NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
569205 | 2lxe | 18672 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 H MET 1 31.840 1.346 62.596 2 HA MET 1 HA MET 1 32.176 2.363 60.141 3 HB2 MET 1 HB2 MET 1 34.044 0.722 59.785 4 HB3 MET 1 HB1 MET 1 34.077 1.560 61.345 5 HG2 MET 1 HG1 MET 1 33.171 -0.380 62.470 6 HG3 MET 1 HG2 MET 1 32.990 -1.213 60.924 7 HE1 MET 1 HE1 MET 1 35.386 -1.191 63.997 8 HE2 MET 1 HE2 MET 1 36.810 -0.436 63.282 9 HE3 MET 1 HE3 MET 1 35.291 0.456 63.373 10 H GLY 2 H GLY 2 29.654 0.812 60.282 11 HA2 GLY 2 HA2 GLY 2 29.800 -0.300 57.613 12 HA3 GLY 2 3HA GLY 2 29.453 -1.478 58.869 13 H SER 3 H SER 3 28.333 1.611 57.531 14 HA SER 3 HA SER 3 25.613 0.915 58.421 15 HB2 SER 3 HB2 SER 3 27.011 3.551 58.032 16 HB3 SER 3 HB1 SER 3 25.244 3.456 57.934 17 HG SER 3 HG SER 3 25.154 2.771 60.027 18 H SER 4 H SER 4 23.941 0.900 56.975 19 HA SER 4 HA SER 4 24.710 0.882 54.154 20 HB2 SER 4 HB2 SER 4 22.065 0.019 55.352 21 HB3 SER 4 HB1 SER 4 22.712 -0.381 53.751 22 HG SER 4 HG SER 4 24.055 -1.816 54.618 23 H HIS 5 H HIS 5 24.182 2.468 52.806 24 HA HIS 5 HA HIS 5 22.041 4.330 53.602 25 HB2 HIS 5 HB2 HIS 5 24.521 5.131 53.686 26 HB3 HIS 5 HB1 HIS 5 24.377 5.197 51.926 27 HD1 HIS 5 HD1 HIS 5 23.036 6.829 55.031 28 HD2 HIS 5 HD2 HIS 5 22.891 7.306 50.906 29 HE1 HIS 5 HE1 HIS 5 21.982 9.080 54.651 30 HE2 HIS 5 HE2 HIS 5 21.894 9.373 52.130 31 H HIS 6 H HIS 6 20.554 3.110 52.346 32 HA HIS 6 HA HIS 6 20.694 3.761 49.498 33 HB2 HIS 6 HB2 HIS 6 19.869 1.476 48.915 34 HB3 HIS 6 HB1 HIS 6 21.519 1.504 49.542 35 HD1 HIS 6 HD1 HIS 6 18.066 0.375 50.440 36 HD2 HIS 6 HD2 HIS 6 21.919 0.217 51.987 37 HE1 HIS 6 HE1 HIS 6 17.963 -1.277 52.334 38 HE2 HIS 6 HE2 HIS 6 20.317 -1.375 53.280 39 H HIS 7 H HIS 7 18.586 3.516 48.409 40 HA HIS 7 HA HIS 7 16.282 3.547 50.216 41 HB2 HIS 7 HB2 HIS 7 15.374 5.555 49.074 42 HB3 HIS 7 HB1 HIS 7 16.855 5.885 49.978 43 HD1 HIS 7 HD1 HIS 7 15.376 6.416 46.742 44 HD2 HIS 7 HD2 HIS 7 19.237 5.912 48.192 45 HE1 HIS 7 HE1 HIS 7 16.892 7.301 44.941 46 HE2 HIS 7 HE2 HIS 7 19.251 6.994 45.827 47 H HIS 8 H HIS 8 14.237 3.231 49.134 48 HA HIS 8 HA HIS 8 14.383 2.279 46.374 49 HB2 HIS 8 HB2 HIS 8 13.697 0.634 48.779 50 HB3 HIS 8 HB1 HIS 8 12.853 0.315 47.260 51 HD1 HIS 8 HD1 HIS 8 15.638 -0.873 49.041 52 HD2 HIS 8 HD2 HIS 8 14.977 0.061 45.047 53 HE1 HIS 8 HE1 HIS 8 17.418 -2.104 47.759 54 HE2 HIS 8 HE2 HIS 8 17.015 -1.533 45.317 55 H HIS 9 H HIS 9 12.313 2.112 45.332 56 HA HIS 9 HA HIS 9 9.987 3.140 46.717 57 HB2 HIS 9 HB2 HIS 9 9.621 4.996 45.157 58 HB3 HIS 9 HB1 HIS 9 11.121 5.207 46.064 59 HD1 HIS 9 HD1 HIS 9 13.319 4.167 44.641 60 HD2 HIS 9 HD2 HIS 9 9.999 5.486 42.520 61 HE1 HIS 9 HE1 HIS 9 14.140 4.588 42.301 62 HE2 HIS 9 HE2 HIS 9 12.111 5.394 41.004 63 H HIS 10 H HIS 10 8.050 2.683 45.672 64 HA HIS 10 HA HIS 10 8.096 0.469 43.898 65 HB2 HIS 10 HB2 HIS 10 5.625 0.766 43.828 66 HB3 HIS 10 HB1 HIS 10 6.278 0.695 45.467 67 HD1 HIS 10 HD1 HIS 10 5.125 3.315 42.973 68 HD2 HIS 10 HD2 HIS 10 5.563 2.771 47.068 69 HE1 HIS 10 HE1 HIS 10 4.109 5.356 44.034 70 HE2 HIS 10 HE2 HIS 10 4.376 5.025 46.538 71 H SER 11 H SER 11 7.390 0.326 41.744 72 HA SER 11 HA SER 11 6.654 2.593 40.198 73 HB2 SER 11 HB2 SER 11 8.796 2.381 38.710 74 HB3 SER 11 HB1 SER 11 8.854 3.361 40.187 75 HG SER 11 HG SER 11 10.030 0.888 39.646 76 H SER 12 H SER 12 5.604 1.925 38.428 77 HA SER 12 HA SER 12 5.673 -0.929 37.805 78 HB2 SER 12 HB2 SER 12 3.757 1.270 36.975 79 HB3 SER 12 HB1 SER 12 3.621 -0.421 36.466 80 HG SER 12 HG SER 12 2.412 0.352 38.437 81 H GLY 13 H GLY 13 6.208 2.217 36.307 82 HA2 GLY 13 HA2 GLY 13 7.746 2.623 34.573 83 HA3 GLY 13 3HA GLY 13 7.755 0.904 34.209 84 H LEU 14 H LEU 14 5.411 3.594 34.241 85 HA LEU 14 HA LEU 14 3.819 2.457 32.176 86 HB2 LEU 14 HB2 LEU 14 3.104 4.117 33.968 87 HB3 LEU 14 HB1 LEU 14 3.878 5.357 32.966 88 HG LEU 14 HG LEU 14 2.322 4.729 31.113 89 HD11 LEU 14 HD11 LEU 14 0.244 3.566 32.607 90 HD12 LEU 14 HD12 LEU 14 1.692 2.612 32.930 91 HD13 LEU 14 HD13 LEU 14 1.149 2.856 31.270 92 HD21 LEU 14 HD21 LEU 14 1.719 6.675 32.220 93 HD22 LEU 14 HD22 LEU 14 1.362 5.829 33.726 94 HD23 LEU 14 HD23 LEU 14 0.265 5.685 32.352 95 H VAL 15 H VAL 15 4.104 2.508 30.048 96 HA VAL 15 HA VAL 15 5.862 4.579 28.909 97 HB VAL 15 HB VAL 15 6.470 2.797 27.169 98 HG11 VAL 15 HG11 VAL 15 7.569 2.094 29.855 99 HG12 VAL 15 HG12 VAL 15 8.407 2.297 28.315 100 HG13 VAL 15 HG13 VAL 15 7.832 3.710 29.200 101 HG21 VAL 15 HG21 VAL 15 4.640 1.248 28.085 102 HG22 VAL 15 HG22 VAL 15 6.198 0.532 27.673 103 HG23 VAL 15 HG23 VAL 15 5.797 0.860 29.359 104 HA PRO 16 HA PRO 16 2.686 5.440 26.004 105 HB2 PRO 16 HB2 PRO 16 4.142 6.122 23.788 106 HB3 PRO 16 HB1 PRO 16 4.019 7.140 25.222 107 HG2 PRO 16 HG1 PRO 16 6.178 5.211 24.438 108 HG3 PRO 16 HG2 PRO 16 6.326 6.888 25.084 109 HD2 PRO 16 HD1 PRO 16 6.683 4.686 26.630 110 HD3 PRO 16 HD2 PRO 16 5.980 6.189 27.252 111 H ARG 17 H ARG 17 1.891 4.888 23.776 112 HA ARG 17 HA ARG 17 2.885 2.345 22.739 113 HB2 ARG 17 HB2 ARG 17 1.053 1.969 24.483 114 HB3 ARG 17 HB1 ARG 17 -0.051 2.701 23.310 115 HG2 ARG 17 HG1 ARG 17 0.230 0.957 21.764 116 HG3 ARG 17 HG2 ARG 17 1.674 0.355 22.596 117 HD2 ARG 17 HD1 ARG 17 0.026 -1.167 23.235 118 HD3 ARG 17 HD2 ARG 17 0.101 -0.038 24.597 119 HE ARG 17 HE ARG 17 -2.046 0.592 24.140 120 HH11 ARG 17 1HH1 ARG 17 -0.720 -0.996 21.340 121 HH12 ARG 17 2HH1 ARG 17 -2.220 -1.008 20.474 122 HH21 ARG 17 1HH2 ARG 17 -4.027 0.583 23.010 123 HH22 ARG 17 2HH2 ARG 17 -4.101 -0.108 21.425 124 H GLY 18 H GLY 18 2.422 1.983 20.569 125 HA2 GLY 18 HA2 GLY 18 0.761 3.928 19.157 126 HA3 GLY 18 3HA GLY 18 2.466 3.884 18.733 127 H SER 19 H SER 19 -0.025 3.230 17.202 128 HA SER 19 HA SER 19 0.578 0.426 16.537 129 HB2 SER 19 HB2 SER 19 -1.909 1.957 15.742 130 HB3 SER 19 HB1 SER 19 -1.647 0.205 15.702 131 HG SER 19 HG SER 19 -2.411 0.176 17.647 132 H HIS 20 H HIS 20 2.451 1.300 15.342 133 HA HIS 20 HA HIS 20 1.647 2.043 12.616 134 HB2 HIS 20 HB2 HIS 20 3.999 3.220 14.120 135 HB3 HIS 20 HB1 HIS 20 3.564 3.565 12.442 136 HD1 HIS 20 HD1 HIS 20 2.743 4.511 15.918 137 HD2 HIS 20 HD2 HIS 20 1.214 5.152 12.108 138 HE1 HIS 20 HE1 HIS 20 1.119 6.416 16.157 139 HE2 HIS 20 HE2 HIS 20 0.183 6.808 13.829 140 H MET 21 H MET 21 2.256 0.467 11.299 141 HA MET 21 HA MET 21 4.808 -0.905 11.839 142 HB2 MET 21 HB2 MET 21 2.194 -2.006 10.802 143 HB3 MET 21 HB1 MET 21 3.729 -2.869 10.623 144 HG2 MET 21 HG1 MET 21 4.000 -2.806 13.098 145 HG3 MET 21 HG2 MET 21 2.387 -2.096 13.200 146 HE1 MET 21 HE1 MET 21 3.514 -6.327 11.935 147 HE2 MET 21 HE2 MET 21 4.521 -4.879 11.929 148 HE3 MET 21 HE3 MET 21 4.111 -5.662 13.456 149 H ILE 22 H ILE 22 6.273 -0.334 10.381 150 HA ILE 22 HA ILE 22 5.715 -0.562 7.569 151 HB ILE 22 HB ILE 22 4.905 1.732 8.049 152 HG12 ILE 22 HG11 ILE 22 6.271 2.873 6.301 153 HG13 ILE 22 HG12 ILE 22 7.406 1.513 6.361 154 HG21 ILE 22 HG21 ILE 22 6.821 1.961 9.852 155 HG22 ILE 22 HG22 ILE 22 7.693 2.661 8.489 156 HG23 ILE 22 HG23 ILE 22 6.167 3.370 9.017 157 HD11 ILE 22 HD11 ILE 22 6.177 0.370 4.928 158 HD12 ILE 22 HD12 ILE 22 4.769 0.498 5.983 159 HD13 ILE 22 HD13 ILE 22 5.094 1.754 4.789 160 H SER 23 H SER 23 7.520 -1.041 6.432 161 HA SER 23 HA SER 23 9.954 -1.471 7.914 162 HB2 SER 23 HB2 SER 23 10.770 -2.282 5.602 163 HB3 SER 23 HB1 SER 23 9.471 -3.197 6.387 164 HG SER 23 HG SER 23 9.398 -2.169 4.004 165 H LEU 24 H LEU 24 9.984 0.994 8.272 166 HA LEU 24 HA LEU 24 10.664 2.797 6.264 167 HB2 LEU 24 HB2 LEU 24 10.160 3.082 8.839 168 HB3 LEU 24 HB1 LEU 24 11.929 3.035 8.951 169 HG LEU 24 HG LEU 24 11.135 5.326 8.912 170 HD11 LEU 24 HD11 LEU 24 13.261 4.544 7.695 171 HD12 LEU 24 HD12 LEU 24 12.645 6.161 7.353 172 HD13 LEU 24 HD13 LEU 24 12.349 4.846 6.215 173 HD21 LEU 24 HD21 LEU 24 10.252 5.336 6.133 174 HD22 LEU 24 HD22 LEU 24 9.540 6.101 7.553 175 HD23 LEU 24 HD23 LEU 24 9.197 4.407 7.199 176 H SER 25 H SER 25 12.781 0.812 8.314 177 HA SER 25 HA SER 25 15.067 1.575 6.643 178 HB2 SER 25 HB2 SER 25 16.415 0.416 8.442 179 HB3 SER 25 HB1 SER 25 15.514 1.843 8.982 180 HG SER 25 HG SER 25 14.332 0.628 10.234 181 H GLY 26 H GLY 26 16.723 -0.332 6.445 182 HA2 GLY 26 HA2 GLY 26 15.248 -2.768 5.663 183 HA3 GLY 26 3HA GLY 26 16.441 -2.039 4.598 184 H LEU 27 H LEU 27 17.548 -4.076 4.625 185 HA LEU 27 HA LEU 27 18.977 -5.673 5.446 186 HB2 LEU 27 HB2 LEU 27 21.033 -4.782 6.223 187 HB3 LEU 27 HB1 LEU 27 20.357 -3.624 5.064 188 HG LEU 27 HG LEU 27 19.762 -3.130 7.921 189 HD11 LEU 27 HD11 LEU 27 22.515 -2.863 6.736 190 HD12 LEU 27 HD12 LEU 27 22.040 -3.738 8.191 191 HD13 LEU 27 HD13 LEU 27 21.978 -1.976 8.163 192 HD21 LEU 27 HD21 LEU 27 19.324 -1.766 5.643 193 HD22 LEU 27 HD22 LEU 27 20.872 -1.072 6.125 194 HD23 LEU 27 HD23 LEU 27 19.493 -1.002 7.223 195 H THR 28 H THR 28 16.650 -5.407 7.053 196 HA THR 28 HA THR 28 17.741 -6.354 9.602 197 HB THR 28 HB THR 28 15.813 -5.172 10.776 198 HG1 THR 28 HG1 THR 28 15.136 -3.232 9.621 199 HG21 THR 28 HG21 THR 28 18.136 -3.675 9.581 200 HG22 THR 28 HG22 THR 28 17.994 -4.368 11.196 201 HG23 THR 28 HG23 THR 28 17.048 -2.946 10.761 202 H SER 29 H SER 29 15.667 -7.117 10.976 203 HA SER 29 HA SER 29 14.691 -9.394 9.671 204 HB2 SER 29 HB2 SER 29 14.881 -8.830 12.220 205 HB3 SER 29 HB1 SER 29 13.241 -8.192 12.009 206 HG SER 29 HG SER 29 13.963 -10.714 12.331 207 H SER 30 H SER 30 12.059 -9.694 10.072 208 HA SER 30 HA SER 30 10.006 -9.320 9.165 209 HB2 SER 30 HB2 SER 30 10.471 -7.076 10.457 210 HB3 SER 30 HB1 SER 30 10.616 -6.404 8.824 211 HG SER 30 HG SER 30 8.528 -6.408 8.733 212 H VAL 31 H VAL 31 11.942 -10.193 7.430 213 HA VAL 31 HA VAL 31 11.707 -8.582 5.003 214 HB VAL 31 HB VAL 31 13.275 -10.253 4.021 215 HG11 VAL 31 HG11 VAL 31 15.033 -9.622 6.075 216 HG12 VAL 31 HG12 VAL 31 14.695 -8.651 4.640 217 HG13 VAL 31 HG13 VAL 31 13.811 -8.352 6.137 218 HG21 VAL 31 HG21 VAL 31 13.886 -12.139 5.063 219 HG22 VAL 31 HG22 VAL 31 14.069 -11.331 6.620 220 HG23 VAL 31 HG23 VAL 31 12.476 -11.864 6.085 221 H GLU 32 H GLU 32 9.287 -9.608 5.789 222 HA GLU 32 HA GLU 32 8.798 -12.063 4.318 223 HB2 GLU 32 HB2 GLU 32 6.544 -11.938 5.173 224 HB3 GLU 32 HB1 GLU 32 7.684 -11.632 6.491 225 HG2 GLU 32 HG1 GLU 32 7.307 -9.189 6.182 226 HG3 GLU 32 HG2 GLU 32 6.048 -9.591 5.006 227 HE2 GLU 32 HE2 GLU 32 4.759 -11.216 8.248 228 H SER 33 H SER 33 8.883 -8.765 3.660 229 HA SER 33 HA SER 33 7.099 -9.086 1.338 230 HB2 SER 33 HB2 SER 33 6.306 -7.346 2.838 231 HB3 SER 33 HB1 SER 33 7.901 -6.573 2.824 232 HG SER 33 HG SER 33 5.958 -6.672 0.799 233 H ASP 34 H ASP 34 10.306 -8.441 2.394 234 HA ASP 34 HA ASP 34 11.375 -7.038 0.246 235 HB2 ASP 34 HB2 ASP 34 12.531 -7.601 2.414 236 HB3 ASP 34 HB1 ASP 34 12.794 -9.227 1.770 237 HD2 ASP 34 HD2 ASP 34 14.956 -6.258 0.289 238 H LEU 35 H LEU 35 10.370 -10.345 0.476 239 HA LEU 35 HA LEU 35 11.770 -11.155 -1.928 240 HB2 LEU 35 HB2 LEU 35 11.096 -12.557 0.213 241 HB3 LEU 35 HB1 LEU 35 9.601 -12.789 -0.709 242 HG LEU 35 HG LEU 35 11.149 -14.660 -0.994 243 HD11 LEU 35 HD11 LEU 35 11.072 -13.161 -3.589 244 HD12 LEU 35 HD12 LEU 35 9.601 -13.776 -2.834 245 HD13 LEU 35 HD13 LEU 35 10.885 -14.891 -3.299 246 HD21 LEU 35 HD21 LEU 35 13.082 -12.610 -1.168 247 HD22 LEU 35 HD22 LEU 35 13.072 -13.449 -2.719 248 HD23 LEU 35 HD23 LEU 35 13.333 -14.355 -1.228 249 H ASP 36 H ASP 36 8.535 -10.218 -0.953 250 HA ASP 36 HA ASP 36 7.074 -11.046 -3.165 251 HB2 ASP 36 HB2 ASP 36 6.283 -9.935 -0.964 252 HB3 ASP 36 HB1 ASP 36 6.557 -8.409 -1.814 253 HD2 ASP 36 HD2 ASP 36 3.945 -10.441 -3.892 254 H MET 37 H MET 37 9.356 -8.458 -2.845 255 HA MET 37 HA MET 37 8.605 -6.777 -4.924 256 HB2 MET 37 HB2 MET 37 10.580 -6.689 -3.160 257 HB3 MET 37 HB1 MET 37 11.503 -7.359 -4.513 258 HG2 MET 37 HG1 MET 37 10.700 -5.444 -5.916 259 HG3 MET 37 HG2 MET 37 10.013 -4.751 -4.444 260 HE1 MET 37 HE1 MET 37 12.265 -3.692 -6.610 261 HE2 MET 37 HE2 MET 37 11.696 -2.570 -5.373 262 HE3 MET 37 HE3 MET 37 13.426 -2.840 -5.591 263 H GLN 38 H GLN 38 10.014 -9.941 -5.016 264 HA GLN 38 HA GLN 38 11.097 -9.872 -7.619 265 HB2 GLN 38 HB2 GLN 38 10.069 -12.145 -5.913 266 HB3 GLN 38 HB1 GLN 38 10.833 -12.389 -7.491 267 HG2 GLN 38 HG1 GLN 38 12.399 -10.705 -5.683 268 HG3 GLN 38 HG2 GLN 38 12.128 -12.349 -5.089 269 HE21 GLN 38 HE21 GLN 38 13.973 -13.384 -5.431 270 HE22 GLN 38 HE22 GLN 38 14.813 -13.471 -6.938 271 H GLN 39 H GLN 39 7.868 -10.501 -6.399 272 HA GLN 39 HA GLN 39 6.761 -11.554 -8.769 273 HB2 GLN 39 HB2 GLN 39 5.219 -9.920 -6.760 274 HB3 GLN 39 HB1 GLN 39 4.650 -11.274 -7.749 275 HG2 GLN 39 HG1 GLN 39 6.338 -11.320 -5.275 276 HG3 GLN 39 HG2 GLN 39 4.840 -12.191 -5.631 277 HE21 GLN 39 HE21 GLN 39 5.438 -13.249 -8.106 278 HE22 GLN 39 HE22 GLN 39 6.704 -14.413 -7.937 279 H ALA 40 H ALA 40 7.050 -8.253 -7.540 280 HA ALA 40 HA ALA 40 5.490 -6.965 -9.479 281 HB1 ALA 40 HB1 ALA 40 6.565 -6.073 -7.281 282 HB2 ALA 40 HB2 ALA 40 6.309 -4.980 -8.642 283 HB3 ALA 40 HB3 ALA 40 7.913 -5.646 -8.335 284 H MET 41 H MET 41 8.654 -8.338 -9.651 285 HA MET 41 HA MET 41 9.605 -6.838 -11.876 286 HB2 MET 41 HB2 MET 41 10.425 -9.582 -10.889 287 HB3 MET 41 HB1 MET 41 11.324 -8.593 -12.050 288 HG2 MET 41 HG1 MET 41 11.159 -6.831 -10.036 289 HG3 MET 41 HG2 MET 41 11.097 -8.336 -9.119 290 HE1 MET 41 HE1 MET 41 12.958 -6.625 -8.307 291 HE2 MET 41 HE2 MET 41 13.949 -8.035 -7.932 292 HE3 MET 41 HE3 MET 41 14.632 -6.698 -8.859 293 H LEU 42 H LEU 42 7.733 -9.780 -11.511 294 HA LEU 42 HA LEU 42 7.880 -10.454 -14.312 295 HB2 LEU 42 HB2 LEU 42 6.651 -11.605 -11.870 296 HB3 LEU 42 HB1 LEU 42 5.866 -11.979 -13.415 297 HG LEU 42 HG LEU 42 7.979 -12.927 -14.245 298 HD11 LEU 42 HD11 LEU 42 9.556 -13.423 -12.116 299 HD12 LEU 42 HD12 LEU 42 8.969 -11.811 -11.709 300 HD13 LEU 42 HD13 LEU 42 9.805 -12.085 -13.237 301 HD21 LEU 42 HD21 LEU 42 7.354 -14.198 -11.601 302 HD22 LEU 42 HD22 LEU 42 7.787 -14.968 -13.127 303 HD23 LEU 42 HD23 LEU 42 6.199 -14.225 -12.933 304 H THR 43 H THR 43 6.319 -8.080 -12.708 305 HA THR 43 HA THR 43 4.249 -7.909 -14.774 306 HB THR 43 HB THR 43 3.005 -8.800 -12.941 307 HG1 THR 43 HG1 THR 43 1.528 -7.336 -13.290 308 HG21 THR 43 HG21 THR 43 3.225 -6.877 -10.893 309 HG22 THR 43 HG22 THR 43 4.871 -7.306 -11.358 310 HG23 THR 43 HG23 THR 43 3.742 -8.562 -10.852 311 H ASN 44 H ASN 44 6.154 -6.429 -15.380 312 HA ASN 44 HA ASN 44 6.598 -4.030 -13.965 313 HB2 ASN 44 HB2 ASN 44 7.811 -5.239 -16.063 314 HB3 ASN 44 HB1 ASN 44 6.914 -3.972 -16.909 315 HD21 ASN 44 HD21 ASN 44 8.810 -4.264 -13.920 316 HD22 ASN 44 HD22 ASN 44 9.732 -2.824 -14.166 317 H LYS 45 H LYS 45 6.296 -1.956 -15.699 318 HA LYS 45 HA LYS 45 3.373 -1.774 -16.031 319 HB2 LYS 45 HB2 LYS 45 3.547 0.611 -15.514 320 HB3 LYS 45 HB1 LYS 45 4.167 -0.379 -14.184 321 HG2 LYS 45 HG1 LYS 45 6.180 0.478 -16.161 322 HG3 LYS 45 HG2 LYS 45 5.445 1.768 -15.193 323 HD2 LYS 45 HD1 LYS 45 6.424 -0.721 -13.839 324 HD3 LYS 45 HD2 LYS 45 7.578 0.533 -14.325 325 HE2 LYS 45 HE1 LYS 45 5.722 2.078 -13.123 326 HE3 LYS 45 HE2 LYS 45 5.510 0.575 -12.215 327 HZ1 LYS 45 3HZ LYS 45 8.245 1.519 -12.617 328 HZ2 LYS 45 1HZ LYS 45 7.558 0.729 -11.288 329 HZ3 LYS 45 2HZ LYS 45 7.282 2.381 -11.526 330 H ASP 46 H ASP 46 3.045 0.462 -17.419 331 HA ASP 46 HA ASP 46 4.810 0.351 -19.755 332 HB2 ASP 46 HB2 ASP 46 1.837 -0.137 -19.728 333 HB3 ASP 46 HB1 ASP 46 2.641 0.507 -21.166 334 HD2 ASP 46 HD2 ASP 46 3.197 -3.290 -20.236 335 H GLU 47 H GLU 47 3.850 2.111 -21.411 336 HA GLU 47 HA GLU 47 4.197 4.604 -20.092 337 HB2 GLU 47 HB2 GLU 47 3.769 5.597 -22.318 338 HB3 GLU 47 HB1 GLU 47 4.982 4.308 -22.362 339 HG2 GLU 47 HG1 GLU 47 3.224 2.734 -23.139 340 HG3 GLU 47 HG2 GLU 47 2.106 4.104 -23.221 341 HE2 GLU 47 HE2 GLU 47 3.390 5.154 -26.228 342 H LYS 48 H LYS 48 1.404 2.952 -21.499 343 HA LYS 48 HA LYS 48 -0.426 5.083 -21.048 344 HB2 LYS 48 HB2 LYS 48 -2.171 3.334 -21.444 345 HB3 LYS 48 HB1 LYS 48 -0.953 3.451 -22.724 346 HG2 LYS 48 HG1 LYS 48 -0.336 1.506 -20.603 347 HG3 LYS 48 HG2 LYS 48 -1.762 1.135 -21.588 348 HD2 LYS 48 HD1 LYS 48 0.268 2.008 -23.364 349 HD3 LYS 48 HD2 LYS 48 1.000 0.838 -22.252 350 HE2 LYS 48 HE1 LYS 48 -0.686 -0.815 -22.784 351 HE3 LYS 48 HE2 LYS 48 -1.555 0.362 -23.782 352 HZ1 LYS 48 3HZ LYS 48 0.762 0.461 -24.995 353 HZ2 LYS 48 1HZ LYS 48 -0.387 -0.718 -25.383 354 HZ3 LYS 48 2HZ LYS 48 0.907 -1.103 -24.365 355 H VAL 49 H VAL 49 0.672 2.354 -19.153 356 HA VAL 49 HA VAL 49 -1.328 2.264 -17.210 357 HB VAL 49 HB VAL 49 1.625 1.713 -16.884 358 HG11 VAL 49 HG11 VAL 49 0.201 0.117 -15.118 359 HG12 VAL 49 HG12 VAL 49 1.174 1.531 -14.710 360 HG13 VAL 49 HG13 VAL 49 -0.560 1.702 -14.984 361 HG21 VAL 49 HG21 VAL 49 -0.009 0.427 -18.559 362 HG22 VAL 49 HG22 VAL 49 1.277 -0.389 -17.671 363 HG23 VAL 49 HG23 VAL 49 -0.382 -0.455 -17.078 364 H LEU 50 H LEU 50 1.323 4.487 -17.648 365 HA LEU 50 HA LEU 50 1.313 5.601 -15.040 366 HB2 LEU 50 HB2 LEU 50 2.142 6.956 -17.610 367 HB3 LEU 50 HB1 LEU 50 2.653 7.365 -15.963 368 HG LEU 50 HG LEU 50 3.371 4.833 -17.441 369 HD11 LEU 50 HD11 LEU 50 5.607 6.438 -16.740 370 HD12 LEU 50 HD12 LEU 50 4.451 7.445 -17.611 371 HD13 LEU 50 HD13 LEU 50 5.051 5.958 -18.343 372 HD21 LEU 50 HD21 LEU 50 4.494 5.857 -14.844 373 HD22 LEU 50 HD22 LEU 50 4.742 4.280 -15.595 374 HD23 LEU 50 HD23 LEU 50 3.164 4.701 -14.926 375 H LYS 51 H LYS 51 -0.743 5.971 -17.764 376 HA LYS 51 HA LYS 51 -1.738 8.573 -17.188 377 HB2 LYS 51 HB2 LYS 51 -3.024 6.301 -18.724 378 HB3 LYS 51 HB1 LYS 51 -3.555 7.990 -18.742 379 HG2 LYS 51 HG1 LYS 51 -0.727 7.481 -19.465 380 HG3 LYS 51 HG2 LYS 51 -1.967 6.944 -20.612 381 HD2 LYS 51 HD1 LYS 51 -1.819 9.056 -21.394 382 HD3 LYS 51 HD2 LYS 51 -2.884 9.422 -20.024 383 HE2 LYS 51 HE1 LYS 51 -0.111 9.366 -19.186 384 HE3 LYS 51 HE2 LYS 51 -0.354 10.493 -20.529 385 HZ1 LYS 51 3HZ LYS 51 -1.286 11.930 -19.149 386 HZ2 LYS 51 1HZ LYS 51 -0.971 10.891 -17.851 387 HZ3 LYS 51 2HZ LYS 51 -2.448 10.798 -18.670 388 H ALA 52 H ALA 52 -2.703 5.313 -16.263 389 HA ALA 52 HA ALA 52 -5.174 5.949 -15.087 390 HB1 ALA 52 HB1 ALA 52 -5.223 3.736 -14.957 391 HB2 ALA 52 HB2 ALA 52 -4.038 3.800 -13.651 392 HB3 ALA 52 HB3 ALA 52 -3.501 3.652 -15.325 393 H LEU 53 H LEU 53 -1.906 5.781 -13.716 394 HA LEU 53 HA LEU 53 -2.566 6.228 -11.043 395 HB2 LEU 53 HB2 LEU 53 -0.086 7.258 -12.420 396 HB3 LEU 53 HB1 LEU 53 -0.284 6.838 -10.710 397 HG LEU 53 HG LEU 53 -0.344 4.867 -12.995 398 HD11 LEU 53 HD11 LEU 53 1.862 6.138 -12.203 399 HD12 LEU 53 HD12 LEU 53 1.859 4.441 -12.683 400 HD13 LEU 53 HD13 LEU 53 1.817 4.873 -10.974 401 HD21 LEU 53 HD21 LEU 53 -1.371 4.652 -10.416 402 HD22 LEU 53 HD22 LEU 53 0.183 3.820 -10.356 403 HD23 LEU 53 HD23 LEU 53 -1.033 3.335 -11.539 404 H GLU 54 H GLU 54 -2.595 8.368 -13.734 405 HA GLU 54 HA GLU 54 -2.216 10.833 -12.453 406 HB2 GLU 54 HB2 GLU 54 -4.022 10.290 -14.819 407 HB3 GLU 54 HB1 GLU 54 -3.267 11.831 -14.384 408 HG2 GLU 54 HG1 GLU 54 -1.806 9.337 -15.252 409 HG3 GLU 54 HG2 GLU 54 -2.123 10.762 -16.251 410 HE2 GLU 54 HE2 GLU 54 0.487 12.521 -14.843 411 H ARG 55 H ARG 55 -5.179 8.982 -13.084 412 HA ARG 55 HA ARG 55 -6.866 10.898 -11.779 413 HB2 ARG 55 HB2 ARG 55 -7.886 9.631 -13.497 414 HB3 ARG 55 HB1 ARG 55 -7.307 8.104 -12.814 415 HG2 ARG 55 HG1 ARG 55 -9.710 8.411 -12.457 416 HG3 ARG 55 HG2 ARG 55 -8.813 8.333 -10.932 417 HD2 ARG 55 HD1 ARG 55 -9.571 10.337 -10.319 418 HD3 ARG 55 HD2 ARG 55 -8.945 11.053 -11.811 419 HE ARG 55 HE ARG 55 -11.342 9.711 -12.388 420 HH11 ARG 55 1HH1 ARG 55 -10.183 12.516 -10.682 421 HH12 ARG 55 2HH1 ARG 55 -11.648 13.415 -10.899 422 HH21 ARG 55 1HH2 ARG 55 -13.276 10.884 -12.680 423 HH22 ARG 55 2HH2 ARG 55 -13.407 12.485 -12.035 424 H THR 56 H THR 56 -5.210 7.955 -10.864 425 HA THR 56 HA THR 56 -6.581 7.529 -8.414 426 HB THR 56 HB THR 56 -4.969 5.884 -7.917 427 HG1 THR 56 HG1 THR 56 -2.952 6.471 -8.154 428 HG21 THR 56 HG21 THR 56 -6.190 5.942 -10.394 429 HG22 THR 56 HG22 THR 56 -5.421 4.540 -9.651 430 HG23 THR 56 HG23 THR 56 -4.514 5.553 -10.774 431 H ARG 57 H ARG 57 -3.545 9.161 -9.248 432 HA ARG 57 HA ARG 57 -2.653 9.749 -6.681 433 HB2 ARG 57 HB2 ARG 57 -1.097 11.098 -7.670 434 HB3 ARG 57 HB1 ARG 57 -1.623 10.177 -9.087 435 HG2 ARG 57 HG1 ARG 57 -3.300 12.070 -9.488 436 HG3 ARG 57 HG2 ARG 57 -2.329 12.986 -8.322 437 HD2 ARG 57 HD1 ARG 57 -1.669 12.114 -11.086 438 HD3 ARG 57 HD2 ARG 57 -1.257 13.607 -10.230 439 HE ARG 57 HE ARG 57 0.273 11.166 -10.297 440 HH11 ARG 57 1HH1 ARG 57 -0.332 14.146 -8.603 441 HH12 ARG 57 2HH1 ARG 57 1.224 14.181 -7.841 442 HH21 ARG 57 1HH2 ARG 57 2.325 11.201 -9.301 443 HH22 ARG 57 2HH2 ARG 57 2.735 12.506 -8.240 444 H GLN 58 H GLN 58 -5.150 11.248 -8.603 445 HA GLN 58 HA GLN 58 -5.405 13.689 -7.279 446 HB2 GLN 58 HB2 GLN 58 -7.484 11.948 -8.616 447 HB3 GLN 58 HB1 GLN 58 -7.798 13.598 -8.053 448 HG2 GLN 58 HG1 GLN 58 -5.587 12.982 -9.993 449 HG3 GLN 58 HG2 GLN 58 -7.250 13.275 -10.518 450 HE21 GLN 58 HE21 GLN 58 -4.528 14.687 -8.802 451 HE22 GLN 58 HE22 GLN 58 -4.959 16.335 -9.094 452 H LEU 59 H LEU 59 -6.809 10.528 -6.536 453 HA LEU 59 HA LEU 59 -8.108 11.591 -4.158 454 HB2 LEU 59 HB2 LEU 59 -8.003 8.709 -5.041 455 HB3 LEU 59 HB1 LEU 59 -9.171 9.485 -3.956 456 HG LEU 59 HG LEU 59 -9.246 10.734 -6.548 457 HD11 LEU 59 HD11 LEU 59 -8.487 8.714 -7.521 458 HD12 LEU 59 HD12 LEU 59 -10.239 8.738 -7.719 459 HD13 LEU 59 HD13 LEU 59 -9.508 7.738 -6.464 460 HD21 LEU 59 HD21 LEU 59 -10.964 10.653 -4.669 461 HD22 LEU 59 HD22 LEU 59 -11.356 9.035 -5.250 462 HD23 LEU 59 HD23 LEU 59 -11.561 10.427 -6.314 463 H ASP 60 H ASP 60 -5.068 11.047 -4.713 464 HA ASP 60 HA ASP 60 -3.247 10.561 -3.439 465 HB2 ASP 60 HB2 ASP 60 -4.679 11.824 -1.731 466 HB3 ASP 60 HB1 ASP 60 -5.097 10.234 -1.082 467 HD2 ASP 60 HD2 ASP 60 -1.216 10.957 -0.821 468 H ILE 61 H ILE 61 -3.658 8.520 -4.852 469 HA ILE 61 HA ILE 61 -3.862 6.187 -3.060 470 HB ILE 61 HB ILE 61 -4.373 6.174 -6.033 471 HG12 ILE 61 HG11 ILE 61 -6.416 6.124 -3.801 472 HG13 ILE 61 HG12 ILE 61 -6.024 7.567 -4.752 473 HG21 ILE 61 HG21 ILE 61 -3.659 4.072 -4.704 474 HG22 ILE 61 HG22 ILE 61 -5.298 4.127 -4.057 475 HG23 ILE 61 HG23 ILE 61 -5.041 3.966 -5.795 476 HD11 ILE 61 HD11 ILE 61 -7.674 6.946 -6.101 477 HD12 ILE 61 HD12 ILE 61 -6.572 5.700 -6.687 478 HD13 ILE 61 HD13 ILE 61 -7.736 5.322 -5.418 479 HA PRO 62 HA PRO 62 0.403 5.503 -4.033 480 HB2 PRO 62 HB2 PRO 62 0.600 2.994 -2.953 481 HB3 PRO 62 HB1 PRO 62 0.534 4.468 -1.986 482 HG2 PRO 62 HG1 PRO 62 -1.670 2.564 -2.706 483 HG3 PRO 62 HG2 PRO 62 -1.282 3.310 -1.110 484 HD2 PRO 62 HD1 PRO 62 -3.277 4.224 -2.707 485 HD3 PRO 62 HD2 PRO 62 -2.311 5.293 -1.676 486 H ASP 63 H ASP 63 1.496 4.644 -5.717 487 HA ASP 63 HA ASP 63 0.084 3.314 -7.784 488 HB2 ASP 63 HB2 ASP 63 3.091 3.518 -7.500 489 HB3 ASP 63 HB1 ASP 63 2.159 3.319 -8.990 490 HD2 ASP 63 HD2 ASP 63 1.104 6.724 -8.799 491 H GLU 64 H GLU 64 1.444 2.165 -4.943 492 HA GLU 64 HA GLU 64 2.372 -0.376 -5.871 493 HB2 GLU 64 HB2 GLU 64 1.526 0.353 -3.062 494 HB3 GLU 64 HB1 GLU 64 2.620 -0.949 -3.554 495 HG2 GLU 64 HG1 GLU 64 4.173 0.816 -4.447 496 HG3 GLU 64 HG2 GLU 64 3.130 2.010 -3.660 497 HE2 GLU 64 HE2 GLU 64 4.199 0.995 -0.469 498 H LYS 65 H LYS 65 -0.639 0.851 -4.516 499 HA LYS 65 HA LYS 65 -1.850 -1.798 -4.606 500 HB2 LYS 65 HB2 LYS 65 -3.638 -0.916 -3.370 501 HB3 LYS 65 HB1 LYS 65 -2.206 -0.099 -2.721 502 HG2 LYS 65 HG1 LYS 65 -2.711 1.839 -4.217 503 HG3 LYS 65 HG2 LYS 65 -4.231 1.030 -4.639 504 HD2 LYS 65 HD1 LYS 65 -3.383 1.848 -1.851 505 HD3 LYS 65 HD2 LYS 65 -4.561 2.692 -2.870 506 HE2 LYS 65 HE1 LYS 65 -6.103 1.429 -1.835 507 HE3 LYS 65 HE2 LYS 65 -5.523 0.132 -2.889 508 HZ1 LYS 65 3HZ LYS 65 -5.270 -0.885 -0.900 509 HZ2 LYS 65 1HZ LYS 65 -5.052 0.557 -0.043 510 HZ3 LYS 65 2HZ LYS 65 -3.774 -0.097 -0.936 511 H THR 66 H THR 66 -1.822 1.201 -6.365 512 HA THR 66 HA THR 66 -4.186 0.699 -7.892 513 HB THR 66 HB THR 66 -1.883 2.583 -8.437 514 HG1 THR 66 HG1 THR 66 -4.429 3.422 -7.616 515 HG21 THR 66 HG21 THR 66 -4.637 2.481 -9.675 516 HG22 THR 66 HG22 THR 66 -3.130 2.047 -10.481 517 HG23 THR 66 HG23 THR 66 -3.412 3.712 -9.976 518 H MET 67 H MET 67 -0.802 -0.087 -8.224 519 HA MET 67 HA MET 67 -0.551 -0.608 -10.910 520 HB2 MET 67 HB2 MET 67 0.773 -1.455 -8.463 521 HB3 MET 67 HB1 MET 67 0.785 -2.730 -9.691 522 HG2 MET 67 HG1 MET 67 1.533 0.003 -10.576 523 HG3 MET 67 HG2 MET 67 2.668 -0.863 -9.538 524 HE1 MET 67 HE1 MET 67 0.726 -0.540 -12.550 525 HE2 MET 67 HE2 MET 67 1.884 -1.019 -13.790 526 HE3 MET 67 HE3 MET 67 0.673 -2.170 -13.223 527 HA PRO 68 HA PRO 68 -2.274 -5.075 -10.281 528 HB2 PRO 68 HB2 PRO 68 -3.431 -5.662 -7.869 529 HB3 PRO 68 HB1 PRO 68 -1.714 -5.879 -8.203 530 HG2 PRO 68 HG1 PRO 68 -3.112 -3.601 -6.842 531 HG3 PRO 68 HG2 PRO 68 -1.605 -4.466 -6.360 532 HD2 PRO 68 HD1 PRO 68 -1.574 -2.045 -7.587 533 HD3 PRO 68 HD2 PRO 68 -0.322 -3.269 -7.853 534 H VAL 69 H VAL 69 -3.819 -2.205 -9.238 535 HA VAL 69 HA VAL 69 -6.519 -3.197 -9.465 536 HB VAL 69 HB VAL 69 -5.385 -0.428 -9.109 537 HG11 VAL 69 HG11 VAL 69 -8.063 -1.257 -9.964 538 HG12 VAL 69 HG12 VAL 69 -8.042 -0.166 -8.577 539 HG13 VAL 69 HG13 VAL 69 -7.265 0.310 -10.088 540 HG21 VAL 69 HG21 VAL 69 -7.273 -1.642 -7.190 541 HG22 VAL 69 HG22 VAL 69 -5.671 -2.375 -7.282 542 HG23 VAL 69 HG23 VAL 69 -5.837 -0.660 -6.903 543 H LEU 70 H LEU 70 -4.606 -0.787 -11.275 544 HA LEU 70 HA LEU 70 -6.415 -0.422 -13.364 545 HB2 LEU 70 HB2 LEU 70 -4.577 0.525 -14.617 546 HB3 LEU 70 HB1 LEU 70 -4.503 1.045 -12.924 547 HG LEU 70 HG LEU 70 -2.844 -1.071 -12.820 548 HD11 LEU 70 HD11 LEU 70 -1.693 -1.501 -14.739 549 HD12 LEU 70 HD12 LEU 70 -2.023 0.088 -15.429 550 HD13 LEU 70 HD13 LEU 70 -3.280 -1.150 -15.424 551 HD21 LEU 70 HD21 LEU 70 -1.000 0.606 -13.131 552 HD22 LEU 70 HD22 LEU 70 -2.246 1.066 -11.971 553 HD23 LEU 70 HD23 LEU 70 -2.238 1.777 -13.585 554 H MET 71 H MET 71 -3.725 -2.709 -13.050 555 HA MET 71 HA MET 71 -3.862 -3.815 -15.617 556 HB2 MET 71 HB2 MET 71 -2.477 -5.537 -14.829 557 HB3 MET 71 HB1 MET 71 -2.067 -4.143 -13.820 558 HG2 MET 71 HG1 MET 71 -3.302 -4.992 -11.970 559 HG3 MET 71 HG2 MET 71 -4.026 -6.253 -12.970 560 HE1 MET 71 HE1 MET 71 -3.481 -8.338 -13.011 561 HE2 MET 71 HE2 MET 71 -1.978 -9.156 -12.586 562 HE3 MET 71 HE3 MET 71 -3.029 -8.526 -11.316 563 H LYS 72 H LYS 72 -5.910 -4.199 -12.873 564 HA LYS 72 HA LYS 72 -7.047 -6.713 -13.615 565 HB2 LYS 72 HB2 LYS 72 -7.039 -5.669 -11.296 566 HB3 LYS 72 HB1 LYS 72 -8.335 -4.610 -11.877 567 HG2 LYS 72 HG1 LYS 72 -9.405 -6.371 -10.737 568 HG3 LYS 72 HG2 LYS 72 -9.618 -6.703 -12.465 569 HD2 LYS 72 HD1 LYS 72 -9.014 -8.779 -11.563 570 HD3 LYS 72 HD2 LYS 72 -7.511 -8.150 -12.261 571 HE2 LYS 72 HE1 LYS 72 -6.806 -8.906 -10.181 572 HE3 LYS 72 HE2 LYS 72 -7.096 -7.184 -9.892 573 HZ1 LYS 72 3HZ LYS 72 -8.192 -9.289 -8.509 574 HZ2 LYS 72 1HZ LYS 72 -9.461 -8.701 -9.461 575 HZ3 LYS 72 2HZ LYS 72 -8.648 -7.663 -8.402 576 H LEU 73 H LEU 73 -7.702 -3.373 -14.379 577 HA LEU 73 HA LEU 73 -10.303 -3.842 -15.485 578 HB2 LEU 73 HB2 LEU 73 -8.593 -1.497 -16.228 579 HB3 LEU 73 HB1 LEU 73 -10.349 -1.586 -16.003 580 HG LEU 73 HG LEU 73 -8.274 -1.609 -13.812 581 HD11 LEU 73 HD11 LEU 73 -8.470 0.577 -14.776 582 HD12 LEU 73 HD12 LEU 73 -9.312 0.568 -13.227 583 HD13 LEU 73 HD13 LEU 73 -10.231 0.489 -14.731 584 HD21 LEU 73 HD21 LEU 73 -10.328 -1.333 -12.361 585 HD22 LEU 73 HD22 LEU 73 -10.076 -2.935 -13.057 586 HD23 LEU 73 HD23 LEU 73 -11.272 -1.844 -13.761 587 H LEU 74 H LEU 74 -7.105 -3.165 -16.899 588 HA LEU 74 HA LEU 74 -7.863 -3.395 -19.582 589 HB2 LEU 74 HB2 LEU 74 -5.245 -3.784 -18.149 590 HB3 LEU 74 HB1 LEU 74 -5.392 -4.000 -19.902 591 HG LEU 74 HG LEU 74 -4.520 -1.812 -19.463 592 HD11 LEU 74 HD11 LEU 74 -6.931 -2.297 -20.863 593 HD12 LEU 74 HD12 LEU 74 -5.715 -1.056 -21.167 594 HD13 LEU 74 HD13 LEU 74 -7.069 -0.717 -20.089 595 HD21 LEU 74 HD21 LEU 74 -6.979 -1.299 -17.795 596 HD22 LEU 74 HD22 LEU 74 -5.658 -0.174 -18.111 597 HD23 LEU 74 HD23 LEU 74 -5.371 -1.624 -17.147 598 H GLU 75 H GLU 75 -7.308 -5.798 -17.165 599 HA GLU 75 HA GLU 75 -6.644 -8.011 -18.725 600 HB2 GLU 75 HB2 GLU 75 -7.633 -7.514 -16.035 601 HB3 GLU 75 HB1 GLU 75 -8.295 -9.007 -16.717 602 HG2 GLU 75 HG1 GLU 75 -5.350 -8.379 -16.712 603 HG3 GLU 75 HG2 GLU 75 -6.165 -9.236 -15.396 604 HE2 GLU 75 HE2 GLU 75 -5.221 -11.229 -18.614 605 H GLU 76 H GLU 76 -9.873 -6.952 -17.646 606 HA GLU 76 HA GLU 76 -11.204 -8.882 -19.303 607 HB2 GLU 76 HB2 GLU 76 -12.450 -6.465 -17.991 608 HB3 GLU 76 HB1 GLU 76 -13.240 -7.979 -18.456 609 HG2 GLU 76 HG1 GLU 76 -11.835 -9.160 -16.761 610 HG3 GLU 76 HG2 GLU 76 -11.266 -7.573 -16.226 611 HE2 GLU 76 HE2 GLU 76 -14.923 -8.702 -15.235 612 H ALA 77 H ALA 77 -10.254 -5.542 -19.584 613 HA ALA 77 HA ALA 77 -11.874 -5.071 -21.936 614 HB1 ALA 77 HB1 ALA 77 -11.307 -3.313 -20.213 615 HB2 ALA 77 HB2 ALA 77 -11.048 -2.857 -21.897 616 HB3 ALA 77 HB3 ALA 77 -9.676 -3.308 -20.884 617 H GLY 78 H GLY 78 -9.263 -6.906 -21.502 618 HA2 GLY 78 HA2 GLY 78 -7.577 -7.685 -22.852 619 HA3 GLY 78 3HA GLY 78 -8.592 -7.157 -24.186 620 H GLY 79 H GLY 79 -7.500 -4.816 -21.877 621 HA2 GLY 79 HA2 GLY 79 -5.667 -3.353 -21.963 622 HA3 GLY 79 3HA GLY 79 -5.210 -4.053 -23.509 623 H ASN 80 H ASN 80 -8.366 -2.753 -22.589 624 HA ASN 80 HA ASN 80 -8.024 -0.704 -24.679 625 HB2 ASN 80 HB2 ASN 80 -9.837 -2.690 -24.760 626 HB3 ASN 80 HB1 ASN 80 -10.759 -1.498 -23.834 627 HD21 ASN 80 HD21 ASN 80 -10.898 0.690 -24.769 628 HD22 ASN 80 HD22 ASN 80 -11.024 0.833 -26.486 629 H TRP 81 H TRP 81 -7.507 1.122 -23.628 630 HA TRP 81 HA TRP 81 -8.639 1.770 -21.057 631 HB2 TRP 81 HB2 TRP 81 -6.895 3.422 -22.908 632 HB3 TRP 81 HB1 TRP 81 -7.293 3.828 -21.238 633 HD1 TRP 81 HD1 TRP 81 -5.308 1.177 -23.220 634 HE1 TRP 81 HE1 TRP 81 -3.492 0.212 -21.673 635 HE3 TRP 81 HE3 TRP 81 -6.610 3.532 -18.873 636 HZ2 TRP 81 2HZ TRP 81 -2.714 0.420 -18.968 637 HZ3 TRP 81 3HZ TRP 81 -5.279 3.094 -16.851 638 HH2 TRP 81 HH TRP 81 -3.372 1.569 -16.899 639 H SER 82 H SER 82 -9.409 2.360 -24.349 640 HA SER 82 HA SER 82 -10.694 4.802 -24.300 641 HB2 SER 82 HB2 SER 82 -10.322 3.021 -26.225 642 HB3 SER 82 HB1 SER 82 -11.975 2.551 -25.794 643 HG SER 82 HG SER 82 -12.408 4.120 -27.163 644 H TYR 83 H TYR 83 -12.132 1.610 -23.640 645 HA TYR 83 HA TYR 83 -14.629 2.753 -22.804 646 HB2 TYR 83 HB2 TYR 83 -14.886 0.635 -23.736 647 HB3 TYR 83 HB1 TYR 83 -13.483 -0.017 -22.886 648 HD1 TYR 83 HD1 TYR 83 -17.045 0.780 -22.599 649 HD2 TYR 83 HD2 TYR 83 -13.638 -0.778 -20.583 650 HE1 TYR 83 HE1 TYR 83 -18.508 -0.140 -20.850 651 HE2 TYR 83 HE2 TYR 83 -15.092 -1.703 -18.828 652 HH TYR 83 HH TYR 83 -18.539 -1.765 -19.141 653 H ILE 84 H ILE 84 -11.830 1.315 -21.185 654 HA ILE 84 HA ILE 84 -12.819 1.305 -18.574 655 HB ILE 84 HB ILE 84 -9.983 1.670 -19.541 656 HG12 ILE 84 HG11 ILE 84 -11.420 -0.765 -18.456 657 HG13 ILE 84 HG12 ILE 84 -11.122 -0.452 -20.173 658 HG21 ILE 84 HG21 ILE 84 -9.917 2.479 -17.355 659 HG22 ILE 84 HG22 ILE 84 -11.108 1.311 -16.787 660 HG23 ILE 84 HG23 ILE 84 -9.474 0.781 -17.185 661 HD11 ILE 84 HD11 ILE 84 -9.209 -1.539 -19.972 662 HD12 ILE 84 HD12 ILE 84 -8.627 -0.222 -18.954 663 HD13 ILE 84 HD13 ILE 84 -9.386 -1.634 -18.220 664 H LYS 85 H LYS 85 -11.711 3.913 -20.559 665 HA LYS 85 HA LYS 85 -11.594 5.736 -18.269 666 HB2 LYS 85 HB2 LYS 85 -10.280 7.129 -19.517 667 HB3 LYS 85 HB1 LYS 85 -9.888 5.588 -20.293 668 HG2 LYS 85 HG1 LYS 85 -11.960 6.269 -21.822 669 HG3 LYS 85 HG2 LYS 85 -11.439 7.888 -21.323 670 HD2 LYS 85 HD1 LYS 85 -9.804 5.782 -22.747 671 HD3 LYS 85 HD2 LYS 85 -10.311 7.366 -23.362 672 HE2 LYS 85 HE1 LYS 85 -8.335 6.812 -21.138 673 HE3 LYS 85 HE2 LYS 85 -7.999 7.499 -22.734 674 HZ1 LYS 85 3HZ LYS 85 -9.928 9.122 -21.622 675 HZ2 LYS 85 1HZ LYS 85 -8.287 9.482 -21.821 676 HZ3 LYS 85 2HZ LYS 85 -8.836 8.817 -20.367 677 H LEU 86 H LEU 86 -13.974 4.520 -19.984 678 HA LEU 86 HA LEU 86 -15.351 6.707 -21.094 679 HB2 LEU 86 HB2 LEU 86 -15.814 4.249 -21.451 680 HB3 LEU 86 HB1 LEU 86 -16.611 4.264 -19.869 681 HG LEU 86 HG LEU 86 -17.837 6.332 -21.253 682 HD11 LEU 86 HD11 LEU 86 -18.550 5.339 -23.357 683 HD12 LEU 86 HD12 LEU 86 -17.489 3.958 -23.080 684 HD13 LEU 86 HD13 LEU 86 -16.801 5.563 -23.330 685 HD21 LEU 86 HD21 LEU 86 -18.756 4.546 -19.701 686 HD22 LEU 86 HD22 LEU 86 -18.862 3.508 -21.124 687 HD23 LEU 86 HD23 LEU 86 -19.779 5.014 -21.060 688 H ASP 87 H ASP 87 -14.743 5.859 -17.861 689 HA ASP 87 HA ASP 87 -16.638 7.915 -16.962 690 HB2 ASP 87 HB2 