 -1.555 -7.642 -2.210 634 HB3 PHE 85 HB3 PHE 85 -0.498 -8.957 -1.715 635 HD1 PHE 85 HD1 PHE 85 -1.207 -10.328 0.337 636 HD2 PHE 85 HD2 PHE 85 -3.858 -7.769 -1.807 637 HE1 PHE 85 HE1 PHE 85 -3.131 -11.552 1.259 638 HE2 PHE 85 HE2 PHE 85 -5.784 -8.986 -0.880 639 HZ PHE 85 HZ PHE 85 -5.425 -10.880 0.653 640 H ALA 86 H ALA 86 1.845 -8.152 -0.023 641 HA ALA 86 HA ALA 86 3.191 -5.842 -1.162 642 HB1 ALA 86 HB1 ALA 86 3.975 -6.830 0.939 643 HB2 ALA 86 HB2 ALA 86 5.227 -6.853 -0.304 644 HB3 ALA 86 HB3 ALA 86 4.347 -8.330 0.093 645 H LYS 87 H LYS 87 3.863 -5.699 -3.209 646 HA LYS 87 HA LYS 87 4.817 -8.134 -4.588 647 HB2 LYS 87 HB2 LYS 87 3.244 -5.858 -5.823 648 HB3 LYS 87 HB3 LYS 87 4.090 -7.079 -6.752 649 HG2 LYS 87 HG2 LYS 87 2.621 -8.782 -5.589 650 HG3 LYS 87 HG3 LYS 87 1.664 -7.405 -5.017 651 HD2 LYS 87 HD2 LYS 87 1.372 -6.668 -7.360 652 HD3 LYS 87 HD3 LYS 87 2.268 -8.087 -7.905 653 HE2 LYS 87 HE2 LYS 87 0.536 -9.487 -6.754 654 HE3 LYS 87 HE3 LYS 87 -0.388 -8.014 -6.495 655 HZ1 LYS 87 HZ1 LYS 87 -0.405 -7.679 -8.912 656 HZ2 LYS 87 HZ2 LYS 87 -1.162 -9.126 -8.470 657 HZ3 LYS 87 HZ3 LYS 87 0.397 -9.152 -9.122 658 H LYS 88 H LYS 88 6.610 -7.922 -5.851 659 HA LYS 88 HA LYS 88 8.221 -5.551 -5.409 660 HB2 LYS 88 HB2 LYS 88 8.996 -8.052 -5.387 661 HB3 LYS 88 HB3 LYS 88 9.049 -7.871 -7.140 662 HG2 LYS 88 HG2 LYS 88 10.542 -5.920 -6.835 663 HG3 LYS 88 HG3 LYS 88 10.550 -6.257 -5.105 664 HD2 LYS 88 HD2 LYS 88 11.491 -8.169 -7.250 665 HD3 LYS 88 HD3 LYS 88 12.546 -7.150 -6.273 666 HE2 LYS 88 HE2 LYS 88 11.762 -8.293 -4.244 667 HE3 LYS 88 HE3 LYS 88 10.702 -9.302 -5.223 668 HZ1 LYS 88 HZ1 LYS 88 12.730 -10.469 -4.689 669 HZ2 LYS 88 HZ2 LYS 88 13.669 -9.234 -5.367 670 HZ3 LYS 88 HZ3 LYS 88 12.670 -10.176 -6.354 671 H GLY 89 H GLY 89 8.408 -3.900 -6.860 672 HA2 GLY 89 HA2 GLY 89 7.233 -4.328 -9.552 673 HA3 GLY 89 HA3 GLY 89 6.877 -2.907 -8.586 674 H ASP 90 H ASP 90 7.702 -2.457 -11.053 675 HA ASP 90 HA ASP 90 10.571 -2.209 -11.286 676 HB2 ASP 90 HB2 ASP 90 8.349 -1.163 -13.058 677 HB3 ASP 90 HB3 ASP 90 10.057 -1.255 -13.488 678 H VAL 91 H VAL 91 9.304 -0.693 -9.101 679 HA VAL 91 HA VAL 91 9.471 2.104 -9.924 680 HB VAL 91 HB VAL 91 8.745 2.588 -7.584 681 HG11 VAL 91 HG11 VAL 91 7.097 2.353 -9.381 682 HG12 VAL 91 HG12 VAL 91 6.454 1.754 -7.852 683 HG13 VAL 91 HG13 VAL 91 7.007 0.616 -9.082 684 HG21 VAL 91 HG21 VAL 91 8.016 0.755 -6.139 685 HG22 VAL 91 HG22 VAL 91 9.732 0.597 -6.514 686 HG23 VAL 91 HG23 VAL 91 8.553 -0.423 -7.337 687 HA PRO 92 HA PRO 92 13.610 2.714 -8.410 688 HB2 PRO 92 HB2 PRO 92 13.563 5.342 -7.748 689 HB3 PRO 92 HB3 PRO 92 13.508 4.782 -9.423 690 HG2 PRO 92 HG2 PRO 92 11.256 5.668 -7.651 691 HG3 PRO 92 HG3 PRO 92 11.571 6.077 -9.349 692 HD2 PRO 92 HD2 PRO 92 9.777 4.173 -8.607 693 HD3 PRO 92 HD3 PRO 92 10.695 4.084 -10.123 694 H LYS 93 H LYS 93 14.830 3.807 -6.505 695 HA LYS 93 HA LYS 93 14.110 2.447 -4.143 696 HB2 LYS 93 HB2 LYS 93 16.431 2.961 -4.715 697 HB3 LYS 93 HB3 LYS 93 16.105 4.684 -4.582 698 HG2 LYS 93 HG2 LYS 93 17.278 3.910 -2.623 699 HG3 LYS 93 HG3 LYS 93 15.638 4.393 -2.180 700 HD2 LYS 93 HD2 LYS 93 14.945 2.032 -2.232 701 HD3 LYS 93 HD3 LYS 93 16.597 1.566 -2.647 702 HE2 LYS 93 HE2 LYS 93 16.221 1.231 -0.290 703 HE3 LYS 93 HE3 LYS 93 17.378 2.542 -0.524 704 HZ1 LYS 93 HZ1 LYS 93 14.488 2.834 0.120 705 HZ2 LYS 93 HZ2 LYS 93 15.542 4.126 -0.189 706 HZ3 LYS 93 HZ3 LYS 93 15.785 3.142 1.163 707 H GLY 94 H GLY 94 13.210 3.117 -2.185 708 HA2 GLY 94 HA2 GLY 94 11.892 4.375 -0.784 709 HA3 GLY 94 HA3 GLY 94 12.784 5.768 -1.375 710 H MET 95 H MET 95 10.770 3.671 -3.364 711 HA MET 95 HA MET 95 8.614 5.615 -3.453 712 HB2 MET 95 HB2 MET 95 10.505 6.245 -5.093 713 HB3 MET 95 HB3 MET 95 10.016 4.829 -6.010 714 HG2 MET 95 HG2 MET 95 7.833 5.751 -6.357 715 HG3 MET 95 HG3 MET 95 8.205 7.119 -5.308 716 HE1 MET 95 HE1 MET 95 8.174 9.038 -8.651 717 HE2 MET 95 HE2 MET 95 7.635 8.983 -6.972 718 HE3 MET 95 HE3 MET 95 7.051 7.785 -8.126 719 H ILE 96 H ILE 96 6.661 4.646 -3.938 720 HA ILE 96 HA ILE 96 6.677 1.911 -5.027 721 HB ILE 96 HB ILE 96 5.007 1.163 -3.366 722 HG12 ILE 96 HG12 ILE 96 5.628 3.768 -1.932 723 HG13 ILE 96 HG13 ILE 96 4.114 3.395 -2.749 724 HG21 ILE 96 HG21 ILE 96 7.372 0.636 -3.024 725 HG22 ILE 96 HG22 ILE 96 6.541 0.854 -1.485 726 HG23 ILE 96 HG23 ILE 96 7.583 2.130 -2.113 727 HD11 ILE 96 HD11 ILE 96 5.228 1.967 -0.344 728 HD12 ILE 96 HD12 ILE 96 3.718 1.576 -1.169 729 HD13 ILE 96 HD13 ILE 96 3.903 3.131 -0.358 730 H PHE 97 H PHE 97 4.833 1.304 -6.160 731 HA PHE 97 HA PHE 97 2.917 3.484 -6.718 732 HB2 PHE 97 HB2 PHE 97 4.133 2.871 -8.716 733 HB3 PHE 97 HB3 PHE 97 3.792 1.162 -8.461 734 HD1 PHE 97 HD2 PHE 97 2.315 4.409 -9.414 735 HD2 PHE 97 HD1 PHE 97 1.700 0.201 -9.119 736 HE1 PHE 97 HE2 PHE 97 0.254 4.615 -10.742 737 HE2 PHE 97 HE1 PHE 97 -0.365 0.408 -10.441 738 HZ PHE 97 HZ PHE 97 -1.087 2.617 -11.254 739 H ILE 98 H ILE 98 0.784 3.178 -6.393 740 HA ILE 98 HA ILE 98 -0.178 0.429 -5.879 741 HB ILE 98 HB ILE 98 -1.162 2.940 -4.489 742 HG12 ILE 98 HG12 ILE 98 0.497 0.623 -3.441 743 HG13 ILE 98 HG13 ILE 98 1.039 2.285 -3.641 744 HG21 ILE 98 HG21 ILE 98 -1.955 0.050 -4.072 745 HG22 ILE 98 HG22 ILE 98 -2.941 1.288 -4.852 746 HG23 ILE 98 HG23 ILE 98 -2.540 1.430 -3.142 747 HD11 ILE 98 HD11 ILE 98 0.581 1.787 -1.321 748 HD12 ILE 98 HD12 ILE 98 -1.073 1.329 -1.725 749 HD13 ILE 98 HD13 ILE 98 -0.545 3.000 -1.926 750 HA PRO 99 HA PRO 99 -3.043 1.217 -9.278 751 HB2 PRO 99 HB2 PRO 99 -4.735 -0.620 -7.632 752 HB3 PRO 99 HB3 PRO 99 -4.377 -0.674 -9.361 753 HG2 PRO 99 HG2 PRO 99 -3.176 -2.357 -7.687 754 HG3 PRO 99 HG3 PRO 99 -2.270 -1.620 -9.025 755 HD2 PRO 99 HD2 PRO 99 -2.221 -0.967 -6.108 756 HD3 PRO 99 HD3 PRO 99 -0.898 -0.944 -7.292 757 H MET 100 H MET 100 -4.757 2.646 -9.577 758 HA MET 100 HA MET 100 -5.465 4.383 -7.483 759 HB2 MET 100 HB2 MET 100 -5.668 4.575 -10.130 760 HB3 MET 100 HB3 MET 100 -7.318 4.071 -9.808 761 HG2 MET 100 HG2 MET 100 -5.922 6.528 -8.777 762 HG3 MET 100 HG3 MET 100 -7.234 6.454 -9.945 763 HE1 MET 100 HE1 MET 100 -7.572 6.497 -5.390 764 HE2 MET 100 HE2 MET 100 -6.337 7.241 -6.406 765 HE3 MET 100 HE3 MET 100 -6.342 5.496 -6.157 766 H GLY 101 H GLY 101 -6.531 3.698 -5.681 767 HA2 GLY 101 HA2 GLY 101 -9.256 2.787 -5.937 768 HA3 GLY 101 HA3 GLY 101 -8.182 1.496 -5.427 769 HA PRO 102 HA PRO 102 -9.998 4.001 -1.795 770 HB2 PRO 102 HB2 PRO 102 -10.771 1.729 -0.402 771 HB3 PRO 102 HB3 PRO 102 -11.825 2.669 -1.463 772 HG2 PRO 102 HG2 PRO 102 -10.300 0.158 -2.049 773 HG3 PRO 102 HG3 PRO 102 -11.955 0.599 -2.512 774 HD2 PRO 102 HD2 PRO 102 -9.948 0.760 -4.272 775 HD3 PRO 102 HD3 PRO 102 -11.234 1.985 -4.245 776 H TYR 103 H TYR 103 -8.051 1.039 -1.886 777 HA TYR 103 HA TYR 103 -6.841 1.249 0.634 778 HB2 TYR 103 HB2 TYR 103 -5.756 0.060 -1.937 779 HB3 TYR 103 HB3 TYR 103 -5.047 -0.190 -0.343 780 HD1 TYR 103 HD2 TYR 103 -8.158 -0.719 -2.315 781 HD2 TYR 103 HD1 TYR 103 -5.866 -1.896 1.076 782 HE1 TYR 103 HE2 TYR 103 -9.710 -2.581 -1.918 783 HE2 TYR 103 HE1 TYR 103 -7.410 -3.763 1.481 784 HH TYR 103 HH TYR 103 -9.475 -4.949 -0.697 785 H ALA 104 H ALA 104 -5.663 2.389 -2.531 786 HA ALA 104 HA ALA 104 -3.469 3.858 -1.533 787 HB1 ALA 104 HB1 ALA 104 -3.442 4.943 -3.723 788 HB2 ALA 104 HB2 ALA 104 -5.050 4.304 -4.072 789 HB3 ALA 104 HB3 ALA 104 -3.685 3.203 -3.888 790 H ASN 105 H ASN 105 -6.848 4.706 -2.098 791 HA ASN 105 HA ASN 105 -6.773 7.460 -1.689 792 HB2 ASN 105 HB2 ASN 105 -8.768 6.453 -2.523 793 HB3 ASN 105 HB3 ASN 105 -8.901 5.389 -1.130 794 HD21 ASN 105 HD21 ASN 105 -9.749 6.172 0.767 795 HD22 ASN 105 HD22 ASN 105 -10.590 7.675 0.858 796 H MET 106 H MET 106 -6.306 4.917 0.602 797 HA MET 106 HA MET 106 -6.935 6.380 2.981 798 HB2 MET 106 HB2 MET 106 -5.150 3.970 2.566 799 HB3 MET 106 HB3 MET 106 -5.694 4.567 4.128 800 HG2 MET 106 HG2 MET 106 -7.555 3.649 1.954 801 HG3 MET 106 HG3 MET 106 -6.947 2.604 3.235 802 HE1 MET 106 HE1 MET 106 -7.780 2.574 5.644 803 HE2 MET 106 HE2 MET 106 -8.597 3.930 6.423 804 HE3 MET 106 HE3 MET 106 -6.943 4.115 5.839 805 H VAL 107 H VAL 107 -4.214 6.374 0.841 806 HA VAL 107 HA VAL 107 -2.587 7.797 2.859 807 HB VAL 107 HB VAL 107 -0.554 6.678 1.973 808 HG11 VAL 107 HG11 VAL 107 -1.595 5.872 4.024 809 HG12 VAL 107 HG12 VAL 107 -0.918 4.527 3.108 810 HG13 VAL 107 HG13 VAL 107 -2.657 4.816 3.093 811 HG21 VAL 107 HG21 VAL 107 -0.790 4.635 0.628 812 HG22 VAL 107 HG22 VAL 107 -1.392 6.050 -0.235 813 HG23 VAL 107 HG23 VAL 107 -2.527 4.920 0.502 814 H ILE 108 H ILE 108 -3.886 7.896 -0.256 815 HA ILE 108 HA ILE 108 -1.838 9.804 -1.177 816 HB ILE 108 HB ILE 108 -2.515 9.507 -3.384 817 HG12 ILE 108 HG12 ILE 108 -4.925 7.880 -2.572 818 HG13 ILE 108 HG13 ILE 108 -5.005 9.628 -2.805 819 HG21 ILE 108 HG21 ILE 108 -2.567 7.018 -3.741 820 HG22 ILE 108 HG22 ILE 108 -2.661 6.842 -1.988 821 HG23 ILE 108 HG23 ILE 108 -1.249 7.605 -2.720 822 HD11 ILE 108 HD11 ILE 108 -4.269 7.554 -4.829 823 HD12 ILE 108 HD12 ILE 108 -4.079 9.290 -5.075 824 HD13 ILE 108 HD13 ILE 108 -5.688 8.603 -4.818 825 H ASP 109 H ASP 109 -2.986 11.491 -2.777 826 HA ASP 109 HA ASP 109 -5.131 12.790 -1.241 827 HB2 ASP 109 HB2 ASP 109 -3.147 14.166 -1.473 828 HB3 ASP 109 HB3 ASP 109 -3.147 13.936 -3.222 829 HA PRO 110 HA PRO 110 -7.661 11.656 -4.804 830 HB2 PRO 110 HB2 PRO 110 -9.980 12.530 -3.327 831 HB3 PRO 110 HB3 PRO 110 -9.450 10.881 -3.654 832 HG2 PRO 110 HG2 PRO 110 -9.465 12.037 -1.153 833 HG3 PRO 110 HG3 PRO 110 -8.426 10.678 -1.616 834 HD2 PRO 110 HD2 PRO 110 -7.763 13.599 -1.430 835 HD3 PRO 110 HD3 PRO 110 -6.791 12.187 -0.951 836 H SER 111 H SER 111 -6.990 14.727 -3.658 837 HA SER 111 HA SER 111 -9.064 16.152 -5.113 838 HB2 SER 111 HB2 SER 111 -8.321 17.108 -3.013 839 HB3 SER 111 HB3 SER 111 -6.650 17.148 -3.574 840 HG SER 111 HG SER 111 -8.670 18.508 -5.006 841 H THR 112 H THR 112 -5.578 15.567 -5.457 842 HA THR 112 HA THR 112 -5.007 17.356 -7.508 843 HB THR 112 HB THR 112 -3.240 16.183 -6.331 844 HG1 THR 112 HG1 THR 112 -1.919 15.991 -8.076 845 HG21 THR 112 HG21 THR 112 -4.299 13.986 -6.082 846 HG22 THR 112 HG22 THR 112 -2.703 13.833 -6.817 847 HG23 THR 112 HG23 THR 112 -4.149 13.707 -7.819 848 H ASP 113 H ASP 113 -5.089 17.357 -9.699 849 HA ASP 113 HA ASP 113 -5.823 16.950 -11.788 850 HB2 ASP 113 HB2 ASP 113 -4.242 15.127 -11.773 851 HB3 ASP 113 HB3 ASP 113 -5.391 14.074 -10.954 852 H GLY 114 H GLY 114 -7.373 13.952 -10.697 853 HA2 GLY 114 HA2 GLY 114 -9.556 13.258 -10.925 854 HA3 GLY 114 HA3 GLY 114 -9.997 14.866 -10.374 855 H THR 115 H THR 115 -8.151 14.414 -13.295 856 HA THR 115 HA THR 115 -10.513 15.073 -14.933 857 HB THR 115 HB THR 115 -7.835 16.482 -15.128 858 HG1 THR 115 HG1 THR 115 -8.905 18.245 -14.291 859 HG21 THR 115 HG21 THR 115 -8.931 17.900 -16.812 860 HG22 THR 115 HG22 THR 115 -10.385 16.907 -16.704 861 HG23 THR 115 HG23 THR 115 -8.888 16.213 -17.327 862 H GLY 116 H GLY 116 -7.027 14.232 -15.151 863 HA2 GLY 116 HA2 GLY 116 -6.873 11.874 -16.216 864 HA3 GLY 116 HA3 GLY 116 -7.645 12.664 -17.579 865 H MET 117 H MET 117 -5.026 13.862 -15.460 866 HA MET 117 HA MET 117 -3.345 14.127 -17.860 867 HB2 MET 117 HB2 MET 117 -3.434 15.588 -15.249 868 HB3 MET 117 HB3 MET 117 -1.933 15.566 -16.170 869 HG2 MET 117 HG2 MET 117 -3.307 17.555 -16.629 870 HG3 MET 117 HG3 MET 117 -3.017 16.574 -18.064 871 HE1 MET 117 HE1 MET 117 -6.532 17.770 -18.998 872 HE2 MET 117 HE2 MET 117 -4.890 17.438 -19.546 873 HE3 MET 117 HE3 MET 117 -5.179 18.692 -18.338 874 HA PRO 118 HA PRO 118 -0.761 10.845 -16.382 875 HB2 PRO 118 HB2 PRO 118 1.154 10.950 -18.239 876 HB3 PRO 118 HB3 PRO 118 -0.513 10.555 -18.678 877 HG2 PRO 118 HG2 PRO 118 0.954 13.154 -18.957 878 HG3 PRO 118 HG3 PRO 118 -0.139 12.360 -20.106 879 HD2 PRO 118 HD2 PRO 118 -0.873 14.405 -18.382 880 HD3 PRO 118 HD3 PRO 118 -2.002 13.246 -19.112 881 H GLN 119 H GLN 119 -0.378 12.988 -14.648 882 HA GLN 119 HA GLN 119 2.392 13.798 -14.622 883 HB2 GLN 119 HB2 GLN 119 0.668 15.253 -13.644 884 HB3 GLN 119 HB3 GLN 119 0.281 14.014 -12.456 885 HG2 GLN 119 HG2 GLN 119 2.564 14.202 -11.541 886 HG3 GLN 119 HG3 GLN 119 2.907 15.482 -12.704 887 HE21 GLN 119 HE21 GLN 119 1.207 14.633 -9.808 888 HE22 GLN 119 HE22 GLN 119 0.778 16.239 -9.342 889 H PHE 120 H PHE 120 4.072 12.715 -13.780 890 HA PHE 120 HA PHE 120 3.607 10.230 -12.344 891 HB2 PHE 120 HB2 PHE 120 6.018 11.494 -13.610 892 HB3 PHE 120 HB3 PHE 120 6.223 10.183 -12.453 893 HD1 PHE 120 HD2 PHE 120 4.656 11.085 -15.691 894 HD2 PHE 120 HD1 PHE 120 5.823 7.942 -13.056 895 HE1 PHE 120 HE2 PHE 120 4.192 9.437 -17.455 896 HE2 PHE 120 HE1 PHE 120 5.354 6.292 -14.823 897 HZ PHE 120 HZ PHE 120 4.538 7.038 -17.022 898 H LYS 121 H LYS 121 5.230 9.744 -10.516 899 HA LYS 121 HA LYS 121 5.672 9.993 -8.319 900 HB2 LYS 121 HB2 LYS 121 5.785 12.923 -9.032 901 HB3 LYS 121 HB3 LYS 121 6.084 12.324 -7.404 902 HG2 LYS 121 HG2 LYS 121 7.811 10.765 -8.611 903 HG3 LYS 121 HG3 LYS 121 7.719 11.987 -9.879 904 HD2 LYS 121 HD2 LYS 121 8.467 13.701 -8.395 905 HD3 LYS 121 HD3 LYS 121 8.287 12.646 -6.990 906 HE2 LYS 121 HE2 LYS 121 10.054 11.167 -7.980 907 HE3 LYS 121 HE3 LYS 121 10.299 12.390 -9.226 908 HZ1 LYS 121 HZ1 LYS 121 10.610 12.876 -6.313 909 HZ2 LYS 121 HZ2 LYS 121 10.977 13.956 -7.563 910 HZ3 LYS 121 HZ3 LYS 121 11.882 12.539 -7.373 911 H GLY 122 H GLY 122 4.680 10.836 -6.208 912 HA2 GLY 122 HA2 GLY 122 1.823 11.404 -6.559 913 HA3 GLY 122 HA3 GLY 122 2.259 9.856 -5.860 914 H VAL 123 H VAL 123 1.619 9.997 -3.803 915 HA VAL 123 HA VAL 123 2.257 12.413 -2.239 916 HB VAL 123 HB VAL 123 0.509 10.058 -1.499 917 HG11 VAL 123 HG11 VAL 123 0.857 12.745 -0.159 918 HG12 VAL 123 HG12 VAL 123 1.401 11.185 0.462 919 HG13 VAL 123 HG13 VAL 123 -0.324 11.516 0.300 920 HG21 VAL 123 HG21 VAL 123 -0.455 11.235 -3.382 921 HG22 VAL 123 HG22 VAL 123 -0.243 12.784 -2.565 922 HG23 VAL 123 HG23 VAL 123 -1.385 11.601 -1.929 923 H LYS 124 H LYS 124 4.056 12.389 -1.009 924 HA LYS 124 HA LYS 124 5.552 9.993 -0.565 925 HB2 LYS 124 HB2 LYS 124 5.937 12.788 0.522 926 HB3 LYS 124 HB3 LYS 124 7.078 11.468 0.757 927 HG2 LYS 124 HG2 LYS 124 7.275 11.300 -1.730 928 HG3 LYS 124 HG3 LYS 124 6.285 12.754 -1.852 929 HD2 LYS 124 HD2 LYS 124 8.941 12.553 -0.419 930 HD3 LYS 124 HD3 LYS 124 8.695 13.240 -2.023 931 HE2 LYS 124 HE2 LYS 124 7.246 14.966 -1.068 932 HE3 LYS 124 HE3 LYS 124 7.474 14.275 0.540 933 HZ1 LYS 124 HZ1 LYS 124 8.926 16.164 0.180 934 HZ2 LYS 124 HZ2 LYS 124 9.606 15.423 -1.177 935 HZ3 LYS 124 HZ3 LYS 124 9.840 14.751 0.356 936 H GLY 125 H GLY 125 6.220 9.130 1.476 937 HA2 GLY 125 HA2 GLY 125 5.116 9.756 3.971 938 HA3 GLY 125 HA3 GLY 125 4.075 8.560 3.214 939 H THR 126 H THR 126 4.476 6.703 4.285 940 HA THR 126 HA THR 126 7.244 5.696 4.354 941 HB THR 126 HB THR 126 6.923 4.854 6.681 942 HG1 THR 126 HG1 THR 126 4.530 6.367 6.444 943 HG21 THR 126 HG21 THR 126 6.715 7.858 6.387 944 HG22 THR 126 HG22 THR 126 8.201 6.908 6.331 945 HG23 THR 126 HG23 THR 126 7.271 7.005 7.827 946 H VAL 127 H VAL 127 7.444 3.420 4.549 947 HA VAL 127 HA VAL 127 4.977 1.824 4.391 948 HB VAL 127 HB VAL 127 5.927 2.098 2.098 949 HG11 VAL 127 HG11 VAL 127 8.016 0.949 1.513 950 HG12 VAL 127 HG12 VAL 127 8.289 0.583 3.216 951 HG13 VAL 127 HG13 VAL 127 8.289 2.258 2.662 952 HG21 VAL 127 HG21 VAL 127 4.591 0.124 2.672 953 HG22 VAL 127 HG22 VAL 127 6.055 -0.722 3.179 954 HG23 VAL 127 HG23 VAL 127 5.839 -0.268 1.488 955 H GLU 128 H GLU 128 5.128 -0.269 5.263 956 HA GLU 128 HA GLU 128 7.608 -1.151 6.520 957 HB2 GLU 128 HB2 GLU 128 6.454 -1.364 8.755 958 HB3 GLU 128 HB3 GLU 128 6.769 0.293 8.250 959 HG2 GLU 128 HG2 GLU 128 4.459 0.540 7.530 960 HG3 GLU 128 HG3 GLU 128 4.125 -1.134 7.965 961 H LYS 129 H LYS 129 7.448 -3.360 7.389 962 HA LYS 129 HA LYS 129 5.384 -4.992 6.135 963 HB2 LYS 129 HB2 LYS 129 7.667 -5.870 6.169 964 HB3 LYS 129 HB3 LYS 129 7.715 -5.751 7.925 965 HG2 LYS 129 HG2 LYS 129 5.666 -7.347 7.851 966 HG3 LYS 129 HG3 LYS 129 6.196 -7.687 6.203 967 HD2 LYS 129 HD2 LYS 129 8.004 -7.920 8.607 968 HD3 LYS 129 HD3 LYS 129 7.044 -9.262 7.990 969 HE2 LYS 129 HE2 LYS 129 9.008 -7.735 6.298 970 HE3 LYS 129 HE3 LYS 129 9.449 -9.167 7.225 971 HZ1 LYS 129 HZ1 LYS 129 8.943 -9.803 5.001 972 HZ2 LYS 129 HZ2 LYS 129 7.450 -9.010 5.036 973 HZ3 LYS 129 HZ3 LYS 129 7.703 -10.377 5.994 974 H THR 130 H THR 130 3.715 -6.039 7.223 975 HA THR 130 HA THR 130 3.649 -5.820 10.151 976 HB THR 130 HB THR 130 2.318 -3.902 9.426 977 HG1 THR 130 HG1 THR 130 0.748 -4.336 10.838 978 HG21 THR 130 HG21 THR 130 0.537 -5.882 7.992 979 HG22 THR 130 HG22 THR 130 1.652 -4.770 7.198 980 HG23 THR 130 HG23 THR 130 0.287 -4.137 8.122 981 H ASP 131 H ASP 131 2.670 -7.458 11.203 982 HA ASP 131 HA ASP 131 2.079 -9.885 9.788 983 HB2 ASP 131 HB2 ASP 131 1.440 -10.667 12.149 984 HB3 ASP 131 HB3 ASP 131 3.108 -10.155 11.907 985 H GLU 132 H GLU 132 0.297 -7.134 10.533 986 HA GLU 132 HA GLU 132 -2.271 -8.141 11.049 987 HB2 GLU 132 HB2 GLU 132 -1.275 -5.565 9.846 988 HB3 GLU 132 HB3 GLU 132 -2.996 -5.893 9.996 989 HG2 GLU 132 HG2 GLU 132 -1.068 -5.935 12.310 990 HG3 GLU 132 HG3 GLU 132 -2.030 -4.532 11.843 991 H LYS 133 H LYS 133 -4.100 -8.315 9.688 992 HA LYS 133 HA LYS 133 -3.529 -9.463 7.103 993 HB2 LYS 133 HB2 LYS 133 -5.987 -9.857 7.005 994 HB3 LYS 133 HB3 LYS 133 -5.225 -10.531 8.439 995 HG2 LYS 133 HG2 LYS 133 -6.093 -8.818 9.827 996 HG3 LYS 133 HG3 LYS 133 -6.603 -7.852 8.443 997 HD2 LYS 133 HD2 LYS 133 -7.707 -10.596 9.008 998 HD3 LYS 133 HD3 LYS 133 -8.423 -9.127 9.673 999 HE2 LYS 133 HE2 LYS 133 -8.804 -8.268 7.430 1000 HE3 LYS 133 HE3 LYS 133 -8.020 -9.689 6.734 1001 HZ1 LYS 133 HZ1 LYS 133 -10.431 -9.850 8.451 1002 HZ2 LYS 133 HZ2 LYS 133 -9.767 -11.068 7.481 1003 HZ3 LYS 133 HZ3 LYS 133 -10.507 -9.725 6.768 1004 H VAL 134 H VAL 134 -4.748 -8.873 5.167 1005 HA VAL 134 HA VAL 134 -4.537 -6.061 4.619 1006 HB VAL 134 HB VAL 134 -5.513 -8.358 2.899 1007 HG11 VAL 134 HG11 VAL 134 -4.968 -5.486 2.122 1008 HG12 VAL 134 HG12 VAL 134 -6.536 -6.295 2.116 1009 HG13 VAL 134 HG13 VAL 134 -5.276 -6.805 0.991 1010 HG21 VAL 134 HG21 VAL 134 -3.342 -8.081 1.763 1011 HG22 VAL 134 HG22 VAL 134 -3.150 -8.509 3.464 1012 HG23 VAL 134 HG23 VAL 134 -2.897 -6.844 2.937 1013 H LEU 135 H LEU 135 -6.132 -4.562 4.431 1014 HA LEU 135 HA LEU 135 -8.642 -4.975 5.630 1015 HB2 LEU 135 HB2 LEU 135 -7.486 -2.812 3.911 1016 HB3 LEU 135 HB3 LEU 135 -9.206 -2.782 4.258 1017 HG LEU 135 HG LEU 135 -6.997 -2.738 6.328 1018 HD11 LEU 135 HD11 LEU 135 -7.693 -0.437 6.723 1019 HD12 LEU 135 HD12 LEU 135 -8.880 -0.557 5.424 1020 HD13 LEU 135 HD13 LEU 135 -7.157 -0.647 5.056 1021 HD21 LEU 135 HD21 LEU 135 -8.946 -3.860 7.204 1022 HD22 LEU 135 HD22 LEU 135 -10.003 -2.583 6.601 1023 HD23 LEU 135 HD23 LEU 135 -8.854 -2.241 7.899 1024 H SER 136 H SER 136 -10.542 -5.777 4.882 1025 HA SER 136 HA SER 136 -10.874 -6.521 2.113 1026 HB2 SER 136 HB2 SER 136 -11.982 -7.750 4.023 1027 HB3 SER 136 HB3 SER 136 -13.021 -6.345 4.258 1028 HG SER 136 HG SER 136 -13.062 -8.291 2.287 1029 H VAL 137 H VAL 137 -12.211 -5.482 0.578 1030 HA VAL 137 HA VAL 137 -11.959 -2.754 0.401 1031 HB VAL 137 HB VAL 137 -14.176 -4.365 -0.892 1032 HG11 VAL 137 HG11 VAL 137 -14.039 -2.640 -2.661 1033 HG12 VAL 137 HG12 VAL 137 -12.887 -1.746 -1.667 1034 HG13 VAL 137 HG13 VAL 137 -14.541 -1.981 -1.104 1035 HG21 VAL 137 HG21 VAL 137 -12.010 -5.400 -1.320 1036 HG22 VAL 137 HG22 VAL 137 -11.346 -3.848 -1.831 1037 HG23 VAL 137 HG23 VAL 137 -12.610 -4.624 -2.787 1038 H LYS 138 H LYS 138 -14.746 -4.538 1.642 1039 HA LYS 138 HA LYS 138 -16.340 -2.243 2.219 1040 HB2 LYS 138 HB2 LYS 138 -17.252 -4.519 1.887 1041 HB3 LYS 138 HB3 LYS 138 -16.485 -5.035 3.384 1042 HG2 LYS 138 HG2 LYS 138 -17.865 -3.377 4.614 1043 HG3 LYS 138 HG3 LYS 138 -18.685 -2.989 3.098 1044 HD2 LYS 138 HD2 LYS 138 -18.638 -5.681 4.474 1045 HD3 LYS 138 HD3 LYS 138 -20.004 -4.566 4.404 1046 HE2 LYS 138 HE2 LYS 138 -20.079 -4.807 1.966 1047 HE3 LYS 138 HE3 LYS 138 -18.711 -5.920 2.030 1048 HZ1 LYS 138 HZ1 LYS 138 -20.761 -7.133 1.874 1049 HZ2 LYS 138 HZ2 LYS 138 -21.389 -6.350 3.235 1050 HZ3 LYS 138 HZ3 LYS 138 -20.076 -7.403 3.396 1051 H GLU 139 H GLU 139 -14.120 -4.233 4.174 1052 HA GLU 139 HA GLU 139 -14.590 -3.094 6.694 1053 HB2 GLU 139 HB2 GLU 139 -13.267 -5.160 6.267 1054 HB3 GLU 139 HB3 GLU 139 -11.992 -4.180 5.561 1055 HG2 GLU 139 HG2 GLU 139 -11.295 -4.701 7.743 1056 HG3 GLU 139 HG3 GLU 139 -11.804 -3.014 7.786 1057 H LEU 140 H LEU 140 -12.512 -2.145 4.034 1058 HA LEU 140 HA LEU 140 -11.142 -0.010 5.218 1059 HB2 LEU 140 HB2 LEU 140 -10.899 -1.289 2.931 1060 HB3 LEU 140 HB3 LEU 140 -11.927 -0.001 2.329 1061 HG LEU 140 HG LEU 140 -9.417 0.622 3.848 1062 HD11 LEU 140 HD11 LEU 140 -9.617 0.149 0.880 1063 HD12 LEU 140 HD12 LEU 140 -8.802 -0.900 2.039 1064 HD13 LEU 140 HD13 LEU 140 -8.201 0.733 1.758 1065 HD21 LEU 140 HD21 LEU 140 -9.508 2.677 2.525 1066 HD22 LEU 140 HD22 LEU 140 -10.972 2.448 3.479 1067 HD23 LEU 140 HD23 LEU 140 -10.987 2.111 1.746 1068 H LEU 141 H LEU 141 -14.297 -0.156 3.573 1069 HA LEU 141 HA LEU 141 -14.882 2.596 3.541 1070 HB2 LEU 141 HB2 LEU 141 -16.906 0.400 4.018 1071 HB3 LEU 141 HB3 LEU 141 -17.199 1.979 3.314 1072 HG LEU 141 HG LEU 141 -15.656 -0.290 2.045 1073 HD11 LEU 141 HD11 LEU 141 -18.082 -0.615 2.073 1074 HD12 LEU 141 HD12 LEU 141 -17.477 -0.353 0.438 1075 HD13 LEU 141 HD13 LEU 141 -18.304 0.953 1.292 1076 HD21 LEU 141 HD21 LEU 141 -14.650 1.824 1.418 1077 HD22 LEU 141 HD22 LEU 141 -16.231 2.477 0.983 1078 HD23 LEU 141 HD23 LEU 141 -15.539 1.144 0.057 1079 H GLU 142 H GLU 142 -15.384 0.128 6.013 1080 HA GLU 142 HA GLU 142 -16.633 1.820 7.935 1081 HB2 GLU 142 HB2 GLU 142 -15.169 -0.807 8.297 1082 HB3 GLU 142 HB3 GLU 142 -16.194 -0.041 9.506 1083 HG2 GLU 142 HG2 GLU 142 -18.125 -0.267 8.048 1084 HG3 GLU 142 HG3 GLU 142 -17.115 -0.976 6.790 1085 H ALA 143 H ALA 143 -13.296 1.070 7.183 1086 HA ALA 143 HA ALA 143 -12.111 2.076 9.555 1087 HB1 ALA 143 HB1 ALA 143 -10.923 1.854 6.787 1088 HB2 ALA 143 HB2 ALA 143 -10.921 0.591 8.018 1089 HB3 ALA 143 HB3 ALA 143 -10.023 2.085 8.287 1090 H ILE 144 H ILE 144 -12.781 3.619 6.400 1091 HA ILE 144 HA ILE 144 -11.679 6.142 7.224 1092 HB ILE 144 HB ILE 144 -12.602 7.043 5.121 1093 HG12 ILE 144 HG12 ILE 144 -13.491 5.111 3.530 1094 HG13 ILE 144 HG13 ILE 144 -13.985 4.379 5.048 1095 HG21 ILE 144 HG21 ILE 144 -10.417 5.982 5.133 1096 HG22 ILE 144 HG22 ILE 144 -11.240 5.672 3.604 1097 HG23 ILE 144 HG23 ILE 144 -11.155 4.407 4.834 1098 HD11 ILE 144 HD11 ILE 144 -15.796 5.615 3.993 1099 HD12 ILE 144 HD12 ILE 144 -14.835 7.092 4.056 1100 HD13 