ASP 87 -16.143 5.308 -15.500 691 HB3 ASP 87 HB1 ASP 87 -17.261 6.594 -15.026 692 HD2 ASP 87 HD2 ASP 87 -18.341 4.285 -18.075 693 H ASN 88 H ASN 88 -13.724 7.864 -17.485 694 HA ASN 88 HA ASN 88 -11.848 8.779 -16.579 695 HB2 ASN 88 HB2 ASN 88 -13.884 10.124 -15.373 696 HB3 ASN 88 HB1 ASN 88 -13.061 9.437 -13.968 697 HD21 ASN 88 HD21 ASN 88 -10.463 9.497 -14.628 698 HD22 ASN 88 HD22 ASN 88 -9.931 11.122 -14.878 699 H TYR 89 H TYR 89 -12.248 6.030 -16.317 700 HA TYR 89 HA TYR 89 -11.393 4.204 -15.264 701 HB2 TYR 89 HB2 TYR 89 -9.787 6.244 -13.703 702 HB3 TYR 89 HB1 TYR 89 -9.436 4.519 -13.823 703 HD1 TYR 89 HD2 TYR 89 -10.188 4.366 -16.847 704 HD2 TYR 89 HD1 TYR 89 -7.631 6.912 -14.594 705 HE1 TYR 89 HE2 TYR 89 -8.818 4.756 -18.853 706 HE2 TYR 89 HE1 TYR 89 -6.255 7.310 -16.593 707 HH TYR 89 HH TYR 89 -6.680 7.215 -19.168 708 H THR 90 H THR 90 -13.827 5.182 -14.308 709 HA THR 90 HA THR 90 -14.095 5.603 -11.597 710 HB THR 90 HB THR 90 -15.905 4.117 -13.500 711 HG1 THR 90 HG1 THR 90 -15.831 6.745 -12.419 712 HG21 THR 90 HG21 THR 90 -16.134 4.547 -10.574 713 HG22 THR 90 HG22 THR 90 -16.777 3.251 -11.582 714 HG23 THR 90 HG23 THR 90 -17.582 4.819 -11.543 715 H ALA 91 H ALA 91 -13.400 2.635 -13.298 716 HA ALA 91 HA ALA 91 -14.058 0.735 -11.389 717 HB1 ALA 91 HB1 ALA 91 -12.479 -0.725 -12.472 718 HB2 ALA 91 HB2 ALA 91 -11.655 0.651 -13.207 719 HB3 ALA 91 HB3 ALA 91 -13.300 0.245 -13.695 720 H LEU 92 H LEU 92 -11.233 2.823 -11.599 721 HA LEU 92 HA LEU 92 -9.721 1.559 -9.568 722 HB2 LEU 92 HB2 LEU 92 -8.228 3.316 -9.752 723 HB3 LEU 92 HB1 LEU 92 -8.991 3.269 -11.352 724 HG LEU 92 HG LEU 92 -10.577 5.085 -10.233 725 HD11 LEU 92 HD11 LEU 92 -8.227 4.911 -8.467 726 HD12 LEU 92 HD12 LEU 92 -9.856 5.503 -8.141 727 HD13 LEU 92 HD13 LEU 92 -8.693 6.536 -8.972 728 HD21 LEU 92 HD21 LEU 92 -8.060 6.345 -10.959 729 HD22 LEU 92 HD22 LEU 92 -9.634 6.418 -11.752 730 HD23 LEU 92 HD23 LEU 92 -8.538 5.078 -12.088 731 H VAL 93 H VAL 93 -12.192 4.049 -9.540 732 HA VAL 93 HA VAL 93 -11.826 4.962 -6.903 733 HB VAL 93 HB VAL 93 -14.241 4.936 -8.701 734 HG11 VAL 93 HG11 VAL 93 -15.216 4.882 -6.562 735 HG12 VAL 93 HG12 VAL 93 -13.985 5.949 -5.883 736 HG13 VAL 93 HG13 VAL 93 -15.183 6.587 -7.010 737 HG21 VAL 93 HG21 VAL 93 -13.236 7.500 -7.831 738 HG22 VAL 93 HG22 VAL 93 -11.968 6.541 -8.594 739 HG23 VAL 93 HG23 VAL 93 -13.463 6.877 -9.466 740 H ASP 94 H ASP 94 -14.039 2.504 -8.219 741 HA ASP 94 HA ASP 94 -15.020 1.753 -5.637 742 HB2 ASP 94 HB2 ASP 94 -16.183 1.517 -7.939 743 HB3 ASP 94 HB1 ASP 94 -15.226 0.039 -8.100 744 HD2 ASP 94 HD2 ASP 94 -18.405 -0.047 -5.845 745 H ALA 95 H ALA 95 -12.431 0.707 -7.721 746 HA ALA 95 HA ALA 95 -11.950 -1.793 -6.444 747 HB1 ALA 95 HB1 ALA 95 -9.642 -1.467 -7.584 748 HB2 ALA 95 HB2 ALA 95 -10.413 -0.077 -8.350 749 HB3 ALA 95 HB3 ALA 95 -11.077 -1.694 -8.583 750 H ILE 96 H ILE 96 -10.164 1.297 -6.329 751 HA ILE 96 HA ILE 96 -8.395 0.559 -4.290 752 HB ILE 96 HB ILE 96 -9.414 3.308 -5.014 753 HG12 ILE 96 HG11 ILE 96 -8.272 2.083 -6.834 754 HG13 ILE 96 HG12 ILE 96 -7.360 3.506 -6.299 755 HG21 ILE 96 HG21 ILE 96 -7.093 2.469 -3.286 756 HG22 ILE 96 HG22 ILE 96 -7.344 4.106 -3.891 757 HG23 ILE 96 HG23 ILE 96 -8.517 3.383 -2.790 758 HD11 ILE 96 HD11 ILE 96 -5.906 1.582 -6.702 759 HD12 ILE 96 HD12 ILE 96 -5.857 2.107 -5.019 760 HD13 ILE 96 HD13 ILE 96 -6.779 0.673 -5.468 761 H TYR 97 H TYR 97 -11.616 1.980 -4.164 762 HA TYR 97 HA TYR 97 -11.675 2.656 -1.449 763 HB2 TYR 97 HB2 TYR 97 -13.696 2.132 -3.564 764 HB3 TYR 97 HB1 TYR 97 -14.260 2.046 -1.894 765 HD1 TYR 97 HD1 TYR 97 -11.686 4.321 -3.324 766 HD2 TYR 97 HD2 TYR 97 -15.578 3.961 -1.641 767 HE1 TYR 97 HE1 TYR 97 -11.869 6.772 -3.238 768 HE2 TYR 97 HE2 TYR 97 -15.772 6.412 -1.552 769 HH TYR 97 HH TYR 97 -14.862 8.363 -2.403 770 H SER 98 H SER 98 -12.185 -0.397 -3.091 771 HA SER 98 HA SER 98 -13.210 -1.758 -0.784 772 HB2 SER 98 HB2 SER 98 -13.937 -2.865 -2.654 773 HB3 SER 98 HB1 SER 98 -12.459 -2.506 -3.563 774 HG SER 98 HG SER 98 -13.064 -4.673 -2.004 775 H VAL 99 H VAL 99 -10.131 -1.957 -2.572 776 HA VAL 99 HA VAL 99 -8.825 -3.673 -0.788 777 HB VAL 99 HB VAL 99 -7.500 -1.546 -2.472 778 HG11 VAL 99 HG11 VAL 99 -6.114 -2.738 -0.764 779 HG12 VAL 99 HG12 VAL 99 -6.464 -4.244 -1.617 780 HG13 VAL 99 HG13 VAL 99 -5.573 -2.955 -2.429 781 HG21 VAL 99 HG21 VAL 99 -7.291 -3.731 -3.988 782 HG22 VAL 99 HG22 VAL 99 -8.830 -4.090 -3.205 783 HG23 VAL 99 HG23 VAL 99 -8.638 -2.601 -4.132 784 H GLU 100 H GLU 100 -8.583 -0.124 -1.058 785 HA GLU 100 HA GLU 100 -6.874 0.362 1.046 786 HB2 GLU 100 HB2 GLU 100 -7.561 2.592 0.985 787 HB3 GLU 100 HB1 GLU 100 -7.909 2.003 -0.648 788 HG2 GLU 100 HG1 GLU 100 -10.272 1.629 0.041 789 HG3 GLU 100 HG2 GLU 100 -9.882 2.395 1.588 790 HE2 GLU 100 HE2 GLU 100 -11.104 5.115 -0.299 791 H ASP 101 H ASP 101 -10.268 -0.447 1.123 792 HA ASP 101 HA ASP 101 -10.534 0.152 3.944 793 HB2 ASP 101 HB2 ASP 101 -12.339 -0.712 1.747 794 HB3 ASP 101 HB1 ASP 101 -12.785 -1.215 3.383 795 HD2 ASP 101 HD2 ASP 101 -14.339 1.877 3.451 796 H GLU 102 H GLU 102 -10.932 -1.384 5.576 797 HA GLU 102 HA GLU 102 -10.412 -3.267 6.750 798 HB2 GLU 102 HB2 GLU 102 -11.253 -4.668 4.202 799 HB3 GLU 102 HB1 GLU 102 -11.234 -5.356 5.833 800 HG2 GLU 102 HG1 GLU 102 -12.908 -3.562 6.471 801 HG3 GLU 102 HG2 GLU 102 -13.064 -3.246 4.737 802 HE2 GLU 102 HE2 GLU 102 -14.320 -6.669 4.437 803 H ASN 103 H ASN 103 -8.173 -2.892 6.872 804 HA ASN 103 HA ASN 103 -6.529 -4.394 4.949 805 HB2 ASN 103 HB2 ASN 103 -6.037 -1.944 6.602 806 HB3 ASN 103 HB1 ASN 103 -4.667 -2.969 6.160 807 HD21 ASN 103 HD21 ASN 103 -7.587 -2.145 4.344 808 HD22 ASN 103 HD22 ASN 103 -6.763 -1.430 3.005 809 H LYS 104 H LYS 104 -7.462 -4.123 8.269 810 HA LYS 104 HA LYS 104 -5.348 -5.870 9.217 811 HB2 LYS 104 HB2 LYS 104 -6.392 -5.615 11.415 812 HB3 LYS 104 HB1 LYS 104 -6.127 -4.041 10.648 813 HG2 LYS 104 HG1 LYS 104 -8.604 -4.371 9.827 814 HG3 LYS 104 HG2 LYS 104 -8.675 -5.466 11.219 815 HD2 LYS 104 HD1 LYS 104 -9.300 -3.512 12.239 816 HD3 LYS 104 HD2 LYS 104 -7.542 -3.424 12.453 817 HE2 LYS 104 HE1 LYS 104 -8.675 -2.280 9.947 818 HE3 LYS 104 HE2 LYS 104 -8.962 -1.403 11.458 819 HZ1 LYS 104 3HZ LYS 104 -6.287 -2.102 11.474 820 HZ2 LYS 104 1HZ LYS 104 -6.941 -0.558 11.246 821 HZ3 LYS 104 2HZ LYS 104 -6.599 -1.537 9.910 822 H GLN 105 H GLN 105 -8.605 -6.104 8.100 823 HA GLN 105 HA GLN 105 -9.399 -8.485 9.354 824 HB2 GLN 105 HB2 GLN 105 -10.185 -7.628 6.565 825 HB3 GLN 105 HB1 GLN 105 -11.115 -8.625 7.695 826 HG2 GLN 105 HG1 GLN 105 -10.499 -5.684 7.957 827 HG3 GLN 105 HG2 GLN 105 -12.067 -6.426 7.610 828 HE21 GLN 105 HE21 GLN 105 -10.555 -4.869 9.920 829 HE22 GLN 105 HE22 GLN 105 -11.195 -5.635 11.330 830 H SER 106 H SER 106 -7.871 -10.079 9.367 831 HA SER 106 HA SER 106 -7.714 -11.827 7.193 832 HB2 SER 106 HB2 SER 106 -6.315 -10.298 6.030 833 HB3 SER 106 HB1 SER 106 -5.372 -9.946 7.489 834 HG SER 106 HG SER 106 -4.610 -11.573 5.747 835 H GLU 107 H GLU 107 -6.207 -13.633 7.579 836 HA GLU 107 HA GLU 107 -6.105 -14.242 10.395 837 HB2 GLU 107 HB2 GLU 107 -5.104 -15.890 8.061 838 HB3 GLU 107 HB1 GLU 107 -5.432 -16.463 9.704 839 HG2 GLU 107 HG1 GLU 107 -7.557 -15.288 7.920 840 HG3 GLU 107 HG2 GLU 107 -7.172 -17.014 7.976 841 HE2 GLU 107 HE2 GLU 107 -8.296 -16.995 11.438 842 H GLY 108 H GLY 108 -3.678 -14.206 7.774 843 HA2 GLY 108 HA2 GLY 108 -1.726 -12.948 9.449 844 HA3 GLY 108 3HA GLY 108 -1.403 -14.663 9.240 845 H SER 109 H SER 109 -0.957 -15.464 7.127 846 HA SER 109 HA SER 109 0.245 -13.418 5.410 847 HB2 SER 109 HB2 SER 109 0.750 -16.332 5.882 848 HB3 SER 109 HB1 SER 109 1.186 -15.638 4.311 849 HG SER 109 HG SER 109 2.896 -14.888 5.249 Start of MODEL 2 1 H1 MET 1 H MET 1 8.206 25.324 -11.032 2 HA MET 1 HA MET 1 5.712 24.540 -11.817 3 HB2 MET 1 HB2 MET 1 7.687 26.028 -13.565 4 HB3 MET 1 HB1 MET 1 5.922 26.066 -13.701 5 HG2 MET 1 HG1 MET 1 5.891 27.002 -11.339 6 HG3 MET 1 HG2 MET 1 7.633 27.222 -11.524 7 HE1 MET 1 HE1 MET 1 8.185 30.270 -13.291 8 HE2 MET 1 HE2 MET 1 8.775 28.752 -12.616 9 HE3 MET 1 HE3 MET 1 8.324 28.843 -14.319 10 H GLY 2 H GLY 2 4.835 23.123 -13.216 11 HA2 GLY 2 HA2 GLY 2 6.308 22.054 -15.443 12 HA3 GLY 2 3HA GLY 2 6.109 20.895 -14.137 13 H SER 3 H SER 3 4.299 19.722 -14.085 14 HA SER 3 HA SER 3 2.273 18.875 -14.682 15 HB2 SER 3 HB2 SER 3 1.634 21.129 -13.598 16 HB3 SER 3 HB1 SER 3 1.365 21.690 -15.258 17 HG SER 3 HG SER 3 -0.003 19.688 -13.824 18 H SER 4 H SER 4 4.091 18.700 -16.668 19 HA SER 4 HA SER 4 2.439 19.100 -19.062 20 HB2 SER 4 HB2 SER 4 4.225 19.952 -20.358 21 HB3 SER 4 HB1 SER 4 4.312 20.839 -18.826 22 HG SER 4 HG SER 4 6.226 19.454 -19.935 23 H HIS 5 H HIS 5 2.248 17.327 -20.272 24 HA HIS 5 HA HIS 5 4.229 15.175 -19.929 25 HB2 HIS 5 HB2 HIS 5 2.320 13.558 -20.241 26 HB3 HIS 5 HB1 HIS 5 2.306 14.450 -18.716 27 HD1 HIS 5 HD1 HIS 5 -0.085 14.787 -18.162 28 HD2 HIS 5 HD2 HIS 5 0.707 15.574 -22.164 29 HE1 HIS 5 HE1 HIS 5 -2.243 15.655 -19.116 30 HE2 HIS 5 HE2 HIS 5 -1.760 16.137 -21.562 31 H HIS 6 H HIS 6 4.080 13.531 -21.740 32 HA HIS 6 HA HIS 6 3.867 14.990 -24.275 33 HB2 HIS 6 HB2 HIS 6 5.976 13.666 -23.410 34 HB3 HIS 6 HB1 HIS 6 5.101 12.273 -24.053 35 HD1 HIS 6 HD1 HIS 6 5.518 15.749 -25.547 36 HD2 HIS 6 HD2 HIS 6 6.272 11.761 -26.438 37 HE1 HIS 6 HE1 HIS 6 6.417 15.743 -27.896 38 HE2 HIS 6 HE2 HIS 6 6.879 13.306 -28.441 39 H HIS 7 H HIS 7 2.777 14.128 -26.059 40 HA HIS 7 HA HIS 7 0.769 12.085 -25.372 41 HB2 HIS 7 HB2 HIS 7 0.678 14.554 -27.056 42 HB3 HIS 7 HB1 HIS 7 -0.354 13.194 -27.505 43 HD1 HIS 7 HD1 HIS 7 -0.132 15.994 -25.150 44 HD2 HIS 7 HD2 HIS 7 -2.276 12.450 -25.474 45 HE1 HIS 7 HE1 HIS 7 -2.051 16.220 -23.540 46 HE2 HIS 7 HE2 HIS 7 -3.362 14.054 -23.738 47 H HIS 8 H HIS 8 0.043 10.701 -27.170 48 HA HIS 8 HA HIS 8 1.671 10.430 -29.503 49 HB2 HIS 8 HB2 HIS 8 2.496 8.131 -28.954 50 HB3 HIS 8 HB1 HIS 8 3.249 9.417 -28.006 51 HD1 HIS 8 HD1 HIS 8 0.434 6.895 -27.597 52 HD2 HIS 8 HD2 HIS 8 3.210 8.996 -25.330 53 HE1 HIS 8 HE1 HIS 8 0.176 6.032 -25.248 54 HE2 HIS 8 HE2 HIS 8 1.872 7.317 -23.862 55 H HIS 9 H HIS 9 1.174 7.999 -30.394 56 HA HIS 9 HA HIS 9 -1.607 7.296 -29.884 57 HB2 HIS 9 HB2 HIS 9 -1.779 8.998 -31.620 58 HB3 HIS 9 HB1 HIS 9 -0.601 8.134 -32.612 59 HD1 HIS 9 HD1 HIS 9 -3.912 7.172 -30.977 60 HD2 HIS 9 HD2 HIS 9 -1.838 6.737 -34.551 61 HE1 HIS 9 HE1 HIS 9 -5.431 5.845 -32.478 62 HE2 HIS 9 HE2 HIS 9 -4.165 5.578 -34.663 63 H HIS 10 H HIS 10 -1.973 5.161 -30.079 64 HA HIS 10 HA HIS 10 -0.096 3.523 -31.617 65 HB2 HIS 10 HB2 HIS 10 -0.684 3.284 -28.677 66 HB3 HIS 10 HB1 HIS 10 -0.219 1.863 -29.617 67 HD1 HIS 10 HD1 HIS 10 1.197 4.760 -27.899 68 HD2 HIS 10 HD2 HIS 10 2.419 2.070 -30.819 69 HE1 HIS 10 HE1 HIS 10 3.698 4.993 -28.023 70 HE2 HIS 10 HE2 HIS 10 4.446 3.350 -29.808 71 H SER 11 H SER 11 -0.944 1.085 -31.352 72 HA SER 11 HA SER 11 -3.738 1.199 -32.214 73 HB2 SER 11 HB2 SER 11 -2.166 0.150 -33.766 74 HB3 SER 11 HB1 SER 11 -1.669 -0.992 -32.506 75 HG SER 11 HG SER 11 -3.940 -0.978 -34.076 76 H SER 12 H SER 12 -5.250 -0.429 -31.508 77 HA SER 12 HA SER 12 -4.689 -1.354 -28.766 78 HB2 SER 12 HB2 SER 12 -7.344 -0.614 -30.036 79 HB3 SER 12 HB1 SER 12 -7.132 -1.221 -28.385 80 HG SER 12 HG SER 12 -6.705 0.742 -27.810 81 H GLY 13 H GLY 13 -6.032 -3.290 -28.115 82 HA2 GLY 13 HA2 GLY 13 -5.402 -5.482 -29.733 83 HA3 GLY 13 3HA GLY 13 -6.537 -5.511 -28.391 84 H LEU 14 H LEU 14 -8.676 -4.241 -29.042 85 HA LEU 14 HA LEU 14 -10.622 -4.374 -30.211 86 HB2 LEU 14 HB2 LEU 14 -9.004 -3.082 -31.786 87 HB3 LEU 14 HB1 LEU 14 -9.030 -4.576 -32.737 88 HG LEU 14 HG LEU 14 -11.546 -4.332 -32.829 89 HD11 LEU 14 HD11 LEU 14 -11.701 -2.758 -30.920 90 HD12 LEU 14 HD12 LEU 14 -12.506 -2.180 -32.378 91 HD13 LEU 14 HD13 LEU 14 -10.935 -1.524 -31.922 92 HD21 LEU 14 HD21 LEU 14 -10.097 -2.021 -34.087 93 HD22 LEU 14 HD22 LEU 14 -11.460 -2.942 -34.721 94 HD23 LEU 14 HD23 LEU 14 -9.863 -3.685 -34.625 95 H VAL 15 H VAL 15 -9.659 -6.804 -29.243 96 HA VAL 15 HA VAL 15 -10.565 -8.669 -31.339 97 HB VAL 15 HB VAL 15 -9.207 -10.407 -30.033 98 HG11 VAL 15 HG11 VAL 15 -8.127 -10.173 -31.973 99 HG12 VAL 15 HG12 VAL 15 -8.370 -8.425 -31.993 100 HG13 VAL 15 HG13 VAL 15 -7.019 -9.118 -31.095 101 HG21 VAL 15 HG21 VAL 15 -7.759 -7.944 -29.072 102 HG22 VAL 15 HG22 VAL 15 -8.836 -8.916 -28.069 103 HG23 VAL 15 HG23 VAL 15 -7.359 -9.625 -28.721 104 HA PRO 16 HA PRO 16 -13.740 -10.030 -28.631 105 HB2 PRO 16 HB2 PRO 16 -13.916 -12.684 -29.283 106 HB3 PRO 16 HB1 PRO 16 -14.462 -11.384 -30.341 107 HG2 PRO 16 HG1 PRO 16 -11.870 -12.892 -30.363 108 HG3 PRO 16 HG2 PRO 16 -12.947 -12.456 -31.742 109 HD2 PRO 16 HD1 PRO 16 -10.677 -11.085 -31.168 110 HD3 PRO 16 HD2 PRO 16 -12.121 -10.306 -31.835 111 H ARG 17 H ARG 17 -14.264 -11.934 -27.072 112 HA ARG 17 HA ARG 17 -12.129 -13.342 -25.853 113 HB2 ARG 17 HB2 ARG 17 -11.848 -10.822 -25.177 114 HB3 ARG 17 HB1 ARG 17 -13.167 -11.186 -24.055 115 HG2 ARG 17 HG1 ARG 17 -11.377 -11.616 -22.708 116 HG3 ARG 17 HG2 ARG 17 -11.635 -13.221 -23.413 117 HD2 ARG 17 HD1 ARG 17 -9.941 -12.654 -25.170 118 HD3 ARG 17 HD2 ARG 17 -9.615 -11.160 -24.281 119 HE ARG 17 HE ARG 17 -9.316 -13.165 -22.434 120 HH11 ARG 17 1HH1 ARG 17 -7.901 -12.366 -25.513 121 HH12 ARG 17 2HH1 ARG 17 -6.370 -13.089 -25.145 122 HH21 ARG 17 1HH2 ARG 17 -7.305 -14.121 -21.937 123 HH22 ARG 17 2HH2 ARG 17 -6.032 -14.087 -23.111 124 H GLY 18 H GLY 18 -12.973 -15.044 -24.822 125 HA2 GLY 18 HA2 GLY 18 -15.712 -14.809 -23.755 126 HA3 GLY 18 3HA GLY 18 -15.264 -16.160 -24.784 127 H SER 19 H SER 19 -14.669 -14.611 -21.676 128 HA SER 19 HA SER 19 -13.766 -17.221 -20.648 129 HB2 SER 19 HB2 SER 19 -12.707 -14.453 -20.044 130 HB3 SER 19 HB1 SER 19 -12.425 -15.829 -18.963 131 HG SER 19 HG SER 19 -10.725 -15.946 -20.278 132 H HIS 20 H HIS 20 -14.531 -17.854 -18.655 133 HA HIS 20 HA HIS 20 -16.755 -16.242 -17.601 134 HB2 HIS 20 HB2 HIS 20 -16.190 -19.211 -17.403 135 HB3 HIS 20 HB1 HIS 20 -17.522 -18.399 -16.576 136 HD1 HIS 20 HD1 HIS 20 -19.544 -17.649 -17.986 137 HD2 HIS 20 HD2 HIS 20 -16.563 -19.538 -20.179 138 HE1 HIS 20 HE1 HIS 20 -20.573 -18.154 -20.224 139 HE2 HIS 20 HE2 HIS 20 -18.753 -19.307 -21.566 140 H MET 21 H MET 21 -14.267 -18.515 -16.421 141 HA MET 21 HA MET 21 -13.113 -18.619 -14.464 142 HB2 MET 21 HB2 MET 21 -12.527 -16.268 -15.521 143 HB3 MET 21 HB1 MET 21 -13.385 -15.670 -14.093 144 HG2 MET 21 HG1 MET 21 -11.840 -16.627 -12.605 145 HG3 MET 21 HG2 MET 21 -11.159 -17.660 -13.865 146 HE1 MET 21 HE1 MET 21 -9.013 -16.632 -15.605 147 HE2 MET 21 HE2 MET 21 -8.018 -15.987 -14.301 148 HE3 MET 21 HE3 MET 21 -9.003 -17.424 -14.030 149 H ILE 22 H ILE 22 -15.656 -19.308 -14.051 150 HA ILE 22 HA ILE 22 -16.930 -17.738 -12.016 151 HB ILE 22 HB ILE 22 -18.208 -19.180 -13.576 152 HG12 ILE 22 HG11 ILE 22 -18.631 -20.177 -10.765 153 HG13 ILE 22 HG12 ILE 22 -18.953 -18.490 -11.199 154 HG21 ILE 22 HG21 ILE 22 -18.002 -21.435 -13.702 155 HG22 ILE 22 HG22 ILE 22 -16.365 -21.064 -13.163 156 HG23 ILE 22 HG23 ILE 22 -17.575 -21.603 -11.999 157 HD11 ILE 22 HD11 ILE 22 -20.342 -20.954 -12.178 158 HD12 ILE 22 HD12 ILE 22 -21.024 -19.541 -11.374 159 HD13 ILE 22 HD13 ILE 22 -20.452 -19.419 -13.038 160 H SER 23 H SER 23 -17.133 -18.204 -9.826 161 HA SER 23 HA SER 23 -14.870 -19.597 -8.680 162 HB2 SER 23 HB2 SER 23 -15.531 -17.438 -7.742 163 HB3 SER 23 HB1 SER 23 -17.141 -18.080 -7.369 164 HG SER 23 HG SER 23 -15.289 -18.066 -5.696 165 H LEU 24 H LEU 24 -16.098 -21.550 -9.862 166 HA LEU 24 HA LEU 24 -18.272 -22.778 -8.591 167 HB2 LEU 24 HB2 LEU 24 -16.989 -23.279 -10.846 168 HB3 LEU 24 HB1 LEU 24 -16.122 -24.433 -9.818 169 HG LEU 24 HG LEU 24 -17.916 -25.540 -11.013 170 HD11 LEU 24 HD11 LEU 24 -18.943 -26.655 -9.181 171 HD12 LEU 24 HD12 LEU 24 -18.705 -25.267 -8.121 172 HD13 LEU 24 HD13 LEU 24 -17.316 -26.203 -8.673 173 HD21 LEU 24 HD21 LEU 24 -20.212 -24.508 -9.705 174 HD22 LEU 24 HD22 LEU 24 -19.838 -24.517 -11.428 175 HD23 LEU 24 HD23 LEU 24 -19.339 -23.155 -10.424 176 H SER 25 H SER 25 -14.779 -23.227 -8.130 177 HA SER 25 HA SER 25 -15.210 -23.988 -5.379 178 HB2 SER 25 HB2 SER 25 -13.989 -25.958 -7.340 179 HB3 SER 25 HB1 SER 25 -14.011 -26.149 -5.578 180 HG SER 25 HG SER 25 -16.045 -26.711 -5.650 181 H GLY 26 H GLY 26 -12.942 -24.696 -4.432 182 HA2 GLY 26 HA2 GLY 26 -11.046 -22.646 -5.367 183 HA3 GLY 26 3HA GLY 26 -11.113 -23.302 -3.738 184 H LEU 27 H LEU 27 -11.089 -25.021 -6.838 185 HA LEU 27 HA LEU 27 -8.574 -26.304 -5.992 186 HB2 LEU 27 HB2 LEU 27 -10.202 -27.985 -5.947 187 HB3 LEU 27 HB1 LEU 27 -10.976 -27.382 -7.423 188 HG LEU 27 HG LEU 27 -9.087 -28.199 -8.752 189 HD11 LEU 27 HD11 LEU 27 -7.298 -29.437 -7.827 190 HD12 LEU 27 HD12 LEU 27 -8.053 -29.479 -6.234 191 HD13 LEU 27 HD13 LEU 27 -7.425 -27.960 -6.872 192 HD21 LEU 27 HD21 LEU 27 -10.109 -30.385 -6.951 193 HD22 LEU 27 HD22 LEU 27 -9.619 -30.513 -8.641 194 HD23 LEU 27 HD23 LEU 27 -11.083 -29.627 -8.211 195 H THR 28 H THR 28 -10.126 -24.423 -8.364 196 HA THR 28 HA THR 28 -7.978 -24.952 -10.306 197 HB THR 28 HB THR 28 -9.395 -24.038 -12.027 198 HG1 THR 28 HG1 THR 28 -10.922 -22.682 -11.500 199 HG21 THR 28 HG21 THR 28 -11.217 -25.649 -12.027 200 HG22 THR 28 HG22 THR 28 -11.019 -25.905 -10.294 201 HG23 THR 28 HG23 THR 28 -9.747 -26.401 -11.410 202 H SER 29 H SER 29 -7.034 -23.137 -11.415 203 HA SER 29 HA SER 29 -5.979 -21.122 -11.471 204 HB2 SER 29 HB2 SER 29 -8.705 -20.447 -10.443 205 HB3 SER 29 HB1 SER 29 -7.451 -19.197 -10.370 206 HG SER 29 HG SER 29 -7.672 -18.925 -12.431 207 H SER 30 H SER 30 -5.718 -22.935 -9.125 208 HA SER 30 HA SER 30 -5.514 -21.513 -6.727 209 HB2 SER 30 HB2 SER 30 -4.460 -23.383 -5.856 210 HB3 SER 30 HB1 SER 30 -5.274 -24.082 -7.266 211 HG SER 30 HG SER 30 -3.395 -24.259 -8.302 212 H VAL 31 H VAL 31 -3.100 -21.555 -5.666 213 HA VAL 31 HA VAL 31 -1.363 -20.052 -5.437 214 HB VAL 31 HB VAL 31 0.479 -20.522 -7.012 215 HG11 VAL 31 HG11 VAL 31 0.566 -22.064 -5.336 216 HG12 VAL 31 HG12 VAL 31 -1.059 -22.674 -5.661 217 HG13 VAL 31 HG13 VAL 31 0.286 -23.147 -6.699 218 HG21 VAL 31 HG21 VAL 31 -1.044 -20.749 -9.009 219 HG22 VAL 31 HG22 VAL 31 0.229 -21.963 -8.881 220 HG23 VAL 31 HG23 VAL 31 -1.426 -22.372 -8.431 221 H GLU 32 H GLU 32 -3.506 -18.671 -6.480 222 HA GLU 32 HA GLU 32 -2.874 -17.284 -8.882 223 HB2 GLU 32 HB2 GLU 32 -4.659 -15.688 -8.121 224 HB3 GLU 32 HB1 GLU 32 -5.164 -17.382 -8.217 225 HG2 GLU 32 HG1 GLU 32 -5.061 -17.642 -5.850 226 HG3 GLU 32 HG2 GLU 32 -4.295 -16.057 -5.663 227 HE2 GLU 32 HE2 GLU 32 -7.324 -14.397 -5.862 228 H SER 33 H SER 33 -2.000 -16.876 -5.558 229 HA SER 33 HA SER 33 -0.694 -14.318 -6.223 230 HB2 SER 33 HB2 SER 33 -1.843 -15.319 -3.608 231 HB3 SER 33 HB1 SER 33 -0.751 -13.927 -3.707 232 HG SER 33 HG SER 33 -3.226 -14.171 -5.078 233 H ASP 34 H ASP 34 -0.297 -17.539 -5.072 234 HA ASP 34 HA ASP 34 2.188 -17.266 -3.760 235 HB2 ASP 34 HB2 ASP 34 0.592 -19.247 -3.665 236 HB3 ASP 34 HB1 ASP 34 1.252 -19.727 -5.234 237 HD2 ASP 34 HD2 ASP 34 4.358 -20.543 -3.784 238 H LEU 35 H LEU 35 1.351 -18.094 -7.108 239 HA LEU 35 HA LEU 35 4.174 -18.010 -7.849 240 HB2 LEU 35 HB2 LEU 35 1.699 -19.132 -9.014 241 HB3 LEU 35 HB1 LEU 35 2.889 -18.505 -10.168 242 HG LEU 35 HG LEU 35 3.402 -20.648 -8.107 243 HD11 LEU 35 HD11 LEU 35 3.693 -21.332 -10.915 244 HD12 LEU 35 HD12 LEU 35 2.045 -20.870 -10.494 245 HD13 LEU 35 HD13 LEU 35 2.843 -22.180 -9.624 246 HD21 LEU 35 HD21 LEU 35 5.412 -20.764 -9.951 247 HD22 LEU 35 HD22 LEU 35 5.527 -19.994 -8.368 248 HD23 LEU 35 HD23 LEU 35 5.154 -19.026 -9.796 249 H ASP 36 H ASP 36 2.249 -15.675 -7.198 250 HA ASP 36 HA ASP 36 1.787 -14.142 -9.471 251 HB2 ASP 36 HB2 ASP 36 0.923 -13.635 -7.189 252 HB3 ASP 36 HB1 ASP 36 2.548 -13.110 -6.732 253 HD2 ASP 36 HD2 ASP 36 1.102 -10.055 -7.675 254 H MET 37 H MET 37 4.738 -14.769 -7.749 255 HA MET 37 HA MET 37 6.324 -12.632 -8.500 256 HB2 MET 37 HB2 MET 37 6.998 -15.552 -8.124 257 HB3 MET 37 HB1 MET 37 8.228 -14.313 -8.413 258 HG2 MET 37 HG1 MET 37 7.697 -13.180 -6.380 259 HG3 MET 37 HG2 MET 37 6.273 -14.194 -6.136 260 HE1 MET 37 HE1 MET 37 6.402 -16.624 -6.313 261 HE2 MET 37 HE2 MET 37 7.895 -17.559 -6.393 262 HE3 MET 37 HE3 MET 37 7.104 -17.290 -4.839 263 H GLN 38 H GLN 38 5.529 -15.559 -10.320 264 HA GLN 38 HA GLN 38 7.202 -14.883 -12.545 265 HB2 GLN 38 HB2 GLN 38 5.239 -17.020 -11.892 266 HB3 GLN 38 HB1 GLN 38 5.553 -16.705 -13.605 267 HG2 GLN 38 HG1 GLN 38 7.713 -17.442 -13.508 268 HG3 GLN 38 HG2 GLN 38 7.882 -17.033 -11.795 269 HE21 GLN 38 HE21 GLN 38 6.033 -19.207 -13.901 270 HE22 GLN 38 HE22 GLN 38 6.101 -20.570 -12.843 271 H GLN 39 H GLN 39 3.778 -14.550 -11.772 272 HA GLN 39 HA GLN 39 2.900 -13.717 -14.310 273 HB2 GLN 39 HB2 GLN 39 1.753 -12.909 -11.628 274 HB3 GLN 39 HB1 GLN 39 0.912 -12.918 -13.187 275 HG2 GLN 39 HG1 GLN 39 2.045 -15.415 -11.946 276 HG3 GLN 39 HG2 GLN 39 0.410 -14.829 -11.610 277 HE21 GLN 39 HE21 GLN 39 2.559 -15.683 -14.287 278 HE22 GLN 39 HE22 GLN 39 1.320 -16.317 -15.310 279 H ALA 40 H ALA 40 4.676 -12.097 -11.849 280 HA ALA 40 HA ALA 40 4.002 -9.427 -12.358 281 HB1 ALA 40 HB1 ALA 40 6.053 -8.844 -11.248 282 HB2 ALA 40 HB2 ALA 40 6.698 -10.467 -11.500 283 HB3 ALA 40 HB3 ALA 40 5.327 -10.221 -10.418 284 H MET 41 H MET 41 5.859 -11.681 -14.190 285 HA MET 41 HA MET 41 7.347 -9.745 -15.691 286 HB2 MET 41 HB2 MET 41 6.744 -12.612 -16.442 287 HB3 MET 41 HB1 MET 41 8.065 -11.602 -17.046 288 HG2 MET 41 HG1 MET 41 8.686 -11.489 -14.472 289 HG3 MET 41 HG2 MET 41 7.792 -13.011 -14.453 290 HE1 MET 41 HE1 MET 41 9.519 -14.553 -13.769 291 HE2 MET 41 HE2 MET 41 8.869 -15.329 -15.215 292 HE3 MET 41 HE3 MET 41 10.611 -15.302 -14.934 293 H LEU 42 H LEU 42 4.345 -11.537 -16.151 294 HA LEU 42 HA LEU 42 3.931 -10.615 -18.830 295 HB2 LEU 42 HB2 LEU 42 2.326 -12.120 -16.806 296 HB3 LEU 42 HB1 LEU 42 1.507 -11.414 -18.210 297 HG LEU 42 HG LEU 42 3.249 -12.708 -19.606 298 HD11 LEU 42 HD11 LEU 42 4.827 -13.514 -18.154 299 HD12 LEU 42 HD12 LEU 42 3.753 -14.907 -18.276 300 HD13 LEU 42 HD13 LEU 42 3.651 -13.836 -16.879 301 HD21 LEU 42 HD21 LEU 42 1.856 -14.832 -19.315 302 HD22 LEU 42 HD22 LEU 42 1.008 -13.356 -19.779 303 HD23 LEU 42 HD23 LEU 42 0.949 -13.920 -18.108 304 H THR 43 H THR 43 3.439 -9.286 -15.728 305 HA THR 43 HA THR 43 1.705 -7.190 -16.868 306 HB THR 43 HB THR 43 0.455 -8.302 -15.164 307 HG1 THR 43 HG1 THR 43 0.847 -5.824 -15.109 308 HG21 THR 43 HG21 THR 43 3.033 -8.581 -13.909 309 HG22 THR 43 HG22 THR 43 1.528 -9.435 -13.570 310 HG23 THR 43 HG23 THR 43 1.867 -7.897 -12.777 311 H ASN 44 H ASN 44 3.978 -6.454 -17.540 312 HA ASN 44 HA ASN 44 5.560 -5.249 -15.441 313 HB2 ASN 44 HB2 ASN 44 6.233 -6.256 -17.852 314 HB3 ASN 44 HB1 ASN 44 6.072 -4.547 -18.278 315 HD21 ASN 44 HD21 ASN 44 7.413 -6.435 -15.583 316 HD22 ASN 44 HD22 ASN 44 8.907 -5.572 -15.503 317 H LYS 45 H LYS 45 6.402 -2.886 -16.409 318 HA LYS 45 HA LYS 45 4.072 -1.204 -16.011 319 HB2 LYS 45 HB2 LYS 45 7.040 -0.675 -16.129 320 HB3 LYS 45 HB1 LYS 45 5.852 0.637 -16.056 321 HG2 LYS 45 HG1 LYS 45 6.511 0.335 -13.839 322 HG3 LYS 45 HG2 LYS 45 4.960 -0.514 -13.961 323 HD2 LYS 45 HD1 LYS 45 5.919 -2.602 -13.813 324 HD3 LYS 45 HD2 LYS 45 7.468 -2.044 -14.471 325 HE2 LYS 45 HE1 LYS 45 7.608 -2.608 -12.065 326 HE3 LYS 45 HE2 LYS 45 7.992 -0.913 -12.401 327 HZ1 LYS 45 3HZ LYS 45 5.407 -1.944 -11.365 328 HZ2 LYS 45 1HZ LYS 45 5.721 -0.326 -11.745 329 HZ3 LYS 45 2HZ LYS 45 6.563 -1.078 -10.486 330 H ASP 46 H ASP 46 3.422 0.460 -17.412 331 HA ASP 46 HA ASP 46 4.545 0.422 -20.120 332 HB2 ASP 46 HB2 ASP 46 1.560 0.469 -19.704 333 HB3 ASP 46 HB1 ASP 46 2.466 0.125 -21.184 334 HD2 ASP 46 HD2 ASP 46 3.150 -3.167 -20.089 335 H GLU 47 H GLU 47 3.854 2.294 -21.424 336 HA GLU 47 HA GLU 47 4.157 4.701 -19.984 337 HB2 GLU 47 HB2 GLU 47 3.690 5.812 -22.158 338 HB3 GLU 47 HB1 GLU 47 4.930 4.552 -22.261 339 HG2 GLU 47 HG1 GLU 47 2.741 3.098 -22.862 340 HG3 GLU 47 HG2 GLU 47 2.258 4.683 -23.484 341 HE2 GLU 47 HE2 GLU 47 4.048 3.980 -26.313 342 H LYS 48 H LYS 48 1.343 3.182 -21.509 343 HA LYS 48 HA LYS 48 -0.487 5.259 -20.996 344 HB2 LYS 48 HB2 LYS 48 -2.230 3.491 -21.301 345 HB3 LYS 48 HB1 LYS 48 -1.041 3.578 -22.611 346 HG2 LYS 48 HG1 LYS 48 -0.365 1.698 -20.449 347 HG3 LYS 48 HG2 LYS 48 -1.812 1.291 -21.391 348 HD2 LYS 48 HD1 LYS 48 0.130 2.108 -23.263 349 HD3 LYS 48 HD2 LYS 48 0.957 1.039 -22.117 350 HE2 LYS 48 HE1 LYS 48 0.156 -0.613 -23.428 351 HE3 LYS 48 HE2 LYS 48 -1.337 -0.342 -22.517 352 HZ1 LYS 48 3HZ LYS 48 -2.079 -0.218 -24.665 353 HZ2 LYS 48 1HZ LYS 48 -0.659 0.491 -25.250 354 HZ3 LYS 48 2HZ LYS 48 -1.763 1.416 -24.364 355 H VAL 49 H VAL 49 0.665 2.590 -19.048 356 HA VAL 49 HA VAL 49 -1.292 2.559 -17.058 357 HB VAL 49 HB VAL 49 1.664 1.991 -16.805 358 HG11 VAL 49 HG11 VAL 49 1.195 2.063 -14.603 359 HG12 VAL 49 HG12 VAL 49 -0.544 1.908 -14.860 360 HG13 VAL 49 HG13 VAL 49 0.487 0.477 -14.903 361 HG21 VAL 49 HG21 VAL 49 -0.318 0.635 -18.217 362 HG22 VAL 49 HG22 VAL 49 1.276 0.023 -17.771 363 HG23 VAL 49 HG23 VAL 49 -0.112 -0.284 -16.726 364 H LEU 50 H LEU 50 1.315 4.782 -17.650 365 HA LEU 50 HA LEU 50 1.420 5.955 -15.070 366 HB2 LEU 50 HB2 LEU 50 2.112 7.238 -17.717 367 HB3 LEU 50 HB1 LEU 50 2.676 7.727 -16.110 368 HG LEU 50 HG LEU 50 3.358 5.070 -17.357 369 HD11 LEU 50 HD11 LEU 50 4.437 7.736 -17.870 370 HD12 LEU 50 HD12 LEU 50 4.608 6.243 -18.792 371 HD13 LEU 50 HD13 LEU 50 5.652 6.546 -17.403 372 HD21 LEU 50 HD21 LEU 50 3.601 6.025 -14.758 373 HD22 LEU 50 HD22 LEU 50 5.211 6.210 -15.452 374 HD23 LEU 50 HD23 LEU 50 4.425 4.630 -15.455 375 H LYS 51 H LYS 51 -0.769 6.244 -17.700 376 HA LYS 51 HA LYS 51 -1.773 8.844 -17.075 377 HB2 LYS 51 HB2 LYS 51 -2.945 6.567 -18.688 378 HB3 LYS 51 HB1 LYS 51 -3.664 8.182 -18.574 379 HG2 LYS 51 HG1 LYS 51 -0.823 7.913 -19.461 380 HG3 LYS 51 HG2 LYS 51 -2.137 7.548 -20.594 381 HD2 LYS 51 HD1 LYS 51 -3.079 9.760 -20.302 382 HD3 LYS 51 HD2 LYS 51 -1.875 10.131 -19.055 383 HE2 LYS 51 HE1 LYS 51 -1.179 11.168 -21.114 384 HE3 LYS 51 HE2 LYS 51 -0.089 9.822 -20.753 385 HZ1 LYS 51 3HZ LYS 51 -2.418 9.449 -22.528 386 HZ2 LYS 51 1HZ LYS 51 -1.010 8.518 -22.421 387 HZ3 LYS 51 2HZ LYS 51 -0.955 10.054 -23.125 388 H ALA 52 H ALA 52 -2.671 5.548 -16.214 389 HA ALA 52 HA ALA 52 -5.127 6.143 -14.967 390 HB1 ALA 52 HB1 ALA 52 -5.118 3.918 -15.109 391 HB2 ALA 52 HB2 ALA 52 -4.159 3.935 -13.628 392 HB3 ALA 52 HB3 ALA 52 -3.357 3.850 -15.197 393 H LEU 53 H LEU 53 -1.823 5.936 -13.704 394 HA LEU 53 HA LEU 53 -2.408 6.251 -10.992 395 HB2 LEU 53 HB2 LEU 53 0.020 7.222 -12.511 396 HB3 LEU 53 HB1 LEU 53 -0.095 7.014 -10.755 397 HG LEU 53 HG LEU 53 -0.290 4.777 -12.768 398 HD11 LEU 53 HD11 LEU 53 1.926 4.359 -12.526 399 HD12 LEU 53 HD12 LEU 53 1.992 5.034 -10.899 400 HD13 LEU 53 HD13 LEU 53 1.963 6.108 -12.298 401 HD21 LEU 53 HD21 LEU 53 0.103 4.595 -9.792 402 HD22 LEU 53 HD22 LEU 53 -0.269 3.297 -10.926 403 HD23 LEU 53 HD23 LEU 53 -1.485 4.521 -10.554 404 H GLU 54 H GLU 54 -2.543 8.503 -13.580 405 HA GLU 54 HA GLU 54 -2.166 10.900 -12.126 406 HB2 GLU 54 HB2 GLU 54 -3.826 10.492 -14.624 407 HB3 GLU 54 HB1 GLU 54 -3.139 12.017 -14.043 408 HG2 GLU 54 HG1 GLU 54 -0.858 10.844 -14.263 409 HG3 GLU 54 HG2 GLU 54 -1.735 9.674 -15.259 410 HE2 GLU 54 HE2 GLU 54 -2.490 12.692 -17.334 411 H ARG 55 H ARG 55 -5.032 8.984 -12.911 412 HA ARG 55 HA ARG 55 -6.849 10.835 -11.680 413 HB2 ARG 55 HB2 ARG 55 -7.740 9.535 -13.447 414 HB3 ARG 55 HB1 ARG 55 -7.140 8.028 -12.735 415 HG2 ARG 55 HG1 ARG 55 -9.577 8.283 -12.502 416 HG3 ARG 55 HG2 ARG 55 -8.743 8.177 -10.942 417 HD2 ARG 55 HD1 ARG 55 -9.540 10.160 -10.305 418 HD3 ARG 55 HD2 ARG 55 -8.904 10.918 -11.773 419 HE ARG 55 HE ARG 55 -11.275 9.507 -12.373 420 HH11 ARG 55 1HH1 ARG 55 -10.148 12.382 -10.767 421 HH12 ARG 55 2HH1 ARG 55 -11.615 13.264 -11.036 422 HH21 ARG 55 1HH2 ARG 55 -13.211 10.657 -12.734 423 HH22 ARG 55 2HH2 ARG 55 -13.357 12.282 -12.154 424 H THR 56 H THR 56 -5.135 7.939 -10.711 425 HA THR 56 HA THR 56 -6.590 7.548 -8.280 426 HB THR 56 HB THR 56 -4.991 5.863 -7.737 427 HG1 THR 56 HG1 THR 56 -2.984 6.457 -8.119 428 HG21 THR 56 HG21 THR 56 -4.717 5.266 -10.536 429 HG22 THR 56 HG22 THR 56 -6.317 5.933 -10.212 430 HG23 THR 56 HG23 THR 56 -5.760 4.511 -9.332 431 H ARG 57 H ARG 57 -3.411 8.931 -9.071 432 HA ARG 57 HA ARG 57 -2.539 9.513 -6.507 433 HB2 ARG 57 HB2 ARG 57 -1.027 11.082 -7.483 434 HB3 ARG 57 HB1 ARG 57 -1.216 9.744 -8.626 435 HG2 ARG 57 HG1 ARG 57 -2.579 11.019 -10.075 436 HG3 ARG 57 HG2 ARG 57 -2.797 12.285 -8.855 437 HD2 ARG 57 HD1 ARG 57 -1.193 12.911 -10.653 438 HD3 ARG 57 HD2 ARG 57 -0.495 12.941 -9.029 439 HE ARG 57 HE ARG 57 -0.032 10.421 -10.197 440 HH11 ARG 57 1HH1 ARG 57 0.964 13.746 -10.458 441 HH12 ARG 57 2HH1 ARG 57 2.538 13.364 -11.071 442 HH21 ARG 57 1HH2 ARG 57 2.038 9.903 -11.003 443 HH22 ARG 57 2HH2 ARG 57 3.148 11.177 -11.382 444 H GLN 58 H GLN 58 -4.962 11.082 -8.434 445 HA GLN 58 HA GLN 58 -5.050 13.569 -7.124 446 HB2 GLN 58 HB2 GLN 58 -7.054 11.979 -8.706 447 HB3 GLN 58 HB1 GLN 58 -7.505 13.512 -7.944 448 HG2 GLN 58 HG1 GLN 58 -5.210 13.208 -9.877 449 HG3 GLN 58 HG2 GLN 58 -6.847 13.694 -10.338 450 HE21 GLN 58 HE21 GLN 58 -3.993 14.610 -8.547 451 HE22 GLN 58 HE22 GLN 58 -4.352 16.297 -8.457 452 H LEU 59 H LEU 59 -6.658 10.494 -6.463 453 HA LEU 59 HA LEU 59 -8.001 11.625 -4.137 454 HB2 LEU 59 HB2 LEU 59 -8.054 8.753 -5.054 455 HB3 LEU 59 HB1 LEU 59 -9.211 9.594 -4.008 456 HG LEU 59 HG LEU 59 -9.091 10.872 -6.585 457 HD11 LEU 59 HD11 LEU 59 -9.645 7.911 -6.563 458 HD12 LEU 59 HD12 LEU 59 -8.411 8.762 -7.490 459 HD13 LEU 59 HD13 LEU 59 -10.117 9.004 -7.864 460 HD21 LEU 59 HD21 LEU 59 -10.887 10.883 -4.769 461 HD22 LEU 59 HD22 LEU 59 -11.373 9.313 -5.409 462 HD23 LEU 59 HD23 LEU 59 -11.427 10.742 -6.442 463 H ASP 60 H ASP 60 -4.988 10.940 -4.538 464 HA ASP 60 HA ASP 60 -3.263 10.337 -3.183 465 HB2 ASP 60 HB2 ASP 60 -5.224 9.943 -0.927 466 HB3 ASP 60 HB1 ASP 60 -3.538 10.473 -0.847 467 HD2 ASP 60 HD2 ASP 60 -6.073 13.260 -0.766 468 H ILE 61 H ILE 61 -3.316 8.386 -4.573 469 HA ILE 61 HA ILE 61 -3.796 5.991 -2.931 470 HB ILE 61 HB ILE 61 -4.203 6.071 -5.918 471 HG12 ILE 61 HG11 ILE 61 -6.324 6.070 -3.756 472 HG13 ILE 61 HG12 ILE 61 -5.858 7.498 -4.695 473 HG21 ILE 61 HG21 ILE 61 -3.613 3.919 -4.621 474 HG22 ILE 61 HG22 ILE 61 -5.264 4.021 -4.012 475 HG23 ILE 61 HG23 ILE 61 -4.972 3.886 -5.745 476 HD11 ILE 61 HD11 ILE 61 -7.252 6.941 -6.313 477 HD12 ILE 61 HD12 ILE 61 -6.469 5.370 -6.492 478 HD13 ILE 61 HD13 ILE 61 -7.791 5.570 -5.343 479 HA PRO 62 HA PRO 62 0.483 5.254 -3.799 480 HB2 PRO 62 HB2 PRO 62 0.601 2.713 -2.786 481 HB3 PRO 62 HB1 PRO 62 0.536 4.159 -1.779 482 HG2 PRO 62 HG1 PRO 62 -1.683 2.321 -2.615 483 HG3 PRO 62 HG2 PRO 62 -1.327 3.014 -0.989 484 HD2 PRO 62 HD1 PRO 62 -3.257 4.012 -2.616 485 HD3 PRO 62 HD2 PRO 62 -2.302 5.032 -1.527 486 H ASP 63 H ASP 63 1.605 4.426 -5.478 487 HA ASP 63 HA ASP 63 0.229 3.180 -7.619 488 HB2 ASP 63 HB2 ASP 63 2.104 4.633 -8.076 489 HB3 ASP 63 HB1 ASP 63 3.182 3.601 -7.125 490 HD2 ASP 63 HD2 ASP 63 3.977 2.025 -10.057 491 H GLU 64 H GLU 64 1.482 1.925 -4.776 492 HA GLU 64 HA GLU 64 2.377 -0.611 -5.764 493 HB2 GLU 64 HB2 GLU 64 1.510 0.018 -2.940 494 HB3 GLU 64 HB1 GLU 64 2.637 -1.237 -3.480 495 HG2 GLU 64 HG1 GLU 64 4.096 0.690 -4.334 496 HG3 GLU 64 HG2 GLU 64 3.070 1.721 -3.324 497 HE2 GLU 64 HE2 GLU 64 5.933 -0.219 -1.597 498 H LYS 65 H LYS 65 -0.641 0.708 -4.585 499 HA LYS 65 HA LYS 65 -1.911 -1.927 -4.706 500 HB2 LYS 65 HB2 LYS 65 -3.671 -1.060 -3.437 501 HB3 LYS 65 HB1 LYS 65 -2.236 -0.268 -2.765 502 HG2 LYS 65 HG1 LYS 65 -2.725 1.711 -4.204 503 HG3 LYS 65 HG2 LYS 65 -4.243 0.923 -4.665 504 HD2 LYS 65 HD1 LYS 65 -3.421 1.652 -1.844 505 HD3 LYS 65 HD2 LYS 65 -4.580 2.537 -2.851 506 HE2 LYS 65 HE1 LYS 65 -6.157 1.256 -1.904 507 HE3 LYS 65 HE2 LYS 65 -5.544 -0.031 -2.952 508 HZ1 LYS 65 3HZ LYS 65 -5.724 -0.398 -0.401 509 HZ2 LYS 65 1HZ LYS 65 -4.246 0.423 -0.357 510 HZ3 LYS 65 2HZ LYS 65 -4.393 -1.007 -1.248 511 H THR 66 H THR 66 -1.838 1.174 -6.305 512 HA THR 66 HA THR 66 -4.178 0.797 -7.882 513 HB THR 66 HB THR 66 -1.809 2.591 -8.439 514 HG1 THR 66 HG1 THR 66 -2.558 3.579 -6.719 515 HG21 THR 66 HG21 THR 66 -4.658 2.843 -9.399 516 HG22 THR 66 HG22 THR 66 -3.354 2.145 -10.360 517 HG23 THR 66 HG23 THR 66 -3.277 3.836 -9.865 518 H MET 67 H MET 67 -0.821 -0.096 -8.231 519 HA MET 67 HA MET 67 -0.606 -0.539 -10.942 520 HB2 MET 67 HB2 MET 67 0.710 -1.526 -8.522 521 HB3 MET 67 HB1 MET 67 0.741 -2.693 -9.854 522 HG2 MET 67 HG1 MET 67 1.467 0.101 -10.524 523 HG3 MET 67 HG2 MET 67 2.598 -0.806 -9.516 524 HE1 MET 67 HE1 MET 67 0.721 -0.333 -12.558 525 HE2 MET 67 HE2 MET 67 1.868 -0.798 -13.815 526 HE3 MET 67 HE3 MET 67 0.656 -1.952 -13.255 527 HA PRO 68 HA PRO 68 -2.376 -4.998 -10.408 528 HB2 PRO 68 HB2 PRO 68 -3.475 -5.650 -7.985 529 HB3 PRO 68 HB1 PRO 68 -1.770 -5.875 -8.373 530 HG2 PRO 68 HG1 PRO 68 -3.105 -3.628 -6.902 531 HG3 PRO 68 HG2 PRO 68 -1.595 -4.525 -6.488 532 HD2 PRO 68 HD1 PRO 68 -1.570 -2.065 -7.636 533 HD3 PRO 68 HD2 PRO 68 -0.339 -3.292 -7.977 534 H VAL 69 H VAL 69 -3.872 -2.164 -9.173 535 HA VAL 69 HA VAL 69 -6.583 -3.118 -9.382 536 HB VAL 69 HB VAL 69 -5.385 -0.399 -8.909 537 HG11 VAL 69 HG11 VAL 69 -7.230 0.345 -10.020 538 HG12 VAL 69 HG12 VAL 69 -8.160 -1.116 -9.683 539 HG13 VAL 69 HG13 VAL 69 -7.944 0.102 -8.426 540 HG21 VAL 69 HG21 VAL 69 -7.354 -1.518 -7.052 541 HG22 VAL 69 HG22 VAL 69 -5.879 -2.473 -7.207 542 HG23 VAL 69 HG23 VAL 69 -5.785 -0.777 -6.733 543 H LEU 70 H LEU 70 -4.701 -0.653 -11.150 544 HA LEU 70 HA LEU 70 -6.570 -0.211 -13.177 545 HB2 LEU 70 HB2 LEU 70 -4.731 0.759 -14.454 546 HB3 LEU 70 HB1 LEU 70 -4.701 1.281 -12.760 547 HG LEU 70 HG LEU 70 -2.991 -0.773 -12.598 548 HD11 LEU 70 HD11 LEU 70 -1.658 0.001 -14.920 549 HD12 LEU 70 HD12 LEU 70 -3.319 -0.311 -15.421 550 HD13 LEU 70 HD13 LEU 70 -2.401 -1.563 -14.585 551 HD21 LEU 70 HD21 LEU 70 -2.261 1.249 -11.772 552 HD22 LEU 70 HD22 LEU 70 -2.602 2.110 -13.272 553 HD23 LEU 70 HD23 LEU 70 -1.203 1.039 -13.167 554 H MET 71 H MET 71 -3.830 -2.463 -13.040 555 HA MET 71 HA MET 71 -4.017 -3.470 -15.636 556 HB2 MET 71 HB2 MET 71 -2.748 -4.261 -13.116 557 HB3 MET 71 HB1 MET 71 -3.184 -5.634 -14.144 558 HG2 MET 71 HG1 MET 71 -1.509 -3.274 -15.009 559 HG3 MET 71 HG2 MET 71 -0.891 -4.857 -14.529 560 HE1 MET 71 HE1 MET 71 -1.613 -3.411 -18.477 561 HE2 MET 71 HE2 MET 71 -3.217 -3.265 -17.762 562 HE3 MET 71 HE3 MET 71 -1.818 -2.573 -16.939 563 H LYS 72 H LYS 72 -5.978 -4.041 -12.843 564 HA LYS 72 HA LYS 72 -7.111 -6.517 -13.619 565 HB2 LYS 72 HB2 LYS 72 -7.171 -5.461 -11.316 566 HB3 LYS 72 HB1 LYS 72 -8.447 -4.400 -11.933 567 HG2 LYS 72 HG1 LYS 72 -10.005 -6.072 -12.036 568 HG3 LYS 72 HG2 LYS 72 -8.781 -7.336 -12.257 569 HD2 LYS 72 HD1 LYS 72 -9.123 -5.801 -9.677 570 HD3 LYS 72 HD2 LYS 72 -9.954 -7.328 -10.022 571 HE2 LYS 72 HE1 LYS 72 -7.537 -8.187 -10.582 572 HE3 LYS 72 HE2 LYS 72 -7.045 -6.811 -9.584 573 HZ1 LYS 72 3HZ LYS 72 -8.677 -7.754 -7.883 574 HZ2 LYS 72 1HZ LYS 72 -7.208 -8.566 -8.095 575 HZ3 LYS 72 2HZ LYS 72 -8.620 -9.179 -8.793 576 H LEU 73 H LEU 73 -7.792 -3.200 -14.451 577 HA LEU 73 HA LEU 73 -10.365 -3.712 -15.598 578 HB2 LEU 73 HB2 LEU 73 -8.683 -1.371 -16.394 579 HB3 LEU 73 HB1 LEU 73 -10.432 -1.471 -16.128 580 HG LEU 73 HG LEU 73 -8.287 -1.361 -14.012 581 HD11 LEU 73 HD11 LEU 73 -10.404 0.571 -14.926 582 HD12 LEU 73 HD12 LEU 73 -8.656 0.794 -14.934 583 HD13 LEU 73 HD13 LEU 73 -9.529 0.733 -13.404 584 HD21 LEU 73 HD21 LEU 73 -10.284 -1.215 -12.466 585 HD22 LEU 73 HD22 LEU 73 -9.944 -2.805 -13.150 586 HD23 LEU 73 HD23 LEU 73 -11.252 -1.821 -13.809 587 H LEU 74 H LEU 74 -7.080 -3.341 -16.858 588 HA LEU 74 HA LEU 74 -7.783 -3.517 -19.596 589 HB2 LEU 74 HB2 LEU 74 -5.208 -3.999 -18.104 590 HB3 LEU 74 HB1 LEU 74 -5.339 -4.141 -19.866 591 HG LEU 74 HG LEU 74 -4.408 -2.005 -19.364 592 HD11 LEU 74 HD11 LEU 74 -6.942 -0.807 -19.879 593 HD12 LEU 74 HD12 LEU 74 -6.846 -2.340 -20.744 594 HD13 LEU 74 HD13 LEU 74 -5.610 -1.108 -20.994 595 HD21 LEU 74 HD21 LEU 74 -5.371 -0.415 -17.880 596 HD22 LEU 74 HD22 LEU 74 -5.275 -1.946 -17.009 597 HD23 LEU 74 HD23 LEU 74 -6.819 -1.398 -17.665 598 H GLU 75 H GLU 75 -7.376 -5.870 -17.104 599 HA GLU 75 HA GLU 75 -6.731 -8.138 -18.604 600 HB2 GLU 75 HB2 GLU 75 -8.206 -7.717 -16.019 601 HB3 GLU 75 HB1 GLU 75 -8.054 -9.337 -16.717 602 HG2 GLU 75 HG1 GLU 75 -5.606 -7.661 -16.356 603 HG3 GLU 75 HG2 GLU 75 -6.325 -8.483 -14.964 604 HE2 GLU 75 HE2 GLU 75 -5.717 -11.615 -16.747 605 H GLU 76 H GLU 76 -9.947 -6.982 -17.584 606 HA GLU 76 HA GLU 76 -11.300 -8.909 -19.228 607 HB2 GLU 76 HB2 GLU 76 -12.491 -6.451 -17.937 608 HB3 GLU 76 HB1 GLU 76 -13.331 -7.930 -18.428 609 HG2 GLU 76 HG1 GLU 76 -11.729 -9.084 -16.719 610 HG3 GLU 76 HG2 GLU 76 -11.582 -7.448 -16.064 611 HE2 GLU 76 HE2 GLU 76 -15.352 -8.595 -16.009 612 H ALA 77 H ALA 77 -10.310 -5.577 -19.527 613 HA ALA 77 HA ALA 77 -11.883 -5.119 -21.911 614 HB1 ALA 77 HB1 ALA 77 -11.371 -3.332 -20.236 615 HB2 ALA 77 HB2 ALA 77 -10.979 -2.914 -21.904 616 HB3 ALA 77 HB3 ALA 77 -9.696 -3.380 -20.787 617 H GLY 78 H GLY 78 -9.284 -6.962 -21.407 618 HA2 GLY 78 HA2 GLY 78 -7.575 -7.763 -22.714 619 HA3 GLY 78 3HA GLY 78 -8.577 -7.273 -24.073 620 H GLY 79 H GLY 79 -7.504 -4.882 -21.802 621 HA2 GLY 79 HA2 GLY 79 -5.680 -3.411 -21.909 622 HA3 GLY 79 3HA GLY 79 -5.205 -4.146 -23.432 623 H ASN 80 H ASN 80 -8.381 -2.845 -22.586 624 HA ASN 80 HA ASN 80 -8.019 -0.837 -24.712 625 HB2 ASN 80 HB2 ASN 80 -9.817 -2.836 -24.782 626 HB3 ASN 80 HB1 ASN 80 -10.760 -1.634 -23.895 627 HD21 ASN 80 HD21 ASN 80 -10.975 0.502 -24.872 628 HD22 ASN 80 HD22 ASN 80 -11.047 0.622 -26.594 629 H TRP 81 H TRP 81 -7.527 1.012 -23.688 630 HA TRP 81 HA TRP 81 -8.692 1.705 -21.146 631 HB2 TRP 81 HB2 TRP 81 -6.962 3.341 -23.024 632 HB3 TRP 81 HB1 TRP 81 -7.377 3.779 -21.366 633 HD1 TRP 81 HD1 TRP 81 -5.330 1.127 -23.278 634 HE1 TRP 81 HE1 TRP 81 -3.513 0.221 -21.697 635 HE3 TRP 81 HE3 TRP 81 -6.719 3.530 -18.986 636 HZ2 TRP 81 2HZ TRP 81 -2.767 0.489 -18.988 637 HZ3 TRP 81 3HZ TRP 81 -5.401 3.151 -16.943 638 HH2 TRP 81 HH TRP 81 -3.468 1.661 -16.945 639 H SER 82 H SER 82 -9.453 2.210 -24.453 640 HA SER 82 HA SER 82 -10.773 4.631 -24.471 641 HB2 SER 82 HB2 SER 82 -10.372 2.819 -26.353 642 HB3 SER 82 HB1 SER 82 -12.010 2.313 -25.905 643 HG SER 82 HG SER 82 -11.913 3.919 -27.601 644 H TYR 83 H TYR 83 -12.185 1.440 -23.747 645 HA TYR 83 HA TYR 83 -14.688 2.584 -22.929 646 HB2 TYR 83 HB2 TYR 83 -14.954 0.457 -23.822 647 HB3 TYR 83 HB1 TYR 83 -13.530 -0.179 -22.994 648 HD1 TYR 83 HD1 TYR 83 -17.091 0.603 -22.641 649 HD2 TYR 83 HD2 TYR 83 -13.637 -0.931 -20.686 650 HE1 TYR 83 HE1 TYR 83 -18.515 -0.314 -20.858 651 HE2 TYR 83 HE2 TYR 83 -15.052 -1.854 -18.898 652 HH TYR 83 HH TYR 83 -17.337 -2.521 -18.518 653 H ILE 84 H ILE 84 -11.876 1.195 -21.295 654 HA ILE 84 HA ILE 84 -12.859 1.204 -18.683 655 HB ILE 84 HB ILE 84 -10.031 1.594 -19.661 656 HG12 ILE 84 HG11 ILE 84 -11.390 -0.850 -18.505 657 HG13 ILE 84 HG12 ILE 84 -11.190 -0.556 -20.240 658 HG21 ILE 84 HG21 ILE 84 -11.176 1.640 -16.964 659 HG22 ILE 84 HG22 ILE 84 -9.808 0.545 -17.162 660 HG23 ILE 84 HG23 ILE 84 -9.632 2.256 -17.554 661 HD11 ILE 84 HD11 ILE 84 -9.499 -2.075 -19.025 662 HD12 ILE 84 HD12 ILE 84 -8.905 -0.876 -20.174 663 HD13 ILE 84 HD13 ILE 84 -8.807 -0.563 -18.442 664 H LYS 85 H LYS 85 -11.752 3.800 -20.694 665 HA LYS 85 HA LYS 85 -11.660 5.652 -18.430 666 HB2 LYS 85 HB2 LYS 85 -10.385 7.056 -19.710 667 HB3 LYS 85 HB1 LYS 85 -9.969 5.506 -20.462 668 HG2 LYS 85 HG1 LYS 85 -12.064 6.124 -21.988 669 HG3 LYS 85 HG2 LYS 85 -11.568 7.760 -21.521 670 HD2 LYS 85 HD1 LYS 85 -9.913 5.660 -22.926 671 HD3 LYS 85 HD2 LYS 85 -10.442 7.229 -23.555 672 HE2 LYS 85 HE1 LYS 85 -8.442 6.723 -21.342 673 HE3 LYS 85 HE2 LYS 85 -8.129 7.401 -22.947 674 HZ1 LYS 85 3HZ LYS 85 -8.369 9.368 -21.961 675 HZ2 LYS 85 1HZ LYS 85 -9.072 8.702 -20.573 676 HZ3 LYS 85 2HZ LYS 85 -10.031 9.050 -21.923 677 H LEU 86 H LEU 86 -14.043 4.382 -20.095 678 HA LEU 86 HA LEU 86 -15.463 6.531 -21.225 679 HB2 LEU 86 HB2 LEU 86 -15.923 4.096 -21.572 680 HB3 LEU 86 HB1 LEU 86 -16.628 4.064 -19.945 681 HG LEU 86 HG LEU 86 -18.022 6.096 -21.160 682 HD11 LEU 86 HD11 LEU 86 -17.893 3.886 -23.184 683 HD12 LEU 86 HD12 LEU 86 -16.879 5.323 -23.306 684 HD13 LEU 86 HD13 LEU 86 -18.635 5.480 -23.331 685 HD21 LEU 86 HD21 LEU 86 -18.829 3.196 -21.162 686 HD22 LEU 86 HD22 LEU 86 -19.879 4.610 -21.072 687 HD23 LEU 86 HD23 LEU 86 -18.821 4.208 -19.718 688 H ASP 87 H ASP 87 -14.807 5.744 -17.982 689 HA ASP 87 HA ASP 87 -16.696 7.810 -17.097 690 HB2 ASP 87 HB2 ASP 87 -16.200 5.223 -15.600 691 HB3 ASP 87 HB1 ASP 87 -17.317 6.517 -15.143 692 HD2 ASP 87 HD2 ASP 87 -18.437 3.962 -17.942 693 H ASN 88 H ASN 88 -13.777 7.718 -17.634 694 HA ASN 88 HA ASN 88 -11.899 8.654 -16.752 695 HB2 ASN 88 HB2 ASN 88 -13.887 10.049 -15.582 696 HB3 ASN 88 HB1 ASN 88 -13.155 9.318 -14.147 697 HD21 ASN 88 HD21 ASN 88 -10.547 9.307 -14.593 698 HD22 ASN 88 HD22 ASN 88 -9.938 10.905 -14.837 699 H TYR 89 H TYR 89 -12.331 5.900 -16.454 700 HA TYR 89 HA TYR 89 -11.470 4.080 -15.397 701 HB2 TYR 89 HB2 TYR 89 -9.820 6.111 -13.869 702 HB3 TYR 89 HB1 TYR 89 -9.479 4.385 -14.016 703 HD1 TYR 89 HD2 TYR 89 -10.239 4.191 -17.002 704 HD2 TYR 89 HD1 TYR 89 -7.739 6.856 -14.822 705 HE1 TYR 89 HE2 TYR 89 -8.913 4.598 -19.032 706 HE2 TYR 89 HE1 TYR 89 -6.406 7.272 -16.847 707 HH TYR 89 HH TYR 89 -5.920 6.343 -18.954 708 H THR 90 H THR 90 -13.878 5.092 -14.408 709 HA THR 90 HA THR 90 -14.092 5.548 -11.698 710 HB THR 90 HB THR 90 -15.955 4.034 -13.530 711 HG1 THR 90 HG1 THR 90 -15.389 6.534 -13.439 712 HG21 THR 90 HG21 THR 90 -16.166 4.667 -10.624 713 HG22 THR 90 HG22 THR 90 -16.730 3.252 -11.512 714 HG23 THR 90 HG23 THR 90 -17.616 4.773 -11.621 715 H ALA 91 H ALA 91 -13.542 2.526 -13.386 716 HA ALA 91 HA ALA 91 -14.157 0.667 -11.442 717 HB1 ALA 91 HB1 ALA 91 -12.492 -0.789 -12.505 718 HB2 ALA 91 HB2 ALA 91 -11.852 0.599 -13.385 719 HB3 ALA 91 HB3 ALA 91 -13.496 0.041 -13.694 720 H LEU 92 H LEU 92 -11.319 2.726 -11.711 721 HA LEU 92 HA LEU 92 -9.794 1.460 -9.685 722 HB2 LEU 92 HB2 LEU 92 -8.269 3.177 -9.928 723 HB3 LEU 92 HB1 LEU 92 -9.065 3.132 -11.511 724 HG LEU 92 HG LEU 92 -10.587 4.994 -10.386 725 HD11 LEU 92 HD11 LEU 92 -9.816 5.382 -8.300 726 HD12 LEU 92 HD12 LEU 92 -8.683 6.425 -9.161 727 HD13 LEU 92 HD13 LEU 92 -8.191 4.804 -8.671 728 HD21 LEU 92 HD21 LEU 92 -9.631 6.305 -11.918 729 HD22 LEU 92 HD22 LEU 92 -8.596 4.923 -12.281 730 HD23 LEU 92 HD23 LEU 92 -8.041 6.173 -11.167 731 H VAL 93 H VAL 93 -12.215 3.999 -9.668 732 HA VAL 93 HA VAL 93 -11.796 4.950 -7.053 733 HB VAL 93 HB VAL 93 -14.246 4.932 -8.807 734 HG11 VAL 93 HG11 VAL 93 -15.051 6.696 -7.110 735 HG12 VAL 93 HG12 VAL 93 -15.225 4.989 -6.696 736 HG13 VAL 93 HG13 VAL 93 -13.907 5.936 -6.004 737 HG21 VAL 93 HG21 VAL 93 -11.925 6.527 -8.703 738 HG22 VAL 93 HG22 VAL 93 -13.370 6.777 -9.682 739 HG23 VAL 93 HG23 VAL 93 -13.249 7.513 -8.084 740 H ASP 94 H ASP 94 -14.066 2.505 -8.295 741 HA ASP 94 HA ASP 94 -15.033 1.821 -5.691 742 HB2 ASP 94 HB2 ASP 94 -16.225 1.553 -7.968 743 HB3 ASP 94 HB1 ASP 94 -15.279 0.065 -8.123 744 HD2 ASP 94 HD2 ASP 94 -18.068 0.143 -5.292 745 H ALA 95 H ALA 95 -12.473 0.697 -7.769 746 HA ALA 95 HA ALA 95 -12.016 -1.781 -6.442 747 HB1 ALA 95 HB1 ALA 95 -9.698 -1.477 -7.601 748 HB2 ALA 95 HB2 ALA 95 -10.500 -0.133 -8.416 749 HB3 ALA 95 HB3 ALA 95 -11.141 -1.769 -8.573 750 H ILE 96 H ILE 96 -10.191 1.287 -6.405 751 HA ILE 96 HA ILE 96 -8.420 0.566 -4.359 752 HB ILE 96 HB ILE 96 -9.396 3.312 -5.149 753 HG12 ILE 96 HG11 ILE 96 -8.281 2.041 -6.943 754 HG13 ILE 96 HG12 ILE 96 -7.324 3.441 -6.429 755 HG21 ILE 96 HG21 ILE 96 -8.490 3.399 -2.917 756 HG22 ILE 96 HG22 ILE 96 -7.064 2.495 -3.423 757 HG23 ILE 96 HG23 ILE 96 -7.340 4.125 -4.039 758 HD11 ILE 96 HD11 ILE 96 -6.833 0.599 -5.572 759 HD12 ILE 96 HD12 ILE 96 -5.922 1.482 -6.797 760 HD13 ILE 96 HD13 ILE 96 -5.875 2.008 -5.114 761 H TYR 97 H TYR 97 -11.631 1.995 -4.256 762 HA TYR 97 HA TYR 97 -11.673 2.773 -1.568 763 HB2 TYR 97 HB2 TYR 97 -13.693 2.190 -3.659 764 HB3 TYR 97 HB1 TYR 97 -14.263 2.114 -1.989 765 HD1 TYR 97 HD1 TYR 97 -11.715 4.406 -3.439 766 HD2 TYR 97 HD2 TYR 97 -15.600 4.015 -1.751 767 HE1 TYR 97 HE1 TYR 97 -11.928 6.856 -3.378 768 HE2 TYR 97 HE2 TYR 97 -15.824 6.464 -1.686 769 HH TYR 97 HH TYR 97 -14.795 8.442 -2.980 770 H SER 98 H SER 98 -12.209 -0.339 -3.093 771 HA SER 98 HA SER 98 -13.196 -1.613 -0.722 772 HB2 SER 98 HB2 SER 98 -13.895 -2.538 -2.815 773 HB3 SER 98 HB1 SER 98 -12.218 -2.687 -3.373 774 HG SER 98 HG SER 98 -11.970 -4.460 -2.231 775 H VAL 99 H VAL 99 -10.146 -1.880 -2.553 776 HA VAL 99 HA VAL 99 -8.811 -3.540 -0.742 777 HB VAL 99 HB VAL 99 -7.520 -1.454 -2.502 778 HG11 VAL 99 HG11 VAL 99 -6.125 -2.615 -0.755 779 HG12 VAL 99 HG12 VAL 99 -6.436 -4.121 -1.622 780 HG13 VAL 99 HG13 VAL 99 -5.572 -2.804 -2.419 781 HG21 VAL 99 HG21 VAL 99 -8.923 -3.950 -3.154 782 HG22 VAL 99 HG22 VAL 99 -8.567 -2.551 -4.165 783 HG23 VAL 99 HG23 VAL 99 -7.329 -3.777 -3.889 784 H GLU 100 H GLU 100 -8.600 0.003 -1.097 785 HA GLU 100 HA GLU 100 -6.858 0.548 0.967 786 HB2 GLU 100 HB2 GLU 100 -7.573 2.772 0.877 787 HB3 GLU 100 HB1 GLU 100 -7.917 2.146 -0.743 788 HG2 GLU 100 HG1 GLU 100 -10.273 1.770 -0.056 789 HG3 GLU 100 HG2 GLU 100 -9.895 2.546 1.489 790 HE2 GLU 100 HE2 GLU 100 -9.236 5.284 -1.169 791 H ASP 101 H ASP 101 -10.244 -0.284 1.118 792 HA ASP 101 HA ASP 101 -10.733 0.528 3.781 793 HB2 ASP 101 HB2 ASP 101 -12.473 -0.036 2.039 794 HB3 ASP 101 HB1 ASP 101 -12.093 -1.740 2.320 795 HD2 ASP 101 HD2 ASP 101 -13.463 -0.139 5.642 796 H GLU 102 H GLU 102 -9.943 -2.665 2.409 797 HA GLU 102 HA GLU 102 -9.245 -3.573 5.118 798 HB2 GLU 102 HB2 GLU 102 -9.795 -5.220 2.638 799 HB3 GLU 102 HB1 GLU 102 -9.490 -5.849 4.265 800 HG2 GLU 102 HG1 GLU 102 -11.750 -3.945 3.874 801 HG3 GLU 102 HG2 GLU 102 -11.929 -5.617 3.324 802 HE2 GLU 102 HE2 GLU 102 -11.967 -4.884 7.196 803 H ASN 103 H ASN 103 -7.153 -3.455 5.565 804 HA ASN 103 HA ASN 103 -5.222 -4.000 3.407 805 HB2 ASN 103 HB2 ASN 103 -5.158 -2.062 5.704 806 HB3 ASN 103 HB1 ASN 103 -3.649 -2.656 5.000 807 HD21 ASN 103 HD21 ASN 103 -6.783 -1.603 3.703 808 HD22 ASN 103 HD22 ASN 103 -6.125 -0.492 2.556 809 H LYS 104 H LYS 104 -6.034 -4.514 6.789 810 HA LYS 104 HA LYS 104 -3.754 -6.127 7.377 811 HB2 LYS 104 HB2 LYS 104 -4.967 -6.711 9.443 812 HB3 LYS 104 HB1 LYS 104 -4.935 -4.965 9.157 813 HG2 LYS 104 HG1 LYS 104 -7.227 -5.092 8.242 814 HG3 LYS 104 HG2 LYS 104 -7.252 -6.818 8.644 815 HD2 LYS 104 HD1 LYS 104 -8.216 -6.052 10.552 816 HD3 LYS 104 HD2 LYS 104 -6.521 -5.839 11.027 817 HE2 LYS 104 HE1 LYS 104 -6.650 -3.487 10.144 818 HE3 LYS 104 HE2 LYS 104 -8.388 -3.743 9.926 819 HZ1 LYS 104 3HZ LYS 104 -7.401 -4.416 12.557 820 HZ2 LYS 104 1HZ LYS 104 -8.775 -3.538 12.107 821 HZ3 LYS 104 2HZ LYS 104 -7.266 -2.778 12.161 822 H GLN 105 H GLN 105 -7.091 -6.790 6.424 823 HA GLN 105 HA GLN 105 -6.432 -9.649 6.239 824 HB2 GLN 105 HB2 GLN 105 -8.891 -10.004 6.129 825 HB3 GLN 105 HB1 GLN 105 -8.354 -9.239 7.633 826 HG2 GLN 105 HG1 GLN 105 -9.172 -7.426 5.439 827 HG3 GLN 105 HG2 GLN 105 -10.444 -8.375 6.221 828 HE21 GLN 105 HE21 GLN 105 -9.268 -5.454 6.243 829 HE22 GLN 105 HE22 GLN 105 -9.379 -5.037 7.915 830 H SER 106 H SER 106 -5.460 -7.883 4.274 831 HA SER 106 HA SER 106 -6.232 -9.192 1.923 832 HB2 SER 106 HB2 SER 106 -8.230 -8.119 1.623 833 HB3 SER 106 HB1 SER 106 -7.728 -6.706 2.567 834 HG SER 106 HG SER 106 -7.660 -7.065 -0.100 835 H GLU 107 H GLU 107 -4.774 -8.826 0.316 836 HA GLU 107 HA GLU 107 -2.678 -6.858 0.902 837 HB2 GLU 107 HB2 GLU 107 -2.197 -9.369 0.601 838 HB3 GLU 107 HB1 GLU 107 -2.473 -9.073 -1.123 839 HG2 GLU 107 HG1 GLU 107 -0.230 -8.781 -1.092 840 HG3 GLU 107 HG2 GLU 107 -0.725 -7.131 -0.689 841 HE2 GLU 107 HE2 GLU 107 0.721 -7.310 2.419 842 H GLY 108 H GLY 108 -3.992 -8.311 -2.082 843 HA2 GLY 108 HA2 GLY 108 -5.217 -6.271 -3.312 844 HA3 GLY 108 3HA GLY 108 -3.530 -5.814 -3.495 845 H SER 109 H SER 109 -2.345 -8.265 -3.938 846 HA SER 109 HA SER 109 -3.743 -9.572 -6.119 847 HB2 SER 109 HB2 SER 109 -2.028 -9.141 -7.790 848 HB3 SER 109 HB1 SER 109 -2.662 -7.601 -7.183 849 HG SER 109 HG SER 109 -0.689 -7.131 -6.676 Start of MODEL 3 1 H1 MET 1 H MET 1 29.889 -53.068 39.459 2 HA MET 1 HA MET 1 28.216 -51.208 39.320 3 HB2 MET 1 HB2 MET 1 28.772 -50.470 37.064 4 HB3 MET 1 HB1 MET 1 30.198 -51.139 37.872 5 HG2 MET 1 HG1 MET 1 28.567 -52.957 36.166 6 HG3 MET 1 HG2 MET 1 29.598 -51.756 35.384 7 HE1 MET 1 HE1 MET 1 30.853 -55.726 36.010 8 HE2 MET 1 HE2 MET 1 29.321 -54.947 35.618 9 HE3 MET 1 HE3 MET 1 30.714 -54.734 34.558 10 H GLY 2 H GLY 2 26.503 -53.337 39.620 11 HA2 GLY 2 HA2 GLY 2 24.881 -53.582 37.224 12 HA3 GLY 2 3HA GLY 2 24.582 -54.358 38.773 13 H SER 3 H SER 3 24.128 -52.616 40.575 14 HA SER 3 HA SER 3 22.026 -50.869 39.487 15 HB2 SER 3 HB2 SER 3 22.305 -52.081 42.256 16 HB3 SER 3 HB1 SER 3 20.988 -51.015 41.733 17 HG SER 3 HG SER 3 20.313 -53.136 41.515 18 H SER 4 H SER 4 22.753 -48.852 39.290 19 HA SER 4 HA SER 4 24.785 -47.787 41.034 20 HB2 SER 4 HB2 SER 4 24.937 -47.076 38.773 21 HB3 SER 4 HB1 SER 4 23.219 -46.642 38.722 22 HG SER 4 HG SER 4 23.610 -44.834 39.835 23 H HIS 5 H HIS 5 21.317 -47.589 40.715 24 HA HIS 5 HA HIS 5 21.128 -46.327 43.308 25 HB2 HIS 5 HB2 HIS 5 19.822 -44.427 42.623 26 HB3 HIS 5 HB1 HIS 5 21.341 -44.411 41.722 27 HD1 HIS 5 HD1 HIS 5 20.967 -45.900 39.281 28 HD2 HIS 5 HD2 HIS 5 17.804 -43.782 40.944 29 HE1 HIS 5 HE1 HIS 5 19.346 -45.523 37.396 30 HE2 HIS 5 HE2 HIS 5 17.412 -44.230 38.411 31 H HIS 6 H HIS 6 19.130 -46.626 44.301 32 HA HIS 6 HA HIS 6 17.546 -48.770 43.178 33 HB2 HIS 6 HB2 HIS 6 17.487 -47.310 45.822 34 HB3 HIS 6 HB1 HIS 6 16.295 -48.538 45.389 35 HD1 HIS 6 HD1 HIS 6 17.533 -50.930 44.589 36 HD2 HIS 6 HD2 HIS 6 19.573 -48.392 47.170 37 HE1 HIS 6 HE1 HIS 6 19.282 -52.359 45.695 38 HE2 HIS 6 HE2 HIS 6 20.530 -50.809 47.272 39 H HIS 7 H HIS 7 15.657 -48.567 42.162 40 HA HIS 7 HA HIS 7 14.487 -45.896 41.937 41 HB2 HIS 7 HB2 HIS 7 15.074 -47.377 39.921 42 HB3 HIS 7 HB1 HIS 7 13.658 -48.332 40.368 43 HD1 HIS 7 HD1 HIS 7 11.996 -47.762 38.605 44 HD2 HIS 7 HD2 HIS 7 13.810 -44.383 40.204 45 HE1 HIS 7 HE1 HIS 7 10.783 -45.806 37.593 46 HE2 HIS 7 HE2 HIS 7 11.890 -43.739 38.571 47 H HIS 8 H HIS 8 12.535 -45.366 42.732 48 HA HIS 8 HA HIS 8 11.059 -47.466 44.171 49 HB2 HIS 8 HB2 HIS 8 11.036 -44.463 44.571 50 HB3 HIS 8 HB1 HIS 8 10.103 -45.628 45.517 51 HD1 HIS 8 HD1 HIS 8 13.067 -43.744 45.784 52 HD2 HIS 8 HD2 HIS 8 12.055 -47.664 46.719 53 HE1 HIS 8 HE1 HIS 8 14.794 -44.506 47.447 54 HE2 HIS 8 HE2 HIS 8 14.176 -46.901 48.019 55 H HIS 9 H HIS 9 8.951 -47.859 43.736 56 HA HIS 9 HA HIS 9 7.786 -46.407 41.465 57 HB2 HIS 9 HB2 HIS 9 7.248 -49.160 42.592 58 HB3 HIS 9 HB1 HIS 9 6.244 -48.414 41.345 59 HD1 HIS 9 HD1 HIS 9 8.946 -50.676 41.625 60 HD2 HIS 9 HD2 HIS 9 8.030 -47.573 39.020 61 HE1 HIS 9 HE1 HIS 9 10.332 -51.094 39.569 62 HE2 HIS 9 HE2 HIS 9 9.771 -49.198 37.975 63 H HIS 10 H HIS 10 6.493 -44.806 42.099 64 HA HIS 10 HA HIS 10 4.379 -45.412 44.028 65 HB2 HIS 10 HB2 HIS 10 6.397 -44.216 45.107 66 HB3 HIS 10 HB1 HIS 10 5.863 -42.798 44.201 67 HD1 HIS 10 HD1 HIS 10 4.424 -45.238 46.737 68 HD2 HIS 10 HD2 HIS 10 3.985 -41.307 45.465 69 HE1 HIS 10 HE1 HIS 10 2.766 -44.201 48.318 70 HE2 HIS 10 HE2 HIS 10 2.498 -41.798 47.542 71 H SER 11 H SER 11 2.446 -44.468 43.574 72 HA SER 11 HA SER 11 2.348 -42.400 41.500 73 HB2 SER 11 HB2 SER 11 1.066 -45.118 41.397 74 HB3 SER 11 HB1 SER 11 0.282 -43.740 40.606 75 HG SER 11 HG SER 11 2.703 -45.000 39.991 76 H SER 12 H SER 12 0.756 -40.913 41.767 77 HA SER 12 HA SER 12 -1.397 -41.422 43.666 78 HB2 SER 12 HB2 SER 12 -0.947 -39.411 44.976 79 HB3 SER 12 HB1 SER 12 0.458 -40.491 45.022 80 HG SER 12 HG SER 12 0.737 -38.103 44.537 81 H GLY 13 H GLY 13 -3.258 -40.487 43.057 82 HA2 GLY 13 HA2 GLY 13 -3.129 -38.283 41.102 83 HA3 GLY 13 3HA GLY 13 -4.162 -39.676 40.813 84 H LEU 14 H LEU 14 -3.646 -36.852 42.830 85 HA LEU 14 HA LEU 14 -6.195 -37.207 44.176 86 HB2 LEU 14 HB2 LEU 14 -3.976 -36.253 45.159 87 HB3 LEU 14 HB1 LEU 14 -4.504 -34.750 44.382 88 HG LEU 14 HG LEU 14 -6.681 -35.058 45.718 89 HD11 LEU 14 HD11 LEU 14 -6.873 -36.808 47.060 90 HD12 LEU 14 HD12 LEU 14 -5.404 -36.339 47.915 91 HD13 LEU 14 HD13 LEU 14 -5.304 -37.396 46.507 92 HD21 LEU 14 HD21 LEU 14 -5.870 -33.645 47.330 93 HD22 LEU 14 HD22 LEU 14 -4.599 -33.506 46.115 94 HD23 LEU 14 HD23 LEU 14 -4.366 -34.546 47.522 95 H VAL 15 H VAL 15 -4.686 -34.673 42.169 96 HA VAL 15 HA VAL 15 -6.879 -33.040 41.816 97 HB VAL 15 HB VAL 15 -5.833 -32.485 39.548 98 HG11 VAL 15 HG11 VAL 15 -5.241 -30.965 41.144 99 HG12 VAL 15 HG12 VAL 15 -4.581 -32.192 42.227 100 HG13 VAL 15 HG13 VAL 15 -3.658 -31.670 40.818 101 HG21 VAL 15 HG21 VAL 15 -4.659 -34.899 39.749 102 HG22 VAL 15 HG22 VAL 15 -4.010 -33.576 38.780 103 HG23 VAL 15 HG23 VAL 15 -3.376 -33.877 40.398 104 HA PRO 16 HA PRO 16 -9.780 -35.144 39.280 105 HB2 PRO 16 HB2 PRO 16 -10.778 -33.089 37.773 106 HB3 PRO 16 HB1 PRO 16 -11.128 -33.296 39.488 107 HG2 PRO 16 HG1 PRO 16 -9.087 -31.543 38.162 108 HG3 PRO 16 HG2 PRO 16 -10.230 -31.151 39.500 109 HD2 PRO 16 HD1 PRO 16 -7.608 -31.709 39.929 110 HD3 PRO 16 HD2 PRO 16 -8.883 -32.155 41.077 111 H ARG 17 H ARG 17 -9.116 -36.532 37.762 112 HA ARG 17 HA ARG 17 -7.204 -35.989 35.780 113 HB2 ARG 17 HB2 ARG 17 -9.258 -38.168 36.117 114 HB3 ARG 17 HB1 ARG 17 -8.177 -38.120 34.716 115 HG2 ARG 17 HG1 ARG 17 -6.253 -38.033 36.385 116 HG3 ARG 17 HG2 ARG 17 -7.457 -38.485 37.604 117 HD2 ARG 17 HD1 ARG 17 -7.337 -40.100 35.100 118 HD3 ARG 17 HD2 ARG 17 -6.043 -40.301 36.290 119 HE ARG 17 HE ARG 17 -8.654 -40.446 37.458 120 HH11 ARG 17 1HH1 ARG 17 -6.199 -42.241 35.765 121 HH12 ARG 17 2HH1 ARG 17 -6.716 -43.778 36.375 122 HH21 ARG 17 1HH2 ARG 17 -9.345 -42.462 38.269 123 HH22 ARG 17 2HH2 ARG 17 -8.506 -43.902 37.800 124 H GLY 18 H GLY 18 -7.359 -34.841 33.975 125 HA2 GLY 18 HA2 GLY 18 -9.629 -35.024 32.239 126 HA3 GLY 18 3HA GLY 18 -9.571 -33.482 33.082 127 H SER 19 H SER 19 -9.344 -33.967 30.238 128 HA SER 19 HA SER 19 -6.901 -32.474 29.780 129 HB2 SER 19 HB2 SER 19 -7.363 -34.965 28.133 130 HB3 SER 19 HB1 SER 19 -5.905 -33.962 28.233 131 HG SER 19 HG SER 19 -5.295 -35.359 29.677 132 H HIS 20 H HIS 20 -7.365 -30.868 28.439 133 HA HIS 20 HA HIS 20 -9.848 -30.851 26.979 134 HB2 HIS 20 HB2 HIS 20 -9.390 -28.567 26.501 135 HB3 HIS 20 HB1 HIS 20 -8.864 -28.847 28.163 136 HD1 HIS 20 HD1 HIS 20 -6.119 -30.270 27.130 137 HD2 HIS 20 HD2 HIS 20 -7.524 -26.464 26.235 138 HE1 HIS 20 HE1 HIS 20 -4.086 -28.938 26.483 139 HE2 HIS 20 HE2 HIS 20 -4.944 -26.611 25.934 140 H MET 21 H MET 21 -9.479 -29.605 24.675 141 HA MET 21 HA MET 21 -7.603 -31.298 23.159 142 HB2 MET 21 HB2 MET 21 -10.185 -31.731 22.996 143 HB3 MET 21 HB1 MET 21 -10.154 -30.309 21.941 144 HG2 MET 21 HG1 MET 21 -8.406 -31.457 20.561 145 HG3 MET 21 HG2 MET 21 -8.680 -32.898 21.544 146 HE1 MET 21 HE1 MET 21 -10.726 -30.098 20.025 147 HE2 MET 21 HE2 MET 21 -10.266 -30.762 18.458 148 HE3 MET 21 HE3 MET 21 -11.936 -30.889 19.016 149 H ILE 22 H ILE 22 -6.247 -30.272 21.820 150 HA ILE 22 HA ILE 22 -6.798 -27.448 21.184 151 HB ILE 22 HB ILE 22 -5.010 -27.680 22.897 152 HG12 ILE 22 HG11 ILE 22 -3.692 -26.746 20.371 153 HG13 ILE 22 HG12 ILE 22 -5.141 -25.912 20.958 154 HG21 ILE 22 HG21 ILE 22 -3.221 -29.017 22.674 155 HG22 ILE 22 HG22 ILE 22 -4.208 -29.850 21.475 156 HG23 ILE 22 HG23 ILE 22 -3.030 -28.643 20.962 157 HD11 ILE 22 HD11 ILE 22 -2.404 -25.842 21.976 158 HD12 ILE 22 HD12 ILE 22 -3.701 -24.654 22.107 159 HD13 ILE 22 HD13 ILE 22 -3.641 -26.021 23.219 160 H SER 23 H SER 23 -6.070 -26.689 19.174 161 HA SER 23 HA SER 23 -6.285 -28.480 17.036 162 HB2 SER 23 HB2 SER 23 -5.285 -25.641 17.252 163 HB3 SER 23 HB1 SER 23 -5.269 -26.508 15.706 164 HG SER 23 HG SER 23 -7.236 -25.186 16.442 165 H LEU 24 H LEU 24 -3.385 -26.759 18.199 166 HA LEU 24 HA LEU 24 -1.165 -27.217 18.012 167 HB2 LEU 24 HB2 LEU 24 -2.350 -29.446 19.019 168 HB3 LEU 24 HB1 LEU 24 -1.548 -30.101 17.580 169 HG LEU 24 HG LEU 24 -0.094 -30.417 19.441 170 HD11 LEU 24 HD11 LEU 24 1.875 -29.134 18.752 171 HD12 LEU 24 HD12 LEU 24 0.844 -28.072 17.794 172 HD13 LEU 24 HD13 LEU 24 0.994 -29.776 17.366 173 HD21 LEU 24 HD21 LEU 24 -0.919 -28.879 21.039 174 HD22 LEU 24 HD22 LEU 24 -0.580 -27.499 19.994 175 HD23 LEU 24 HD23 LEU 24 0.750 -28.409 20.714 176 H SER 25 H SER 25 -2.480 -26.523 15.629 177 HA SER 25 HA SER 25 -0.650 -27.718 13.706 178 HB2 SER 25 HB2 SER 25 -2.602 -29.135 13.457 179 HB3 SER 25 HB1 SER 25 -3.654 -27.715 13.327 180 HG SER 25 HG SER 25 -2.394 -28.968 11.375 181 H GLY 26 H GLY 26 -0.018 -26.327 12.113 182 HA2 GLY 26 HA2 GLY 26 -0.406 -24.428 10.678 183 HA3 GLY 26 3HA GLY 26 -1.422 -23.742 11.938 184 H LEU 27 H LEU 27 1.879 -25.078 11.970 185 HA LEU 27 HA LEU 27 2.820 -22.470 12.960 186 HB2 LEU 27 HB2 LEU 27 4.118 -23.432 14.624 187 HB3 LEU 27 HB1 LEU 27 2.611 -24.365 14.679 188 HG LEU 27 HG LEU 27 5.139 -25.286 13.312 189 HD11 LEU 27 HD11 LEU 27 5.464 -25.114 15.723 190 HD12 LEU 27 HD12 LEU 27 5.396 -26.800 15.209 191 HD13 LEU 27 HD13 LEU 27 4.002 -26.060 15.996 192 HD21 LEU 27 HD21 LEU 27 3.426 -26.442 12.278 193 HD22 LEU 27 HD22 LEU 27 2.424 -26.466 13.730 194 HD23 LEU 27 HD23 LEU 27 3.839 -27.514 13.616 195 H THR 28 H THR 28 2.857 -24.154 10.340 196 HA THR 28 HA THR 28 5.761 -24.062 9.878 197 HB THR 28 HB THR 28 5.123 -25.346 7.741 198 HG1 THR 28 HG1 THR 28 3.034 -25.588 7.515 199 HG21 THR 28 HG21 THR 28 5.928 -27.098 8.862 200 HG22 THR 28 HG22 THR 28 4.439 -27.244 9.796 201 HG23 THR 28 HG23 THR 28 5.728 -26.174 10.350 202 H SER 29 H SER 29 6.349 -23.472 7.557 203 HA SER 29 HA SER 29 4.577 -21.477 6.377 204 HB2 SER 29 HB2 SER 29 6.076 -20.324 8.063 205 HB3 SER 29 HB1 SER 29 7.446 -20.789 7.038 206 HG SER 29 HG SER 29 6.835 -18.762 6.399 207 H SER 30 H SER 30 5.993 -20.446 4.421 208 HA SER 30 HA SER 30 7.775 -22.223 3.102 209 HB2 SER 30 HB2 SER 30 4.852 -22.335 2.412 210 HB3 SER 30 HB1 SER 30 6.063 -22.562 1.138 211 HG SER 30 HG SER 30 5.640 -24.566 1.962 212 H VAL 31 H VAL 31 7.729 -21.566 0.581 213 HA VAL 31 HA VAL 31 8.137 -18.684 0.603 214 HB VAL 31 HB VAL 31 9.150 -19.045 -1.641 215 HG11 VAL 31 HG11 VAL 31 11.107 -20.376 -0.803 216 HG12 VAL 31 HG12 VAL 31 10.619 -19.032 0.232 217 HG13 VAL 31 HG13 VAL 31 10.179 -20.685 0.665 218 HG21 VAL 31 HG21 VAL 31 7.683 -21.229 -1.877 219 HG22 VAL 31 HG22 VAL 31 9.235 -21.071 -2.698 220 HG23 VAL 31 HG23 VAL 31 9.122 -21.985 -1.194 221 H GLU 32 H GLU 32 5.483 -19.178 0.790 222 HA GLU 32 HA GLU 32 4.184 -19.303 -1.753 223 HB2 GLU 32 HB2 GLU 32 2.155 -18.606 -0.457 224 HB3 GLU 32 HB1 GLU 32 2.963 -20.057 0.160 225 HG2 GLU 32 HG1 GLU 32 3.930 -18.863 1.976 226 HG3 GLU 32 HG2 GLU 32 3.415 -17.312 1.296 227 HE2 GLU 32 HE2 GLU 32 0.979 -18.104 3.796 228 H SER 33 H SER 33 5.568 -16.790 0.164 229 HA SER 33 HA SER 33 4.424 -14.770 -1.651 230 HB2 SER 33 HB2 SER 33 5.552 -14.212 1.101 231 HB3 SER 33 HB1 SER 33 4.552 -13.150 0.093 232 HG SER 33 HG SER 33 2.788 -14.298 0.578 233 H ASP 34 H ASP 34 7.285 -16.217 -0.399 234 HA ASP 34 HA ASP 34 9.159 -14.195 -0.948 235 HB2 ASP 34 HB2 ASP 34 9.524 -16.320 0.396 236 HB3 ASP 34 HB1 ASP 34 9.686 -17.160 -1.151 237 HD2 ASP 34 HD2 ASP 34 12.816 -15.771 -1.752 238 H LEU 35 H LEU 35 7.931 -16.856 -2.943 239 HA LEU 35 HA LEU 35 9.444 -15.862 -5.236 240 HB2 LEU 35 HB2 LEU 35 8.221 -18.413 -4.448 241 HB3 LEU 35 HB1 LEU 35 7.988 -17.986 -6.152 242 HG LEU 35 HG LEU 35 10.723 -17.947 -4.923 243 HD11 LEU 35 HD11 LEU 35 10.010 -20.135 -4.393 244 HD12 LEU 35 HD12 LEU 35 10.958 -20.274 -5.872 245 HD13 LEU 35 HD13 LEU 35 9.197 -20.327 -5.947 246 HD21 LEU 35 HD21 LEU 35 9.690 -18.368 -7.726 247 HD22 LEU 35 HD22 LEU 35 11.386 -18.399 -7.247 248 HD23 LEU 35 HD23 LEU 35 10.455 -16.908 -7.100 249 H ASP 36 H ASP 36 6.890 -14.707 -3.922 250 HA ASP 36 HA ASP 36 4.988 -14.830 -6.105 251 HB2 ASP 36 HB2 ASP 36 4.074 -14.787 -3.879 252 HB3 ASP 36 HB1 ASP 36 4.987 -13.326 -3.483 253 HD2 ASP 36 HD2 ASP 36 2.400 -11.388 -4.564 254 H MET 37 H MET 37 7.561 -12.796 -5.032 255 HA MET 37 HA MET 37 6.818 -10.348 -6.157 256 HB2 MET 37 HB2 MET 37 8.864 -11.058 -4.656 257 HB3 MET 37 HB1 MET 37 9.673 -11.230 -6.221 258 HG2 MET 37 HG1 MET 37 8.725 -8.821 -6.648 259 HG3 MET 37 HG2 MET 37 8.645 -8.778 -4.884 260 HE1 MET 37 HE1 MET 37 10.949 -8.751 -8.031 261 HE2 MET 37 HE2 MET 37 10.447 -7.213 -7.329 262 HE3 MET 37 HE3 MET 37 12.148 -7.679 -7.310 263 H GLN 38 H GLN 38 7.793 -13.287 -7.641 264 HA GLN 38 HA GLN 38 8.941 -12.412 -10.016 265 HB2 GLN 38 HB2 GLN 38 8.349 -14.833 -8.990 266 HB3 GLN 38 HB1 GLN 38 7.068 -14.700 -10.204 267 HG2 GLN 38 HG1 GLN 38 9.067 -14.001 -11.772 268 HG3 GLN 38 HG2 GLN 38 10.009 -14.893 -10.570 269 HE21 GLN 38 HE21 GLN 38 9.495 -17.113 -10.197 270 HE22 GLN 38 HE22 GLN 38 8.763 -18.059 -11.444 271 H GLN 39 H GLN 39 5.660 -12.254 -8.942 272 HA GLN 39 HA GLN 39 4.257 -12.135 -11.328 273 HB2 GLN 39 HB2 GLN 39 2.586 -10.797 -10.116 274 HB3 GLN 39 HB1 GLN 39 3.146 -12.181 -9.163 275 HG2 GLN 39 HG1 GLN 39 3.156 -10.537 -7.573 276 HG3 GLN 39 HG2 GLN 39 4.822 -10.453 -8.161 277 HE21 GLN 39 HE21 GLN 39 5.364 -8.385 -7.990 278 HE22 GLN 39 HE22 GLN 39 4.480 -7.058 -8.654 279 H ALA 40 H ALA 40 6.280 -9.730 -9.798 280 HA ALA 40 HA ALA 40 5.456 -7.464 -11.229 281 HB1 ALA 40 HB1 ALA 40 6.807 -7.089 -9.346 282 HB2 ALA 40 HB2 ALA 40 7.815 -6.645 -10.725 283 HB3 ALA 40 HB3 ALA 40 8.057 -8.195 -9.917 284 H MET 41 H MET 41 7.336 -10.197 -12.178 285 HA MET 41 HA MET 41 8.594 -8.914 -14.427 286 HB2 MET 41 HB2 MET 41 8.309 -11.845 -13.719 287 HB3 MET 41 HB1 MET 41 9.324 -11.203 -15.020 288 HG2 MET 41 HG1 MET 41 10.319 -9.765 -13.007 289 HG3 MET 41 HG2 MET 41 9.742 -11.160 -12.091 290 HE1 MET 41 HE1 MET 41 13.506 -10.484 -13.173 291 HE2 MET 41 HE2 MET 41 13.058 -10.506 -14.878 292 HE3 MET 41 HE3 MET 41 12.181 -9.473 -13.749 293 H LEU 42 H LEU 42 5.722 -10.837 -13.846 294 HA LEU 42 HA LEU 42 5.131 -11.158 -16.652 295 HB2 LEU 42 HB2 LEU 42 3.867 -11.955 -14.075 296 HB3 LEU 42 HB1 LEU 42 2.837 -11.854 -15.515 297 HG LEU 42 HG LEU 42 4.222 -13.509 -16.647 298 HD11 LEU 42 HD11 LEU 42 6.377 -13.046 -15.720 299 HD12 LEU 42 HD12 LEU 42 5.960 -14.716 -15.338 300 HD13 LEU 42 HD13 LEU 42 5.827 -13.468 -14.098 301 HD21 LEU 42 HD21 LEU 42 2.319 -14.172 -15.153 302 HD22 LEU 42 HD22 LEU 42 3.511 -14.507 -13.896 303 HD23 LEU 42 HD23 LEU 42 3.540 -15.420 -15.406 304 H THR 43 H THR 43 4.874 -8.639 -14.506 305 HA THR 43 HA THR 43 2.744 -7.392 -16.114 306 HB THR 43 HB THR 43 1.798 -7.879 -13.935 307 HG1 THR 43 HG1 THR 43 1.311 -5.828 -14.923 308 HG21 THR 43 HG21 THR 43 4.362 -7.461 -12.978 309 HG22 THR 43 HG22 THR 43 2.915 -7.723 -12.003 310 HG23 THR 43 HG23 THR 43 3.453 -6.082 -12.359 311 H ASN 44 H ASN 44 5.215 -7.036 -16.993 312 HA ASN 44 HA ASN 44 6.850 -5.103 -15.891 313 HB2 ASN 44 HB2 ASN 44 7.237 -6.528 -17.977 314 HB3 ASN 44 HB1 ASN 44 6.316 -5.299 -18.853 315 HD21 ASN 44 HD21 ASN 44 7.441 -3.735 -19.742 316 HD22 ASN 44 HD22 ASN 44 9.012 -3.206 -19.258 317 H LYS 45 H LYS 45 6.443 -3.091 -15.292 318 HA LYS 45 HA LYS 45 4.128 -1.665 -15.755 319 HB2 LYS 45 HB2 LYS 45 6.925 -0.739 -15.100 320 HB3 LYS 45 HB1 LYS 45 5.553 0.376 -15.185 321 HG2 LYS 45 HG1 LYS 45 5.425 -0.046 -12.978 322 HG3 LYS 45 HG2 LYS 45 4.522 -1.466 -13.532 323 HD2 LYS 45 HD1 LYS 45 6.332 -2.909 -13.226 324 HD3 LYS 45 HD2 LYS 45 7.503 -1.578 -13.230 325 HE2 LYS 45 HE1 LYS 45 5.462 -1.475 -11.091 326 HE3 LYS 45 HE2 LYS 45 6.620 -2.809 -10.991 327 HZ1 LYS 45 3HZ LYS 45 8.265 -1.434 -10.425 328 HZ2 LYS 45 1HZ LYS 45 7.052 -0.305 -10.081 329 HZ3 LYS 45 2HZ LYS 45 7.841 -0.269 -11.577 330 H ASP 46 H ASP 46 3.573 0.064 -17.119 331 HA ASP 46 HA ASP 46 5.255 0.409 -19.506 332 HB2 ASP 46 HB2 ASP 46 2.554 -0.694 -19.342 333 HB3 ASP 46 HB1 ASP 46 2.656 0.687 -20.440 334 HD2 ASP 46 HD2 ASP 46 4.853 -1.059 -22.578 335 H GLU 47 H GLU 47 4.683 2.372 -20.762 336 HA GLU 47 HA GLU 47 4.521 4.623 -19.028 337 HB2 GLU 47 HB2 GLU 47 4.610 5.960 -21.107 338 HB3 GLU 47 HB1 GLU 47 5.878 4.726 -21.030 339 HG2 GLU 47 HG1 GLU 47 4.484 3.262 -22.473 340 HG3 GLU 47 HG2 GLU 47 3.335 4.598 -22.632 341 HE2 GLU 47 HE2 GLU 47 5.173 5.944 -25.174 342 H LYS 48 H LYS 48 2.303 3.150 -21.356 343 HA LYS 48 HA LYS 48 0.284 5.094 -21.237 344 HB2 LYS 48 HB2 LYS 48 -1.224 3.199 -21.984 345 HB3 LYS 48 HB1 LYS 48 0.188 3.518 -23.004 346 HG2 LYS 48 HG1 LYS 48 0.268 1.237 -22.893 347 HG3 LYS 48 HG2 LYS 48 1.297 1.669 -21.516 348 HD2 LYS 48 HD1 LYS 48 -0.139 0.820 -20.008 349 HD3 