ILE 144 HD13 ILE 144 -15.364 6.318 5.552 1101 H GLY 145 H GLY 145 -14.553 4.625 8.001 1102 HA2 GLY 145 HA2 GLY 145 -15.805 5.933 9.749 1103 HA3 GLY 145 HA3 GLY 145 -15.908 7.208 8.545 1104 H SER 146 H SER 146 -16.842 6.300 6.353 1105 HA SER 146 HA SER 146 -19.174 4.573 6.959 1106 HB2 SER 146 HB2 SER 146 -20.533 5.973 5.452 1107 HB3 SER 146 HB3 SER 146 -19.879 6.930 6.783 1108 HG SER 146 HG SER 146 -19.243 8.167 5.193 Start of MODEL 18 1 H1 MET 1 H1 MET 1 -22.053 -35.556 44.777 2 H2 MET 1 H2 MET 1 -21.589 -35.242 46.371 3 H3 MET 1 H3 MET 1 -22.916 -36.245 46.063 4 HA MET 1 HA MET 1 -21.029 -37.568 46.694 5 HB2 MET 1 HB2 MET 1 -21.675 -37.788 43.745 6 HB3 MET 1 HB3 MET 1 -20.937 -39.054 44.717 7 HG2 MET 1 HG2 MET 1 -23.310 -39.462 44.381 8 HG3 MET 1 HG3 MET 1 -22.948 -39.197 46.085 9 HE1 MET 1 HE1 MET 1 -25.903 -39.054 44.700 10 HE2 MET 1 HE2 MET 1 -26.568 -37.684 45.590 11 HE3 MET 1 HE3 MET 1 -25.609 -38.898 46.433 12 H GLY 2 H GLY 2 -18.924 -37.205 47.091 13 HA2 GLY 2 HA2 GLY 2 -17.276 -35.633 45.307 14 HA3 GLY 2 HA3 GLY 2 -16.779 -36.357 46.828 15 H SER 3 H SER 3 -17.385 -37.048 43.410 16 HA SER 3 HA SER 3 -16.010 -39.613 43.564 17 HB2 SER 3 HB2 SER 3 -16.586 -39.790 41.152 18 HB3 SER 3 HB3 SER 3 -17.997 -39.467 42.158 19 HG SER 3 HG SER 3 -17.969 -38.147 40.298 20 H SER 4 H SER 4 -14.338 -40.119 41.855 21 HA SER 4 HA SER 4 -12.125 -38.362 42.193 22 HB2 SER 4 HB2 SER 4 -12.424 -40.797 40.417 23 HB3 SER 4 HB3 SER 4 -10.899 -39.974 40.747 24 HG SER 4 HG SER 4 -10.879 -41.446 42.291 25 H HIS 5 H HIS 5 -11.491 -36.678 41.010 26 HA HIS 5 HA HIS 5 -12.166 -36.578 38.144 27 HB2 HIS 5 HB2 HIS 5 -13.738 -35.121 39.425 28 HB3 HIS 5 HB3 HIS 5 -12.359 -34.207 40.029 29 HD1 HIS 5 HD1 HIS 5 -11.024 -32.783 38.231 30 HD2 HIS 5 HD2 HIS 5 -14.608 -34.407 36.885 31 HE1 HIS 5 HE1 HIS 5 -11.571 -31.547 36.119 32 HE2 HIS 5 HE2 HIS 5 -13.687 -32.604 35.271 33 H HIS 6 H HIS 6 -10.248 -36.705 37.143 34 HA HIS 6 HA HIS 6 -7.792 -35.835 38.313 35 HB2 HIS 6 HB2 HIS 6 -6.805 -36.345 36.064 36 HB3 HIS 6 HB3 HIS 6 -7.708 -37.676 36.778 37 HD1 HIS 6 HD1 HIS 6 -8.652 -34.788 34.451 38 HD2 HIS 6 HD2 HIS 6 -9.151 -38.895 34.867 39 HE1 HIS 6 HE1 HIS 6 -10.033 -35.502 32.485 40 HE2 HIS 6 HE2 HIS 6 -10.452 -37.952 32.844 41 H HIS 7 H HIS 7 -6.445 -34.110 37.758 42 HA HIS 7 HA HIS 7 -7.572 -31.993 36.061 43 HB2 HIS 7 HB2 HIS 7 -8.249 -31.534 38.404 44 HB3 HIS 7 HB3 HIS 7 -6.557 -31.541 38.882 45 HD1 HIS 7 HD1 HIS 7 -5.614 -29.284 39.089 46 HD2 HIS 7 HD2 HIS 7 -8.669 -29.393 36.279 47 HE1 HIS 7 HE1 HIS 7 -5.877 -26.920 38.297 48 HE2 HIS 7 HE2 HIS 7 -7.811 -26.986 36.693 49 H HIS 8 H HIS 8 -6.006 -32.282 34.515 50 HA HIS 8 HA HIS 8 -3.165 -32.200 35.266 51 HB2 HIS 8 HB2 HIS 8 -4.162 -33.921 33.654 52 HB3 HIS 8 HB3 HIS 8 -4.342 -32.606 32.502 53 HD1 HIS 8 HD1 HIS 8 -1.863 -34.923 33.965 54 HD2 HIS 8 HD2 HIS 8 -1.875 -31.615 31.450 55 HE1 HIS 8 HE1 HIS 8 0.389 -34.914 32.861 56 HE2 HIS 8 HE2 HIS 8 0.310 -32.988 31.244 57 H HIS 9 H HIS 9 -2.058 -30.295 35.172 58 HA HIS 9 HA HIS 9 -3.430 -27.934 34.403 59 HB2 HIS 9 HB2 HIS 9 -1.250 -26.756 34.891 60 HB3 HIS 9 HB3 HIS 9 -1.940 -27.697 36.204 61 HD1 HIS 9 HD1 HIS 9 0.877 -27.841 33.677 62 HD2 HIS 9 HD2 HIS 9 -0.297 -29.595 37.252 63 HE1 HIS 9 HE1 HIS 9 2.821 -29.253 34.408 64 HE2 HIS 9 HE2 HIS 9 2.159 -30.123 36.667 65 H HIS 10 H HIS 10 -0.540 -29.448 32.847 66 HA HIS 10 HA HIS 10 0.211 -29.336 30.695 67 HB2 HIS 10 HB2 HIS 10 -1.870 -29.993 29.837 68 HB3 HIS 10 HB3 HIS 10 -2.648 -28.486 30.299 69 HD1 HIS 10 HD1 HIS 10 -2.213 -26.410 28.749 70 HD2 HIS 10 HD2 HIS 10 -0.734 -30.014 27.294 71 HE1 HIS 10 HE1 HIS 10 -1.744 -26.011 26.319 72 HE2 HIS 10 HE2 HIS 10 -1.062 -28.251 25.420 73 H SER 11 H SER 11 1.726 -27.968 29.986 74 HA SER 11 HA SER 11 1.078 -25.087 29.773 75 HB2 SER 11 HB2 SER 11 3.670 -26.270 30.819 76 HB3 SER 11 HB3 SER 11 3.433 -24.566 30.435 77 HG SER 11 HG SER 11 2.862 -25.838 32.692 78 H SER 12 H SER 12 1.597 -24.147 27.872 79 HA SER 12 HA SER 12 3.729 -25.211 26.198 80 HB2 SER 12 HB2 SER 12 2.324 -25.497 24.199 81 HB3 SER 12 HB3 SER 12 1.807 -26.575 25.490 82 HG SER 12 HG SER 12 0.292 -24.653 25.950 83 H GLY 13 H GLY 13 3.004 -22.674 27.621 84 HA2 GLY 13 HA2 GLY 13 2.336 -20.653 25.757 85 HA3 GLY 13 HA3 GLY 13 3.175 -20.404 27.283 86 H ARG 14 H ARG 14 3.534 -19.386 24.398 87 HA ARG 14 HA ARG 14 6.402 -19.453 24.309 88 HB2 ARG 14 HB2 ARG 14 6.400 -20.486 21.945 89 HB3 ARG 14 HB3 ARG 14 6.225 -21.570 23.321 90 HG2 ARG 14 HG2 ARG 14 3.747 -21.499 22.966 91 HG3 ARG 14 HG3 ARG 14 4.045 -20.599 21.478 92 HD2 ARG 14 HD2 ARG 14 5.191 -22.437 20.496 93 HD3 ARG 14 HD3 ARG 14 5.272 -23.293 22.039 94 HE ARG 14 HE ARG 14 2.587 -22.903 21.475 95 HH11 ARG 14 HH11 ARG 14 5.248 -24.560 20.047 96 HH12 ARG 14 HH12 ARG 14 4.259 -25.836 19.430 97 HH21 ARG 14 HH21 ARG 14 1.330 -24.525 20.671 98 HH22 ARG 14 HH22 ARG 14 2.060 -25.810 19.770 99 H GLU 15 H GLU 15 6.791 -17.387 23.883 100 HA GLU 15 HA GLU 15 5.486 -16.112 21.561 101 HB2 GLU 15 HB2 GLU 15 5.361 -13.994 22.791 102 HB3 GLU 15 HB3 GLU 15 4.452 -15.245 23.622 103 HG2 GLU 15 HG2 GLU 15 7.256 -14.462 24.397 104 HG3 GLU 15 HG3 GLU 15 5.820 -13.695 25.067 105 H ASN 16 H ASN 16 7.006 -13.618 22.117 106 HA ASN 16 HA ASN 16 9.047 -12.635 22.018 107 HB2 ASN 16 HB2 ASN 16 10.210 -15.421 22.240 108 HB3 ASN 16 HB3 ASN 16 11.130 -13.922 22.325 109 HD21 ASN 16 HD21 ASN 16 10.719 -16.092 24.286 110 HD22 ASN 16 HD22 ASN 16 10.120 -15.312 25.705 111 H LEU 17 H LEU 17 8.472 -11.972 19.919 112 HA LEU 17 HA LEU 17 9.752 -13.399 17.703 113 HB2 LEU 17 HB2 LEU 17 7.907 -11.019 17.832 114 HB3 LEU 17 HB3 LEU 17 8.772 -11.426 16.363 115 HG LEU 17 HG LEU 17 6.528 -12.290 16.227 116 HD11 LEU 17 HD11 LEU 17 8.457 -14.557 16.700 117 HD12 LEU 17 HD12 LEU 17 8.315 -13.623 15.211 118 HD13 LEU 17 HD13 LEU 17 6.969 -14.627 15.753 119 HD21 LEU 17 HD21 LEU 17 7.107 -13.838 18.753 120 HD22 LEU 17 HD22 LEU 17 5.640 -13.946 17.780 121 HD23 LEU 17 HD23 LEU 17 6.031 -12.446 18.621 122 H TYR 18 H TYR 18 10.603 -11.369 16.071 123 HA TYR 18 HA TYR 18 13.046 -10.580 17.380 124 HB2 TYR 18 HB2 TYR 18 12.043 -10.124 14.562 125 HB3 TYR 18 HB3 TYR 18 13.644 -9.654 15.130 126 HD1 TYR 18 HD1 TYR 18 11.471 -12.496 14.266 127 HD2 TYR 18 HD2 TYR 18 15.360 -11.326 15.551 128 HE1 TYR 18 HE1 TYR 18 12.311 -14.756 13.772 129 HE2 TYR 18 HE2 TYR 18 16.208 -13.577 15.054 130 HH TYR 18 HH TYR 18 15.366 -15.851 14.830 131 H PHE 19 H PHE 19 10.036 -9.034 16.652 132 HA PHE 19 HA PHE 19 9.155 -7.035 17.257 133 HB2 PHE 19 HB2 PHE 19 11.734 -6.688 18.788 134 HB3 PHE 19 HB3 PHE 19 10.352 -5.607 18.910 135 HD1 PHE 19 HD1 PHE 19 8.087 -6.728 19.564 136 HD2 PHE 19 HD2 PHE 19 11.909 -8.483 20.261 137 HE1 PHE 19 HE1 PHE 19 7.115 -8.145 21.325 138 HE2 PHE 19 HE2 PHE 19 10.935 -9.905 22.019 139 HZ PHE 19 HZ PHE 19 8.538 -9.736 22.552 140 H GLN 20 H GLN 20 12.348 -6.955 15.803 141 HA GLN 20 HA GLN 20 12.309 -4.174 15.149 142 HB2 GLN 20 HB2 GLN 20 14.415 -5.417 15.379 143 HB3 GLN 20 HB3 GLN 20 13.984 -6.422 14.001 144 HG2 GLN 20 HG2 GLN 20 13.993 -4.401 12.571 145 HG3 GLN 20 HG3 GLN 20 14.525 -3.453 13.960 146 HE21 GLN 20 HE21 GLN 20 15.426 -5.831 11.605 147 HE22 GLN 20 HE22 GLN 20 17.125 -5.766 11.899 148 H GLY 21 H GLY 21 10.602 -3.524 13.916 149 HA2 GLY 21 HA2 GLY 21 9.942 -4.930 11.438 150 HA3 GLY 21 HA3 GLY 21 9.126 -3.517 12.089 151 H HIS 22 H HIS 22 10.797 -1.562 12.261 152 HA HIS 22 HA HIS 22 12.046 0.011 11.226 153 HB2 HIS 22 HB2 HIS 22 13.905 -1.446 11.156 154 HB3 HIS 22 HB3 HIS 22 13.189 -2.438 9.892 155 HD1 HIS 22 HD1 HIS 22 14.607 1.068 10.333 156 HD2 HIS 22 HD2 HIS 22 13.989 -1.792 7.376 157 HE1 HIS 22 HE1 HIS 22 15.697 1.988 8.264 158 HE2 HIS 22 HE2 HIS 22 15.248 0.277 6.475 159 H MET 23 H MET 23 10.627 1.303 10.190 160 HA MET 23 HA MET 23 9.407 0.524 7.679 161 HB2 MET 23 HB2 MET 23 8.379 2.778 7.732 162 HB3 MET 23 HB3 MET 23 8.092 1.861 9.203 163 HG2 MET 23 HG2 MET 23 9.648 3.156 10.428 164 HG3 MET 23 HG3 MET 23 10.290 3.895 8.962 165 HE1 MET 23 HE1 MET 23 6.903 3.452 10.986 166 HE2 MET 23 HE2 MET 23 6.458 3.310 9.284 167 HE3 MET 23 HE3 MET 23 5.927 4.706 10.222 168 H LEU 24 H LEU 24 9.507 1.906 5.759 169 HA LEU 24 HA LEU 24 12.067 3.336 5.408 170 HB2 LEU 24 HB2 LEU 24 10.750 1.291 3.653 171 HB3 LEU 24 HB3 LEU 24 11.761 2.529 2.927 172 HG LEU 24 HG LEU 24 12.810 0.833 5.172 173 HD11 LEU 24 HD11 LEU 24 13.740 -0.717 3.521 174 HD12 LEU 24 HD12 LEU 24 12.874 0.124 2.236 175 HD13 LEU 24 HD13 LEU 24 11.977 -0.734 3.489 176 HD21 LEU 24 HD21 LEU 24 14.115 2.305 2.880 177 HD22 LEU 24 HD22 LEU 24 14.966 1.338 4.086 178 HD23 LEU 24 HD23 LEU 24 14.104 2.796 4.576 179 H GLU 25 H GLU 25 11.913 5.348 4.604 180 HA GLU 25 HA GLU 25 9.375 6.533 4.145 181 HB2 GLU 25 HB2 GLU 25 11.415 7.660 5.134 182 HB3 GLU 25 HB3 GLU 25 12.093 7.688 3.510 183 HG2 GLU 25 HG2 GLU 25 10.040 8.914 2.787 184 HG3 GLU 25 HG3 GLU 25 9.611 9.042 4.485 185 H VAL 26 H VAL 26 8.257 6.256 2.317 186 HA VAL 26 HA VAL 26 9.702 6.050 -0.256 187 HB VAL 26 HB VAL 26 8.043 4.381 -1.015 188 HG11 VAL 26 HG11 VAL 26 10.182 3.612 -0.114 189 HG12 VAL 26 HG12 VAL 26 8.892 2.473 0.267 190 HG13 VAL 26 HG13 VAL 26 9.494 3.569 1.511 191 HG21 VAL 26 HG21 VAL 26 7.086 4.425 1.857 192 HG22 VAL 26 HG22 VAL 26 6.566 3.281 0.619 193 HG23 VAL 26 HG23 VAL 26 6.186 4.994 0.451 194 H GLU 27 H GLU 27 8.444 6.669 -2.163 195 HA GLU 27 HA GLU 27 6.315 8.599 -1.535 196 HB2 GLU 27 HB2 GLU 27 8.200 9.353 -2.972 197 HB3 GLU 27 HB3 GLU 27 7.742 8.149 -4.171 198 HG2 GLU 27 HG2 GLU 27 5.605 9.239 -4.509 199 HG3 GLU 27 HG3 GLU 27 5.962 10.394 -3.229 200 H VAL 28 H VAL 28 4.267 8.030 -1.738 201 HA VAL 28 HA VAL 28 3.580 5.497 -3.031 202 HB VAL 28 HB VAL 28 1.850 7.292 -1.315 203 HG11 VAL 28 HG11 VAL 28 0.552 5.787 -2.709 204 HG12 VAL 28 HG12 VAL 28 0.471 5.272 -1.024 205 HG13 VAL 28 HG13 VAL 28 1.510 4.413 -2.161 206 HG21 VAL 28 HG21 VAL 28 3.807 6.546 -0.064 207 HG22 VAL 28 HG22 VAL 28 3.469 4.874 -0.516 208 HG23 VAL 28 HG23 VAL 28 2.346 5.751 0.524 209 H ILE 29 H ILE 29 3.103 5.671 -5.156 210 HA ILE 29 HA ILE 29 1.652 8.038 -6.128 211 HB ILE 29 HB ILE 29 2.517 5.898 -8.025 212 HG12 ILE 29 HG12 ILE 29 4.469 7.853 -6.778 213 HG13 ILE 29 HG13 ILE 29 4.439 6.128 -6.455 214 HG21 ILE 29 HG21 ILE 29 1.364 7.860 -8.862 215 HG22 ILE 29 HG22 ILE 29 3.037 7.888 -9.419 216 HG23 ILE 29 HG23 ILE 29 2.534 8.923 -8.078 217 HD11 ILE 29 HD11 ILE 29 4.929 5.692 -8.817 218 HD12 ILE 29 HD12 ILE 29 6.178 6.660 -8.033 219 HD13 ILE 29 HD13 ILE 29 5.010 7.431 -9.106 220 H SER 30 H SER 30 -0.149 7.728 -7.667 221 HA SER 30 HA SER 30 -1.556 5.162 -7.404 222 HB2 SER 30 HB2 SER 30 -2.775 7.871 -6.839 223 HB3 SER 30 HB3 SER 30 -3.718 6.397 -7.067 224 HG SER 30 HG SER 30 -1.758 5.938 -5.296 225 H GLY 31 H GLY 31 -1.378 4.505 -9.466 226 HA2 GLY 31 HA2 GLY 31 -1.819 6.268 -11.713 227 HA3 GLY 31 HA3 GLY 31 -1.562 4.531 -11.784 228 H ARG 32 H ARG 32 -3.783 6.924 -12.337 229 HA ARG 32 HA ARG 32 -6.194 5.857 -11.391 230 HB2 ARG 32 HB2 ARG 32 -5.699 7.610 -13.806 231 HB3 ARG 32 HB3 ARG 32 -7.287 7.274 -13.125 232 HG2 ARG 32 HG2 ARG 32 -6.510 8.263 -10.971 233 HG3 ARG 32 HG3 ARG 32 -5.009 8.723 -11.778 234 HD2 ARG 32 HD2 ARG 32 -7.779 9.618 -12.594 235 HD3 ARG 32 HD3 ARG 32 -6.639 10.572 -11.647 236 HE ARG 32 HE ARG 32 -5.794 9.656 -14.289 237 HH11 ARG 32 HH11 ARG 32 -6.896 12.231 -12.286 238 HH12 ARG 32 HH12 ARG 32 -6.352 13.457 -13.371 239 HH21 ARG 32 HH21 ARG 32 -5.093 11.247 -15.671 240 HH22 ARG 32 HH22 ARG 32 -5.308 12.907 -15.241 241 H THR 33 H THR 33 -6.730 3.799 -11.740 242 HA THR 33 HA THR 33 -6.940 2.822 -14.520 243 HB THR 33 HB THR 33 -6.251 0.567 -13.766 244 HG1 THR 33 HG1 THR 33 -6.696 0.627 -11.567 245 HG21 THR 33 HG21 THR 33 -3.842 1.037 -13.447 246 HG22 THR 33 HG22 THR 33 -4.227 2.737 -13.175 247 HG23 THR 33 HG23 THR 33 -4.550 2.001 -14.745 248 H LEU 34 H LEU 34 -8.209 0.575 -14.407 249 HA LEU 34 HA LEU 34 -10.079 -0.627 -13.940 250 HB2 LEU 34 HB2 LEU 34 -9.126 -0.575 -11.632 251 HB3 LEU 34 HB3 LEU 34 -10.101 0.840 -11.294 252 HG LEU 34 HG LEU 34 -12.155 -0.500 -11.615 253 HD11 LEU 34 HD11 LEU 34 -11.292 -2.149 -13.196 254 HD12 LEU 34 HD12 LEU 34 -12.011 -2.938 -11.793 255 HD13 LEU 34 HD13 LEU 34 -10.255 -2.828 -11.942 256 HD21 LEU 34 HD21 LEU 34 -11.184 -0.248 -9.380 257 HD22 LEU 34 HD22 LEU 34 -10.209 -1.697 -9.634 258 HD23 LEU 34 HD23 LEU 34 -11.968 -1.815 -9.565 259 H ASN 35 H ASN 35 -10.124 2.359 -14.850 260 HA ASN 35 HA ASN 35 -11.622 3.945 -15.486 261 HB2 ASN 35 HB2 ASN 35 -13.479 1.557 -15.384 262 HB3 ASN 35 HB3 ASN 35 -13.962 3.135 -16.009 263 HD21 ASN 35 HD21 ASN 35 -12.037 0.307 -16.566 264 HD22 ASN 35 HD22 ASN 35 -11.646 0.661 -18.210 265 H GLN 36 H GLN 36 -11.652 5.388 -13.818 266 HA GLN 36 HA GLN 36 -13.058 4.949 -11.372 267 HB2 GLN 36 HB2 GLN 36 -11.939 7.501 -12.554 268 HB3 GLN 36 HB3 GLN 36 -12.560 7.342 -10.916 269 HG2 GLN 36 HG2 GLN 36 -10.818 5.620 -10.482 270 HG3 GLN 36 HG3 GLN 36 -10.158 5.939 -12.083 271 HE21 GLN 36 HE21 GLN 36 -10.582 7.154 -8.870 272 HE22 GLN 36 HE22 GLN 36 -9.463 8.460 -8.994 273 H GLY 37 H GLY 37 -14.440 7.230 -10.791 274 HA2 GLY 37 HA2 GLY 37 -16.421 8.406 -11.288 275 HA3 GLY 37 HA3 GLY 37 -16.590 7.474 -12.770 276 H ALA 38 H ALA 38 -15.862 5.270 -10.473 277 HA ALA 38 HA ALA 38 -18.649 4.871 -9.586 278 HB1 ALA 38 HB1 ALA 38 -18.163 3.440 -11.547 279 HB2 ALA 38 HB2 ALA 38 -18.485 2.502 -10.088 280 HB3 ALA 38 HB3 ALA 38 -16.827 2.704 -10.656 281 H THR 39 H THR 39 -18.851 4.322 -7.452 282 HA THR 39 HA THR 39 -16.600 4.172 -5.713 283 HB THR 39 HB THR 39 -18.125 3.604 -3.932 284 HG1 THR 39 HG1 THR 39 -20.497 3.389 -5.059 285 HG21 THR 39 HG21 THR 39 -19.518 5.477 -5.857 286 HG22 THR 39 HG22 THR 39 -18.259 5.926 -4.704 287 HG23 THR 39 HG23 THR 39 -19.826 5.360 -4.124 288 H VAL 40 H VAL 40 -16.420 2.193 -4.145 289 HA VAL 40 HA VAL 40 -15.610 -0.071 -5.599 290 HB VAL 40 HB VAL 40 -15.209 -1.173 -3.536 291 HG11 VAL 40 HG11 VAL 40 -14.830 1.789 -3.091 292 HG12 VAL 40 HG12 VAL 40 -13.728 0.712 -3.951 293 HG13 VAL 40 HG13 VAL 40 -13.994 0.502 -2.219 294 HG21 VAL 40 HG21 VAL 40 -16.123 -0.454 -1.385 295 HG22 VAL 40 HG22 VAL 40 -17.407 -0.891 -2.511 296 HG23 VAL 40 HG23 VAL 40 -17.056 0.808 -2.195 297 H GLU 41 H GLU 41 -18.691 0.813 -4.216 298 HA GLU 41 HA GLU 41 -19.828 -1.812 -4.164 299 HB2 GLU 41 HB2 GLU 41 -20.584 0.027 -2.690 300 HB3 GLU 41 HB3 GLU 41 -21.207 0.881 -4.094 301 HG2 GLU 41 HG2 GLU 41 -22.773 -0.968 -4.512 302 HG3 GLU 41 HG3 GLU 41 -22.157 -1.797 -3.082 303 H GLU 42 H GLU 42 -19.598 0.711 -6.566 304 HA GLU 42 HA GLU 42 -21.650 -0.281 -8.297 305 HB2 GLU 42 HB2 GLU 42 -19.272 1.495 -8.906 306 HB3 GLU 42 HB3 GLU 42 -20.631 1.217 -9.986 307 HG2 GLU 42 HG2 GLU 42 -20.742 2.556 -7.288 308 HG3 GLU 42 HG3 GLU 42 -20.856 3.348 -8.858 309 H LYS 43 H LYS 43 -18.550 -1.433 -7.559 310 HA LYS 43 HA LYS 43 -18.519 -3.080 -10.003 311 HB2 LYS 43 HB2 LYS 43 -16.147 -2.043 -8.460 312 HB3 LYS 43 HB3 LYS 43 -16.056 -3.161 -9.814 313 HG2 LYS 43 HG2 LYS 43 -16.980 -1.478 -11.310 314 HG3 LYS 43 HG3 LYS 43 -17.186 -0.359 -9.962 315 HD2 LYS 43 HD2 LYS 43 -14.727 -0.376 -9.622 316 HD3 LYS 43 HD3 LYS 43 -14.559 -1.424 -11.031 317 HE2 LYS 43 HE2 LYS 43 -15.782 1.339 -11.086 318 HE3 LYS 43 HE3 LYS 43 -14.101 0.986 -11.480 319 HZ1 LYS 43 HZ1 LYS 43 -14.866 -0.434 -13.285 320 HZ2 LYS 43 HZ2 LYS 43 -15.434 1.149 -13.468 321 HZ3 LYS 43 HZ3 LYS 43 -16.479 -0.065 -12.917 322 H LEU 44 H LEU 44 -16.859 -3.232 -6.821 323 HA LEU 44 HA LEU 44 -16.745 -4.820 -5.204 324 HB2 LEU 44 HB2 LEU 44 -19.461 -5.471 -6.316 325 HB3 LEU 44 HB3 LEU 44 -18.791 -6.321 -4.936 326 HG LEU 44 HG LEU 44 -19.324 -3.347 -5.058 327 HD11 LEU 44 HD11 LEU 44 -20.789 -5.521 -3.563 328 HD12 LEU 44 HD12 LEU 44 -21.381 -4.685 -4.999 329 HD13 LEU 44 HD13 LEU 44 -21.132 -3.792 -3.499 330 HD21 LEU 44 HD21 LEU 44 -18.829 -3.397 -2.646 331 HD22 LEU 44 HD22 LEU 44 -17.432 -3.856 -3.617 332 HD23 LEU 44 HD23 LEU 44 -18.371 -5.095 -2.783 333 H THR 45 H THR 45 -16.837 -5.896 -8.430 334 HA THR 45 HA THR 45 -16.904 -8.661 -8.255 335 HB THR 45 HB THR 45 -16.976 -7.642 -10.418 336 HG1 THR 45 HG1 THR 45 -15.527 -8.952 -11.491 337 HG21 THR 45 HG21 THR 45 -15.659 -5.639 -9.968 338 HG22 THR 45 HG22 THR 45 -15.045 -6.463 -11.403 339 HG23 THR 45 HG23 THR 45 -14.186 -6.607 -9.869 340 H GLU 46 H GLU 46 -15.256 -10.283 -8.297 341 HA GLU 46 HA GLU 46 -13.218 -10.204 -6.434 342 HB2 GLU 46 HB2 GLU 46 -14.014 -12.286 -7.434 343 HB3 GLU 46 HB3 GLU 46 -13.372 -11.818 -9.000 344 HG2 GLU 46 HG2 GLU 46 -11.901 -13.434 -8.062 345 HG3 GLU 46 HG3 GLU 46 -11.084 -11.876 -8.005 346 H GLU 47 H GLU 47 -13.138 -9.319 -9.829 347 HA GLU 47 HA GLU 47 -10.436 -8.867 -10.253 348 HB2 GLU 47 HB2 GLU 47 -12.242 -8.803 -11.959 349 HB3 GLU 47 HB3 GLU 47 -12.761 -7.251 -11.322 350 HG2 GLU 47 HG2 GLU 47 -10.725 -6.203 -12.027 351 HG3 GLU 47 HG3 GLU 47 -10.024 -7.760 -12.476 352 H TYR 48 H TYR 48 -12.845 -6.712 -8.777 353 HA TYR 48 HA TYR 48 -11.267 -4.397 -8.511 354 HB2 TYR 48 HB2 TYR 48 -13.825 -4.806 -8.071 355 HB3 TYR 48 HB3 TYR 48 -13.311 -5.197 -6.437 356 HD1 TYR 48 HD1 TYR 48 -11.710 -3.325 -5.333 357 HD2 TYR 48 HD2 TYR 48 -14.465 -2.636 -8.514 358 HE1 TYR 48 HE1 TYR 48 -11.736 -0.929 -4.792 359 HE2 TYR 48 HE2 TYR 48 -14.491 -0.237 -7.979 360 HH TYR 48 HH TYR 48 -13.989 1.268 -6.246 361 H PHE 49 H PHE 49 -11.539 -7.291 -6.542 362 HA PHE 49 HA PHE 49 -9.999 -6.253 -4.331 363 HB2 PHE 49 HB2 PHE 49 -11.882 -7.887 -4.093 364 HB3 PHE 49 HB3 PHE 49 -10.880 -9.098 -4.880 365 HD1 PHE 49 HD1 PHE 49 -10.996 -6.838 -1.928 366 HD2 PHE 49 HD2 PHE 49 -9.434 -10.431 -3.604 367 HE1 PHE 49 HE1 PHE 49 -10.066 -7.454 0.266 368 HE2 PHE 49 HE2 PHE 49 -8.497 -11.049 -1.414 369 HZ PHE 49 HZ PHE 49 -8.813 -9.561 0.526 370 H ASN 50 H ASN 50 -9.152 -7.528 -7.342 371 HA ASN 50 HA ASN 50 -6.460 -8.251 -6.336 372 HB2 ASN 50 HB2 ASN 50 -7.940 -9.290 -8.767 373 HB3 ASN 50 HB3 ASN 50 -6.239 -9.613 -8.444 374 HD21 ASN 50 HD21 ASN 50 -9.499 -10.173 -7.387 375 HD22 ASN 50 HD22 ASN 50 -9.154 -11.522 -6.375 376 H ALA 51 H ALA 51 -8.025 -5.781 -7.751 377 HA ALA 51 HA ALA 51 -5.988 -5.144 -9.757 378 HB1 ALA 51 HB1 ALA 51 -8.379 -4.889 -10.330 379 HB2 ALA 51 HB2 ALA 51 -7.475 -3.384 -10.487 380 HB3 ALA 51 HB3 ALA 51 -8.524 -3.642 -9.091 381 H VAL 52 H VAL 52 -7.520 -3.480 -6.974 382 HA VAL 52 HA VAL 52 -5.241 -1.594 -6.929 383 HB VAL 52 HB VAL 52 -6.747 -0.039 -5.746 384 HG11 VAL 52 HG11 VAL 52 -7.938 -1.119 -8.310 385 HG12 VAL 52 HG12 VAL 52 -6.630 0.060 -8.188 386 HG13 VAL 52 HG13 VAL 52 -8.247 0.476 -7.618 387 HG21 VAL 52 HG21 VAL 52 -8.837 -2.200 -6.117 388 HG22 VAL 52 HG22 VAL 52 -9.163 -0.555 -5.568 389 HG23 VAL 52 HG23 VAL 52 -8.174 -1.633 -4.583 390 H ASN 53 H ASN 53 -5.407 -4.300 -5.505 391 HA ASN 53 HA ASN 53 -5.522 -3.412 -2.691 392 HB2 ASN 53 HB2 ASN 53 -5.750 -6.189 -3.872 393 HB3 ASN 53 HB3 ASN 53 -5.782 -5.828 -2.150 394 HD21 ASN 53 HD21 ASN 53 -7.338 -3.945 -4.699 395 HD22 ASN 53 HD22 ASN 53 -8.946 -4.249 -4.174 396 H TYR 54 H TYR 54 -3.114 -3.294 -4.633 397 HA TYR 54 HA TYR 54 -1.210 -4.503 -2.758 398 HB2 TYR 54 HB2 TYR 54 0.116 -5.497 -4.601 399 HB3 TYR 54 HB3 TYR 54 -1.480 -6.220 -4.460 400 HD1 TYR 54 HD1 TYR 54 0.598 -3.911 -6.482 401 HD2 TYR 54 HD2 TYR 54 -3.048 -6.101 -6.263 402 HE1 TYR 54 HE1 TYR 54 0.173 -3.433 -8.857 403 HE2 TYR 54 HE2 TYR 54 -3.478 -5.625 -8.637 404 HH TYR 54 HH TYR 54 -2.826 -3.926 -10.327 405 H ALA 55 H ALA 55 1.039 -3.818 -3.132 406 HA ALA 55 HA ALA 55 1.290 -1.240 -4.551 407 HB1 ALA 55 HB1 ALA 55 2.529 -1.882 -1.868 408 HB2 ALA 55 HB2 ALA 55 1.110 -0.864 -2.113 409 HB3 ALA 55 HB3 ALA 55 2.672 -0.365 -2.759 410 H GLU 56 H GLU 56 3.018 -1.119 -5.912 411 HA GLU 56 HA GLU 56 4.803 -3.417 -6.049 412 HB2 GLU 56 HB2 GLU 56 4.533 -1.040 -7.902 413 HB3 GLU 56 HB3 GLU 56 5.560 -2.442 -8.186 414 HG2 GLU 56 HG2 GLU 56 3.431 -3.835 -8.003 415 HG3 GLU 56 HG3 GLU 56 2.560 -2.310 -8.128 416 H ILE 57 H ILE 57 6.750 -3.476 -5.236 417 HA ILE 57 HA ILE 57 7.985 -1.003 -4.186 418 HB ILE 57 HB ILE 57 8.164 -3.778 -2.995 419 HG12 ILE 57 HG12 ILE 57 6.466 -1.527 -1.916 420 HG13 ILE 57 HG13 ILE 57 5.822 -2.705 -3.055 421 HG21 ILE 57 HG21 ILE 57 10.012 -2.319 -2.374 422 HG22 ILE 57 HG22 ILE 57 8.956 -2.587 -0.987 423 HG23 ILE 57 HG23 ILE 57 8.879 -1.063 -1.873 424 HD11 ILE 57 HD11 ILE 57 5.287 -3.263 -0.747 425 HD12 ILE 57 HD12 ILE 57 7.008 -3.349 -0.368 426 HD13 ILE 57 HD13 ILE 57 6.293 -4.499 -1.503 427 H ASN 58 H ASN 58 10.273 -0.824 -4.300 428 HA ASN 58 HA ASN 58 11.613 -2.412 -6.288 429 HB2 ASN 58 HB2 ASN 58 12.088 0.013 -5.907 430 HB3 ASN 58 HB3 ASN 58 12.817 -0.402 -4.360 431 HD21 ASN 58 HD21 ASN 58 13.805 0.737 -6.987 432 HD22 ASN 58 HD22 ASN 58 15.220 -0.188 -7.337 433 H GLU 59 H GLU 59 13.280 -3.904 -5.996 434 HA GLU 59 HA GLU 59 12.867 -5.750 -3.953 435 HB2 GLU 59 HB2 GLU 59 13.840 -6.350 -6.123 436 HB3 GLU 59 HB3 GLU 59 15.306 -5.464 -5.718 437 HG2 GLU 59 HG2 GLU 59 15.914 -7.004 -4.050 438 HG3 GLU 59 HG3 GLU 59 14.313 -7.733 -4.026 439 H GLU 60 H GLU 60 15.313 -3.201 -4.173 440 HA GLU 60 HA GLU 60 16.909 -3.877 -2.006 441 HB2 GLU 60 HB2 GLU 60 16.099 -1.155 -3.033 442 HB3 GLU 60 HB3 GLU 60 17.322 -1.389 -1.791 443 HG2 GLU 60 HG2 GLU 60 17.428 -2.455 -4.608 444 HG3 GLU 60 HG3 GLU 60 18.330 -1.077 -3.983 445 H ASP 61 H ASP 61 13.997 -1.790 -1.938 446 HA ASP 61 HA ASP 61 13.938 -1.556 0.906 447 HB2 ASP 61 HB2 ASP 61 11.629 -1.218 -1.032 448 HB3 ASP 61 HB3 ASP 61 11.759 -0.538 0.589 449 H TRP 62 H TRP 62 12.425 -3.713 -1.418 450 HA TRP 62 HA TRP 62 10.628 -5.137 0.125 451 HB2 TRP 62 HB2 TRP 62 10.822 -5.403 -2.283 452 HB3 TRP 62 HB3 TRP 62 12.440 -6.065 -2.120 453 HD1 TRP 62 HD1 TRP 62 12.611 -8.602 -1.115 454 HE1 TRP 62 HE1 TRP 62 10.938 -10.544 -1.238 455 HE3 TRP 62 HE3 TRP 62 8.400 -5.969 -2.301 456 HZ2 TRP 62 HZ2 TRP 62 8.202 -10.922 -1.779 457 HZ3 TRP 62 HZ3 TRP 62 6.292 -7.197 -2.603 458 HH2 TRP 62 HH2 TRP 62 6.193 -9.627 -2.348 459 H ASN 63 H ASN 63 14.076 -5.922 -0.404 460 HA ASN 63 HA ASN 63 14.159 -8.128 1.368 461 HB2 ASN 63 HB2 ASN 63 16.396 -6.341 0.374 462 HB3 ASN 63 HB3 ASN 63 16.636 -7.859 1.235 463 HD21 ASN 63 HD21 ASN 63 17.443 -7.072 -1.471 464 HD22 ASN 63 HD22 ASN 63 16.747 -8.253 -2.520 465 H ALA 64 H ALA 64 14.850 -4.684 1.821 466 HA ALA 64 HA ALA 64 15.913 -4.758 4.411 467 HB1 ALA 64 HB1 ALA 64 15.917 -2.760 2.972 468 HB2 ALA 64 HB2 ALA 64 15.272 -2.421 4.579 469 HB3 ALA 64 HB3 ALA 64 14.175 -2.602 3.209 470 H LEU 65 H LEU 65 12.529 -4.542 3.350 471 HA LEU 65 HA LEU 65 11.491 -4.522 6.043 472 HB2 LEU 65 HB2 