LYS 48 HD2 LYS 48 -1.547 1.488 -20.851 350 HE2 LYS 48 HE1 LYS 48 -0.032 -1.018 -21.622 351 HE3 LYS 48 HE2 LYS 48 -1.619 -0.947 -20.840 352 HZ1 LYS 48 3HZ LYS 48 -1.802 0.626 -23.110 353 HZ2 LYS 48 1HZ LYS 48 -2.511 -0.889 -22.850 354 HZ3 LYS 48 2HZ LYS 48 -0.994 -0.782 -23.590 355 H VAL 49 H VAL 49 1.077 2.422 -19.132 356 HA VAL 49 HA VAL 49 -1.342 2.239 -17.713 357 HB VAL 49 HB VAL 49 1.493 1.585 -16.939 358 HG11 VAL 49 HG11 VAL 49 0.078 0.242 -15.104 359 HG12 VAL 49 HG12 VAL 49 0.757 1.845 -14.812 360 HG13 VAL 49 HG13 VAL 49 -0.939 1.674 -15.262 361 HG21 VAL 49 HG21 VAL 49 0.994 -0.175 -18.229 362 HG22 VAL 49 HG22 VAL 49 -0.010 -0.709 -16.881 363 HG23 VAL 49 HG23 VAL 49 -0.732 0.189 -18.215 364 H LEU 50 H LEU 50 1.367 4.433 -17.449 365 HA LEU 50 HA LEU 50 0.920 5.475 -14.903 366 HB2 LEU 50 HB2 LEU 50 1.895 6.974 -17.341 367 HB3 LEU 50 HB1 LEU 50 2.143 7.431 -15.647 368 HG LEU 50 HG LEU 50 3.304 4.986 -16.983 369 HD11 LEU 50 HD11 LEU 50 5.457 6.292 -16.531 370 HD12 LEU 50 HD12 LEU 50 4.415 7.706 -16.380 371 HD13 LEU 50 HD13 LEU 50 4.457 6.800 -17.893 372 HD21 LEU 50 HD21 LEU 50 4.751 5.203 -14.803 373 HD22 LEU 50 HD22 LEU 50 3.201 4.360 -14.778 374 HD23 LEU 50 HD23 LEU 50 3.313 6.018 -14.187 375 H LYS 51 H LYS 51 -0.686 6.111 -17.944 376 HA LYS 51 HA LYS 51 -1.971 8.495 -17.439 377 HB2 LYS 51 HB2 LYS 51 -2.879 6.035 -18.932 378 HB3 LYS 51 HB1 LYS 51 -3.839 7.522 -18.888 379 HG2 LYS 51 HG1 LYS 51 -0.972 7.616 -19.749 380 HG3 LYS 51 HG2 LYS 51 -2.236 7.091 -20.875 381 HD2 LYS 51 HD1 LYS 51 -2.471 9.662 -19.323 382 HD3 LYS 51 HD2 LYS 51 -1.608 9.575 -20.868 383 HE2 LYS 51 HE1 LYS 51 -4.502 8.809 -20.405 384 HE3 LYS 51 HE2 LYS 51 -3.924 10.289 -21.185 385 HZ1 LYS 51 3HZ LYS 51 -2.762 8.719 -22.802 386 HZ2 LYS 51 1HZ LYS 51 -4.441 8.877 -22.939 387 HZ3 LYS 51 2HZ LYS 51 -3.777 7.516 -22.186 388 H ALA 52 H ALA 52 -2.715 5.293 -16.218 389 HA ALA 52 HA ALA 52 -5.255 5.980 -15.113 390 HB1 ALA 52 HB1 ALA 52 -4.267 3.797 -13.683 391 HB2 ALA 52 HB2 ALA 52 -3.600 3.632 -15.307 392 HB3 ALA 52 HB3 ALA 52 -5.344 3.761 -15.080 393 H LEU 53 H LEU 53 -1.966 5.761 -13.819 394 HA LEU 53 HA LEU 53 -2.570 6.196 -11.123 395 HB2 LEU 53 HB2 LEU 53 -0.105 7.010 -12.674 396 HB3 LEU 53 HB1 LEU 53 -0.236 6.936 -10.908 397 HG LEU 53 HG LEU 53 -0.491 4.559 -12.749 398 HD11 LEU 53 HD11 LEU 53 1.737 3.988 -11.589 399 HD12 LEU 53 HD12 LEU 53 1.830 5.718 -11.254 400 HD13 LEU 53 HD13 LEU 53 1.749 5.146 -12.920 401 HD21 LEU 53 HD21 LEU 53 -0.912 4.994 -9.880 402 HD22 LEU 53 HD22 LEU 53 0.127 3.624 -10.273 403 HD23 LEU 53 HD23 LEU 53 -1.506 3.711 -10.937 404 H GLU 54 H GLU 54 -2.649 8.333 -13.803 405 HA GLU 54 HA GLU 54 -2.194 10.786 -12.478 406 HB2 GLU 54 HB2 GLU 54 -3.809 10.168 -14.963 407 HB3 GLU 54 HB1 GLU 54 -3.361 11.795 -14.428 408 HG2 GLU 54 HG1 GLU 54 -1.569 9.600 -15.433 409 HG3 GLU 54 HG2 GLU 54 -1.818 11.221 -16.099 410 HE2 GLU 54 HE2 GLU 54 0.342 12.655 -13.747 411 H ARG 55 H ARG 55 -5.119 8.898 -13.083 412 HA ARG 55 HA ARG 55 -6.863 10.856 -11.915 413 HB2 ARG 55 HB2 ARG 55 -7.816 9.470 -13.588 414 HB3 ARG 55 HB1 ARG 55 -7.249 7.998 -12.786 415 HG2 ARG 55 HG1 ARG 55 -9.678 8.360 -12.537 416 HG3 ARG 55 HG2 ARG 55 -8.816 8.299 -10.991 417 HD2 ARG 55 HD1 ARG 55 -9.420 10.386 -10.450 418 HD3 ARG 55 HD2 ARG 55 -8.954 10.996 -12.044 419 HE ARG 55 HE ARG 55 -11.335 9.646 -12.410 420 HH11 ARG 55 1HH1 ARG 55 -10.202 12.378 -10.574 421 HH12 ARG 55 2HH1 ARG 55 -11.730 13.195 -10.601 422 HH21 ARG 55 1HH2 ARG 55 -13.350 10.712 -12.454 423 HH22 ARG 55 2HH2 ARG 55 -13.520 12.246 -11.670 424 H THR 56 H THR 56 -5.183 7.985 -10.825 425 HA THR 56 HA THR 56 -6.581 7.759 -8.341 426 HB THR 56 HB THR 56 -5.110 6.020 -7.788 427 HG1 THR 56 HG1 THR 56 -3.279 7.236 -9.601 428 HG21 THR 56 HG21 THR 56 -4.663 5.598 -10.652 429 HG22 THR 56 HG22 THR 56 -6.325 6.022 -10.239 430 HG23 THR 56 HG23 THR 56 -5.559 4.622 -9.489 431 H ARG 57 H ARG 57 -3.463 9.128 -9.330 432 HA ARG 57 HA ARG 57 -2.477 9.806 -6.818 433 HB2 ARG 57 HB2 ARG 57 -1.030 11.371 -7.939 434 HB3 ARG 57 HB1 ARG 57 -1.198 9.927 -8.949 435 HG2 ARG 57 HG1 ARG 57 -2.512 11.010 -10.530 436 HG3 ARG 57 HG2 ARG 57 -2.943 12.311 -9.407 437 HD2 ARG 57 HD1 ARG 57 -1.343 13.065 -11.125 438 HD3 ARG 57 HD2 ARG 57 -0.684 13.180 -9.487 439 HE ARG 57 HE ARG 57 0.046 10.702 -10.593 440 HH11 ARG 57 1HH1 ARG 57 0.705 14.103 -10.944 441 HH12 ARG 57 2HH1 ARG 57 2.315 13.862 -11.536 442 HH21 ARG 57 1HH2 ARG 57 2.165 10.373 -11.371 443 HH22 ARG 57 2HH2 ARG 57 3.144 11.740 -11.780 444 H GLN 58 H GLN 58 -4.988 11.265 -8.708 445 HA GLN 58 HA GLN 58 -5.015 13.820 -7.510 446 HB2 GLN 58 HB2 GLN 58 -7.118 12.186 -8.924 447 HB3 GLN 58 HB1 GLN 58 -7.457 13.802 -8.284 448 HG2 GLN 58 HG1 GLN 58 -5.244 13.220 -10.245 449 HG3 GLN 58 HG2 GLN 58 -6.876 13.711 -10.714 450 HE21 GLN 58 HE21 GLN 58 -3.970 14.702 -9.037 451 HE22 GLN 58 HE22 GLN 58 -4.267 16.401 -9.125 452 H LEU 59 H LEU 59 -6.599 10.777 -6.678 453 HA LEU 59 HA LEU 59 -7.873 12.008 -4.362 454 HB2 LEU 59 HB2 LEU 59 -7.983 9.105 -5.168 455 HB3 LEU 59 HB1 LEU 59 -9.102 9.998 -4.124 456 HG LEU 59 HG LEU 59 -9.036 11.172 -6.754 457 HD11 LEU 59 HD11 LEU 59 -9.636 8.224 -6.594 458 HD12 LEU 59 HD12 LEU 59 -8.413 9.014 -7.588 459 HD13 LEU 59 HD13 LEU 59 -10.124 9.271 -7.927 460 HD21 LEU 59 HD21 LEU 59 -11.350 11.132 -6.523 461 HD22 LEU 59 HD22 LEU 59 -10.777 11.245 -4.859 462 HD23 LEU 59 HD23 LEU 59 -11.323 9.695 -5.502 463 H ASP 60 H ASP 60 -4.881 11.285 -4.821 464 HA ASP 60 HA ASP 60 -3.122 10.711 -3.497 465 HB2 ASP 60 HB2 ASP 60 -4.992 10.385 -1.160 466 HB3 ASP 60 HB1 ASP 60 -3.321 10.963 -1.174 467 HD2 ASP 60 HD2 ASP 60 -5.908 13.690 -1.069 468 H ILE 61 H ILE 61 -3.231 8.717 -4.820 469 HA ILE 61 HA ILE 61 -3.670 6.382 -3.083 470 HB ILE 61 HB ILE 61 -4.180 6.346 -6.054 471 HG12 ILE 61 HG11 ILE 61 -6.214 6.529 -3.816 472 HG13 ILE 61 HG12 ILE 61 -5.774 7.862 -4.897 473 HG21 ILE 61 HG21 ILE 61 -5.093 4.200 -5.705 474 HG22 ILE 61 HG22 ILE 61 -3.586 4.230 -4.791 475 HG23 ILE 61 HG23 ILE 61 -5.128 4.413 -3.956 476 HD11 ILE 61 HD11 ILE 61 -7.781 5.962 -5.285 477 HD12 ILE 61 HD12 ILE 61 -7.215 7.181 -6.427 478 HD13 ILE 61 HD13 ILE 61 -6.511 5.565 -6.441 479 HA PRO 62 HA PRO 62 0.567 5.579 -4.086 480 HB2 PRO 62 HB2 PRO 62 0.703 3.069 -2.997 481 HB3 PRO 62 HB1 PRO 62 0.686 4.547 -2.036 482 HG2 PRO 62 HG1 PRO 62 -1.576 2.704 -2.729 483 HG3 PRO 62 HG2 PRO 62 -1.154 3.444 -1.141 484 HD2 PRO 62 HD1 PRO 62 -3.136 4.408 -2.725 485 HD3 PRO 62 HD2 PRO 62 -2.133 5.453 -1.706 486 H ASP 63 H ASP 63 1.607 4.707 -5.791 487 HA ASP 63 HA ASP 63 0.140 3.389 -7.828 488 HB2 ASP 63 HB2 ASP 63 3.153 3.553 -7.597 489 HB3 ASP 63 HB1 ASP 63 2.194 3.360 -9.070 490 HD2 ASP 63 HD2 ASP 63 3.140 6.895 -8.461 491 H GLU 64 H GLU 64 1.523 2.232 -5.004 492 HA GLU 64 HA GLU 64 2.393 -0.330 -5.945 493 HB2 GLU 64 HB2 GLU 64 1.628 0.370 -3.109 494 HB3 GLU 64 HB1 GLU 64 2.755 -0.880 -3.659 495 HG2 GLU 64 HG1 GLU 64 4.288 0.860 -4.470 496 HG3 GLU 64 HG2 GLU 64 3.171 2.094 -3.872 497 HE2 GLU 64 HE2 GLU 64 4.100 0.371 -0.610 498 H LYS 65 H LYS 65 -0.557 0.966 -4.528 499 HA LYS 65 HA LYS 65 -1.818 -1.661 -4.544 500 HB2 LYS 65 HB2 LYS 65 -3.495 -0.767 -3.218 501 HB3 LYS 65 HB1 LYS 65 -2.082 0.177 -2.719 502 HG2 LYS 65 HG1 LYS 65 -2.787 1.971 -4.299 503 HG3 LYS 65 HG2 LYS 65 -4.267 1.043 -4.598 504 HD2 LYS 65 HD1 LYS 65 -3.351 2.162 -1.941 505 HD3 LYS 65 HD2 LYS 65 -4.691 2.757 -2.938 506 HE2 LYS 65 HE1 LYS 65 -4.495 0.142 -1.441 507 HE3 LYS 65 HE2 LYS 65 -5.675 1.445 -1.235 508 HZ1 LYS 65 3HZ LYS 65 -6.516 0.949 -3.474 509 HZ2 LYS 65 1HZ LYS 65 -6.670 -0.369 -2.426 510 HZ3 LYS 65 2HZ LYS 65 -5.441 -0.350 -3.588 511 H THR 66 H THR 66 -1.816 1.330 -6.334 512 HA THR 66 HA THR 66 -4.202 0.790 -7.819 513 HB THR 66 HB THR 66 -1.946 2.721 -8.388 514 HG1 THR 66 HG1 THR 66 -2.904 3.763 -6.817 515 HG21 THR 66 HG21 THR 66 -4.703 2.550 -9.609 516 HG22 THR 66 HG22 THR 66 -3.187 2.167 -10.425 517 HG23 THR 66 HG23 THR 66 -3.518 3.821 -9.909 518 H MET 67 H MET 67 -0.807 0.074 -8.205 519 HA MET 67 HA MET 67 -0.582 -0.437 -10.893 520 HB2 MET 67 HB2 MET 67 0.758 -1.341 -8.453 521 HB3 MET 67 HB1 MET 67 0.828 -2.528 -9.764 522 HG2 MET 67 HG1 MET 67 1.518 0.322 -10.341 523 HG3 MET 67 HG2 MET 67 2.684 -0.712 -9.512 524 HE1 MET 67 HE1 MET 67 0.857 0.351 -12.355 525 HE2 MET 67 HE2 MET 67 2.006 0.002 -13.646 526 HE3 MET 67 HE3 MET 67 0.629 -1.067 -13.377 527 HA PRO 68 HA PRO 68 -2.228 -4.933 -10.263 528 HB2 PRO 68 HB2 PRO 68 -3.349 -5.546 -7.841 529 HB3 PRO 68 HB1 PRO 68 -1.633 -5.736 -8.195 530 HG2 PRO 68 HG1 PRO 68 -3.051 -3.485 -6.811 531 HG3 PRO 68 HG2 PRO 68 -1.526 -4.329 -6.347 532 HD2 PRO 68 HD1 PRO 68 -1.546 -1.902 -7.564 533 HD3 PRO 68 HD2 PRO 68 -0.278 -3.106 -7.850 534 H VAL 69 H VAL 69 -3.805 -2.091 -9.194 535 HA VAL 69 HA VAL 69 -6.492 -3.123 -9.391 536 HB VAL 69 HB VAL 69 -5.394 -0.338 -9.043 537 HG11 VAL 69 HG11 VAL 69 -7.293 0.366 -10.016 538 HG12 VAL 69 HG12 VAL 69 -8.077 -1.206 -9.858 539 HG13 VAL 69 HG13 VAL 69 -8.040 -0.097 -8.487 540 HG21 VAL 69 HG21 VAL 69 -5.728 -0.627 -6.842 541 HG22 VAL 69 HG22 VAL 69 -7.254 -1.477 -7.084 542 HG23 VAL 69 HG23 VAL 69 -5.727 -2.348 -7.232 543 H LEU 70 H LEU 70 -4.639 -0.679 -11.220 544 HA LEU 70 HA LEU 70 -6.477 -0.342 -13.288 545 HB2 LEU 70 HB2 LEU 70 -4.677 0.647 -14.555 546 HB3 LEU 70 HB1 LEU 70 -4.577 1.151 -12.859 547 HG LEU 70 HG LEU 70 -2.886 -0.936 -12.801 548 HD11 LEU 70 HD11 LEU 70 -2.323 0.251 -15.495 549 HD12 LEU 70 HD12 LEU 70 -3.321 -1.191 -15.316 550 HD13 LEU 70 HD13 LEU 70 -1.649 -1.202 -14.757 551 HD21 LEU 70 HD21 LEU 70 -2.312 1.910 -13.603 552 HD22 LEU 70 HD22 LEU 70 -1.071 0.752 -13.124 553 HD23 LEU 70 HD23 LEU 70 -2.321 1.230 -11.975 554 H MET 71 H MET 71 -3.750 -2.588 -13.004 555 HA MET 71 HA MET 71 -3.896 -3.692 -15.573 556 HB2 MET 71 HB2 MET 71 -2.473 -5.388 -14.804 557 HB3 MET 71 HB1 MET 71 -2.080 -3.993 -13.789 558 HG2 MET 71 HG1 MET 71 -3.288 -4.874 -11.937 559 HG3 MET 71 HG2 MET 71 -3.992 -6.145 -12.939 560 HE1 MET 71 HE1 MET 71 0.505 -5.978 -11.922 561 HE2 MET 71 HE2 MET 71 -0.203 -5.057 -13.249 562 HE3 MET 71 HE3 MET 71 -0.640 -4.680 -11.582 563 H LYS 72 H LYS 72 -5.910 -4.110 -12.808 564 HA LYS 72 HA LYS 72 -7.014 -6.642 -13.534 565 HB2 LYS 72 HB2 LYS 72 -7.001 -5.512 -11.224 566 HB3 LYS 72 HB1 LYS 72 -8.388 -4.586 -11.818 567 HG2 LYS 72 HG1 LYS 72 -9.315 -6.381 -10.629 568 HG3 LYS 72 HG2 LYS 72 -9.475 -6.817 -12.340 569 HD2 LYS 72 HD1 LYS 72 -8.711 -8.764 -11.202 570 HD3 LYS 72 HD2 LYS 72 -7.334 -8.118 -12.112 571 HE2 LYS 72 HE1 LYS 72 -6.168 -8.174 -10.206 572 HE3 LYS 72 HE2 LYS 72 -7.185 -6.836 -9.655 573 HZ1 LYS 72 3HZ LYS 72 -8.201 -8.142 -8.192 574 HZ2 LYS 72 1HZ LYS 72 -7.003 -9.297 -8.495 575 HZ3 LYS 72 2HZ LYS 72 -8.472 -9.366 -9.328 576 H LEU 73 H LEU 73 -7.726 -3.317 -14.310 577 HA LEU 73 HA LEU 73 -10.327 -3.832 -15.396 578 HB2 LEU 73 HB2 LEU 73 -8.660 -1.463 -16.160 579 HB3 LEU 73 HB1 LEU 73 -10.412 -1.580 -15.924 580 HG LEU 73 HG LEU 73 -8.331 -1.571 -13.738 581 HD11 LEU 73 HD11 LEU 73 -10.288 0.515 -14.682 582 HD12 LEU 73 HD12 LEU 73 -8.526 0.610 -14.702 583 HD13 LEU 73 HD13 LEU 73 -9.391 0.604 -13.166 584 HD21 LEU 73 HD21 LEU 73 -11.327 -1.828 -13.691 585 HD22 LEU 73 HD22 LEU 73 -10.394 -1.288 -12.294 586 HD23 LEU 73 HD23 LEU 73 -10.123 -2.896 -12.967 587 H LEU 74 H LEU 74 -7.151 -3.107 -16.835 588 HA LEU 74 HA LEU 74 -7.926 -3.366 -19.512 589 HB2 LEU 74 HB2 LEU 74 -5.288 -3.701 -18.102 590 HB3 LEU 74 HB1 LEU 74 -5.449 -3.915 -19.853 591 HG LEU 74 HG LEU 74 -4.618 -1.713 -19.430 592 HD11 LEU 74 HD11 LEU 74 -7.204 -0.668 -19.992 593 HD12 LEU 74 HD12 LEU 74 -7.045 -2.237 -20.782 594 HD13 LEU 74 HD13 LEU 74 -5.864 -0.966 -21.101 595 HD21 LEU 74 HD21 LEU 74 -7.050 -1.235 -17.715 596 HD22 LEU 74 HD22 LEU 74 -5.736 -0.104 -18.038 597 HD23 LEU 74 HD23 LEU 74 -5.433 -1.561 -17.091 598 H GLU 75 H GLU 75 -7.305 -5.742 -17.086 599 HA GLU 75 HA GLU 75 -6.610 -7.950 -18.646 600 HB2 GLU 75 HB2 GLU 75 -7.733 -7.499 -15.955 601 HB3 GLU 75 HB1 GLU 75 -8.095 -9.081 -16.662 602 HG2 GLU 75 HG1 GLU 75 -5.288 -8.043 -16.667 603 HG3 GLU 75 HG2 GLU 75 -5.972 -8.778 -15.211 604 HE2 GLU 75 HE2 GLU 75 -5.283 -11.135 -18.331 605 H GLU 76 H GLU 76 -9.845 -6.955 -17.520 606 HA GLU 76 HA GLU 76 -11.161 -8.921 -19.145 607 HB2 GLU 76 HB2 GLU 76 -12.442 -6.520 -17.837 608 HB3 GLU 76 HB1 GLU 76 -13.200 -8.061 -18.269 609 HG2 GLU 76 HG1 GLU 76 -11.179 -7.579 -16.081 610 HG3 GLU 76 HG2 GLU 76 -12.894 -7.974 -15.895 611 HE2 GLU 76 HE2 GLU 76 -10.575 -10.945 -15.834 612 H ALA 77 H ALA 77 -10.295 -5.559 -19.457 613 HA ALA 77 HA ALA 77 -11.955 -5.142 -21.790 614 HB1 ALA 77 HB1 ALA 77 -9.787 -3.329 -20.755 615 HB2 ALA 77 HB2 ALA 77 -11.426 -3.355 -20.102 616 HB3 ALA 77 HB3 ALA 77 -11.154 -2.909 -21.787 617 H GLY 78 H GLY 78 -9.283 -6.902 -21.373 618 HA2 GLY 78 HA2 GLY 78 -7.600 -7.652 -22.743 619 HA3 GLY 78 3HA GLY 78 -8.647 -7.163 -24.067 620 H GLY 79 H GLY 79 -7.591 -4.769 -21.800 621 HA2 GLY 79 HA2 GLY 79 -5.799 -3.259 -21.924 622 HA3 GLY 79 3HA GLY 79 -5.341 -3.964 -23.468 623 H ASN 80 H ASN 80 -8.508 -2.718 -22.501 624 HA ASN 80 HA ASN 80 -8.257 -0.702 -24.636 625 HB2 ASN 80 HB2 ASN 80 -10.036 -2.726 -24.626 626 HB3 ASN 80 HB1 ASN 80 -10.958 -1.521 -23.718 627 HD21 ASN 80 HD21 ASN 80 -10.702 0.772 -24.770 628 HD22 ASN 80 HD22 ASN 80 -11.035 0.811 -26.465 629 H TRP 81 H TRP 81 -7.806 1.182 -23.679 630 HA TRP 81 HA TRP 81 -8.888 1.848 -21.080 631 HB2 TRP 81 HB2 TRP 81 -7.206 3.520 -22.970 632 HB3 TRP 81 HB1 TRP 81 -7.555 3.894 -21.281 633 HD1 TRP 81 HD1 TRP 81 -5.623 1.272 -23.360 634 HE1 TRP 81 HE1 TRP 81 -3.734 0.323 -21.893 635 HE3 TRP 81 HE3 TRP 81 -6.756 3.615 -18.960 636 HZ2 TRP 81 2HZ TRP 81 -2.842 0.538 -19.223 637 HZ3 TRP 81 3HZ TRP 81 -5.335 3.190 -16.997 638 HH2 TRP 81 HH TRP 81 -3.419 1.683 -17.128 639 H SER 82 H SER 82 -9.715 2.346 -24.367 640 HA SER 82 HA SER 82 -11.025 4.780 -24.354 641 HB2 SER 82 HB2 SER 82 -10.637 3.147 -26.307 642 HB3 SER 82 HB1 SER 82 -12.141 2.371 -25.783 643 HG SER 82 HG SER 82 -12.608 3.923 -27.343 644 H TYR 83 H TYR 83 -12.328 1.590 -23.483 645 HA TYR 83 HA TYR 83 -14.858 2.720 -22.674 646 HB2 TYR 83 HB2 TYR 83 -15.111 0.585 -23.570 647 HB3 TYR 83 HB1 TYR 83 -13.688 -0.042 -22.733 648 HD1 TYR 83 HD2 TYR 83 -13.798 -0.764 -20.415 649 HD2 TYR 83 HD1 TYR 83 -17.251 0.730 -22.400 650 HE1 TYR 83 HE2 TYR 83 -15.215 -1.673 -18.621 651 HE2 TYR 83 HE1 TYR 83 -18.678 -0.172 -20.612 652 HH TYR 83 HH TYR 83 -18.679 -1.738 -18.870 653 H ILE 84 H ILE 84 -12.019 1.321 -21.088 654 HA ILE 84 HA ILE 84 -12.953 1.348 -18.459 655 HB ILE 84 HB ILE 84 -10.139 1.711 -19.489 656 HG12 ILE 84 HG11 ILE 84 -11.535 -0.714 -18.328 657 HG13 ILE 84 HG12 ILE 84 -11.289 -0.427 -20.059 658 HG21 ILE 84 HG21 ILE 84 -11.230 1.507 -16.722 659 HG22 ILE 84 HG22 ILE 84 -9.663 0.788 -17.088 660 HG23 ILE 84 HG23 ILE 84 -9.923 2.513 -17.345 661 HD11 ILE 84 HD11 ILE 84 -8.811 -0.228 -18.580 662 HD12 ILE 84 HD12 ILE 84 -9.590 -1.799 -18.382 663 HD13 ILE 84 HD13 ILE 84 -9.212 -1.198 -19.996 664 H LYS 85 H LYS 85 -11.861 3.927 -20.501 665 HA LYS 85 HA LYS 85 -11.729 5.787 -18.242 666 HB2 LYS 85 HB2 LYS 85 -10.418 7.151 -19.519 667 HB3 LYS 85 HB1 LYS 85 -10.054 5.604 -20.300 668 HG2 LYS 85 HG1 LYS 85 -12.134 6.282 -21.801 669 HG3 LYS 85 HG2 LYS 85 -11.632 7.907 -21.298 670 HD2 LYS 85 HD1 LYS 85 -9.997 5.836 -22.769 671 HD3 LYS 85 HD2 LYS 85 -10.510 7.433 -23.343 672 HE2 LYS 85 HE1 LYS 85 -8.504 6.821 -21.163 673 HE3 LYS 85 HE2 LYS 85 -8.198 7.565 -22.739 674 HZ1 LYS 85 3HZ LYS 85 -9.176 8.762 -20.307 675 HZ2 LYS 85 1HZ LYS 85 -10.046 9.213 -21.686 676 HZ3 LYS 85 2HZ LYS 85 -8.376 9.472 -21.617 677 H LEU 86 H LEU 86 -14.119 4.542 -19.938 678 HA LEU 86 HA LEU 86 -15.513 6.722 -21.045 679 HB2 LEU 86 HB2 LEU 86 -15.971 4.274 -21.414 680 HB3 LEU 86 HB1 LEU 86 -16.736 4.260 -19.816 681 HG LEU 86 HG LEU 86 -17.738 6.241 -21.788 682 HD11 LEU 86 HD11 LEU 86 -19.304 4.421 -22.631 683 HD12 LEU 86 HD12 LEU 86 -18.118 3.272 -22.013 684 HD13 LEU 86 HD13 LEU 86 -17.659 4.424 -23.267 685 HD21 LEU 86 HD21 LEU 86 -19.748 4.729 -20.489 686 HD22 LEU 86 HD22 LEU 86 -19.296 6.413 -20.219 687 HD23 LEU 86 HD23 LEU 86 -18.521 5.130 -19.288 688 H ASP 87 H ASP 87 -14.880 5.885 -17.814 689 HA ASP 87 HA ASP 87 -16.774 7.935 -16.907 690 HB2 ASP 87 HB2 ASP 87 -16.273 5.378 -15.371 691 HB3 ASP 87 HB1 ASP 87 -17.477 6.629 -15.030 692 HD2 ASP 87 HD2 ASP 87 -19.702 5.348 -17.343 693 H ASN 88 H ASN 88 -13.866 7.890 -17.435 694 HA ASN 88 HA ASN 88 -11.989 8.802 -16.529 695 HB2 ASN 88 HB2 ASN 88 -14.004 10.152 -15.322 696 HB3 ASN 88 HB1 ASN 88 -13.224 9.427 -13.912 697 HD21 ASN 88 HD21 ASN 88 -10.592 9.432 -14.677 698 HD22 ASN 88 HD22 ASN 88 -10.037 11.062 -14.823 699 H TYR 89 H TYR 89 -12.372 6.051 -16.295 700 HA TYR 89 HA TYR 89 -11.510 4.217 -15.264 701 HB2 TYR 89 HB2 TYR 89 -9.907 6.248 -13.684 702 HB3 TYR 89 HB1 TYR 89 -9.550 4.525 -13.826 703 HD1 TYR 89 HD2 TYR 89 -10.305 4.397 -16.848 704 HD2 TYR 89 HD1 TYR 89 -7.760 6.939 -14.575 705 HE1 TYR 89 HE2 TYR 89 -8.943 4.815 -18.852 706 HE2 TYR 89 HE1 TYR 89 -6.392 7.365 -16.573 707 HH TYR 89 HH TYR 89 -6.839 7.289 -19.160 708 H THR 90 H THR 90 -13.945 5.180 -14.291 709 HA THR 90 HA THR 90 -14.203 5.566 -11.572 710 HB THR 90 HB THR 90 -16.018 4.111 -13.493 711 HG1 THR 90 HG1 THR 90 -16.208 6.670 -12.247 712 HG21 THR 90 HG21 THR 90 -16.572 3.213 -11.354 713 HG22 THR 90 HG22 THR 90 -17.775 4.450 -11.719 714 HG23 THR 90 HG23 THR 90 -16.464 4.799 -10.592 715 H ALA 91 H ALA 91 -13.514 2.622 -13.315 716 HA ALA 91 HA ALA 91 -14.164 0.701 -11.420 717 HB1 ALA 91 HB1 ALA 91 -12.616 -0.757 -12.542 718 HB2 ALA 91 HB2 ALA 91 -11.779 0.620 -13.262 719 HB3 ALA 91 HB3 ALA 91 -13.433 0.242 -13.745 720 H LEU 92 H LEU 92 -11.356 2.805 -11.626 721 HA LEU 92 HA LEU 92 -9.816 1.504 -9.632 722 HB2 LEU 92 HB2 LEU 92 -8.311 3.241 -9.834 723 HB3 LEU 92 HB1 LEU 92 -9.116 3.242 -11.414 724 HG LEU 92 HG LEU 92 -10.649 5.050 -10.215 725 HD11 LEU 92 HD11 LEU 92 -8.222 4.843 -8.538 726 HD12 LEU 92 HD12 LEU 92 -9.859 5.343 -8.114 727 HD13 LEU 92 HD13 LEU 92 -8.782 6.466 -8.945 728 HD21 LEU 92 HD21 LEU 92 -8.144 6.311 -10.960 729 HD22 LEU 92 HD22 LEU 92 -9.728 6.395 -11.733 730 HD23 LEU 92 HD23 LEU 92 -8.634 5.063 -12.106 731 H VAL 93 H VAL 93 -12.280 3.999 -9.553 732 HA VAL 93 HA VAL 93 -11.882 4.906 -6.923 733 HB VAL 93 HB VAL 93 -14.322 4.857 -8.686 734 HG11 VAL 93 HG11 VAL 93 -15.125 6.583 -6.879 735 HG12 VAL 93 HG12 VAL 93 -15.406 4.854 -6.662 736 HG13 VAL 93 HG13 VAL 93 -14.071 5.644 -5.822 737 HG21 VAL 93 HG21 VAL 93 -12.065 6.549 -8.451 738 HG22 VAL 93 HG22 VAL 93 -13.475 6.744 -9.492 739 HG23 VAL 93 HG23 VAL 93 -13.468 7.449 -7.876 740 H ASP 94 H ASP 94 -14.106 2.433 -8.192 741 HA ASP 94 HA ASP 94 -15.012 1.665 -5.588 742 HB2 ASP 94 HB2 ASP 94 -16.155 1.415 -7.955 743 HB3 ASP 94 HB1 ASP 94 -15.294 -0.130 -7.964 744 HD2 ASP 94 HD2 ASP 94 -18.608 -0.349 -6.293 745 H ALA 95 H ALA 95 -12.478 0.643 -7.748 746 HA ALA 95 HA ALA 95 -11.948 -1.864 -6.514 747 HB1 ALA 95 HB1 ALA 95 -9.661 -1.493 -7.686 748 HB2 ALA 95 HB2 ALA 95 -10.465 -0.107 -8.422 749 HB3 ALA 95 HB3 ALA 95 -11.110 -1.732 -8.661 750 H ILE 96 H ILE 96 -10.178 1.234 -6.383 751 HA ILE 96 HA ILE 96 -8.361 0.488 -4.398 752 HB ILE 96 HB ILE 96 -9.451 3.232 -5.032 753 HG12 ILE 96 HG11 ILE 96 -8.315 2.072 -6.899 754 HG13 ILE 96 HG12 ILE 96 -7.429 3.504 -6.351 755 HG21 ILE 96 HG21 ILE 96 -8.371 3.957 -3.234 756 HG22 ILE 96 HG22 ILE 96 -7.744 2.343 -2.903 757 HG23 ILE 96 HG23 ILE 96 -6.864 3.427 -3.979 758 HD11 ILE 96 HD11 ILE 96 -6.762 0.673 -5.582 759 HD12 ILE 96 HD12 ILE 96 -5.940 1.620 -6.822 760 HD13 ILE 96 HD13 ILE 96 -5.865 2.123 -5.133 761 H TYR 97 H TYR 97 -11.509 2.106 -4.118 762 HA TYR 97 HA TYR 97 -11.468 2.501 -1.344 763 HB2 TYR 97 HB2 TYR 97 -13.633 2.307 -3.410 764 HB3 TYR 97 HB1 TYR 97 -14.073 2.343 -1.701 765 HD1 TYR 97 HD1 TYR 97 -11.452 4.186 -3.626 766 HD2 TYR 97 HD2 TYR 97 -14.926 4.427 -1.182 767 HE1 TYR 97 HE1 TYR 97 -11.263 6.639 -3.609 768 HE2 TYR 97 HE2 TYR 97 -14.748 6.879 -1.159 769 HH TYR 97 HH TYR 97 -12.747 8.581 -1.472 770 H SER 98 H SER 98 -12.230 -0.304 -3.277 771 HA SER 98 HA SER 98 -13.447 -1.782 -1.140 772 HB2 SER 98 HB2 SER 98 -12.673 -2.316 -3.969 773 HB3 SER 98 HB1 SER 98 -12.816 -3.714 -2.890 774 HG SER 98 HG SER 98 -14.779 -2.862 -4.086 775 H VAL 99 H VAL 99 -10.343 -2.090 -2.871 776 HA VAL 99 HA VAL 99 -9.262 -4.069 -1.194 777 HB VAL 99 HB VAL 99 -7.667 -2.005 -2.708 778 HG11 VAL 99 HG11 VAL 99 -6.681 -4.723 -2.698 779 HG12 VAL 99 HG12 VAL 99 -5.875 -3.230 -2.211 780 HG13 VAL 99 HG13 VAL 99 -6.887 -4.103 -1.059 781 HG21 VAL 99 HG21 VAL 99 -7.803 -4.249 -4.300 782 HG22 VAL 99 HG22 VAL 99 -9.449 -4.089 -3.687 783 HG23 VAL 99 HG23 VAL 99 -8.694 -2.748 -4.548 784 H GLU 100 H GLU 100 -8.665 -0.553 -1.244 785 HA GLU 100 HA GLU 100 -6.935 -0.366 0.890 786 HB2 GLU 100 HB2 GLU 100 -7.394 1.917 0.957 787 HB3 GLU 100 HB1 GLU 100 -7.811 1.466 -0.703 788 HG2 GLU 100 HG1 GLU 100 -10.189 1.314 -0.038 789 HG3 GLU 100 HG2 GLU 100 -9.733 1.881 1.574 790 HE2 GLU 100 HE2 GLU 100 -10.573 4.936 0.104 791 H ASP 101 H ASP 101 -10.389 -0.854 0.909 792 HA ASP 101 HA ASP 101 -10.964 -0.174 3.558 793 HB2 ASP 101 HB2 ASP 101 -12.624 -0.709 1.731 794 HB3 ASP 101 HB1 ASP 101 -12.263 -2.419 2.008 795 HD2 ASP 101 HD2 ASP 101 -13.649 -1.125 5.389 796 H GLU 102 H GLU 102 -10.101 -3.344 2.183 797 HA GLU 102 HA GLU 102 -9.354 -4.207 4.900 798 HB2 GLU 102 HB2 GLU 102 -9.752 -6.560 3.967 799 HB3 GLU 102 HB1 GLU 102 -11.175 -5.567 4.316 800 HG2 GLU 102 HG1 GLU 102 -10.032 -5.517 1.561 801 HG3 GLU 102 HG2 GLU 102 -10.977 -6.920 2.079 802 HE2 GLU 102 HE2 GLU 102 -13.359 -4.635 0.696 803 H ASN 103 H ASN 103 -7.251 -4.487 5.172 804 HA ASN 103 HA ASN 103 -5.608 -5.171 2.823 805 HB2 ASN 103 HB2 ASN 103 -5.049 -3.399 5.195 806 HB3 ASN 103 HB1 ASN 103 -3.731 -4.099 4.250 807 HD21 ASN 103 HD21 ASN 103 -6.855 -2.574 3.517 808 HD22 ASN 103 HD22 ASN 103 -6.230 -1.473 2.341 809 H LYS 104 H LYS 104 -5.878 -5.553 6.345 810 HA LYS 104 HA LYS 104 -3.954 -7.686 6.419 811 HB2 LYS 104 HB2 LYS 104 -4.505 -7.857 8.779 812 HB3 LYS 104 HB1 LYS 104 -4.277 -6.159 8.328 813 HG2 LYS 104 HG1 LYS 104 -6.785 -5.987 8.108 814 HG3 LYS 104 HG2 LYS 104 -6.865 -7.589 8.863 815 HD2 LYS 104 HD1 LYS 104 -5.388 -5.285 10.130 816 HD3 LYS 104 HD2 LYS 104 -7.115 -5.577 10.405 817 HE2 LYS 104 HE1 LYS 104 -6.708 -7.687 11.416 818 HE3 LYS 104 HE2 LYS 104 -5.030 -7.697 10.858 819 HZ1 LYS 104 3HZ LYS 104 -4.452 -6.762 12.762 820 HZ2 LYS 104 1HZ LYS 104 -6.066 -6.666 13.258 821 HZ3 LYS 104 2HZ LYS 104 -5.374 -5.395 12.383 822 H GLN 105 H GLN 105 -7.372 -7.413 5.988 823 HA GLN 105 HA GLN 105 -8.236 -9.921 6.845 824 HB2 GLN 105 HB2 GLN 105 -9.305 -8.444 4.434 825 HB3 GLN 105 HB1 GLN 105 -10.174 -9.580 5.478 826 HG2 GLN 105 HG1 GLN 105 -9.214 -6.814 6.197 827 HG3 GLN 105 HG2 GLN 105 -10.885 -7.359 5.996 828 HE21 GLN 105 HE21 GLN 105 -8.779 -6.482 8.247 829 HE22 GLN 105 HE22 GLN 105 -9.302 -7.448 9.580 830 H SER 106 H SER 106 -7.011 -11.659 6.314 831 HA SER 106 HA SER 106 -6.826 -12.305 3.448 832 HB2 SER 106 HB2 SER 106 -4.599 -11.682 4.085 833 HB3 SER 106 HB1 SER 106 -4.696 -12.653 5.566 834 HG SER 106 HG SER 106 -4.916 -13.787 2.981 835 H GLU 107 H GLU 107 -7.808 -14.144 2.956 836 HA GLU 107 HA GLU 107 -8.128 -16.174 5.070 837 HB2 GLU 107 HB2 GLU 107 -10.041 -15.402 2.857 838 HB3 GLU 107 HB1 GLU 107 -10.245 -16.820 3.899 839 HG2 GLU 107 HG1 GLU 107 -10.208 -15.235 5.868 840 HG3 GLU 107 HG2 GLU 107 -10.338 -13.924 4.685 841 HE2 GLU 107 HE2 GLU 107 -13.568 -15.452 3.775 842 H GLY 108 H GLY 108 -5.873 -16.335 3.625 843 HA2 GLY 108 HA2 GLY 108 -5.506 -18.797 2.760 844 HA3 GLY 108 3HA GLY 108 -6.349 -18.135 1.368 845 H SER 109 H SER 109 -4.768 -18.121 -0.137 846 HA SER 109 HA SER 109 -2.068 -17.455 0.378 847 HB2 SER 109 HB2 SER 109 -1.709 -17.656 -1.949 848 HB3 SER 109 HB1 SER 109 -3.023 -18.792 -1.593 849 HG SER 109 HG SER 109 -3.620 -17.602 -3.378 Start of MODEL 4 1 H1 MET 1 H MET 1 -7.657 -26.936 -30.166 2 HA MET 1 HA MET 1 -8.232 -29.569 -29.109 3 HB2 MET 1 HB2 MET 1 -7.033 -29.136 -31.294 4 HB3 MET 1 HB1 MET 1 -5.647 -28.605 -30.331 5 HG2 MET 1 HG1 MET 1 -5.630 -30.844 -29.224 6 HG3 MET 1 HG2 MET 1 -6.886 -31.344 -30.359 7 HE1 MET 1 HE1 MET 1 -3.358 -33.017 -31.371 8 HE2 MET 1 HE2 MET 1 -3.474 -32.231 -29.797 9 HE3 MET 1 HE3 MET 1 -4.800 -33.238 -30.380 10 H GLY 2 H GLY 2 -7.816 -30.140 -27.084 11 HA2 GLY 2 HA2 GLY 2 -5.633 -30.228 -25.629 12 HA3 GLY 2 3HA GLY 2 -5.972 -28.508 -25.497 13 H SER 3 H SER 3 -5.887 -29.544 -23.164 14 HA SER 3 HA SER 3 -8.688 -30.024 -22.391 15 HB2 SER 3 HB2 SER 3 -7.484 -32.129 -22.173 16 HB3 SER 3 HB1 SER 3 -6.219 -31.331 -21.222 17 HG SER 3 HG SER 3 -7.959 -32.499 -20.042 18 H SER 4 H SER 4 -9.410 -29.010 -20.547 19 HA SER 4 HA SER 4 -7.511 -27.304 -19.099 20 HB2 SER 4 HB2 SER 4 -9.067 -25.407 -19.179 21 HB3 SER 4 HB1 SER 4 -8.590 -25.901 -20.812 22 HG SER 4 HG SER 4 -10.735 -25.763 -20.984 23 H HIS 5 H HIS 5 -7.723 -27.484 -16.969 24 HA HIS 5 HA HIS 5 -9.724 -29.151 -15.823 25 HB2 HIS 5 HB2 HIS 5 -7.696 -27.315 -14.521 26 HB3 HIS 5 HB1 HIS 5 -8.687 -28.495 -13.656 27 HD1 HIS 5 HD1 HIS 5 -5.528 -28.555 -13.795 28 HD2 HIS 5 HD2 HIS 5 -8.116 -30.873 -16.073 29 HE1 HIS 5 HE1 HIS 5 -4.194 -30.572 -14.485 30 HE2 HIS 5 HE2 HIS 5 -5.774 -31.990 -15.877 31 H HIS 6 H HIS 6 -11.095 -28.464 -13.970 32 HA HIS 6 HA HIS 6 -12.364 -25.887 -14.591 33 HB2 HIS 6 HB2 HIS 6 -13.368 -28.497 -13.527 34 HB3 HIS 6 HB1 HIS 6 -14.221 -27.016 -13.078 35 HD1 HIS 6 HD1 HIS 6 -14.589 -29.562 -15.398 36 HD2 HIS 6 HD2 HIS 6 -14.587 -25.423 -15.750 37 HE1 HIS 6 HE1 HIS 6 -15.799 -29.070 -17.547 38 HE2 HIS 6 HE2 HIS 6 -15.798 -26.540 -17.764 39 H HIS 7 H HIS 7 -13.556 -24.957 -12.580 40 HA HIS 7 HA HIS 7 -12.093 -25.297 -10.097 41 HB2 HIS 7 HB2 HIS 7 -11.992 -22.782 -11.754 42 HB3 HIS 7 HB1 HIS 7 -11.771 -22.737 -10.002 43 HD1 HIS 7 HD1 HIS 7 -9.971 -25.113 -9.506 44 HD2 HIS 7 HD2 HIS 7 -9.456 -22.508 -12.702 45 HE1 HIS 7 HE1 HIS 7 -7.556 -25.334 -10.171 46 HE2 HIS 7 HE2 HIS 7 -7.241 -23.743 -12.126 47 H HIS 8 H HIS 8 -12.965 -23.379 -8.547 48 HA HIS 8 HA HIS 8 -15.774 -22.823 -8.992 49 HB2 HIS 8 HB2 HIS 8 -15.556 -25.171 -7.984 50 HB3 HIS 8 HB1 HIS 8 -15.018 -24.358 -6.511 51 HD1 HIS 8 HD1 HIS 8 -18.050 -24.501 -8.775 52 HD2 HIS 8 HD2 HIS 8 -17.012 -23.411 -4.902 53 HE1 HIS 8 HE1 HIS 8 -20.224 -24.014 -7.609 54 HE2 HIS 8 HE2 HIS 8 -19.591 -23.346 -5.242 55 H HIS 9 H HIS 9 -16.265 -20.890 -8.180 56 HA HIS 9 HA HIS 9 -15.002 -19.919 -5.759 57 HB2 HIS 9 HB2 HIS 9 -14.616 -18.577 -8.441 58 HB3 HIS 9 HB1 HIS 9 -14.338 -17.760 -6.900 59 HD1 HIS 9 HD1 HIS 9 -12.639 -19.777 -9.369 60 HD2 HIS 9 HD2 HIS 9 -12.256 -19.107 -5.287 61 HE1 HIS 9 HE1 HIS 9 -10.325 -20.563 -8.774 62 HE2 HIS 9 HE2 HIS 9 -10.090 -20.155 -6.278 63 H HIS 10 H HIS 10 -16.198 -18.368 -4.705 64 HA HIS 10 HA HIS 10 -18.305 -16.908 -5.948 65 HB2 HIS 10 HB2 HIS 10 -19.346 -19.156 -5.844 66 HB3 HIS 10 HB1 HIS 10 -19.122 -19.156 -4.092 67 HD1 HIS 10 HD1 HIS 10 -20.802 -17.896 -2.676 68 HD2 HIS 10 HD2 HIS 10 -21.335 -17.298 -6.752 69 HE1 HIS 10 HE1 HIS 10 -23.003 -16.703 -2.898 70 HE2 HIS 10 HE2 HIS 10 -23.332 -16.337 -5.388 71 H SER 11 H SER 11 -18.574 -15.090 -4.829 72 HA SER 11 HA SER 11 -17.845 -15.092 -1.973 73 HB2 SER 11 HB2 SER 11 -17.346 -12.965 -4.073 74 HB3 SER 11 HB1 SER 11 -17.135 -12.701 -2.333 75 HG SER 11 HG SER 11 -15.447 -13.855 -4.064 76 H SER 12 H SER 12 -19.123 -13.935 -0.565 77 HA SER 12 HA SER 12 -21.229 -12.216 -1.462 78 HB2 SER 12 HB2 SER 12 -23.113 -13.575 -0.653 79 HB3 SER 12 HB1 SER 12 -22.253 -14.394 -1.968 80 HG SER 12 HG SER 12 -22.206 -14.968 0.793 81 H GLY 13 H GLY 13 -21.527 -10.732 0.066 82 HA2 GLY 13 HA2 GLY 13 -22.025 -11.078 2.735 83 HA3 GLY 13 3HA GLY 13 -20.271 -11.021 2.631 84 H LEU 14 H LEU 14 -21.894 -9.152 4.024 85 HA LEU 14 HA LEU 14 -21.304 -6.724 2.465 86 HB2 LEU 14 HB2 LEU 14 -23.572 -6.994 4.438 87 HB3 LEU 14 HB1 LEU 14 -23.239 -5.642 3.339 88 HG LEU 14 HG LEU 14 -23.972 -8.390 2.352 89 HD11 LEU 14 HD11 LEU 14 -26.252 -7.422 2.022 90 HD12 LEU 14 HD12 LEU 14 -25.765 -6.073 3.047 91 HD13 LEU 14 HD13 LEU 14 -25.812 -7.708 3.705 92 HD21 LEU 14 HD21 LEU 14 -22.854 -6.453 0.954 93 HD22 LEU 14 HD22 LEU 14 -24.509 -5.844 0.912 94 HD23 LEU 14 HD23 LEU 14 -24.143 -7.449 0.278 95 H VAL 15 H VAL 15 -20.942 -4.790 3.816 96 HA VAL 15 HA VAL 15 -20.191 -5.269 6.582 97 HB VAL 15 HB VAL 15 -17.931 -4.143 6.138 98 HG11 VAL 15 HG11 VAL 15 -18.407 -6.586 6.700 99 HG12 VAL 15 HG12 VAL 15 -18.157 -6.906 4.983 100 HG13 VAL 15 HG13 VAL 15 -16.854 -6.219 5.951 101 HG21 VAL 15 HG21 VAL 15 -17.985 -5.351 3.437 102 HG22 VAL 15 HG22 VAL 15 -18.803 -3.802 3.636 103 HG23 VAL 15 HG23 VAL 15 -17.092 -3.954 4.037 104 HA PRO 16 HA PRO 16 -21.459 -1.099 7.116 105 HB2 PRO 16 HB2 PRO 16 -19.879 -0.312 9.211 106 HB3 PRO 16 HB1 PRO 16 -21.226 -1.438 9.377 107 HG2 PRO 16 HG1 PRO 16 -18.296 -2.007 9.083 108 HG3 PRO 16 HG2 PRO 16 -19.489 -2.733 10.223 109 HD2 PRO 16 HD1 PRO 16 -18.661 -3.996 7.968 110 HD3 PRO 16 HD2 PRO 16 -20.304 -4.166 8.612 111 H ARG 17 H ARG 17 -20.339 1.172 7.653 112 HA ARG 17 HA ARG 17 -17.907 1.477 6.045 113 HB2 ARG 17 HB2 ARG 17 -20.076 1.884 4.711 114 HB3 ARG 17 HB1 ARG 17 -20.226 3.358 5.680 115 HG2 ARG 17 HG1 ARG 17 -18.148 4.216 4.835 116 HG3 ARG 17 HG2 ARG 17 -17.826 2.692 3.992 117 HD2 ARG 17 HD1 ARG 17 -19.495 3.061 2.396 118 HD3 ARG 17 HD2 ARG 17 -20.313 4.257 3.412 119 HE ARG 17 HE ARG 17 -18.205 4.750 1.561 120 HH11 ARG 17 1HH1 ARG 17 -19.580 5.806 4.579 121 HH12 ARG 17 2HH1 ARG 17 -18.983 7.426 4.434 122 HH21 ARG 17 1HH2 ARG 17 -17.413 6.880 1.359 123 HH22 ARG 17 2HH2 ARG 17 -17.751 8.037 2.602 124 H GLY 18 H GLY 18 -16.826 3.544 6.372 125 HA2 GLY 18 HA2 GLY 18 -17.500 5.562 8.095 126 HA3 GLY 18 3HA GLY 18 -16.867 4.300 9.139 127 H SER 19 H SER 19 -15.807 6.974 8.597 128 HA SER 19 HA SER 19 -13.438 6.570 6.994 129 HB2 SER 19 HB2 SER 19 -14.682 8.763 7.140 130 HB3 SER 19 HB1 SER 19 -14.073 8.912 8.798 131 HG SER 19 HG SER 19 -11.920 8.574 7.736 132 H HIS 20 H HIS 20 -12.917 4.661 8.474 133 HA HIS 20 HA HIS 20 -11.479 5.546 10.880 134 HB2 HIS 20 HB2 HIS 20 -13.132 3.794 11.265 135 HB3 HIS 20 HB1 HIS 20 -12.370 2.780 10.037 136 HD1 HIS 20 HD1 HIS 20 -10.684 1.158 10.855 137 HD2 HIS 20 HD2 HIS 20 -11.265 4.281 13.533 138 HE1 HIS 20 HE1 HIS 20 -9.301 0.578 12.874 139 HE2 HIS 20 HE2 HIS 20 -9.656 2.487 14.512 140 H MET 21 H MET 21 -9.569 6.281 9.993 141 HA MET 21 HA MET 21 -8.026 4.421 8.336 142 HB2 MET 21 HB2 MET 21 -8.189 6.632 7.411 143 HB3 MET 21 HB1 MET 21 -7.667 7.359 8.939 144 HG2 MET 21 HG1 MET 21 -5.450 6.499 8.690 145 HG3 MET 21 HG2 MET 21 -5.937 5.528 7.299 146 HE1 MET 21 HE1 MET 21 -4.726 9.749 7.730 147 HE2 MET 21 HE2 MET 21 -6.487 9.840 7.692 148 HE3 MET 21 HE3 MET 21 -5.682 8.813 8.879 149 H ILE 22 H ILE 22 -5.925 3.791 8.882 150 HA ILE 22 HA ILE 22 -4.565 4.640 11.209 151 HB ILE 22 HB ILE 22 -6.453 3.344 12.252 152 HG12 ILE 22 HG11 ILE 22 -4.985 2.081 13.799 153 HG13 ILE 22 HG12 ILE 22 -3.637 2.312 12.671 154 HG21 ILE 22 HG21 ILE 22 -6.367 0.906 12.149 155 HG22 ILE 22 HG22 ILE 22 -6.642 1.603 10.553 156 HG23 ILE 22 HG23 ILE 22 -5.044 0.996 10.987 157 HD11 ILE 22 HD11 ILE 22 -4.208 3.940 14.773 158 HD12 ILE 22 HD12 ILE 22 -3.250 4.395 13.363 159 HD13 ILE 22 HD13 ILE 22 -4.966 4.797 13.432 160 H SER 23 H SER 23 -2.512 3.717 11.401 161 HA SER 23 HA SER 23 -1.515 2.516 8.991 162 HB2 SER 23 HB2 SER 23 0.684 2.713 10.017 163 HB3 SER 23 HB1 SER 23 -0.226 4.212 10.275 164 HG SER 23 HG SER 23 0.017 3.909 12.328 165 H LEU 24 H LEU 24 -3.156 0.663 9.557 166 HA LEU 24 HA LEU 24 -1.961 -1.335 11.319 167 HB2 LEU 24 HB2 LEU 24 -4.413 -0.837 11.374 168 HB3 LEU 24 HB1 LEU 24 -4.519 -1.499 9.734 169 HG LEU 24 HG LEU 24 -3.290 -3.509 11.219 170 HD11 LEU 24 HD11 LEU 24 -5.732 -2.924 12.763 171 HD12 LEU 24 HD12 LEU 24 -4.322 -1.929 13.126 172 HD13 LEU 24 HD13 LEU 24 -4.221 -3.685 13.264 173 HD21 LEU 24 HD21 LEU 24 -5.815 -4.369 11.075 174 HD22 LEU 24 HD22 LEU 24 -4.746 -4.298 9.673 175 HD23 LEU 24 HD23 LEU 24 -5.919 -3.009 9.956 176 H SER 25 H SER 25 -0.357 -0.831 9.170 177 HA SER 25 HA SER 25 -0.749 -2.307 6.855 178 HB2 SER 25 HB2 SER 25 1.952 -2.040 8.186 179 HB3 SER 25 HB1 SER 25 1.577 -2.088 6.455 180 HG SER 25 HG SER 25 2.029 0.049 7.501 181 H GLY 26 H GLY 26 -1.000 -4.407 6.504 182 HA2 GLY 26 HA2 GLY 26 0.230 -6.592 6.800 183 HA3 GLY 26 3HA GLY 26 0.058 -6.287 8.521 184 H LEU 27 H LEU 27 -1.459 -7.449 5.661 185 HA LEU 27 HA LEU 27 -3.953 -7.935 7.146 186 HB2 LEU 27 HB2 LEU 27 -4.279 -6.629 5.131 187 HB3 LEU 27 HB1 LEU 27 -3.428 -7.858 4.179 188 HG LEU 27 HG LEU 27 -5.746 -8.915 5.607 189 HD11 LEU 27 HD11 LEU 27 -6.321 -6.463 4.932 190 HD12 LEU 27 HD12 LEU 27 -7.455 -7.767 4.582 191 HD13 LEU 27 HD13 LEU 27 -6.414 -7.138 3.305 192 HD21 LEU 27 HD21 LEU 27 -4.244 -9.810 3.634 193 HD22 LEU 27 HD22 LEU 27 -5.412 -8.924 2.652 194 HD23 LEU 27 HD23 LEU 27 -5.961 -10.205 3.734 195 H THR 28 H THR 28 -1.156 -9.415 6.086 196 HA THR 28 HA THR 28 -2.157 -12.025 6.761 197 HB THR 28 HB THR 28 -1.052 -12.845 4.456 198 HG1 THR 28 HG1 THR 28 -2.031 -10.228 4.006 199 HG21 THR 28 HG21 THR 28 -3.189 -13.438 3.784 200 HG22 THR 28 HG22 THR 28 -3.897 -11.923 4.345 201 HG23 THR 28 HG23 THR 28 -3.418 -13.159 5.509 202 H SER 29 H SER 29 -0.310 -13.706 6.283 203 HA SER 29 HA SER 29 2.308 -12.456 6.739 204 HB2 SER 29 HB2 SER 29 1.336 -13.107 8.930 205 HB3 SER 29 HB1 SER 29 1.216 -14.777 8.349 206 HG SER 29 HG SER 29 3.204 -13.940 9.603 207 H SER 30 H SER 30 1.212 -13.618 4.359 208 HA SER 30 HA SER 30 2.876 -16.036 4.098 209 HB2 SER 30 HB2 SER 30 0.584 -15.256 2.281 210 HB3 SER 30 HB1 SER 30 1.406 -16.823 2.387 211 HG SER 30 HG SER 30 -0.395 -17.109 3.567 212 H VAL 31 H VAL 31 3.115 -16.254 1.421 213 HA VAL 31 HA VAL 31 4.878 -14.018 0.793 214 HB VAL 31 HB VAL 31 5.668 -15.440 -1.073 215 HG11 VAL 31 HG11 VAL 31 6.068 -17.438 0.888 216 HG12 VAL 31 HG12 VAL 31 7.157 -16.130 0.420 217 HG13 VAL 31 HG13 VAL 31 5.992 -15.886 1.723 218 HG21 VAL 31 HG21 VAL 31 3.312 -16.665 -1.025 219 HG22 VAL 31 HG22 VAL 31 4.767 -17.458 -1.631 220 HG23 VAL 31 HG23 VAL 31 4.202 -17.784 0.008 221 H GLU 32 H GLU 32 2.285 -13.209 0.673 222 HA GLU 32 HA GLU 32 1.199 -13.468 -1.969 223 HB2 GLU 32 HB2 GLU 32 -0.535 -12.013 -1.252 224 HB3 GLU 32 HB1 GLU 32 -0.146 -13.053 0.127 225 HG2 GLU 32 HG1 GLU 32 1.162 -11.280 1.146 226 HG3 GLU 32 HG2 GLU 32 0.853 -10.238 -0.250 227 HE2 GLU 32 HE2 GLU 32 -2.660 -10.773 1.229 228 H SER 33 H SER 33 3.458 -11.378 -0.419 229 HA SER 33 HA SER 33 3.427 -9.590 -2.762 230 HB2 SER 33 HB2 SER 33 4.504 -8.947 0.000 231 HB3 SER 33 HB1 SER 33 4.297 -7.827 -1.358 232 HG SER 33 HG SER 33 2.106 -7.948 -1.138 233 H ASP 34 H ASP 34 5.279 -11.757 -0.826 234 HA ASP 34 HA ASP 34 7.885 -10.967 -1.430 235 HB2 ASP 34 HB2 ASP 34 7.388 -12.659 0.259 236 HB3 ASP 34 HB1 ASP 34 6.797 -13.756 -0.995 237 HD2 ASP 34 HD2 ASP 34 10.661 -13.142 -1.453 238 H LEU 35 H LEU 35 5.507 -12.615 -3.359 239 HA LEU 35 HA LEU 35 7.475 -13.267 -5.416 240 HB2 LEU 35 HB2 LEU 35 4.672 -14.070 -4.818 241 HB3 LEU 35 HB1 LEU 35 5.195 -14.090 -6.511 242 HG LEU 35 HG LEU 35 5.370 -16.294 -5.418 243 HD11 LEU 35 HD11 LEU 35 6.847 -16.444 -7.088 244 HD12 LEU 35 HD12 LEU 35 8.070 -16.287 -5.826 245 HD13 LEU 35 HD13 LEU 35 7.553 -14.867 -6.736 246 HD21 LEU 35 HD21 LEU 35 7.222 -16.619 -3.781 247 HD22 LEU 35 HD22 LEU 35 5.871 -15.669 -3.162 248 HD23 LEU 35 HD23 LEU 35 7.361 -14.865 -3.661 249 H ASP 36 H ASP 36 6.302 -10.513 -4.627 250 HA ASP 36 HA ASP 36 4.729 -9.493 -6.672 251 HB2 ASP 36 HB2 ASP 36 5.183 -8.215 -4.661 252 HB3 ASP 36 HB1 ASP 36 6.901 -8.127 -5.071 253 HD2 ASP 36 HD2 ASP 36 6.421 -5.419 -7.113 254 H MET 37 H MET 37 8.270 -9.696 -6.479 255 HA MET 37 HA MET 37 8.920 -8.388 -8.831 256 HB2 MET 37 HB2 MET 37 10.296 -10.821 -7.665 257 HB3 MET 37 HB1 MET 37 11.008 -9.663 -8.798 258 HG2 MET 37 HG1 MET 37 10.084 -9.025 -5.994 259 HG3 MET 37 HG2 MET 37 11.755 -9.291 -6.500 260 HE1 MET 37 HE1 MET 37 12.894 -6.148 -8.134 261 HE2 MET 37 HE2 MET 37 13.257 -7.121 -6.709 262 HE3 MET 37 HE3 MET 37 12.972 -7.906 -8.262 263 H GLN 38 H GLN 38 7.886 -11.722 -8.336 264 HA GLN 38 HA GLN 38 8.348 -12.559 -11.018 265 HB2 GLN 38 HB2 GLN 38 7.894 -13.885 -8.725 266 HB3 GLN 38 HB1 GLN 38 6.261 -13.920 -9.408 267 HG2 GLN 38 HG1 GLN 38 7.301 -14.833 -11.530 268 HG3 GLN 38 HG2 GLN 38 8.777 -15.054 -10.582 269 HE21 GLN 38 HE21 GLN 38 5.321 -15.605 -9.979 270 HE22 GLN 38 HE22 GLN 38 5.499 -17.243 -9.460 271 H GLN 39 H GLN 39 5.789 -10.873 -9.420 272 HA GLN 39 HA GLN 39 3.878 -11.369 -11.550 273 HB2 GLN 39 HB2 GLN 39 3.684 -9.565 -9.125 274 HB3 GLN 39 HB1 GLN 39 2.357 -9.973 -10.225 275 HG2 GLN 39 HG1 GLN 39 3.867 -12.049 -8.648 276 HG3 GLN 39 HG2 GLN 39 2.424 -11.226 -8.039 277 HE21 GLN 39 HE21 GLN 39 3.661 -13.452 -10.413 278 HE22 GLN 39 HE22 GLN 39 2.137 -14.123 -10.871 279 H ALA 40 H ALA 40 6.221 -9.005 -10.644 280 HA ALA 40 HA ALA 40 5.195 -6.742 -11.951 281 HB1 ALA 40 HB1 ALA 40 7.076 -6.703 -10.349 282 HB2 ALA 40 HB2 ALA 40 7.439 -5.856 -11.854 283 HB3 ALA 40 HB3 ALA 40 8.097 -7.467 -11.567 284 H MET 41 H MET 41 6.677 -9.617 -13.168 285 HA MET 41 HA MET 41 7.460 -8.526 -15.701 286 HB2 MET 41 HB2 MET 41 7.008 -11.425 -14.958 287 HB3 MET 41 HB1 MET 41 7.939 -10.813 -16.333 288 HG2 MET 41 HG1 MET 41 9.551 -9.785 -14.780 289 HG3 MET 41 HG2 MET 41 8.634 -10.455 -13.428 290 HE1 MET 41 HE1 MET 41 11.472 -12.545 -16.275 291 HE2 MET 41 HE2 MET 41 9.852 -12.376 -16.950 292 HE3 MET 41 HE3 MET 41 10.745 -10.946 -16.430 293 H LEU 42 H LEU 42 4.692 -10.356 -14.482 294 HA LEU 42 HA LEU 42 3.437 -10.617 -17.036 295 HB2 LEU 42 HB2 LEU 42 2.560 -11.049 -14.195 296 HB3 LEU 42 HB1 LEU 42 1.402 -11.133 -15.534 297 HG LEU 42 HG LEU 42 2.837 -12.930 -16.543 298 HD11 LEU 42 HD11 LEU 42 4.355 -14.099 -14.934 299 HD12 LEU 42 HD12 LEU 42 4.222 -12.691 -13.880 300 HD13 LEU 42 HD13 LEU 42 4.932 -12.526 -15.486 301 HD21 LEU 42 HD21 LEU 42 1.985 -14.672 -15.098 302 HD22 LEU 42 HD22 LEU 42 0.780 -13.395 -15.266 303 HD23 LEU 42 HD23 LEU 42 1.743 -13.510 -13.793 304 H THR 43 H THR 43 3.712 -8.085 -14.787 305 HA THR 43 HA THR 43 1.480 -6.652 -16.075 306 HB THR 43 HB THR 43 0.993 -7.021 -13.715 307 HG1 THR 43 HG1 THR 43 0.601 -4.901 -14.836 308 HG21 THR 43 HG21 THR 43 3.093 -5.258 -12.687 309 HG22 THR 43 HG22 THR 43 3.693 -6.793 -13.315 310 HG23 THR 43 HG23 THR 43 2.473 -6.777 -12.042 311 H ASN 44 H ASN 44 3.870 -6.627 -17.356 312 HA ASN 44 HA ASN 44 5.768 -4.744 -16.675 313 HB2 ASN 44 HB2 ASN 44 5.721 -6.365 -18.668 314 HB3 ASN 44 HB1 ASN 44 4.813 -5.104 -19.510 315 HD21 ASN 44 HD21 ASN 44 5.813 -3.058 -19.847 316 HD22 ASN 44 HD22 ASN 44 7.535 -2.931 -19.926 317 H LYS 45 H LYS 45 5.557 -2.674 -16.180 318 HA LYS 45 HA LYS 45 3.269 -1.132 -16.574 319 HB2 LYS 45 HB2 LYS 45 6.140 -0.327 -16.081 320 HB3 LYS 45 HB1 LYS 45 4.795 0.825 -16.084 321 HG2 LYS 45 HG1 LYS 45 4.912 0.407 -13.853 322 HG3 LYS 45 HG2 LYS 45 3.791 -0.880 -14.333 323 HD2 LYS 45 HD1 LYS 45 5.448 -2.538 -14.237 324 HD3 LYS 45 HD2 LYS 45 6.757 -1.344 -14.268 325 HE2 LYS 45 HE1 LYS 45 4.826 -1.233 -11.997 326 HE3 LYS 45 HE2 LYS 45 6.007 -2.549 -12.027 327 HZ1 LYS 45 3HZ LYS 45 7.705 -0.695 -12.421 328 HZ2 LYS 45 1HZ LYS 45 7.074 -0.874 -10.862 329 HZ3 LYS 45 2HZ LYS 45 6.499 0.355 -11.871 330 H ASP 46 H ASP 46 3.114 0.904 -17.837 331 HA ASP 46 HA ASP 46 4.651 0.969 -20.308 332 HB2 ASP 46 HB2 ASP 46 1.629 0.725 -20.295 333 HB3 ASP 46 HB1 ASP 46 2.636 1.007 -21.722 334 HD2 ASP 46 HD2 ASP 46 3.820 -2.319 -21.646 335 H GLU 47 H GLU 47 3.929 2.900 -21.678 336 HA GLU 47 HA GLU 47 4.149 5.232 -20.123 337 HB2 GLU 47 HB2 GLU 47 3.703 6.447 -22.244 338 HB3 GLU 47 HB1 GLU 47 4.949 5.199 -22.400 339 HG2 GLU 47 HG1 GLU 47 2.771 3.769 -23.094 340 HG3 GLU 47 HG2 GLU 47 2.290 5.383 -23.642 341 HE2 GLU 47 HE2 GLU 47 5.538 5.092 -25.535 342 H LYS 48 H LYS 48 1.374 3.729 -21.725 343 HA LYS 48 HA LYS 48 -0.475 5.782 -21.069 344 HB2 LYS 48 HB2 LYS 48 -2.204 4.065 -21.631 345 HB3 LYS 48 HB1 LYS 48 -0.983 4.308 -22.890 346 HG2 LYS 48 HG1 LYS 48 -0.353 2.181 -20.958 347 HG3 LYS 48 HG2 LYS 48 -1.778 1.891 -21.970 348 HD2 LYS 48 HD1 LYS 48 0.163 2.912 -23.715 349 HD3 LYS 48 HD2 LYS 48 1.019 1.768 -22.667 350 HE2 LYS 48 HE1 LYS 48 0.246 0.136 -23.985 351 HE3 LYS 48 HE2 LYS 48 -1.346 0.464 -23.286 352 HZ1 LYS 48 3HZ LYS 48 -1.290 2.331 -25.155 353 HZ2 LYS 48 1HZ LYS 48 -1.864 0.766 -25.447 354 HZ3 LYS 48 2HZ LYS 48 -0.291 1.187 -25.900 355 H VAL 49 H VAL 49 0.638 2.895 -19.433 356 HA VAL 49 HA VAL 49 -1.370 2.628 -17.508 357 HB VAL 49 HB VAL 49 1.578 2.019 -17.245 358 HG11 VAL 49 HG11 VAL 49 -0.650 1.777 -15.376 359 HG12 VAL 49 HG12 VAL 49 0.231 0.268 -15.622 360 HG13 VAL 49 HG13 VAL 49 1.088 1.712 -15.084 361 HG21 VAL 49 HG21 VAL 49 -0.400 -0.134 -17.609 362 HG22 VAL 49 HG22 VAL 49 -0.140 0.910 -19.007 363 HG23 VAL 49 HG23 VAL 49 1.219 0.048 -18.285 364 H LEU 50 H LEU 50 1.294 4.863 -17.741 365 HA LEU 50 HA LEU 50 1.307 5.718 -15.037 366 HB2 LEU 50 HB2 LEU 50 2.124 7.327 -17.457 367 HB3 LEU 50 HB1 LEU 50 2.664 7.541 -15.783 368 HG LEU 50 HG LEU 50 3.282 5.078 -17.402 369 HD11 LEU 50 HD11 LEU 50 4.184 7.535 -18.087 370 HD12 LEU 50 HD12 LEU 50 5.084 6.038 -18.337 371 HD13 LEU 50 HD13 LEU 50 5.414 7.041 -16.923 372 HD21 LEU 50 HD21 LEU 50 3.395 4.942 -14.918 373 HD22 LEU 50 HD22 LEU 50 4.611 6.220 -14.948 374 HD23 LEU 50 HD23 LEU 50 4.941 4.669 -15.723 375 H LYS 51 H LYS 51 -0.686 6.459 -17.765 376 HA LYS 51 HA LYS 51 -1.675 8.970 -16.951 377 HB2 LYS 51 HB2 LYS 51 -2.999 6.811 -18.610 378 HB3 LYS 51 HB1 LYS 51 -3.565 8.482 -18.475 379 HG2 LYS 51 HG1 LYS 51 -1.215 9.129 -19.323 380 HG3 LYS 51 HG2 LYS 51 -1.116 7.435 -19.835 381 HD2 LYS 51 HD1 LYS 51 -2.899 7.648 -21.342 382 HD3 LYS 51 HD2 LYS 51 -3.472 9.141 -20.578 383 HE2 LYS 51 HE1 LYS 51 -2.459 9.924 -22.521 384 HE3 LYS 51 HE2 LYS 51 -1.191 10.119 -21.300 385 HZ1 LYS 51 3HZ LYS 51 -0.270 9.139 -23.272 386 HZ2 LYS 51 1HZ LYS 51 -1.419 7.898 -23.257 387 HZ3 LYS 51 2HZ LYS 51 -0.252 7.985 -22.035 388 H ALA 52 H ALA 52 -2.681 5.671 -16.225 389 HA ALA 52 HA ALA 52 -5.102 6.276 -14.932 390 HB1 ALA 52 HB1 ALA 52 -4.376 4.023 -13.672 391 HB2 ALA 52 HB2 ALA 52 -3.282 3.955 -15.054 392 HB3 ALA 52 HB3 ALA 52 -5.024 4.049 -15.312 393 H LEU 53 H LEU 53 -1.799 5.953 -13.685 394 HA LEU 53 HA LEU 53 -2.375 6.216 -10.964 395 HB2 LEU 53 HB2 LEU 53 0.085 7.166 -12.442 396 HB3 LEU 53 HB1 LEU 53 -0.045 6.876 -10.699 397 HG LEU 53 HG LEU 53 -0.236 4.772 -12.854 398 HD11 LEU 53 HD11 LEU 53 2.008 6.011 -11.663 399 HD12 LEU 53 HD12 LEU 53 1.971 4.628 -12.755 400 HD13 LEU 53 HD13 LEU 53 1.893 4.376 -11.012 401 HD21 LEU 53 HD21 LEU 53 0.065 3.312 -10.720 402 HD22 LEU 53 HD22 LEU 53 -1.536 3.909 -11.156 403 HD23 LEU 53 HD23 LEU 53 -0.607 4.715 -9.891 404 H GLU 54 H GLU 54 -2.438 8.533 -13.497 405 HA GLU 54 HA GLU 54 -1.990 10.880 -11.977 406 HB2 GLU 54 HB2 GLU 54 -3.659 10.617 -14.487 407 HB3 GLU 54 HB1 GLU 54 -2.879 12.082 -13.870 408 HG2 GLU 54 HG1 GLU 54 -1.578 9.649 -15.074 409 HG3 GLU 54 HG2 GLU 54 -1.551 11.319 -15.660 410 HE2 GLU 54 HE2 GLU 54 1.434 10.333 -13.581 411 H ARG 55 H ARG 55 -4.879 9.019 -12.756 412 HA ARG 55 HA ARG 55 -6.677 10.910 -11.557 413 HB2 ARG 55 HB2 ARG 55 -7.612 9.617 -13.290 414 HB3 ARG 55 HB1 ARG 55 -6.985 8.108 -12.608 415 HG2 ARG 55 HG1 ARG 55 -9.406 8.302 -12.311 416 HG3 ARG 55 HG2 ARG 55 -8.548 8.252 -10.763 417 HD2 ARG 55 HD1 ARG 55 -9.481 10.183 -10.159 418 HD3 ARG 55 HD2 ARG 55 -8.743 10.968 -11.562 419 HE ARG 55 HE ARG 55 -11.055 9.578 -12.373 420 HH11 ARG 55 1HH1 ARG 55 -10.077 12.394 -10.575 421 HH12 ARG 55 2HH1 ARG 55 -11.528 13.277 -10.916 422 HH21 ARG 55 1HH2 ARG 55 -12.970 10.730 -12.829 423 HH22 ARG 55 2HH2 ARG 55 -13.174 12.330 -12.198 424 H THR 56 H THR 56 -5.032 7.977 -10.558 425 HA THR 56 HA THR 56 -6.482 7.681 -8.106 426 HB THR 56 HB THR 56 -5.055 5.884 -7.600 427 HG1 THR 56 HG1 THR 56 -3.192 7.088 -9.390 428 HG21 THR 56 HG21 THR 56 -4.616 5.529 -10.471 429 HG22 THR 56 HG22 THR 56 -6.261 6.017 -10.062 430 HG23 THR 56 HG23 THR 56 -5.568 4.564 -9.343 431 H ARG 57 H ARG 57 -3.293 8.968 -8.986 432 HA ARG 57 HA ARG 57 -2.316 9.514 -6.450 433 HB2 ARG 57 HB2 ARG 57 -0.816 11.076 -7.478 434 HB3 ARG 57 HB1 ARG 57 -1.047 9.722 -8.593 435 HG2 ARG 57 HG1 ARG 57 -2.410 10.982 -10.038 436 HG3 ARG 57 HG2 ARG 57 -2.633 12.257 -8.829 437 HD2 ARG 57 HD1 ARG 57 -1.055 12.898 -10.635 438 HD3 ARG 57 HD2 ARG 57 -0.329 12.925 -9.021 439 HE ARG 57 HE ARG 57 0.184 10.416 -10.086 440 HH11 ARG 57 1HH1 ARG 57 0.946 13.736 -10.807 441 HH12 ARG 57 2HH1 ARG 57 2.462 13.360 -11.558 442 HH21 ARG 57 1HH2 ARG 57 2.178 9.910 -11.071 443 HH22 ARG 57 2HH2 ARG 57 3.161 11.184 -11.708 444 H GLN 58 H GLN 58 -4.773 11.143 -8.280 445 HA GLN 58 HA GLN 58 -4.752 13.625 -6.946 446 HB2 GLN 58 HB2 GLN 58 -6.868 12.112 -8.466 447 HB3 GLN 58 HB1 GLN 58 -7.206 13.680 -7.716 448 HG2 GLN 58 HG1 GLN 58 -4.980 13.232 -9.698 449 HG3 GLN 58 HG2 GLN 58 -6.607 13.761 -10.143 450 HE21 GLN 58 HE21 GLN 58 -3.713 14.621 -8.375 451 HE22 GLN 58 HE22 GLN 58 -4.005 16.323 -8.346 452 H LEU 59 H LEU 59 -6.394 10.576 -6.269 453 HA LEU 59 HA LEU 59 -7.648 11.717 -3.895 454 HB2 LEU 59 HB2 LEU 59 -7.833 8.866 -4.855 455 HB3 LEU 59 HB1 LEU 59 -8.929 9.730 -3.765 456 HG LEU 59 HG LEU 59 -8.833 11.045 -6.324 457 HD11 LEU 59 HD11 LEU 59 -8.274 8.969 -7.327 458 HD12 LEU 59 HD12 LEU 59 -10.004 9.206 -7.568 459 HD13 LEU 59 HD13 LEU 59 -9.431 8.096 -6.323 460 HD21 LEU 59 HD21 LEU 59 -11.151 11.035 -6.103 461 HD22 LEU 59 HD22 LEU 59 -10.577 11.054 -4.434 462 HD23 LEU 59 HD23 LEU 59 -11.151 9.549 -5.154 463 H ASP 60 H ASP 60 -4.674 10.918 -4.406 464 HA ASP 60 HA ASP 60 -2.933 10.223 -3.117 465 HB2 ASP 60 HB2 ASP 60 -4.775 9.839 -0.774 466 HB3 ASP 60 HB1 ASP 60 -3.103 10.415 -0.799 467 HD2 ASP 60 HD2 ASP 60 -4.415 13.574 -2.087 468 H ILE 61 H ILE 61 -3.103 8.292 -4.518 469 HA ILE 61 HA ILE 61 -3.649 5.902 -2.890 470 HB ILE 61 HB ILE 61 -4.102 6.008 -5.868 471 HG12 ILE 61 HG11 ILE 61 -6.182 6.173 -3.672 472 HG13 ILE 61 HG12 ILE 61 -5.653 7.544 -4.661 473 HG21 ILE 61 HG21 ILE 61 -5.220 4.039 -3.898 474 HG22 ILE 61 HG22 ILE 61 -5.056 3.883 -5.648 475 HG23 ILE 61 HG23 ILE 61 -3.625 3.827 -4.620 476 HD11 ILE 61 HD11 ILE 61 -6.469 5.327 -6.315 477 HD12 ILE 61 HD12 ILE 61 -7.751 5.826 -5.211 478 HD13 ILE 61 HD13 ILE 61 -7.025 7.000 -6.310 479 HA PRO 62 HA PRO 62 0.575 4.988 -3.858 480 HB2 PRO 62 HB2 PRO 62 0.602 2.431 -2.877 481 HB3 PRO 62 HB1 PRO 62 0.620 3.866 -1.853 482 HG2 PRO 62 HG1 PRO 62 -1.694 2.138 -2.664 483 HG3 PRO 62 HG2 PRO 62 -1.274 2.793 -1.037 484 HD2 PRO 62 HD1 PRO 62 -3.192 3.895 -2.610 485 HD3 PRO 62 HD2 PRO 62 -2.170 4.859 -1.530 486 H ASP 63 H ASP 63 1.625 4.131 -5.569 487 HA ASP 63 HA ASP 63 0.152 2.977 -7.698 488 HB2 ASP 63 HB2 ASP 63 3.159 2.887 -7.443 489 HB3 ASP 63 HB1 ASP 63 2.182 2.979 -8.915 490 HD2 ASP 63 HD2 ASP 63 3.499 6.293 -7.914 491 H GLU 64 H GLU 64 1.402 1.629 -4.894 492 HA GLU 64 HA GLU 64 2.151 -0.935 -5.934 493 HB2 GLU 64 HB2 GLU 64 1.379 -0.321 -3.081 494 HB3 GLU 64 HB1 GLU 64 2.453 -1.598 -3.672 495 HG2 GLU 64 HG1 GLU 64 3.010 1.368 -3.719 496 HG3 GLU 64 HG2 GLU 64 3.732 0.172 -2.633 497 HE2 GLU 64 HE2 GLU 64 5.763 0.812 -5.706 498 H LYS 65 H LYS 65 -0.772 0.519 -4.684 499 HA LYS 65 HA LYS 65 -2.170 -2.053 -4.804 500 HB2 LYS 65 HB2 LYS 65 -3.842 -1.135 -3.461 501 HB3 LYS 65 HB1 LYS 65 -2.357 -0.404 -2.829 502 HG2 LYS 65 HG1 LYS 65 -2.818 1.609 -4.225 503 HG3 LYS 65 HG2 LYS 65 -4.377 0.881 -4.653 504 HD2 LYS 65 HD1 LYS 65 -3.450 1.545 -1.847 505 HD3 LYS 65 HD2 LYS 65 -4.606 2.482 -2.810 506 HE2 LYS 65 HE1 LYS 65 -6.260 1.212 -2.023 507 HE3 LYS 65 HE2 LYS 65 -5.526 -0.179 -2.833 508 HZ1 LYS 65 3HZ LYS 65 -4.021 -0.172 -0.710 509 HZ2 LYS 65 1HZ LYS 65 -5.546 -0.904 -0.688 510 HZ3 LYS 65 2HZ LYS 65 -5.339 0.639 -0.027 511 H THR 66 H THR 66 -1.944 1.042 -6.380 512 HA THR 66 HA THR 66 -4.355 0.800 -7.897 513 HB THR 66 HB THR 66 -1.937 2.557 -8.354 514 HG1 THR 66 HG1 THR 66 -2.867 3.291 -6.532 515 HG21 THR 66 HG21 THR 66 -3.390 3.878 -9.805 516 HG22 THR 66 HG22 THR 66 -4.702 2.726 -9.558 517 HG23 THR 66 HG23 THR 66 -3.240 2.229 -10.410 518 H MET 67 H MET 67 -1.027 -0.165 -8.342 519 HA MET 67 HA MET 67 -0.881 -0.545 -11.067 520 HB2 MET 67 HB2 MET 67 0.438 -1.685 -8.698 521 HB3 MET 67 HB1 MET 67 0.461 -2.738 -10.121 522 HG2 MET 67 HG1 MET 67 1.301 0.141 -10.302 523 HG3 MET 67 HG2 MET 67 2.415 -1.121 -9.768 524 HE1 MET 67 HE1 MET 67 0.125 -0.661 -13.526 525 HE2 MET 67 HE2 MET 67 0.380 0.491 -12.216 526 HE3 MET 67 HE3 MET 67 1.493 0.451 -13.585 527 HA PRO 68 HA PRO 68 -2.763 -4.968 -10.583 528 HB2 PRO 68 HB2 PRO 68 -3.873 -5.613 -8.163 529 HB3 PRO 68 HB1 PRO 68 -2.177 -5.884 -8.558 530 HG2 PRO 68 HG1 PRO 68 -3.440 -3.614 -7.060 531 HG3 PRO 68 HG2 PRO 68 -1.958 -4.560 -6.660 532 HD2 PRO 68 HD1 PRO 68 -1.862 -2.090 -7.781 533 HD3 PRO 68 HD2 PRO 68 -0.670 -3.350 -8.138 534 H VAL 69 H VAL 69 -4.170 -2.104 -9.314 535 HA VAL 69 HA VAL 69 -6.909 -2.979 -9.538 536 HB VAL 69 HB VAL 69 -5.636 -0.307 -8.998 537 HG11 VAL 69 HG11 VAL 69 -8.231 0.177 -8.497 538 HG12 VAL 69 HG12 VAL 69 -7.446 0.572 -10.028 539 HG13 VAL 69 HG13 VAL 69 -8.389 -0.911 -9.876 540 HG21 VAL 69 HG21 VAL 69 -7.642 -1.429 -7.178 541 HG22 VAL 69 HG22 VAL 69 -6.179 -2.400 -7.345 542 HG23 VAL 69 HG23 VAL 69 -6.066 -0.717 -6.832 543 H LEU 70 H LEU 70 -4.779 -0.777 -11.344 544 HA LEU 70 HA LEU 70 -6.701 -0.188 -13.354 545 HB2 LEU 70 HB2 LEU 70 -4.977 0.972 -14.478 546 HB3 LEU 70 HB1 LEU 70 -4.707 1.210 -12.743 547 HG LEU 70 HG LEU 70 -3.103 -0.911 -13.168 548 HD11 LEU 70 HD11 LEU 70 -2.142 0.437 -15.497 549 HD12 LEU 70 HD12 LEU 70 -3.803 -0.089 -15.766 550 HD13 LEU 70 HD13 LEU 70 -2.575 -1.261 -15.291 551 HD21 LEU 70 HD21 LEU 70 -2.702 2.028 -13.209 552 HD22 LEU 70 HD22 LEU 70 -1.338 1.008 -13.666 553 HD23 LEU 70 HD23 LEU 70 -2.092 0.815 -12.083 554 H MET 71 H MET 71 -4.106 -2.552 -13.055 555 HA MET 71 HA MET 71 -4.254 -3.493 -15.734 556 HB2 MET 71 HB2 MET 71 -2.644 -5.026 -15.147 557 HB3 MET 71 HB1 MET 71 -2.393 -3.792 -13.903 558 HG2 MET 71 HG1 MET 71 -3.723 -5.093 -12.315 559 HG3 MET 71 HG2 MET 71 -3.990 -6.318 -13.557 560 HE1 MET 71 HE1 MET 71 -2.176 -8.566 -13.619 561 HE2 MET 71 HE2 MET 71 -1.725 -8.645 -11.915 562 HE3 MET 71 HE3 MET 71 -3.353 -8.144 -12.374 563 H LYS 72 H LYS 72 -6.110 -4.070 -12.892 564 HA LYS 72 HA LYS 72 -7.121 -6.633 -13.480 565 HB2 LYS 72 HB2 LYS 72 -7.317 -5.568 -11.269 566 HB3 LYS 72 HB1 LYS 72 -8.439 -4.380 -11.953 567 HG2 LYS 72 HG1 LYS 72 -10.026 -5.770 -11.200 568 HG3 LYS 72 HG2 LYS 72 -9.652 -6.695 -12.664 569 HD2 LYS 72 HD1 LYS 72 -8.052 -7.183 -10.182 570 HD3 LYS 72 HD2 LYS 72 -9.680 -7.869 -10.321 571 HE2 LYS 72 HE1 LYS 72 -8.913 -8.765 -12.607 572 HE3 LYS 72 HE2 LYS 72 -7.277 -8.387 -12.046 573 HZ1 LYS 72 3HZ LYS 72 -7.734 -9.803 -10.078 574 HZ2 LYS 72 1HZ LYS 72 -7.739 -10.652 -11.542 575 HZ3 LYS 72 2HZ LYS 72 -9.200 -10.262 -10.786 576 H LEU 73 H LEU 73 -7.971 -3.446 -14.616 577 HA LEU 73 HA LEU 73 -10.441 -4.325 -15.837 578 HB2 LEU 73 HB2 LEU 73 -9.121 -1.741 -16.543 579 HB3 LEU 73 HB1 LEU 73 -10.841 -2.121 -16.342 580 HG LEU 73 HG LEU 73 -8.872 -1.857 -14.071 581 HD11 LEU 73 HD11 LEU 73 -11.014 0.104 -14.840 582 HD12 LEU 73 HD12 LEU 73 -9.349 0.248 -15.399 583 HD13 LEU 73 HD13 LEU 73 -9.708 0.307 -13.673 584 HD21 LEU 73 HD21 LEU 73 -10.879 -1.808 -12.677 585 HD22 LEU 73 HD22 LEU 73 -10.762 -3.319 -13.580 586 HD23 LEU 73 HD23 LEU 73 -11.882 -2.061 -14.105 587 H LEU 74 H LEU 74 -7.208 -3.345 -16.918 588 HA LEU 74 HA LEU 74 -7.742 -3.701 -19.686 589 HB2 LEU 74 HB2 LEU 74 -5.101 -3.720 -18.215 590 HB3 LEU 74 HB1 LEU 74 -5.319 -3.553 -19.966 591 HG LEU 74 HG LEU 74 -6.776 -1.525 -18.476 592 HD11 LEU 74 HD11 LEU 74 -4.532 -2.134 -17.160 593 HD12 LEU 74 HD12 LEU 74 -5.146 -0.487 -17.301 594 HD13 LEU 74 HD13 LEU 74 -3.862 -1.045 -18.375 595 HD21 LEU 74 HD21 LEU 74 -4.655 -1.449 -20.619 596 HD22 LEU 74 HD22 LEU 74 -5.589 -0.060 -20.063 597 HD23 LEU 74 HD23 LEU 74 -6.402 -1.406 -20.863 598 H GLU 75 H GLU 75 -6.906 -5.845 -17.115 599 HA GLU 75 HA GLU 75 -5.765 -7.931 -18.658 600 HB2 GLU 75 HB2 GLU 75 -6.858 -7.645 -15.904 601 HB3 GLU 75 HB1 GLU 75 -6.720 -9.283 -16.559 602 HG2 GLU 75 HG1 GLU 75 -4.387 -7.408 -16.677 603 HG3 GLU 75 HG2 GLU 75 -4.766 -8.290 -15.190 604 HE2 GLU 75 HE2 GLU 75 -2.677 -10.649 -16.668 605 H GLU 76 H GLU 76 -9.043 -7.474 -17.341 606 HA GLU 76 HA GLU 76 -10.073 -9.768 -18.726 607 HB2 GLU 76 HB2 GLU 76 -11.574 -7.516 -17.372 608 HB3 GLU 76 HB1 GLU 76 -12.238 -9.089 -17.840 609 HG2 GLU 76 HG1 GLU 76 -10.033 -8.687 -15.817 610 HG3 GLU 76 HG2 GLU 76 -11.746 -8.903 -15.428 611 HE2 GLU 76 HE2 GLU 76 -9.764 -12.101 -15.623 612 H ALA 77 H ALA 77 -10.161 -6.270 -19.191 613 HA ALA 77 HA ALA 77 -11.911 -6.374 -21.452 614 HB1 ALA 77 HB1 ALA 77 -11.334 -4.001 -21.729 615 HB2 ALA 77 HB2 ALA 77 -10.101 -4.168 -20.478 616 HB3 ALA 77 HB3 ALA 77 -11.805 -4.383 -20.073 617 H GLY 78 H GLY 78 -8.615 -7.031 -21.000 618 HA2 GLY 78 HA2 GLY 78 -7.185 -7.918 -22.631 619 HA3 GLY 78 3HA GLY 78 -8.251 -7.289 -23.878 620 H GLY 79 H GLY 79 -8.003 -4.717 -22.012 621 HA2 GLY 79 HA2 GLY 79 -6.145 -3.172 -21.695 622 HA3 GLY 79 3HA GLY 79 -5.433 -3.829 -23.162 623 H ASN 80 H ASN 80 -8.709 -2.651 -22.410 624 HA ASN 80 HA ASN 80 -8.478 -0.858 -24.733 625 HB2 ASN 80 HB2 ASN 80 -10.403 -2.786 -24.147 626 HB3 ASN 80 HB1 ASN 80 -11.182 -1.253 -23.734 627 HD21 ASN 80 HD21 ASN 80 -10.676 0.519 -25.451 628 HD22 ASN 80 HD22 ASN 80 -10.954 0.033 -27.086 629 H TRP 81 H TRP 81 -7.806 1.057 -23.939 630 HA TRP 81 HA TRP 81 -8.630 2.083 -21.406 631 HB2 TRP 81 HB2 TRP 81 -7.227 3.390 -23.752 632 HB3 TRP 81 HB1 TRP 81 -7.498 4.182 -22.198 633 HD1 TRP 81 HD1 TRP 81 -5.359 1.459 -23.809 634 HE1 TRP 81 HE1 TRP 81 -3.432 0.868 -22.209 635 HE3 TRP 81 HE3 TRP 81 -6.852 4.136 -19.717 636 HZ2 TRP 81 2HZ TRP 81 -2.649 1.457 -19.562 637 HZ3 TRP 81 3HZ TRP 81 -5.457 4.067 -17.690 638 HH2 TRP 81 HH TRP 81 -3.400 2.755 -17.616 639 H SER 82 H SER 82 -9.803 2.352 -24.669 640 HA SER 82 HA SER 82 -11.283 4.692 -24.549 641 HB2 SER 82 HB2 SER 82 -11.247 3.788 -26.674 642 HB3 SER 82 HB1 SER 82 -11.546 2.142 -26.088 643 HG SER 82 HG SER 82 -13.398 4.256 -26.397 644 H TYR 83 H TYR 83 -12.198 1.422 -23.537 645 HA TYR 83 HA TYR 83 -14.772 2.348 -22.572 646 HB2 TYR 83 HB2 TYR 83 -14.965 0.223 -23.494 647 HB3 TYR 83 HB1 TYR 83 -13.431 -0.322 -22.808 648 HD1 TYR 83 HD1 TYR 83 -16.994 0.185 -22.135 649 HD2 TYR 83 HD2 TYR 83 -13.280 -1.110 -20.513 650 HE1 TYR 83 HE1 TYR 83 -18.187 -0.864 -20.258 651 HE2 TYR 83 HE2 TYR 83 -14.462 -2.165 -18.632 652 HH TYR 83 HH TYR 83 -17.661 -2.836 -18.614 653 H ILE 84 H ILE 84 -11.725 1.142 -21.244 654 HA ILE 84 HA ILE 84 -12.481 1.064 -18.545 655 HB ILE 84 HB ILE 84 -9.774 1.519 -19.798 656 HG12 ILE 84 HG11 ILE 84 -10.852 -0.930 -18.395 657 HG13 ILE 84 HG12 ILE 84 -11.015 -0.679 -20.142 658 HG21 ILE 84 HG21 ILE 84 -9.703 2.460 -17.592 659 HG22 ILE 84 HG22 ILE 84 -10.499 1.042 -16.913 660 HG23 ILE 84 HG23 ILE 84 -8.866 0.908 -17.565 661 HD11 ILE 84 HD11 ILE 84 -8.317 -0.248 -19.613 662 HD12 ILE 84 HD12 ILE 84 -8.765 -1.658 -18.651 663 HD13 ILE 84 HD13 ILE 84 -9.048 -1.653 -20.392 664 H LYS 85 H LYS 85 -11.611 3.708 -20.619 665 HA LYS 85 HA LYS 85 -11.446 5.541 -18.336 666 HB2 LYS 85 HB2 LYS 85 -10.172 6.929 -19.608 667 HB3 LYS 85 HB1 LYS 85 -9.838 5.418 -20.471 668 HG2 LYS 85 HG1 LYS 85 -11.962 6.136 -21.867 669 HG3 LYS 85 HG2 LYS 85 -11.490 7.745 -21.292 670 HD2 LYS 85 HD1 LYS 85 -9.871 5.810 -22.949 671 HD3 LYS 85 HD2 LYS 85 -10.407 7.444 -23.377 672 HE2 LYS 85 HE1 LYS 85 -8.319 6.664 -21.333 673 HE3 LYS 85 HE2 LYS 85 -8.084 7.560 -22.841 674 HZ1 LYS 85 3HZ LYS 85 -8.286 9.376 -21.597 675 HZ2 LYS 85 1HZ LYS 85 -8.888 8.519 -20.269 676 HZ3 LYS 85 2HZ LYS 85 -9.939 9.030 -21.492 677 H LEU 86 H LEU 86 -13.796 4.275 -20.166 678 HA LEU 86 HA LEU 86 -15.298 6.322 -21.234 679 HB2 LEU 86 HB2 LEU 86 -15.761 3.838 -21.305 680 HB3 LEU 86 HB1 LEU 86 -16.461 4.017 -19.687 681 HG LEU 86 HG LEU 86 -17.511 5.692 -21.928 682 HD11 LEU 86 HD11 LEU 86 -17.381 3.282 -22.671 683 HD12 LEU 86 HD12 LEU 86 -18.988 4.006 -22.666 684 HD13 LEU 86 HD13 LEU 86 -18.510 2.912 -21.368 685 HD21 LEU 86 HD21 LEU 86 -18.172 5.149 -19.199 686 HD22 LEU 86 HD22 LEU 86 -19.505 4.645 -20.236 687 HD23 LEU 86 HD23 LEU 86 -18.904 6.303 -20.314 688 H ASP 87 H ASP 87 -14.809 5.482 -17.888 689 HA ASP 87 HA ASP 87 -16.524 7.753 -17.118 690 HB2 ASP 87 HB2 ASP 87 -16.023 5.287 -15.435 691 HB3 ASP 87 HB1 ASP 87 -17.158 6.602 -15.102 692 HD2 ASP 87 HD2 ASP 87 -18.269 3.720 -17.535 693 H ASN 88 H ASN 88 -13.644 7.642 -17.727 694 HA ASN 88 HA ASN 88 -11.720 8.573 -16.945 695 HB2 ASN 88 HB2 ASN 88 -13.615 10.116 -15.881 696 HB3 ASN 88 HB1 ASN 88 -12.984 9.423 -14.383 697 HD21 ASN 88 HD21 ASN 88 -10.447 9.351 -14.438 698 HD22 ASN 88 HD22 ASN 88 -9.708 10.859 -14.842 699 H TYR 89 H TYR 89 -12.144 5.859 -16.472 700 HA TYR 89 HA TYR 89 -11.244 4.109 -15.333 701 HB2 TYR 89 HB2 TYR 89 -9.674 6.191 -13.794 702 HB3 TYR 89 HB1 TYR 89 -9.273 4.483 -13.987 703 HD1 TYR 89 HD2 TYR 89 -9.975 4.322 -16.976 704 HD2 TYR 89 HD1 TYR 89 -7.634 7.060 -14.712 705 HE1 TYR 89 HE2 TYR 89 -8.644 4.831 -18.980 706 HE2 TYR 89 HE1 TYR 89 -6.297 7.577 -16.711 707 HH TYR 89 HH TYR 89 -5.717 6.349 -18.907 708 H THR 90 H THR 90 -13.688 5.198 -14.431 709 HA THR 90 HA THR 90 -13.936 5.706 -11.729 710 HB THR 90 HB THR 90 -15.785 4.302 -13.646 711 HG1 THR 90 HG1 THR 90 -15.569 6.880 -12.498 712 HG21 THR 90 HG21 THR 90 -16.581 3.333 -11.713 713 HG22 THR 90 HG22 THR 90 -17.491 4.843 -11.722 714 HG23 THR 90 HG23 THR 90 -16.064 4.679 -10.698 715 H ALA 91 H ALA 91 -13.442 2.648 -13.367 716 HA ALA 91 HA ALA 91 -14.140 0.831 -11.414 717 HB1 ALA 91 HB1 ALA 91 -12.756 0.754 -13.840 718 HB2 ALA 91 HB2 ALA 91 -13.303 -0.618 -12.875 719 HB3 ALA 91 HB3 ALA 91 -11.674 0.021 -12.656 720 H LEU 92 H LEU 92 -11.255 2.827 -11.639 721 HA LEU 92 HA LEU 92 -9.798 1.545 -9.572 722 HB2 LEU 92 HB2 LEU 92 -8.235 3.233 -9.793 723 HB3 LEU 92 HB1 LEU 92 -8.994 3.185 -11.394 724 HG LEU 92 HG LEU 92 -10.507 5.087 -10.308 725 HD11 LEU 92 HD11 LEU 92 -9.744 5.490 -8.221 726 HD12 LEU 92 HD12 LEU 92 -8.586 6.499 -9.087 727 HD13 LEU 92 HD13 LEU 92 -8.128 4.876 -8.572 728 HD21 LEU 92 HD21 LEU 92 -9.513 6.366 -11.844 729 HD22 LEU 92 HD22 LEU 92 -8.513 4.955 -12.191 730 HD23 LEU 92 HD23 LEU 92 -7.929 6.200 -11.087 731 H VAL 93 H VAL 93 -12.179 4.118 -9.625 732 HA VAL 93 HA VAL 93 -11.792 5.084 -7.007 733 HB VAL 93 HB VAL 93 -14.193 5.116 -8.825 734 HG11 VAL 93 HG11 VAL 93 -13.913 6.147 -6.021 735 HG12 VAL 93 HG12 VAL 93 -15.043 6.873 -7.166 736 HG13 VAL 93 HG13 VAL 93 -15.209 5.174 -6.718 737 HG21 VAL 93 HG21 VAL 93 -13.199 7.681 -8.092 738 HG22 VAL 93 HG22 VAL 93 -11.843 6.681 -8.613 739 HG23 VAL 93 HG23 VAL 93 -13.223 6.921 -9.683 740 H ASP 94 H ASP 94 -14.084 2.683 -8.289 741 HA ASP 94 HA ASP 94 -15.124 2.036 -5.701 742 HB2 ASP 94 HB2 ASP 94 -16.260 1.787 -8.023 743 HB3 ASP 94 HB1 ASP 94 -15.373 0.260 -8.114 744 HD2 ASP 94 HD2 ASP 94 -18.365 0.524 -5.531 745 H ALA 95 H ALA 95 -12.558 0.837 -7.730 746 HA ALA 95 HA ALA 95 -12.190 -1.643 -6.369 747 HB1 ALA 95 HB1 ALA 95 -10.518 -0.059 -8.290 748 HB2 ALA 95 HB2 ALA 95 -11.344 -1.597 -8.544 749 HB3 ALA 95 HB3 ALA 95 -9.905 -1.525 -7.526 750 H ILE 96 H ILE 96 -10.264 1.364 -6.369 751 HA ILE 96 HA ILE 96 -8.524 0.632 -4.310 752 HB ILE 96 HB ILE 96 -9.454 3.390 -5.117 753 HG12 ILE 96 HG11 ILE 96 -8.342 2.076 -6.890 754 HG13 ILE 96 HG12 ILE 96 -7.386 3.482 -6.394 755 HG21 ILE 96 HG21 ILE 96 -7.396 4.181 -3.999 756 HG22 ILE 96 HG22 ILE 96 -8.561 3.477 -2.880 757 HG23 ILE 96 HG23 ILE 96 -7.143 2.552 -3.373 758 HD11 ILE 96 HD11 ILE 96 -6.904 0.655 -5.485 759 HD12 ILE 96 HD12 ILE 96 -5.988 1.511 -6.726 760 HD13 ILE 96 HD13 ILE 96 -5.943 2.071 -5.054 761 H TYR 97 H TYR 97 -11.681 2.204 -4.207 762 HA TYR 97 HA TYR 97 -11.693 2.923 -1.501 763 HB2 TYR 97 HB2 TYR 97 -13.766 2.453 -3.589 764 HB3 TYR 97 HB1 TYR 97 -14.303 2.489 -1.909 765 HD1 TYR 97 HD1 TYR 97 -11.591 4.509 -3.453 766 HD2 TYR 97 HD2 TYR 97 -15.499 4.499 -1.771 767 HE1 TYR 97 HE1 TYR 97 -11.605 6.968 -3.488 768 HE2 TYR 97 HE2 TYR 97 -15.525 6.958 -1.803 769 HH TYR 97 HH TYR 97 -13.219 8.800 -3.500 770 H SER 98 H SER 98 -12.356 -0.120 -3.100 771 HA SER 98 HA SER 98 -13.466 -1.392 -0.781 772 HB2 SER 98 HB2 SER 98 -14.062 -2.129 -3.053 773 HB3 SER 98 HB1 SER 98 -12.379 -2.605 -3.334 774 HG SER 98 HG SER 98 -13.894 -4.310 -2.634 775 H VAL 99 H VAL 99 -10.389 -1.773 -2.544 776 HA VAL 99 HA VAL 99 -9.187 -3.526 -0.721 777 HB VAL 99 HB VAL 99 -7.756 -1.512 -2.456 778 HG11 VAL 99 HG11 VAL 99 -5.841 -2.565 -1.963 779 HG12 VAL 99 HG12 VAL 99 -6.720 -3.188 -0.565 780 HG13 VAL 99 HG13 VAL 99 -6.589 -4.160 -2.032 781 HG21 VAL 99 HG21 VAL 99 -8.771 -2.561 -4.155 782 HG22 VAL 99 HG22 VAL 99 -7.669 -3.891 -3.799 783 HG23 VAL 99 HG23 VAL 99 -9.303 -3.898 -3.136 784 H GLU 100 H GLU 100 -8.773 0.000 -1.056 785 HA GLU 100 HA GLU 100 -7.038 0.444 1.035 786 HB2 GLU 100 HB2 GLU 100 -7.632 2.702 0.944 787 HB3 GLU 100 HB1 GLU 100 -7.999 2.103 -0.680 788 HG2 GLU 100 HG1 GLU 100 -10.374 1.857 -0.024 789 HG3 GLU 100 HG2 GLU 100 -9.972 2.579 1.540 790 HE2 GLU 100 HE2 GLU 100 -9.137 5.329 -1.059 791 H ASP 101 H ASP 101 -10.470 -0.196 1.135 792 HA ASP 101 HA ASP 101 -10.570 0.324 4.009 793 HB2 ASP 101 HB2 ASP 101 -12.391 0.872 2.107 794 HB3 ASP 101 HB1 ASP 101 -12.943 -0.741 2.577 795 HD2 ASP 101 HD2 ASP 101 -14.341 0.446 5.462 796 H GLU 102 H GLU 102 -12.316 -1.447 4.979 797 HA GLU 102 HA GLU 102 -12.158 -3.472 6.072 798 HB2 GLU 102 HB2 GLU 102 -12.571 -5.380 4.476 799 HB3 GLU 102 HB1 GLU 102 -13.705 -4.027 4.350 800 HG2 GLU 102 HG1 GLU 102 -12.524 -3.179 2.397 801 HG3 GLU 102 HG2 GLU 102 -11.356 -4.502 2.530 802 HE2 GLU 102 HE2 GLU 102 -13.997 -6.793 1.597 803 H ASN 103 H ASN 103 -9.802 -2.811 6.519 804 HA ASN 103 HA ASN 103 -7.837 -4.433 5.121 805 HB2 ASN 103 HB2 ASN 103 -7.733 -2.241 7.162 806 HB3 ASN 103 HB1 ASN 103 -6.340 -3.317 6.986 807 HD21 ASN 103 HD21 ASN 103 -8.570 -2.057 4.549 808 HD22 ASN 103 HD22 ASN 103 -7.365 -1.257 3.606 809 H LYS 104 H LYS 104 -9.679 -4.471 8.049 810 HA LYS 104 HA LYS 104 -8.181 -6.842 8.954 811 HB2 LYS 104 HB2 LYS 104 -8.979 -6.329 11.231 812 HB3 LYS 104 HB1 LYS 104 -7.992 -5.024 10.555 813 HG2 LYS 104 HG1 LYS 104 -9.635 -3.695 11.298 814 HG3 LYS 104 HG2 LYS 104 -10.467 -4.212 9.821 815 HD2 LYS 104 HD1 LYS 104 -12.092 -4.656 11.383 816 HD3 LYS 104 HD2 LYS 104 -11.248 -6.214 11.336 817 HE2 LYS 104 HE1 LYS 104 -9.891 -5.516 13.288 818 HE3 LYS 104 HE2 LYS 104 -10.821 -4.011 13.352 819 HZ1 LYS 104 3HZ LYS 104 -12.838 -5.584 13.493 820 HZ2 LYS 104 1HZ LYS 104 -11.893 -5.344 14.876 821 HZ3 LYS 104 2HZ LYS 104 -11.708 -6.753 13.957 822 H GLN 105 H GLN 105 -11.284 -5.487 8.173 823 HA GLN 105 HA GLN 105 -12.750 -7.787 9.150 824 HB2 GLN 105 HB2 GLN 105 -13.477 -5.194 7.833 825 HB3 GLN 105 HB1 GLN 105 -14.647 -6.523 7.854 826 HG2 GLN 105 HG1 GLN 105 -15.104 -6.279 10.035 827 HG3 GLN 105 HG2 GLN 105 -13.416 -5.949 10.448 828 HE21 GLN 105 HE21 GLN 105 -12.680 -3.761 9.348 829 HE22 GLN 105 HE22 GLN 105 -13.722 -2.426 9.690 830 H SER 106 H SER 106 -11.419 -9.250 7.766 831 HA SER 106 HA SER 106 -12.714 -9.553 5.145 832 HB2 SER 106 HB2 SER 106 -9.804 -10.241 5.526 833 HB3 SER 106 HB1 SER 106 -10.693 -9.952 4.020 834 HG SER 106 HG SER 106 -10.256 -7.938 5.965 835 H GLU 107 H GLU 107 -14.035 -11.063 6.395 836 HA GLU 107 HA GLU 107 -14.608 -13.126 7.185 837 HB2 GLU 107 HB2 GLU 107 -13.809 -13.444 4.711 838 HB3 GLU 107 HB1 GLU 107 -12.454 -14.299 5.465 839 HG2 GLU 107 HG1 GLU 107 -14.102 -15.762 6.634 840 HG3 GLU 107 HG2 GLU 107 -15.373 -14.984 5.681 841 HE2 GLU 107 HE2 GLU 107 -13.844 -18.005 4.047 842 H GLY 108 H GLY 108 -12.950 -11.892 8.950 843 HA2 GLY 108 HA2 GLY 108 -10.891 -13.850 9.688 844 HA3 GLY 108 3HA GLY 108 -11.055 -12.229 10.347 845 H SER 109 H SER 109 -10.641 -14.230 12.090 846 HA SER 109 HA SER 109 -11.436 -15.211 13.983 847 HB2 SER 109 HB2 SER 109 -13.875 -13.447 13.678 848 HB3 SER 109 HB1 SER 109 -13.167 -14.085 15.172 849 HG SER 109 HG SER 109 -11.441 -12.707 14.942 Start of MODEL 5 1 H1 MET 1 H MET 1 37.640 15.588 39.231 2 HA MET 1 HA MET 1 37.127 15.465 36.400 3 HB2 MET 1 HB2 MET 1 39.381 15.299 35.638 4 HB3 MET 1 HB1 MET 1 39.257 16.787 36.590 5 HG2 MET 1 HG1 MET 1 40.129 15.392 38.558 6 HG3 MET 1 HG2 MET 1 40.574 14.202 37.332 7 HE1 MET 1 HE1 MET 1 44.123 