LEU 65 10.094 -4.909 3.390 473 HB3 LEU 65 HB3 LEU 65 9.286 -4.667 4.929 474 HG LEU 65 HG LEU 65 11.106 -2.653 3.598 475 HD11 LEU 65 HD11 LEU 65 9.058 -1.380 3.159 476 HD12 LEU 65 HD12 LEU 65 8.097 -2.724 3.780 477 HD13 LEU 65 HD13 LEU 65 9.066 -2.930 2.319 478 HD21 LEU 65 HD21 LEU 65 9.338 -2.397 6.033 479 HD22 LEU 65 HD22 LEU 65 10.273 -1.100 5.289 480 HD23 LEU 65 HD23 LEU 65 11.099 -2.467 6.032 481 H GLY 66 H GLY 66 12.839 -6.962 4.280 482 HA2 GLY 66 HA2 GLY 66 12.823 -9.255 4.425 483 HA3 GLY 66 HA3 GLY 66 12.043 -9.045 5.986 484 H LEU 67 H LEU 67 10.941 -8.292 2.691 485 HA LEU 67 HA LEU 67 8.343 -9.435 3.300 486 HB2 LEU 67 HB2 LEU 67 9.425 -7.875 0.962 487 HB3 LEU 67 HB3 LEU 67 7.792 -8.519 0.996 488 HG LEU 67 HG LEU 67 8.833 -6.629 3.113 489 HD11 LEU 67 HD11 LEU 67 8.975 -5.531 0.923 490 HD12 LEU 67 HD12 LEU 67 7.703 -4.830 1.920 491 HD13 LEU 67 HD13 LEU 67 7.287 -5.934 0.609 492 HD21 LEU 67 HD21 LEU 67 6.470 -6.266 3.558 493 HD22 LEU 67 HD22 LEU 67 6.873 -7.976 3.699 494 HD23 LEU 67 HD23 LEU 67 6.034 -7.385 2.264 495 H GLN 68 H GLN 68 7.414 -11.192 2.397 496 HA GLN 68 HA GLN 68 8.885 -12.656 0.290 497 HB2 GLN 68 HB2 GLN 68 8.598 -13.910 2.427 498 HB3 GLN 68 HB3 GLN 68 6.854 -13.736 2.269 499 HG2 GLN 68 HG2 GLN 68 6.894 -15.068 0.225 500 HG3 GLN 68 HG3 GLN 68 8.646 -15.215 0.341 501 HE21 GLN 68 HE21 GLN 68 9.529 -16.513 1.991 502 HE22 GLN 68 HE22 GLN 68 8.584 -17.726 2.782 503 H GLU 69 H GLU 69 7.607 -13.474 -1.488 504 HA GLU 69 HA GLU 69 5.739 -11.661 -2.473 505 HB2 GLU 69 HB2 GLU 69 6.208 -14.540 -3.259 506 HB3 GLU 69 HB3 GLU 69 5.186 -13.429 -4.165 507 HG2 GLU 69 HG2 GLU 69 7.130 -11.932 -4.454 508 HG3 GLU 69 HG3 GLU 69 8.140 -13.132 -3.650 509 H GLY 70 H GLY 70 3.911 -11.169 -1.469 510 HA2 GLY 70 HA2 GLY 70 1.529 -11.900 -1.377 511 HA3 GLY 70 HA3 GLY 70 2.111 -13.377 -0.630 512 H ASP 71 H ASP 71 4.057 -11.217 0.772 513 HA ASP 71 HA ASP 71 2.693 -11.193 3.245 514 HB2 ASP 71 HB2 ASP 71 5.238 -10.069 2.232 515 HB3 ASP 71 HB3 ASP 71 4.550 -9.244 3.627 516 H ARG 72 H ARG 72 2.387 -9.147 4.549 517 HA ARG 72 HA ARG 72 0.696 -7.299 2.984 518 HB2 ARG 72 HB2 ARG 72 0.392 -8.083 5.896 519 HB3 ARG 72 HB3 ARG 72 -0.756 -7.169 4.920 520 HG2 ARG 72 HG2 ARG 72 -1.253 -9.092 3.576 521 HG3 ARG 72 HG3 ARG 72 0.052 -10.013 4.325 522 HD2 ARG 72 HD2 ARG 72 -1.137 -9.882 6.490 523 HD3 ARG 72 HD3 ARG 72 -2.468 -9.044 5.686 524 HE ARG 72 HE ARG 72 -2.377 -11.223 4.219 525 HH11 ARG 72 HH11 ARG 72 -2.059 -11.001 7.649 526 HH12 ARG 72 HH12 ARG 72 -2.713 -12.577 7.908 527 HH21 ARG 72 HH21 ARG 72 -3.193 -13.232 4.577 528 HH22 ARG 72 HH22 ARG 72 -3.360 -13.817 6.196 529 H VAL 73 H VAL 73 1.205 -5.189 3.018 530 HA VAL 73 HA VAL 73 3.122 -4.239 5.060 531 HB VAL 73 HB VAL 73 3.822 -2.509 3.401 532 HG11 VAL 73 HG11 VAL 73 5.134 -4.545 3.726 533 HG12 VAL 73 HG12 VAL 73 5.196 -4.011 2.046 534 HG13 VAL 73 HG13 VAL 73 4.171 -5.375 2.502 535 HG21 VAL 73 HG21 VAL 73 1.845 -2.464 1.983 536 HG22 VAL 73 HG22 VAL 73 2.134 -4.130 1.482 537 HG23 VAL 73 HG23 VAL 73 3.268 -2.861 1.022 538 H LYS 74 H LYS 74 2.715 -2.410 6.176 539 HA LYS 74 HA LYS 74 0.108 -1.103 5.778 540 HB2 LYS 74 HB2 LYS 74 0.498 -2.086 7.997 541 HB3 LYS 74 HB3 LYS 74 1.962 -1.131 8.178 542 HG2 LYS 74 HG2 LYS 74 0.568 0.926 8.080 543 HG3 LYS 74 HG3 LYS 74 -0.870 -0.096 8.050 544 HD2 LYS 74 HD2 LYS 74 1.196 -0.280 10.241 545 HD3 LYS 74 HD3 LYS 74 -0.157 0.846 10.319 546 HE2 LYS 74 HE2 LYS 74 -0.522 -2.117 9.906 547 HE3 LYS 74 HE3 LYS 74 -0.460 -1.378 11.503 548 HZ1 LYS 74 HZ1 LYS 74 -2.456 -0.851 9.373 549 HZ2 LYS 74 HZ2 LYS 74 -2.332 0.068 10.779 550 HZ3 LYS 74 HZ3 LYS 74 -2.728 -1.576 10.877 551 H VAL 75 H VAL 75 0.219 0.711 4.594 552 HA VAL 75 HA VAL 75 2.679 2.314 4.540 553 HB VAL 75 HB VAL 75 0.206 2.554 2.804 554 HG11 VAL 75 HG11 VAL 75 2.958 3.766 2.500 555 HG12 VAL 75 HG12 VAL 75 1.480 4.630 2.925 556 HG13 VAL 75 HG13 VAL 75 1.644 3.894 1.330 557 HG21 VAL 75 HG21 VAL 75 1.493 1.412 1.069 558 HG22 VAL 75 HG22 VAL 75 1.311 0.386 2.493 559 HG23 VAL 75 HG23 VAL 75 2.840 1.209 2.187 560 H LYS 76 H LYS 76 2.837 4.208 5.613 561 HA LYS 76 HA LYS 76 0.366 5.569 6.507 562 HB2 LYS 76 HB2 LYS 76 3.050 5.334 7.884 563 HB3 LYS 76 HB3 LYS 76 1.854 6.534 8.349 564 HG2 LYS 76 HG2 LYS 76 1.594 4.757 9.858 565 HG3 LYS 76 HG3 LYS 76 0.251 4.614 8.726 566 HD2 LYS 76 HD2 LYS 76 1.075 2.419 9.033 567 HD3 LYS 76 HD3 LYS 76 1.673 2.932 7.457 568 HE2 LYS 76 HE2 LYS 76 3.425 1.792 8.687 569 HE3 LYS 76 HE3 LYS 76 3.844 3.495 8.489 570 HZ1 LYS 76 HZ1 LYS 76 2.595 2.371 10.940 571 HZ2 LYS 76 HZ2 LYS 76 3.224 3.927 10.734 572 HZ3 LYS 76 HZ3 LYS 76 4.261 2.596 10.746 573 H THR 77 H THR 77 0.126 7.710 6.095 574 HA THR 77 HA THR 77 2.466 9.285 5.207 575 HB THR 77 HB THR 77 1.151 10.465 3.542 576 HG1 THR 77 HG1 THR 77 -1.023 9.564 3.083 577 HG21 THR 77 HG21 THR 77 2.274 8.424 2.770 578 HG22 THR 77 HG22 THR 77 0.772 8.694 1.889 579 HG23 THR 77 HG23 THR 77 0.838 7.479 3.164 580 H GLU 78 H GLU 78 1.425 11.767 5.004 581 HA GLU 78 HA GLU 78 0.643 12.435 7.689 582 HB2 GLU 78 HB2 GLU 78 0.661 14.750 6.960 583 HB3 GLU 78 HB3 GLU 78 2.094 13.928 6.356 584 HG2 GLU 78 HG2 GLU 78 1.202 13.824 4.148 585 HG3 GLU 78 HG3 GLU 78 -0.380 14.374 4.696 586 H PHE 79 H PHE 79 -1.118 11.255 5.140 587 HA PHE 79 HA PHE 79 -3.566 12.736 5.805 588 HB2 PHE 79 HB2 PHE 79 -2.974 10.794 3.554 589 HB3 PHE 79 HB3 PHE 79 -4.531 11.575 3.815 590 HD1 PHE 79 HD2 PHE 79 -4.795 13.986 3.457 591 HD2 PHE 79 HD1 PHE 79 -1.113 12.011 2.617 592 HE1 PHE 79 HE2 PHE 79 -4.054 15.930 2.147 593 HE2 PHE 79 HE1 PHE 79 -0.369 13.956 1.308 594 HZ PHE 79 HZ PHE 79 -1.839 15.917 1.069 595 H GLY 80 H GLY 80 -2.395 9.368 5.538 596 HA2 GLY 80 HA2 GLY 80 -3.778 8.488 7.850 597 HA3 GLY 80 HA3 GLY 80 -4.717 8.076 6.423 598 H GLU 81 H GLU 81 -4.384 5.821 7.062 599 HA GLU 81 HA GLU 81 -1.940 4.790 5.836 600 HB2 GLU 81 HB2 GLU 81 -1.472 3.230 7.634 601 HB3 GLU 81 HB3 GLU 81 -1.436 4.880 8.239 602 HG2 GLU 81 HG2 GLU 81 -3.519 4.620 9.344 603 HG3 GLU 81 HG3 GLU 81 -3.845 3.094 8.524 604 H VAL 82 H VAL 82 -2.023 2.504 5.304 605 HA VAL 82 HA VAL 82 -4.554 1.106 5.483 606 HB VAL 82 HB VAL 82 -4.861 2.594 3.506 607 HG11 VAL 82 HG11 VAL 82 -3.622 2.174 1.447 608 HG12 VAL 82 HG12 VAL 82 -2.613 0.994 2.281 609 HG13 VAL 82 HG13 VAL 82 -2.545 2.693 2.742 610 HG21 VAL 82 HG21 VAL 82 -5.616 0.818 1.945 611 HG22 VAL 82 HG22 VAL 82 -6.130 0.549 3.610 612 HG23 VAL 82 HG23 VAL 82 -4.780 -0.373 2.945 613 H VAL 83 H VAL 83 -4.355 -1.135 5.098 614 HA VAL 83 HA VAL 83 -1.590 -2.116 4.776 615 HB VAL 83 HB VAL 83 -3.979 -3.615 5.889 616 HG11 VAL 83 HG11 VAL 83 -2.318 -5.241 6.676 617 HG12 VAL 83 HG12 VAL 83 -1.033 -4.310 5.903 618 HG13 VAL 83 HG13 VAL 83 -2.278 -5.082 4.919 619 HG21 VAL 83 HG21 VAL 83 -3.364 -1.747 7.357 620 HG22 VAL 83 HG22 VAL 83 -1.695 -2.315 7.391 621 HG23 VAL 83 HG23 VAL 83 -2.975 -3.300 8.099 622 H VAL 84 H VAL 84 -1.079 -2.946 2.839 623 HA VAL 84 HA VAL 84 -3.183 -4.249 1.210 624 HB VAL 84 HB VAL 84 -2.155 -3.339 -0.824 625 HG11 VAL 84 HG11 VAL 84 -2.827 -0.982 -0.565 626 HG12 VAL 84 HG12 VAL 84 -2.875 -1.200 1.185 627 HG13 VAL 84 HG13 VAL 84 -3.996 -2.090 0.155 628 HG21 VAL 84 HG21 VAL 84 -0.337 -1.808 1.047 629 HG22 VAL 84 HG22 VAL 84 -0.448 -1.567 -0.696 630 HG23 VAL 84 HG23 VAL 84 0.145 -3.098 -0.055 631 H PHE 85 H PHE 85 -2.030 -5.447 -0.742 632 HA PHE 85 HA PHE 85 -0.158 -7.337 0.414 633 HB2 PHE 85 HB2 PHE 85 -1.440 -7.184 -2.328 634 HB3 PHE 85 HB3 PHE 85 -0.345 -8.469 -1.832 635 HD1 PHE 85 HD1 PHE 85 -1.003 -9.894 0.172 636 HD2 PHE 85 HD2 PHE 85 -3.734 -7.309 -1.835 637 HE1 PHE 85 HE1 PHE 85 -2.889 -11.153 1.120 638 HE2 PHE 85 HE2 PHE 85 -5.624 -8.563 -0.883 639 HZ PHE 85 HZ PHE 85 -5.203 -10.489 0.595 640 H ALA 86 H ALA 86 1.971 -7.645 -0.139 641 HA ALA 86 HA ALA 86 3.297 -5.347 -1.348 642 HB1 ALA 86 HB1 ALA 86 4.094 -6.191 0.798 643 HB2 ALA 86 HB2 ALA 86 5.348 -6.314 -0.436 644 HB3 ALA 86 HB3 ALA 86 4.454 -7.752 0.063 645 H LYS 87 H LYS 87 3.971 -5.302 -3.394 646 HA LYS 87 HA LYS 87 4.761 -7.823 -4.723 647 HB2 LYS 87 HB2 LYS 87 3.358 -5.423 -5.898 648 HB3 LYS 87 HB3 LYS 87 4.217 -6.577 -6.896 649 HG2 LYS 87 HG2 LYS 87 2.691 -8.346 -5.914 650 HG3 LYS 87 HG3 LYS 87 1.734 -7.006 -5.267 651 HD2 LYS 87 HD2 LYS 87 1.523 -6.081 -7.546 652 HD3 LYS 87 HD3 LYS 87 2.436 -7.453 -8.175 653 HE2 LYS 87 HE2 LYS 87 0.666 -8.946 -7.266 654 HE3 LYS 87 HE3 LYS 87 -0.265 -7.515 -6.843 655 HZ1 LYS 87 HZ1 LYS 87 -1.018 -8.326 -8.951 656 HZ2 LYS 87 HZ2 LYS 87 0.554 -8.360 -9.568 657 HZ3 LYS 87 HZ3 LYS 87 -0.182 -6.877 -9.220 658 H LYS 88 H LYS 88 6.426 -7.676 -6.305 659 HA LYS 88 HA LYS 88 8.344 -5.536 -5.756 660 HB2 LYS 88 HB2 LYS 88 8.805 -8.131 -5.716 661 HB3 LYS 88 HB3 LYS 88 8.949 -7.930 -7.460 662 HG2 LYS 88 HG2 LYS 88 10.668 -6.236 -7.115 663 HG3 LYS 88 HG3 LYS 88 10.523 -6.456 -5.373 664 HD2 LYS 88 HD2 LYS 88 11.342 -8.611 -7.331 665 HD3 LYS 88 HD3 LYS 88 12.457 -7.669 -6.344 666 HE2 LYS 88 HE2 LYS 88 11.388 -8.552 -4.307 667 HE3 LYS 88 HE3 LYS 88 10.298 -9.514 -5.306 668 HZ1 LYS 88 HZ1 LYS 88 12.175 -10.735 -6.157 669 HZ2 LYS 88 HZ2 LYS 88 12.192 -10.795 -4.469 670 HZ3 LYS 88 HZ3 LYS 88 13.258 -9.771 -5.287 671 H GLY 89 H GLY 89 8.409 -3.844 -7.154 672 HA2 GLY 89 HA2 GLY 89 7.350 -4.280 -9.893 673 HA3 GLY 89 HA3 GLY 89 7.006 -2.844 -8.950 674 H ASP 90 H ASP 90 7.787 -2.109 -11.192 675 HA ASP 90 HA ASP 90 10.671 -2.091 -11.582 676 HB2 ASP 90 HB2 ASP 90 8.484 -0.796 -13.233 677 HB3 ASP 90 HB3 ASP 90 10.148 -1.090 -13.732 678 H VAL 91 H VAL 91 9.751 -0.662 -9.266 679 HA VAL 91 HA VAL 91 9.828 2.181 -10.013 680 HB VAL 91 HB VAL 91 9.028 2.604 -7.702 681 HG11 VAL 91 HG11 VAL 91 7.407 2.373 -9.513 682 HG12 VAL 91 HG12 VAL 91 6.756 1.700 -8.018 683 HG13 VAL 91 HG13 VAL 91 7.366 0.624 -9.276 684 HG21 VAL 91 HG21 VAL 91 8.255 0.704 -6.328 685 HG22 VAL 91 HG22 VAL 91 10.001 0.670 -6.582 686 HG23 VAL 91 HG23 VAL 91 8.954 -0.414 -7.501 687 HA PRO 92 HA PRO 92 13.950 2.853 -8.336 688 HB2 PRO 92 HB2 PRO 92 12.907 5.448 -7.335 689 HB3 PRO 92 HB3 PRO 92 14.244 5.126 -8.443 690 HG2 PRO 92 HG2 PRO 92 11.940 6.141 -9.339 691 HG3 PRO 92 HG3 PRO 92 12.848 4.949 -10.291 692 HD2 PRO 92 HD2 PRO 92 10.412 4.549 -8.582 693 HD3 PRO 92 HD3 PRO 92 10.784 3.881 -10.187 694 H LYS 93 H LYS 93 15.048 3.328 -6.220 695 HA LYS 93 HA LYS 93 13.716 1.893 -4.142 696 HB2 LYS 93 HB2 LYS 93 16.207 1.886 -4.505 697 HB3 LYS 93 HB3 LYS 93 16.252 3.520 -3.846 698 HG2 LYS 93 HG2 LYS 93 15.200 2.633 -1.762 699 HG3 LYS 93 HG3 LYS 93 15.360 1.011 -2.434 700 HD2 LYS 93 HD2 LYS 93 17.819 1.382 -2.578 701 HD3 LYS 93 HD3 LYS 93 17.589 2.923 -1.743 702 HE2 LYS 93 HE2 LYS 93 16.967 0.162 -0.692 703 HE3 LYS 93 HE3 LYS 93 18.222 1.262 -0.120 704 HZ1 LYS 93 HZ1 LYS 93 16.300 1.273 1.338 705 HZ2 LYS 93 HZ2 LYS 93 15.290 1.734 0.065 706 HZ3 LYS 93 HZ3 LYS 93 16.495 2.788 0.616 707 H GLY 94 H GLY 94 13.066 2.611 -2.055 708 HA2 GLY 94 HA2 GLY 94 11.916 4.025 -0.649 709 HA3 GLY 94 HA3 GLY 94 12.944 5.320 -1.249 710 H MET 95 H MET 95 10.801 3.399 -3.266 711 HA MET 95 HA MET 95 8.780 5.485 -3.417 712 HB2 MET 95 HB2 MET 95 10.693 6.094 -4.957 713 HB3 MET 95 HB3 MET 95 10.346 4.631 -5.866 714 HG2 MET 95 HG2 MET 95 8.197 5.457 -6.485 715 HG3 MET 95 HG3 MET 95 8.379 6.854 -5.423 716 HE1 MET 95 HE1 MET 95 7.534 7.464 -8.352 717 HE2 MET 95 HE2 MET 95 8.670 8.746 -8.775 718 HE3 MET 95 HE3 MET 95 7.955 8.697 -7.164 719 H ILE 96 H ILE 96 6.778 4.608 -3.984 720 HA ILE 96 HA ILE 96 6.737 1.874 -5.064 721 HB ILE 96 HB ILE 96 4.999 1.174 -3.450 722 HG12 ILE 96 HG12 ILE 96 5.706 3.735 -1.980 723 HG13 ILE 96 HG13 ILE 96 4.180 3.413 -2.796 724 HG21 ILE 96 HG21 ILE 96 7.324 0.535 -3.094 725 HG22 ILE 96 HG22 ILE 96 6.497 0.781 -1.557 726 HG23 ILE 96 HG23 ILE 96 7.603 2.011 -2.169 727 HD11 ILE 96 HD11 ILE 96 5.260 1.951 -0.390 728 HD12 ILE 96 HD12 ILE 96 3.753 1.566 -1.223 729 HD13 ILE 96 HD13 ILE 96 3.941 3.120 -0.410 730 H PHE 97 H PHE 97 5.097 1.401 -6.411 731 HA PHE 97 HA PHE 97 3.204 3.559 -7.056 732 HB2 PHE 97 HB2 PHE 97 4.530 2.769 -8.942 733 HB3 PHE 97 HB3 PHE 97 4.049 1.105 -8.630 734 HD1 PHE 97 HD2 PHE 97 2.967 4.357 -9.948 735 HD2 PHE 97 HD1 PHE 97 1.870 0.291 -9.295 736 HE1 PHE 97 HE2 PHE 97 1.048 4.631 -11.460 737 HE2 PHE 97 HE1 PHE 97 -0.051 0.562 -10.805 738 HZ PHE 97 HZ PHE 97 -0.464 2.733 -11.890 739 H ILE 98 H ILE 98 1.089 3.375 -6.540 740 HA ILE 98 HA ILE 98 -0.018 0.670 -6.089 741 HB ILE 98 HB ILE 98 -0.838 3.236 -4.691 742 HG12 ILE 98 HG12 ILE 98 0.622 0.771 -3.694 743 HG13 ILE 98 HG13 ILE 98 1.265 2.406 -3.808 744 HG21 ILE 98 HG21 ILE 98 -1.905 0.425 -4.374 745 HG22 ILE 98 HG22 ILE 98 -2.762 1.794 -5.083 746 HG23 ILE 98 HG23 ILE 98 -2.348 1.807 -3.369 747 HD11 ILE 98 HD11 ILE 98 -0.918 1.469 -1.956 748 HD12 ILE 98 HD12 ILE 98 -0.351 3.134 -2.100 749 HD13 ILE 98 HD13 ILE 98 0.741 1.877 -1.518 750 HA PRO 99 HA PRO 99 -2.859 1.775 -9.434 751 HB2 PRO 99 HB2 PRO 99 -4.528 -0.351 -8.183 752 HB3 PRO 99 HB3 PRO 99 -3.978 -0.195 -9.854 753 HG2 PRO 99 HG2 PRO 99 -2.880 -2.003 -8.234 754 HG3 PRO 99 HG3 PRO 99 -1.889 -1.099 -9.395 755 HD2 PRO 99 HD2 PRO 99 -2.189 -0.686 -6.437 756 HD3 PRO 99 HD3 PRO 99 -0.726 -0.611 -7.444 757 H MET 100 H MET 100 -4.321 3.399 -9.390 758 HA MET 100 HA MET 100 -5.145 4.648 -7.050 759 HB2 MET 100 HB2 MET 100 -5.050 5.786 -9.198 760 HB3 MET 100 HB3 MET 100 -6.368 4.805 -9.810 761 HG2 MET 100 HG2 MET 100 -7.249 6.938 -9.298 762 HG3 MET 100 HG3 MET 100 -7.840 5.829 -8.066 763 HE1 MET 100 HE1 MET 100 -7.799 6.381 -5.624 764 HE2 MET 100 HE2 MET 100 -6.423 7.119 -4.803 765 HE3 MET 100 HE3 MET 100 -6.222 5.587 -5.653 766 H GLY 101 H GLY 101 -6.444 3.874 -5.518 767 HA2 GLY 101 HA2 GLY 101 -9.152 3.075 -6.154 768 HA3 GLY 101 HA3 GLY 101 -8.154 1.744 -5.588 769 HA PRO 102 HA PRO 102 -10.292 3.959 -1.969 770 HB2 PRO 102 HB2 PRO 102 -10.872 1.548 -0.703 771 HB3 PRO 102 HB3 PRO 102 -11.986 2.440 -1.744 772 HG2 PRO 102 HG2 PRO 102 -10.223 0.111 -2.413 773 HG3 PRO 102 HG3 PRO 102 -11.897 0.432 -2.909 774 HD2 PRO 102 HD2 PRO 102 -9.869 0.865 -4.593 775 HD3 PRO 102 HD3 PRO 102 -11.251 1.979 -4.535 776 H TYR 103 H TYR 103 -8.058 1.243 -2.156 777 HA TYR 103 HA TYR 103 -6.938 1.429 0.423 778 HB2 TYR 103 HB2 TYR 103 -5.759 0.368 -2.160 779 HB3 TYR 103 HB3 TYR 103 -5.034 0.142 -0.570 780 HD1 TYR 103 HD2 TYR 103 -8.147 -0.559 -2.516 781 HD2 TYR 103 HD1 TYR 103 -5.679 -1.679 0.771 782 HE1 TYR 103 HE2 TYR 103 -9.513 -2.574 -2.179 783 HE2 TYR 103 HE1 TYR 103 -7.040 -3.692 1.111 784 HH TYR 103 HH TYR 103 -9.150 -4.894 -1.130 785 H ALA 104 H ALA 104 -5.670 2.637 -2.696 786 HA ALA 104 HA ALA 104 -3.562 4.160 -1.632 787 HB1 ALA 104 HB1 ALA 104 -3.726 3.579 -4.006 788 HB2 ALA 104 HB2 ALA 104 -3.539 5.317 -3.788 789 HB3 ALA 104 HB3 ALA 104 -5.122 4.643 -4.176 790 H ASN 105 H ASN 105 -6.936 4.960 -2.234 791 HA ASN 105 HA ASN 105 -6.907 7.707 -1.792 792 HB2 ASN 105 HB2 ASN 105 -8.822 6.643 -2.746 793 HB3 ASN 105 HB3 ASN 105 -9.035 5.611 -1.339 794 HD21 ASN 105 HD21 ASN 105 -10.060 6.398 0.441 795 HD22 ASN 105 HD22 ASN 105 -10.887 7.917 0.461 796 H MET 106 H MET 106 -6.414 5.189 0.488 797 HA MET 106 HA MET 106 -7.252 6.616 2.839 798 HB2 MET 106 HB2 MET 106 -5.472 4.190 2.501 799 HB3 MET 106 HB3 MET 106 -6.057 4.791 4.048 800 HG2 MET 106 HG2 MET 106 -7.888 3.940 1.822 801 HG3 MET 106 HG3 MET 106 -7.303 2.843 3.073 802 HE1 MET 106 HE1 MET 106 -8.104 2.767 5.479 803 HE2 MET 106 HE2 MET 106 -8.956 4.078 6.294 804 HE3 MET 106 HE3 MET 106 -7.302 4.317 5.736 805 H VAL 107 H VAL 107 -4.389 6.661 0.896 806 HA VAL 107 HA VAL 107 -2.890 8.001 3.070 807 HB VAL 107 HB VAL 107 -0.797 7.076 2.074 808 HG11 VAL 107 HG11 VAL 107 -1.753 6.056 4.052 809 HG12 VAL 107 HG12 VAL 107 -1.066 4.811 3.009 810 HG13 VAL 107 HG13 VAL 107 -2.813 5.054 3.060 811 HG21 VAL 107 HG21 VAL 107 -1.615 6.594 -0.177 812 HG22 VAL 107 HG22 VAL 107 -2.698 5.359 0.465 813 HG23 VAL 107 HG23 VAL 107 -0.951 5.140 0.566 814 H ILE 108 H ILE 108 -3.765 8.040 -0.305 815 HA ILE 108 HA ILE 108 -1.855 10.112 -0.965 816 HB ILE 108 HB ILE 108 -2.593 10.019 -3.173 817 HG12 ILE 108 HG12 ILE 108 -5.034 8.406 -2.402 818 HG13 ILE 108 HG13 ILE 108 -5.065 10.164 -2.556 819 HG21 ILE 108 HG21 ILE 108 -1.364 8.038 -2.635 820 HG22 ILE 108 HG22 ILE 108 -2.694 7.566 -3.701 821 HG23 ILE 108 HG23 ILE 108 -2.800 7.259 -1.969 822 HD11 ILE 108 HD11 ILE 108 -5.819 9.206 -4.599 823 HD12 ILE 108 HD12 ILE 108 -4.390 8.174 -4.689 824 HD13 ILE 108 HD13 ILE 108 -4.223 9.923 -4.858 825 H ASP 109 H ASP 109 -2.924 12.006 -2.371 826 HA ASP 109 HA ASP 109 -4.947 13.268 -0.633 827 HB2 ASP 109 HB2 ASP 109 -2.891 14.542 -0.735 828 HB3 ASP 109 HB3 ASP 109 -2.910 14.507 -2.497 829 HA PRO 110 HA PRO 110 -7.548 12.880 -4.342 830 HB2 PRO 110 HB2 PRO 110 -9.910 12.863 -3.091 831 HB3 PRO 110 HB3 PRO 110 -8.835 11.459 -3.015 832 HG2 PRO 110 HG2 PRO 110 -9.286 13.609 -0.974 833 HG3 PRO 110 HG3 PRO 110 -9.136 11.859 -0.737 834 HD2 PRO 110 HD2 PRO 110 -7.082 13.676 -0.362 835 HD3 PRO 110 HD3 PRO 110 -6.848 11.948 -0.691 836 H SER 111 H SER 111 -7.074 15.406 -2.137 837 HA SER 111 HA SER 111 -9.173 17.188 -2.850 838 HB2 SER 111 HB2 SER 111 -6.442 17.886 -1.731 839 HB3 SER 111 HB3 SER 111 -7.889 18.894 -1.679 840 HG SER 111 HG SER 111 -7.122 16.868 -0.034 841 H THR 112 H THR 112 -5.772 16.962 -3.914 842 HA THR 112 HA THR 112 -5.873 19.110 -5.761 843 HB THR 112 HB THR 112 -3.756 18.125 -4.899 844 HG1 THR 112 HG1 THR 112 -2.658 18.508 -6.774 845 HG21 THR 112 HG21 THR 112 -4.359 15.748 -5.046 846 HG22 THR 112 HG22 THR 112 -2.863 16.082 -5.918 847 HG23 THR 112 HG23 THR 112 -4.368 15.858 -6.806 848 H ASP 113 H ASP 113 -6.095 19.121 -8.035 849 HA ASP 113 HA ASP 113 -7.459 16.754 -9.167 850 HB2 ASP 113 HB2 ASP 113 -8.922 18.732 -8.940 851 HB3 ASP 113 HB3 ASP 113 -7.813 19.663 -9.942 852 H GLY 114 H GLY 114 -6.768 15.918 -11.109 853 HA2 GLY 114 HA2 GLY 114 -4.502 17.294 -12.435 854 HA3 GLY 114 HA3 GLY 114 -4.421 15.585 -12.046 855 H THR 115 H THR 115 -4.691 17.501 -14.578 856 HA THR 115 HA THR 115 -6.748 15.907 -15.980 857 HB THR 115 HB THR 115 -6.732 17.690 -17.708 858 HG1 THR 115 HG1 THR 115 -5.549 19.569 -17.367 859 HG21 THR 115 HG21 THR 115 -7.821 19.448 -16.353 860 HG22 THR 115 HG22 THR 115 -7.208 18.680 -14.887 861 HG23 THR 115 HG23 THR 115 -8.370 17.830 -15.909 862 H GLY 116 H GLY 116 -6.111 14.408 -17.412 863 HA2 GLY 116 HA2 GLY 116 -4.742 14.074 -19.489 864 HA3 GLY 116 HA3 GLY 116 -3.367 14.602 -18.535 865 H MET 117 H MET 117 -2.156 12.757 -18.731 866 HA MET 117 HA MET 117 -3.058 10.106 -18.445 867 HB2 MET 117 HB2 MET 117 -0.685 9.529 -18.204 868 HB3 MET 117 HB3 MET 117 -0.916 10.703 -19.493 869 HG2 MET 117 HG2 MET 117 -0.113 12.483 -18.092 870 HG3 MET 117 HG3 MET 117 -0.028 11.404 -16.700 871 HE1 MET 117 HE1 MET 117 1.168 8.736 -18.108 872 HE2 MET 117 HE2 MET 117 1.652 9.359 -16.531 873 HE3 MET 117 HE3 MET 117 2.875 8.982 -17.746 874 HA PRO 118 HA PRO 118 -3.322 9.075 -14.060 875 HB2 PRO 118 HB2 PRO 118 -0.899 7.351 -14.485 876 HB3 PRO 118 HB3 PRO 118 -2.423 6.968 -13.669 877 HG2 PRO 118 HG2 PRO 118 -1.977 6.071 -16.124 878 HG3 PRO 118 HG3 PRO 118 -3.578 6.691 -15.679 879 HD2 PRO 118 HD2 PRO 118 -1.442 7.968 -17.331 880 HD3 PRO 118 HD3 PRO 118 -3.207 8.061 -17.498 881 H GLN 119 H GLN 119 -0.278 10.087 -15.413 882 HA GLN 119 HA GLN 119 1.173 11.689 -14.774 883 HB2 GLN 119 HB2 GLN 119 -0.812 12.779 -13.714 884 HB3 GLN 119 HB3 GLN 119 -0.427 11.936 -12.218 885 HG2 GLN 119 HG2 GLN 119 1.874 13.066 -12.416 886 HG3 GLN 119 HG3 GLN 119 1.100 14.122 -13.593 887 HE21 GLN 119 HE21 GLN 119 1.309 13.227 -10.256 888 HE22 GLN 119 HE22 GLN 119 0.387 14.548 -9.635 889 H PHE 120 H PHE 120 3.110 11.854 -13.639 890 HA PHE 120 HA PHE 120 3.782 9.645 -11.840 891 HB2 PHE 120 HB2 PHE 120 5.529 11.736 -13.175 892 HB3 PHE 120 HB3 PHE 120 6.128 10.471 -12.105 893 HD1 PHE 120 HD1 PHE 120 6.114 8.127 -12.818 894 HD2 PHE 120 HD2 PHE 120 4.857 11.246 -15.436 895 HE1 PHE 120 HE1 PHE 120 6.297 6.590 -14.731 896 HE2 PHE 120 HE2 PHE 120 5.044 9.715 -17.351 897 HZ PHE 120 HZ PHE 120 5.762 7.384 -17.002 898 H LYS 121 H LYS 121 5.612 10.602 -10.150 899 HA LYS 121 HA LYS 121 5.867 11.598 -8.135 900 HB2 LYS 121 HB2 LYS 121 4.349 13.816 -9.507 901 HB3 LYS 121 HB3 LYS 121 4.897 13.946 -7.843 902 HG2 LYS 121 HG2 LYS 121 6.761 13.344 -10.114 903 HG3 LYS 121 HG3 LYS 121 6.372 14.987 -9.608 904 HD2 LYS 121 HD2 LYS 121 8.272 14.641 -8.365 905 HD3 LYS 121 HD3 LYS 121 7.070 14.034 -7.229 906 HE2 LYS 121 HE2 LYS 121 7.500 11.734 -8.112 907 HE3 LYS 121 HE3 LYS 121 8.808 12.406 -9.088 908 HZ1 LYS 121 HZ1 LYS 121 8.622 12.264 -6.137 909 HZ2 LYS 121 HZ2 LYS 121 9.753 13.243 -6.928 910 HZ3 LYS 121 HZ3 LYS 121 9.791 11.569 -7.143 911 H GLY 122 H GLY 122 4.979 10.849 -6.397 912 HA2 GLY 122 HA2 GLY 122 2.018 10.838 -6.159 913 HA3 GLY 122 HA3 GLY 122 3.024 9.504 -5.621 914 H VAL 123 H VAL 123 1.547 10.088 -3.712 915 HA VAL 123 HA VAL 123 2.468 12.321 -2.083 916 HB VAL 123 HB VAL 123 0.537 10.092 -1.415 917 HG11 VAL 123 HG11 VAL 123 1.077 12.694 0.023 918 HG12 VAL 123 HG12 VAL 123 1.494 11.077 0.596 919 HG13 VAL 123 HG13 VAL 123 -0.200 11.543 0.427 920 HG21 VAL 123 HG21 VAL 123 -1.224 11.768 -1.823 921 HG22 VAL 123 HG22 VAL 123 -0.278 11.437 -3.273 922 HG23 VAL 123 HG23 VAL 123 0.006 12.917 -2.354 923 H LYS 124 H LYS 124 4.205 12.182 -0.773 924 HA LYS 124 HA LYS 124 5.544 9.667 -0.414 925 HB2 LYS 124 HB2 LYS 124 6.199 12.425 0.633 926 HB3 LYS 124 HB3 LYS 124 7.220 11.012 0.870 927 HG2 LYS 124 HG2 LYS 124 7.313 10.788 -1.638 928 HG3 LYS 124 HG3 LYS 124 6.521 12.361 -1.731 929 HD2 LYS 124 HD2 LYS 124 9.157 11.808 -0.353 930 HD3 LYS 124 HD3 LYS 124 8.975 12.519 -1.957 931 HE2 LYS 124 HE2 LYS 124 7.815 14.434 -1.000 932 HE3 LYS 124 HE3 LYS 124 7.900 13.706 0.603 933 HZ1 LYS 124 HZ1 LYS 124 10.251 14.479 -1.035 934 HZ2 LYS 124 HZ2 LYS 124 10.283 13.873 0.546 935 HZ3 LYS 124 HZ3 LYS 124 9.610 15.394 0.239 936 H GLY 125 H GLY 125 6.224 8.758 1.563 937 HA2 GLY 125 HA2 GLY 125 5.261 9.482 4.116 938 HA3 GLY 125 HA3 GLY 125 4.208 8.257 3.423 939 H THR 126 H THR 126 4.751 6.625 4.853 940 HA THR 126 HA THR 126 7.427 5.449 4.498 941 HB THR 126 HB THR 126 7.461 4.782 6.904 942 HG1 THR 126 HG1 THR 126 5.446 6.740 7.329 943 HG21 THR 126 HG21 THR 126 8.131 6.971 7.798 944 HG22 THR 126 HG22 THR 126 7.345 7.774 6.439 945 HG23 THR 126 HG23 THR 126 8.748 6.743 6.161 946 H VAL 127 H VAL 127 7.502 3.191 4.560 947 HA VAL 127 HA VAL 127 4.927 1.794 4.940 948 HB VAL 127 HB VAL 127 5.454 1.975 2.525 949 HG11 VAL 127 HG11 VAL 127 7.894 2.038 2.677 950 HG12 VAL 127 HG12 VAL 