15.274 37.340 8 HE2 MET 1 HE2 MET 1 43.154 14.887 38.762 9 HE3 MET 1 HE3 MET 1 42.908 13.997 37.259 10 H GLY 2 H GLY 2 37.211 13.376 35.585 11 HA2 GLY 2 HA2 GLY 2 38.447 11.137 36.367 12 HA3 GLY 2 3HA GLY 2 37.223 11.295 37.617 13 H SER 3 H SER 3 37.613 9.246 35.512 14 HA SER 3 HA SER 3 35.822 9.438 33.416 15 HB2 SER 3 HB2 SER 3 36.144 6.858 34.940 16 HB3 SER 3 HB1 SER 3 36.001 7.111 33.190 17 HG SER 3 HG SER 3 38.094 7.092 33.169 18 H SER 4 H SER 4 33.713 9.787 33.368 19 HA SER 4 HA SER 4 31.867 8.340 34.976 20 HB2 SER 4 HB2 SER 4 32.849 10.265 36.477 21 HB3 SER 4 HB1 SER 4 31.746 11.283 35.536 22 HG SER 4 HG SER 4 30.675 10.531 37.361 23 H HIS 5 H HIS 5 30.042 8.146 33.850 24 HA HIS 5 HA HIS 5 28.491 8.410 32.205 25 HB2 HIS 5 HB2 HIS 5 28.320 10.592 33.703 26 HB3 HIS 5 HB1 HIS 5 28.883 11.371 32.220 27 HD1 HIS 5 HD1 HIS 5 26.275 8.647 32.781 28 HD2 HIS 5 HD2 HIS 5 26.706 12.364 30.976 29 HE1 HIS 5 HE1 HIS 5 24.069 9.113 31.666 30 HE2 HIS 5 HE2 HIS 5 24.332 11.384 30.562 31 H HIS 6 H HIS 6 30.815 7.687 31.141 32 HA HIS 6 HA HIS 6 31.649 9.539 29.079 33 HB2 HIS 6 HB2 HIS 6 33.090 7.784 30.386 34 HB3 HIS 6 HB1 HIS 6 32.482 6.659 29.168 35 HD1 HIS 6 HD1 HIS 6 33.613 10.239 28.610 36 HD2 HIS 6 HD2 HIS 6 34.636 6.358 27.537 37 HE1 HIS 6 HE1 HIS 6 35.455 10.473 26.913 38 HE2 HIS 6 HE2 HIS 6 36.081 8.102 26.257 39 H HIS 7 H HIS 7 29.495 6.848 29.422 40 HA HIS 7 HA HIS 7 28.017 5.862 28.002 41 HB2 HIS 7 HB2 HIS 7 27.713 8.423 27.501 42 HB3 HIS 7 HB1 HIS 7 28.473 8.008 25.961 43 HD1 HIS 7 HD1 HIS 7 25.916 5.926 27.833 44 HD2 HIS 7 HD2 HIS 7 26.326 8.046 24.283 45 HE1 HIS 7 HE1 HIS 7 23.835 5.430 26.510 46 HE2 HIS 7 HE2 HIS 7 24.085 6.725 24.340 47 H HIS 8 H HIS 8 30.498 4.790 27.912 48 HA HIS 8 HA HIS 8 30.612 3.805 25.183 49 HB2 HIS 8 HB2 HIS 8 32.211 5.835 25.517 50 HB3 HIS 8 HB1 HIS 8 33.202 4.687 26.422 51 HD1 HIS 8 HD1 HIS 8 35.105 4.228 24.884 52 HD2 HIS 8 HD2 HIS 8 31.431 3.966 22.960 53 HE1 HIS 8 HE1 HIS 8 35.615 3.373 22.574 54 HE2 HIS 8 HE2 HIS 8 33.370 3.213 21.398 55 H HIS 9 H HIS 9 31.400 1.729 25.022 56 HA HIS 9 HA HIS 9 32.401 0.473 27.482 57 HB2 HIS 9 HB2 HIS 9 30.056 -0.355 25.797 58 HB3 HIS 9 HB1 HIS 9 30.987 -1.575 26.672 59 HD1 HIS 9 HD1 HIS 9 28.428 1.034 27.163 60 HD2 HIS 9 HD2 HIS 9 30.885 -1.340 29.527 61 HE1 HIS 9 HE1 HIS 9 27.481 1.191 29.487 62 HE2 HIS 9 HE2 HIS 9 28.982 -0.260 30.932 63 H HIS 10 H HIS 10 33.739 -1.343 27.178 64 HA HIS 10 HA HIS 10 35.265 -1.270 24.751 65 HB2 HIS 10 HB2 HIS 10 36.401 -1.613 26.863 66 HB3 HIS 10 HB1 HIS 10 35.443 -3.064 27.180 67 HD1 HIS 10 HD1 HIS 10 37.259 -2.207 23.962 68 HD2 HIS 10 HD2 HIS 10 37.332 -5.018 27.020 69 HE1 HIS 10 HE1 HIS 10 38.941 -3.934 23.246 70 HE2 HIS 10 HE2 HIS 10 38.987 -5.652 25.116 71 H SER 11 H SER 11 34.220 -2.056 23.001 72 HA SER 11 HA SER 11 32.639 -4.469 23.151 73 HB2 SER 11 HB2 SER 11 31.814 -2.765 21.684 74 HB3 SER 11 HB1 SER 11 33.380 -2.636 20.864 75 HG SER 11 HG SER 11 32.687 -4.116 19.561 76 H SER 12 H SER 12 33.035 -6.360 21.874 77 HA SER 12 HA SER 12 35.728 -6.743 20.837 78 HB2 SER 12 HB2 SER 12 34.646 -8.073 23.293 79 HB3 SER 12 HB1 SER 12 35.692 -9.008 22.210 80 HG SER 12 HG SER 12 37.279 -7.384 22.448 81 H GLY 13 H GLY 13 35.930 -8.524 19.430 82 HA2 GLY 13 HA2 GLY 13 33.633 -9.114 17.910 83 HA3 GLY 13 3HA GLY 13 35.187 -9.924 17.769 84 H LEU 14 H LEU 14 31.973 -10.310 18.568 85 HA LEU 14 HA LEU 14 32.198 -12.316 20.582 86 HB2 LEU 14 HB2 LEU 14 30.166 -10.972 20.253 87 HB3 LEU 14 HB1 LEU 14 29.939 -11.737 18.671 88 HG LEU 14 HG LEU 14 29.911 -13.945 20.116 89 HD11 LEU 14 HD11 LEU 14 28.797 -11.967 22.088 90 HD12 LEU 14 HD12 LEU 14 30.431 -12.620 22.201 91 HD13 LEU 14 HD13 LEU 14 29.041 -13.701 22.298 92 HD21 LEU 14 HD21 LEU 14 27.711 -14.000 19.643 93 HD22 LEU 14 HD22 LEU 14 28.055 -12.492 18.794 94 HD23 LEU 14 HD23 LEU 14 27.394 -12.454 20.431 95 H VAL 15 H VAL 15 32.617 -14.421 20.389 96 HA VAL 15 HA VAL 15 32.375 -15.673 17.737 97 HB VAL 15 HB VAL 15 34.421 -17.057 18.417 98 HG11 VAL 15 HG11 VAL 15 34.530 -14.169 17.607 99 HG12 VAL 15 HG12 VAL 15 35.983 -15.169 17.682 100 HG13 VAL 15 HG13 VAL 15 34.664 -15.606 16.595 101 HG21 VAL 15 HG21 VAL 15 34.347 -16.164 20.790 102 HG22 VAL 15 HG22 VAL 15 35.928 -16.181 20.009 103 HG23 VAL 15 HG23 VAL 15 35.027 -14.671 20.144 104 HA PRO 16 HA PRO 16 30.262 -18.961 19.733 105 HB2 PRO 16 HB2 PRO 16 31.034 -21.108 18.218 106 HB3 PRO 16 HB1 PRO 16 29.927 -19.861 17.646 107 HG2 PRO 16 HG1 PRO 16 32.879 -20.136 17.190 108 HG3 PRO 16 HG2 PRO 16 31.574 -19.740 16.009 109 HD2 PRO 16 HD1 PRO 16 33.205 -17.852 17.079 110 HD3 PRO 16 HD2 PRO 16 31.511 -17.534 16.671 111 H ARG 17 H ARG 17 30.721 -19.796 21.662 112 HA ARG 17 HA ARG 17 33.265 -21.241 22.003 113 HB2 ARG 17 HB2 ARG 17 31.898 -19.637 24.169 114 HB3 ARG 17 HB1 ARG 17 33.510 -20.366 24.215 115 HG2 ARG 17 HG1 ARG 17 32.660 -18.069 22.449 116 HG3 ARG 17 HG2 ARG 17 33.644 -17.957 23.917 117 HD2 ARG 17 HD1 ARG 17 35.009 -19.844 22.466 118 HD3 ARG 17 HD2 ARG 17 34.399 -18.762 21.206 119 HE ARG 17 HE ARG 17 35.948 -17.232 21.868 120 HH11 ARG 17 1HH1 ARG 17 35.331 -19.391 24.529 121 HH12 ARG 17 2HH1 ARG 17 36.537 -18.683 25.553 122 HH21 ARG 17 1HH2 ARG 17 37.536 -16.291 23.207 123 HH22 ARG 17 2HH2 ARG 17 37.789 -16.919 24.800 124 H GLY 18 H GLY 18 31.741 -23.026 21.341 125 HA2 GLY 18 HA2 GLY 18 31.257 -24.821 23.297 126 HA3 GLY 18 3HA GLY 18 29.792 -23.850 23.318 127 H SER 19 H SER 19 29.462 -26.443 22.813 128 HA SER 19 HA SER 19 29.346 -26.770 19.903 129 HB2 SER 19 HB2 SER 19 30.336 -28.567 21.411 130 HB3 SER 19 HB1 SER 19 28.685 -28.854 21.987 131 HG SER 19 HG SER 19 29.859 -29.614 19.648 132 H HIS 20 H HIS 20 27.320 -28.121 19.216 133 HA HIS 20 HA HIS 20 25.081 -28.129 18.813 134 HB2 HIS 20 HB2 HIS 20 25.131 -28.918 21.236 135 HB3 HIS 20 HB1 HIS 20 24.705 -27.261 21.679 136 HD1 HIS 20 HD1 HIS 20 23.147 -28.641 18.606 137 HD2 HIS 20 HD2 HIS 20 22.201 -28.188 22.627 138 HE1 HIS 20 HE1 HIS 20 20.674 -29.072 18.768 139 HE2 HIS 20 HE2 HIS 20 20.095 -28.795 21.225 140 H MET 21 H MET 21 26.523 -25.770 18.216 141 HA MET 21 HA MET 21 24.520 -23.679 18.754 142 HB2 MET 21 HB2 MET 21 27.042 -23.446 19.438 143 HB3 MET 21 HB1 MET 21 27.265 -23.069 17.722 144 HG2 MET 21 HG1 MET 21 27.014 -20.977 18.684 145 HG3 MET 21 HG2 MET 21 25.403 -21.341 18.060 146 HE1 MET 21 HE1 MET 21 23.541 -20.459 19.353 147 HE2 MET 21 HE2 MET 21 23.364 -22.193 19.620 148 HE3 MET 21 HE3 MET 21 23.144 -21.067 20.961 149 H ILE 22 H ILE 22 23.152 -23.488 17.109 150 HA ILE 22 HA ILE 22 24.256 -23.367 14.389 151 HB ILE 22 HB ILE 22 23.220 -25.595 14.738 152 HG12 ILE 22 HG11 ILE 22 21.392 -24.121 12.883 153 HG13 ILE 22 HG12 ILE 22 23.133 -24.107 12.555 154 HG21 ILE 22 HG21 ILE 22 20.514 -24.371 14.783 155 HG22 ILE 22 HG22 ILE 22 21.065 -25.924 15.410 156 HG23 ILE 22 HG23 ILE 22 21.423 -24.439 16.293 157 HD11 ILE 22 HD11 ILE 22 21.248 -26.117 11.925 158 HD12 ILE 22 HD12 ILE 22 22.982 -26.089 11.599 159 HD13 ILE 22 HD13 ILE 22 22.379 -26.782 13.104 160 H SER 23 H SER 23 23.419 -21.801 13.107 161 HA SER 23 HA SER 23 21.780 -19.796 14.358 162 HB2 SER 23 HB2 SER 23 23.761 -19.520 12.647 163 HB3 SER 23 HB1 SER 23 22.477 -19.738 11.443 164 HG SER 23 HG SER 23 22.966 -17.611 13.133 165 H LEU 24 H LEU 24 20.056 -21.612 14.548 166 HA LEU 24 HA LEU 24 18.549 -22.516 12.416 167 HB2 LEU 24 HB2 LEU 24 18.217 -23.341 14.662 168 HB3 LEU 24 HB1 LEU 24 17.657 -21.745 15.189 169 HG LEU 24 HG LEU 24 15.696 -22.013 13.652 170 HD11 LEU 24 HD11 LEU 24 15.160 -24.255 12.861 171 HD12 LEU 24 HD12 LEU 24 16.706 -24.848 13.465 172 HD13 LEU 24 HD13 LEU 24 16.665 -23.674 12.151 173 HD21 LEU 24 HD21 LEU 24 16.074 -22.889 16.210 174 HD22 LEU 24 HD22 LEU 24 15.454 -24.337 15.415 175 HD23 LEU 24 HD23 LEU 24 14.523 -22.839 15.372 176 H SER 25 H SER 25 18.551 -19.378 13.961 177 HA SER 25 HA SER 25 16.137 -18.424 12.808 178 HB2 SER 25 HB2 SER 25 18.378 -16.561 13.520 179 HB3 SER 25 HB1 SER 25 16.636 -16.389 13.801 180 HG SER 25 HG SER 25 18.096 -16.938 15.663 181 H GLY 26 H GLY 26 15.833 -17.001 11.062 182 HA2 GLY 26 HA2 GLY 26 17.784 -15.949 9.391 183 HA3 GLY 26 3HA GLY 26 17.431 -17.559 8.782 184 H LEU 27 H LEU 27 14.683 -17.661 9.338 185 HA LEU 27 HA LEU 27 13.699 -15.719 7.365 186 HB2 LEU 27 HB2 LEU 27 11.955 -17.266 6.840 187 HB3 LEU 27 HB1 LEU 27 13.501 -18.134 6.834 188 HG LEU 27 HG LEU 27 11.845 -18.205 9.310 189 HD11 LEU 27 HD11 LEU 27 11.186 -19.548 6.720 190 HD12 LEU 27 HD12 LEU 27 10.114 -18.759 7.876 191 HD13 LEU 27 HD13 LEU 27 10.817 -20.331 8.257 192 HD21 LEU 27 HD21 LEU 27 12.835 -20.708 8.713 193 HD22 LEU 27 HD22 LEU 27 13.563 -19.535 9.811 194 HD23 LEU 27 HD23 LEU 27 14.094 -19.620 8.130 195 H THR 28 H THR 28 13.958 -15.702 10.489 196 HA THR 28 HA THR 28 11.215 -15.282 11.301 197 HB THR 28 HB THR 28 12.217 -14.627 13.492 198 HG1 THR 28 HG1 THR 28 14.684 -15.402 12.298 199 HG21 THR 28 HG21 THR 28 12.185 -17.179 12.245 200 HG22 THR 28 HG22 THR 28 12.033 -16.796 13.960 201 HG23 THR 28 HG23 THR 28 13.625 -17.089 13.259 202 H SER 29 H SER 29 10.261 -13.496 10.530 203 HA SER 29 HA SER 29 9.840 -11.313 10.040 204 HB2 SER 29 HB2 SER 29 11.678 -11.052 12.425 205 HB3 SER 29 HB1 SER 29 10.944 -9.640 11.644 206 HG SER 29 HG SER 29 9.850 -11.204 13.452 207 H SER 30 H SER 30 11.663 -12.462 8.344 208 HA SER 30 HA SER 30 13.471 -10.208 7.779 209 HB2 SER 30 HB2 SER 30 14.025 -13.163 7.738 210 HB3 SER 30 HB1 SER 30 14.914 -12.082 6.652 211 HG SER 30 HG SER 30 15.023 -12.293 9.424 212 H VAL 31 H VAL 31 13.342 -9.377 5.784 213 HA VAL 31 HA VAL 31 12.261 -8.916 3.796 214 HB VAL 31 HB VAL 31 12.856 -10.529 2.025 215 HG11 VAL 31 HG11 VAL 31 15.424 -10.647 3.034 216 HG12 VAL 31 HG12 VAL 31 14.721 -9.309 2.125 217 HG13 VAL 31 HG13 VAL 31 14.703 -9.284 3.889 218 HG21 VAL 31 HG21 VAL 31 13.932 -12.593 2.482 219 HG22 VAL 31 HG22 VAL 31 14.066 -12.224 4.201 220 HG23 VAL 31 HG23 VAL 31 12.486 -12.550 3.489 221 H GLU 32 H GLU 32 10.349 -9.762 5.591 222 HA GLU 32 HA GLU 32 8.780 -11.915 4.563 223 HB2 GLU 32 HB2 GLU 32 7.043 -11.100 6.129 224 HB3 GLU 32 HB1 GLU 32 8.618 -11.333 6.903 225 HG2 GLU 32 HG1 GLU 32 9.048 -8.985 6.936 226 HG3 GLU 32 HG2 GLU 32 7.618 -8.665 5.944 227 HE2 GLU 32 HE2 GLU 32 6.238 -10.027 9.305 228 H SER 33 H SER 33 9.018 -8.526 3.906 229 HA SER 33 HA SER 33 6.664 -8.708 2.141 230 HB2 SER 33 HB2 SER 33 7.845 -6.289 3.539 231 HB3 SER 33 HB1 SER 33 6.536 -6.218 2.346 232 HG SER 33 HG SER 33 6.091 -6.402 4.789 233 H ASP 34 H ASP 34 10.035 -7.997 2.393 234 HA ASP 34 HA ASP 34 10.483 -6.503 0.092 235 HB2 ASP 34 HB2 ASP 34 12.157 -7.092 1.900 236 HB3 ASP 34 HB1 ASP 34 12.324 -8.668 1.113 237 HD2 ASP 34 HD2 ASP 34 14.576 -7.374 -1.097 238 H LEU 35 H LEU 35 9.672 -9.848 0.456 239 HA LEU 35 HA LEU 35 10.630 -10.966 -1.881 240 HB2 LEU 35 HB2 LEU 35 9.192 -11.915 0.133 241 HB3 LEU 35 HB1 LEU 35 7.868 -11.649 -1.015 242 HG LEU 35 HG LEU 35 8.658 -13.961 -1.060 243 HD11 LEU 35 HD11 LEU 35 9.645 -13.035 -3.663 244 HD12 LEU 35 HD12 LEU 35 8.074 -12.391 -3.192 245 HD13 LEU 35 HD13 LEU 35 8.324 -14.135 -3.272 246 HD21 LEU 35 HD21 LEU 35 11.119 -13.648 -2.446 247 HD22 LEU 35 HD22 LEU 35 10.814 -14.454 -0.907 248 HD23 LEU 35 HD23 LEU 35 11.211 -12.736 -0.939 249 H ASP 36 H ASP 36 7.868 -8.865 -1.392 250 HA ASP 36 HA ASP 36 6.520 -9.220 -3.794 251 HB2 ASP 36 HB2 ASP 36 5.390 -7.235 -3.332 252 HB3 ASP 36 HB1 ASP 36 5.927 -7.758 -1.731 253 HD2 ASP 36 HD2 ASP 36 8.510 -5.234 -1.873 254 H MET 37 H MET 37 9.531 -7.631 -3.144 255 HA MET 37 HA MET 37 9.747 -5.909 -5.312 256 HB2 MET 37 HB2 MET 37 11.884 -7.568 -3.954 257 HB3 MET 37 HB1 MET 37 12.212 -6.249 -5.087 258 HG2 MET 37 HG1 MET 37 10.672 -5.903 -2.517 259 HG3 MET 37 HG2 MET 37 12.411 -5.639 -2.678 260 HE1 MET 37 HE1 MET 37 13.195 -3.707 -2.551 261 HE2 MET 37 HE2 MET 37 12.812 -2.242 -3.456 262 HE3 MET 37 HE3 MET 37 11.951 -2.606 -1.959 263 H GLN 38 H GLN 38 9.987 -9.381 -5.174 264 HA GLN 38 HA GLN 38 11.187 -9.674 -7.764 265 HB2 GLN 38 HB2 GLN 38 10.027 -11.522 -5.715 266 HB3 GLN 38 HB1 GLN 38 10.262 -12.112 -7.369 267 HG2 GLN 38 HG1 GLN 38 12.573 -11.911 -7.267 268 HG3 GLN 38 HG2 GLN 38 12.502 -10.783 -5.904 269 HE21 GLN 38 HE21 GLN 38 13.122 -11.610 -4.054 270 HE22 GLN 38 HE22 GLN 38 12.977 -13.261 -3.569 271 H GLN 39 H GLN 39 7.966 -9.392 -6.517 272 HA GLN 39 HA GLN 39 6.646 -10.477 -8.815 273 HB2 GLN 39 HB2 GLN 39 5.469 -8.607 -6.755 274 HB3 GLN 39 HB1 GLN 39 4.610 -9.761 -7.786 275 HG2 GLN 39 HG1 GLN 39 6.579 -10.530 -5.633 276 HG3 GLN 39 HG2 GLN 39 4.822 -10.490 -5.432 277 HE21 GLN 39 HE21 GLN 39 7.506 -12.200 -6.734 278 HE22 GLN 39 HE22 GLN 39 6.636 -13.592 -7.275 279 H ALA 40 H ALA 40 7.948 -7.402 -7.943 280 HA ALA 40 HA ALA 40 6.412 -5.730 -9.604 281 HB1 ALA 40 HB1 ALA 40 7.607 -4.331 -8.340 282 HB2 ALA 40 HB2 ALA 40 8.887 -4.540 -9.535 283 HB3 ALA 40 HB3 ALA 40 8.879 -5.522 -8.070 284 H MET 41 H MET 41 8.955 -7.968 -10.291 285 HA MET 41 HA MET 41 9.683 -6.846 -12.829 286 HB2 MET 41 HB2 MET 41 10.169 -9.647 -11.788 287 HB3 MET 41 HB1 MET 41 11.014 -8.852 -13.125 288 HG2 MET 41 HG1 MET 41 11.076 -7.805 -10.300 289 HG3 MET 41 HG2 MET 41 12.249 -8.962 -10.934 290 HE1 MET 41 HE1 MET 41 13.405 -8.494 -13.337 291 HE2 MET 41 HE2 MET 41 14.401 -7.038 -13.369 292 HE3 MET 41 HE3 MET 41 14.506 -8.150 -12.002 293 H LEU 42 H LEU 42 7.654 -9.545 -11.751 294 HA LEU 42 HA LEU 42 6.955 -10.423 -14.358 295 HB2 LEU 42 HB2 LEU 42 5.973 -10.922 -11.588 296 HB3 LEU 42 HB1 LEU 42 4.930 -11.377 -12.946 297 HG LEU 42 HG LEU 42 6.658 -12.865 -13.804 298 HD11 LEU 42 HD11 LEU 42 8.266 -11.551 -11.696 299 HD12 LEU 42 HD12 LEU 42 8.739 -12.127 -13.293 300 HD13 LEU 42 HD13 LEU 42 8.542 -13.272 -11.967 301 HD21 LEU 42 HD21 LEU 42 6.830 -14.185 -11.420 302 HD22 LEU 42 HD22 LEU 42 5.459 -14.256 -12.525 303 HD23 LEU 42 HD23 LEU 42 5.435 -13.138 -11.162 304 H THR 43 H THR 43 5.911 -7.812 -12.407 305 HA THR 43 HA THR 43 3.573 -7.394 -14.154 306 HB THR 43 HB THR 43 2.946 -7.633 -11.797 307 HG1 THR 43 HG1 THR 43 1.739 -6.172 -13.074 308 HG21 THR 43 HG21 THR 43 4.026 -6.653 -10.094 309 HG22 THR 43 HG22 THR 43 4.072 -5.091 -10.910 310 HG23 THR 43 HG23 THR 43 5.299 -6.307 -11.262 311 H ASN 44 H ASN 44 6.062 -6.681 -15.113 312 HA ASN 44 HA ASN 44 7.013 -4.146 -14.590 313 HB2 ASN 44 HB2 ASN 44 7.908 -5.935 -16.214 314 HB3 ASN 44 HB1 ASN 44 6.809 -5.219 -17.398 315 HD21 ASN 44 HD21 ASN 44 9.212 -4.153 -15.012 316 HD22 ASN 44 HD22 ASN 44 9.951 -2.973 -16.034 317 H LYS 45 H LYS 45 6.041 -2.241 -14.591 318 HA LYS 45 HA LYS 45 3.483 -1.817 -15.768 319 HB2 LYS 45 HB2 LYS 45 3.483 0.237 -14.716 320 HB3 LYS 45 HB1 LYS 45 4.617 -0.672 -13.703 321 HG2 LYS 45 HG1 LYS 45 5.382 1.233 -15.919 322 HG3 LYS 45 HG2 LYS 45 5.429 1.581 -14.180 323 HD2 LYS 45 HD1 LYS 45 6.988 -0.639 -15.521 324 HD3 LYS 45 HD2 LYS 45 7.641 0.965 -15.139 325 HE2 LYS 45 HE1 LYS 45 7.120 0.582 -12.744 326 HE3 LYS 45 HE2 LYS 45 6.564 -1.045 -13.163 327 HZ1 LYS 45 3HZ LYS 45 8.661 -1.645 -12.775 328 HZ2 LYS 45 1HZ LYS 45 9.243 -0.058 -12.845 329 HZ3 LYS 45 2HZ LYS 45 9.032 -0.946 -14.270 330 H ASP 46 H ASP 46 3.165 0.274 -17.124 331 HA ASP 46 HA ASP 46 5.235 0.450 -19.204 332 HB2 ASP 46 HB2 ASP 46 2.715 -0.786 -19.506 333 HB3 ASP 46 HB1 ASP 46 2.609 0.766 -20.347 334 HD2 ASP 46 HD2 ASP 46 4.443 -2.074 -22.159 335 H GLU 47 H GLU 47 4.556 2.329 -20.787 336 HA GLU 47 HA GLU 47 4.587 4.706 -19.237 337 HB2 GLU 47 HB2 GLU 47 4.159 4.360 -22.215 338 HB3 GLU 47 HB1 GLU 47 4.572 5.874 -21.394 339 HG2 GLU 47 HG1 GLU 47 6.338 3.451 -21.210 340 HG3 GLU 47 HG2 GLU 47 6.447 4.591 -22.559 341 HE2 GLU 47 HE2 GLU 47 8.373 6.696 -20.684 342 H LYS 48 H LYS 48 2.182 3.402 -21.519 343 HA LYS 48 HA LYS 48 0.236 5.362 -21.159 344 HB2 LYS 48 HB2 LYS 48 -1.383 3.537 -21.878 345 HB3 LYS 48 HB1 LYS 48 -0.038 3.879 -22.979 346 HG2 LYS 48 HG1 LYS 48 -0.056 1.579 -22.971 347 HG3 LYS 48 HG2 LYS 48 1.148 1.940 -21.722 348 HD2 LYS 48 HD1 LYS 48 -0.094 1.026 -20.094 349 HD3 LYS 48 HD2 LYS 48 -1.569 1.820 -20.672 350 HE2 LYS 48 HE1 LYS 48 -1.905 -0.546 -20.843 351 HE3 LYS 48 HE2 LYS 48 -1.704 0.101 -22.478 352 HZ1 LYS 48 3HZ LYS 48 -0.399 -1.830 -22.379 353 HZ2 LYS 48 1HZ LYS 48 0.266 -1.422 -20.878 354 HZ3 LYS 48 2HZ LYS 48 0.705 -0.554 -22.261 355 H VAL 49 H VAL 49 1.064 2.597 -19.200 356 HA VAL 49 HA VAL 49 -1.258 2.362 -17.665 357 HB VAL 49 HB VAL 49 1.620 1.824 -16.934 358 HG11 VAL 49 HG11 VAL 49 0.856 1.868 -14.814 359 HG12 VAL 49 HG12 VAL 49 -0.831 1.709 -15.307 360 HG13 VAL 49 HG13 VAL 49 0.204 0.283 -15.229 361 HG21 VAL 49 HG21 VAL 49 1.222 0.166 -18.406 362 HG22 VAL 49 HG22 VAL 49 0.377 -0.575 -17.047 363 HG23 VAL 49 HG23 VAL 49 -0.530 0.320 -18.267 364 H LEU 50 H LEU 50 1.428 4.603 -17.446 365 HA LEU 50 HA LEU 50 0.993 5.611 -14.878 366 HB2 LEU 50 HB2 LEU 50 1.951 7.168 -17.284 367 HB3 LEU 50 HB1 LEU 50 2.241 7.549 -15.578 368 HG LEU 50 HG LEU 50 3.334 5.133 -17.020 369 HD11 LEU 50 HD11 LEU 50 5.372 6.871 -16.153 370 HD12 LEU 50 HD12 LEU 50 4.193 7.855 -17.019 371 HD13 LEU 50 HD13 LEU 50 4.924 6.459 -17.808 372 HD21 LEU 50 HD21 LEU 50 3.202 4.540 -14.772 373 HD22 LEU 50 HD22 LEU 50 3.578 6.171 -14.218 374 HD23 LEU 50 HD23 LEU 50 4.841 5.170 -14.936 375 H LYS 51 H LYS 51 -0.600 6.295 -17.919 376 HA LYS 51 HA LYS 51 -1.890 8.669 -17.375 377 HB2 LYS 51 HB2 LYS 51 -2.964 6.256 -18.855 378 HB3 LYS 51 HB1 LYS 51 -3.661 7.881 -18.928 379 HG2 LYS 51 HG1 LYS 51 -0.854 7.175 -19.787 380 HG3 LYS 51 HG2 LYS 51 -2.247 7.339 -20.873 381 HD2 LYS 51 HD1 LYS 51 -1.194 9.527 -19.066 382 HD3 LYS 51 HD2 LYS 51 -0.842 9.374 -20.797 383 HE2 LYS 51 HE1 LYS 51 -3.547 9.830 -19.517 384 HE3 LYS 51 HE2 LYS 51 -2.618 10.969 -20.503 385 HZ1 LYS 51 3HZ LYS 51 -4.046 8.535 -21.361 386 HZ2 LYS 51 1HZ LYS 51 -2.787 9.165 -22.299 387 HZ3 LYS 51 2HZ LYS 51 -4.156 10.106 -21.979 388 H ALA 52 H ALA 52 -2.653 5.439 -16.238 389 HA ALA 52 HA ALA 52 -5.196 6.107 -15.132 390 HB1 ALA 52 HB1 ALA 52 -5.264 3.882 -15.206 391 HB2 ALA 52 HB2 ALA 52 -4.284 3.894 -13.739 392 HB3 ALA 52 HB3 ALA 52 -3.508 3.759 -15.317 393 H LEU 53 H LEU 53 -1.916 5.859 -13.823 394 HA LEU 53 HA LEU 53 -2.532 6.224 -11.121 395 HB2 LEU 53 HB2 LEU 53 -0.058 7.178 -12.572 396 HB3 LEU 53 HB1 LEU 53 -0.220 6.872 -10.833 397 HG LEU 53 HG LEU 53 -0.308 4.795 -13.022 398 HD11 LEU 53 HD11 LEU 53 1.926 5.654 -12.652 399 HD12 LEU 53 HD12 LEU 53 1.788 4.020 -12.004 400 HD13 LEU 53 HD13 LEU 53 1.758 5.406 -10.914 401 HD21 LEU 53 HD21 LEU 53 -0.336 3.178 -11.171 402 HD22 LEU 53 HD22 LEU 53 -1.786 4.181 -11.202 403 HD23 LEU 53 HD23 LEU 53 -0.511 4.508 -10.026 404 H GLU 54 H GLU 54 -2.597 8.432 -13.747 405 HA GLU 54 HA GLU 54 -2.177 10.848 -12.338 406 HB2 GLU 54 HB2 GLU 54 -3.749 10.321 -14.873 407 HB3 GLU 54 HB1 GLU 54 -3.267 11.920 -14.284 408 HG2 GLU 54 HG1 GLU 54 -1.536 9.718 -15.365 409 HG3 GLU 54 HG2 GLU 54 -1.698 11.387 -15.927 410 HE2 GLU 54 HE2 GLU 54 0.776 10.628 -12.941 411 H ARG 55 H ARG 55 -5.067 8.949 -13.051 412 HA ARG 55 HA ARG 55 -6.860 10.867 -11.891 413 HB2 ARG 55 HB2 ARG 55 -7.752 9.495 -13.614 414 HB3 ARG 55 HB1 ARG 55 -7.195 8.017 -12.815 415 HG2 ARG 55 HG1 ARG 55 -9.623 8.328 -12.616 416 HG3 ARG 55 HG2 ARG 55 -8.808 8.311 -11.044 417 HD2 ARG 55 HD1 ARG 55 -9.427 10.414 -10.563 418 HD3 ARG 55 HD2 ARG 55 -9.009 10.983 -12.185 419 HE ARG 55 HE ARG 55 -11.345 9.538 -12.461 420 HH11 ARG 55 1HH1 ARG 55 -10.281 12.372 -10.740 421 HH12 ARG 55 2HH1 ARG 55 -11.838 13.133 -10.769 422 HH21 ARG 55 1HH2 ARG 55 -13.399 10.531 -12.506 423 HH22 ARG 55 2HH2 ARG 55 -13.611 12.085 -11.773 424 H THR 56 H THR 56 -5.182 7.986 -10.816 425 HA THR 56 HA THR 56 -6.631 7.716 -8.364 426 HB THR 56 HB THR 56 -5.169 5.968 -7.811 427 HG1 THR 56 HG1 THR 56 -3.312 7.194 -9.591 428 HG21 THR 56 HG21 THR 56 -6.347 6.012 -10.284 429 HG22 THR 56 HG22 THR 56 -5.606 4.596 -9.536 430 HG23 THR 56 HG23 THR 56 -4.683 5.579 -10.672 431 H ARG 57 H ARG 57 -3.483 9.080 -9.264 432 HA ARG 57 HA ARG 57 -2.543 9.716 -6.728 433 HB2 ARG 57 HB2 ARG 57 -1.070 11.290 -7.790 434 HB3 ARG 57 HB1 ARG 57 -1.237 9.878 -8.844 435 HG2 ARG 57 HG1 ARG 57 -2.561 11.021 -10.394 436 HG3 ARG 57 HG2 ARG 57 -2.930 12.316 -9.242 437 HD2 ARG 57 HD1 ARG 57 -1.310 13.011 -10.986 438 HD3 ARG 57 HD2 ARG 57 -0.663 13.126 -9.343 439 HE ARG 57 HE ARG 57 -0.006 10.619 -10.475 440 HH11 ARG 57 1HH1 ARG 57 0.814 13.999 -10.643 441 HH12 ARG 57 2HH1 ARG 57 2.440 13.712 -11.167 442 HH21 ARG 57 1HH2 ARG 57 2.133 10.230 -11.165 443 HH22 ARG 57 2HH2 ARG 57 3.189 11.568 -11.465 444 H GLN 58 H GLN 58 -5.016 11.221 -8.635 445 HA GLN 58 HA GLN 58 -5.062 13.748 -7.384 446 HB2 GLN 58 HB2 GLN 58 -7.132 12.147 -8.880 447 HB3 GLN 58 HB1 GLN 58 -7.497 13.740 -8.197 448 HG2 GLN 58 HG1 GLN 58 -5.241 13.235 -10.132 449 HG3 GLN 58 HG2 GLN 58 -6.868 13.733 -10.617 450 HE21 GLN 58 HE21 GLN 58 -3.998 14.687 -8.859 451 HE22 GLN 58 HE22 GLN 58 -4.305 16.387 -8.896 452 H LEU 59 H LEU 59 -6.667 10.693 -6.645 453 HA LEU 59 HA LEU 59 -7.986 11.877 -4.330 454 HB2 LEU 59 HB2 LEU 59 -8.070 8.991 -5.198 455 HB3 LEU 59 HB1 LEU 59 -9.209 9.855 -4.151 456 HG LEU 59 HG LEU 59 -9.108 11.090 -6.752 457 HD11 LEU 59 HD11 LEU 59 -9.777 8.151 -6.691 458 HD12 LEU 59 HD12 LEU 59 -8.440 8.903 -7.561 459 HD13 LEU 59 HD13 LEU 59 -10.104 9.250 -8.031 460 HD21 LEU 59 HD21 LEU 59 -11.396 9.573 -5.538 461 HD22 LEU 59 HD22 LEU 59 -11.437 11.001 -6.574 462 HD23 LEU 59 HD23 LEU 59 -10.881 11.136 -4.905 463 H ASP 60 H ASP 60 -4.983 11.161 -4.748 464 HA ASP 60 HA ASP 60 -3.248 10.568 -3.399 465 HB2 ASP 60 HB2 ASP 60 -5.211 10.245 -1.130 466 HB3 ASP 60 HB1 ASP 60 -3.508 10.720 -1.055 467 HD2 ASP 60 HD2 ASP 60 -5.891 13.608 -0.950 468 H ILE 61 H ILE 61 -3.355 8.594 -4.768 469 HA ILE 61 HA ILE 61 -3.837 6.230 -3.080 470 HB ILE 61 HB ILE 61 -4.251 6.273 -6.066 471 HG12 ILE 61 HG11 ILE 61 -6.353 6.324 -3.887 472 HG13 ILE 61 HG12 ILE 61 -5.897 7.721 -4.878 473 HG21 ILE 61 HG21 ILE 61 -3.667 4.134 -4.737 474 HG22 ILE 61 HG22 ILE 61 -5.323 4.249 -4.142 475 HG23 ILE 61 HG23 ILE 61 -5.016 4.092 -5.872 476 HD11 ILE 61 HD11 ILE 61 -6.584 5.432 -6.508 477 HD12 ILE 61 HD12 ILE 61 -7.900 5.915 -5.436 478 HD13 ILE 61 HD13 ILE 61 -7.199 7.084 -6.555 479 HA PRO 62 HA PRO 62 0.435 5.442 -3.941 480 HB2 PRO 62 HB2 PRO 62 0.531 2.915 -2.888 481 HB3 PRO 62 HB1 PRO 62 0.479 4.376 -1.905 482 HG2 PRO 62 HG1 PRO 62 -1.757 2.546 -2.710 483 HG3 PRO 62 HG2 PRO 62 -1.393 3.260 -1.094 484 HD2 PRO 62 HD1 PRO 62 -3.315 4.251 -2.736 485 HD3 PRO 62 HD2 PRO 62 -2.350 5.279 -1.662 486 H ASP 63 H ASP 63 1.536 4.596 -5.620 487 HA ASP 63 HA ASP 63 0.145 3.315 -7.731 488 HB2 ASP 63 HB2 ASP 63 2.012 4.760 -8.232 489 HB3 ASP 63 HB1 ASP 63 3.099 3.755 -7.264 490 HD2 ASP 63 HD2 ASP 63 3.856 1.945 -10.052 491 H GLU 64 H GLU 64 1.423 2.107 -4.878 492 HA GLU 64 HA GLU 64 2.318 -0.441 -5.829 493 HB2 GLU 64 HB2 GLU 64 1.454 0.236 -3.014 494 HB3 GLU 64 HB1 GLU 64 2.571 -1.036 -3.531 495 HG2 GLU 64 HG1 GLU 64 4.136 0.729 -4.327 496 HG3 GLU 64 HG2 GLU 64 3.048 1.932 -3.620 497 HE2 GLU 64 HE2 GLU 64 5.593 1.071 -1.164 498 H LYS 65 H LYS 65 -0.687 0.852 -4.544 499 HA LYS 65 HA LYS 65 -1.951 -1.774 -4.634 500 HB2 LYS 65 HB2 LYS 65 -3.727 -0.860 -3.418 501 HB3 LYS 65 HB1 LYS 65 -2.300 -0.034 -2.771 502 HG2 LYS 65 HG1 LYS 65 -2.784 1.881 -4.294 503 HG3 LYS 65 HG2 LYS 65 -4.294 1.066 -4.739 504 HD2 LYS 65 HD1 LYS 65 -3.506 1.910 -1.941 505 HD3 LYS 65 HD2 LYS 65 -4.652 2.756 -2.996 506 HE2 LYS 65 HE1 LYS 65 -6.230 1.515 -1.987 507 HE3 LYS 65 HE2 LYS 65 -5.637 0.205 -3.020 508 HZ1 LYS 65 3HZ LYS 65 -4.596 0.766 -0.297 509 HZ2 LYS 65 1HZ LYS 65 -4.227 -0.567 -1.273 510 HZ3 LYS 65 2HZ LYS 65 -5.784 -0.388 -0.640 511 H THR 66 H THR 66 -1.868 1.244 -6.378 512 HA THR 66 HA THR 66 -4.198 0.758 -7.960 513 HB THR 66 HB THR 66 -1.872 2.629 -8.455 514 HG1 THR 66 HG1 THR 66 -3.089 4.118 -7.407 515 HG21 THR 66 HG21 THR 66 -4.607 2.545 -9.737 516 HG22 THR 66 HG22 THR 66 -3.086 2.119 -10.521 517 HG23 THR 66 HG23 THR 66 -3.377 3.780 -10.006 518 H MET 67 H MET 67 -0.807 -0.036 -8.233 519 HA MET 67 HA MET 67 -0.527 -0.557 -10.920 520 HB2 MET 67 HB2 MET 67 0.729 -1.528 -8.439 521 HB3 MET 67 HB1 MET 67 0.882 -2.622 -9.820 522 HG2 MET 67 HG1 MET 67 1.526 0.267 -10.198 523 HG3 MET 67 HG2 MET 67 2.676 -0.774 -9.353 524 HE1 MET 67 HE1 MET 67 1.852 -0.385 -13.723 525 HE2 MET 67 HE2 MET 67 0.499 -1.217 -12.955 526 HE3 MET 67 HE3 MET 67 1.015 0.363 -12.363 527 HA PRO 68 HA PRO 68 -2.212 -5.038 -10.287 528 HB2 PRO 68 HB2 PRO 68 -3.374 -5.629 -7.878 529 HB3 PRO 68 HB1 PRO 68 -1.654 -5.831 -8.203 530 HG2 PRO 68 HG1 PRO 68 -3.081 -3.562 -6.858 531 HG3 PRO 68 HG2 PRO 68 -1.569 -4.411 -6.363 532 HD2 PRO 68 HD1 PRO 68 -1.556 -1.993 -7.597 533 HD3 PRO 68 HD2 PRO 68 -0.290 -3.205 -7.854 534 H VAL 69 H VAL 69 -3.800 -2.192 -9.216 535 HA VAL 69 HA VAL 69 -6.483 -3.216 -9.485 536 HB VAL 69 HB VAL 69 -5.373 -0.451 -9.049 537 HG11 VAL 69 HG11 VAL 69 -7.211 0.296 -10.113 538 HG12 VAL 69 HG12 VAL 69 -8.042 -1.256 -9.985 539 HG13 VAL 69 HG13 VAL 69 -8.027 -0.147 -8.613 540 HG21 VAL 69 HG21 VAL 69 -7.342 -1.634 -7.214 541 HG22 VAL 69 HG22 VAL 69 -5.793 -2.471 -7.292 542 HG23 VAL 69 HG23 VAL 69 -5.850 -0.760 -6.870 543 H LEU 70 H LEU 70 -4.590 -0.751 -11.242 544 HA LEU 70 HA LEU 70 -6.384 -0.375 -13.340 545 HB2 LEU 70 HB2 LEU 70 -4.564 0.628 -14.555 546 HB3 LEU 70 HB1 LEU 70 -4.468 1.088 -12.846 547 HG LEU 70 HG LEU 70 -2.802 -1.015 -12.823 548 HD11 LEU 70 HD11 LEU 70 -2.159 0.206 -15.475 549 HD12 LEU 70 HD12 LEU 70 -3.251 -1.174 -15.366 550 HD13 LEU 70 HD13 LEU 70 -1.596 -1.312 -14.774 551 HD21 LEU 70 HD21 LEU 70 -0.968 0.701 -13.210 552 HD22 LEU 70 HD22 LEU 70 -2.134 1.057 -11.934 553 HD23 LEU 70 HD23 LEU 70 -2.264 1.863 -13.498 554 H MET 71 H MET 71 -3.692 -2.656 -13.026 555 HA MET 71 HA MET 71 -3.798 -3.723 -15.615 556 HB2 MET 71 HB2 MET 71 -2.410 -5.452 -14.839 557 HB3 MET 71 HB1 MET 71 -2.008 -4.062 -13.818 558 HG2 MET 71 HG1 MET 71 -3.234 -4.928 -11.976 559 HG3 MET 71 HG2 MET 71 -3.966 -6.179 -12.984 560 HE1 MET 71 HE1 MET 71 -2.735 -8.766 -11.683 561 HE2 MET 71 HE2 MET 71 -3.453 -8.172 -13.181 562 HE3 MET 71 HE3 MET 71 -1.877 -8.965 -13.212 563 H LYS 72 H LYS 72 -5.854 -4.169 -12.883 564 HA LYS 72 HA LYS 72 -6.973 -6.675 -13.686 565 HB2 LYS 72 HB2 LYS 72 -6.956 -5.610 -11.341 566 HB3 LYS 72 HB1 LYS 72 -8.339 -4.663 -11.913 567 HG2 LYS 72 HG1 LYS 72 -9.420 -6.412 -10.911 568 HG3 LYS 72 HG2 LYS 72 -9.289 -7.013 -12.575 569 HD2 LYS 72 HD1 LYS 72 -7.062 -7.615 -10.682 570 HD3 LYS 72 HD2 LYS 72 -8.586 -8.502 -10.501 571 HE2 LYS 72 HE1 LYS 72 -8.384 -8.909 -13.061 572 HE3 LYS 72 HE2 LYS 72 -6.688 -8.465 -12.819 573 HZ1 LYS 72 3HZ LYS 72 -6.441 -10.243 -11.241 574 HZ2 LYS 72 1HZ LYS 72 -7.075 -10.871 -12.679 575 HZ3 LYS 72 2HZ LYS 72 -8.085 -10.631 -11.344 576 H LEU 73 H LEU 73 -7.649 -3.320 -14.358 577 HA LEU 73 HA LEU 73 -10.262 -3.721 -15.426 578 HB2 LEU 73 HB2 LEU 73 -8.481 -1.455 -16.248 579 HB3 LEU 73 HB1 LEU 73 -10.234 -1.474 -15.993 580 HG LEU 73 HG LEU 73 -8.098 -1.479 -13.865 581 HD11 LEU 73 HD11 LEU 73 -10.131 0.556 -14.754 582 HD12 LEU 73 HD12 LEU 73 -8.374 0.696 -14.799 583 HD13 LEU 73 HD13 LEU 73 -9.217 0.670 -13.251 584 HD21 LEU 73 HD21 LEU 73 -10.136 -1.214 -12.351 585 HD22 LEU 73 HD22 LEU 73 -9.796 -2.828 -12.977 586 HD23 LEU 73 HD23 LEU 73 -11.073 -1.851 -13.703 587 H LEU 74 H LEU 74 -7.067 -3.246 -16.919 588 HA LEU 74 HA LEU 74 -7.923 -3.484 -19.585 589 HB2 LEU 74 HB2 LEU 74 -5.265 -3.959 -18.245 590 HB3 LEU 74 HB1 LEU 74 -5.495 -4.124 -19.995 591 HG LEU 74 HG LEU 74 -4.545 -1.983 -19.598 592 HD11 LEU 74 HD11 LEU 74 -7.138 -0.812 -19.916 593 HD12 LEU 74 HD12 LEU 74 -7.056 -2.333 -20.807 594 HD13 LEU 74 HD13 LEU 74 -5.870 -1.064 -21.117 595 HD21 LEU 74 HD21 LEU 74 -6.810 -1.385 -17.703 596 HD22 LEU 74 HD22 LEU 74 -5.418 -0.366 -18.069 597 HD23 LEU 74 HD23 LEU 74 -5.196 -1.879 -17.190 598 H GLU 75 H GLU 75 -7.366 -5.844 -17.128 599 HA GLU 75 HA GLU 75 -6.820 -8.109 -18.672 600 HB2 GLU 75 HB2 GLU 75 -7.777 -7.549 -15.950 601 HB3 GLU 75 HB1 GLU 75 -8.321 -9.101 -16.603 602 HG2 GLU 75 HG1 GLU 75 -5.439 -8.217 -16.551 603 HG3 GLU 75 HG2 GLU 75 -6.204 -9.205 -15.298 604 HE2 GLU 75 HE2 GLU 75 -4.765 -11.073 -18.304 605 H GLU 76 H GLU 76 -9.963 -6.946 -17.453 606 HA GLU 76 HA GLU 76 -11.422 -8.870 -19.005 607 HB2 GLU 76 HB2 GLU 76 -12.451 -6.408 -17.576 608 HB3 GLU 76 HB1 GLU 76 -13.412 -7.786 -18.132 609 HG2 GLU 76 HG1 GLU 76 -11.196 -8.096 -16.123 610 HG3 GLU 76 HG2 GLU 76 -12.850 -7.673 -15.657 611 HE2 GLU 76 HE2 GLU 76 -12.063 -11.400 -16.275 612 H ALA 77 H ALA 77 -10.439 -5.543 -19.377 613 HA ALA 77 HA ALA 77 -12.151 -5.088 -21.665 614 HB1 ALA 77 HB1 ALA 77 -9.990 -3.410 -20.404 615 HB2 ALA 77 HB2 ALA 77 -11.734 -3.215 -20.232 616 HB3 ALA 77 HB3 ALA 77 -10.960 -2.905 -21.786 617 H GLY 78 H GLY 78 -9.534 -6.939 -21.311 618 HA2 GLY 78 HA2 GLY 78 -7.910 -7.750 -22.717 619 HA3 GLY 78 3HA GLY 78 -8.985 -7.252 -24.014 620 H GLY 79 H GLY 79 -7.778 -4.864 -21.811 621 HA2 GLY 79 HA2 GLY 79 -5.949 -3.407 -22.020 622 HA3 GLY 79 3HA GLY 79 -5.570 -4.142 -23.572 623 H ASN 80 H ASN 80 -8.651 -2.774 -22.485 624 HA ASN 80 HA ASN 80 -8.430 -0.804 -24.666 625 HB2 ASN 80 HB2 ASN 80 -10.269 -2.755 -24.563 626 HB3 ASN 80 HB1 ASN 80 -11.105 -1.536 -23.593 627 HD21 ASN 80 HD21 ASN 80 -11.094 0.704 -24.589 628 HD22 ASN 80 HD22 ASN 80 -11.429 0.788 -26.282 629 H TRP 81 H TRP 81 -7.847 1.067 -23.750 630 HA TRP 81 HA TRP 81 -8.777 1.817 -21.120 631 HB2 TRP 81 HB2 TRP 81 -7.100 3.329 -23.143 632 HB3 TRP 81 HB1 TRP 81 -7.419 3.861 -21.492 633 HD1 TRP 81 HD1 TRP 81 -5.565 1.042 -23.363 634 HE1 TRP 81 HE1 TRP 81 -3.711 0.140 -21.822 635 HE3 TRP 81 HE3 TRP 81 -6.657 3.699 -19.135 636 HZ2 TRP 81 2HZ TRP 81 -2.827 0.507 -19.167 637 HZ3 TRP 81 3HZ TRP 81 -5.259 3.365 -17.138 638 HH2 TRP 81 HH TRP 81 -3.385 1.802 -17.156 639 H SER 82 H SER 82 -9.755 2.298 -24.370 640 HA SER 82 HA SER 82 -10.983 4.772 -24.328 641 HB2 SER 82 HB2 SER 82 -10.755 3.009 -26.241 642 HB3 SER 82 HB1 SER 82 -12.326 2.436 -25.657 643 HG SER 82 HG SER 82 -13.165 4.008 -26.748 644 H TYR 83 H TYR 83 -12.454 1.636 -23.489 645 HA TYR 83 HA TYR 83 -14.866 2.854 -22.536 646 HB2 TYR 83 HB2 TYR 83 -15.211 0.706 -23.365 647 HB3 TYR 83 HB1 TYR 83 -13.770 0.063 -22.572 648 HD1 TYR 83 HD1 TYR 83 -17.295 0.939 -22.112 649 HD2 TYR 83 HD2 TYR 83 -13.803 -0.604 -20.235 650 HE1 TYR 83 HE1 TYR 83 -18.670 0.118 -20.245 651 HE2 TYR 83 HE2 TYR 83 -15.167 -1.431 -18.363 652 HH TYR 83 HH TYR 83 -18.090 -0.420 -17.633 653 H ILE 84 H ILE 84 -12.028 1.371 -21.016 654 HA ILE 84 HA ILE 84 -12.843 1.498 -18.360 655 HB ILE 84 HB ILE 84 -10.065 1.784 -19.507 656 HG12 ILE 84 HG11 ILE 84 -11.462 -0.588 -18.244 657 HG13 ILE 84 HG12 ILE 84 -11.274 -0.343 -19.988 658 HG21 ILE 84 HG21 ILE 84 -9.669 0.809 -17.029 659 HG22 ILE 84 HG22 ILE 84 -9.582 2.522 -17.433 660 HG23 ILE 84 HG23 ILE 84 -11.058 1.855 -16.735 661 HD11 ILE 84 HD11 ILE 84 -8.767 -0.209 -18.487 662 HD12 ILE 84 HD12 ILE 84 -9.572 -1.778 -18.447 663 HD13 ILE 84 HD13 ILE 84 -9.153 -1.041 -19.993 664 H LYS 85 H LYS 85 -11.596 3.995 -20.465 665 HA LYS 85 HA LYS 85 -11.400 5.899 -18.265 666 HB2 LYS 85 HB2 LYS 85 -10.119 7.214 -19.628 667 HB3 LYS 85 HB1 LYS 85 -9.807 5.635 -20.367 668 HG2 LYS 85 HG1 LYS 85 -11.924 6.304 -21.821 669 HG3 LYS 85 HG2 LYS 85 -11.374 7.934 -21.391 670 HD2 LYS 85 HD1 LYS 85 -9.829 5.781 -22.843 671 HD3 LYS 85 HD2 LYS 85 -10.331 7.367 -23.454 672 HE2 LYS 85 HE1 LYS 85 -8.266 6.791 -21.321 673 HE3 LYS 85 HE2 LYS 85 -7.996 7.472 -22.933 674 HZ1 LYS 85 3HZ LYS 85 -8.177 9.452 -21.976 675 HZ2 LYS 85 1HZ LYS 85 -8.743 8.795 -20.522 676 HZ3 LYS 85 2HZ LYS 85 -9.829 9.144 -21.771 677 H LEU 86 H LEU 86 -13.721 4.794 -20.410 678 HA LEU 86 HA LEU 86 -15.114 7.026 -21.243 679 HB2 LEU 86 HB2 LEU 86 -15.522 4.414 -21.498 680 HB3 LEU 86 HB1 LEU 86 -16.672 4.726 -20.186 681 HG LEU 86 HG LEU 86 -17.747 4.738 -22.390 682 HD11 LEU 86 HD11 LEU 86 -17.904 7.581 -21.623 683 HD12 LEU 86 HD12 LEU 86 -18.215 6.408 -20.343 684 HD13 LEU 86 HD13 LEU 86 -19.182 6.380 -21.816 685 HD21 LEU 86 HD21 LEU 86 -16.234 7.258 -23.002 686 HD22 LEU 86 HD22 LEU 86 -17.232 6.280 -24.078 687 HD23 LEU 86 HD23 LEU 86 -15.666 5.675 -23.534 688 H ASP 87 H ASP 87 -14.903 5.629 -18.057 689 HA ASP 87 HA ASP 87 -16.752 7.699 -17.062 690 HB2 ASP 87 HB2 ASP 87 -16.073 5.179 -15.554 