127 7.356 0.773 1.569 951 HG13 VAL 127 HG13 VAL 127 7.912 0.349 3.190 952 HG21 VAL 127 HG21 VAL 127 4.174 0.053 3.342 953 HG22 VAL 127 HG22 VAL 127 5.672 -0.847 3.593 954 HG23 VAL 127 HG23 VAL 127 5.179 -0.389 1.961 955 H GLU 128 H GLU 128 4.999 -0.149 6.009 956 HA GLU 128 HA GLU 128 7.556 -1.477 6.508 957 HB2 GLU 128 HB2 GLU 128 7.051 -1.657 8.959 958 HB3 GLU 128 HB3 GLU 128 7.415 -0.020 8.429 959 HG2 GLU 128 HG2 GLU 128 5.066 0.549 8.434 960 HG3 GLU 128 HG3 GLU 128 4.635 -1.108 8.861 961 H LYS 129 H LYS 129 7.349 -3.712 6.953 962 HA LYS 129 HA LYS 129 4.879 -4.944 6.176 963 HB2 LYS 129 HB2 LYS 129 7.049 -6.005 5.688 964 HB3 LYS 129 HB3 LYS 129 7.345 -6.196 7.413 965 HG2 LYS 129 HG2 LYS 129 5.489 -7.728 7.616 966 HG3 LYS 129 HG3 LYS 129 5.030 -7.449 5.934 967 HD2 LYS 129 HD2 LYS 129 6.206 -9.557 6.133 968 HD3 LYS 129 HD3 LYS 129 7.179 -8.415 5.208 969 HE2 LYS 129 HE2 LYS 129 8.578 -9.639 6.764 970 HE3 LYS 129 HE3 LYS 129 8.506 -7.939 7.226 971 HZ1 LYS 129 HZ1 LYS 129 8.277 -9.460 9.129 972 HZ2 LYS 129 HZ2 LYS 129 6.864 -10.091 8.448 973 HZ3 LYS 129 HZ3 LYS 129 6.918 -8.474 8.931 974 H THR 130 H THR 130 3.391 -6.071 7.484 975 HA THR 130 HA THR 130 3.533 -5.296 10.338 976 HB THR 130 HB THR 130 2.124 -3.659 9.300 977 HG1 THR 130 HG1 THR 130 0.965 -3.944 11.047 978 HG21 THR 130 HG21 THR 130 0.541 -5.965 8.148 979 HG22 THR 130 HG22 THR 130 1.568 -4.857 7.239 980 HG23 THR 130 HG23 THR 130 0.108 -4.261 8.027 981 H ASP 131 H ASP 131 2.100 -6.409 11.778 982 HA ASP 131 HA ASP 131 1.591 -9.194 11.052 983 HB2 ASP 131 HB2 ASP 131 1.320 -7.781 13.725 984 HB3 ASP 131 HB3 ASP 131 1.189 -9.517 13.458 985 H GLU 132 H GLU 132 -0.022 -6.467 10.564 986 HA GLU 132 HA GLU 132 -2.679 -7.245 11.448 987 HB2 GLU 132 HB2 GLU 132 -1.693 -4.922 9.781 988 HB3 GLU 132 HB3 GLU 132 -3.373 -5.158 10.245 989 HG2 GLU 132 HG2 GLU 132 -1.147 -4.929 12.254 990 HG3 GLU 132 HG3 GLU 132 -2.017 -3.531 11.627 991 H LYS 133 H LYS 133 -4.487 -7.240 9.860 992 HA LYS 133 HA LYS 133 -3.785 -8.844 7.532 993 HB2 LYS 133 HB2 LYS 133 -6.273 -9.171 7.336 994 HB3 LYS 133 HB3 LYS 133 -5.557 -9.766 8.822 995 HG2 LYS 133 HG2 LYS 133 -7.584 -8.755 9.451 996 HG3 LYS 133 HG3 LYS 133 -6.325 -7.616 9.918 997 HD2 LYS 133 HD2 LYS 133 -6.789 -6.244 7.970 998 HD3 LYS 133 HD3 LYS 133 -7.960 -7.424 7.380 999 HE2 LYS 133 HE2 LYS 133 -8.201 -5.912 9.986 1000 HE3 LYS 133 HE3 LYS 133 -8.996 -5.446 8.484 1001 HZ1 LYS 133 HZ1 LYS 133 -9.429 -7.985 9.967 1002 HZ2 LYS 133 HZ2 LYS 133 -10.178 -7.569 8.509 1003 HZ3 LYS 133 HZ3 LYS 133 -10.496 -6.673 9.907 1004 H VAL 134 H VAL 134 -4.817 -8.408 5.418 1005 HA VAL 134 HA VAL 134 -4.463 -5.680 4.622 1006 HB VAL 134 HB VAL 134 -5.608 -8.031 3.084 1007 HG11 VAL 134 HG11 VAL 134 -4.747 -5.317 2.052 1008 HG12 VAL 134 HG12 VAL 134 -6.407 -5.910 2.143 1009 HG13 VAL 134 HG13 VAL 134 -5.250 -6.690 1.063 1010 HG21 VAL 134 HG21 VAL 134 -3.400 -8.063 1.987 1011 HG22 VAL 134 HG22 VAL 134 -3.284 -8.355 3.720 1012 HG23 VAL 134 HG23 VAL 134 -2.856 -6.775 3.066 1013 H LEU 135 H LEU 135 -5.939 -4.070 4.524 1014 HA LEU 135 HA LEU 135 -8.534 -4.433 5.605 1015 HB2 LEU 135 HB2 LEU 135 -7.067 -2.155 4.390 1016 HB3 LEU 135 HB3 LEU 135 -8.817 -2.049 4.395 1017 HG LEU 135 HG LEU 135 -6.983 -2.248 6.783 1018 HD11 LEU 135 HD11 LEU 135 -8.065 -0.136 7.395 1019 HD12 LEU 135 HD12 LEU 135 -9.001 -0.189 5.900 1020 HD13 LEU 135 HD13 LEU 135 -7.245 -0.027 5.837 1021 HD21 LEU 135 HD21 LEU 135 -9.051 -2.225 8.157 1022 HD22 LEU 135 HD22 LEU 135 -8.855 -3.711 7.230 1023 HD23 LEU 135 HD23 LEU 135 -10.000 -2.483 6.688 1024 H SER 136 H SER 136 -9.548 -6.020 4.417 1025 HA SER 136 HA SER 136 -9.921 -6.164 1.672 1026 HB2 SER 136 HB2 SER 136 -11.902 -6.919 3.842 1027 HB3 SER 136 HB3 SER 136 -11.972 -7.464 2.166 1028 HG SER 136 HG SER 136 -9.540 -7.917 3.377 1029 H VAL 137 H VAL 137 -11.712 -5.537 0.307 1030 HA VAL 137 HA VAL 137 -11.881 -2.829 0.132 1031 HB VAL 137 HB VAL 137 -13.923 -4.790 -0.934 1032 HG11 VAL 137 HG11 VAL 137 -14.371 -3.072 -2.650 1033 HG12 VAL 137 HG12 VAL 137 -13.296 -1.960 -1.801 1034 HG13 VAL 137 HG13 VAL 137 -14.784 -2.511 -1.030 1035 HG21 VAL 137 HG21 VAL 137 -11.635 -5.333 -1.620 1036 HG22 VAL 137 HG22 VAL 137 -11.406 -3.681 -2.194 1037 HG23 VAL 137 HG23 VAL 137 -12.575 -4.735 -2.989 1038 H LYS 138 H LYS 138 -14.487 -4.881 1.527 1039 HA LYS 138 HA LYS 138 -16.073 -2.597 2.227 1040 HB2 LYS 138 HB2 LYS 138 -17.060 -4.854 1.842 1041 HB3 LYS 138 HB3 LYS 138 -16.312 -5.403 3.338 1042 HG2 LYS 138 HG2 LYS 138 -17.596 -3.711 4.587 1043 HG3 LYS 138 HG3 LYS 138 -18.365 -3.203 3.086 1044 HD2 LYS 138 HD2 LYS 138 -19.878 -4.657 4.233 1045 HD3 LYS 138 HD3 LYS 138 -19.242 -5.530 2.837 1046 HE2 LYS 138 HE2 LYS 138 -17.786 -6.822 4.198 1047 HE3 LYS 138 HE3 LYS 138 -18.077 -5.796 5.603 1048 HZ1 LYS 138 HZ1 LYS 138 -20.163 -7.460 4.301 1049 HZ2 LYS 138 HZ2 LYS 138 -20.302 -6.600 5.753 1050 HZ3 LYS 138 HZ3 LYS 138 -19.275 -7.938 5.657 1051 H GLU 139 H GLU 139 -13.769 -4.632 4.016 1052 HA GLU 139 HA GLU 139 -14.247 -3.667 6.608 1053 HB2 GLU 139 HB2 GLU 139 -12.813 -5.635 6.021 1054 HB3 GLU 139 HB3 GLU 139 -11.592 -4.528 5.411 1055 HG2 GLU 139 HG2 GLU 139 -10.851 -5.107 7.541 1056 HG3 GLU 139 HG3 GLU 139 -11.571 -3.513 7.749 1057 H LEU 140 H LEU 140 -12.265 -2.467 3.984 1058 HA LEU 140 HA LEU 140 -11.050 -0.269 5.218 1059 HB2 LEU 140 HB2 LEU 140 -10.748 -1.443 2.893 1060 HB3 LEU 140 HB3 LEU 140 -11.923 -0.261 2.350 1061 HG LEU 140 HG LEU 140 -9.424 0.576 3.787 1062 HD11 LEU 140 HD11 LEU 140 -9.729 0.125 0.823 1063 HD12 LEU 140 HD12 LEU 140 -8.718 -0.809 1.927 1064 HD13 LEU 140 HD13 LEU 140 -8.348 0.889 1.618 1065 HD21 LEU 140 HD21 LEU 140 -11.240 1.980 1.823 1066 HD22 LEU 140 HD22 LEU 140 -9.772 2.659 2.530 1067 HD23 LEU 140 HD23 LEU 140 -11.147 2.270 3.563 1068 H LEU 141 H LEU 141 -14.168 -0.580 3.512 1069 HA LEU 141 HA LEU 141 -15.023 2.090 3.687 1070 HB2 LEU 141 HB2 LEU 141 -16.806 -0.344 3.947 1071 HB3 LEU 141 HB3 LEU 141 -17.280 1.255 3.407 1072 HG LEU 141 HG LEU 141 -15.499 -0.679 1.912 1073 HD11 LEU 141 HD11 LEU 141 -18.319 0.267 1.379 1074 HD12 LEU 141 HD12 LEU 141 -17.828 -1.352 1.882 1075 HD13 LEU 141 HD13 LEU 141 -17.354 -0.741 0.298 1076 HD21 LEU 141 HD21 LEU 141 -14.788 1.607 1.505 1077 HD22 LEU 141 HD22 LEU 141 -16.445 2.078 1.125 1078 HD23 LEU 141 HD23 LEU 141 -15.588 0.944 0.080 1079 H GLU 142 H GLU 142 -15.762 -0.642 5.843 1080 HA GLU 142 HA GLU 142 -17.091 0.673 7.876 1081 HB2 GLU 142 HB2 GLU 142 -15.170 -1.656 8.121 1082 HB3 GLU 142 HB3 GLU 142 -16.382 -1.205 9.314 1083 HG2 GLU 142 HG2 GLU 142 -17.005 -2.038 6.481 1084 HG3 GLU 142 HG3 GLU 142 -17.039 -3.119 7.871 1085 H ALA 143 H ALA 143 -13.605 0.312 7.400 1086 HA ALA 143 HA ALA 143 -12.729 1.445 9.816 1087 HB1 ALA 143 HB1 ALA 143 -11.339 1.485 7.133 1088 HB2 ALA 143 HB2 ALA 143 -11.268 0.172 8.309 1089 HB3 ALA 143 HB3 ALA 143 -10.580 1.749 8.705 1090 H ILE 144 H ILE 144 -13.445 2.989 6.680 1091 HA ILE 144 HA ILE 144 -12.798 5.611 7.760 1092 HB ILE 144 HB ILE 144 -13.321 6.480 5.502 1093 HG12 ILE 144 HG12 ILE 144 -13.407 4.529 3.713 1094 HG13 ILE 144 HG13 ILE 144 -14.130 3.625 5.035 1095 HG21 ILE 144 HG21 ILE 144 -11.386 5.464 4.397 1096 HG22 ILE 144 HG22 ILE 144 -11.407 4.147 5.572 1097 HG23 ILE 144 HG23 ILE 144 -11.063 5.795 6.100 1098 HD11 ILE 144 HD11 ILE 144 -15.901 5.309 5.199 1099 HD12 ILE 144 HD12 ILE 144 -15.825 4.579 3.597 1100 HD13 ILE 144 HD13 ILE 144 -15.170 6.194 3.861 1101 H GLY 145 H GLY 145 -15.515 3.669 7.788 1102 HA2 GLY 145 HA2 GLY 145 -17.376 4.418 9.150 1103 HA3 GLY 145 HA3 GLY 145 -17.191 6.020 8.455 1104 H SER 146 H SER 146 -16.850 3.949 5.932 1105 HA SER 146 HA SER 146 -18.131 3.480 4.107 1106 HB2 SER 146 HB2 SER 146 -20.103 2.700 6.276 1107 HB3 SER 146 HB3 SER 146 -20.278 2.279 4.570 1108 HG SER 146 HG SER 146 -19.275 0.632 5.916 Start of MODEL 19 1 H1 MET 1 H1 MET 1 28.314 59.512 13.056 2 H2 MET 1 H2 MET 1 28.290 61.118 12.531 3 H3 MET 1 H3 MET 1 28.242 59.861 11.402 4 HA MET 1 HA MET 1 26.135 60.485 13.395 5 HB2 MET 1 HB2 MET 1 26.166 60.811 10.382 6 HB3 MET 1 HB3 MET 1 24.777 61.098 11.420 7 HG2 MET 1 HG2 MET 1 25.903 62.932 12.501 8 HG3 MET 1 HG3 MET 1 27.377 62.607 11.590 9 HE1 MET 1 HE1 MET 1 23.616 63.753 11.357 10 HE2 MET 1 HE2 MET 1 23.683 62.430 10.191 11 HE3 MET 1 HE3 MET 1 23.459 64.088 9.634 12 H GLY 2 H GLY 2 24.092 59.264 12.931 13 HA2 GLY 2 HA2 GLY 2 23.050 57.379 11.778 14 HA3 GLY 2 HA3 GLY 2 24.630 56.619 11.706 15 H SER 3 H SER 3 23.260 54.820 12.607 16 HA SER 3 HA SER 3 23.693 54.627 15.452 17 HB2 SER 3 HB2 SER 3 21.341 54.133 16.053 18 HB3 SER 3 HB3 SER 3 21.526 55.784 15.458 19 HG SER 3 HG SER 3 19.712 54.490 14.601 20 H SER 4 H SER 4 23.980 52.547 16.095 21 HA SER 4 HA SER 4 22.864 50.347 14.535 22 HB2 SER 4 HB2 SER 4 25.055 49.177 14.350 23 HB3 SER 4 HB3 SER 4 25.002 50.669 13.414 24 HG SER 4 HG SER 4 26.875 50.067 15.002 25 H HIS 5 H HIS 5 21.804 49.256 16.028 26 HA HIS 5 HA HIS 5 23.150 48.623 18.583 27 HB2 HIS 5 HB2 HIS 5 21.250 50.348 18.686 28 HB3 HIS 5 HB3 HIS 5 20.162 49.023 18.293 29 HD1 HIS 5 HD1 HIS 5 22.393 50.305 21.024 30 HD2 HIS 5 HD2 HIS 5 19.602 47.286 20.412 31 HE1 HIS 5 HE1 HIS 5 21.918 49.354 23.295 32 HE2 HIS 5 HE2 HIS 5 20.117 47.644 22.919 33 H HIS 6 H HIS 6 23.325 47.010 16.328 34 HA HIS 6 HA HIS 6 21.624 44.961 15.850 35 HB2 HIS 6 HB2 HIS 6 23.649 43.519 15.480 36 HB3 HIS 6 HB3 HIS 6 23.715 45.090 14.689 37 HD1 HIS 6 HD1 HIS 6 25.576 42.933 16.986 38 HD2 HIS 6 HD2 HIS 6 25.449 46.987 16.069 39 HE1 HIS 6 HE1 HIS 6 27.700 43.896 17.909 40 HE2 HIS 6 HE2 HIS 6 27.683 46.306 17.188 41 H HIS 7 H HIS 7 21.092 42.951 16.701 42 HA HIS 7 HA HIS 7 22.038 42.129 19.310 43 HB2 HIS 7 HB2 HIS 7 19.701 42.259 20.311 44 HB3 HIS 7 HB3 HIS 7 20.531 43.798 20.099 45 HD1 HIS 7 HD1 HIS 7 19.512 45.473 18.462 46 HD2 HIS 7 HD2 HIS 7 17.501 41.841 18.536 47 HE1 HIS 7 HE1 HIS 7 17.403 45.849 17.159 48 HE2 HIS 7 HE2 HIS 7 16.263 43.609 17.113 49 H HIS 8 H HIS 8 22.004 39.967 19.385 50 HA HIS 8 HA HIS 8 19.696 38.438 18.708 51 HB2 HIS 8 HB2 HIS 8 20.703 37.033 16.937 52 HB3 HIS 8 HB3 HIS 8 20.501 38.703 16.427 53 HD1 HIS 8 HD1 HIS 8 23.107 36.146 17.193 54 HD2 HIS 8 HD2 HIS 8 22.889 40.092 15.911 55 HE1 HIS 8 HE1 HIS 8 25.408 36.716 16.383 56 HE2 HIS 8 HE2 HIS 8 25.185 39.019 15.406 57 H HIS 9 H HIS 9 19.638 36.731 20.054 58 HA HIS 9 HA HIS 9 21.915 35.117 20.642 59 HB2 HIS 9 HB2 HIS 9 22.042 35.578 23.075 60 HB3 HIS 9 HB3 HIS 9 22.520 36.962 22.101 61 HD1 HIS 9 HD1 HIS 9 19.996 35.844 24.593 62 HD2 HIS 9 HD2 HIS 9 20.721 39.160 22.193 63 HE1 HIS 9 HE1 HIS 9 18.510 37.658 25.484 64 HE2 HIS 9 HE2 HIS 9 18.914 39.638 23.984 65 H HIS 10 H HIS 10 21.035 33.167 20.639 66 HA HIS 10 HA HIS 10 19.258 32.331 22.684 67 HB2 HIS 10 HB2 HIS 10 17.366 31.570 21.257 68 HB3 HIS 10 HB3 HIS 10 17.511 33.323 21.317 69 HD1 HIS 10 HD1 HIS 10 18.121 30.405 18.997 70 HD2 HIS 10 HD2 HIS 10 17.912 34.552 18.880 71 HE1 HIS 10 HE1 HIS 10 18.104 31.008 16.565 72 HE2 HIS 10 HE2 HIS 10 17.803 33.503 16.522 73 H SER 11 H SER 11 19.141 30.060 22.847 74 HA SER 11 HA SER 11 20.503 28.482 20.778 75 HB2 SER 11 HB2 SER 11 21.348 28.527 23.690 76 HB3 SER 11 HB3 SER 11 21.909 27.346 22.506 77 HG SER 11 HG SER 11 22.604 29.283 21.260 78 H SER 12 H SER 12 20.028 26.246 20.801 79 HA SER 12 HA SER 12 17.976 25.341 22.710 80 HB2 SER 12 HB2 SER 12 16.602 24.397 20.909 81 HB3 SER 12 HB3 SER 12 16.786 26.137 20.686 82 HG SER 12 HG SER 12 17.093 24.837 18.756 83 H GLY 13 H GLY 13 17.497 22.911 22.263 84 HA2 GLY 13 HA2 GLY 13 19.185 21.122 21.049 85 HA3 GLY 13 HA3 GLY 13 19.984 21.499 22.570 86 H ARG 14 H ARG 14 18.081 19.250 21.188 87 HA ARG 14 HA ARG 14 16.902 18.453 23.746 88 HB2 ARG 14 HB2 ARG 14 14.674 18.238 22.966 89 HB3 ARG 14 HB3 ARG 14 15.199 19.851 22.513 90 HG2 ARG 14 HG2 ARG 14 15.140 17.483 20.645 91 HG3 ARG 14 HG3 ARG 14 13.868 18.697 20.770 92 HD2 ARG 14 HD2 ARG 14 15.498 20.432 20.112 93 HD3 ARG 14 HD3 ARG 14 16.735 19.185 19.941 94 HE ARG 14 HE ARG 14 14.396 18.660 18.375 95 HH11 ARG 14 HH11 ARG 14 17.428 20.291 18.426 96 HH12 ARG 14 HH12 ARG 14 17.500 20.440 16.707 97 HH21 ARG 14 HH21 ARG 14 14.513 18.832 16.177 98 HH22 ARG 14 HH22 ARG 14 15.866 19.621 15.446 99 H GLU 15 H GLU 15 15.979 16.259 23.694 100 HA GLU 15 HA GLU 15 17.801 14.449 22.437 101 HB2 GLU 15 HB2 GLU 15 16.503 12.706 23.602 102 HB3 GLU 15 HB3 GLU 15 16.938 14.028 24.676 103 HG2 GLU 15 HG2 GLU 15 14.622 14.971 24.230 104 HG3 GLU 15 HG3 GLU 15 14.245 13.423 23.479 105 H ASN 16 H ASN 16 17.503 13.054 20.733 106 HA ASN 16 HA ASN 16 15.061 13.362 19.142 107 HB2 ASN 16 HB2 ASN 16 16.327 12.073 17.401 108 HB3 ASN 16 HB3 ASN 16 17.089 13.589 17.869 109 HD21 ASN 16 HD21 ASN 16 17.339 10.145 17.893 110 HD22 ASN 16 HD22 ASN 16 18.951 10.069 18.508 111 H LEU 17 H LEU 17 13.457 11.931 19.260 112 HA LEU 17 HA LEU 17 13.644 9.765 21.117 113 HB2 LEU 17 HB2 LEU 17 11.393 10.662 19.322 114 HB3 LEU 17 HB3 LEU 17 11.249 9.357 20.482 115 HG LEU 17 HG LEU 17 10.284 11.266 21.493 116 HD11 LEU 17 HD11 LEU 17 13.056 10.939 22.629 117 HD12 LEU 17 HD12 LEU 17 11.648 9.942 23.001 118 HD13 LEU 17 HD13 LEU 17 11.669 11.642 23.463 119 HD21 LEU 17 HD21 LEU 17 11.443 13.411 21.762 120 HD22 LEU 17 HD22 LEU 17 11.214 12.999 20.062 121 HD23 LEU 17 HD23 LEU 17 12.797 12.794 20.813 122 H TYR 18 H TYR 18 13.024 7.565 20.731 123 HA TYR 18 HA TYR 18 14.098 6.537 18.195 124 HB2 TYR 18 HB2 TYR 18 13.613 5.127 20.835 125 HB3 TYR 18 HB3 TYR 18 14.365 4.406 19.417 126 HD1 TYR 18 HD1 TYR 18 14.793 7.181 21.881 127 HD2 TYR 18 HD2 TYR 18 16.693 4.532 19.137 128 HE1 TYR 18 HE1 TYR 18 16.992 7.929 22.689 129 HE2 TYR 18 HE2 TYR 18 18.894 5.282 19.933 130 HH TYR 18 HH TYR 18 19.265 7.229 22.762 131 H PHE 19 H PHE 19 12.925 5.230 16.850 132 HA PHE 19 HA PHE 19 10.091 4.781 17.550 133 HB2 PHE 19 HB2 PHE 19 11.313 5.271 14.820 134 HB3 PHE 19 HB3 PHE 19 9.614 4.910 15.119 135 HD1 PHE 19 HD1 PHE 19 8.222 6.527 16.422 136 HD2 PHE 19 HD2 PHE 19 12.165 7.476 15.115 137 HE1 PHE 19 HE1 PHE 19 7.769 8.916 16.793 138 HE2 PHE 19 HE2 PHE 19 11.714 9.863 15.486 139 HZ PHE 19 HZ PHE 19 9.517 10.586 16.327 140 H GLN 20 H GLN 20 9.068 2.887 16.447 141 HA GLN 20 HA GLN 20 10.580 0.583 17.165 142 HB2 GLN 20 HB2 GLN 20 8.182 0.687 17.567 143 HB3 GLN 20 HB3 GLN 20 7.868 0.787 15.840 144 HG2 GLN 20 HG2 GLN 20 8.884 -1.460 15.565 145 HG3 GLN 20 HG3 GLN 20 9.066 -1.556 17.315 146 HE21 GLN 20 HE21 GLN 20 6.834 -1.605 14.659 147 HE22 GLN 20 HE22 GLN 20 5.476 -2.202 15.551 148 H GLY 21 H GLY 21 11.936 -0.564 15.981 149 HA2 GLY 21 HA2 GLY 21 12.671 -1.927 14.293 150 HA3 GLY 21 HA3 GLY 21 11.128 -1.685 13.501 151 H HIS 22 H HIS 22 11.456 -1.095 11.478 152 HA HIS 22 HA HIS 22 13.253 1.092 10.797 153 HB2 HIS 22 HB2 HIS 22 14.676 -0.984 10.898 154 HB3 HIS 22 HB3 HIS 22 13.694 -1.660 9.605 155 HD1 HIS 22 HD1 HIS 22 16.582 0.490 10.251 156 HD2 HIS 22 HD2 HIS 22 14.020 -0.274 7.069 157 HE1 HIS 22 HE1 HIS 22 17.758 1.360 8.211 158 HE2 HIS 22 HE2 HIS 22 16.120 1.045 6.335 159 H MET 23 H MET 23 11.074 1.917 10.204 160 HA MET 23 HA MET 23 9.839 0.761 7.848 161 HB2 MET 23 HB2 MET 23 8.201 2.570 8.113 162 HB3 MET 23 HB3 MET 23 8.435 1.678 9.607 163 HG2 MET 23 HG2 MET 23 10.026 3.517 10.312 164 HG3 MET 23 HG3 MET 23 9.433 4.428 8.924 165 HE1 MET 23 HE1 MET 23 6.459 2.946 9.103 166 HE2 MET 23 HE2 MET 23 6.631 4.621 8.574 167 HE3 MET 23 HE3 MET 23 5.514 4.220 9.878 168 H LEU 24 H LEU 24 9.758 1.701 5.802 169 HA LEU 24 HA LEU 24 12.015 3.481 5.208 170 HB2 LEU 24 HB2 LEU 24 10.447 1.477 3.635 171 HB3 LEU 24 HB3 LEU 24 11.313 2.739 2.778 172 HG LEU 24 HG LEU 24 12.714 0.991 4.783 173 HD11 LEU 24 HD11 LEU 24 13.400 -0.466 2.938 174 HD12 LEU 24 HD12 LEU 24 12.344 0.423 1.842 175 HD13 LEU 24 HD13 LEU 24 11.652 -0.509 3.168 176 HD21 LEU 24 HD21 LEU 24 14.687 1.594 3.487 177 HD22 LEU 24 HD22 LEU 24 13.844 3.043 4.039 178 HD23 LEU 24 HD23 LEU 24 13.687 2.515 2.360 179 H GLU 25 H GLU 25 11.791 5.504 4.500 180 HA GLU 25 HA GLU 25 9.150 6.616 4.050 181 HB2 GLU 25 HB2 GLU 25 11.838 7.714 4.524 182 HB3 GLU 25 HB3 GLU 25 10.886 8.640 3.367 183 HG2 GLU 25 HG2 GLU 25 9.087 8.857 4.985 184 HG3 GLU 25 HG3 GLU 25 9.981 7.875 6.135 185 H VAL 26 H VAL 26 8.177 6.376 2.219 186 HA VAL 26 HA VAL 26 9.693 6.451 -0.321 187 HB VAL 26 HB VAL 26 8.314 4.595 -1.201 188 HG11 VAL 26 HG11 VAL 26 9.393 2.759 0.042 189 HG12 VAL 26 HG12 VAL 26 9.844 3.897 1.313 190 HG13 VAL 26 HG13 VAL 26 10.515 4.074 -0.308 191 HG21 VAL 26 HG21 VAL 26 7.299 4.344 1.642 192 HG22 VAL 26 HG22 VAL 26 6.973 3.212 0.329 193 HG23 VAL 26 HG23 VAL 26 6.356 4.860 0.244 194 H GLU 27 H GLU 27 8.304 6.921 -2.238 195 HA GLU 27 HA GLU 27 6.021 8.611 -1.473 196 HB2 GLU 27 HB2 GLU 27 7.809 9.585 -2.923 197 HB3 GLU 27 HB3 GLU 27 7.366 8.435 -4.180 198 HG2 GLU 27 HG2 GLU 27 5.160 9.395 -4.350 199 HG3 GLU 27 HG3 GLU 27 5.481 10.468 -2.991 200 H VAL 28 H VAL 28 3.998 8.006 -1.787 201 HA VAL 28 HA VAL 28 3.451 5.434 -3.059 202 HB VAL 28 HB VAL 28 1.652 7.193 -1.373 203 HG11 VAL 28 HG11 VAL 28 1.306 4.331 -2.276 204 HG12 VAL 28 HG12 VAL 28 0.382 5.724 -2.838 205 HG13 VAL 28 HG13 VAL 28 0.242 5.193 -1.164 206 HG21 VAL 28 HG21 VAL 28 3.542 6.424 -0.066 207 HG22 VAL 28 HG22 VAL 28 3.278 4.763 -0.601 208 HG23 VAL 28 HG23 VAL 28 2.086 5.559 0.429 209 H ILE 29 H ILE 29 2.765 5.405 -5.120 210 HA ILE 29 HA ILE 29 1.353 7.758 -6.202 211 HB ILE 29 HB ILE 29 2.204 5.537 -8.010 212 HG12 ILE 29 HG12 ILE 29 4.180 7.544 -6.884 213 HG13 ILE 29 HG13 ILE 29 4.120 5.851 -6.416 214 HG21 ILE 29 HG21 ILE 29 2.268 8.562 -8.180 215 HG22 ILE 29 HG22 ILE 29 1.063 7.495 -8.906 216 HG23 ILE 29 HG23 ILE 29 2.730 7.463 -9.484 217 HD11 ILE 29 HD11 ILE 29 4.700 6.898 -9.177 218 HD12 ILE 29 HD12 ILE 29 4.642 5.198 -8.708 219 HD13 ILE 29 HD13 ILE 29 5.878 6.258 -8.030 220 H SER 30 H SER 30 -0.437 7.316 -7.776 221 HA SER 30 HA SER 30 -1.897 4.819 -7.198 222 HB2 SER 30 HB2 SER 30 -2.800 6.738 -5.842 223 HB3 SER 30 HB3 SER 30 -3.251 7.520 -7.357 224 HG SER 30 HG SER 30 -4.114 4.930 -6.571 225 H GLY 31 H GLY 31 -2.356 3.747 -9.001 226 HA2 GLY 31 HA2 GLY 31 -2.523 5.265 -11.550 227 HA3 GLY 31 HA3 GLY 31 -1.985 3.602 -11.414 228 H ARG 32 H ARG 32 -4.282 5.086 -12.875 229 HA ARG 32 HA ARG 32 -6.767 4.459 -11.796 230 HB2 ARG 32 HB2 ARG 32 -6.442 5.965 -13.702 231 HB3 ARG 32 HB3 ARG 32 -5.986 4.602 -14.714 232 HG2 ARG 32 HG2 ARG 32 -8.236 3.659 -14.459 233 HG3 ARG 32 HG3 ARG 32 -8.689 5.028 -13.442 234 HD2 ARG 32 HD2 ARG 32 -7.823 5.179 -16.333 235 HD3 ARG 32 HD3 ARG 32 -9.477 5.324 -15.738 236 HE ARG 32 HE ARG 32 -8.345 7.299 -14.403 237 HH11 ARG 32 HH11 ARG 32 -7.913 6.407 -17.690 238 HH12 ARG 32 HH12 ARG 32 -7.588 8.020 -18.210 239 HH21 ARG 32 HH21 ARG 32 -7.932 9.379 -15.068 240 HH22 ARG 32 HH22 ARG 32 -7.575 9.688 -16.737 241 H THR 33 H THR 33 -4.715 2.470 -13.890 242 HA THR 33 HA THR 33 -4.683 0.287 -14.455 243 HB THR 33 HB THR 33 -5.368 -1.406 -12.820 244 HG1 THR 33 HG1 THR 33 -6.418 0.778 -11.304 245 HG21 THR 33 HG21 THR 33 -3.929 -0.691 -10.961 246 HG22 THR 33 HG22 THR 33 -3.982 0.968 -11.561 247 HG23 THR 33 HG23 THR 33 -3.214 -0.294 -12.525 248 H LEU 34 H LEU 34 -7.930 0.275 -12.925 249 HA LEU 34 HA LEU 34 -8.987 -1.345 -15.023 250 HB2 LEU 34 HB2 LEU 34 -10.235 0.015 -12.652 251 HB3 LEU 34 HB3 LEU 34 -11.228 -0.780 -13.857 252 HG LEU 34 HG LEU 34 -9.954 -2.899 -13.407 253 HD11 LEU 34 HD11 LEU 34 -7.937 -1.936 -12.439 254 HD12 LEU 34 HD12 LEU 34 -8.689 -3.081 -11.329 255 HD13 LEU 34 HD13 LEU 34 -8.868 -1.346 -11.059 256 HD21 LEU 34 HD21 LEU 34 -12.162 -2.499 -12.452 257 HD22 LEU 34 HD22 LEU 34 -11.430 -1.681 -11.073 258 HD23 LEU 34 HD23 LEU 34 -11.146 -3.403 -11.331 259 H ASN 35 H ASN 35 -11.429 -0.540 -15.674 260 HA ASN 35 HA ASN 35 -10.904 1.296 -17.794 261 HB2 ASN 35 HB2 ASN 35 -13.298 0.893 -18.379 262 HB3 ASN 35 HB3 ASN 35 -12.366 -0.587 -18.173 263 HD21 ASN 35 HD21 ASN 35 -15.240 -0.174 -17.984 264 HD22 ASN 35 HD22 ASN 35 -15.691 -0.708 -16.408 265 H GLN 36 H GLN 36 -10.869 3.450 -17.582 266 HA GLN 36 HA GLN 36 -11.516 5.589 -17.175 267 HB2 GLN 36 HB2 GLN 36 -14.221 4.325 -16.684 268 HB3 GLN 36 HB3 GLN 36 -13.937 6.043 -16.932 269 HG2 GLN 36 HG2 GLN 36 -13.471 3.833 -18.934 270 HG3 GLN 36 HG3 GLN 36 -14.768 5.028 -18.959 271 HE21 GLN 36 HE21 GLN 36 -11.409 4.445 -19.564 272 HE22 GLN 36 HE22 GLN 36 -11.083 5.944 -20.357 273 H GLY 37 H GLY 37 -13.116 6.898 -15.434 274 HA2 GLY 37 HA2 GLY 37 -11.893 6.235 -12.838 275 HA3 GLY 37 HA3 GLY 37 -12.518 7.806 -13.310 276 H ALA 38 H ALA 38 -13.037 5.814 -11.023 277 HA ALA 38 HA ALA 38 -15.755 6.445 -10.568 278 HB1 ALA 38 HB1 ALA 38 -15.288 3.539 -11.255 279 HB2 ALA 38 HB2 ALA 38 -16.076 4.707 -12.320 280 HB3 ALA 38 HB3 ALA 38 -16.813 4.289 -10.774 281 H THR 39 H THR 39 -16.614 5.333 -8.571 282 HA THR 39 HA THR 39 -14.472 4.708 -6.680 283 HB THR 39 HB THR 39 -16.078 4.807 -4.935 284 HG1 THR 39 HG1 THR 39 -18.301 5.027 -6.645 285 HG21 THR 39 HG21 THR 39 -16.931 6.841 -7.008 286 HG22 THR 39 HG22 THR 39 -15.587 7.015 -5.878 287 HG23 THR 39 HG23 THR 39 -17.243 6.946 -5.274 288 H VAL 40 H VAL 40 -15.110 2.785 -5.104 289 HA VAL 40 HA VAL 40 -15.079 0.398 -6.616 290 HB VAL 40 HB VAL 40 -15.249 -0.815 -4.519 291 HG11 VAL 40 HG11 VAL 40 -13.102 0.209 -5.106 292 HG12 VAL 40 HG12 VAL 40 -13.323 0.119 -3.359 293 HG13 VAL 40 HG13 VAL 40 -13.544 1.655 -4.199 294 HG21 VAL 40 HG21 VAL 40 -15.905 1.849 -3.251 295 HG22 VAL 40 HG22 VAL 40 -15.594 0.346 -2.381 296 HG23 VAL 40 HG23 VAL 40 -17.004 0.482 -3.431 297 H GLU 41 H GLU 41 -17.708 2.307 -5.378 298 HA GLU 41 HA GLU 41 -19.672 0.252 -5.271 299 HB2 GLU 41 HB2 GLU 41 -20.042 3.236 -5.602 300 HB3 GLU 41 HB3 GLU 41 -21.305 2.088 -5.176 301 HG2 GLU 41 HG2 GLU 41 -20.042 1.522 -3.120 302 HG3 GLU 41 HG3 GLU 41 -18.868 2.769 -3.535 303 H GLU 42 H GLU 42 -18.478 2.266 -7.884 304 HA GLU 42 HA GLU 42 -20.498 1.289 -9.749 305 HB2 GLU 42 HB2 GLU 42 -18.026 2.985 -10.183 306 HB3 GLU 42 HB3 GLU 42 -19.128 2.511 -11.466 307 HG2 GLU 42 HG2 GLU 42 -19.706 4.713 -10.877 308 HG3 GLU 42 HG3 GLU 42 -20.955 3.680 -10.187 309 H LYS 43 H LYS 43 -17.592 0.159 -8.489 310 HA LYS 43 HA LYS 43 -17.181 -1.710 -10.737 311 HB2 LYS 43 HB2 LYS 43 -15.051 -0.326 -9.108 312 HB3 LYS 43 HB3 LYS 43 -14.751 -1.589 -10.292 313 HG2 LYS 43 HG2 LYS 43 -15.700 -0.112 -12.045 314 HG3 LYS 43 HG3 LYS 43 -15.863 1.163 -10.834 315 HD2 LYS 43 HD2 LYS 43 -13.424 1.071 -10.441 316 HD3 LYS 43 HD3 LYS 43 -13.281 -0.167 -11.691 317 HE2 LYS 43 HE2 LYS 43 -14.247 2.666 -12.086 318 HE3 LYS 43 HE3 LYS 43 -12.672 2.028 -12.557 319 HZ1 LYS 43 HZ1 LYS 43 -15.285 1.097 -13.618 320 HZ2 LYS 43 HZ2 LYS 43 -13.763 0.539 -14.097 321 HZ3 LYS 43 HZ3 LYS 43 -14.219 2.131 -14.419 322 H LEU 44 H LEU 44 -18.676 -2.159 -8.241 323 HA LEU 44 HA LEU 44 -17.086 -3.664 -6.432 324 HB2 LEU 44 HB2 LEU 44 -20.055 -3.548 -6.916 325 HB3 LEU 44 HB3 LEU 44 -19.366 -4.681 -5.767 326 HG LEU 44 HG LEU 44 -19.108 -1.668 -5.626 327 HD11 LEU 44 HD11 LEU 44 -20.737 -3.565 -3.939 328 HD12 LEU 44 HD12 LEU 44 -21.375 -2.441 -5.139 329 HD13 LEU 44 HD13 LEU 44 -20.578 -1.826 -3.691 330 HD21 LEU 44 HD21 LEU 44 -18.199 -3.798 -3.682 331 HD22 LEU 44 HD22 LEU 44 -18.110 -2.056 -3.426 332 HD23 LEU 44 HD23 LEU 44 -17.150 -2.807 -4.698 333 H THR 45 H THR 45 -15.822 -4.988 -7.730 334 HA THR 45 HA THR 45 -17.083 -7.538 -8.435 335 HB THR 45 HB THR 45 -16.982 -6.372 -10.569 336 HG1 THR 45 HG1 THR 45 -15.907 -7.967 -11.672 337 HG21 THR 45 HG21 THR 45 -14.022 -6.049 -10.033 338 HG22 THR 45 HG22 THR 45 -15.215 -4.751 -10.067 339 HG23 THR 45 HG23 THR 45 -14.844 -5.646 -11.541 340 H GLU 46 H GLU 46 -15.598 -9.334 -8.422 341 HA GLU 46 HA GLU 46 -13.645 -9.242 -6.415 342 HB2 GLU 46 HB2 GLU 46 -14.797 -11.314 -7.176 343 HB3 GLU 46 HB3 GLU 46 -13.858 -11.262 -8.663 344 HG2 GLU 46 HG2 GLU 46 -11.791 -11.487 -7.345 345 HG3 GLU 46 HG3 GLU 46 -12.756 -11.587 -5.875 346 H GLU 47 H GLU 47 -13.414 -8.715 -9.872 347 HA GLU 47 HA GLU 47 -10.635 -8.832 -10.199 348 HB2 GLU 47 HB2 GLU 47 -12.187 -8.694 -12.087 349 HB3 GLU 47 HB3 GLU 47 -12.628 -7.055 -11.627 350 HG2 GLU 47 HG2 GLU 47 -10.435 -6.244 -12.159 351 HG3 GLU 47 HG3 GLU 47 -9.836 -7.884 -12.413 352 H TYR 48 H TYR 48 -12.693 -6.144 -9.106 353 HA TYR 48 HA TYR 48 -10.685 -4.162 -8.993 354 HB2 TYR 48 HB2 TYR 48 -13.275 -3.931 -8.699 355 HB3 TYR 48 HB3 TYR 48 -12.958 -4.271 -7.003 356 HD1 TYR 48 HD1 TYR 48 -11.213 -2.712 -5.813 357 HD2 TYR 48 HD2 TYR 48 -13.139 -1.749 -9.487 358 HE1 TYR 48 HE1 TYR 48 -10.656 -0.343 -5.483 359 HE2 TYR 48 HE2 TYR 48 -12.593 0.622 -9.164 360 HH TYR 48 HH TYR 48 -10.303 1.697 -7.071 361 H PHE 49 H PHE 49 -11.629 -6.716 -6.782 362 HA PHE 49 HA PHE 49 -10.255 -5.875 -4.479 363 HB2 PHE 49 HB2 PHE 49 -11.996 -7.620 -4.470 364 HB3 PHE 49 HB3 PHE 49 -10.943 -8.686 -5.389 365 HD1 PHE 49 HD1 PHE 49 -11.510 -7.101 -2.112 366 HD2 PHE 49 HD2 PHE 49 -9.177 -9.911 -4.312 367 HE1 PHE 49 HE1 PHE 49 -10.614 -8.007 -0.003 368 HE2 PHE 49 HE2 PHE 49 -8.278 -10.816 -2.208 369 HZ PHE 49 HZ PHE 49 -8.999 -9.868 -0.050 370 H ASN 50 H ASN 50 -9.265 -8.542 -6.679 371 HA ASN 50 HA ASN 50 -6.681 -8.700 -5.572 372 HB2 ASN 50 HB2 ASN 50 -6.120 -10.180 -7.448 373 HB3 ASN 50 HB3 ASN 50 -7.683 -10.594 -6.752 374 HD21 ASN 50 HD21 ASN 50 -9.520 -10.357 -7.983 375 HD22 ASN 50 HD22 ASN 50 -9.477 -9.997 -9.671 376 H ALA 51 H ALA 51 -7.952 -6.444 -7.774 377 HA ALA 51 HA ALA 51 -5.487 -5.809 -9.125 378 HB1 ALA 51 HB1 ALA 51 -8.068 -4.249 -9.008 379 HB2 ALA 51 HB2 ALA 51 -7.658 -5.470 -10.212 380 HB3 ALA 51 HB3 ALA 51 -6.730 -3.973 -10.126 381 H VAL 52 H VAL 52 -7.405 -4.220 -6.532 382 HA VAL 52 HA VAL 52 -5.274 -2.198 -6.292 383 HB VAL 52 HB VAL 52 -6.842 -0.832 -5.048 384 HG11 VAL 52 HG11 VAL 52 -6.895 -0.712 -7.494 385 HG12 VAL 52 HG12 VAL 52 -8.484 -0.401 -6.795 386 HG13 VAL 52 HG13 VAL 52 -8.138 -1.967 -7.532 387 HG21 VAL 52 HG21 VAL 52 -8.781 -3.135 -5.323 388 HG22 VAL 52 HG22 VAL 52 -9.164 -1.541 -4.675 389 HG23 VAL 52 HG23 VAL 52 -8.023 -2.584 -3.828 390 H ASN 53 H ASN 53 -5.703 -5.089 -4.899 391 HA ASN 53 HA ASN 53 -5.445 -4.236 -2.115 392 HB2 ASN 53 HB2 ASN 53 -5.846 -6.919 -3.408 393 HB3 ASN 53 HB3 ASN 53 -5.403 -6.782 -1.710 394 HD21 ASN 53 HD21 ASN 53 -7.486 -4.556 -3.451 395 HD22 ASN 53 HD22 ASN 53 -8.916 -4.943 -2.574 396 H TYR 54 H TYR 54 -3.176 -4.033 -4.234 397 HA TYR 54 HA TYR 54 -1.138 -5.116 -2.414 398 HB2 TYR 54 HB2 TYR 54 0.192 -6.054 -4.195 399 HB3 TYR 54 HB3 TYR 54 -1.423 -6.741 -4.282 400 HD1 TYR 54 HD1 TYR 54 0.945 -4.406 -5.888 401 HD2 TYR 54 HD2 TYR 54 -2.828 -6.355 -6.202 402 HE1 TYR 54 HE1 TYR 54 0.798 -3.725 -8.245 403 HE2 TYR 54 HE2 TYR 54 -2.983 -5.674 -8.561 404 HH TYR 54 HH TYR 54 -2.095 -4.030 -10.065 405 H ALA 55 H ALA 55 1.020 -4.220 -2.750 406 HA ALA 55 HA ALA 55 1.086 -1.635 -4.182 407 HB1 ALA 55 HB1 ALA 55 2.498 -0.710 -2.410 408 HB2 ALA 55 HB2 ALA 55 2.369 -2.219 -1.505 409 HB3 ALA 55 HB3 ALA 55 0.938 -1.221 -1.765 410 H GLU 56 H GLU 56 2.989 -1.171 -5.282 411 HA GLU 56 HA GLU 56 4.821 -3.420 -5.675 412 HB2 GLU 56 HB2 GLU 56 4.496 -0.840 -7.225 413 HB3 GLU 56 HB3 GLU 56 5.624 -2.124 -7.636 414 HG2 GLU 56 HG2 GLU 56 3.628 -3.656 -7.841 415 HG3 GLU 56 HG3 GLU 56 2.616 -2.219 -7.702 416 H ILE 57 H ILE 57 6.616 -3.486 -4.495 417 HA ILE 57 HA ILE 57 7.909 -0.958 -3.672 418 HB ILE 57 HB ILE 57 8.231 -3.707 -2.423 419 HG12 ILE 57 HG12 ILE 57 7.079 -2.427 -0.441 420 HG13 ILE 57 HG13 ILE 57 6.504 -1.341 -1.702 421 HG21 ILE 57 HG21 ILE 57 10.230 -2.327 -2.185 422 HG22 ILE 57 HG22 ILE 57 9.422 -2.530 -0.630 423 HG23 ILE 57 HG23 ILE 57 9.259 -1.014 -1.517 424 HD11 ILE 57 HD11 ILE 57 5.412 -3.230 -2.810 425 HD12 ILE 57 HD12 ILE 57 4.841 -3.012 -1.156 426 HD13 ILE 57 HD13 ILE 57 5.982 -4.304 -1.533 427 H ASN 58 H ASN 58 10.191 -0.760 -3.838 428 HA ASN 58 HA ASN 58 11.374 -1.901 -6.164 429 HB2 ASN 58 HB2 ASN 58 11.882 0.376 -5.400 430 HB3 ASN 58 HB3 ASN 58 12.599 -0.261 -3.925 431 HD21 ASN 58 HD21 ASN 58 13.007 0.216 -7.329 432 HD22 ASN 58 HD22 ASN 58 14.689 -0.183 -7.385 433 H GLU 59 H GLU 59 13.330 -3.180 -6.279 434 HA GLU 59 HA GLU 59 13.347 -5.524 -4.792 435 HB2 GLU 59 HB2 GLU 59 14.393 -5.327 -6.978 436 HB3 GLU 59 HB3 GLU 59 15.613 -4.243 -6.326 437 HG2 GLU 59 HG2 GLU 59 16.582 -6.401 -6.618 438 HG3 GLU 59 HG3 GLU 59 16.434 -6.097 -4.895 439 H GLU 60 H GLU 60 15.492 -2.689 -4.365 440 HA GLU 60 HA GLU 60 17.023 -3.840 -2.269 441 HB2 GLU 60 HB2 GLU 60 16.629 -0.915 -2.953 442 HB3 GLU 60 HB3 GLU 60 17.894 -1.562 -1.915 443 HG2 GLU 60 HG2 GLU 60 17.539 -2.064 -4.862 444 HG3 GLU 60 HG3 GLU 60 18.788 -1.084 -4.098 445 H ASP 61 H ASP 61 14.272 -1.577 -2.234 446 HA ASP 61 HA ASP 61 14.178 -1.275 0.588 447 HB2 ASP 61 HB2 ASP 61 12.038 -0.873 -1.518 448 HB3 ASP 61 HB3 ASP 61 11.879 -0.377 0.165 449 H TRP 62 H TRP 62 12.652 -3.519 -1.636 450 HA TRP 62 HA TRP 62 10.819 -4.829 -0.030 451 HB2 TRP 62 HB2 TRP 62 11.099 -5.231 -2.438 452 HB3 TRP 62 HB3 TRP 62 12.661 -5.985 -2.148 453 HD1 TRP 62 HD1 TRP 62 12.620 -8.465 -1.019 454 HE1 TRP 62 HE1 TRP 62 10.795 -10.277 -1.043 455 HE3 TRP 62 HE3 TRP 62 8.633 -5.579 -2.391 456 HZ2 TRP 62 HZ2 TRP 62 8.038 -10.454 -1.585 457 HZ3 TRP 62 HZ3 TRP 62 6.437 -6.650 -2.639 458 HH2 TRP 62 HH2 TRP 62 6.148 -9.040 -2.244 459 H ASN 63 H ASN 63 14.225 -5.719 -0.539 460 HA ASN 63 HA ASN 63 14.233 -7.738 1.477 461 HB2 ASN 63 HB2 ASN 63 16.488 -6.346 0.022 462 HB3 ASN 63 HB3 ASN 63 16.704 -7.729 1.095 463 HD21 ASN 63 HD21 ASN 63 17.071 -7.321 -1.863 464 HD22 ASN 63 HD22 ASN 63 16.199 -8.625 -2.581 465 H ALA 64 H ALA 64 14.946 -4.308 1.493 466 HA ALA 64 HA ALA 64 16.321 -4.111 3.940 467 HB1 ALA 64 HB1 ALA 64 16.116 -2.263 2.326 468 HB2 ALA 64 HB2 ALA 64 15.640 -1.776 3.953 469 HB3 ALA 64 HB3 ALA 64 14.406 -2.107 2.735 470 H LEU 65 H LEU 65 12.853 -4.231 3.234 471 HA LEU 65 HA LEU 65 12.138 -4.047 6.055 472 HB2 LEU 65 HB2 LEU 65 10.457 -4.524 3.590 473 HB3 LEU 65 HB3 LEU 65 9.817 -4.307 5.208 474 HG LEU 65 HG LEU 65 11.394 -2.218 3.691 475 HD11 LEU 65 HD11 LEU 65 9.256 -2.618 2.617 476 HD12 LEU 65 HD12 LEU 65 9.260 -1.055 3.434 477 HD13 LEU 65 HD13 LEU 65 8.421 -2.429 4.159 478 HD21 LEU 65 HD21 LEU 65 10.612 -0.699 5.456 479 HD22 LEU 65 HD22 LEU 65 11.620 -1.993 6.101 480 HD23 LEU 65 HD23 LEU 65 9.868 -2.063 6.294 481 H GLY 66 H GLY 66 13.199 -6.495 4.041 482 HA2 GLY 66 HA2 GLY 66 13.241 -8.787 4.224 483 HA3 GLY 66 HA3 GLY 66 12.613 -8.592 5.853 484 H LEU 67 H LEU 67 11.222 -7.821 2.662 485 HA LEU 67 HA LEU 67 8.687 -8.972 3.498 486 HB2 LEU 67 HB2 LEU 67 9.453 -7.639 0.893 487 HB3 LEU 67 HB3 LEU 67 7.824 -8.044 1.400 488 HG LEU 67 HG LEU 67 9.634 -6.016 2.726 489 HD11 LEU 67 HD11 LEU 67 8.053 -4.361 1.869 490 HD12 LEU 67 HD12 LEU 67 7.156 -5.635 1.043 491 HD13 LEU 67 HD13 LEU 67 8.811 -5.261 0.556 492 HD21 LEU 67 HD21 LEU 67 6.771 -6.760 3.339 493 HD22 LEU 67 HD22 LEU 67 7.678 -5.438 4.077 494 HD23 LEU 67 HD23 LEU 67 8.177 -7.107 4.346 495 H GLN 68 H GLN 68 7.574 -10.632 2.423 496 HA GLN 68 HA GLN 68 9.123 -12.220 0.463 497 HB2 GLN 68 HB2 GLN 68 8.734 -13.374 2.648 498 HB3 GLN 68 HB3 GLN 68 6.998 -13.223 2.382 499 HG2 GLN 68 HG2 GLN 68 7.099 -14.665 0.472 500 HG3 GLN 68 HG3 GLN 68 8.862 -14.685 0.518 501 HE21 GLN 68 HE21 GLN 68 8.964 -16.911 0.718 502 HE22 GLN 68 HE22 GLN 68 8.518 -17.737 2.167 503 H GLU 69 H GLU 69 7.988 -12.972 -1.393 504 HA GLU 69 HA GLU 69 6.057 -11.244 -2.430 505 HB2 GLU 69 HB2 GLU 69 6.860 -14.032 -3.257 506 HB3 GLU 69 HB3 GLU 69 5.701 -13.072 -4.172 507 HG2 GLU 69 HG2 GLU 69 7.374 -11.345 -4.529 508 HG3 GLU 69 HG3 GLU 69 8.535 -12.247 -3.557 509 H GLY 70 H GLY 70 4.069 -10.919 -1.728 510 HA2 GLY 70 HA2 GLY 70 1.782 -11.669 -1.562 511 HA3 GLY 70 HA3 GLY 70 2.369 -13.243 -1.053 512 H ASP 71 H ASP 71 4.177 -10.941 0.530 513 HA ASP 71 HA ASP 71 3.030 -11.484 3.065 514 HB2 ASP 71 HB2 ASP 71 5.443 -10.439 2.111 515 HB3 ASP 71 HB3 ASP 71 4.734 -9.117 3.027 516 H ARG 72 H ARG 72 2.602 -9.605 4.654 517 HA ARG 72 HA ARG 72 0.730 -7.678 3.427 518 HB2 ARG 72 HB2 ARG 72 0.902 -8.801 6.224 519 HB3 ARG 72 HB3 ARG 72 -0.045 -7.369 5.858 520 HG2 ARG 72 HG2 ARG 72 -1.517 -9.236 5.905 521 HG3 ARG 72 HG3 ARG 72 -1.353 -8.723 4.227 522 HD2 ARG 72 HD2 ARG 72 0.202 -10.542 3.796 523 HD3 ARG 72 HD3 ARG 72 0.145 -11.017 5.494 524 HE ARG 72 HE ARG 72 -2.361 -11.334 4.975 525 HH11 ARG 72 HH11 ARG 72 0.196 -11.973 2.753 526 HH12 ARG 72 HH12 ARG 72 -0.681 -13.227 1.955 527 HH21 ARG 72 HH21 ARG 72 -3.452 -12.966 3.932 528 HH22 ARG 72 HH22 ARG 72 -2.692 -13.780 2.609 529 H VAL 73 H VAL 73 1.333 -5.602 3.306 530 HA VAL 73 HA VAL 73 3.443 -4.635 5.137 531 HB VAL 73 HB VAL 73 4.053 -2.984 3.358 532 HG11 VAL 73 HG11 VAL 73 5.307 -4.590 1.983 533 HG12 VAL 73 HG12 VAL 73 4.319 -5.902 2.624 534 HG13 VAL 73 HG13 VAL 73 5.382 -4.989 3.699 535 HG21 VAL 73 HG21 VAL 73 1.958 -3.028 2.087 536 HG22 VAL 73 HG22 VAL 73 2.276 -4.695 1.605 537 HG23 VAL 73 HG23 VAL 73 3.337 -3.398 1.052 538 H LYS 74 H LYS 74 3.242 -2.660 6.086 539 HA LYS 74 HA LYS 74 0.615 -1.370 5.967 540 HB2 LYS 74 HB2 LYS 74 1.424 -1.883 8.203 541 HB3 LYS 74 HB3 LYS 74 2.936 -1.039 7.889 542 HG2 LYS 74 HG2 LYS 74 1.582 0.369 9.246 543 HG3 LYS 74 HG3 LYS 74 1.635 1.070 7.630 544 HD2 LYS 74 HD2 LYS 74 -0.610 1.242 7.988 545 HD3 LYS 74 HD3 LYS 74 -0.586 -0.403 7.355 546 HE2 LYS 74 HE2 LYS 74 -0.684 0.453 10.243 547 HE3 LYS 74 HE3 LYS 74 -1.950 -0.362 9.327 548 HZ1 LYS 74 HZ1 LYS 74 0.676 -1.491 10.120 549 HZ2 LYS 74 HZ2 LYS 74 -0.448 -2.281 9.133 550 HZ3 LYS 74 HZ3 LYS 74 -0.841 -1.917 10.734 551 H VAL 75 H VAL 75 0.323 0.676 5.235 552 HA VAL 75 HA VAL 75 2.663 2.187 4.244 553 HB VAL 75 HB VAL 75 -0.049 2.006 2.887 554 HG11 VAL 75 HG11 VAL 75 1.030 4.186 2.600 555 HG12 VAL 75 HG12 VAL 75 0.989 3.293 1.082 556 HG13 VAL 75 HG13 VAL 75 2.490 3.394 2.005 557 HG21 VAL 75 HG21 VAL 75 1.128 0.805 1.084 558 HG22 VAL 75 HG22 VAL 75 1.177 -0.081 2.608 559 HG23 VAL 75 HG23 VAL 75 2.601 0.802 2.058 560 H LYS 76 H LYS 76 2.782 4.174 5.137 561 HA LYS 76 HA LYS 76 0.343 5.307 6.377 562 HB2 LYS 76 HB2 LYS 76 3.082 5.242 7.665 563 HB3 LYS 76 HB3 LYS 76 1.587 5.831 8.387 564 HG2 LYS 76 HG2 LYS 76 0.675 3.639 8.489 565 HG3 LYS 76 HG3 LYS 76 1.972 2.984 7.494 566 HD2 LYS 76 HD2 LYS 76 2.574 2.323 9.616 567 HD3 LYS 76 HD3 LYS 76 3.525 3.790 9.388 568 HE2 LYS 76 HE2 LYS 76 0.911 3.592 10.893 569 HE3 LYS 76 HE3 LYS 76 2.509 3.686 11.624 570 HZ1 LYS 76 HZ1 LYS 76 1.386 5.818 11.629 571 HZ2 LYS 76 HZ2 LYS 76 1.251 5.792 9.948 572 HZ3 LYS 76 HZ3 LYS 76 2.779 5.888 10.671 573 H THR 77 H THR 77 0.026 7.406 6.060 574 HA THR 77 HA THR 77 2.277 9.147 5.256 575 HB THR 77 HB THR 77 1.007 10.221 3.519 576 HG1 THR 77 HG1 THR 77 -1.128 9.420 2.992 577 HG21 THR 77 HG21 THR 77 2.179 8.198 2.807 578 HG22 THR 77 HG22 THR 77 0.689 8.412 1.890 579 HG23 THR 77 HG23 THR 77 0.759 7.225 3.194 580 H GLU 78 H GLU 78 1.118 11.514 4.979 581 HA GLU 78 HA GLU 78 0.271 12.281 7.593 582 HB2 GLU 78 HB2 GLU 78 0.042 14.541 6.571 583 HB3 GLU 78 HB3 GLU 78 1.604 13.787 6.278 584 HG2 GLU 78 HG2 GLU 78 0.642 13.046 4.031 585 HG3 GLU 78 HG3 GLU 78 -0.666 14.184 4.350 586 H PHE 79 H PHE 79 -1.455 10.900 5.075 587 HA PHE 79 HA PHE 79 -3.997 12.176 5.798 588 HB2 PHE 79 HB2 PHE 79 -3.306 10.150 3.650 589 HB3 PHE 79 HB3 PHE 79 -4.934 10.753 3.947 590 HD1 PHE 79 HD2 PHE 79 -5.541 13.039 3.390 591 HD2 PHE 79 HD1 PHE 79 -1.624 11.558 2.604 592 HE1 PHE 79 HE2 PHE 79 -5.112 14.957 1.914 593 HE2 PHE 79 HE1 PHE 79 -1.190 13.484 1.135 594 HZ PHE 79 HZ PHE 79 -2.937 15.184 0.786 595 H GLY 80 H GLY 80 -2.652 8.858 5.596 596 HA2 GLY 80 HA2 GLY 80 -3.663 8.061 8.119 597 HA3 GLY 80 HA3 GLY 80 -4.763 7.519 6.859 598 H GLU 81 H GLU 81 -4.156 5.342 7.697 599 HA GLU 81 HA GLU 81 -1.799 4.370 6.237 600 HB2 GLU 81 HB2 GLU 81 -1.183 2.868 8.057 601 HB3 GLU 81 HB3 GLU 81 -1.129 4.542 8.580 602 HG2 GLU 81 HG2 GLU 81 -3.430 2.682 9.145 603 HG3 GLU 81 HG3 GLU 81 -2.071 2.923 10.237 604 H VAL 82 H VAL 82 -1.879 2.232 5.499 605 HA VAL 82 HA VAL 82 -4.396 0.752 5.805 606 HB VAL 82 HB VAL 82 -4.589 2.254 3.802 607 HG11 VAL 82 HG11 VAL 82 -2.271 2.236 3.069 608 HG12 VAL 82 HG12 VAL 82 -3.336 1.700 1.769 609 HG13 VAL 82 HG13 VAL 82 -2.388 0.519 2.676 610 HG21 VAL 82 HG21 VAL 82 -5.439 0.524 2.274 611 HG22 VAL 82 HG22 VAL 82 -5.945 0.247 3.941 612 HG23 VAL 82 HG23 VAL 82 -4.637 -0.713 3.243 613 H VAL 83 H VAL 83 -4.235 -1.504 5.252 614 HA VAL 83 HA VAL 83 -1.460 -2.522 5.037 615 HB VAL 83 HB VAL 83 -3.863 -3.984 6.178 616 HG11 VAL 83 HG11 VAL 83 -2.208 -5.501 5.251 617 HG12 VAL 83 HG12 VAL 83 -2.181 -5.590 7.014 618 HG13 VAL 83 HG13 VAL 83 -0.924 -4.697 6.156 619 HG21 VAL 83 HG21 VAL 83 -3.255 -2.119 7.630 620 HG22 VAL 83 HG22 VAL 83 -1.575 -2.656 7.646 621 HG23 VAL 83 HG23 VAL 83 -2.831 -3.656 8.384 622 H VAL 84 H VAL 84 -0.946 -3.509 3.164 623 HA VAL 84 HA VAL 84 -3.077 -4.778 1.551 624 HB VAL 84 HB VAL 84 -2.083 -3.878 -0.516 625 HG11 VAL 84 HG11 VAL 84 -3.951 -2.679 0.471 626 HG12 VAL 84 HG12 VAL 84 -2.828 -1.546 -0.281 627 HG13 VAL 84 HG13 VAL 84 -2.849 -1.737 1.472 628 HG21 VAL 84 HG21 VAL 84 0.210 -3.556 0.230 629 HG22 VAL 84 HG22 VAL 84 -0.302 -2.283 1.339 630 HG23 VAL 84 HG23 VAL 84 -0.437 -2.042 -0.404 631 H PHE 85 H PHE 85 -2.097 -6.115 -0.301 632 HA PHE 85 HA PHE 85 -0.102 -7.921 0.695 633 HB2 PHE 85 HB2 PHE 85 -1.390 -7.687 -2.039 634 HB3 PHE 85 HB3 PHE 85 -0.277 -8.971 -1.584 635 HD1 PHE 85 HD1 PHE 85 -0.941 -10.424 0.446 636 HD2 PHE 85 HD2 PHE 85 -3.684 -7.950 -1.683 637 HE1 PHE 85 HE1 PHE 85 -2.818 -11.761 1.300 638 HE2 PHE 85 HE2 PHE 85 -5.558 -9.285 -0.818 639 HZ PHE 85 HZ PHE 85 -5.126 -11.191 0.673 640 H ALA 86 H ALA 86 2.006 -8.258 -0.057 641 HA ALA 86 HA ALA 86 3.263 -5.860 -1.175 642 HB1 ALA 86 HB1 ALA 86 5.353 -6.800 -0.340 643 HB2 ALA 86 HB2 ALA 86 4.503 -8.267 0.152 644 HB3 ALA 86 HB3 ALA 86 4.130 -6.728 0.929 645 H LYS 87 H LYS 87 3.678 -5.772 -3.289 646 HA LYS 87 HA LYS 87 4.777 -8.176 -4.619 647 HB2 LYS 87 HB2 LYS 87 3.027 -6.024 -5.843 648 HB3 LYS 87 HB3 LYS 87 3.907 -7.217 -6.782 649 HG2 LYS 87 HG2 LYS 87 2.591 -8.974 -5.509 650 HG3 LYS 87 HG3 LYS 87 1.580 -7.641 -4.934 651 HD2 LYS 87 HD2 LYS 87 1.200 -6.990 -7.325 652 HD3 LYS 87 HD3 LYS 87 2.069 -8.444 -7.811 653 HE2 LYS 87 HE2 LYS 87 0.383 -9.752 -6.473 654 HE3 LYS 87 HE3 LYS 87 -0.529 -8.258 -6.311 655 HZ1 LYS 87 HZ1 LYS 87 -0.585 -8.137 -8.771 656 HZ2 LYS 87 HZ2 LYS 87 -1.399 -9.479 -8.149 657 HZ3 LYS 87 HZ3 LYS 87 0.133 -9.668 -8.840 658 H LYS 88 H LYS 88 6.426 -7.821 -6.161 659 HA LYS 88 HA LYS 88 7.970 -5.393 -5.642 660 HB2 LYS 88 HB2 LYS 88 8.809 -7.902 -5.575 661 HB3 LYS 88 HB3 LYS 88 8.981 -7.667 -7.311 662 HG2 LYS 88 HG2 LYS 88 10.391 -5.695 -6.863 663 HG3 LYS 88 HG3 LYS 88 10.264 -6.039 -5.139 664 HD2 LYS 88 HD2 LYS 88 11.464 -7.874 -7.222 665 HD3 LYS 88 HD3 LYS 88 12.371 -6.882 -6.079 666 HE2 LYS 88 HE2 LYS 88 11.401 -8.124 -4.211 667 HE3 LYS 88 HE3 LYS 88 10.453 -9.098 -5.337 668 HZ1 LYS 88 HZ1 LYS 88 12.443 -10.260 -4.626 669 HZ2 LYS 88 HZ2 LYS 88 13.419 -9.003 -5.205 670 HZ3 LYS 88 HZ3 LYS 88 12.512 -9.933 -6.283 671 H GLY 89 H GLY 89 7.828 -3.740 -7.064 672 HA2 GLY 89 HA2 GLY 89 6.691 -4.364 -9.731 673 HA3 GLY 89 HA3 GLY 89 6.320 -2.917 -8.820 674 H ASP 90 H ASP 90 6.826 -1.808 -10.779 675 HA ASP 90 HA ASP 90 9.617 -1.797 -11.677 676 HB2 ASP 90 HB2 ASP 90 7.201 -0.345 -12.793 677 HB3 ASP 90 HB3 ASP 90 8.772 -0.516 -13.575 678 H VAL 91 H VAL 91 8.717 -0.569 -9.098 679 HA VAL 91 HA VAL 91 8.879 2.299 -9.528 680 HB VAL 91 HB VAL 91 8.522 2.461 -7.081 681 HG11 VAL 91 HG11 VAL 91 6.584 0.649 -8.534 682 HG12 VAL 91 HG12 VAL 91 6.608 2.414 -8.597 683 HG13 VAL 91 HG13 VAL 91 6.226 1.589 -7.085 684 HG21 VAL 91 HG21 VAL 91 7.987 0.418 -5.808 685 HG22 VAL 91 HG22 VAL 91 9.654 0.416 -6.382 686 HG23 VAL 91 HG23 VAL 91 8.438 -0.559 -7.206 687 HA PRO 92 HA PRO 92 13.234 2.587 -8.650 688 HB2 PRO 92 HB2 PRO 92 13.431 5.219 -8.108 689 HB3 PRO 92 HB3 PRO 92 13.077 4.621 -9.733 690 HG2 PRO 92 HG2 PRO 92 11.189 5.691 -7.659 691 HG3 PRO 92 HG3 PRO 92 11.255 6.042 -9.397 692 HD2 PRO 92 HD2 PRO 92 9.504 4.259 -8.305 693 HD3 PRO 92 HD3 PRO 92 10.131 4.112 -9.959 694 H LYS 93 H LYS 93 14.755 3.529 -6.955 695 HA LYS 93 HA LYS 93 14.257 2.399 -4.453 696 HB2 LYS 93 HB2 LYS 93 16.503 2.869 -5.372 697 HB3 LYS 93 HB3 LYS 93 16.226 4.592 -5.157 698 HG2 LYS 93 HG2 LYS 93 17.606 3.810 -3.369 699 HG3 LYS 93 HG3 LYS 93 16.015 4.204 -2.714 700 HD2 LYS 93 HD2 LYS 93 15.416 1.798 -2.825 701 HD3 LYS 93 HD3 LYS 93 17.053 1.442 -3.380 702 HE2 LYS 93 HE2 LYS 93 16.845 1.020 -0.996 703 HE3 LYS 93 HE3 LYS 93 17.955 2.360 -1.292 704 HZ1 LYS 93 HZ1 LYS 93 15.108 2.622 -0.472 705 HZ2 LYS 93 HZ2 LYS 93 16.182 3.904 -0.734 706 HZ3 LYS 93 HZ3 LYS 93 16.448 2.831 0.536 707 H GLY 94 H GLY 94 13.142 3.060 -2.694 708 HA2 GLY 94 HA2 GLY 94 12.160 4.444 -1.135 709 HA3 GLY 94 HA3 GLY 94 13.007 5.797 -1.860 710 H MET 95 H MET 95 10.835 3.770 -3.730 711 HA MET 95 HA MET 95 8.616 5.638 -3.442 712 HB2 MET 95 HB2 MET 95 10.244 6.393 -5.289 713 HB3 MET 95 HB3 MET 95 9.703 4.981 -6.184 714 HG2 MET 95 HG2 MET 95 7.439 5.819 -6.195 715 HG3 MET 95 HG3 MET 95 7.917 7.189 -5.194 716 HE1 MET 95 HE1 MET 95 7.207 9.169 -6.687 717 HE2 MET 95 HE2 MET 95 6.356 7.986 -7.676 718 HE3 MET 95 HE3 MET 95 7.388 9.193 -8.440 719 H ILE 96 H ILE 96 6.608 4.627 -3.806 720 HA ILE 96 HA ILE 96 6.662 1.896 -4.906 721 HB ILE 96 HB ILE 96 5.136 1.060 -3.195 722 HG12 ILE 96 HG12 ILE 96 5.539 3.720 -1.790 723 HG13 ILE 96 HG13 ILE 96 4.058 3.215 -2.598 724 HG21 ILE 96 HG21 ILE 96 7.640 2.274 -2.024 725 HG22 ILE 96 HG22 ILE 96 7.517 0.726 -2.863 726 HG23 ILE 96 HG23 ILE 96 6.708 0.956 -1.312 727 HD11 ILE 96 HD11 ILE 96 5.300 1.883 -0.197 728 HD12 ILE 96 HD12 ILE 96 3.817 1.378 -1.008 729 HD13 ILE 96 HD13 ILE 96 3.888 2.941 -0.195 730 H PHE 97 H PHE 97 4.754 1.152 -5.859 731 HA PHE 97 HA PHE 97 2.866 3.296 -6.622 732 HB2 PHE 97 HB2 PHE 97 4.111 2.437 -8.516 733 HB3 PHE 97 HB3 PHE 97 3.705 0.780 -8.088 734 HD1 PHE 97 HD2 PHE 97 2.381 3.944 -9.444 735 HD2 PHE 97 HD1 PHE 97 1.601 -0.182 -8.705 736 HE1 PHE 97 HE2 PHE 97 0.399 4.057 -10.894 737 HE2 PHE 97 HE1 PHE 97 -0.381 -0.070 -10.159 738 HZ PHE 97 HZ PHE 97 -0.982 2.050 -11.257 739 H ILE 98 H ILE 98 0.772 3.119 -6.038 740 HA ILE 98 HA ILE 98 -0.284 0.430 -5.416 741 HB ILE 98 HB ILE 98 -1.058 3.039 -4.079 742 HG12 ILE 98 HG12 ILE 98 0.383 0.582 -3.030 743 HG13 ILE 98 HG13 ILE 98 1.077 2.184 -3.256 744 HG21 ILE 98 HG21 ILE 98 -2.141 0.250 -3.630 745 HG22 ILE 98 HG22 ILE 98 -3.008 1.600 -4.364 746 HG23 ILE 98 HG23 ILE 98 -2.538 1.675 -2.666 747 HD11 ILE 98 HD11 ILE 98 0.614 1.757 -0.921 748 HD12 ILE 98 HD12 ILE 98 -1.082 1.444 -1.291 749 HD13 ILE 98 HD13 ILE 98 -0.412 3.060 -1.522 750 HA PRO 99 HA PRO 99 -3.179 1.251 -8.773 751 HB2 PRO 99 HB2 PRO 99 -4.763 -0.815 -7.308 752 HB3 PRO 99 HB3 PRO 99 -4.306 -0.751 -9.014 753 HG2 PRO 99 HG2 PRO 99 -3.069 -2.422 -7.360 754 HG3 PRO 99 HG3 PRO 99 -2.154 -1.544 -8.602 755 HD2 PRO 99 HD2 PRO 99 -2.363 -1.000 -5.659 756 HD3 PRO 99 HD3 PRO 99 -0.944 -0.913 -6.724 757 H MET 100 H MET 100 -5.002 2.484 -8.997 758 HA MET 100 HA MET 100 -5.810 4.154 -6.903 759 HB2 MET 100 HB2 MET 100 -5.937 4.832 -9.235 760 HB3 MET 100 HB3 MET 100 -7.135 3.590 -9.564 761 HG2 MET 100 HG2 MET 100 -8.326 5.598 -9.435 762 HG3 MET 100 HG3 MET 100 -8.633 4.785 -7.906 763 HE1 MET 100 HE1 MET 100 -8.271 5.839 -5.633 764 HE2 MET 100 HE2 MET 100 -7.000 7.005 -5.270 765 HE3 MET 100 HE3 MET 100 -6.576 5.382 -5.813 766 H GLY 101 H GLY 101 -6.843 3.435 -5.133 767 HA2 GLY 101 HA2 GLY 101 -9.520 2.414 -5.391 768 HA3 GLY 101 HA3 GLY 101 -8.398 1.163 -4.883 769 HA PRO 102 HA PRO 102 -10.291 3.485 -1.201 770 HB2 PRO 102 HB2 PRO 102 -10.710 1.126 0.207 771 HB3 PRO 102 HB3 PRO 102 -11.923 1.936 -0.788 772 HG2 PRO 102 HG2 PRO 102 -10.149 -0.379 -1.471 773 HG3 PRO 102 HG3 PRO 102 -11.860 -0.121 -1.869 774 HD2 PRO 102 HD2 PRO 102 -9.932 0.269 -3.691 775 HD3 PRO 102 HD3 PRO 102 -11.355 1.328 -3.624 776 H TYR 103 H TYR 103 -8.037 0.791 -1.433 777 HA TYR 103 HA TYR 103 -6.697 1.118 1.016 778 HB2 TYR 103 HB2 TYR 103 -5.648 0.038 -1.617 779 HB3 TYR 103 HB3 TYR 103 -4.869 -0.172 -0.051 780 HD1 TYR 103 HD2 TYR 103 -7.904 -1.025 -2.013 781 HD2 TYR 103 HD1 TYR 103 -5.576 -1.891 1.448 782 HE1 TYR 103 HE2 TYR 103 -9.245 -3.047 -1.614 783 HE2 TYR 103 HE1 TYR 103 -6.914 -3.907 1.847 784 HH TYR 103 HH TYR 103 -8.738 -5.376 -0.326 785 H ALA 104 H ALA 104 -5.811 2.306 -2.233 786 HA ALA 104 HA ALA 104 -3.682 3.949 -1.410 787 HB1 ALA 104 HB1 ALA 104 -3.919 5.047 -3.581 788 HB2 ALA 104 HB2 ALA 104 -5.503 4.303 -3.797 789 HB3 ALA 104 HB3 ALA 104 -4.056 3.297 -3.749 790 H ASN 105 H ASN 105 -7.154 4.534 -1.624 791 HA ASN 105 HA ASN 105 -7.263 7.292 -1.314 792 HB2 ASN 105 HB2 ASN 105 -9.173 5.903 -1.914 793 HB3 ASN 105 HB3 ASN 105 -9.147 5.137 -0.332 794 HD21 ASN 105 HD21 ASN 105 -11.187 5.724 0.191 795 HD22 ASN 105 HD22 ASN 105 -11.645 7.352 0.520 796 H MET 106 H MET 106 -6.456 4.850 1.035 797 HA MET 106 HA MET 106 -6.995 6.407 3.384 798 HB2 MET 106 HB2 MET 106 -5.188 4.006 3.003 799 HB3 MET 106 HB3 MET 106 -5.700 4.658 4.554 800 HG2 MET 106 HG2 MET 106 -7.591 3.594 2.469 801 HG3 MET 106 HG3 MET 106 -6.945 2.635 3.798 802 HE1 MET 106 HE1 MET 106 -7.979 2.566 6.163 803 HE2 MET 106 HE2 MET 106 -8.656 4.009 6.921 804 HE3 MET 106 HE3 MET 106 -6.990 4.016 6.342 805 H VAL 107 H VAL 107 -4.428 6.422 1.083 806 HA VAL 107 HA VAL 107 -2.645 7.761 3.026 807 HB VAL 107 HB VAL 107 -0.706 6.706 1.904 808 HG11 VAL 107 HG11 VAL 107 -1.553 5.737 3.957 809 HG12 VAL 107 HG12 VAL 107 -1.014 4.454 2.873 810 HG13 VAL 107 HG13 VAL 107 -2.737 4.787 3.058 811 HG21 VAL 107 HG21 VAL 107 -2.788 5.049 0.465 812 HG22 VAL 107 HG22 VAL 107 -1.045 4.780 0.426 813 HG23 VAL 107 HG23 VAL 107 -1.727 6.249 -0.274 814 H ILE 108 H ILE 108 -4.006 7.835 -0.151 815 HA ILE 108 HA ILE 108 -2.050 9.809 -1.072 816 HB ILE 108 HB ILE 108 -2.839 9.545 -3.254 817 HG12 ILE 108 HG12 ILE 108 -5.205 7.928 -2.309 818 HG13 ILE 108 HG13 ILE 108 -5.290 9.668 -2.580 819 HG21 ILE 108 HG21 ILE 108 -2.877 7.078 -3.644 820 HG22 ILE 108 HG22 ILE 108 -2.966 6.847 -1.898 821 HG23 ILE 108 HG23 ILE 108 -1.549 7.619 -2.613 822 HD11 ILE 108 HD11 ILE 108 -4.517 9.294 -4.884 823 HD12 ILE 108 HD12 ILE 108 -6.079 8.548 -4.522 824 HD13 ILE 108 HD13 ILE 108 -4.619 7.557 -4.594 825 H ASP 109 H ASP 109 -3.227 11.537 -2.595 826 HA ASP 109 HA ASP 109 -5.195 12.933 -0.906 827 HB2 ASP 109 HB2 ASP 109 -3.172 14.198 -1.171 828 HB3 ASP 109 HB3 ASP 109 -3.178 13.952 -2.916 829 HA PRO 110 HA PRO 110 -7.995 11.976 -4.314 830 HB2 PRO 110 HB2 PRO 110 -10.288 12.633 -3.091 831 HB3 PRO 110 HB3 PRO 110 -9.356 11.213 -2.597 832 HG2 PRO 110 HG2 PRO 110 -9.449 13.941 -1.349 833 HG3 PRO 110 HG3 PRO 110 -9.517 12.352 -0.563 834 HD2 PRO 110 HD2 PRO 110 -7.232 13.863 -0.754 835 HD3 PRO 110 HD3 PRO 110 -7.232 12.090 -0.629 836 H SER 111 H SER 111 -6.744 14.851 -3.844 837 HA SER 111 HA SER 111 -8.893 16.464 -5.048 838 HB2 SER 111 HB2 SER 111 -7.648 17.407 -3.107 839 HB3 SER 111 HB3 SER 111 -6.165 17.351 -4.056 840 HG SER 111 HG SER 111 -7.044 18.860 -5.471 841 H THR 112 H THR 112 -7.037 14.349 -6.356 842 HA THR 112 HA THR 112 -5.342 15.665 -8.204 843 HB THR 112 HB THR 112 -5.261 13.543 -9.419 844 HG1 THR 112 HG1 THR 112 -7.505 13.003 -9.230 845 HG21 THR 112 HG21 THR 112 -5.304 13.164 -6.418 846 HG22 THR 112 HG22 THR 112 -3.929 13.709 -7.381 847 HG23 THR 112 HG23 THR 112 -4.545 12.067 -7.572 848 H ASP 113 H ASP 113 -5.967 17.023 -9.771 849 HA ASP 113 HA ASP 113 -8.621 17.067 -10.838 850 HB2 ASP 113 HB2 ASP 113 -6.138 18.499 -11.820 851 HB3 ASP 113 HB3 ASP 113 -7.799 18.881 -12.266 852 H GLY 114 H GLY 114 -9.246 15.358 -12.061 853 HA2 GLY 114 HA2 GLY 114 -7.484 14.111 -13.990 854 HA3 GLY 114 HA3 GLY 114 -9.166 13.700 -13.689 855 H THR 115 H THR 115 -10.250 13.860 -15.550 856 HA THR 115 HA THR 115 -11.271 14.751 -17.357 857 HB THR 115 HB THR 115 -9.929 17.360 -16.611 858 HG1 THR 115 HG1 THR 115 -11.853 17.812 -15.574 859 HG21 THR 115 HG21 THR 115 -12.218 16.789 -18.501 860 HG22 THR 115 HG22 THR 115 -10.608 17.349 -18.954 861 HG23 THR 115 HG23 THR 115 -11.672 18.393 -18.015 862 H GLY 116 H GLY 116 -7.873 15.877 -17.154 863 HA2 GLY 116 HA2 GLY 116 -7.640 15.452 -20.066 864 HA3 GLY 116 HA3 GLY 116 -6.608 16.499 -19.111 865 H MET 117 H MET 117 -4.847 15.615 -17.987 866 HA MET 117 HA MET 117 -4.083 12.948 -18.994 867 HB2 MET 117 HB2 MET 117 -2.476 15.444 -18.519 868 HB3 MET 117 HB3 MET 117 -1.695 13.869 -18.596 869 HG2 MET 117 HG2 MET 117 -1.623 15.012 -20.738 870 HG3 MET 117 HG3 MET 117 -2.554 13.518 -20.831 871 HE1 MET 117 HE1 MET 117 -2.994 15.076 -23.258 872 HE2 MET 117 HE2 MET 117 -4.741 15.289 -23.333 873 HE3 MET 117 HE3 MET 117 -4.065 13.757 -22.777 874 HA PRO 118 HA PRO 118 -3.351 11.724 -14.741 875 HB2 PRO 118 HB2 PRO 118 -2.505 9.222 -15.237 876 HB3 PRO 118 HB3 PRO 118 -4.190 9.691 -15.491 877 HG2 PRO 118 HG2 PRO 118 -2.014 9.278 -17.492 878 HG3 PRO 118 HG3 PRO 118 -3.744 8.922 -17.624 879 HD2 PRO 118 HD2 PRO 118 -2.436 11.186 -18.653 880 HD3 PRO 118 HD3 PRO 118 -4.189 10.992 -18.466 881 H GLN 119 H GLN 119 -1.620 12.509 -13.643 882 HA GLN 119 HA GLN 119 1.055 12.270 -14.874 883 HB2 GLN 119 HB2 GLN 119 0.163 14.270 -12.782 884 HB3 GLN 119 HB3 GLN 119 1.668 14.288 -13.695 885 HG2 GLN 119 HG2 GLN 119 0.362 14.623 -15.774 886 HG3 GLN 119 HG3 GLN 119 -1.109 14.700 -14.806 887 HE21 GLN 119 HE21 GLN 119 -1.602 16.800 -15.378 888 HE22 GLN 119 HE22 GLN 119 -0.668 18.156 -14.860 889 H PHE 120 H PHE 120 2.818 11.580 -13.679 890 HA PHE 120 HA PHE 120 2.229 9.633 -11.667 891 HB2 PHE 120 HB2 PHE 120 4.572 9.034 -11.821 892 HB3 PHE 120 HB3 PHE 120 3.937 9.318 -13.437 893 HD1 PHE 120 HD1 PHE 120 4.347 11.689 -14.438 894 HD2 PHE 120 HD2 PHE 120 6.546 10.080 -11.159 895 HE1 PHE 120 HE1 PHE 120 6.170 13.283 -14.876 896 HE2 PHE 120 HE2 PHE 120 8.367 11.675 -11.595 897 HZ PHE 120 HZ PHE 120 8.180 13.280 -13.456 898 H LYS 121 H LYS 121 1.813 12.468 -10.770 899 HA LYS 121 HA LYS 121 3.888 12.948 -8.810 900 HB2 LYS 121 HB2 LYS 121 1.240 14.290 -9.367 901 HB3 LYS 121 HB3 LYS 121 2.214 14.709 -7.967 902 HG2 LYS 121 HG2 LYS 121 2.616 16.289 -9.736 903 HG3 LYS 121 HG3 LYS 121 4.071 15.329 -9.459 904 HD2 LYS 121 HD2 LYS 121 3.655 14.010 -11.419 905 HD3 LYS 121 HD3 LYS 121 2.060 14.732 -11.633 906 HE2 LYS 121 HE2 LYS 121 4.682 16.219 -11.823 907 HE3 LYS 121 HE3 LYS 121 3.737 15.648 -13.197 908 HZ1 LYS 121 HZ1 LYS 121 1.889 17.051 -12.401 909 HZ2 LYS 121 HZ2 LYS 121 3.262 17.939 -12.827 910 HZ3 LYS 121 HZ3 LYS 121 2.905 17.675 -11.198 911 H GLY 122 H GLY 122 4.023 11.413 -7.266 912 HA2 GLY 122 HA2 GLY 122 1.596 10.214 -6.175 913 HA3 GLY 122 HA3 GLY 122 3.243 9.685 -5.882 914 H VAL 123 H VAL 123 1.330 9.888 -3.867 915 HA VAL 123 HA VAL 123 2.070 12.265 -2.304 916 HB VAL 123 HB VAL 123 0.237 9.971 -1.580 917 HG11 VAL 123 HG11 VAL 123 -0.595 11.472 0.185 918 HG12 VAL 123 HG12 VAL 123 0.643 12.652 -0.247 919 HG13 VAL 123 HG13 VAL 123 1.111 11.077 0.396 920 HG21 VAL 123 HG21 VAL 123 -0.631 11.179 -3.501 921 HG22 VAL 123 HG22 VAL 123 -0.430 12.717 -2.658 922 HG23 VAL 123 HG23 VAL 123 -1.603 11.535 -2.074 923 H LYS 124 H LYS 124 3.823 12.205 -0.984 924 HA LYS 124 HA LYS 124 5.337 9.861 -0.601 925 HB2 LYS 124 HB2 LYS 124 5.880 12.529 -0.425 926 HB3 LYS 124 HB3 LYS 124 5.841 12.088 1.279 927 HG2 LYS 124 HG2 LYS 124 7.376 10.127 0.501 928 HG3 LYS 124 HG3 LYS 124 7.679 11.170 -0.881 929 HD2 LYS 124 HD2 LYS 124 9.405 11.609 0.695 930 HD3 LYS 124 HD3 LYS 124 8.305 12.986 0.754 931 HE2 LYS 124 HE2 LYS 124 7.274 12.116 2.775 932 HE3 LYS 124 HE3 LYS 124 8.265 10.661 2.688 933 HZ1 LYS 124 HZ1 LYS 124 9.171 13.432 3.236 934 HZ2 LYS 124 HZ2 LYS 124 10.233 12.171 2.875 935 HZ3 LYS 124 HZ3 LYS 124 9.271 12.084 4.259 936 H GLY 125 H GLY 125 5.873 8.771 1.324 937 HA2 GLY 125 HA2 GLY 125 4.593 9.178 3.823 938 HA3 GLY 125 HA3 GLY 125 3.772 7.915 2.918 939 H THR 126 H THR 126 4.330 6.206 4.220 940 HA THR 126 HA THR 126 7.150 5.367 4.177 941 HB THR 126 HB THR 126 7.015 4.628 6.553 942 HG1 THR 126 HG1 THR 126 4.643 6.221 6.640 943 HG21 THR 126 HG21 THR 126 6.562 7.597 6.174 944 HG22 THR 126 HG22 THR 126 8.106 6.761 6.004 945 HG23 THR 126 HG23 THR 126 7.311 6.831 7.577 946 H VAL 127 H VAL 127 7.449 3.067 4.648 947 HA VAL 127 HA VAL 127 5.040 1.400 4.620 948 HB VAL 127 HB VAL 127 5.695 1.663 2.251 949 HG11 VAL 127 HG11 VAL 127 7.797 0.686 1.431 950 HG12 VAL 127 HG12 VAL 127 8.294 0.376 3.096 951 HG13 VAL 127 HG13 VAL 127 8.084 2.034 2.533 952 HG21 VAL 127 HG21 VAL 127 4.613 -0.407 2.965 953 HG22 VAL 127 HG22 VAL 127 6.184 -1.114 3.341 954 HG23 VAL 127 HG23 VAL 127 5.770 -0.721 1.672 955 H GLU 128 H GLU 128 5.278 -0.595 5.619 956 HA GLU 128 HA GLU 128 7.906 -1.593 6.361 957 HB2 GLU 128 HB2 GLU 128 7.356 -1.669 8.789 958 HB3 GLU 128 HB3 GLU 128 7.517 -0.030 8.168 959 HG2 GLU 128 HG2 GLU 128 5.117 0.227 8.096 960 HG3 GLU 128 HG3 GLU 128 4.890 -1.453 8.579 961 H LYS 129 H LYS 129 7.810 -3.707 7.472 962 HA LYS 129 HA LYS 129 5.830 -5.501 6.481 963 HB2 LYS 129 HB2 LYS 129 8.051 -6.337 6.871 964 HB3 LYS 129 HB3 LYS 129 8.033 -5.781 8.538 965 HG2 LYS 129 HG2 LYS 129 7.772 -8.123 8.628 966 HG3 LYS 129 HG3 LYS 129 6.174 -7.451 8.950 967 HD2 LYS 129 HD2 LYS 129 5.860 -9.270 7.455 968 HD3 LYS 129 HD3 LYS 129 5.658 -7.801 6.498 969 HE2 LYS 129 HE2 LYS 129 6.993 -9.389 5.260 970 HE3 LYS 129 HE3 LYS 129 8.003 -8.026 5.730 971 HZ1 LYS 129 HZ1 LYS 129 9.135 -10.125 6.070 972 HZ2 LYS 129 HZ2 LYS 129 7.907 -10.661 7.099 973 HZ3 LYS 129 HZ3 LYS 129 8.879 -9.355 7.552 974 H THR 130 H THR 130 3.987 -6.337 7.476 975 HA THR 130 HA THR 130 3.642 -5.907 10.351 976 HB THR 130 HB THR 130 2.501 -3.969 9.508 977 HG1 THR 130 HG1 THR 130 1.082 -4.467 10.990 978 HG21 THR 130 HG21 THR 130 0.927 -5.842 7.727 979 HG22 THR 130 HG22 THR 130 2.135 -4.673 7.193 980 HG23 THR 130 HG23 THR 130 0.630 -4.114 7.923 981 H ASP 131 H ASP 131 2.242 -7.300 11.389 982 HA ASP 131 HA ASP 131 1.632 -9.783 9.990 983 HB2 ASP 131 HB2 ASP 131 1.279 -9.063 12.914 984 HB3 ASP 131 HB3 ASP 131 1.185 -10.679 12.220 985 H GLU 132 H GLU 132 0.066 -6.909 10.548 986 HA GLU 132 HA GLU 132 -2.557 -7.684 11.252 987 HB2 GLU 132 HB2 GLU 132 -1.510 -5.297 9.716 988 HB3 GLU 132 HB3 GLU 132 -3.185 -5.462 10.233 989 HG2 GLU 132 HG2 GLU 132 -2.625 -5.302 12.498 990 HG3 GLU 132 HG3 GLU 132 -0.921 -5.632 12.192 991 H LYS 133 H LYS 133 -4.484 -7.411 9.759 992 HA LYS 133 HA LYS 133 -3.993 -9.079 7.404 993 HB2 LYS 133 HB2 LYS 133 -6.136 -9.857 7.605 994 HB3 LYS 133 HB3 LYS 133 -5.894 -9.352 9.269 995 HG2 LYS 133 HG2 LYS 133 -7.067 -7.249 8.810 996 HG3 LYS 133 HG3 LYS 133 -7.280 -7.736 7.128 997 HD2 LYS 133 HD2 LYS 133 -8.462 -9.819 8.112 998 HD3 LYS 133 HD3 LYS 133 -8.564 -8.872 9.598 999 HE2 LYS 133 HE2 LYS 133 -10.611 -8.568 8.384 1000 HE3 LYS 133 HE3 LYS 133 -9.693 -7.065 8.274 1001 HZ1 LYS 133 HZ1 LYS 133 -8.954 -7.717 6.062 1002 HZ2 LYS 133 HZ2 LYS 133 -10.646 -7.698 6.133 1003 HZ3 LYS 133 HZ3 LYS 133 -9.815 -9.170 6.176 1004 H VAL 134 H VAL 134 -4.860 -8.578 5.330 1005 HA VAL 134 HA VAL 134 -4.653 -5.940 4.427 1006 HB VAL 134 HB VAL 134 -6.163 -8.262 3.197 1007 HG11 VAL 134 HG11 VAL 134 -5.272 -5.662 1.934 1008 HG12 VAL 134 HG12 VAL 134 -6.938 -6.170 2.219 1009 HG13 VAL 134 HG13 VAL 134 -5.935 -7.046 1.062 1010 HG21 VAL 134 HG21 VAL 134 -3.807 -8.750 3.550 1011 HG22 VAL 134 HG22 VAL 134 -3.351 -7.242 2.756 1012 HG23 VAL 134 HG23 VAL 134 -4.124 -8.527 1.829 1013 H LEU 135 H LEU 135 -6.011 -4.229 4.468 1014 HA LEU 135 HA LEU 135 -8.463 -4.404 5.931 1015 HB2 LEU 135 HB2 LEU 135 -6.702 -2.328 5.132 1016 HB3 LEU 135 HB3 LEU 135 -8.278 -1.922 4.479 1017 HG LEU 135 HG LEU 135 -7.542 -2.351 7.376 1018 HD11 LEU 135 HD11 LEU 135 -8.324 -0.071 7.650 1019 HD12 LEU 135 HD12 LEU 135 -8.718 0.019 5.933 1020 HD13 LEU 135 HD13 LEU 135 -7.037 -0.144 6.446 1021 HD21 LEU 135 HD21 LEU 135 -10.301 -1.958 6.212 1022 HD22 LEU 135 HD22 LEU 135 -9.890 -1.962 7.927 1023 HD23 LEU 135 HD23 LEU 135 -9.694 -3.431 6.972 1024 H SER 136 H SER 136 -9.802 -5.791 4.819 1025 HA SER 136 HA SER 136 -10.308 -6.074 2.165 1026 HB2 SER 136 HB2 SER 136 -12.448 -6.239 4.306 1027 HB3 SER 136 HB3 SER 136 -12.419 -7.102 2.767 1028 HG SER 136 HG SER 136 -11.246 -8.579 3.687 1029 H VAL 137 H VAL 137 -11.699 -5.206 0.627 1030 HA VAL 137 HA VAL 137 -11.789 -2.503 0.392 1031 HB VAL 137 HB VAL 137 -13.815 -4.381 -0.850 1032 HG11 VAL 137 HG11 VAL 137 -12.859 -1.660 -1.765 1033 HG12 VAL 137 HG12 VAL 137 -14.446 -2.029 -1.089 1034 HG13 VAL 137 HG13 VAL 137 -13.967 -2.720 -2.639 1035 HG21 VAL 137 HG21 VAL 137 -11.092 -3.528 -1.855 1036 HG22 VAL 137 HG22 VAL 137 -12.250 -4.530 -2.731 1037 HG23 VAL 137 HG23 VAL 137 -11.514 -5.127 -1.243 1038 H LYS 138 H LYS 138 -14.572 -4.473 1.487 1039 HA LYS 138 HA LYS 138 -16.256 -2.209 1.917 1040 HB2 LYS 138 HB2 LYS 138 -17.180 -4.444 1.495 1041 HB3 LYS 138 HB3 LYS 138 -16.492 -5.028 3.005 1042 HG2 LYS 138 HG2 LYS 138 -17.920 -3.449 4.249 1043 HG3 LYS 138 HG3 LYS 138 -18.634 -2.917 2.725 1044 HD2 LYS 138 HD2 LYS 138 -18.731 -5.739 3.810 1045 HD3 LYS 138 HD3 LYS 138 -20.040 -4.563 3.920 1046 HE2 LYS 138 HE2 LYS 138 -20.202 -4.482 1.489 1047 HE3 LYS 138 HE3 LYS 138 -18.847 -5.604 1.347 1048 HZ1 LYS 138 HZ1 LYS 138 -20.928 -6.757 1.084 1049 HZ2 LYS 138 HZ2 LYS 138 -21.487 -6.189 2.571 1050 HZ3 LYS 138 HZ3 LYS 138 -20.184 -7.267 2.514 1051 H GLU 139 H GLU 139 -14.297 -4.233 4.106 1052 HA GLU 139 HA GLU 139 -14.955 -3.061 6.551 1053 HB2 GLU 139 HB2 GLU 139 -13.556 -5.080 6.327 1054 HB3 GLU 139 HB3 GLU 139 -12.269 -4.119 5.615 1055 HG2 GLU 139 HG2 GLU 139 -11.661 -4.527 7.861 1056 HG3 GLU 139 HG3 GLU 139 -12.146 -2.834 7.769 1057 H LEU 140 H LEU 140 -12.578 -2.110 4.145 1058 HA LEU 140 HA LEU 140 -11.402 0.068 5.432 1059 HB2 LEU 140 HB2 LEU 140 -10.869 -1.266 3.229 1060 HB3 LEU 140 HB3 LEU 140 -11.820 -0.005 2.468 1061 HG LEU 140 HG LEU 140 -9.525 0.688 4.267 1062 HD11 LEU 140 HD11 LEU 140 -9.337 0.069 1.323 1063 HD12 LEU 140 HD12 LEU 140 -8.664 -0.901 2.634 1064 HD13 LEU 140 HD13 LEU 140 -8.047 0.725 2.335 1065 HD21 LEU 140 HD21 LEU 140 -10.825 2.097 1.934 1066 HD22 LEU 140 HD22 LEU 140 -9.433 2.691 2.838 1067 HD23 LEU 140 HD23 LEU 140 -10.993 2.516 3.641 1068 H LEU 141 H LEU 141 -14.338 -0.155 3.438 1069 HA LEU 141 HA LEU 141 -14.887 2.588 3.159 1070 HB2 LEU 141 HB2 LEU 141 -16.948 0.396 3.486 1071 HB3 LEU 141 HB3 LEU 141 -17.187 1.958 2.727 1072 HG LEU 141 HG LEU 141 -15.505 -0.318 1.673 1073 HD11 LEU 141 HD11 LEU 141 -18.062 0.922 0.656 1074 HD12 LEU 141 HD12 LEU 141 -17.894 -0.667 1.403 1075 HD13 LEU 141 HD13 LEU 141 -17.137 -0.344 -0.156 1076 HD21 LEU 141 HD21 LEU 141 -14.456 1.841 1.175 1077 HD22 LEU 141 HD22 LEU 141 -15.968 2.409 0.461 1078 HD23 LEU 141 HD23 LEU 141 -15.088 1.069 -0.278 1079 H GLU 142 H GLU 142 -15.818 0.285 5.688 1080 HA GLU 142 HA GLU 142 -17.213 2.255 7.261 1081 HB2 GLU 142 HB2 GLU 142 -16.257 -0.500 8.096 1082 HB3 GLU 142 HB3 GLU 142 -17.478 0.480 8.905 1083 HG2 GLU 142 HG2 GLU 142 -18.864 0.338 6.833 1084 HG3 GLU 142 HG3 GLU 142 -17.673 -0.779 6.170 1085 H ALA 143 H ALA 143 -13.964 0.988 7.130 1086 HA ALA 143 HA ALA 143 -12.989 1.797 9.625 1087 HB1 ALA 143 HB1 ALA 143 -11.779 0.298 8.087 1088 HB2 ALA 143 HB2 ALA 143 -10.774 1.633 8.650 1089 HB3 ALA 143 HB3 ALA 143 -11.456 1.671 7.025 1090 H ILE 144 H ILE 144 -13.244 3.637 6.579 1091 HA ILE 144 HA ILE 144 -12.020 5.982 7.731 1092 HB ILE 144 HB ILE 144 -12.673 7.137 5.644 1093 HG12 ILE 144 HG12 ILE 144 -13.475 5.425 3.792 1094 HG13 ILE 144 HG13 ILE 144 -14.156 4.569 5.168 1095 HG21 ILE 144 HG21 ILE 144 -10.557 5.966 5.783 1096 HG22 ILE 144 HG22 ILE 144 -11.224 5.826 4.156 1097 HG23 ILE 144 HG23 ILE 144 -11.328 4.464 5.274 1098 HD11 ILE 144 HD11 ILE 144 -15.495 6.515 5.733 1099 HD12 ILE 144 HD12 ILE 144 -15.789 6.003 4.071 1100 HD13 ILE 144 HD13 ILE 144 -14.778 7.411 4.393 1101 H GLY 145 H GLY 145 -15.088 4.640 7.994 1102 HA2 GLY 145 HA2 GLY 145 -16.393 6.015 9.720 1103 HA3 GLY 145 HA3 GLY 145 -16.367 7.263 8.485 1104 H SER 146 H SER 146 -17.152 6.356 6.248 1105 HA SER 146 HA SER 146 -18.962 5.782 5.002 1106 HB2 SER 146 HB2 SER 146 -18.130 3.498 5.435 1107 HB3 SER 146 HB3 SER 146 -19.126 3.409 6.886 1108 HG SER 146 HG SER 146 -19.807 2.937 4.320 Start of MODEL 20 1 H1 MET 1 H1 MET 1 -46.256 -10.464 -2.108 2 H2 MET 1 H2 MET 1 -46.848 -10.740 -3.662 3 H3 MET 1 H3 MET 1 -46.411 -9.177 -3.192 4 HA MET 1 HA MET 1 -44.555 -11.473 -3.416 5 HB2 MET 1 HB2 MET 1 -43.661 -10.288 -5.419 6 HB3 MET 1 HB3 MET 1 -45.302 -10.878 -5.625 7 HG2 MET 1 HG2 MET 1 -46.159 -8.614 -5.217 8 HG3 MET 1 HG3 MET 1 -44.507 -8.029 -5.040 9 HE1 MET 1 HE1 MET 1 -46.209 -9.734 -8.978 10 HE2 MET 1 HE2 MET 1 -47.156 -9.570 -7.499 11 HE3 MET 1 HE3 MET 1 -45.834 -10.733 -7.575 12 H GLY 2 H GLY 2 -43.045 -11.211 -1.897 13 HA2 GLY 2 HA2 GLY 2 -41.665 -8.620 -1.726 14 HA3 GLY 2 HA3 GLY 2 -42.330 -9.295 -0.246 15 H SER 3 H SER 3 -39.701 -8.786 -0.254 16 HA SER 3 HA SER 3 -38.284 -11.270 -0.950 17 HB2 SER 3 HB2 SER 3 -36.225 -10.008 -0.730 18 HB3 SER 3 HB3 SER 3 -37.341 -9.092 -1.741 19 HG SER 3 HG SER 3 -37.681 -7.673 -0.110 20 H SER 4 H SER 4 -36.781 -12.221 0.576 21 HA SER 4 HA SER 4 -36.987 -11.447 3.381 22 HB2 SER 4 HB2 SER 4 -37.912 -14.162 2.401 23 HB3 SER 4 HB3 SER 4 -37.551 -13.803 4.090 24 HG SER 4 HG SER 4 -39.338 -12.141 2.706 25 H HIS 5 H HIS 5 -34.841 -11.113 3.607 26 HA HIS 5 HA HIS 5 -33.067 -13.439 3.391 27 HB2 HIS 5 HB2 HIS 5 -31.292 -11.845 2.409 28 HB3 HIS 5 HB3 HIS 5 -32.547 -12.439 1.328 29 HD1 HIS 5 HD1 HIS 5 -33.672 -10.696 -0.026 30 HD2 HIS 5 HD2 HIS 5 -31.945 -9.104 3.399 31 HE1 HIS 5 HE1 HIS 5 -34.006 -8.217 -0.197 32 HE2 HIS 5 HE2 HIS 5 -32.748 -7.272 1.760 33 H HIS 6 H HIS 6 -31.295 -13.415 4.825 34 HA HIS 6 HA HIS 6 -31.044 -11.212 6.718 35 HB2 HIS 6 HB2 HIS 6 -31.476 -12.726 8.678 36 HB3 HIS 6 HB3 HIS 6 -32.902 -12.396 7.701 37 HD1 HIS 6 HD1 HIS 6 -34.065 -14.384 6.620 38 HD2 HIS 6 HD2 HIS 6 -30.451 -15.382 8.413 39 HE1 HIS 6 HE1 HIS 6 -33.943 -16.887 6.546 40 HE2 HIS 6 HE2 HIS 6 -31.688 -17.454 7.499 41 H HIS 7 H HIS 7 -29.041 -11.098 7.647 42 HA HIS 7 HA HIS 7 -27.368 -13.501 7.741 43 HB2 HIS 7 HB2 HIS 7 -25.396 -12.291 6.862 44 HB3 HIS 7 HB3 HIS 7 -26.674 -12.443 5.666 45 HD1 HIS 7 HD1 HIS 7 -25.108 -9.858 7.956 46 HD2 HIS 7 HD2 HIS 7 -27.565 -10.060 4.607 47 HE1 HIS 7 HE1 HIS 7 -25.315 -7.496 7.128 48 HE2 HIS 7 HE2 HIS 7 -26.723 -7.657 5.050 49 H HIS 8 H HIS 8 -27.151 -13.698 9.896 50 HA HIS 8 HA HIS 8 -26.232 -11.333 11.417 51 HB2 HIS 8 HB2 HIS 8 -27.621 -13.806 12.484 52 HB3 HIS 8 HB3 HIS 8 -27.129 -12.405 13.429 53 HD1 HIS 8 HD1 HIS 8 -29.886 -13.725 11.410 54 HD2 HIS 8 HD2 HIS 8 -28.656 -10.013 12.813 55 HE1 HIS 8 HE1 HIS 8 -31.894 -12.234 11.218 56 HE2 HIS 8 HE2 HIS 8 -31.170 -10.046 12.223 57 H HIS 9 H HIS 9 -24.022 -11.608 10.982 58 HA HIS 9 HA HIS 9 -22.771 -13.821 12.459 59 HB2 HIS 9 HB2 HIS 9 -22.048 -12.987 9.641 60 HB3 HIS 9 HB3 HIS 9 -21.042 -14.025 10.645 61 HD1 HIS 9 HD1 HIS 9 -23.132 -14.402 7.940 62 HD2 HIS 9 HD2 HIS 9 -23.008 -16.284 11.638 63 HE1 HIS 9 HE1 HIS 9 -24.317 -16.588 7.618 64 HE2 HIS 9 HE2 HIS 9 -24.073 -17.773 9.819 65 H HIS 10 H HIS 10 -20.699 -13.414 13.258 66 HA HIS 10 HA HIS 10 -19.512 -10.765 12.823 67 HB2 HIS 10 HB2 HIS 10 -20.025 -12.011 15.536 68 HB3 HIS 10 HB3 HIS 10 -18.974 -10.626 15.273 69 HD1 HIS 10 HD1 HIS 10 -22.466 -11.557 15.819 70 HD2 HIS 10 HD2 HIS 10 -20.394 -8.253 14.385 71 HE1 HIS 10 HE1 HIS 10 -24.111 -9.662 15.864 72 HE2 HIS 10 HE2 HIS 10 -22.820 -7.663 15.059 73 H SER 11 H SER 11 -17.834 -11.613 11.630 74 HA SER 11 HA SER 11 -16.351 -13.926 12.340 75 HB2 SER 11 HB2 SER 11 -14.654 -13.038 10.698 76 HB3 SER 11 HB3 SER 11 -16.289 -13.167 10.051 77 HG SER 11 HG SER 11 -15.079 -10.792 11.052 78 H SER 12 H SER 12 -15.659 -13.855 14.444 79 HA SER 12 HA SER 12 -14.545 -11.666 15.770 80 HB2 SER 12 HB2 SER 12 -13.659 -13.348 17.399 81 HB3 SER 12 HB3 SER 12 -15.369 -13.558 17.021 82 HG SER 12 HG SER 12 -13.902 -15.485 17.018 83 H GLY 13 H GLY 13 -12.698 -10.632 15.530 84 HA2 GLY 13 HA2 GLY 13 -10.235 -12.094 14.915 85 HA3 GLY 13 HA3 GLY 13 -10.717 -10.829 13.793 86 H ARG 14 H ARG 14 -9.730 -11.497 17.104 87 HA ARG 14 HA ARG 14 -9.633 -8.724 17.885 88 HB2 ARG 14 HB2 ARG 14 -10.083 -10.536 19.508 89 HB3 ARG 14 HB3 ARG 14 -8.466 -11.170 19.231 90 HG2 ARG 14 HG2 ARG 14 -7.814 -8.662 19.915 91 HG3 ARG 14 HG3 ARG 14 -9.342 -8.803 20.784 92 HD2 ARG 14 HD2 ARG 14 -6.937 -10.608 21.039 93 HD3 ARG 14 HD3 ARG 14 -7.512 -9.440 22.228 94 HE ARG 14 HE ARG 14 -9.569 -11.263 21.704 95 HH11 ARG 14 HH11 ARG 14 -6.462 -11.150 23.196 96 HH12 ARG 14 HH12 ARG 14 -6.800 -12.487 24.241 97 HH21 ARG 14 HH21 ARG 14 -9.984 -12.971 23.062 98 HH22 ARG 14 HH22 ARG 14 -8.761 -13.496 24.171 99 H GLU 15 H GLU 15 -7.255 -11.221 17.078 100 HA GLU 15 HA GLU 15 -5.079 -11.168 16.469 101 HB2 GLU 15 HB2 GLU 15 -5.975 -8.532 15.719 102 HB3 GLU 15 HB3 GLU 15 -4.334 -8.433 16.337 103 HG2 GLU 15 HG2 GLU 15 -5.307 -10.173 14.078 104 HG3 GLU 15 HG3 GLU 15 -4.292 -8.735 13.950 105 H ASN 16 H ASN 16 -2.922 -10.719 17.342 106 HA ASN 16 HA ASN 16 -2.720 -9.419 19.922 107 HB2 ASN 16 HB2 ASN 16 -3.754 -11.829 20.195 108 HB3 ASN 16 HB3 ASN 16 -2.099 -12.366 19.951 109 HD21 ASN 16 HD21 ASN 16 -0.991 -9.991 21.358 110 HD22 ASN 16 HD22 ASN 16 -1.300 -10.277 23.028 111 H LEU 17 H LEU 17 -1.409 -9.647 17.143 112 HA LEU 17 HA LEU 17 1.350 -10.186 18.028 113 HB2 LEU 17 HB2 LEU 17 0.108 -10.141 15.292 114 HB3 LEU 17 HB3 LEU 17 1.846 -10.108 15.534 115 HG LEU 17 HG LEU 17 1.561 -12.263 16.876 116 HD11 LEU 17 HD11 LEU 17 -0.405 -13.624 16.351 117 HD12 LEU 17 HD12 LEU 17 -1.132 -12.253 15.514 118 HD13 LEU 17 HD13 LEU 17 -0.837 -12.172 17.251 119 HD21 LEU 17 HD21 LEU 17 1.539 -13.636 14.847 120 HD22 LEU 17 HD22 LEU 17 2.547 -12.200 14.678 121 HD23 LEU 17 HD23 LEU 17 0.954 -12.249 13.926 122 H TYR 18 H TYR 18 3.008 -8.780 16.789 123 HA TYR 18 HA TYR 18 2.276 -6.093 16.148 124 HB2 TYR 18 HB2 TYR 18 3.697 -5.106 18.062 125 HB3 TYR 18 HB3 TYR 18 2.074 -5.663 18.449 126 HD1 TYR 18 HD2 TYR 18 1.726 -7.658 19.809 127 HD2 TYR 18 HD1 TYR 18 5.667 -6.287 18.942 128 HE1 TYR 18 HE2 TYR 18 2.612 -9.093 21.590 129 HE2 TYR 18 HE1 TYR 18 6.559 -7.729 20.726 130 HH TYR 18 HH TYR 18 5.691 -8.788 22.853 131 H PHE 19 H PHE 19 3.686 -5.414 14.662 132 HA PHE 19 HA PHE 19 6.289 -6.766 14.477 133 HB2 PHE 19 HB2 PHE 19 4.778 -6.732 12.478 134 HB3 PHE 19 HB3 PHE 19 4.960 -4.983 12.421 135 HD1 PHE 19 HD2 PHE 19 6.748 -8.192 12.071 136 HD2 PHE 19 HD1 PHE 19 6.913 -3.975 11.479 137 HE1 PHE 19 HE2 PHE 19 8.782 -8.463 10.723 138 HE2 PHE 19 HE1 PHE 19 8.952 -4.245 10.127 139 HZ PHE 19 HZ PHE 19 9.888 -6.491 9.748 140 H GLN 20 H GLN 20 7.547 -5.683 15.962 141 HA GLN 20 HA GLN 20 7.864 -2.792 15.774 142 HB2 GLN 20 HB2 GLN 20 7.821 -3.864 17.990 143 HB3 GLN 20 HB3 GLN 20 9.234 -4.818 17.566 144 HG2 GLN 20 HG2 GLN 20 10.582 -2.798 17.424 145 HG3 GLN 20 HG3 GLN 20 9.164 -1.808 17.767 146 HE21 GLN 20 HE21 GLN 20 10.101 -0.929 19.611 147 HE22 GLN 20 HE22 GLN 20 10.308 -1.840 21.063 148 H GLY 21 H GLY 21 8.760 -2.564 13.699 149 HA2 GLY 21 HA2 GLY 21 11.593 -3.373 13.494 150 HA3 GLY 21 HA3 GLY 21 10.490 -3.747 12.180 151 H HIS 22 H HIS 22 12.409 -2.457 11.214 152 HA HIS 22 HA HIS 22 12.195 0.431 11.519 153 HB2 HIS 22 HB2 HIS 22 14.421 -0.539 11.394 154 HB3 HIS 22 HB3 HIS 22 14.043 -1.295 9.851 155 HD1 HIS 22 HD1 HIS 22 14.983 1.977 11.384 156 HD2 HIS 22 HD2 HIS 22 14.158 0.424 7.621 157 HE1 HIS 22 HE1 HIS 22 15.751 3.723 9.758 158 HE2 HIS 22 HE2 HIS 22 15.411 2.685 7.493 159 H MET 23 H MET 23 10.344 1.175 10.520 160 HA MET 23 HA MET 23 9.567 0.396 7.877 161 HB2 MET 23 HB2 MET 23 7.940 2.222 8.082 162 HB3 MET 23 HB3 MET 23 7.945 1.213 9.522 163 HG2 MET 23 HG2 MET 23 9.467 2.919 10.582 164 HG3 MET 23 HG3 MET 23 9.140 3.956 9.194 165 HE1 MET 23 HE1 MET 23 5.137 4.031 9.528 166 HE2 MET 23 HE2 MET 23 6.070 2.712 8.817 167 HE3 MET 23 HE3 MET 23 6.488 4.384 8.449 168 H LEU 24 H LEU 24 9.604 1.776 5.980 169 HA LEU 24 HA LEU 24 11.837 3.725 5.987 170 HB2 LEU 24 HB2 LEU 24 10.980 1.762 3.879 171 HB3 LEU 24 HB3 LEU 24 11.986 3.150 3.506 172 HG LEU 24 HG LEU 24 13.352 2.055 5.610 173 HD11 LEU 24 HD11 LEU 24 13.544 -0.337 5.222 174 HD12 LEU 24 HD12 LEU 24 12.259 -0.259 4.015 175 HD13 LEU 24 HD13 LEU 24 11.907 0.101 5.707 176 HD21 LEU 24 HD21 LEU 24 14.922 1.246 3.903 177 HD22 LEU 24 HD22 LEU 24 14.319 2.872 3.566 178 HD23 LEU 24 HD23 LEU 24 13.683 1.492 2.665 179 H GLU 25 H GLU 25 11.645 5.625 4.819 180 HA GLU 25 HA GLU 25 8.944 6.477 4.174 181 HB2 GLU 25 HB2 GLU 25 11.557 7.848 4.529 182 HB3 GLU 25 HB3 GLU 25 10.395 8.618 3.451 183 HG2 GLU 25 HG2 GLU 25 8.737 8.656 5.208 184 HG3 GLU 25 HG3 GLU 25 9.828 7.803 6.291 185 H VAL 26 H VAL 26 8.069 6.606 2.266 186 HA VAL 26 HA VAL 26 9.697 6.416 -0.175 187 HB VAL 26 HB VAL 26 8.215 4.664 -1.110 188 HG11 VAL 26 HG11 VAL 26 10.345 3.994 -0.142 189 HG12 VAL 26 HG12 VAL 26 9.120 2.756 0.145 190 HG13 VAL 26 HG13 VAL 26 9.596 3.846 1.449 191 HG21 VAL 26 HG21 VAL 26 7.085 4.493 1.689 192 HG22 VAL 26 HG22 VAL 26 6.740 3.371 0.372 193 HG23 VAL 26 HG23 VAL 26 6.229 5.056 0.251 194 H GLU 27 H GLU 27 8.436 6.937 -2.151 195 HA GLU 27 HA GLU 27 6.219 8.769 -1.546 196 HB2 GLU 27 HB2 GLU 27 8.174 9.553 -2.929 197 HB3 GLU 27 HB3 GLU 27 7.665 8.435 -4.185 198 HG2 GLU 27 HG2 GLU 27 5.646 9.619 -4.556 199 HG3 GLU 27 HG3 GLU 27 5.858 10.582 -3.096 200 H VAL 28 H VAL 28 4.245 7.999 -1.690 201 HA VAL 28 HA VAL 28 3.731 5.436 -2.953 202 HB VAL 28 HB VAL 28 1.839 7.169 -1.348 203 HG11 VAL 28 HG11 VAL 28 0.694 5.497 -2.686 204 HG12 VAL 28 HG12 VAL 28 0.616 5.065 -0.978 205 HG13 VAL 28 HG13 VAL 28 1.743 4.230 -2.047 206 HG21 VAL 28 HG21 VAL 28 2.419 5.770 0.582 207 HG22 VAL 28 HG22 VAL 28 3.823 6.648 -0.023 208 HG23 VAL 28 HG23 VAL 28 3.633 4.934 -0.387 209 H ILE 29 H ILE 29 2.949 5.279 -4.960 210 HA ILE 29 HA ILE 29 1.612 7.604 -6.172 211 HB ILE 29 HB ILE 29 2.491 5.217 -7.769 212 HG12 ILE 29 HG12 ILE 29 4.346 7.457 -6.889 213 HG13 ILE 29 HG13 ILE 29 4.399 5.815 -6.262 214 HG21 ILE 29 HG21 ILE 29 1.231 6.947 -8.888 215 HG22 ILE 29 HG22 ILE 29 2.900 7.002 -9.456 216 HG23 ILE 29 HG23 ILE 29 2.325 8.194 -8.282 217 HD11 ILE 29 HD11 ILE 29 4.928 4.990 -8.505 218 HD12 ILE 29 HD12 ILE 29 6.114 6.154 -7.913 219 HD13 ILE 29 HD13 ILE 29 4.912 6.649 -9.105 220 H SER 30 H SER 30 -0.298 7.309 -7.453 221 HA SER 30 HA SER 30 -1.651 4.708 -7.177 222 HB2 SER 30 HB2 SER 30 -2.554 6.364 -5.511 223 HB3 SER 30 HB3 SER 30 -3.103 7.342 -6.873 224 HG SER 30 HG SER 30 -3.804 4.617 -6.560 225 H GLY 31 H GLY 31 -1.756 3.940 -9.182 226 HA2 GLY 31 HA2 GLY 31 -2.231 5.820 -11.416 227 HA3 GLY 31 HA3 GLY 31 -1.482 4.240 -11.561 228 H ARG 32 H ARG 32 -3.998 5.700 -12.698 229 HA ARG 32 HA ARG 32 -6.176 4.035 -11.820 230 HB2 ARG 32 HB2 ARG 32 -6.556 6.358 -12.538 231 HB3 ARG 32 HB3 ARG 32 -6.018 5.949 -14.161 232 HG2 ARG 32 HG2 ARG 32 -7.905 4.407 -14.406 233 HG3 ARG 32 HG3 ARG 32 -8.445 4.809 -12.777 234 HD2 ARG 32 HD2 ARG 32 -8.184 6.796 -15.038 235 HD3 ARG 32 HD3 ARG 32 -9.688 6.001 -14.571 236 HE ARG 32 HE ARG 32 -8.354 7.457 -12.453 237 HH11 ARG 32 HH11 ARG 32 -10.681 7.581 -14.992 238 HH12 ARG 32 HH12 ARG 32 -11.527 8.922 -14.299 239 HH21 ARG 32 HH21 ARG 32 -9.476 9.176 -11.555 240 HH22 ARG 32 HH22 ARG 32 -10.868 9.795 -12.372 241 H THR 33 H THR 33 -5.201 1.953 -12.256 242 HA THR 33 HA THR 33 -4.900 1.060 -14.980 243 HB THR 33 HB THR 33 -3.618 -0.071 -13.256 244 HG1 THR 33 HG1 THR 33 -5.262 -2.194 -13.805 245 HG21 THR 33 HG21 THR 33 -4.687 -1.498 -11.568 246 HG22 THR 33 HG22 THR 33 -6.275 -0.968 -12.121 247 HG23 THR 33 HG23 THR 33 -5.172 0.187 -11.373 248 H LEU 34 H LEU 34 -7.447 0.954 -12.547 249 HA LEU 34 HA LEU 34 -9.297 -0.387 -14.358 250 HB2 LEU 34 HB2 LEU 34 -9.751 0.799 -11.609 251 HB3 LEU 34 HB3 LEU 34 -10.917 -0.149 -12.512 252 HG LEU 34 HG LEU 34 -8.267 -1.177 -11.471 253 HD11 LEU 34 HD11 LEU 34 -9.612 -2.457 -9.883 254 HD12 LEU 34 HD12 LEU 34 -11.077 -1.684 -10.489 255 HD13 LEU 34 HD13 LEU 34 -9.849 -0.722 -9.668 256 HD21 LEU 34 HD21 LEU 34 -10.539 -2.610 -12.857 257 HD22 LEU 34 HD22 LEU 34 -9.135 -3.388 -12.127 258 HD23 LEU 34 HD23 LEU 34 -8.927 -2.320 -13.512 259 H ASN 35 H ASN 35 -10.171 0.828 -15.950 260 HA ASN 35 HA ASN 35 -10.144 3.710 -15.755 261 HB2 ASN 35 HB2 ASN 35 -11.089 1.888 -17.978 262 HB3 ASN 35 HB3 ASN 35 -10.967 3.642 -18.096 263 HD21 ASN 35 HD21 ASN 35 -8.887 4.608 -18.024 264 HD22 ASN 35 HD22 ASN 35 -7.469 3.686 -18.390 265 H GLN 36 H GLN 36 -12.252 4.631 -17.100 266 HA GLN 36 HA GLN 36 -14.350 5.444 -16.835 267 HB2 GLN 36 HB2 GLN 36 -14.915 2.830 -15.440 268 HB3 GLN 36 HB3 GLN 36 -16.127 4.016 -15.890 269 HG2 GLN 36 HG2 GLN 36 -14.337 2.580 -17.850 270 HG3 GLN 36 HG3 GLN 36 -15.995 2.114 -17.468 271 HE21 GLN 36 HE21 GLN 36 -14.777 2.999 -20.003 272 HE22 GLN 36 HE22 GLN 36 -15.719 4.353 -20.518 273 H GLY 37 H GLY 37 -14.301 7.161 -15.539 274 HA2 GLY 37 HA2 GLY 37 -13.462 7.142 -12.865 275 HA3 GLY 37 HA3 GLY 37 -14.367 8.436 -13.632 276 H ALA 38 H ALA 38 -14.447 5.873 -11.409 277 HA ALA 38 HA ALA 38 -17.237 6.394 -10.750 278 HB1 ALA 38 HB1 ALA 38 -17.272 4.603 -12.482 279 HB2 ALA 38 HB2 ALA 38 -17.942 4.104 -10.931 280 HB3 ALA 38 HB3 ALA 38 -16.317 3.587 -11.391 281 H THR 39 H THR 39 -17.742 5.957 -8.619 282 HA THR 39 HA THR 39 -15.706 5.413 -6.712 283 HB THR 39 HB THR 39 -17.592 6.600 -5.883 284 HG1 THR 39 HG1 THR 39 -17.255 5.445 -4.135 285 HG21 THR 39 HG21 THR 39 -19.882 5.708 -5.903 286 HG22 THR 39 HG22 THR 39 -19.325 4.298 -6.803 287 HG23 THR 39 HG23 THR 39 -19.252 5.900 -7.538 288 H VAL 40 H VAL 40 -15.610 3.526 -5.255 289 HA VAL 40 HA VAL 40 -15.492 1.076 -6.615 290 HB VAL 40 HB VAL 40 -14.200 1.511 -4.569 291 HG11 VAL 40 HG11 VAL 40 -15.232 1.369 -2.363 292 HG12 VAL 40 HG12 VAL 40 -16.826 1.228 -3.106 293 HG13 VAL 40 HG13 VAL 40 -15.896 2.715 -3.289 294 HG21 VAL 40 HG21 VAL 40 -14.454 -0.697 -3.544 295 HG22 VAL 40 HG22 VAL 40 -14.558 -0.799 -5.302 296 HG23 VAL 40 HG23 VAL 40 -16.024 -0.888 -4.326 297 H GLU 41 H GLU 41 -18.110 2.625 -4.914 298 HA GLU 41 HA GLU 41 -19.890 0.509 -4.511 299 HB2 GLU 41 HB2 GLU 41 -20.270 2.757 -3.631 300 HB3 GLU 41 HB3 GLU 41 -20.463 3.388 -5.258 301 HG2 GLU 41 HG2 GLU 41 -22.476 1.966 -5.529 302 HG3 GLU 41 HG3 GLU 41 -22.294 1.448 -3.853 303 H GLU 42 H GLU 42 -19.093 2.262 -7.453 304 HA GLU 42 HA GLU 42 -21.242 1.252 -9.043 305 HB2 GLU 42 HB2 GLU 42 -18.583 2.473 -9.809 306 HB3 GLU 42 HB3 GLU 42 -19.843 2.067 -10.965 307 HG2 GLU 42 HG2 GLU 42 -20.202 3.993 -8.676 308 HG3 GLU 42 HG3 GLU 42 -19.776 4.468 -10.319 309 H LYS 43 H LYS 43 -17.985 0.136 -8.337 310 HA LYS 43 HA LYS 43 -18.184 -2.015 -10.300 311 HB2 LYS 43 HB2 LYS 43 -15.950 -1.152 -8.493 312 HB3 LYS 43 HB3 LYS 43 -15.880 -2.605 -9.476 313 HG2 LYS 43 HG2 LYS 43 -14.720 -0.992 -10.706 314 HG3 LYS 43 HG3 LYS 43 -16.296 -1.090 -11.486 315 HD2 LYS 43 HD2 LYS 43 -16.958 0.994 -10.696 316 HD3 LYS 43 HD3 LYS 43 -15.818 0.958 -9.348 317 HE2 LYS 43 HE2 LYS 43 -15.104 2.575 -11.025 318 HE3 LYS 43 HE3 LYS 43 -13.951 1.249 -10.909 319 HZ1 LYS 43 HZ1 LYS 43 -14.362 1.851 -13.205 320 HZ2 LYS 43 HZ2 LYS 43 -16.018 1.569 -13.019 321 HZ3 LYS 43 HZ3 LYS 43 -14.931 0.285 -12.909 322 H LEU 44 H LEU 44 -17.097 -2.002 -6.891 323 HA LEU 44 HA LEU 44 -17.298 -3.491 -5.191 324 HB2 LEU 44 HB2 LEU 44 -20.041 -3.744 -6.416 325 HB3 LEU 44 HB3 LEU 44 -19.602 -4.492 -4.891 326 HG LEU 44 HG LEU 44 -19.605 -1.519 -5.462 327 HD11 LEU 44 HD11 LEU 44 -21.852 -2.465 -5.302 328 HD12 LEU 44 HD12 LEU 44 -21.489 -1.435 -3.918 329 HD13 LEU 44 HD13 LEU 44 -21.445 -3.191 -3.747 330 HD21 LEU 44 HD21 LEU 44 -18.986 -3.033 -2.919 331 HD22 LEU 44 HD22 LEU 44 -19.177 -1.283 -3.042 332 HD23 LEU 44 HD23 LEU 44 -17.850 -2.086 -3.881 333 H THR 45 H THR 45 -16.733 -4.643 -8.114 334 HA THR 45 HA THR 45 -17.389 -7.437 -7.739 335 HB THR 45 HB THR 45 -17.349 -6.619 -10.019 336 HG1 THR 45 HG1 THR 45 -16.097 -8.277 -10.870 337 HG21 THR 45 HG21 THR 45 -15.699 -4.818 -9.782 338 HG22 THR 45 HG22 THR 45 -15.260 -5.899 -11.105 339 HG23 THR 45 HG23 THR 45 -14.416 -6.012 -9.560 340 H GLU 46 H GLU 46 -15.808 -9.157 -7.615 341 HA GLU 46 HA GLU 46 -13.828 -8.772 -5.657 342 HB2 GLU 46 HB2 GLU 46 -14.900 -10.962 -6.165 343 HB3 GLU 46 HB3 GLU 46 -14.001 -11.027 -7.676 344 HG2 GLU 46 HG2 GLU 46 -11.892 -10.989 -6.374 345 HG3 GLU 46 HG3 GLU 46 -12.842 -11.039 -4.890 346 H GLU 47 H GLU 47 -13.697 -8.649 -9.163 347 HA GLU 47 HA GLU 47 -10.932 -8.715 -9.565 348 HB2 GLU 47 HB2 GLU 47 -12.742 -8.719 -11.337 349 HB3 GLU 47 HB3 GLU 47 -12.844 -6.976 -11.126 350 HG2 GLU 47 HG2 GLU 47 -11.467 -7.489 -13.027 351 HG3 GLU 47 HG3 GLU 47 -10.473 -6.774 -11.762 352 H TYR 48 H TYR 48 -13.034 -6.024 -8.642 353 HA TYR 48 HA TYR 48 -11.171 -3.925 -8.765 354 HB2 TYR 48 HB2 TYR 48 -13.738 -3.880 -8.298 355 HB3 TYR 48 HB3 TYR 48 -13.286 -4.107 -6.615 356 HD1 TYR 48 HD1 TYR 48 -11.473 -2.341 -5.723 357 HD2 TYR 48 HD2 TYR 48 -14.019 -1.733 -9.081 358 HE1 TYR 48 HE1 TYR 48 -11.190 0.087 -5.498 359 HE2 TYR 48 HE2 TYR 48 -13.742 0.701 -8.874 360 HH TYR 48 HH TYR 48 -11.345 2.118 -7.039 361 H PHE 49 H PHE 49 -11.991 -6.177 -6.157 362 HA PHE 49 HA PHE 49 -10.184 -5.276 -4.203 363 HB2 PHE 49 HB2 PHE 49 -12.033 -6.861 -3.768 364 HB3 PHE 49 HB3 PHE 49 -11.219 -8.084 -4.731 365 HD1 PHE 49 HD2 PHE 49 -9.200 -9.208 -3.869 366 HD2 PHE 49 HD1 PHE 49 -11.353 -6.384 -1.512 367 HE1 PHE 49 HE2 PHE 49 -8.062 -10.029 -1.845 368 HE2 PHE 49 HE1 PHE 49 -10.218 -7.203 0.509 369 HZ PHE 49 HZ PHE 49 -8.573 -9.028 0.346 370 H ASN 50 H ASN 50 -9.850 -8.062 -6.415 371 HA ASN 50 HA ASN 50 -7.229 -8.749 -5.873 372 HB2 ASN 50 HB2 ASN 50 -8.653 -8.953 -8.539 373 HB3 ASN 50 HB3 ASN 50 -7.233 -9.881 -8.057 374 HD21 ASN 50 HD21 ASN 50 -9.932 -10.750 -8.832 375 HD22 ASN 50 HD22 ASN 50 -10.495 -11.719 -7.519 376 H ALA 51 H ALA 51 -8.395 -6.100 -7.822 377 HA ALA 51 HA ALA 51 -5.901 -5.696 -9.218 378 HB1 ALA 51 HB1 ALA 51 -8.318 -3.896 -9.116 379 HB2 ALA 51 HB2 ALA 51 -8.077 -5.209 -10.268 380 HB3 ALA 51 HB3 ALA 51 -6.990 -3.819 -10.275 381 H VAL 52 H VAL 52 -7.493 -4.193 -6.412 382 HA VAL 52 HA VAL 52 -5.317 -2.189 -6.325 383 HB VAL 52 HB VAL 52 -6.786 -0.740 -5.061 384 HG11 VAL 52 HG11 VAL 52 -6.926 -0.596 -7.484 385 HG12 VAL 52 HG12 VAL 52 -8.513 -0.307 -6.767 386 HG13 VAL 52 HG13 VAL 52 -8.151 -1.865 -7.512 387 HG21 VAL 52 HG21 VAL 52 -8.838 -2.954 -5.245 388 HG22 VAL 52 HG22 VAL 52 -9.130 -1.332 -4.616 389 HG23 VAL 52 HG23 VAL 52 -8.015 -2.414 -3.782 390 H ASN 53 H ASN 53 -5.729 -5.045 -4.965 391 HA ASN 53 HA ASN 53 -5.254 -4.235 -2.180 392 HB2 ASN 53 HB2 ASN 53 -6.222 -6.734 -3.487 393 HB3 ASN 53 HB3 ASN 53 -5.365 -6.892 -1.956 394 HD21 ASN 53 HD21 ASN 53 -7.994 -5.076 -3.472 395 HD22 ASN 53 HD22 ASN 53 -8.965 -4.982 -2.051 396 H TYR 54 H TYR 54 -3.148 -4.031 -4.333 397 HA TYR 54 HA TYR 54 -1.054 -5.279 -2.731 398 HB2 TYR 54 HB2 TYR 54 0.088 -6.292 -4.632 399 HB3 TYR 54 HB3 TYR 54 -1.531 -6.956 -4.473 400 HD1 TYR 54 HD1 TYR 54 0.683 -4.874 -6.532 401 HD2 TYR 54 HD2 TYR 54 -3.228 -6.522 -6.166 402 HE1 TYR 54 HE1 TYR 54 0.240 -4.338 -8.892 403 HE2 TYR 54 HE2 TYR 54 -3.673 -5.997 -8.524 404 HH TYR 54 HH TYR 54 -1.200 -5.017 -10.693 405 H ALA 55 H ALA 55 1.095 -4.444 -3.164 406 HA ALA 55 HA ALA 55 1.116 -1.854 -4.591 407 HB1 ALA 55 HB1 ALA 55 0.963 -1.464 -2.176 408 HB2 ALA 55 HB2 ALA 55 2.507 -0.907 -2.823 409 HB3 ALA 55 HB3 ALA 55 2.422 -2.424 -1.927 410 H GLU 56 H GLU 56 2.883 -1.442 -5.833 411 HA GLU 56 HA GLU 56 4.878 -3.534 -6.152 412 HB2 GLU 56 HB2 GLU 56 4.455 -0.951 -7.683 413 HB3 GLU 56 HB3 GLU 56 5.678 -2.154 -8.072 414 HG2 GLU 56 HG2 GLU 56 3.819 -3.815 -8.368 415 HG3 GLU 56 HG3 GLU 56 2.690 -2.473 -8.203 416 H ILE 57 H ILE 57 6.657 -3.548 -5.000 417 HA ILE 57 HA ILE 57 7.605 -1.070 -3.711 418 HB ILE 57 HB ILE 57 7.903 -3.927 -2.758 419 HG12 ILE 57 HG12 ILE 57 6.064 -1.829 -1.591 420 HG13 ILE 57 HG13 ILE 57 5.528 -2.940 -2.848 421 HG21 ILE 57 HG21 ILE 57 8.467 -1.305 -1.361 422 HG22 ILE 57 HG22 ILE 57 9.668 -2.470 -1.922 423 HG23 ILE 57 HG23 ILE 57 8.562 -2.903 -0.618 424 HD11 ILE 57 HD11 ILE 57 4.887 -3.708 -0.639 425 HD12 ILE 57 HD12 ILE 57 6.581 -3.731 -0.144 426 HD13 ILE 57 HD13 ILE 57 6.014 -4.827 -1.408 427 H ASN 58 H ASN 58 9.862 -0.737 -3.500 428 HA ASN 58 HA ASN 58 11.466 -1.660 -5.681 429 HB2 ASN 58 HB2 ASN 58 12.609 -0.312 -3.245 430 HB3 ASN 58 HB3 ASN 58 13.082 -0.138 -4.933 431 HD21 ASN 58 HD21 ASN 58 11.728 1.083 -6.311 432 HD22 ASN 58 HD22 ASN 58 10.683 2.295 -5.661 433 H GLU 59 H GLU 59 13.000 -3.277 -5.740 434 HA GLU 59 HA GLU 59 12.938 -5.387 -3.943 435 HB2 GLU 59 HB2 GLU 59 13.803 -5.647 -6.185 436 HB3 GLU 59 HB3 GLU 59 15.154 -4.576 -5.832 437 HG2 GLU 59 HG2 GLU 59 16.108 -6.163 -4.316 438 HG3 GLU 59 HG3 GLU 59 14.681 -7.189 -4.413 439 H GLU 60 H GLU 60 15.190 -2.637 -3.948 440 HA GLU 60 HA GLU 60 16.900 -3.583 -1.918 441 HB2 GLU 60 HB2 GLU 60 16.295 -0.822 -2.953 442 HB3 GLU 60 HB3 GLU 60 17.443 -1.088 -1.645 443 HG2 GLU 60 HG2 GLU 60 17.648 -2.406 -4.347 444 HG3 GLU 60 HG3 GLU 60 18.457 -0.901 -3.918 445 H ASP 61 H ASP 61 14.110 -1.329 -1.644 446 HA ASP 61 HA ASP 61 14.253 -1.208 1.212 447 HB2 ASP 61 HB2 ASP 61 11.856 -0.619 -0.551 448 HB3 ASP 61 HB3 ASP 61 12.126 -0.045 1.094 449 H TRP 62 H TRP 62 12.648 -3.263 -1.080 450 HA TRP 62 HA TRP 62 10.942 -4.799 0.487 451 HB2 TRP 62 HB2 TRP 62 11.100 -4.942 -1.951 452 HB3 TRP 62 HB3 TRP 62 12.728 -5.577 -1.834 453 HD1 TRP 62 HD1 TRP 62 12.949 -8.167 -0.941 454 HE1 TRP 62 HE1 TRP 62 11.315 -10.130 -1.225 455 HE3 TRP 62 HE3 TRP 62 8.698 -5.541 -2.023 456 HZ2 TRP 62 HZ2 TRP 62 8.594 -10.518 -1.832 457 HZ3 TRP 62 HZ3 TRP 62 6.623 -6.787 -2.443 458 HH2 TRP 62 HH2 TRP 62 6.571 -9.227 -2.349 459 H ASN 63 H ASN 63 14.411 -5.279 -0.185 460 HA ASN 63 HA ASN 63 14.820 -7.446 1.585 461 HB2 ASN 63 HB2 ASN 63 16.762 -5.345 0.587 462 HB3 ASN 63 HB3 ASN 63 17.230 -6.820 1.429 463 HD21 ASN 63 HD21 ASN 63 17.872 -5.881 -1.268 464 HD22 ASN 63 HD22 ASN 63 17.352 -7.137 -2.333 465 H ALA 64 H ALA 64 15.111 -3.935 2.013 466 HA ALA 64 HA ALA 64 16.202 -3.853 4.580 467 HB1 ALA 64 HB1 ALA 64 15.960 -1.889 3.120 468 HB2 ALA 64 HB2 ALA 64 15.310 -1.594 4.733 469 HB3 ALA 64 HB3 ALA 64 14.217 -1.914 3.385 470 H LEU 65 H LEU 65 12.812 -4.155 3.595 471 HA LEU 65 HA LEU 65 11.877 -4.304 6.348 472 HB2 LEU 65 HB2 LEU 65 10.445 -4.603 3.703 473 HB3 LEU 65 HB3 LEU 65 9.649 -4.666 5.265 474 HG LEU 65 HG LEU 65 11.169 -2.263 4.229 475 HD11 LEU 65 HD11 LEU 65 8.193 -2.771 4.310 476 HD12 LEU 65 HD12 LEU 65 9.196 -2.673 2.861 477 HD13 LEU 65 HD13 LEU 65 8.970 -1.249 3.874 478 HD21 LEU 65 HD21 LEU 65 11.097 -2.396 6.665 479 HD22 LEU 65 HD22 LEU 65 9.347 -2.613 6.616 480 HD23 LEU 65 HD23 LEU 65 10.064 -1.091 6.083 481 H GLY 66 H GLY 66 13.146 -6.485 4.085 482 HA2 GLY 66 HA2 GLY 66 13.352 -8.779 4.075 483 HA3 GLY 66 HA3 GLY 66 12.736 -8.766 5.719 484 H LEU 67 H LEU 67 11.322 -7.919 2.560 485 HA LEU 67 HA LEU 67 8.829 -9.200 3.343 486 HB2 LEU 67 HB2 LEU 67 9.558 -7.627 0.868 487 HB3 LEU 67 HB3 LEU 67 7.944 -8.188 1.269 488 HG LEU 67 HG LEU 67 9.545 -6.215 2.914 489 HD11 LEU 67 HD11 LEU 67 7.227 -5.734 1.038 490 HD12 LEU 67 HD12 LEU 67 8.905 -5.266 0.756 491 HD13 LEU 67 HD13 LEU 67 7.995 -4.527 2.072 492 HD21 LEU 67 HD21 LEU 67 6.694 -7.190 3.152 493 HD22 LEU 67 HD22 LEU 67 7.370 -5.829 4.047 494 HD23 LEU 67 HD23 LEU 67 8.007 -7.453 4.302 495 H GLN 68 H GLN 68 7.729 -10.742 2.092 496 HA GLN 68 HA GLN 68 9.258 -12.177 0.030 497 HB2 GLN 68 HB2 GLN 68 9.180 -13.471 2.123 498 HB3 GLN 68 HB3 GLN 68 7.430 -13.338 2.154 499 HG2 GLN 68 HG2 GLN 68 8.562 -14.527 -0.291 500 HG3 GLN 68 HG3 GLN 68 8.795 -15.450 1.186 501 HE21 GLN 68 HE21 GLN 68 7.444 -17.085 0.411 502 HE22 GLN 68 HE22 GLN 68 5.730 -16.907 0.387 503 H GLU 69 H GLU 69 7.934 -13.122 -1.663 504 HA GLU 69 HA GLU 69 5.947 -11.325 -2.528 505 HB2 GLU 69 HB2 GLU 69 6.656 -14.063 -3.603 506 HB3 GLU 69 HB3 GLU 69 5.595 -12.911 -4.409 507 HG2 GLU 69 HG2 GLU 69 7.522 -12.365 -5.461 508 HG3 GLU 69 HG3 GLU 69 7.677 -11.314 -4.053 509 H GLY 70 H GLY 70 4.172 -11.117 -1.380 510 HA2 GLY 70 HA2 GLY 70 1.853 -12.134 -1.321 511 HA3 GLY 70 HA3 GLY 70 2.638 -13.551 -0.641 512 H ASP 71 H ASP 71 4.467 -11.532 0.846 513 HA ASP 71 HA ASP 71 3.202 -11.565 3.331 514 HB2 ASP 71 HB2 ASP 71 5.492 -9.973 2.225 515 HB3 ASP 71 HB3 ASP 71 4.864 -9.584 3.822 516 H ARG 72 H ARG 72 2.382 -9.860 4.656 517 HA ARG 72 HA ARG 72 0.731 -7.950 3.169 518 HB2 ARG 72 HB2 ARG 72 0.640 -8.891 6.046 519 HB3 ARG 72 HB3 ARG 72 -0.371 -7.593 5.430 520 HG2 ARG 72 HG2 ARG 72 -1.675 -9.582 5.467 521 HG3 ARG 72 HG3 ARG 72 -1.325 -9.206 3.780 522 HD2 ARG 72 HD2 ARG 72 0.417 -10.893 3.736 523 HD3 ARG 72 HD3 ARG 72 0.183 -11.214 5.454 524 HE ARG 72 HE ARG 72 -2.230 -11.776 4.563 525 HH11 ARG 72 HH11 ARG 72 0.791 -12.577 3.112 526 HH12 ARG 72 HH12 ARG 72 0.208 -14.066 2.459 527 HH21 ARG 72 HH21 ARG 72 -2.957 -13.712 3.716 528 HH22 ARG 72 HH22 ARG 72 -1.874 -14.692 2.791 529 H VAL 73 H VAL 73 1.306 -5.886 3.009 530 HA VAL 73 HA VAL 73 3.172 -4.761 5.007 531 HB VAL 73 HB VAL 73 3.910 -3.169 3.253 532 HG11 VAL 73 HG11 VAL 73 5.223 -5.160 3.692 533 HG12 VAL 73 HG12 VAL 73 5.266 -4.772 1.973 534 HG13 VAL 73 HG13 VAL 73 4.243 -6.085 2.554 535 HG21 VAL 73 HG21 VAL 73 1.943 -3.185 1.814 536 HG22 VAL 73 HG22 VAL 73 2.233 -4.877 1.405 537 HG23 VAL 73 HG23 VAL 73 3.376 -3.637 0.889 538 H LYS 74 H LYS 74 2.796 -2.685 5.790 539 HA LYS 74 HA LYS 74 0.181 -1.522 5.089 540 HB2 LYS 74 HB2 LYS 74 0.183 -2.305 7.392 541 HB3 LYS 74 HB3 LYS 74 1.641 -1.382 7.738 542 HG2 LYS 74 HG2 LYS 74 0.527 0.649 7.719 543 HG3 LYS 74 HG3 LYS 74 -0.799 0.028 6.739 544 HD2 LYS 74 HD2 LYS 74 -1.450 0.481 9.084 545 HD3 LYS 74 HD3 LYS 74 -1.688 -1.199 8.617 546 HE2 LYS 74 HE2 LYS 74 0.887 -0.475 9.905 547 HE3 LYS 74 HE3 LYS 74 -0.550 -0.501 10.913 548 HZ1 LYS 74 HZ1 LYS 74 0.500 -2.749 9.304 549 HZ2 LYS 74 HZ2 LYS 74 -0.939 -2.783 10.180 550 HZ3 LYS 74 HZ3 LYS 74 0.538 -2.608 10.988 551 H VAL 75 H VAL 75 0.027 0.610 4.662 552 HA VAL 75 HA VAL 75 2.557 2.070 4.239 553 HB VAL 75 HB VAL 75 0.043 2.198 2.538 554 HG11 VAL 75 HG11 VAL 75 1.412 3.567 1.009 555 HG12 VAL 75 HG12 VAL 75 2.725 3.553 2.187 556 HG13 VAL 75 HG13 VAL 75 1.193 4.336 2.581 557 HG21 VAL 75 HG21 VAL 75 1.406 1.126 0.787 558 HG22 VAL 75 HG22 VAL 75 1.213 0.088 2.200 559 HG23 VAL 75 HG23 VAL 75 2.731 0.948 1.939 560 H LYS 76 H LYS 76 2.625 4.175 4.946 561 HA LYS 76 HA LYS 76 0.195 5.247 6.230 562 HB2 LYS 76 HB2 LYS 76 2.910 4.826 7.475 563 HB3 LYS 76 HB3 LYS 76 1.715 5.916 8.164 564 HG2 LYS 76 HG2 LYS 76 0.393 4.229 8.916 565 HG3 LYS 76 HG3 LYS 76 0.807 3.155 7.578 566 HD2 LYS 76 HD2 LYS 76 2.768 2.441 8.578 567 HD3 LYS 76 HD3 LYS 76 2.859 3.842 9.657 568 HE2 LYS 76 HE2 LYS 76 0.780 2.956 10.785 569 HE3 LYS 76 HE3 LYS 76 0.972 1.492 9.825 570 HZ1 LYS 76 HZ1 LYS 76 1.928 1.216 12.009 571 HZ2 LYS 76 HZ2 LYS 76 2.931 2.560 11.788 572 HZ3 LYS 76 HZ3 LYS 76 3.156 1.175 10.847 573 H THR 77 H THR 77 -0.187 7.253 5.602 574 HA THR 77 HA THR 77 2.087 9.092 5.131 575 HB THR 77 HB THR 77 0.843 10.263 3.421 576 HG1 THR 77 HG1 THR 77 -1.237 9.509 2.783 577 HG21 THR 77 HG21 THR 77 2.128 8.331 2.640 578 HG22 THR 77 HG22 THR 77 0.670 8.544 1.671 579 HG23 THR 77 HG23 THR 77 0.735 7.284 2.902 580 H GLU 78 H GLU 78 0.885 11.478 4.979 581 HA GLU 78 HA GLU 78 -0.066 11.986 7.630 582 HB2 GLU 78 HB2 GLU 78 -0.313 14.323 6.861 583 HB3 GLU 78 HB3 GLU 78 1.269 13.653 6.486 584 HG2 GLU 78 HG2 GLU 78 0.484 13.236 4.162 585 HG3 GLU 78 HG3 GLU 78 -1.026 14.049 4.571 586 H PHE 79 H PHE 79 -1.610 10.998 4.767 587 HA PHE 79 HA PHE 79 -4.205 12.127 5.407 588 HB2 PHE 79 HB2 PHE 79 -3.325 10.167 3.272 589 HB3 PHE 79 HB3 PHE 79 -4.974 10.764 3.443 590 HD1 PHE 79 HD2 PHE 79 -5.528 13.073 2.902 591 HD2 PHE 79 HD1 PHE 79 -1.563 11.592 2.418 592 HE1 PHE 79 HE2 PHE 79 -4.965 15.028 1.524 593 HE2 PHE 79 HE1 PHE 79 -0.999 13.547 1.037 594 HZ PHE 79 HZ PHE 79 -2.702 15.266 0.588 595 H GLY 80 H GLY 80 -2.849 8.816 5.219 596 HA2 GLY 80 HA2 GLY 80 -4.181 7.966 7.591 597 HA3 GLY 80 HA3 GLY 80 -5.057 7.415 6.172 598 H GLU 81 H GLU 81 -4.565 5.243 7.010 599 HA GLU 81 HA GLU 81 -2.077 4.285 5.806 600 HB2 GLU 81 HB2 GLU 81 -1.600 2.777 7.693 601 HB3 GLU 81 HB3 GLU 81 -1.481 4.469 8.147 602 HG2 GLU 81 HG2 GLU 81 -3.904 2.761 8.700 603 HG3 GLU 81 HG3 GLU 81 -2.565 2.959 9.830 604 H VAL 82 H VAL 82 -2.094 2.050 5.219 605 HA VAL 82 HA VAL 82 -4.618 0.598 5.390 606 HB VAL 82 HB VAL 82 -4.849 2.110 3.419 607 HG11 VAL 82 HG11 VAL 82 -3.532 1.685 1.396 608 HG12 VAL 82 HG12 VAL 82 -2.553 0.511 2.277 609 HG13 VAL 82 HG13 VAL 82 -2.513 2.214 2.736 610 HG21 VAL 82 HG21 VAL 82 -5.555 0.370 1.808 611 HG22 VAL 82 HG22 VAL 82 -6.127 0.063 3.449 612 HG23 VAL 82 HG23 VAL 82 -4.755 -0.845 2.806 613 H VAL 83 H VAL 83 -4.394 -1.643 5.059 614 HA VAL 83 HA VAL 83 -1.623 -2.619 4.739 615 HB VAL 83 HB VAL 83 -3.985 -4.076 5.968 616 HG11 VAL 83 HG11 VAL 83 -2.424 -5.644 4.999 617 HG12 VAL 83 HG12 VAL 83 -2.255 -5.679 6.757 618 HG13 VAL 83 HG13 VAL 83 -1.065 -4.826 5.773 619 HG21 VAL 83 HG21 VAL 83 -3.278 -2.216 7.386 620 HG22 VAL 83 HG22 VAL 83 -1.606 -2.777 7.327 621 HG23 VAL 83 HG23 VAL 83 -2.842 -3.759 8.120 622 H VAL 84 H VAL 84 -1.128 -3.523 2.847 623 HA VAL 84 HA VAL 84 -3.192 -4.986 1.312 624 HB VAL 84 HB VAL 84 -2.263 -4.105 -0.797 625 HG11 VAL 84 HG11 VAL 84 -3.155 -1.947 1.124 626 HG12 VAL 84 HG12 VAL 84 -4.197 -2.973 0.137 627 HG13 VAL 84 HG13 VAL 84 -3.132 -1.799 -0.634 628 HG21 VAL 84 HG21 VAL 84 -0.584 -2.308 0.964 629 HG22 VAL 84 HG22 VAL 84 -0.700 -2.220 -0.795 630 HG23 VAL 84 HG23 VAL 84 0.014 -3.639 -0.028 631 H PHE 85 H PHE 85 -1.979 -6.195 -0.627 632 HA PHE 85 HA PHE 85 0.006 -7.911 0.598 633 HB2 PHE 85 HB2 PHE 85 -1.308 -7.955 -2.125 634 HB3 PHE 85 HB3 PHE 85 -0.102 -9.131 -1.615 635 HD1 PHE 85 HD1 PHE 85 -0.598 -10.540 0.444 636 HD2 PHE 85 HD2 PHE 85 -3.578 -8.254 -1.570 637 HE1 PHE 85 HE1 PHE 85 -2.351 -11.920 1.475 638 HE2 PHE 85 HE2 PHE 85 -5.335 -9.633 -0.536 639 HZ PHE 85 HZ PHE 85 -4.722 -11.468 0.987 640 H ALA 86 H ALA 86 2.112 -8.280 -0.117 641 HA ALA 86 HA ALA 86 3.379 -5.926 -1.295 642 HB1 ALA 86 HB1 ALA 86 4.205 -6.787 0.844 643 HB2 ALA 86 HB2 ALA 86 5.453 -6.825 -0.402 644 HB3 ALA 86 HB3 ALA 86 4.627 -8.312 0.066 645 H LYS 87 H LYS 87 4.147 -5.844 -3.305 646 HA LYS 87 HA LYS 87 5.161 -8.292 -4.601 647 HB2 LYS 87 HB2 LYS 87 3.446 -6.158 -5.906 648 HB3 LYS 87 HB3 LYS 87 4.318 -7.386 -6.799 649 HG2 LYS 87 HG2 LYS 87 2.970 -9.113 -5.683 650 HG3 LYS 87 HG3 LYS 87 2.055 -7.834 -4.875 651 HD2 LYS 87 HD2 LYS 87 1.450 -6.905 -7.069 652 HD3 LYS 87 HD3 LYS 87 2.320 -8.224 -7.854 653 HE2 LYS 87 HE2 LYS 87 0.045 -8.666 -5.943 654 HE3 LYS 87 HE3 LYS 87 -0.166 -8.456 -7.672 655 HZ1 LYS 87 HZ1 LYS 87 1.352 -10.617 -6.330 656 HZ2 LYS 87 HZ2 LYS 87 1.339 -10.369 -8.001 657 HZ3 LYS 87 HZ3 LYS 87 -0.093 -10.774 -7.200 658 H LYS 88 H LYS 88 6.983 -7.919 -6.009 659 HA LYS 88 HA LYS 88 8.445 -5.478 -5.527 660 HB2 LYS 88 HB2 LYS 88 9.003 -7.920 -7.201 661 HB3 LYS 88 HB3 LYS 88 10.037 -6.513 -7.285 662 HG2 LYS 88 HG2 LYS 88 10.362 -6.697 -4.824 663 HG3 LYS 88 HG3 LYS 88 9.537 -8.253 -4.917 664 HD2 LYS 88 HD2 LYS 88 11.216 -8.931 -6.669 665 HD3 LYS 88 HD3 LYS 88 12.098 -7.446 -6.293 666 HE2 LYS 88 HE2 LYS 88 12.374 -8.160 -3.997 667 HE3 LYS 88 HE3 LYS 88 11.390 -9.578 -4.325 668 HZ1 LYS 88 HZ1 LYS 88 13.064 -10.422 -5.793 669 HZ2 LYS 88 HZ2 LYS 88 13.801 -10.037 -4.318 670 HZ3 LYS 88 HZ3 LYS 88 13.981 -9.009 -5.647 671 H GLY 89 H GLY 89 9.019 -3.897 -7.077 672 HA2 GLY 89 HA2 GLY 89 7.297 -3.833 -9.484 673 HA3 GLY 89 HA3 GLY 89 7.304 -2.483 -8.365 674 H ASP 90 H ASP 90 7.813 -2.002 -10.952 675 HA ASP 90 HA ASP 90 10.690 -1.922 -11.436 676 HB2 ASP 90 HB2 ASP 90 8.430 -0.805 -13.125 677 HB3 ASP 90 HB3 ASP 90 10.084 -1.129 -13.641 678 H VAL 91 H VAL 91 9.392 -0.344 -9.265 679 HA VAL 91 HA VAL 91 9.554 2.429 -10.145 680 HB VAL 91 HB VAL 91 8.757 2.918 -7.802 681 HG11 VAL 91 HG11 VAL 91 7.189 2.730 -9.687 682 HG12 VAL 91 HG12 VAL 91 6.469 2.134 -8.192 683 HG13 VAL 91 HG13 VAL 91 7.053 0.993 -9.404 684 HG21 VAL 91 HG21 VAL 91 7.896 1.045 -6.463 685 HG22 VAL 91 HG22 VAL 91 9.637 0.913 -6.702 686 HG23 VAL 91 HG23 VAL 91 8.541 -0.096 -7.644 687 HA PRO 92 HA PRO 92 13.641 3.214 -8.538 688 HB2 PRO 92 HB2 PRO 92 12.812 5.920 -7.745 689 HB3 PRO 92 HB3 PRO 92 13.930 5.422 -9.016 690 HG2 PRO 92 HG2 PRO 92 11.506 6.474 -9.569 691 HG3 PRO 92 HG3 PRO 92 12.261 5.245 -10.602 692 HD2 PRO 92 HD2 PRO 92 10.116 4.918 -8.522 693 HD3 PRO 92 HD3 PRO 92 10.231 4.201 -10.145 694 H LYS 93 H LYS 93 14.819 3.294 -6.595 695 HA LYS 93 HA LYS 93 13.571 2.244 -4.354 696 HB2 LYS 93 HB2 LYS 93 16.006 2.092 -4.808 697 HB3 LYS 93 HB3 LYS 93 16.178 3.782 -4.345 698 HG2 LYS 93 HG2 LYS 93 15.357 3.242 -2.094 699 HG3 LYS 93 HG3 LYS 93 15.210 1.550 -2.564 700 HD2 LYS 93 HD2 LYS 93 17.658 1.512 -2.998 701 HD3 LYS 93 HD3 LYS 93 17.753 3.169 -2.389 702 HE2 LYS 93 HE2 LYS 93 16.860 0.720 -0.854 703 HE3 LYS 93 HE3 LYS 93 18.357 1.623 -0.619 704 HZ1 LYS 93 HZ1 LYS 93 15.592 2.541 -0.064 705 HZ2 LYS 93 HZ2 LYS 93 16.941 3.565 -0.030 706 HZ3 LYS 93 HZ3 LYS 93 16.832 2.273 1.055 707 H GLY 94 H GLY 94 12.939 3.015 -2.321 708 HA2 GLY 94 HA2 GLY 94 11.981 4.528 -0.870 709 HA3 GLY 94 HA3 GLY 94 12.923 5.790 -1.646 710 H MET 95 H MET 95 10.755 3.819 -3.533 711 HA MET 95 HA MET 95 8.552 5.697 -3.377 712 HB2 MET 95 HB2 MET 95 10.249 6.662 -4.990 713 HB3 MET 95 HB3 MET 95 9.994 5.251 -6.005 714 HG2 MET 95 HG2 MET 95 7.695 5.859 -6.340 715 HG3 MET 95 HG3 MET 95 7.861 7.214 -5.223 716 HE1 MET 95 HE1 MET 95 6.625 7.994 -7.858 717 HE2 MET 95 HE2 MET 95 7.631 9.327 -8.426 718 HE3 MET 95 HE3 MET 95 7.208 9.205 -6.718 719 H ILE 96 H ILE 96 6.601 4.668 -3.901 720 HA ILE 96 HA ILE 96 6.791 1.950 -5.044 721 HB ILE 96 HB ILE 96 5.202 1.080 -3.382 722 HG12 ILE 96 HG12 ILE 96 5.594 3.724 -1.941 723 HG13 ILE 96 HG13 ILE 96 4.127 3.249 -2.791 724 HG21 ILE 96 HG21 ILE 96 6.753 0.955 -1.477 725 HG22 ILE 96 HG22 ILE 96 7.695 2.277 -2.166 726 HG23 ILE 96 HG23 ILE 96 7.580 0.738 -3.019 727 HD11 ILE 96 HD11 ILE 96 3.797 1.417 -1.228 728 HD12 ILE 96 HD12 ILE 96 3.925 2.958 -0.379 729 HD13 ILE 96 HD13 ILE 96 5.293 1.844 -0.394 730 H PHE 97 H PHE 97 4.994 1.202 -6.165 731 HA PHE 97 HA PHE 97 3.025 3.283 -6.880 732 HB2 PHE 97 HB2 PHE 97 4.368 2.473 -8.756 733 HB3 PHE 97 HB3 PHE 97 3.906 0.812 -8.402 734 HD1 PHE 97 HD1 PHE 97 1.685 -0.017 -8.962 735 HD2 PHE 97 HD2 PHE 97 2.808 4.006 -9.826 736 HE1 PHE 97 HE1 PHE 97 -0.263 0.206 -10.446 737 HE2 PHE 97 HE2 PHE 97 0.858 4.227 -11.309 738 HZ PHE 97 HZ PHE 97 -0.676 2.329 -11.620 739 H ILE 98 H ILE 98 0.926 3.022 -6.359 740 HA ILE 98 HA ILE 98 -0.061 0.296 -5.782 741 HB ILE 98 HB ILE 98 -0.919 2.845 -4.378 742 HG12 ILE 98 HG12 ILE 98 0.671 0.459 -3.396 743 HG13 ILE 98 HG13 ILE 98 1.277 2.095 -3.616 744 HG21 ILE 98 HG21 ILE 98 -1.824 -0.008 -3.941 745 HG22 ILE 98 HG22 ILE 98 -2.785 1.286 -4.662 746 HG23 ILE 98 HG23 ILE 98 -2.301 1.386 -2.969 747 HD11 ILE 98 HD11 ILE 98 -0.224 2.869 -1.836 748 HD12 ILE 98 HD12 ILE 98 0.899 1.628 -1.279 749 HD13 ILE 98 HD13 ILE 98 -0.783 1.212 -1.605 750 HA PRO 99 HA PRO 99 -2.977 1.146 -9.111 751 HB2 PRO 99 HB2 PRO 99 -4.567 -0.903 -7.631 752 HB3 PRO 99 HB3 PRO 99 -4.143 -0.832 -9.344 753 HG2 PRO 99 HG2 PRO 99 -2.890 -2.528 -7.732 754 HG3 PRO 99 HG3 PRO 99 -1.987 -1.642 -8.978 755 HD2 PRO 99 HD2 PRO 99 -2.142 -1.137 -6.026 756 HD3 PRO 99 HD3 PRO 99 -0.742 -1.033 -7.116 757 H MET 100 H MET 100 -4.597 2.599 -9.278 758 HA MET 100 HA MET 100 -5.517 4.131 -7.163 759 HB2 MET 100 HB2 MET 100 -5.567 4.894 -9.474 760 HB3 MET 100 HB3 MET 100 -6.783 3.693 -9.874 761 HG2 MET 100 HG2 MET 100 -7.918 5.743 -9.697 762 HG3 MET 100 HG3 MET 100 -8.305 4.853 -8.232 763 HE1 MET 100 HE1 MET 100 -8.124 5.849 -5.915 764 HE2 MET 100 HE2 MET 100 -6.811 6.909 -5.408 765 HE3 MET 100 HE3 MET 100 -6.456 5.281 -5.978 766 H GLY 101 H GLY 101 -6.656 3.435 -5.466 767 HA2 GLY 101 HA2 GLY 101 -9.322 2.365 -5.873 768 HA3 GLY 101 HA3 GLY 101 -8.210 1.199 -5.168 769 HA PRO 102 HA PRO 102 -10.185 3.856 -1.808 770 HB2 PRO 102 HB2 PRO 102 -10.966 1.755 -0.218 771 HB3 PRO 102 HB3 PRO 102 -11.997 2.500 -1.443 772 HG2 PRO 102 HG2 PRO 102 -10.400 -0.024 -1.588 773 HG3 PRO 102 HG3 PRO 102 -12.015 0.321 -2.231 774 HD2 PRO 102 HD2 PRO 102 -9.780 0.281 -3.784 775 HD3 PRO 102 HD3 PRO 102 -11.178 1.325 -4.135 776 H TYR 103 H TYR 103 -8.047 1.108 -1.861 777 HA TYR 103 HA TYR 103 -6.861 1.402 0.695 778 HB2 TYR 103 HB2 TYR 103 -5.694 0.200 -1.833 779 HB3 TYR 103 HB3 TYR 103 -5.095 -0.056 -0.197 780 HD1 TYR 103 HD2 TYR 103 -8.285 -0.391 -2.125 781 HD2 TYR 103 HD1 TYR 103 -5.744 -2.018 0.877 782 HE1 TYR 103 HE2 TYR 103 -9.793 -2.311 -1.901 783 HE2 TYR 103 HE1 TYR 103 -7.248 -3.946 1.107 784 HH TYR 103 HH TYR 103 -9.104 -4.925 0.397 785 H ALA 104 H ALA 104 -5.672 2.314 -2.550 786 HA ALA 104 HA ALA 104 -3.531 3.898 -1.684 787 HB1 ALA 104 HB1 ALA 104 -3.558 4.867 -3.928 788 HB2 ALA 104 HB2 ALA 104 -5.168 4.200 -4.208 789 HB3 ALA 104 HB3 ALA 104 -3.789 3.120 -3.998 790 H ASN 105 H ASN 105 -6.916 4.716 -2.327 791 HA ASN 105 HA ASN 105 -6.874 7.464 -2.030 792 HB2 ASN 105 HB2 ASN 105 -8.860 6.355 -2.770 793 HB3 ASN 105 HB3 ASN 105 -8.976 5.424 -1.280 794 HD21 ASN 105 HD21 ASN 105 -9.766 6.397 0.558 795 HD22 ASN 105 HD22 ASN 105 -10.600 7.908 0.518 796 H MET 106 H MET 106 -6.564 5.009 0.441 797 HA MET 106 HA MET 106 -7.130 6.572 2.727 798 HB2 MET 106 HB2 MET 106 -5.285 4.193 2.383 799 HB3 MET 106 HB3 MET 106 -5.756 4.869 3.938 800 HG2 MET 106 HG2 MET 106 -7.764 3.861 1.950 801 HG3 MET 106 HG3 MET 106 -7.002 2.816 3.146 802 HE1 MET 106 HE1 MET 106 -6.765 4.167 5.754 803 HE2 MET 106 HE2 MET 106 -7.687 2.668 5.618 804 HE3 MET 106 HE3 MET 106 -8.354 4.039 6.506 805 H VAL 107 H VAL 107 -4.273 6.334 0.708 806 HA VAL 107 HA VAL 107 -2.701 7.803 2.738 807 HB VAL 107 HB VAL 107 -0.685 6.708 1.801 808 HG11 VAL 107 HG11 VAL 107 -1.783 5.771 3.778 809 HG12 VAL 107 HG12 VAL 107 -1.074 4.497 2.786 810 HG13 VAL 107 HG13 VAL 107 -2.815 4.779 2.745 811 HG21 VAL 107 HG21 VAL 107 -0.950 4.745 0.328 812 HG22 VAL 107 HG22 VAL 107 -1.476 6.238 -0.452 813 HG23 VAL 107 HG23 VAL 107 -2.673 5.104 0.180 814 H ILE 108 H ILE 108 -3.817 7.849 -0.528 815 HA ILE 108 HA ILE 108 -1.756 9.727 -1.377 816 HB ILE 108 HB ILE 108 -2.574 9.562 -3.570 817 HG12 ILE 108 HG12 ILE 108 -4.982 7.997 -2.646 818 HG13 ILE 108 HG13 ILE 108 -5.022 9.744 -2.864 819 HG21 ILE 108 HG21 ILE 108 -2.700 7.090 -3.973 820 HG22 ILE 108 HG22 ILE 108 -2.757 6.866 -2.225 821 HG23 ILE 108 HG23 ILE 108 -1.338 7.602 -2.970 822 HD11 ILE 108 HD11 ILE 108 -4.513 7.637 -4.919 823 HD12 ILE 108 HD12 ILE 108 -4.180 9.347 -5.189 824 HD13 ILE 108 HD13 ILE 108 -5.832 8.808 -4.852 825 H ASP 109 H ASP 109 -2.899 11.505 -2.974 826 HA ASP 109 HA ASP 109 -4.635 13.084 -1.194 827 HB2 ASP 109 HB2 ASP 109 -2.525 14.168 -1.513 828 HB3 ASP 109 HB3 ASP 109 -2.589 13.922 -3.257 829 HA PRO 110 HA PRO 110 -7.583 12.598 -4.593 830 HB2 PRO 110 HB2 PRO 110 -9.803 13.089 -3.194 831 HB3 PRO 110 HB3 PRO 110 -8.874 11.607 -2.929 832 HG2 PRO 110 HG2 PRO 110 -8.920 14.129 -1.308 833 HG3 PRO 110 HG3 PRO 110 -8.913 12.444 -0.754 834 HD2 PRO 110 HD2 PRO 110 -6.670 14.077 -0.908 835 HD3 PRO 110 HD3 PRO 110 -6.630 12.304 -0.876 836 H SER 111 H SER 111 -6.238 15.339 -3.627 837 HA SER 111 HA SER 111 -8.338 17.235 -4.321 838 HB2 SER 111 HB2 SER 111 -6.691 17.824 -2.577 839 HB3 SER 111 HB3 SER 111 -5.397 17.733 -3.771 840 HG SER 111 HG SER 111 -7.622 19.508 -3.868 841 H THR 112 H THR 112 -5.536 15.772 -5.834 842 HA THR 112 HA THR 112 -5.706 17.480 -8.182 843 HB THR 112 HB THR 112 -3.484 16.780 -7.586 844 HG1 THR 112 HG1 THR 112 -2.912 16.324 -9.612 845 HG21 THR 112 HG21 THR 112 -2.787 14.418 -7.612 846 HG22 THR 112 HG22 THR 112 -4.458 13.929 -7.900 847 HG23 THR 112 HG23 THR 112 -4.017 14.708 -6.380 848 H ASP 113 H ASP 113 -6.416 16.902 -10.207 849 HA ASP 113 HA ASP 113 -8.270 14.683 -10.426 850 HB2 ASP 113 HB2 ASP 113 -7.319 16.636 -12.545 851 HB3 ASP 113 HB3 ASP 113 -8.719 15.574 -12.660 852 H GLY 114 H GLY 114 -5.113 14.577 -10.319 853 HA2 GLY 114 HA2 GLY 114 -3.812 12.700 -11.111 854 HA3 GLY 114 HA3 GLY 114 -4.743 12.737 -12.603 855 H THR 115 H THR 115 -4.156 15.850 -11.688 856 HA THR 115 HA THR 115 -2.881 17.552 -12.435 857 HB THR 115 HB THR 115 -0.662 15.499 -12.621 858 HG1 THR 115 HG1 THR 115 -0.175 16.231 -10.492 859 HG21 THR 115 HG21 THR 115 -0.103 17.544 -13.811 860 HG22 THR 115 HG22 THR 115 0.815 17.461 -12.307 861 HG23 THR 115 HG23 THR 115 -0.594 18.516 -12.424 862 H GLY 116 H GLY 116 -1.484 14.899 -14.386 863 HA2 GLY 116 HA2 GLY 116 -2.785 15.940 -16.791 864 HA3 GLY 116 HA3 GLY 116 -1.025 15.975 -16.777 865 H MET 117 H MET 117 0.070 14.138 -17.305 866 HA MET 117 HA MET 117 -1.473 11.625 -17.444 867 HB2 MET 117 HB2 MET 117 1.062 12.383 -18.917 868 HB3 MET 117 HB3 MET 117 0.233 10.837 -19.046 869 HG2 MET 117 HG2 MET 117 -1.798 12.177 -19.825 870 HG3 MET 117 HG3 MET 117 -0.681 13.530 -20.006 871 HE1 MET 117 HE1 MET 117 -1.667 9.939 -21.199 872 HE2 MET 117 HE2 MET 117 -0.029 9.688 -20.597 873 HE3 MET 117 HE3 MET 117 -0.366 9.555 -22.323 874 HA PRO 118 HA PRO 118 0.755 10.069 -14.020 875 HB2 PRO 118 HB2 PRO 118 0.853 7.386 -14.569 876 HB3 PRO 118 HB3 PRO 118 -0.602 8.229 -14.024 877 HG2 PRO 118 HG2 PRO 118 0.212 7.464 -16.810 878 HG3 PRO 118 HG3 PRO 118 -1.376 7.323 -16.029 879 HD2 PRO 118 HD2 PRO 118 -0.802 9.329 -17.737 880 HD3 PRO 118 HD3 PRO 118 -1.865 9.572 -16.335 881 H GLN 119 H GLN 119 2.806 11.070 -14.362 882 HA GLN 119 HA GLN 119 4.919 9.329 -15.441 883 HB2 GLN 119 HB2 GLN 119 5.080 12.158 -14.352 884 HB3 GLN 119 HB3 GLN 119 6.418 11.259 -15.054 885 HG2 GLN 119 HG2 GLN 119 5.194 11.185 -17.205 886 HG3 GLN 119 HG3 GLN 119 3.926 12.178 -16.487 887 HE21 GLN 119 HE21 GLN 119 5.839 13.776 -14.939 888 HE22 GLN 119 HE22 GLN 119 6.624 14.817 -16.073 889 H PHE 120 H PHE 120 7.046 9.911 -13.797 890 HA PHE 120 HA PHE 120 6.459 8.419 -11.436 891 HB2 PHE 120 HB2 PHE 120 8.937 9.850 -12.384 892 HB3 PHE 120 HB3 PHE 120 8.864 9.055 -10.812 893 HD1 PHE 120 HD1 PHE 120 8.556 6.611 -10.666 894 HD2 PHE 120 HD2 PHE 120 9.104 8.575 -14.407 895 HE1 PHE 120 HE1 PHE 120 9.092 4.455 -11.718 896 HE2 PHE 120 HE2 PHE 120 9.643 6.419 -15.460 897 HZ PHE 120 HZ PHE 120 9.637 4.356 -14.116 898 H LYS 121 H LYS 121 4.796 9.656 -10.540 899 HA LYS 121 HA LYS 121 5.747 11.803 -8.760 900 HB2 LYS 121 HB2 LYS 121 3.447 11.822 -10.628 901 HB3 LYS 121 HB3 LYS 121 3.149 12.479 -9.023 902 HG2 LYS 121 HG2 LYS 121 5.029 14.027 -9.312 903 HG3 LYS 121 HG3 LYS 121 5.298 13.382 -10.936 904 HD2 LYS 121 HD2 LYS 121 3.239 14.210 -11.716 905 HD3 LYS 121 HD3 LYS 121 2.652 14.504 -10.080 906 HE2 LYS 121 HE2 LYS 121 4.958 15.980 -11.355 907 HE3 LYS 121 HE3 LYS 121 3.299 16.576 -11.304 908 HZ1 LYS 121 HZ1 LYS 121 4.513 17.539 -9.514 909 HZ2 LYS 121 HZ2 LYS 121 5.066 16.037 -8.979 910 HZ3 LYS 121 HZ3 LYS 121 3.423 16.430 -8.853 911 H GLY 122 H GLY 122 3.577 12.122 -7.150 912 HA2 GLY 122 HA2 GLY 122 1.821 10.324 -6.379 913 HA3 GLY 122 HA3 GLY 122 3.285 9.471 -5.920 914 H VAL 123 H VAL 123 1.609 9.822 -3.961 915 HA VAL 123 HA VAL 123 2.275 12.276 -2.489 916 HB VAL 123 HB VAL 123 0.466 9.980 -1.723 917 HG11 VAL 123 HG11 VAL 123 -0.412 11.505 -0.001 918 HG12 VAL 123 HG12 VAL 123 0.824 12.690 -0.431 919 HG13 VAL 123 HG13 VAL 123 1.294 11.131 0.252 920 HG21 VAL 123 HG21 VAL 123 -1.367 11.533 -2.287 921 HG22 VAL 123 HG22 VAL 123 -0.362 11.154 -3.682 922 HG23 VAL 123 HG23 VAL 123 -0.181 12.706 -2.861 923 H LYS 124 H LYS 124 3.951 12.367 -1.138 924 HA LYS 124 HA LYS 124 5.651 10.253 -0.501 925 HB2 LYS 124 HB2 LYS 124 5.893 12.886 -0.459 926 HB3 LYS 124 HB3 LYS 124 5.461 12.696 1.231 927 HG2 LYS 124 HG2 LYS 124 7.717 11.166 -0.020 928 HG3 LYS 124 HG3 LYS 124 7.921 12.793 0.617 929 HD2 LYS 124 HD2 LYS 124 6.917 10.425 2.214 930 HD3 LYS 124 HD3 LYS 124 8.576 11.023 2.237 931 HE2 LYS 124 HE2 LYS 124 7.779 13.187 3.086 932 HE3 LYS 124 HE3 LYS 124 6.122 12.583 3.074 933 HZ1 LYS 124 HZ1 LYS 124 8.352 11.486 4.703 934 HZ2 LYS 124 HZ2 LYS 124 6.764 10.911 4.700 935 HZ3 LYS 124 HZ3 LYS 124 7.100 12.462 5.276 936 H GLY 125 H GLY 125 5.892 8.949 1.286 937 HA2 GLY 125 HA2 GLY 125 4.506 9.318 3.754 938 HA3 GLY 125 HA3 GLY 125 3.730 8.082 2.776 939 H THR 126 H THR 126 4.209 6.377 4.148 940 HA THR 126 HA THR 126 7.016 5.493 4.205 941 HB THR 126 HB THR 126 6.746 4.703 6.559 942 HG1 THR 126 HG1 THR 126 4.391 6.319 6.508 943 HG21 THR 126 HG21 THR 126 7.042 6.880 7.635 944 HG22 THR 126 HG22 THR 126 6.385 7.683 6.210 945 HG23 THR 126 HG23 THR 126 7.914 6.810 6.105 946 H VAL 127 H VAL 127 7.277 3.185 4.630 947 HA VAL 127 HA VAL 127 4.862 1.533 4.372 948 HB VAL 127 HB VAL 127 5.760 1.854 2.082 949 HG11 VAL 127 HG11 VAL 127 7.898 0.834 1.445 950 HG12 VAL 127 HG12 VAL 127 8.224 0.454 3.138 951 HG13 VAL 127 HG13 VAL 127 8.122 2.136 2.612 952 HG21 VAL 127 HG21 VAL 127 4.543 -0.190 2.649 953 HG22 VAL 127 HG22 VAL 127 6.049 -0.965 3.144 954 HG23 VAL 127 HG23 VAL 127 5.800 -0.517 1.456 955 H GLU 128 H GLU 128 5.017 -0.523 5.273 956 HA GLU 128 HA GLU 128 7.526 -1.517 6.347 957 HB2 GLU 128 HB2 GLU 128 6.636 -1.649 8.680 958 HB3 GLU 128 HB3 GLU 128 6.895 0.001 8.129 959 HG2 GLU 128 HG2 GLU 128 4.551 0.323 7.756 960 HG3 GLU 128 HG3 GLU 128 4.215 -1.378 8.069 961 H LYS 129 H LYS 129 7.403 -3.760 6.991 962 HA LYS 129 HA LYS 129 5.174 -5.290 6.040 963 HB2 LYS 129 HB2 LYS 129 7.302 -6.412 6.107 964 HB3 LYS 129 HB3 LYS 129 7.515 -6.044 7.815 965 HG2 LYS 129 HG2 LYS 129 5.668 -7.520 8.394 966 HG3 LYS 129 HG3 LYS 129 5.370 -7.850 6.690 967 HD2 LYS 129 HD2 LYS 129 7.975 -8.489 8.070 968 HD3 LYS 129 HD3 LYS 129 6.636 -9.629 7.957 969 HE2 LYS 129 HE2 LYS 129 6.730 -9.362 5.467 970 HE3 LYS 129 HE3 LYS 129 8.202 -8.416 5.686 971 HZ1 LYS 129 HZ1 LYS 129 8.591 -10.783 5.162 972 HZ2 LYS 129 HZ2 LYS 129 7.863 -11.210 6.624 973 HZ3 LYS 129 HZ3 LYS 129 9.290 -10.304 6.628 974 H THR 130 H THR 130 3.520 -6.315 7.271 975 HA THR 130 HA THR 130 3.262 -5.309 10.031 976 HB THR 130 HB THR 130 1.908 -3.816 8.735 977 HG1 THR 130 HG1 THR 130 1.058 -4.809 10.771 978 HG21 THR 130 HG21 THR 130 0.477 -6.250 7.666 979 HG22 THR 130 HG22 THR 130 1.548 -5.194 6.743 980 HG23 THR 130 HG23 THR 130 0.024 -4.569 7.378 981 H ASP 131 H ASP 131 2.216 -6.504 11.469 982 HA ASP 131 HA ASP 131 1.912 -9.321 11.043 983 HB2 ASP 131 HB2 ASP 131 1.192 -9.224 13.470 984 HB3 ASP 131 HB3 ASP 131 2.784 -8.543 13.138 985 H GLU 132 H GLU 132 -0.118 -6.707 10.485 986 HA GLU 132 HA GLU 132 -2.594 -7.859 11.417 987 HB2 GLU 132 HB2 GLU 132 -2.181 -5.421 9.677 988 HB3 GLU 132 HB3 GLU 132 -3.629 -5.837 10.584 989 HG2 GLU 132 HG2 GLU 132 -2.301 -5.633 12.677 990 HG3 GLU 132 HG3 GLU 132 -0.946 -5.061 11.705 991 H LYS 133 H LYS 133 -4.506 -7.546 9.735 992 HA LYS 133 HA LYS 133 -3.882 -9.294 7.459 993 HB2 LYS 133 HB2 LYS 133 -6.270 -9.723 7.338 994 HB3 LYS 133 HB3 LYS 133 -5.746 -9.918 9.007 995 HG2 LYS 133 HG2 LYS 133 -6.685 -7.801 9.627 996 HG3 LYS 133 HG3 LYS 133 -7.004 -7.389 7.943 997 HD2 LYS 133 HD2 LYS 133 -8.608 -9.296 7.840 998 HD3 LYS 133 HD3 LYS 133 -8.352 -9.556 9.567 999 HE2 LYS 133 HE2 LYS 133 -9.226 -7.360 10.073 1000 HE3 LYS 133 HE3 LYS 133 -9.343 -6.968 8.360 1001 HZ1 LYS 133 HZ1 LYS 133 -10.921 -9.027 9.809 1002 HZ2 LYS 133 HZ2 LYS 133 -10.995 -8.754 8.141 1003 HZ3 LYS 133 HZ3 LYS 133 -11.491 -7.548 9.217 1004 H VAL 134 H VAL 134 -4.614 -8.804 5.324 1005 HA VAL 134 HA VAL 134 -4.590 -6.084 4.515 1006 HB VAL 134 HB VAL 134 -5.554 -8.538 3.015 1007 HG11 VAL 134 HG11 VAL 134 -4.962 -5.765 1.962 1008 HG12 VAL 134 HG12 VAL 134 -6.545 -6.537 2.039 1009 HG13 VAL 134 HG13 VAL 134 -5.301 -7.186 0.971 1010 HG21 VAL 134 HG21 VAL 134 -3.375 -8.425 1.892 1011 HG22 VAL 134 HG22 VAL 134 -3.192 -8.636 3.634 1012 HG23 VAL 134 HG23 VAL 134 -2.925 -7.052 2.904 1013 H LEU 135 H LEU 135 -6.213 -4.636 4.193 1014 HA LEU 135 HA LEU 135 -8.717 -5.109 5.477 1015 HB2 LEU 135 HB2 LEU 135 -7.557 -2.819 3.928 1016 HB3 LEU 135 HB3 LEU 135 -9.261 -2.810 4.341 1017 HG LEU 135 HG LEU 135 -6.962 -2.915 6.307 1018 HD11 LEU 135 HD11 LEU 135 -8.944 -0.720 5.686 1019 HD12 LEU 135 HD12 LEU 135 -7.235 -0.727 5.244 1020 HD13 LEU 135 HD13 LEU 135 -7.707 -0.678 6.943 1021 HD21 LEU 135 HD21 LEU 135 -9.955 -2.898 6.735 1022 HD22 LEU 135 HD22 LEU 135 -8.757 -2.613 8.006 1023 HD23 LEU 135 HD23 LEU 135 -8.815 -4.172 7.184 1024 H SER 136 H SER 136 -10.478 -6.094 4.637 1025 HA SER 136 HA SER 136 -10.983 -6.467 1.868 1026 HB2 SER 136 HB2 SER 136 -12.909 -6.393 4.216 1027 HB3 SER 136 HB3 SER 136 -13.363 -6.872 2.582 1028 HG SER 136 HG SER 136 -11.343 -8.137 4.140 1029 H VAL 137 H VAL 137 -12.443 -5.307 0.471 1030 HA VAL 137 HA VAL 137 -12.020 -2.591 0.369 1031 HB VAL 137 HB VAL 137 -14.407 -4.066 -0.769 1032 HG11 VAL 137 HG11 VAL 137 -14.542 -2.224 -2.392 1033 HG12 VAL 137 HG12 VAL 137 -13.243 -1.381 -1.548 1034 HG13 VAL 137 HG13 VAL 137 -14.792 -1.648 -0.744 1035 HG21 VAL 137 HG21 VAL 137 -12.307 -5.027 -1.524 1036 HG22 VAL 137 HG22 VAL 137 -11.705 -3.431 -1.969 1037 HG23 VAL 137 HG23 VAL 137 -13.063 -4.136 -2.845 1038 H LYS 138 H LYS 138 -14.950 -4.185 1.676 1039 HA LYS 138 HA LYS 138 -16.139 -1.720 2.511 1040 HB2 LYS 138 HB2 LYS 138 -17.424 -3.838 2.071 1041 HB3 LYS 138 HB3 LYS 138 -16.767 -4.486 3.571 1042 HG2 LYS 138 HG2 LYS 138 -17.767 -2.397 4.689 1043 HG3 LYS 138 HG3 LYS 138 -18.685 -2.200 3.197 1044 HD2 LYS 138 HD2 LYS 138 -20.059 -3.381 4.760 1045 HD3 LYS 138 HD3 LYS 138 -19.550 -4.531 3.519 1046 HE2 LYS 138 HE2 LYS 138 -17.870 -5.448 4.983 1047 HE3 LYS 138 HE3 LYS 138 -18.180 -4.202 6.190 1048 HZ1 LYS 138 HZ1 LYS 138 -19.211 -6.337 6.739 1049 HZ2 LYS 138 HZ2 LYS 138 -20.145 -6.254 5.331 1050 HZ3 LYS 138 HZ3 LYS 138 -20.361 -5.106 6.556 1051 H GLU 139 H GLU 139 -14.112 -4.139 4.142 1052 HA GLU 139 HA GLU 139 -14.385 -3.320 6.799 1053 HB2 GLU 139 HB2 GLU 139 -13.156 -5.359 5.979 1054 HB3 GLU 139 HB3 GLU 139 -11.852 -4.309 5.446 1055 HG2 GLU 139 HG2 GLU 139 -11.103 -5.130 7.479 1056 HG3 GLU 139 HG3 GLU 139 -11.730 -3.534 7.887 1057 H LEU 140 H LEU 140 -12.260 -2.217 4.239 1058 HA LEU 140 HA LEU 140 -10.838 -0.192 5.497 1059 HB2 LEU 140 HB2 LEU 140 -10.725 -1.287 3.144 1060 HB3 LEU 140 HB3 LEU 140 -11.842 -0.024 2.671 1061 HG LEU 140 HG LEU 140 -9.241 0.628 4.010 1062 HD11 LEU 140 HD11 LEU 140 -8.232 0.878 1.807 1063 HD12 LEU 140 HD12 LEU 140 -9.697 0.240 1.056 1064 HD13 LEU 140 HD13 LEU 140 -8.720 -0.789 2.105 1065 HD21 LEU 140 HD21 LEU 140 -11.044 2.151 2.130 1066 HD22 LEU 140 HD22 LEU 140 -9.509 2.735 2.771 1067 HD23 LEU 140 HD23 LEU 140 -10.859 2.428 3.862 1068 H LEU 141 H LEU 141 -14.006 -0.045 3.837 1069 HA LEU 141 HA LEU 141 -14.498 2.707 4.128 1070 HB2 LEU 141 HB2 LEU 141 -16.603 0.539 4.211 1071 HB3 LEU 141 HB3 LEU 141 -16.816 2.205 3.705 1072 HG LEU 141 HG LEU 141 -15.251 0.075 2.236 1073 HD11 LEU 141 HD11 LEU 141 -17.662 -0.220 2.078 1074 HD12 LEU 141 HD12 LEU 141 -16.986 0.291 0.532 1075 HD13 LEU 141 HD13 LEU 141 -17.846 1.451 1.546 1076 HD21 LEU 141 HD21 LEU 141 -14.188 2.238 1.946 1077 HD22 LEU 141 HD22 LEU 141 -15.731 2.962 1.496 1078 HD23 LEU 141 HD23 LEU 141 -14.992 1.741 0.460 1079 H GLU 142 H GLU 142 -15.279 -0.015 6.233 1080 HA GLU 142 HA GLU 142 -16.606 1.455 8.267 1081 HB2 GLU 142 HB2 GLU 142 -15.156 -1.202 8.420 1082 HB3 GLU 142 HB3 GLU 142 -16.299 -0.591 9.610 1083 HG2 GLU 142 HG2 GLU 142 -17.072 -1.016 6.734 1084 HG3 GLU 142 HG3 GLU 142 -17.142 -2.315 7.920 1085 H ALA 143 H ALA 143 -13.238 0.557 7.730 1086 HA ALA 143 HA ALA 143 -12.205 1.248 10.258 1087 HB1 ALA 143 HB1 ALA 143 -10.757 1.313 7.609 1088 HB2 ALA 143 HB2 ALA 143 -11.010 -0.128 8.594 1089 HB3 ALA 143 HB3 ALA 143 -10.026 1.199 9.211 1090 H ILE 144 H ILE 144 -12.912 3.232 7.432 1091 HA ILE 144 HA ILE 144 -11.769 5.583 8.771 1092 HB ILE 144 HB ILE 144 -12.165 6.788 6.669 1093 HG12 ILE 144 HG12 ILE 144 -12.594 5.077 4.657 1094 HG13 ILE 144 HG13 ILE 144 -13.498 4.223 5.899 1095 HG21 ILE 144 HG21 ILE 144 -10.656 4.195 6.354 1096 HG22 ILE 144 HG22 ILE 144 -10.036 5.686 7.066 1097 HG23 ILE 144 HG23 ILE 144 -10.451 5.634 5.353 1098 HD11 ILE 144 HD11 ILE 144 -14.945 5.644 4.588 1099 HD12 ILE 144 HD12 ILE 144 -13.961 7.053 4.986 1100 HD13 ILE 144 HD13 ILE 144 -14.868 6.224 6.252 1101 H GLY 145 H GLY 145 -14.593 4.012 8.902 1102 HA2 GLY 145 HA2 GLY 145 -16.424 4.725 10.187 1103 HA3 GLY 145 HA3 GLY 145 -15.955 6.391 9.907 1104 H SER 146 H SER 146 -16.025 6.824 7.323 1105 HA SER 146 HA SER 146 -17.403 7.333 5.582 1106 HB2 SER 146 HB2 SER 146 -18.593 4.607 6.171 1107 HB3 SER 146 HB3 SER 146 -18.945 5.565 4.734 1108 HG SER 146 HG SER 146 -16.536 4.307 5.492
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