691 HB3 ASP 87 HB1 ASP 87 -17.454 6.262 -15.333 692 HD2 ASP 87 HD2 ASP 87 -19.025 4.876 -18.221 693 H ASN 88 H ASN 88 -13.792 7.758 -17.569 694 HA ASN 88 HA ASN 88 -11.971 8.734 -16.614 695 HB2 ASN 88 HB2 ASN 88 -14.071 10.001 -15.445 696 HB3 ASN 88 HB1 ASN 88 -13.278 9.313 -14.024 697 HD21 ASN 88 HD21 ASN 88 -10.639 9.429 -14.753 698 HD22 ASN 88 HD22 ASN 88 -10.152 11.080 -14.897 699 H TYR 89 H TYR 89 -12.294 5.965 -16.384 700 HA TYR 89 HA TYR 89 -11.395 4.158 -15.335 701 HB2 TYR 89 HB2 TYR 89 -9.887 6.228 -13.716 702 HB3 TYR 89 HB1 TYR 89 -9.473 4.519 -13.866 703 HD1 TYR 89 HD2 TYR 89 -10.139 4.362 -16.892 704 HD2 TYR 89 HD1 TYR 89 -7.775 7.031 -14.570 705 HE1 TYR 89 HE2 TYR 89 -8.753 4.841 -18.866 706 HE2 TYR 89 HE1 TYR 89 -6.382 7.519 -16.538 707 HH TYR 89 HH TYR 89 -7.122 7.173 -19.444 708 H THR 90 H THR 90 -13.878 5.049 -14.415 709 HA THR 90 HA THR 90 -14.209 5.433 -11.705 710 HB THR 90 HB THR 90 -15.934 3.891 -13.644 711 HG1 THR 90 HG1 THR 90 -15.491 6.417 -13.429 712 HG21 THR 90 HG21 THR 90 -17.680 4.528 -11.743 713 HG22 THR 90 HG22 THR 90 -16.249 4.365 -10.726 714 HG23 THR 90 HG23 THR 90 -16.786 3.009 -11.716 715 H ALA 91 H ALA 91 -13.451 2.482 -13.429 716 HA ALA 91 HA ALA 91 -14.055 0.561 -11.533 717 HB1 ALA 91 HB1 ALA 91 -12.435 -0.853 -12.615 718 HB2 ALA 91 HB2 ALA 91 -11.637 0.547 -13.334 719 HB3 ALA 91 HB3 ALA 91 -13.269 0.106 -13.839 720 H LEU 92 H LEU 92 -11.284 2.722 -11.712 721 HA LEU 92 HA LEU 92 -9.751 1.484 -9.680 722 HB2 LEU 92 HB2 LEU 92 -8.295 3.259 -9.867 723 HB3 LEU 92 HB1 LEU 92 -9.080 3.246 -11.455 724 HG LEU 92 HG LEU 92 -10.677 5.006 -10.278 725 HD11 LEU 92 HD11 LEU 92 -9.949 5.328 -8.162 726 HD12 LEU 92 HD12 LEU 92 -8.852 6.454 -8.960 727 HD13 LEU 92 HD13 LEU 92 -8.297 4.836 -8.536 728 HD21 LEU 92 HD21 LEU 92 -8.630 5.086 -12.128 729 HD22 LEU 92 HD22 LEU 92 -8.182 6.330 -10.959 730 HD23 LEU 92 HD23 LEU 92 -9.754 6.394 -11.758 731 H VAL 93 H VAL 93 -12.304 3.886 -9.649 732 HA VAL 93 HA VAL 93 -11.970 4.785 -6.996 733 HB VAL 93 HB VAL 93 -14.369 4.742 -8.818 734 HG11 VAL 93 HG11 VAL 93 -15.455 4.718 -6.782 735 HG12 VAL 93 HG12 VAL 93 -14.157 5.585 -5.959 736 HG13 VAL 93 HG13 VAL 93 -15.239 6.447 -7.054 737 HG21 VAL 93 HG21 VAL 93 -12.117 6.389 -8.648 738 HG22 VAL 93 HG22 VAL 93 -13.589 6.682 -9.576 739 HG23 VAL 93 HG23 VAL 93 -13.438 7.319 -7.939 740 H ASP 94 H ASP 94 -14.103 2.294 -8.376 741 HA ASP 94 HA ASP 94 -15.117 1.495 -5.821 742 HB2 ASP 94 HB2 ASP 94 -16.237 1.259 -8.140 743 HB3 ASP 94 HB1 ASP 94 -15.237 -0.190 -8.310 744 HD2 ASP 94 HD2 ASP 94 -17.161 -1.091 -5.166 745 H ALA 95 H ALA 95 -12.465 0.533 -7.864 746 HA ALA 95 HA ALA 95 -11.952 -1.961 -6.571 747 HB1 ALA 95 HB1 ALA 95 -10.435 -0.245 -8.494 748 HB2 ALA 95 HB2 ALA 95 -11.097 -1.864 -8.721 749 HB3 ALA 95 HB3 ALA 95 -9.661 -1.629 -7.724 750 H ILE 96 H ILE 96 -10.211 1.155 -6.507 751 HA ILE 96 HA ILE 96 -8.417 0.485 -4.475 752 HB ILE 96 HB ILE 96 -9.523 3.194 -5.218 753 HG12 ILE 96 HG11 ILE 96 -8.322 1.986 -7.012 754 HG13 ILE 96 HG12 ILE 96 -7.469 3.449 -6.490 755 HG21 ILE 96 HG21 ILE 96 -8.644 3.302 -2.980 756 HG22 ILE 96 HG22 ILE 96 -7.174 2.465 -3.475 757 HG23 ILE 96 HG23 ILE 96 -7.510 4.087 -4.079 758 HD11 ILE 96 HD11 ILE 96 -6.787 0.651 -5.619 759 HD12 ILE 96 HD12 ILE 96 -5.937 1.583 -6.853 760 HD13 ILE 96 HD13 ILE 96 -5.927 2.125 -5.175 761 H TYR 97 H TYR 97 -11.694 1.748 -4.328 762 HA TYR 97 HA TYR 97 -11.758 2.472 -1.624 763 HB2 TYR 97 HB2 TYR 97 -13.756 1.840 -3.720 764 HB3 TYR 97 HB1 TYR 97 -14.314 1.687 -2.052 765 HD1 TYR 97 HD1 TYR 97 -11.891 4.149 -3.437 766 HD2 TYR 97 HD2 TYR 97 -15.750 3.509 -1.763 767 HE1 TYR 97 HE1 TYR 97 -12.230 6.581 -3.305 768 HE2 TYR 97 HE2 TYR 97 -16.101 5.940 -1.627 769 HH TYR 97 HH TYR 97 -13.756 8.212 -2.962 770 H SER 98 H SER 98 -12.131 -0.632 -3.208 771 HA SER 98 HA SER 98 -13.054 -2.003 -0.865 772 HB2 SER 98 HB2 SER 98 -13.690 -2.909 -2.995 773 HB3 SER 98 HB1 SER 98 -11.999 -2.986 -3.523 774 HG SER 98 HG SER 98 -13.386 -4.647 -1.752 775 H VAL 99 H VAL 99 -9.991 -2.072 -2.690 776 HA VAL 99 HA VAL 99 -8.573 -3.691 -0.903 777 HB VAL 99 HB VAL 99 -7.380 -1.514 -2.620 778 HG11 VAL 99 HG11 VAL 99 -6.243 -4.124 -1.621 779 HG12 VAL 99 HG12 VAL 99 -5.413 -2.956 -2.653 780 HG13 VAL 99 HG13 VAL 99 -5.848 -2.522 -0.999 781 HG21 VAL 99 HG21 VAL 99 -8.203 -2.598 -4.381 782 HG22 VAL 99 HG22 VAL 99 -7.143 -3.942 -3.957 783 HG23 VAL 99 HG23 VAL 99 -8.807 -3.914 -3.372 784 H GLU 100 H GLU 100 -8.582 -0.137 -1.194 785 HA GLU 100 HA GLU 100 -6.856 0.486 0.859 786 HB2 GLU 100 HB2 GLU 100 -7.750 2.657 0.847 787 HB3 GLU 100 HB1 GLU 100 -8.022 2.050 -0.793 788 HG2 GLU 100 HG1 GLU 100 -10.071 2.940 -0.415 789 HG3 GLU 100 HG2 GLU 100 -10.340 1.323 0.251 790 HE2 GLU 100 HE2 GLU 100 -11.265 2.792 3.195 791 H ASP 101 H ASP 101 -10.177 -0.575 1.036 792 HA ASP 101 HA ASP 101 -10.713 0.151 3.704 793 HB2 ASP 101 HB2 ASP 101 -12.317 -0.695 1.841 794 HB3 ASP 101 HB1 ASP 101 -11.878 -2.306 2.426 795 HD2 ASP 101 HD2 ASP 101 -14.405 -1.939 4.710 796 H GLU 102 H GLU 102 -9.618 -2.947 2.325 797 HA GLU 102 HA GLU 102 -8.588 -3.653 4.994 798 HB2 GLU 102 HB2 GLU 102 -8.902 -6.065 4.208 799 HB3 GLU 102 HB1 GLU 102 -10.361 -5.155 4.633 800 HG2 GLU 102 HG1 GLU 102 -10.749 -4.689 2.243 801 HG3 GLU 102 HG2 GLU 102 -9.334 -5.680 1.853 802 HE2 GLU 102 HE2 GLU 102 -11.055 -8.640 2.566 803 H ASN 103 H ASN 103 -6.453 -3.780 5.065 804 HA ASN 103 HA ASN 103 -4.989 -4.329 2.571 805 HB2 ASN 103 HB2 ASN 103 -4.298 -2.707 5.017 806 HB3 ASN 103 HB1 ASN 103 -3.042 -3.280 3.913 807 HD21 ASN 103 HD21 ASN 103 -6.286 -1.899 3.494 808 HD22 ASN 103 HD22 ASN 103 -5.802 -0.666 2.386 809 H LYS 104 H LYS 104 -5.588 -5.395 5.796 810 HA LYS 104 HA LYS 104 -3.359 -6.889 6.420 811 HB2 LYS 104 HB2 LYS 104 -5.077 -8.480 7.532 812 HB3 LYS 104 HB1 LYS 104 -4.974 -6.803 8.093 813 HG2 LYS 104 HG1 LYS 104 -7.054 -6.304 7.423 814 HG3 LYS 104 HG2 LYS 104 -6.891 -7.232 5.922 815 HD2 LYS 104 HD1 LYS 104 -6.911 -8.989 8.223 816 HD3 LYS 104 HD2 LYS 104 -8.346 -7.949 8.195 817 HE2 LYS 104 HE1 LYS 104 -7.760 -8.970 5.548 818 HE3 LYS 104 HE2 LYS 104 -7.924 -10.284 6.722 819 HZ1 LYS 104 3HZ LYS 104 -9.949 -8.717 5.555 820 HZ2 LYS 104 1HZ LYS 104 -9.979 -8.481 7.230 821 HZ3 LYS 104 2HZ LYS 104 -10.106 -10.043 6.593 822 H GLN 105 H GLN 105 -6.042 -7.737 4.285 823 HA GLN 105 HA GLN 105 -6.376 -9.486 2.859 824 HB2 GLN 105 HB2 GLN 105 -3.376 -9.158 2.632 825 HB3 GLN 105 HB1 GLN 105 -4.360 -10.131 1.528 826 HG2 GLN 105 HG1 GLN 105 -4.327 -7.150 1.884 827 HG3 GLN 105 HG2 GLN 105 -4.056 -8.104 0.418 828 HE21 GLN 105 HE21 GLN 105 -6.449 -6.888 2.638 829 HE22 GLN 105 HE22 GLN 105 -7.816 -7.135 1.612 830 H SER 106 H SER 106 -5.954 -10.158 5.663 831 HA SER 106 HA SER 106 -5.908 -12.945 5.489 832 HB2 SER 106 HB2 SER 106 -3.575 -12.920 5.058 833 HB3 SER 106 HB1 SER 106 -3.290 -11.677 6.288 834 HG SER 106 HG SER 106 -2.742 -13.482 7.331 835 H GLU 107 H GLU 107 -6.600 -13.883 7.373 836 HA GLU 107 HA GLU 107 -7.593 -12.112 9.394 837 HB2 GLU 107 HB2 GLU 107 -8.640 -14.033 10.356 838 HB3 GLU 107 HB1 GLU 107 -8.786 -14.167 8.597 839 HG2 GLU 107 HG1 GLU 107 -6.514 -15.540 8.926 840 HG3 GLU 107 HG2 GLU 107 -7.262 -15.829 10.503 841 HE2 GLU 107 HE2 GLU 107 -9.551 -17.077 7.522 842 H GLY 108 H GLY 108 -7.352 -13.228 11.775 843 HA2 GLY 108 HA2 GLY 108 -5.966 -13.413 13.595 844 HA3 GLY 108 3HA GLY 108 -4.873 -14.285 12.530 845 H SER 109 H SER 109 -3.057 -13.300 11.789 846 HA SER 109 HA SER 109 -2.520 -10.626 12.872 847 HB2 SER 109 HB2 SER 109 -0.354 -12.301 11.671 848 HB3 SER 109 HB1 SER 109 -0.299 -11.205 13.063 849 HG SER 109 HG SER 109 -1.878 -12.983 13.911 Start of MODEL 6 1 H1 MET 1 H MET 1 26.687 6.234 56.086 2 HA MET 1 HA MET 1 26.811 5.602 53.289 3 HB2 MET 1 HB2 MET 1 28.794 6.196 55.448 4 HB3 MET 1 HB1 MET 1 29.359 5.412 53.964 5 HG2 MET 1 HG1 MET 1 29.700 7.678 53.554 6 HG3 MET 1 HG2 MET 1 28.188 7.306 52.720 7 HE1 MET 1 HE1 MET 1 27.588 10.863 53.663 8 HE2 MET 1 HE2 MET 1 29.207 10.603 54.313 9 HE3 MET 1 HE3 MET 1 28.747 9.876 52.773 10 H GLY 2 H GLY 2 27.586 3.910 56.309 11 HA2 GLY 2 HA2 GLY 2 28.078 1.456 54.765 12 HA3 GLY 2 3HA GLY 2 28.561 1.728 56.433 13 H SER 3 H SER 3 27.572 -0.406 56.753 14 HA SER 3 HA SER 3 24.734 -0.691 56.480 15 HB2 SER 3 HB2 SER 3 26.457 -2.574 56.424 16 HB3 SER 3 HB1 SER 3 26.541 -2.406 58.186 17 HG SER 3 HG SER 3 25.001 -3.914 57.865 18 H SER 4 H SER 4 23.404 -1.371 58.428 19 HA SER 4 HA SER 4 24.141 0.012 60.890 20 HB2 SER 4 HB2 SER 4 21.503 0.548 59.494 21 HB3 SER 4 HB1 SER 4 22.084 1.282 60.999 22 HG SER 4 HG SER 4 22.404 2.648 59.178 23 H HIS 5 H HIS 5 22.046 -0.243 62.434 24 HA HIS 5 HA HIS 5 21.002 -2.968 62.150 25 HB2 HIS 5 HB2 HIS 5 22.410 -1.861 64.590 26 HB3 HIS 5 HB1 HIS 5 21.470 -3.356 64.585 27 HD1 HIS 5 HD1 HIS 5 22.385 -4.934 62.306 28 HD2 HIS 5 HD2 HIS 5 25.024 -2.542 64.447 29 HE1 HIS 5 HE1 HIS 5 24.670 -5.879 61.852 30 HE2 HIS 5 HE2 HIS 5 26.284 -4.419 63.160 31 H HIS 6 H HIS 6 19.278 -3.406 63.842 32 HA HIS 6 HA HIS 6 17.245 -2.904 64.733 33 HB2 HIS 6 HB2 HIS 6 18.862 -1.409 66.128 34 HB3 HIS 6 HB1 HIS 6 18.151 -0.081 65.205 35 HD1 HIS 6 HD1 HIS 6 16.676 1.041 66.869 36 HD2 HIS 6 HD2 HIS 6 16.145 -3.080 66.822 37 HE1 HIS 6 HE1 HIS 6 14.723 0.598 68.390 38 HE2 HIS 6 HE2 HIS 6 14.396 -1.920 68.362 39 H HIS 7 H HIS 7 17.324 -2.803 62.023 40 HA HIS 7 HA HIS 7 16.364 -0.365 60.924 41 HB2 HIS 7 HB2 HIS 7 16.302 -3.220 59.934 42 HB3 HIS 7 HB1 HIS 7 15.678 -1.865 58.988 43 HD1 HIS 7 HD1 HIS 7 18.222 -3.721 58.307 44 HD2 HIS 7 HD2 HIS 7 18.267 0.177 59.745 45 HE1 HIS 7 HE1 HIS 7 20.450 -2.778 57.622 46 HE2 HIS 7 HE2 HIS 7 20.480 -0.396 58.501 47 H HIS 8 H HIS 8 14.305 0.322 60.490 48 HA HIS 8 HA HIS 8 12.101 -1.336 61.521 49 HB2 HIS 8 HB2 HIS 8 12.859 0.680 62.972 50 HB3 HIS 8 HB1 HIS 8 12.070 1.663 61.735 51 HD1 HIS 8 HD1 HIS 8 10.607 -1.620 62.803 52 HD2 HIS 8 HD2 HIS 8 9.977 2.445 63.394 53 HE1 HIS 8 HE1 HIS 8 8.374 -1.444 63.950 54 HE2 HIS 8 HE2 HIS 8 7.989 1.039 64.312 55 H HIS 9 H HIS 9 13.101 -1.002 58.802 56 HA HIS 9 HA HIS 9 11.488 0.772 57.320 57 HB2 HIS 9 HB2 HIS 9 12.620 -1.856 56.341 58 HB3 HIS 9 HB1 HIS 9 12.210 -0.438 55.370 59 HD1 HIS 9 HD1 HIS 9 13.635 1.816 56.681 60 HD2 HIS 9 HD2 HIS 9 15.328 -1.964 56.348 61 HE1 HIS 9 HE1 HIS 9 16.117 2.173 56.864 62 HE2 HIS 9 HE2 HIS 9 17.154 -0.137 56.661 63 H HIS 10 H HIS 10 9.767 0.177 55.806 64 HA HIS 10 HA HIS 10 8.146 -2.103 56.710 65 HB2 HIS 10 HB2 HIS 10 6.125 -0.781 56.654 66 HB3 HIS 10 HB1 HIS 10 7.290 -0.005 57.731 67 HD1 HIS 10 HD1 HIS 10 8.158 2.308 57.099 68 HD2 HIS 10 HD2 HIS 10 5.641 0.649 54.241 69 HE1 HIS 10 HE1 HIS 10 7.630 4.178 55.501 70 HE2 HIS 10 HE2 HIS 10 6.092 3.164 53.754 71 H SER 11 H SER 11 6.126 -2.203 55.090 72 HA SER 11 HA SER 11 7.052 -1.748 52.348 73 HB2 SER 11 HB2 SER 11 6.105 -4.128 51.850 74 HB3 SER 11 HB1 SER 11 7.731 -3.975 52.537 75 HG SER 11 HG SER 11 5.716 -5.326 53.531 76 H SER 12 H SER 12 5.509 -0.790 51.215 77 HA SER 12 HA SER 12 2.736 -0.990 52.153 78 HB2 SER 12 HB2 SER 12 2.348 1.039 50.751 79 HB3 SER 12 HB1 SER 12 3.568 1.284 52.013 80 HG SER 12 HG SER 12 4.149 2.075 49.875 81 H GLY 13 H GLY 13 4.620 -1.003 49.130 82 HA2 GLY 13 HA2 GLY 13 4.325 -2.547 47.372 83 HA3 GLY 13 3HA GLY 13 2.754 -2.969 48.037 84 H LEU 14 H LEU 14 4.377 -1.243 45.653 85 HA LEU 14 HA LEU 14 1.867 -0.158 44.673 86 HB2 LEU 14 HB2 LEU 14 2.750 2.078 44.313 87 HB3 LEU 14 HB1 LEU 14 2.766 1.654 46.033 88 HG LEU 14 HG LEU 14 5.275 0.985 45.449 89 HD11 LEU 14 HD11 LEU 14 5.910 1.604 43.416 90 HD12 LEU 14 HD12 LEU 14 5.680 3.280 43.913 91 HD13 LEU 14 HD13 LEU 14 4.367 2.408 43.119 92 HD21 LEU 14 HD21 LEU 14 5.035 2.470 47.176 93 HD22 LEU 14 HD22 LEU 14 4.027 3.571 46.239 94 HD23 LEU 14 HD23 LEU 14 5.768 3.516 45.961 95 H VAL 15 H VAL 15 1.836 0.188 42.445 96 HA VAL 15 HA VAL 15 4.261 -0.621 40.983 97 HB VAL 15 HB VAL 15 2.640 -1.654 39.287 98 HG11 VAL 15 HG11 VAL 15 3.492 -3.532 40.104 99 HG12 VAL 15 HG12 VAL 15 3.902 -2.686 41.598 100 HG13 VAL 15 HG13 VAL 15 2.342 -3.494 41.440 101 HG21 VAL 15 HG21 VAL 15 0.470 -2.129 39.859 102 HG22 VAL 15 HG22 VAL 15 0.794 -2.064 41.590 103 HG23 VAL 15 HG23 VAL 15 0.677 -0.571 40.658 104 HA PRO 16 HA PRO 16 3.684 2.914 38.447 105 HB2 PRO 16 HB2 PRO 16 4.611 2.013 36.033 106 HB3 PRO 16 HB1 PRO 16 5.656 2.352 37.411 107 HG2 PRO 16 HG1 PRO 16 4.528 -0.266 36.478 108 HG3 PRO 16 HG2 PRO 16 6.206 0.130 37.004 109 HD2 PRO 16 HD1 PRO 16 4.424 -1.130 38.618 110 HD3 PRO 16 HD2 PRO 16 5.644 -0.003 39.235 111 H ARG 17 H ARG 17 2.786 3.566 36.209 112 HA ARG 17 HA ARG 17 0.383 1.969 35.610 113 HB2 ARG 17 HB2 ARG 17 0.586 4.990 35.664 114 HB3 ARG 17 HB1 ARG 17 -0.856 4.049 35.250 115 HG2 ARG 17 HG1 ARG 17 0.503 3.859 37.932 116 HG3 ARG 17 HG2 ARG 17 -0.796 5.009 37.574 117 HD2 ARG 17 HD1 ARG 17 -2.047 2.857 36.711 118 HD3 ARG 17 HD2 ARG 17 -0.896 2.036 37.775 119 HE ARG 17 HE ARG 17 -3.159 3.598 38.570 120 HH11 ARG 17 1HH1 ARG 17 0.015 2.527 39.518 121 HH12 ARG 17 2HH1 ARG 17 -0.298 2.681 41.215 122 HH21 ARG 17 1HH2 ARG 17 -3.583 3.805 40.801 123 HH22 ARG 17 2HH2 ARG 17 -2.345 3.407 41.943 124 H GLY 18 H GLY 18 0.291 1.317 33.567 125 HA2 GLY 18 HA2 GLY 18 0.589 2.848 31.297 126 HA3 GLY 18 3HA GLY 18 2.191 2.207 31.628 127 H SER 19 H SER 19 2.178 0.996 29.710 128 HA SER 19 HA SER 19 1.022 -1.614 29.987 129 HB2 SER 19 HB2 SER 19 -0.158 0.385 28.109 130 HB3 SER 19 HB1 SER 19 0.008 -1.284 27.539 131 HG SER 19 HG SER 19 -1.954 -0.435 28.911 132 H HIS 20 H HIS 20 2.757 -2.790 29.530 133 HA HIS 20 HA HIS 20 4.499 -1.960 27.314 134 HB2 HIS 20 HB2 HIS 20 6.258 -3.223 28.323 135 HB3 HIS 20 HB1 HIS 20 5.508 -2.256 29.597 136 HD1 HIS 20 HD1 HIS 20 4.190 -3.497 31.438 137 HD2 HIS 20 HD2 HIS 20 5.916 -6.002 28.608 138 HE1 HIS 20 HE1 HIS 20 4.042 -5.812 32.409 139 HE2 HIS 20 HE2 HIS 20 5.097 -7.343 30.680 140 H MET 21 H MET 21 2.509 -4.565 28.522 141 HA MET 21 HA MET 21 3.165 -6.168 26.144 142 HB2 MET 21 HB2 MET 21 3.547 -7.353 28.222 143 HB3 MET 21 HB1 MET 21 1.905 -6.977 28.769 144 HG2 MET 21 HG1 MET 21 1.886 -9.235 28.052 145 HG3 MET 21 HG2 MET 21 1.041 -8.286 26.826 146 HE1 MET 21 HE1 MET 21 3.194 -11.238 27.084 147 HE2 MET 21 HE2 MET 21 1.745 -11.063 26.095 148 HE3 MET 21 HE3 MET 21 3.301 -11.394 25.331 149 H ILE 22 H ILE 22 1.788 -5.862 24.525 150 HA ILE 22 HA ILE 22 -1.076 -5.579 25.163 151 HB ILE 22 HB ILE 22 -0.066 -3.498 24.242 152 HG12 ILE 22 HG11 ILE 22 -1.771 -3.171 22.450 153 HG13 ILE 22 HG12 ILE 22 -2.122 -4.906 22.524 154 HG21 ILE 22 HG21 ILE 22 0.267 -5.091 21.706 155 HG22 ILE 22 HG22 ILE 22 0.667 -3.393 21.958 156 HG23 ILE 22 HG23 ILE 22 1.588 -4.648 22.787 157 HD11 ILE 22 HD11 ILE 22 -2.260 -3.549 25.112 158 HD12 ILE 22 HD12 ILE 22 -3.452 -3.011 23.928 159 HD13 ILE 22 HD13 ILE 22 -3.358 -4.714 24.374 160 H SER 23 H SER 23 -2.538 -6.733 23.952 161 HA SER 23 HA SER 23 -1.512 -9.070 22.627 162 HB2 SER 23 HB2 SER 23 -3.602 -8.923 24.127 163 HB3 SER 23 HB1 SER 23 -4.410 -8.241 22.703 164 HG SER 23 HG SER 23 -3.078 -10.748 22.774 165 H LEU 24 H LEU 24 -0.460 -7.336 21.075 166 HA LEU 24 HA LEU 24 -2.089 -6.243 19.024 167 HB2 LEU 24 HB2 LEU 24 0.411 -5.769 19.811 168 HB3 LEU 24 HB1 LEU 24 0.756 -6.900 18.489 169 HG LEU 24 HG LEU 24 -0.782 -5.278 17.111 170 HD11 LEU 24 HD11 LEU 24 -0.107 -3.735 19.562 171 HD12 LEU 24 HD12 LEU 24 -1.569 -3.711 18.576 172 HD13 LEU 24 HD13 LEU 24 -0.109 -2.900 18.008 173 HD21 LEU 24 HD21 LEU 24 1.375 -3.802 16.841 174 HD22 LEU 24 HD22 LEU 24 1.353 -5.483 16.307 175 HD23 LEU 24 HD23 LEU 24 2.094 -5.056 17.851 176 H SER 25 H SER 25 -0.143 -9.192 19.272 177 HA SER 25 HA SER 25 -0.451 -10.094 16.644 178 HB2 SER 25 HB2 SER 25 1.181 -11.112 18.115 179 HB3 SER 25 HB1 SER 25 -0.100 -11.659 19.211 180 HG SER 25 HG SER 25 0.888 -13.043 17.292 181 H GLY 26 H GLY 26 -2.053 -11.085 15.560 182 HA2 GLY 26 HA2 GLY 26 -3.931 -12.782 15.929 183 HA3 GLY 26 3HA GLY 26 -4.556 -11.572 17.040 184 H LEU 27 H LEU 27 -4.324 -9.241 15.770 185 HA LEU 27 HA LEU 27 -5.855 -9.635 13.283 186 HB2 LEU 27 HB2 LEU 27 -6.819 -7.342 13.834 187 HB3 LEU 27 HB1 LEU 27 -7.355 -8.716 14.817 188 HG LEU 27 HG LEU 27 -6.878 -6.525 16.025 189 HD11 LEU 27 HD11 LEU 27 -5.161 -8.430 17.387 190 HD12 LEU 27 HD12 LEU 27 -6.650 -9.164 16.794 191 HD13 LEU 27 HD13 LEU 27 -6.723 -7.766 17.867 192 HD21 LEU 27 HD21 LEU 27 -4.016 -7.415 15.738 193 HD22 LEU 27 HD22 LEU 27 -4.627 -5.958 16.522 194 HD23 LEU 27 HD23 LEU 27 -4.734 -6.128 14.770 195 H THR 28 H THR 28 -2.885 -9.011 14.105 196 HA THR 28 HA THR 28 -2.334 -6.488 12.887 197 HB THR 28 HB THR 28 0.061 -7.320 12.903 198 HG1 THR 28 HG1 THR 28 0.477 -9.279 13.822 199 HG21 THR 28 HG21 THR 28 -1.701 -6.768 15.160 200 HG22 THR 28 HG22 THR 28 -0.097 -6.132 14.796 201 HG23 THR 28 HG23 THR 28 -0.265 -7.684 15.616 202 H SER 29 H SER 29 -1.010 -6.196 10.956 203 HA SER 29 HA SER 29 -2.102 -7.532 8.720 204 HB2 SER 29 HB2 SER 29 0.009 -5.471 9.168 205 HB3 SER 29 HB1 SER 29 0.019 -6.329 7.617 206 HG SER 29 HG SER 29 -1.659 -4.392 8.484 207 H SER 30 H SER 30 -0.941 -8.754 7.092 208 HA SER 30 HA SER 30 1.273 -10.346 8.213 209 HB2 SER 30 HB2 SER 30 -0.755 -11.485 6.289 210 HB3 SER 30 HB1 SER 30 0.358 -12.345 7.367 211 HG SER 30 HG SER 30 -0.997 -11.039 9.039 212 H VAL 31 H VAL 31 1.929 -11.858 6.055 213 HA VAL 31 HA VAL 31 3.049 -9.850 4.255 214 HB VAL 31 HB VAL 31 4.525 -11.655 3.466 215 HG11 VAL 31 HG11 VAL 31 4.857 -11.977 6.357 216 HG12 VAL 31 HG12 VAL 31 5.955 -11.296 5.156 217 HG13 VAL 31 HG13 VAL 31 4.661 -10.306 5.831 218 HG21 VAL 31 HG21 VAL 31 3.838 -13.527 5.600 219 HG22 VAL 31 HG22 VAL 31 2.576 -13.352 4.381 220 HG23 VAL 31 HG23 VAL 31 4.205 -13.830 3.901 221 H GLU 32 H GLU 32 0.302 -10.359 3.928 222 HA GLU 32 HA GLU 32 -0.094 -12.211 1.770 223 HB2 GLU 32 HB2 GLU 32 -2.368 -11.536 1.787 224 HB3 GLU 32 HB1 GLU 32 -1.841 -11.555 3.476 225 HG2 GLU 32 HG1 GLU 32 -1.569 -9.136 3.452 226 HG3 GLU 32 HG2 GLU 32 -2.048 -9.099 1.749 227 HE2 GLU 32 HE2 GLU 32 -5.413 -9.548 2.543 228 H SER 33 H SER 33 0.802 -8.897 2.065 229 HA SER 33 HA SER 33 0.450 -8.529 -0.838 230 HB2 SER 33 HB2 SER 33 0.763 -6.319 1.209 231 HB3 SER 33 HB1 SER 33 0.238 -6.174 -0.478 232 HG SER 33 HG SER 33 -1.551 -6.106 0.907 233 H ASP 34 H ASP 34 2.681 -8.653 1.770 234 HA ASP 34 HA ASP 34 4.813 -7.153 0.770 235 HB2 ASP 34 HB2 ASP 34 4.616 -8.171 3.074 236 HB3 ASP 34 HB1 ASP 34 5.071 -9.718 2.346 237 HD2 ASP 34 HD2 ASP 34 8.209 -8.515 3.349 238 H LEU 35 H LEU 35 3.566 -10.224 -0.204 239 HA LEU 35 HA LEU 35 5.954 -10.844 -1.766 240 HB2 LEU 35 HB2 LEU 35 3.488 -12.348 -0.979 241 HB3 LEU 35 HB1 LEU 35 4.429 -12.875 -2.386 242 HG LEU 35 HG LEU 35 5.575 -12.582 0.388 243 HD11 LEU 35 HD11 LEU 35 5.479 -15.276 -0.329 244 HD12 LEU 35 HD12 LEU 35 3.883 -14.633 -0.716 245 HD13 LEU 35 HD13 LEU 35 4.530 -14.466 0.917 246 HD21 LEU 35 HD21 LEU 35 7.433 -13.843 -0.493 247 HD22 LEU 35 HD22 LEU 35 7.168 -12.416 -1.495 248 HD23 LEU 35 HD23 LEU 35 6.630 -14.001 -2.055 249 H ASP 36 H ASP 36 3.790 -8.689 -2.266 250 HA ASP 36 HA ASP 36 2.701 -9.484 -4.824 251 HB2 ASP 36 HB2 ASP 36 1.456 -7.516 -4.777 252 HB3 ASP 36 HB1 ASP 36 1.627 -7.904 -3.060 253 HD2 ASP 36 HD2 ASP 36 4.242 -5.325 -2.993 254 H MET 37 H MET 37 5.697 -8.639 -3.907 255 HA MET 37 HA MET 37 6.346 -6.734 -5.965 256 HB2 MET 37 HB2 MET 37 7.639 -6.587 -3.982 257 HB3 MET 37 HB1 MET 37 8.002 -8.319 -4.009 258 HG2 MET 37 HG1 MET 37 9.724 -8.087 -5.438 259 HG3 MET 37 HG2 MET 37 8.895 -6.845 -6.379 260 HE1 MET 37 HE1 MET 37 11.515 -7.838 -4.493 261 HE2 MET 37 HE2 MET 37 12.428 -6.426 -5.026 262 HE3 MET 37 HE3 MET 37 12.022 -6.623 -3.320 263 H GLN 38 H GLN 38 6.745 -10.208 -5.463 264 HA GLN 38 HA GLN 38 8.346 -10.750 -7.696 265 HB2 GLN 38 HB2 GLN 38 6.542 -12.327 -5.932 266 HB3 GLN 38 HB1 GLN 38 6.996 -13.050 -7.482 267 HG2 GLN 38 HG1 GLN 38 8.495 -13.794 -5.732 268 HG3 GLN 38 HG2 GLN 38 9.356 -12.803 -6.917 269 HE21 GLN 38 HE21 GLN 38 7.724 -12.610 -3.787 270 HE22 GLN 38 HE22 GLN 38 8.752 -11.388 -3.127 271 H GLN 39 H GLN 39 4.962 -10.072 -7.415 272 HA GLN 39 HA GLN 39 4.262 -11.138 -9.996 273 HB2 GLN 39 HB2 GLN 39 2.667 -9.197 -8.316 274 HB3 GLN 39 HB1 GLN 39 2.065 -10.289 -9.574 275 HG2 GLN 39 HG1 GLN 39 2.757 -12.218 -8.150 276 HG3 GLN 39 HG2 GLN 39 3.142 -11.055 -6.873 277 HE21 GLN 39 HE21 GLN 39 1.097 -9.282 -7.039 278 HE22 GLN 39 HE22 GLN 39 -0.400 -10.060 -6.668 279 H ALA 40 H ALA 40 5.460 -8.155 -8.748 280 HA ALA 40 HA ALA 40 4.553 -6.367 -10.710 281 HB1 ALA 40 HB1 ALA 40 7.259 -6.048 -9.495 282 HB2 ALA 40 HB2 ALA 40 5.828 -5.964 -8.467 283 HB3 ALA 40 HB3 ALA 40 6.017 -4.837 -9.812 284 H MET 41 H MET 41 6.949 -8.843 -10.824 285 HA MET 41 HA MET 41 8.384 -7.774 -13.073 286 HB2 MET 41 HB2 MET 41 8.372 -10.606 -12.004 287 HB3 MET 41 HB1 MET 41 9.582 -9.882 -13.075 288 HG2 MET 41 HG1 MET 41 9.036 -9.098 -10.210 289 HG3 MET 41 HG2 MET 41 10.418 -10.018 -10.810 290 HE1 MET 41 HE1 MET 41 12.736 -7.536 -12.402 291 HE2 MET 41 HE2 MET 41 12.726 -8.773 -11.146 292 HE3 MET 41 HE3 MET 41 11.979 -9.099 -12.710 293 H LEU 42 H LEU 42 5.706 -9.968 -12.566 294 HA LEU 42 HA LEU 42 5.653 -10.789 -15.349 295 HB2 LEU 42 HB2 LEU 42 4.253 -11.550 -12.851 296 HB3 LEU 42 HB1 LEU 42 3.343 -11.736 -14.360 297 HG LEU 42 HG LEU 42 5.085 -13.219 -15.233 298 HD11 LEU 42 HD11 LEU 42 6.774 -14.066 -13.528 299 HD12 LEU 42 HD12 LEU 42 6.399 -12.614 -12.602 300 HD13 LEU 42 HD13 LEU 42 7.067 -12.473 -14.227 301 HD21 LEU 42 HD21 LEU 42 3.524 -13.769 -12.807 302 HD22 LEU 42 HD22 LEU 42 4.835 -14.906 -13.124 303 HD23 LEU 42 HD23 LEU 42 3.587 -14.635 -14.341 304 H THR 43 H THR 43 4.912 -8.007 -13.957 305 HA THR 43 HA THR 43 2.798 -7.432 -15.895 306 HB THR 43 HB THR 43 1.565 -7.854 -13.847 307 HG1 THR 43 HG1 THR 43 0.779 -6.141 -15.090 308 HG21 THR 43 HG21 THR 43 2.238 -7.240 -11.799 309 HG22 THR 43 HG22 THR 43 2.597 -5.594 -12.321 310 HG23 THR 43 HG23 THR 43 3.789 -6.872 -12.552 311 H ASN 44 H ASN 44 5.311 -6.717 -16.381 312 HA ASN 44 HA ASN 44 6.354 -4.397 -15.315 313 HB2 ASN 44 HB2 ASN 44 7.190 -6.027 -17.230 314 HB3 ASN 44 HB1 ASN 44 6.489 -4.784 -18.275 315 HD21 ASN 44 HD21 ASN 44 7.644 -3.032 -18.719 316 HD22 ASN 44 HD22 ASN 44 9.119 -2.582 -17.940 317 H LYS 45 H LYS 45 5.514 -2.443 -15.088 318 HA LYS 45 HA LYS 45 3.121 -1.546 -16.128 319 HB2 LYS 45 HB2 LYS 45 3.794 0.691 -15.452 320 HB3 LYS 45 HB1 LYS 45 4.292 -0.492 -14.232 321 HG2 LYS 45 HG1 LYS 45 6.302 0.125 -16.304 322 HG3 LYS 45 HG2 LYS 45 5.896 1.443 -15.190 323 HD2 LYS 45 HD1 LYS 45 7.275 0.534 -13.695 324 HD3 LYS 45 HD2 LYS 45 6.155 -0.836 -13.584 325 HE2 LYS 45 HE1 LYS 45 8.130 -1.910 -14.123 326 HE3 LYS 45 HE2 LYS 45 7.397 -1.676 -15.716 327 HZ1 LYS 45 3HZ LYS 45 8.941 0.589 -15.039 328 HZ2 LYS 45 1HZ LYS 45 9.129 -0.474 -16.342 329 HZ3 LYS 45 2HZ LYS 45 9.884 -0.805 -14.866 330 H ASP 46 H ASP 46 2.814 0.379 -17.588 331 HA ASP 46 HA ASP 46 4.681 0.330 -19.860 332 HB2 ASP 46 HB2 ASP 46 1.694 -0.048 -19.886 333 HB3 ASP 46 HB1 ASP 46 2.537 0.608 -21.296 334 HD2 ASP 46 HD2 ASP 46 2.604 -3.227 -20.765 335 H GLU 47 H GLU 47 3.806 2.162 -21.491 336 HA GLU 47 HA GLU 47 4.243 4.610 -20.121 337 HB2 GLU 47 HB2 GLU 47 3.871 5.667 -22.324 338 HB3 GLU 47 HB1 GLU 47 5.019 4.321 -22.399 339 HG2 GLU 47 HG1 GLU 47 3.171 2.856 -23.200 340 HG3 GLU 47 HG2 GLU 47 2.140 4.293 -23.269 341 HE2 GLU 47 HE2 GLU 47 4.978 3.901 -26.015 342 H LYS 48 H LYS 48 1.390 3.093 -21.553 343 HA LYS 48 HA LYS 48 -0.353 5.290 -21.057 344 HB2 LYS 48 HB2 LYS 48 -2.166 3.629 -21.510 345 HB3 LYS 48 HB1 LYS 48 -0.938 3.729 -22.782 346 HG2 LYS 48 HG1 LYS 48 -0.413 1.701 -20.714 347 HG3 LYS 48 HG2 LYS 48 -1.851 1.420 -21.712 348 HD2 LYS 48 HD1 LYS 48 0.169 2.239 -23.493 349 HD3 LYS 48 HD2 LYS 48 0.923 1.079 -22.385 350 HE2 LYS 48 HE1 LYS 48 0.053 -0.530 -23.675 351 HE3 LYS 48 HE2 LYS 48 -1.506 -0.091 -22.961 352 HZ1 LYS 48 3HZ LYS 48 -0.432 1.222 -25.391 353 HZ2 LYS 48 1HZ LYS 48 -2.006 1.308 -24.778 354 HZ3 LYS 48 2HZ LYS 48 -1.436 -0.137 -25.447 355 H VAL 49 H VAL 49 0.621 2.461 -19.241 356 HA VAL 49 HA VAL 49 -1.384 2.385 -17.310 357 HB VAL 49 HB VAL 49 1.548 1.735 -16.992 358 HG11 VAL 49 HG11 VAL 49 0.140 0.143 -15.246 359 HG12 VAL 49 HG12 VAL 49 1.069 1.580 -14.815 360 HG13 VAL 49 HG13 VAL 49 -0.667 1.704 -15.102 361 HG21 VAL 49 HG21 VAL 49 0.162 0.517 -18.755 362 HG22 VAL 49 HG22 VAL 49 1.022 -0.477 -17.578 363 HG23 VAL 49 HG23 VAL 49 -0.711 -0.200 -17.402 364 H LEU 50 H LEU 50 1.302 4.564 -17.694 365 HA LEU 50 HA LEU 50 1.341 5.598 -15.055 366 HB2 LEU 50 HB2 LEU 50 2.149 7.053 -17.572 367 HB3 LEU 50 HB1 LEU 50 2.720 7.342 -15.919 368 HG LEU 50 HG LEU 50 3.277 4.800 -17.438 369 HD11 LEU 50 HD11 LEU 50 4.406 7.421 -17.793 370 HD12 LEU 50 HD12 LEU 50 4.732 5.928 -18.675 371 HD13 LEU 50 HD13 LEU 50 5.625 6.292 -17.199 372 HD21 LEU 50 HD21 LEU 50 4.499 6.020 -14.964 373 HD22 LEU 50 HD22 LEU 50 5.041 4.539 -15.753 374 HD23 LEU 50 HD23 LEU 50 3.439 4.612 -15.019 375 H LYS 51 H LYS 51 -0.683 6.153 -17.797 376 HA LYS 51 HA LYS 51 -1.643 8.726 -17.117 377 HB2 LYS 51 HB2 LYS 51 -3.003 6.520 -18.685 378 HB3 LYS 51 HB1 LYS 51 -3.490 8.223 -18.662 379 HG2 LYS 51 HG1 LYS 51 -0.699 7.546 -19.471 380 HG3 LYS 51 HG2 LYS 51 -2.026 7.260 -20.612 381 HD2 LYS 51 HD1 LYS 51 -1.698 9.904 -19.205 382 HD3 LYS 51 HD2 LYS 51 -0.834 9.530 -20.707 383 HE2 LYS 51 HE1 LYS 51 -3.832 9.267 -20.435 384 HE3 LYS 51 HE2 LYS 51 -3.034 10.758 -20.958 385 HZ1 LYS 51 3HZ LYS 51 -3.017 8.128 -22.319 386 HZ2 LYS 51 1HZ LYS 51 -1.956 9.377 -22.736 387 HZ3 LYS 51 2HZ LYS 51 -3.625 9.595 -22.901 388 H ALA 52 H ALA 52 -2.680 5.464 -16.273 389 HA ALA 52 HA ALA 52 -5.115 6.124 -15.042 390 HB1 ALA 52 HB1 ALA 52 -4.095 3.918 -13.663 391 HB2 ALA 52 HB2 ALA 52 -3.440 3.798 -15.297 392 HB3 ALA 52 HB3 ALA 52 -5.184 3.904 -15.050 393 H LEU 53 H LEU 53 -1.829 5.890 -13.739 394 HA LEU 53 HA LEU 53 -2.438 6.261 -11.039 395 HB2 LEU 53 HB2 LEU 53 0.025 7.222 -12.506 396 HB3 LEU 53 HB1 LEU 53 -0.128 6.933 -10.764 397 HG LEU 53 HG LEU 53 -0.343 4.780 -12.865 398 HD11 LEU 53 HD11 LEU 53 1.900 5.781 -12.818 399 HD12 LEU 53 HD12 LEU 53 1.896 4.124 -12.214 400 HD13 LEU 53 HD13 LEU 53 1.988 5.474 -11.083 401 HD21 LEU 53 HD21 LEU 53 -1.380 4.658 -10.430 402 HD22 LEU 53 HD22 LEU 53 0.287 4.268 -10.008 403 HD23 LEU 53 HD23 LEU 53 -0.585 3.272 -11.176 404 H GLU 54 H GLU 54 -2.516 8.467 -13.669 405 HA GLU 54 HA GLU 54 -2.103 10.889 -12.276 406 HB2 GLU 54 HB2 GLU 54 -3.820 10.467 -14.731 407 HB3 GLU 54 HB1 GLU 54 -3.059 11.977 -14.205 408 HG2 GLU 54 HG1 GLU 54 -1.580 9.497 -15.085 409 HG3 GLU 54 HG2 GLU 54 -1.876 10.930 -16.080 410 HE2 GLU 54 HE2 GLU 54 0.924 11.122 -13.288 411 H ARG 55 H ARG 55 -5.025 9.031 -13.020 412 HA ARG 55 HA ARG 55 -6.775 10.930 -11.767 413 HB2 ARG 55 HB2 ARG 55 -7.720 9.662 -13.531 414 HB3 ARG 55 HB1 ARG 55 -7.159 8.138 -12.829 415 HG2 ARG 55 HG1 ARG 55 -9.572 8.422 -12.556 416 HG3 ARG 55 HG2 ARG 55 -8.732 8.363 -10.997 417 HD2 ARG 55 HD1 ARG 55 -9.429 10.412 -10.433 418 HD3 ARG 55 HD2 ARG 55 -8.922 11.073 -11.994 419 HE ARG 55 HE ARG 55 -11.268 9.649 -12.434 420 HH11 ARG 55 1HH1 ARG 55 -10.220 12.449 -10.650 421 HH12 ARG 55 2HH1 ARG 55 -11.753 13.248 -10.751 422 HH21 ARG 55 1HH2 ARG 55 -13.292 10.692 -12.574 423 HH22 ARG 55 2HH2 ARG 55 -13.499 12.248 -11.844 424 H THR 56 H THR 56 -5.122 7.995 -10.820 425 HA THR 56 HA THR 56 -6.570 7.600 -8.391 426 HB THR 56 HB THR 56 -5.000 5.899 -7.866 427 HG1 THR 56 HG1 THR 56 -2.988 6.555 -8.154 428 HG21 THR 56 HG21 THR 56 -5.656 4.562 -9.530 429 HG22 THR 56 HG22 THR 56 -4.645 5.417 -10.695 430 HG23 THR 56 HG23 THR 56 -6.272 5.998 -10.346 431 H ARG 57 H ARG 57 -3.400 9.006 -9.169 432 HA ARG 57 HA ARG 57 -2.554 9.577 -6.584 433 HB2 ARG 57 HB2 ARG 57 -1.012 11.130 -7.546 434 HB3 ARG 57 HB1 ARG 57 -1.188 9.779 -8.677 435 HG2 ARG 57 HG1 ARG 57 -2.494 11.044 -10.175 436 HG3 ARG 57 HG2 ARG 57 -2.759 12.317 -8.971 437 HD2 ARG 57 HD1 ARG 57 -1.081 12.865 -10.778 438 HD3 ARG 57 HD2 ARG 57 -0.514 13.056 -9.113 439 HE ARG 57 HE ARG 57 0.106 10.470 -10.121 440 HH11 ARG 57 1HH1 ARG 57 1.088 13.808 -10.235 441 HH12 ARG 57 2HH1 ARG 57 2.740 13.445 -10.610 442 HH21 ARG 57 1HH2 ARG 57 2.278 9.979 -10.615 443 HH22 ARG 57 2HH2 ARG 57 3.416 11.267 -10.827 444 H GLN 58 H GLN 58 -4.932 11.151 -8.560 445 HA GLN 58 HA GLN 58 -5.015 13.650 -7.267 446 HB2 GLN 58 HB2 GLN 58 -7.012 12.075 -8.877 447 HB3 GLN 58 HB1 GLN 58 -7.448 13.625 -8.141 448 HG2 GLN 58 HG1 GLN 58 -5.118 13.258 -10.020 449 HG3 GLN 58 HG2 GLN 58 -6.738 13.757 -10.528 450 HE21 GLN 58 HE21 GLN 58 -3.917 14.664 -8.679 451 HE22 GLN 58 HE22 GLN 58 -4.255 16.358 -8.626 452 H LEU 59 H LEU 59 -6.669 10.595 -6.627 453 HA LEU 59 HA LEU 59 -8.043 11.753 -4.331 454 HB2 LEU 59 HB2 LEU 59 -8.124 8.881 -5.242 455 HB3 LEU 59 HB1 LEU 59 -9.289 9.743 -4.221 456 HG LEU 59 HG LEU 59 -9.093 11.009 -6.800 457 HD11 LEU 59 HD11 LEU 59 -9.722 8.062 -6.781 458 HD12 LEU 59 HD12 LEU 59 -8.429 8.868 -7.668 459 HD13 LEU 59 HD13 LEU 59 -10.113 9.164 -8.102 460 HD21 LEU 59 HD21 LEU 59 -11.405 9.506 -5.596 461 HD22 LEU 59 HD22 LEU 59 -11.452 10.857 -6.729 462 HD23 LEU 59 HD23 LEU 59 -10.926 11.118 -5.066 463 H ASP 60 H ASP 60 -5.038 11.076 -4.639 464 HA ASP 60 HA ASP 60 -3.352 10.459 -3.241 465 HB2 ASP 60 HB2 ASP 60 -5.377 10.004 -1.056 466 HB3 ASP 60 HB1 ASP 60 -3.701 10.548 -0.914 467 HD2 ASP 60 HD2 ASP 60 -4.719 13.791 -2.108 468 H ILE 61 H ILE 61 -3.336 8.536 -4.667 469 HA ILE 61 HA ILE 61 -3.781 6.110 -3.071 470 HB ILE 61 HB ILE 61 -4.279 6.184 -6.040 471 HG12 ILE 61 HG11 ILE 61 -6.336 6.301 -3.820 472 HG13 ILE 61 HG12 ILE 61 -5.885 7.666 -4.856 473 HG21 ILE 61 HG21 ILE 61 -5.009 4.012 -5.841 474 HG22 ILE 61 HG22 ILE 61 -3.722 4.052 -4.638 475 HG23 ILE 61 HG23 ILE 61 -5.405 4.188 -4.132 476 HD11 ILE 61 HD11 ILE 61 -6.540 5.641 -6.636 477 HD12 ILE 61 HD12 ILE 61 -7.752 5.534 -5.358 478 HD13 ILE 61 HD13 ILE 61 -7.512 7.053 -6.222 479 HA PRO 62 HA PRO 62 0.501 5.565 -4.133 480 HB2 PRO 62 HB2 PRO 62 0.804 3.132 -2.911 481 HB3 PRO 62 HB1 PRO 62 0.740 4.660 -2.035 482 HG2 PRO 62 HG1 PRO 62 -1.444 2.668 -2.544 483 HG3 PRO 62 HG2 PRO 62 -1.010 3.518 -1.015 484 HD2 PRO 62 HD1 PRO 62 -3.089 4.289 -2.580 485 HD3 PRO 62 HD2 PRO 62 -2.110 5.440 -1.656 486 H ASP 63 H ASP 63 1.458 4.731 -5.888 487 HA ASP 63 HA ASP 63 0.055 3.280 -7.821 488 HB2 ASP 63 HB2 ASP 63 2.448 2.826 -8.733 489 HB3 ASP 63 HB1 ASP 63 1.857 4.492 -8.661 490 HD2 ASP 63 HD2 ASP 63 4.237 5.407 -6.348 491 H GLU 64 H GLU 64 1.660 2.220 -4.995 492 HA GLU 64 HA GLU 64 2.414 -0.380 -5.764 493 HB2 GLU 64 HB2 GLU 64 1.469 0.412 -3.007 494 HB3 GLU 64 HB1 GLU 64 2.624 -0.859 -3.441 495 HG2 GLU 64 HG1 GLU 64 4.155 0.933 -4.295 496 HG3 GLU 64 HG2 GLU 64 3.038 2.114 -3.596 497 HE2 GLU 64 HE2 GLU 64 4.378 -0.112 -0.672 498 H LYS 65 H LYS 65 -0.597 0.905 -4.420 499 HA LYS 65 HA LYS 65 -1.854 -1.717 -4.537 500 HB2 LYS 65 HB2 LYS 65 -3.547 -0.860 -3.230 501 HB3 LYS 65 HB1 LYS 65 -2.180 0.141 -2.718 502 HG2 LYS 65 HG1 LYS 65 -2.935 1.859 -4.403 503 HG3 LYS 65 HG2 LYS 65 -4.409 0.891 -4.588 504 HD2 LYS 65 HD1 LYS 65 -3.399 2.154 -2.030 505 HD3 LYS 65 HD2 LYS 65 -4.787 2.682 -2.996 506 HE2 LYS 65 HE1 LYS 65 -4.489 0.144 -1.388 507 HE3 LYS 65 HE2 LYS 65 -5.680 1.440 -1.194 508 HZ1 LYS 65 3HZ LYS 65 -6.306 0.750 -3.621 509 HZ2 LYS 65 1HZ LYS 65 -6.911 -0.110 -2.296 510 HZ3 LYS 65 2HZ LYS 65 -5.600 -0.720 -3.173 511 H THR 66 H THR 66 -1.776 1.282 -6.305 512 HA THR 66 HA THR 66 -4.122 0.805 -7.860 513 HB THR 66 HB THR 66 -1.779 2.647 -8.368 514 HG1 THR 66 HG1 THR 66 -4.338 3.537 -7.659 515 HG21 THR 66 HG21 THR 66 -2.927 2.128 -10.456 516 HG22 THR 66 HG22 THR 66 -3.268 3.785 -9.960 517 HG23 THR 66 HG23 THR 66 -4.477 2.525 -9.718 518 H MET 67 H MET 67 -0.746 -0.039 -8.154 519 HA MET 67 HA MET 67 -0.482 -0.592 -10.832 520 HB2 MET 67 HB2 MET 67 0.752 -1.573 -8.345 521 HB3 MET 67 HB1 MET 67 0.873 -2.686 -9.716 522 HG2 MET 67 HG1 MET 67 1.591 0.180 -10.130 523 HG3 MET 67 HG2 MET 67 2.713 -0.876 -9.270 524 HE1 MET 67 HE1 MET 67 2.090 -0.163 -13.481 525 HE2 MET 67 HE2 MET 67 0.769 -1.289 -13.167 526 HE3 MET 67 HE3 MET 67 0.936 0.169 -12.188 527 HA PRO 68 HA PRO 68 -2.272 -5.028 -10.180 528 HB2 PRO 68 HB2 PRO 68 -3.439 -5.586 -7.765 529 HB3 PRO 68 HB1 PRO 68 -1.724 -5.828 -8.097 530 HG2 PRO 68 HG1 PRO 68 -3.093 -3.524 -6.751 531 HG3 PRO 68 HG2 PRO 68 -1.600 -4.407 -6.261 532 HD2 PRO 68 HD1 PRO 68 -1.536 -1.992 -7.500 533 HD3 PRO 68 HD2 PRO 68 -0.298 -3.234 -7.760 534 H VAL 69 H VAL 69 -3.776 -2.129 -9.170 535 HA VAL 69 HA VAL 69 -6.491 -3.084 -9.382 536 HB VAL 69 HB VAL 69 -5.308 -0.334 -9.047 537 HG11 VAL 69 HG11 VAL 69 -7.949 0.023 -8.556 538 HG12 VAL 69 HG12 VAL 69 -7.158 0.418 -10.084 539 HG13 VAL 69 HG13 VAL 69 -8.009 -1.116 -9.900 540 HG21 VAL 69 HG21 VAL 69 -5.711 -0.579 -6.851 541 HG22 VAL 69 HG22 VAL 69 -7.252 -1.393 -7.122 542 HG23 VAL 69 HG23 VAL 69 -5.745 -2.303 -7.223 543 H LEU 70 H LEU 70 -4.548 -0.719 -11.221 544 HA LEU 70 HA LEU 70 -6.352 -0.358 -13.315 545 HB2 LEU 70 HB2 LEU 70 -4.508 0.558 -14.576 546 HB3 LEU 70 HB1 LEU 70 -4.416 1.086 -12.886 547 HG LEU 70 HG LEU 70 -2.786 -1.048 -12.774 548 HD11 LEU 70 HD11 LEU 70 -2.099 0.085 -15.454 549 HD12 LEU 70 HD12 LEU 70 -3.210 -1.277 -15.314 550 HD13 LEU 70 HD13 LEU 70 -1.562 -1.417 -14.702 551 HD21 LEU 70 HD21 LEU 70 -2.171 1.791 -13.557 552 HD22 LEU 70 HD22 LEU 70 -0.920 0.613 -13.156 553 HD23 LEU 70 HD23 LEU 70 -2.125 1.067 -11.949 554 H MET 71 H MET 71 -3.691 -2.675 -12.972 555 HA MET 71 HA MET 71 -3.843 -3.810 -15.527 556 HB2 MET 71 HB2 MET 71 -2.475 -5.536 -14.720 557 HB3 MET 71 HB1 MET 71 -2.051 -4.137 -13.723 558 HG2 MET 71 HG1 MET 71 -3.299 -4.955 -11.868 559 HG3 MET 71 HG2 MET 71 -4.033 -6.220 -12.858 560 HE1 MET 71 HE1 MET 71 -1.570 -8.636 -13.718 561 HE2 MET 71 HE2 MET 71 -2.556 -9.030 -12.309 562 HE3 MET 71 HE3 MET 71 -3.240 -8.077 -13.626 563 H LYS 72 H LYS 72 -5.893 -4.136 -12.776 564 HA LYS 72 HA LYS 72 -7.060 -6.645 -13.485 565 HB2 LYS 72 HB2 LYS 72 -7.036 -5.537 -11.183 566 HB3 LYS 72 HB1 LYS 72 -8.352 -4.517 -11.786 567 HG2 LYS 72 HG1 LYS 72 -9.605 -6.138 -10.824 568 HG3 LYS 72 HG2 LYS 72 -9.382 -6.882 -12.417 569 HD2 LYS 72 HD1 LYS 72 -7.395 -7.399 -10.228 570 HD3 LYS 72 HD2 LYS 72 -8.931 -8.283 -10.270 571 HE2 LYS 72 HE1 LYS 72 -8.349 -8.815 -12.721 572 HE3 LYS 72 HE2 LYS 72 -6.716 -8.281 -12.296 573 HZ1 LYS 72 3HZ LYS 72 -7.132 -9.961 -10.318 574 HZ2 LYS 72 1HZ LYS 72 -6.520 -10.469 -11.811 575 HZ3 LYS 72 2HZ LYS 72 -8.161 -10.673 -11.457 576 H LEU 73 H LEU 73 -7.676 -3.309 -14.295 577 HA LEU 73 HA LEU 73 -10.282 -3.762 -15.395 578 HB2 LEU 73 HB2 LEU 73 -8.546 -1.449 -16.174 579 HB3 LEU 73 HB1 LEU 73 -10.302 -1.513 -15.941 580 HG LEU 73 HG LEU 73 -8.212 -1.514 -13.765 581 HD11 LEU 73 HD11 LEU 73 -9.347 0.659 -13.196 582 HD12 LEU 73 HD12 LEU 73 -10.148 0.561 -14.764 583 HD13 LEU 73 HD13 LEU 73 -8.389 0.665 -14.678 584 HD21 LEU 73 HD21 LEU 73 -10.001 -2.844 -12.980 585 HD22 LEU 73 HD22 LEU 73 -11.209 -1.762 -13.676 586 HD23 LEU 73 HD23 LEU 73 -10.248 -1.238 -12.293 587 H LEU 74 H LEU 74 -7.075 -3.143 -16.818 588 HA LEU 74 HA LEU 74 -7.842 -3.408 -19.498 589 HB2 LEU 74 HB2 LEU 74 -5.222 -3.789 -18.067 590 HB3 LEU 74 HB1 LEU 74 -5.376 -4.022 -19.817 591 HG LEU 74 HG LEU 74 -4.495 -1.834 -19.411 592 HD11 LEU 74 HD11 LEU 74 -6.918 -2.320 -20.782 593 HD12 LEU 74 HD12 LEU 74 -5.706 -1.083 -21.106 594 HD13 LEU 74 HD13 LEU 74 -7.049 -0.737 -20.018 595 HD21 LEU 74 HD21 LEU 74 -6.934 -1.282 -17.727 596 HD22 LEU 74 HD22 LEU 74 -5.597 -0.180 -18.057 597 HD23 LEU 74 HD23 LEU 74 -5.328 -1.628 -17.085 598 H GLU 75 H GLU 75 -7.288 -5.772 -17.041 599 HA GLU 75 HA GLU 75 -6.638 -8.013 -18.571 600 HB2 GLU 75 HB2 GLU 75 -7.814 -7.518 -15.900 601 HB3 GLU 75 HB1 GLU 75 -8.132 -9.114 -16.599 602 HG2 GLU 75 HG1 GLU 75 -5.347 -8.004 -16.499 603 HG3 GLU 75 HG2 GLU 75 -6.069 -8.809 -15.099 604 HE2 GLU 75 HE2 GLU 75 -6.022 -11.326 -18.112 605 H GLU 76 H GLU 76 -9.856 -6.930 -17.482 606 HA GLU 76 HA GLU 76 -11.205 -8.882 -19.097 607 HB2 GLU 76 HB2 GLU 76 -12.428 -6.439 -17.807 608 HB3 GLU 76 HB1 GLU 76 -13.234 -7.951 -18.254 609 HG2 GLU 76 HG1 GLU 76 -11.357 -7.426 -15.971 610 HG3 GLU 76 HG2 GLU 76 -13.008 -8.062 -15.936 611 HE2 GLU 76 HE2 GLU 76 -10.348 -10.702 -15.742 612 H ALA 77 H ALA 77 -10.253 -5.546 -19.438 613 HA ALA 77 HA ALA 77 -11.889 -5.111 -21.785 614 HB1 ALA 77 HB1 ALA 77 -11.197 -3.359 -20.024 615 HB2 ALA 77 HB2 ALA 77 -11.182 -2.900 -21.727 616 HB3 ALA 77 HB3 ALA 77 -9.671 -3.299 -20.908 617 H GLY 78 H GLY 78 -9.273 -6.940 -21.340 618 HA2 GLY 78 HA2 GLY 78 -7.596 -7.739 -22.688 619 HA3 GLY 78 3HA GLY 78 -8.622 -7.237 -24.023 620 H GLY 79 H GLY 79 -7.506 -4.862 -21.759 621 HA2 GLY 79 HA2 GLY 79 -5.680 -3.395 -21.889 622 HA3 GLY 79 3HA GLY 79 -5.234 -4.122 -23.426 623 H ASN 80 H ASN 80 -8.387 -2.813 -22.509 624 HA ASN 80 HA ASN 80 -8.062 -0.798 -24.633 625 HB2 ASN 80 HB2 ASN 80 -9.870 -2.789 -24.673 626 HB3 ASN 80 HB1 ASN 80 -10.789 -1.587 -23.759 627 HD21 ASN 80 HD21 ASN 80 -10.969 0.575 -24.723 628 HD22 ASN 80 HD22 ASN 80 -11.096 0.698 -26.442 629 H TRP 81 H TRP 81 -7.565 1.059 -23.636 630 HA TRP 81 HA TRP 81 -8.669 1.743 -21.060 631 HB2 TRP 81 HB2 TRP 81 -6.957 3.373 -22.960 632 HB3 TRP 81 HB1 TRP 81 -7.342 3.809 -21.295 633 HD1 TRP 81 HD1 TRP 81 -5.351 1.140 -23.245 634 HE1 TRP 81 HE1 TRP 81 -3.514 0.218 -21.695 635 HE3 TRP 81 HE3 TRP 81 -6.642 3.556 -18.928 636 HZ2 TRP 81 2HZ TRP 81 -2.719 0.480 -19.000 637 HZ3 TRP 81 3HZ TRP 81 -5.292 3.165 -16.909 638 HH2 TRP 81 HH TRP 81 -3.372 1.658 -16.945 639 H SER 82 H SER 82 -9.485 2.259 -24.351 640 HA SER 82 HA SER 82 -10.788 4.693 -24.333 641 HB2 SER 82 HB2 SER 82 -10.422 2.877 -26.229 642 HB3 SER 82 HB1 SER 82 -12.069 2.408 -25.774 643 HG SER 82 HG SER 82 -11.350 5.076 -26.394 644 H TYR 83 H TYR 83 -12.198 1.502 -23.610 645 HA TYR 83 HA TYR 83 -14.694 2.637 -22.767 646 HB2 TYR 83 HB2 TYR 83 -14.944 0.500 -23.655 647 HB3 TYR 83 HB1 TYR 83 -13.522 -0.123 -22.811 648 HD1 TYR 83 HD2 TYR 83 -13.640 -0.840 -20.490 649 HD2 TYR 83 HD1 TYR 83 -17.089 0.643 -22.495 650 HE1 TYR 83 HE2 TYR 83 -15.063 -1.748 -18.702 651 HE2 TYR 83 HE1 TYR 83 -18.520 -0.260 -20.711 652 HH TYR 83 HH TYR 83 -17.933 -2.463 -18.817 653 H ILE 84 H ILE 84 -11.863 1.261 -21.150 654 HA ILE 84 HA ILE 84 -12.826 1.288 -18.530 655 HB ILE 84 HB ILE 84 -10.005 1.665 -19.536 656 HG12 ILE 84 HG11 ILE 84 -11.399 -0.759 -18.373 657 HG13 ILE 84 HG12 ILE 84 -11.129 -0.484 -20.102 658 HG21 ILE 84 HG21 ILE 84 -9.857 2.505 -17.388 659 HG22 ILE 84 HG22 ILE 84 -11.108 1.428 -16.769 660 HG23 ILE 84 HG23 ILE 84 -9.506 0.794 -17.142 661 HD11 ILE 84 HD11 ILE 84 -9.352 -1.598 -18.145 662 HD12 ILE 84 HD12 ILE 84 -9.200 -1.543 -19.902 663 HD13 ILE 84 HD13 ILE 84 -8.620 -0.194 -18.924 664 H LYS 85 H LYS 85 -11.757 3.871 -20.571 665 HA LYS 85 HA LYS 85 -11.650 5.737 -18.316 666 HB2 LYS 85 HB2 LYS 85 -10.355 7.122 -19.595 667 HB3 LYS 85 HB1 LYS 85 -9.951 5.570 -20.346 668 HG2 LYS 85 HG1 LYS 85 -12.036 6.201 -21.877 669 HG3 LYS 85 HG2 LYS 85 -11.532 7.834 -21.409 670 HD2 LYS 85 HD1 LYS 85 -9.880 5.724 -22.805 671 HD3 LYS 85 HD2 LYS 85 -10.405 7.293 -23.442 672 HE2 LYS 85 HE1 LYS 85 -8.414 6.790 -21.220 673 HE3 LYS 85 HE2 LYS 85 -8.093 7.460 -22.826 674 HZ1 LYS 85 3HZ LYS 85 -8.382 9.448 -21.920 675 HZ2 LYS 85 1HZ LYS 85 -8.957 8.793 -20.470 676 HZ3 LYS 85 2HZ LYS 85 -10.025 9.086 -21.748 677 H LEU 86 H LEU 86 -14.021 4.465 -20.008 678 HA LEU 86 HA LEU 86 -15.427 6.618 -21.147 679 HB2 LEU 86 HB2 LEU 86 -15.861 4.146 -21.455 680 HB3 LEU 86 HB1 LEU 86 -16.661 4.187 -19.874 681 HG LEU 86 HG LEU 86 -17.611 6.099 -21.938 682 HD11 LEU 86 HD11 LEU 86 -18.531 4.610 -23.342 683 HD12 LEU 86 HD12 LEU 86 -18.888 3.460 -22.054 684 HD13 LEU 86 HD13 LEU 86 -17.267 3.534 -22.745 685 HD21 LEU 86 HD21 LEU 86 -19.219 6.331 -20.431 686 HD22 LEU 86 HD22 LEU 86 -18.443 5.121 -19.409 687 HD23 LEU 86 HD23 LEU 86 -19.643 4.628 -20.605 688 H ASP 87 H ASP 87 -14.804 5.825 -17.900 689 HA ASP 87 HA ASP 87 -16.708 7.885 -17.031 690 HB2 ASP 87 HB2 ASP 87 -16.194 5.362 -15.445 691 HB3 ASP 87 HB1 ASP 87 -17.414 6.605 -15.140 692 HD2 ASP 87 HD2 ASP 87 -19.545 5.320 -17.579 693 H ASN 88 H ASN 88 -13.799 7.850 -17.553 694 HA ASN 88 HA ASN 88 -11.929 8.787 -16.657 695 HB2 ASN 88 HB2 ASN 88 -13.931 10.169 -15.503 696 HB3 ASN 88 HB1 ASN 88 -13.215 9.437 -14.061 697 HD21 ASN 88 HD21 ASN 88 -10.565 9.402 -14.671 698 HD22 ASN 88 HD22 ASN 88 -9.974 11.018 -14.828 699 H TYR 89 H TYR 89 -12.301 6.037 -16.380 700 HA TYR 89 HA TYR 89 -11.423 4.226 -15.322 701 HB2 TYR 89 HB2 TYR 89 -9.846 6.290 -13.761 702 HB3 TYR 89 HB1 TYR 89 -9.473 4.568 -13.879 703 HD1 TYR 89 HD2 TYR 89 -10.207 4.389 -16.901 704 HD2 TYR 89 HD1 TYR 89 -7.707 6.997 -14.653 705 HE1 TYR 89 HE2 TYR 89 -8.838 4.794 -18.903 706 HE2 TYR 89 HE1 TYR 89 -6.332 7.410 -16.649 707 HH TYR 89 HH TYR 89 -6.193 7.136 -18.879 708 H THR 90 H THR 90 -13.870 5.190 -14.372 709 HA THR 90 HA THR 90 -14.140 5.604 -11.657 710 HB THR 90 HB THR 90 -15.944 4.132 -13.573 711 HG1 THR 90 HG1 THR 90 -16.092 6.709 -12.357 712 HG21 THR 90 HG21 THR 90 -17.702 4.546 -11.773 713 HG22 THR 90 HG22 THR 90 -16.351 4.779 -10.663 714 HG23 THR 90 HG23 THR 90 -16.563 3.232 -11.483 715 H ALA 91 H ALA 91 -13.409 2.654 -13.365 716 HA ALA 91 HA ALA 91 -14.074 0.744 -11.461 717 HB1 ALA 91 HB1 ALA 91 -11.672 0.653 -13.278 718 HB2 ALA 91 HB2 ALA 91 -13.320 0.275 -13.780 719 HB3 ALA 91 HB3 ALA 91 -12.519 -0.717 -12.561 720 H LEU 92 H LEU 92 -11.283 2.868 -11.656 721 HA LEU 92 HA LEU 92 -9.746 1.589 -9.644 722 HB2 LEU 92 HB2 LEU 92 -8.262 3.353 -9.826 723 HB3 LEU 92 HB1 LEU 92 -9.029 3.307 -11.424 724 HG LEU 92 HG LEU 92 -10.619 5.114 -10.300 725 HD11 LEU 92 HD11 LEU 92 -9.933 5.695 -8.263 726 HD12 LEU 92 HD12 LEU 92 -8.579 6.494 -9.060 727 HD13 LEU 92 HD13 LEU 92 -8.396 4.849 -8.451 728 HD21 LEU 92 HD21 LEU 92 -8.590 5.120 -12.160 729 HD22 LEU 92 HD22 LEU 92 -8.098 6.377 -11.023 730 HD23 LEU 92 HD23 LEU 92 -9.676 6.464 -11.806 731 H VAL 93 H VAL 93 -12.218 4.082 -9.598 732 HA VAL 93 HA VAL 93 -11.854 5.010 -6.978 733 HB VAL 93 HB VAL 93 -14.281 4.903 -8.754 734 HG11 VAL 93 HG11 VAL 93 -15.291 6.498 -7.056 735 HG12 VAL 93 HG12 VAL 93 -15.242 4.794 -6.604 736 HG13 VAL 93 HG13 VAL 93 -14.061 5.920 -5.933 737 HG21 VAL 93 HG21 VAL 93 -12.062 6.633 -8.523 738 HG22 VAL 93 HG22 VAL 93 -13.482 6.817 -9.552 739 HG23 VAL 93 HG23 VAL 93 -13.471 7.514 -7.932 740 H ASP 94 H ASP 94 -14.041 2.490 -8.221 741 HA ASP 94 HA ASP 94 -14.929 1.736 -5.606 742 HB2 ASP 94 HB2 ASP 94 -16.127 1.465 -7.911 743 HB3 ASP 94 HB1 ASP 94 -15.192 -0.032 -8.018 744 HD2 ASP 94 HD2 ASP 94 -18.265 0.100 -5.570 745 H ALA 95 H ALA 95 -12.392 0.727 -7.770 746 HA ALA 95 HA ALA 95 -11.827 -1.769 -6.537 747 HB1 ALA 95 HB1 ALA 95 -10.354 0.022 -8.423 748 HB2 ALA 95 HB2 ALA 95 -10.974 -1.610 -8.678 749 HB3 ALA 95 HB3 ALA 95 -9.536 -1.357 -7.689 750 H ILE 96 H ILE 96 -10.103 1.353 -6.375 751 HA ILE 96 HA ILE 96 -8.296 0.618 -4.373 752 HB ILE 96 HB ILE 96 -9.405 3.357 -4.996 753 HG12 ILE 96 HG11 ILE 96 -8.279 2.229 -6.883 754 HG13 ILE 96 HG12 ILE 96 -7.384 3.650 -6.319 755 HG21 ILE 96 HG21 ILE 96 -6.977 2.559 -3.396 756 HG22 ILE 96 HG22 ILE 96 -7.384 4.206 -3.875 757 HG23 ILE 96 HG23 ILE 96 -8.441 3.321 -2.773 758 HD11 ILE 96 HD11 ILE 96 -5.823 1.902 -6.771 759 HD12 ILE 96 HD12 ILE 96 -5.899 2.145 -5.026 760 HD13 ILE 96 HD13 ILE 96 -6.724 0.771 -5.762 761 H TYR 97 H TYR 97 -11.449 2.235 -4.119 762 HA TYR 97 HA TYR 97 -11.437 2.602 -1.341 763 HB2 TYR 97 HB2 TYR 97 -13.585 2.435 -3.430 764 HB3 TYR 97 HB1 TYR 97 -14.036 2.473 -1.724 765 HD1 TYR 97 HD1 TYR 97 -11.431 4.300 -3.692 766 HD2 TYR 97 HD2 TYR 97 -14.828 4.559 -1.142 767 HE1 TYR 97 HE1 TYR 97 -11.221 6.749 -3.672 768 HE2 TYR 97 HE2 TYR 97 -14.628 7.010 -1.115 769 HH TYR 97 HH TYR 97 -11.883 8.645 -2.538 770 H SER 98 H SER 98 -12.160 -0.183 -3.307 771 HA SER 98 HA SER 98 -13.439 -1.678 -1.222 772 HB2 SER 98 HB2 SER 98 -13.986 -2.188 -3.524 773 HB3 SER 98 HB1 SER 98 -12.285 -2.526 -3.889 774 HG SER 98 HG SER 98 -12.797 -4.500 -3.388 775 H VAL 99 H VAL 99 -10.270 -1.943 -2.836 776 HA VAL 99 HA VAL 99 -9.250 -3.931 -1.114 777 HB VAL 99 HB VAL 99 -7.591 -1.900 -2.601 778 HG11 VAL 99 HG11 VAL 99 -5.827 -3.200 -2.154 779 HG12 VAL 99 HG12 VAL 99 -6.845 -3.929 -0.911 780 HG13 VAL 99 HG13 VAL 99 -6.719 -4.681 -2.502 781 HG21 VAL 99 HG21 VAL 99 -8.588 -2.618 -4.467 782 HG22 VAL 99 HG22 VAL 99 -7.730 -4.137 -4.202 783 HG23 VAL 99 HG23 VAL 99 -9.387 -3.948 -3.629 784 H GLU 100 H GLU 100 -8.685 -0.412 -1.186 785 HA GLU 100 HA GLU 100 -6.984 -0.180 0.965 786 HB2 GLU 100 HB2 GLU 100 -7.514 2.097 1.040 787 HB3 GLU 100 HB1 GLU 100 -7.845 1.633 -0.636 788 HG2 GLU 100 HG1 GLU 100 -9.712 2.859 -0.195 789 HG3 GLU 100 HG2 GLU 100 -10.272 1.248 0.278 790 HE2 GLU 100 HE2 GLU 100 -9.264 3.479 3.396 791 H ASP 101 H ASP 101 -10.434 -0.719 0.953 792 HA ASP 101 HA ASP 101 -11.087 -0.028 3.563 793 HB2 ASP 101 HB2 ASP 101 -12.517 -0.958 1.522 794 HB3 ASP 101 HB1 ASP 101 -12.309 -2.484 2.392 795 HD2 ASP 101 HD2 ASP 101 -14.448 0.343 4.189 796 H GLU 102 H GLU 102 -10.441 -3.350 2.425 797 HA GLU 102 HA GLU 102 -9.539 -4.005 5.147 798 HB2 GLU 102 HB2 GLU 102 -9.902 -6.398 4.395 799 HB3 GLU 102 HB1 GLU 102 -11.358 -5.405 4.560 800 HG2 GLU 102 HG1 GLU 102 -11.451 -5.064 2.162 801 HG3 GLU 102 HG2 GLU 102 -9.950 -5.981 1.964 802 HE2 GLU 102 HE2 GLU 102 -13.328 -7.948 2.368 803 H ASN 103 H ASN 103 -7.445 -4.322 5.468 804 HA ASN 103 HA ASN 103 -5.767 -5.072 3.164 805 HB2 ASN 103 HB2 ASN 103 -5.280 -3.111 5.394 806 HB3 ASN 103 HB1 ASN 103 -3.925 -3.862 4.542 807 HD21 ASN 103 HD21 ASN 103 -7.044 -2.403 3.668 808 HD22 ASN 103 HD22 ASN 103 -6.416 -1.416 2.397 809 H LYS 104 H LYS 104 -6.414 -5.461 6.586 810 HA LYS 104 HA LYS 104 -4.385 -7.568 6.772 811 HB2 LYS 104 HB2 LYS 104 -4.713 -7.463 9.179 812 HB3 LYS 104 HB1 LYS 104 -4.400 -5.844 8.533 813 HG2 LYS 104 HG1 LYS 104 -6.139 -5.301 9.863 814 HG3 LYS 104 HG2 LYS 104 -7.068 -5.817 8.446 815 HD2 LYS 104 HD1 LYS 104 -7.705 -7.816 9.403 816 HD3 LYS 104 HD2 LYS 104 -6.300 -7.858 10.481 817 HE2 LYS 104 HE1 LYS 104 -8.300 -7.428 11.781 818 HE3 LYS 104 HE2 LYS 104 -7.262 -5.995 11.777 819 HZ1 LYS 104 3HZ LYS 104 -9.164 -4.963 11.236 820 HZ2 LYS 104 1HZ LYS 104 -9.900 -6.364 10.638 821 HZ3 LYS 104 2HZ LYS 104 -8.818 -5.498 9.669 822 H GLN 105 H GLN 105 -7.806 -7.052 6.663 823 HA GLN 105 HA GLN 105 -8.529 -9.629 7.698 824 HB2 GLN 105 HB2 GLN 105 -10.178 -7.673 6.081 825 HB3 GLN 105 HB1 GLN 105 -10.797 -9.048 7.008 826 HG2 GLN 105 HG1 GLN 105 -10.412 -8.034 9.052 827 HG3 GLN 105 HG2 GLN 105 -9.215 -6.919 8.377 828 HE21 GLN 105 HE21 GLN 105 -9.918 -5.106 7.212 829 HE22 GLN 105 HE22 GLN 105 -11.527 -4.498 7.373 830 H SER 106 H SER 106 -6.811 -10.522 6.081 831 HA SER 106 HA SER 106 -8.145 -12.103 4.201 832 HB2 SER 106 HB2 SER 106 -8.424 -10.208 2.788 833 HB3 SER 106 HB1 SER 106 -6.758 -9.672 3.069 834 HG SER 106 HG SER 106 -7.175 -10.790 1.022 835 H GLU 107 H GLU 107 -6.668 -13.463 2.940 836 HA GLU 107 HA GLU 107 -3.892 -13.423 3.890 837 HB2 GLU 107 HB2 GLU 107 -5.762 -15.801 3.968 838 HB3 GLU 107 HB1 GLU 107 -4.007 -15.912 4.177 839 HG2 GLU 107 HG1 GLU 107 -4.060 -14.692 6.203 840 HG3 GLU 107 HG2 GLU 107 -5.739 -14.203 5.933 841 HE2 GLU 107 HE2 GLU 107 -6.927 -17.032 7.450 842 H GLY 108 H GLY 108 -2.797 -15.505 2.688 843 HA2 GLY 108 HA2 GLY 108 -2.757 -16.693 0.564 844 HA3 GLY 108 3HA GLY 108 -3.592 -15.321 -0.149 845 H SER 109 H SER 109 -1.769 -15.595 -1.714 846 HA SER 109 HA SER 109 0.733 -14.400 -0.751 847 HB2 SER 109 HB2 SER 109 0.014 -16.201 -3.023 848 HB3 SER 109 HB1 SER 109 1.375 -15.087 -3.247 849 HG SER 109 HG SER 109 2.495 -16.098 -1.710 Start of MODEL 7 1 H1 MET 1 H MET 1 -51.147 6.004 -10.907 2 HA MET 1 HA MET 1 -51.612 7.666 -13.292 3 HB2 MET 1 HB2 MET 1 -49.051 6.934 -11.935 4 HB3 MET 1 HB1 MET 1 -49.063 7.070 -13.700 5 HG2 MET 1 HG1 MET 1 -50.076 9.372 -13.401 6 HG3 MET 1 HG2 MET 1 -49.693 9.203 -11.686 7 HE1 MET 1 HE1 MET 1 -47.159 8.162 -14.908 8 HE2 MET 1 HE2 MET 1 -48.561 9.189 -15.206 9 HE3 MET 1 HE3 MET 1 -46.940 9.886 -15.203 10 H GLY 2 H GLY 2 -49.901 4.684 -12.309 11 HA2 GLY 2 HA2 GLY 2 -50.884 3.428 -14.788 12 HA3 GLY 2 3HA GLY 2 -49.454 2.923 -13.898 13 H SER 3 H SER 3 -49.669 1.612 -12.087 14 HA SER 3 HA SER 3 -52.313 0.348 -11.822 15 HB2 SER 3 HB2 SER 3 -49.550 -0.744 -11.204 16 HB3 SER 3 HB1 SER 3 -51.070 -1.612 -10.928 17 HG SER 3 HG SER 3 -49.997 -2.097 -12.959 18 H SER 4 H SER 4 -53.261 0.096 -9.842 19 HA SER 4 HA SER 4 -52.517 1.927 -7.797 20 HB2 SER 4 HB2 SER 4 -54.874 1.188 -8.340 21 HB3 SER 4 HB1 SER 4 -54.489 -0.352 -7.550 22 HG SER 4 HG SER 4 -55.178 0.711 -5.850 23 H HIS 5 H HIS 5 -51.121 1.664 -6.193 24 HA HIS 5 HA HIS 5 -50.554 -1.051 -5.224 25 HB2 HIS 5 HB2 HIS 5 -48.203 -0.690 -5.200 26 HB3 HIS 5 HB1 HIS 5 -48.766 -0.226 -6.809 27 HD1 HIS 5 HD1 HIS 5 -49.411 2.556 -6.831 28 HD2 HIS 5 HD2 HIS 5 -46.457 1.153 -4.269 29 HE1 HIS 5 HE1 HIS 5 -48.010 4.564 -6.257 30 HE2 HIS 5 HE2 HIS 5 -46.204 3.707 -4.692 31 H HIS 6 H HIS 6 -49.725 -1.148 -3.054 32 HA HIS 6 HA HIS 6 -50.115 1.298 -1.474 33 HB2 HIS 6 HB2 HIS 6 -52.165 -0.120 -1.375 34 HB3 HIS 6 HB1 HIS 6 -51.186 -1.421 -0.692 35 HD1 HIS 6 HD1 HIS 6 -51.976 -1.561 1.664 36 HD2 HIS 6 HD2 HIS 6 -51.165 2.346 0.510 37 HE1 HIS 6 HE1 HIS 6 -52.214 -0.180 3.752 38 HE2 HIS 6 HE2 HIS 6 -51.720 2.208 3.049 39 H HIS 7 H HIS 7 -48.829 1.493 0.346 40 HA HIS 7 HA HIS 7 -46.437 -0.124 0.338 41 HB2 HIS 7 HB2 HIS 7 -47.243 2.170 2.144 42 HB3 HIS 7 HB1 HIS 7 -45.633 1.449 2.050 43 HD1 HIS 7 HD1 HIS 7 -47.636 4.106 0.619 44 HD2 HIS 7 HD2 HIS 7 -44.395 1.809 -0.602 45 HE1 HIS 7 HE1 HIS 7 -46.614 5.355 -1.311 46 HE2 HIS 7 HE2 HIS 7 -44.634 3.951 -2.058 47 H HIS 8 H HIS 8 -47.149 -2.157 1.029 48 HA HIS 8 HA HIS 8 -48.104 -2.299 3.809 49 HB2 HIS 8 HB2 HIS 8 -48.853 -4.601 3.239 50 HB3 HIS 8 HB1 HIS 8 -49.646 -3.351 2.277 51 HD1 HIS 8 HD1 HIS 8 -46.987 -6.010 1.958 52 HD2 HIS 8 HD2 HIS 8 -49.312 -3.545 -0.445 53 HE1 HIS 8 HE1 HIS 8 -46.610 -6.815 -0.393 54 HE2 HIS 8 HE2 HIS 8 -48.031 -5.309 -1.864 55 H HIS 9 H HIS 9 -45.588 -3.247 1.609 56 HA HIS 9 HA HIS 9 -44.285 -4.802 3.740 57 HB2 HIS 9 HB2 HIS 9 -44.753 -5.773 1.375 58 HB3 HIS 9 HB1 HIS 9 -43.383 -4.778 0.873 59 HD1 HIS 9 HD1 HIS 9 -44.070 -7.405 3.545 60 HD2 HIS 9 HD2 HIS 9 -41.012 -6.053 1.078 61 HE1 HIS 9 HE1 HIS 9 -42.135 -8.957 3.960 62 HE2 HIS 9 HE2 HIS 9 -40.266 -8.131 2.453 63 H HIS 10 H HIS 10 -41.864 -4.623 3.777 64 HA HIS 10 HA HIS 10 -41.149 -1.812 3.846 65 HB2 HIS 10 HB2 HIS 10 -39.732 -4.319 4.772 66 HB3 HIS 10 HB1 HIS 10 -39.024 -2.705 4.894 67 HD1 HIS 10 HD1 HIS 10 -41.857 -1.377 5.725 68 HD2 HIS 10 HD2 HIS 10 -39.909 -4.551 7.567 69 HE1 HIS 10 HE1 HIS 10 -42.730 -1.425 8.083 70 HE2 HIS 10 HE2 HIS 10 -41.540 -3.364 9.210 71 H SER 11 H SER 11 -41.241 -1.660 1.460 72 HA SER 11 HA SER 11 -39.215 -2.992 -0.082 73 HB2 SER 11 HB2 SER 11 -39.989 -1.455 -1.917 74 HB3 SER 11 HB1 SER 11 -41.277 -2.433 -1.192 75 HG SER 11 HG SER 11 -42.110 -0.688 -0.241 76 H SER 12 H SER 12 -37.572 -1.836 -1.327 77 HA SER 12 HA SER 12 -35.731 -0.507 -1.472 78 HB2 SER 12 HB2 SER 12 -37.356 1.572 0.017 79 HB3 SER 12 HB1 SER 12 -35.981 1.849 -1.069 80 HG SER 12 HG SER 12 -38.535 0.838 -1.785 81 H GLY 13 H GLY 13 -35.703 -2.320 0.588 82 HA2 GLY 13 HA2 GLY 13 -35.214 -1.350 3.154 83 HA3 GLY 13 3HA GLY 13 -34.530 -2.827 2.494 84 H LEU 14 H LEU 14 -33.831 0.199 3.709 85 HA LEU 14 HA LEU 14 -31.273 0.413 2.300 86 HB2 LEU 14 HB2 LEU 14 -32.655 2.285 4.229 87 HB3 LEU 14 HB1 LEU 14 -31.085 2.589 3.467 88 HG LEU 14 HG LEU 14 -33.682 2.275 1.964 89 HD11 LEU 14 HD11 LEU 14 -32.766 4.868 1.665 90 HD12 LEU 14 HD12 LEU 14 -32.548 4.531 3.382 91 HD13 LEU 14 HD13 LEU 14 -34.138 4.344 2.643 92 HD21 LEU 14 HD21 LEU 14 -32.277 3.376 0.158 93 HD22 LEU 14 HD22 LEU 14 -31.916 1.689 0.525 94 HD23 LEU 14 HD23 LEU 14 -30.875 2.969 1.149 95 H VAL 15 H VAL 15 -29.351 0.997 3.657 96 HA VAL 15 HA VAL 15 -29.367 -0.552 6.167 97 HB VAL 15 HB VAL 15 -26.868 -0.848 5.681 98 HG11 VAL 15 HG11 VAL 15 -28.844 -2.517 5.391 99 HG12 VAL 15 HG12 VAL 15 -28.545 -2.285 3.668 100 HG13 VAL 15 HG13 VAL 15 -27.264 -2.906 4.710 101 HG21 VAL 15 HG21 VAL 15 -27.641 -0.477 2.815 102 HG22 VAL 15 HG22 VAL 15 -27.069 0.893 3.767 103 HG23 VAL 15 HG23 VAL 15 -26.035 -0.518 3.543 104 HA PRO 16 HA PRO 16 -27.892 2.967 8.336 105 HB2 PRO 16 HB2 PRO 16 -26.255 1.812 10.204 106 HB3 PRO 16 HB1 PRO 16 -28.014 1.698 10.248 107 HG2 PRO 16 HG1 PRO 16 -26.008 -0.262 9.187 108 HG3 PRO 16 HG2 PRO 16 -27.449 -0.557 10.229 109 HD2 PRO 16 HD1 PRO 16 -27.446 -1.049 7.558 110 HD3 PRO 16 HD2 PRO 16 -28.887 -0.493 8.428 111 H ARG 17 H ARG 17 -25.815 4.016 9.152 112 HA ARG 17 HA ARG 17 -23.618 3.478 7.262 113 HB2 ARG 17 HB2 ARG 17 -25.014 5.605 6.907 114 HB3 ARG 17 HB1 ARG 17 -24.245 6.200 8.386 115 HG2 ARG 17 HG1 ARG 17 -22.055 6.034 7.388 116 HG3 ARG 17 HG2 ARG 17 -22.750 5.298 5.934 117 HD2 ARG 17 HD1 ARG 17 -24.135 7.410 5.671 118 HD3 ARG 17 HD2 ARG 17 -23.117 8.111 6.937 119 HE ARG 17 HE ARG 17 -21.295 7.225 5.167 120 HH11 ARG 17 1HH1 ARG 17 -24.171 9.156 4.814 121 HH12 ARG 17 2HH1 ARG 17 -23.564 10.046 3.456 122 HH21 ARG 17 1HH2 ARG 17 -20.485 8.390 3.382 123 HH22 ARG 17 2HH2 ARG 17 -21.467 9.609 2.642 124 H GLY 18 H GLY 18 -22.327 2.289 8.620 125 HA2 GLY 18 HA2 GLY 18 -20.712 3.727 10.463 126 HA3 GLY 18 3HA GLY 18 -21.859 2.711 11.323 127 H SER 19 H SER 19 -18.955 2.815 9.480 128 HA SER 19 HA SER 19 -18.068 0.312 10.403 129 HB2 SER 19 HB2 SER 19 -17.929 -0.674 7.960 130 HB3 SER 19 HB1 SER 19 -19.394 -0.891 8.935 131 HG SER 19 HG SER 19 -19.218 0.242 6.575 132 H HIS 20 H HIS 20 -15.942 -0.261 9.563 133 HA HIS 20 HA HIS 20 -14.204 1.875 9.372 134 HB2 HIS 20 HB2 HIS 20 -13.826 -0.721 9.736 135 HB3 HIS 20 HB1 HIS 20 -13.475 -0.680 8.005 136 HD1 HIS 20 HD1 HIS 20 -11.044 -1.444 9.080 137 HD2 HIS 20 HD2 HIS 20 -12.186 2.530 9.494 138 HE1 HIS 20 HE1 HIS 20 -8.926 -0.184 9.586 139 HE2 HIS 20 HE2 HIS 20 -9.623 2.244 9.837 140 H MET 21 H MET 21 -13.707 3.278 7.822 141 HA MET 21 HA MET 21 -14.609 2.707 5.086 142 HB2 MET 21 HB2 MET 21 -13.980 5.319 6.478 143 HB3 MET 21 HB1 MET 21 -14.382 5.182 4.760 144 HG2 MET 21 HG1 MET 21 -16.507 3.921 5.720 145 HG3 MET 21 HG2 MET 21 -16.123 4.894 7.142 146 HE1 MET 21 HE1 MET 21 -19.132 5.975 4.843 147 HE2 MET 21 HE2 MET 21 -18.126 5.548 3.459 148 HE3 MET 21 HE3 MET 21 -18.270 4.436 4.822 149 H ILE 22 H ILE 22 -11.905 4.282 6.795 150 HA ILE 22 HA ILE 22 -10.075 3.164 4.803 151 HB ILE 22 HB ILE 22 -10.611 5.482 4.094 152 HG12 ILE 22 HG11 ILE 22 -7.781 5.073 5.094 153 HG13 ILE 22 HG12 ILE 22 -8.434 4.456 3.566 154 HG21 ILE 22 HG21 ILE 22 -10.485 7.276 5.441 155 HG22 ILE 22 HG22 ILE 22 -10.623 6.086 6.734 156 HG23 ILE 22 HG23 ILE 22 -9.037 6.691 6.258 157 HD11 ILE 22 HD11 ILE 22 -7.383 6.322 2.807 158 HD12 ILE 22 HD12 ILE 22 -8.973 7.002 3.158 159 HD13 ILE 22 HD13 ILE 22 -7.648 7.218 4.303 160 H SER 23 H SER 23 -8.131 2.545 5.606 161 HA SER 23 HA SER 23 -7.836 2.559 8.483 162 HB2 SER 23 HB2 SER 23 -7.367 0.521 7.137 163 HB3 SER 23 HB1 SER 23 -6.015 1.376 6.373 164 HG SER 23 HG SER 23 -4.982 0.476 8.001 165 H LEU 24 H LEU 24 -7.657 5.035 8.252 166 HA LEU 24 HA LEU 24 -5.414 6.310 7.235 167 HB2 LEU 24 HB2 LEU 24 -7.526 7.334 8.207 168 HB3 LEU 24 HB1 LEU 24 -6.778 7.100 9.796 169 HG LEU 24 HG LEU 24 -4.818 8.490 8.743 170 HD11 LEU 24 HD11 LEU 24 -7.142 9.574 7.173 171 HD12 LEU 24 HD12 LEU 24 -5.949 8.471 6.488 172 HD13 LEU 24 HD13 LEU 24 -5.446 10.053 7.085 173 HD21 LEU 24 HD21 LEU 24 -7.096 10.258 9.292 174 HD22 LEU 24 HD22 LEU 24 -5.524 10.146 10.084 175 HD23 LEU 24 HD23 LEU 24 -6.809 9.014 10.509 176 H SER 25 H SER 25 -5.766 4.370 10.088 177 HA SER 25 HA SER 25 -3.159 5.201 11.114 178 HB2 SER 25 HB2 SER 25 -3.777 3.522 12.973 179 HB3 SER 25 HB1 SER 25 -4.724 5.018 12.864 180 HG SER 25 HG SER 25 -5.865 2.870 13.047 181 H GLY 26 H GLY 26 -1.574 4.301 9.908 182 HA2 GLY 26 HA2 GLY 26 -1.707 1.385 9.459 183 HA3 GLY 26 3HA GLY 26 -0.833 2.507 8.426 184 H LEU 27 H LEU 27 -0.666 0.450 11.131 185 HA LEU 27 HA LEU 27 2.018 1.469 11.795 186 HB2 LEU 27 HB2 LEU 27 1.773 0.570 13.993 187 HB3 LEU 27 HB1 LEU 27 0.342 1.547 13.623 188 HG LEU 27 HG LEU 27 0.220 -1.402 13.190 189 HD11 LEU 27 HD11 LEU 27 1.095 -0.464 15.602 190 HD12 LEU 27 HD12 LEU 27 0.227 -1.978 15.350 191 HD13 LEU 27 HD13 LEU 27 -0.652 -0.528 15.837 192 HD21 LEU 27 HD21 LEU 27 -1.642 0.865 13.632 193 HD22 LEU 27 HD22 LEU 27 -2.120 -0.720 14.239 194 HD23 LEU 27 HD23 LEU 27 -1.762 -0.502 12.525 195 H THR 28 H THR 28 0.815 -0.653 9.826 196 HA THR 28 HA THR 28 2.017 -3.117 10.647 197 HB THR 28 HB THR 28 1.515 -3.904 8.371 198 HG1 THR 28 HG1 THR 28 1.331 -2.478 6.830 199 HG21 THR 28 HG21 THR 28 -1.035 -3.025 8.487 200 HG22 THR 28 HG22 THR 28 -0.494 -2.626 10.118 201 HG23 THR 28 HG23 THR 28 -0.389 -4.287 9.535 202 H SER 29 H SER 29 3.529 -4.209 8.923 203 HA SER 29 HA SER 29 6.021 -2.956 9.088 204 HB2 SER 29 HB2 SER 29 5.574 -5.428 8.768 205 HB3 SER 29 HB1 SER 29 5.269 -5.069 7.060 206 HG SER 29 HG SER 29 7.537 -5.662 7.922 207 H SER 30 H SER 30 7.356 -2.937 6.814 208 HA SER 30 HA SER 30 5.983 -0.890 5.206 209 HB2 SER 30 HB2 SER 30 8.255 -0.509 6.520 210 HB3 SER 30 HB1 SER 30 8.945 -1.280 5.080 211 HG SER 30 HG SER 30 7.537 1.146 5.288 212 H VAL 31 H VAL 31 6.940 -0.768 2.895 213 HA VAL 31 HA VAL 31 6.674 -1.788 0.840 214 HB VAL 31 HB VAL 31 8.531 -3.327 0.325 215 HG11 VAL 31 HG11 VAL 31 10.201 -1.724 0.461 216 HG12 VAL 31 HG12 VAL 31 8.730 -0.759 0.599 217 HG13 VAL 31 HG13 VAL 31 9.666 -1.155 2.042 218 HG21 VAL 31 HG21 VAL 31 8.447 -4.468 2.572 219 HG22 VAL 31 HG22 VAL 31 10.061 -4.091 1.968 220 HG23 VAL 31 HG23 VAL 31 9.328 -3.084 3.217 221 H GLU 32 H GLU 32 4.723 -2.785 2.518 222 HA GLU 32 HA GLU 32 4.748 -5.664 2.480 223 HB2 GLU 32 HB2 GLU 32 2.494 -5.506 3.400 224 HB3 GLU 32 HB1 GLU 32 3.604 -4.438 4.271 225 HG2 GLU 32 HG1 GLU 32 2.770 -2.518 2.993 226 HG3 GLU 32 HG2 GLU 32 1.643 -3.590 2.152 227 HE2 GLU 32 HE2 GLU 32 0.620 -2.210 5.644 228 H SER 33 H SER 33 3.774 -3.150 0.353 229 HA SER 33 HA SER 33 2.346 -5.102 -1.331 230 HB2 SER 33 HB2 SER 33 2.026 -2.126 -1.642 231 HB3 SER 33 HB1 SER 33 0.912 -3.425 -2.103 232 HG SER 33 HG SER 33 0.721 -3.819 0.233 233 H ASP 34 H ASP 34 5.034 -3.024 -1.064 234 HA ASP 34 HA ASP 34 5.559 -2.320 -3.703 235 HB2 ASP 34 HB2 ASP 34 6.810 -1.530 -1.676 236 HB3 ASP 34 HB1 ASP 34 7.629 -3.096 -1.640 237 HD2 ASP 34 HD2 ASP 34 8.493 -0.925 -4.849 238 H LEU 35 H LEU 35 5.779 -5.393 -2.131 239 HA LEU 35 HA LEU 35 7.628 -6.753 -3.660 240 HB2 LEU 35 HB2 LEU 35 5.977 -7.452 -1.674 241 HB3 LEU 35 HB1 LEU 35 5.097 -8.163 -3.038 242 HG LEU 35 HG LEU 35 6.530 -9.805 -1.943 243 HD11 LEU 35 HD11 LEU 35 7.791 -9.199 -4.592 244 HD12 LEU 35 HD12 LEU 35 6.109 -9.717 -4.476 245 HD13 LEU 35 HD13 LEU 35 7.397 -10.762 -3.878 246 HD21 LEU 35 HD21 LEU 35 8.392 -7.651 -1.925 247 HD22 LEU 35 HD22 LEU 35 9.095 -8.996 -2.823 248 HD23 LEU 35 HD23 LEU 35 8.530 -9.239 -1.169 249 H ASP 36 H ASP 36 4.406 -5.725 -4.504 250 HA ASP 36 HA ASP 36 3.868 -7.357 -6.686 251 HB2 ASP 36 HB2 ASP 36 2.201 -5.848 -7.268 252 HB3 ASP 36 HB1 ASP 36 2.429 -5.506 -5.547 253 HD2 ASP 36 HD2 ASP 36 3.257 -2.690 -8.149 254 H MET 37 H MET 37 6.024 -4.625 -6.398 255 HA MET 37 HA MET 37 6.406 -3.909 -9.035 256 HB2 MET 37 HB2 MET 37 8.292 -4.003 -6.687 257 HB3 MET 37 HB1 MET 37 8.816 -3.412 -8.271 258 HG2 MET 37 HG1 MET 37 6.444 -2.278 -6.795 259 HG3 MET 37 HG2 MET 37 8.087 -1.658 -6.628 260 HE1 MET 37 HE1 MET 37 9.364 -0.498 -8.090 261 HE2 MET 37 HE2 MET 37 8.888 0.286 -9.595 262 HE3 MET 37 HE3 MET 37 8.242 0.862 -8.057 263 H GLN 38 H GLN 38 7.540 -6.738 -7.333 264 HA GLN 38 HA GLN 38 9.586 -7.611 -8.968 265 HB2 GLN 38 HB2 GLN 38 8.328 -8.626 -6.804 266 HB3 GLN 38 HB1 GLN 38 7.687 -9.692 -8.064 267 HG2 GLN 38 HG1 GLN 38 9.681 -10.625 -6.983 268 HG3 GLN 38 HG2 GLN 38 9.912 -10.346 -8.714 269 HE21 GLN 38 HE21 GLN 38 10.483 -8.884 -5.549 270 HE22 GLN 38 HE22 GLN 38 11.947 -8.079 -5.987 271 H GLN 39 H GLN 39 6.100 -8.196 -9.335 272 HA GLN 39 HA GLN 39 6.395 -9.665 -11.763 273 HB2 GLN 39 HB2 GLN 39 3.903 -8.273 -10.768 274 HB3 GLN 39 HB1 GLN 39 4.002 -9.654 -11.874 275 HG2 GLN 39 HG1 GLN 39 4.814 -9.689 -8.966 276 HG3 GLN 39 HG2 GLN 39 3.289 -10.303 -9.620 277 HE21 GLN 39 HE21 GLN 39 6.721 -10.810 -9.398 278 HE22 GLN 39 HE22 GLN 39 6.721 -12.446 -9.952 279 H ALA 40 H ALA 40 6.173 -6.317 -10.956 280 HA ALA 40 HA ALA 40 5.170 -5.272 -13.357 281 HB1 ALA 40 HB1 ALA 40 7.237 -3.701 -11.949 282 HB2 ALA 40 HB2 ALA 40 5.832 -4.187 -10.999 283 HB3 ALA 40 HB3 ALA 40 5.617 -3.240 -12.472 284 H MET 41 H MET 41 8.237 -6.638 -12.577 285 HA MET 41 HA MET 41 9.674 -5.395 -14.737 286 HB2 MET 41 HB2 MET 41 10.452 -7.863 -13.172 287 HB3 MET 41 HB1 MET 41 11.520 -6.791 -14.091 288 HG2 MET 41 HG1 MET 41 10.438 -5.016 -12.359 289 HG3 MET 41 HG2 MET 41 10.413 -6.489 -11.386 290 HE1 MET 41 HE1 MET 41 12.157 -4.036 -13.390 291 HE2 MET 41 HE2 MET 41 13.594 -3.693 -12.427 292 HE3 MET 41 HE3 MET 41 13.685 -4.830 -13.773 293 H LEU 42 H LEU 42 8.395 -8.653 -14.098 294 HA LEU 42 HA LEU 42 9.164 -9.812 -16.527 295 HB2 LEU 42 HB2 LEU 42 7.023 -10.412 -14.513 296 HB3 LEU 42 HB1 LEU 42 7.112 -11.325 -16.030 297 HG LEU 42 HG LEU 42 9.508 -11.883 -15.384 298 HD11 LEU 42 HD11 LEU 42 8.526 -10.668 -12.819 299 HD12 LEU 42 HD12 LEU 42 10.003 -10.308 -13.711 300 HD13 LEU 42 HD13 LEU 42 9.837 -11.846 -12.866 301 HD21 LEU 42 HD21 LEU 42 8.315 -13.764 -15.122 302 HD22 LEU 42 HD22 LEU 42 6.992 -12.932 -14.304 303 HD23 LEU 42 HD23 LEU 42 8.433 -13.402 -13.400 304 H THR 43 H THR 43 6.653 -7.586 -15.782 305 HA THR 43 HA THR 43 5.327 -8.084 -18.355 306 HB THR 43 HB THR 43 3.898 -7.993 -16.314 307 HG1 THR 43 HG1 THR 43 2.330 -6.871 -17.375 308 HG21 THR 43 HG21 THR 43 3.640 -6.083 -15.024 309 HG22 THR 43 HG22 THR 43 4.306 -5.028 -16.270 310 HG23 THR 43 HG23 THR 43 5.375 -6.080 -15.342 311 H ASN 44 H ASN 44 7.357 -5.859 -16.686 312 HA ASN 44 HA ASN 44 8.409 -3.949 -17.336 313 HB2 ASN 44 HB2 ASN 44 8.448 -5.442 -19.541 314 HB3 ASN 44 HB1 ASN 44 7.385 -4.158 -20.130 315 HD21 ASN 44 HD21 ASN 44 10.333 -4.340 -18.156 316 HD22 ASN 44 HD22 ASN 44 11.189 -3.114 -19.021 317 H LYS 45 H LYS 45 7.543 -2.166 -16.515 318 HA LYS 45 HA LYS 45 4.906 -1.363 -16.619 319 HB2 LYS 45 HB2 LYS 45 7.490 0.044 -16.094 320 HB3 LYS 45 HB1 LYS 45 6.025 1.018 -16.288 321 HG2 LYS 45 HG1 LYS 45 6.044 0.716 -14.018 322 HG3 LYS 45 HG2 LYS 45 5.030 -0.642 -14.536 323 HD2 LYS 45 HD1 LYS 45 6.561 -1.545 -12.974 324 HD3 LYS 45 HD2 LYS 45 7.142 -2.041 -14.573 325 HE2 LYS 45 HE1 LYS 45 8.857 -0.383 -14.573 326 HE3 LYS 45 HE2 LYS 45 8.165 0.405 -13.147 327 HZ1 LYS 45 3HZ LYS 45 9.419 -0.875 -11.874 328 HZ2 LYS 45 1HZ LYS 45 10.071 -1.640 -13.236 329 HZ3 LYS 45 2HZ LYS 45 8.685 -2.266 -12.497 330 H ASP 46 H ASP 46 3.996 0.601 -17.663 331 HA ASP 46 HA ASP 46 5.144 1.270 -20.258 332 HB2 ASP 46 HB2 ASP 46 2.459 -0.055 -19.866 333 HB3 ASP 46 HB1 ASP 46 2.829 0.912 -21.299 334 HD2 ASP 46 HD2 ASP 46 4.070 -2.751 -21.219 335 H GLU 47 H GLU 47 4.420 3.237 -21.108 336 HA GLU 47 HA GLU 47 3.767 5.227 -19.266 337 HB2 GLU 47 HB2 GLU 47 3.303 6.651 -21.271 338 HB3 GLU 47 HB1 GLU 47 4.865 5.819 -21.311 339 HG2 GLU 47 HG1 GLU 47 3.792 4.053 -22.740 340 HG3 GLU 47 HG2 GLU 47 2.374 5.107 -22.835 341 HE2 GLU 47 HE2 GLU 47 4.426 5.889 -25.687 342 H LYS 48 H LYS 48 1.706 3.569 -21.636 343 HA LYS 48 HA LYS 48 -0.658 4.936 -21.251 344 HB2 LYS 48 HB2 LYS 48 -1.767 2.698 -21.814 345 HB3 LYS 48 HB1 LYS 48 -0.628 3.362 -22.995 346 HG2 LYS 48 HG1 LYS 48 -0.027 1.133 -22.925 347 HG3 LYS 48 HG2 LYS 48 1.119 1.881 -21.799 348 HD2 LYS 48 HD1 LYS 48 0.318 0.739 -20.046 349 HD3 LYS 48 HD2 LYS 48 -1.362 1.073 -20.505 350 HE2 LYS 48 HE1 LYS 48 0.417 -1.078 -21.680 351 HE3 LYS 48 HE2 LYS 48 -0.915 -1.320 -20.541 352 HZ1 LYS 48 3HZ LYS 48 -1.849 0.142 -22.758 353 HZ2 LYS 48 1HZ LYS 48 -2.330 -1.389 -22.223 354 HZ3 LYS 48 2HZ LYS 48 -1.048 -1.239 -23.316 355 H VAL 49 H VAL 49 0.871 2.563 -19.201 356 HA VAL 49 HA VAL 49 -1.431 2.139 -17.532 357 HB VAL 49 HB VAL 49 1.450 1.327 -17.367 358 HG11 VAL 49 HG11 VAL 49 0.516 0.051 -15.239 359 HG12 VAL 49 HG12 VAL 49 1.241 1.656 -15.120 360 HG13 VAL 49 HG13 VAL 49 -0.514 1.479 -15.145 361 HG21 VAL 49 HG21 VAL 49 -0.503 -0.726 -16.911 362 HG22 VAL 49 HG22 VAL 49 -0.904 0.176 -18.373 363 HG23 VAL 49 HG23 VAL 49 0.681 -0.580 -18.211 364 H LEU 50 H LEU 50 1.496 4.106 -17.388 365 HA LEU 50 HA LEU 50 1.197 5.029 -14.749 366 HB2 LEU 50 HB2 LEU 50 2.454 6.498 -17.071 367 HB3 LEU 50 HB1 LEU 50 2.755 6.770 -15.347 368 HG LEU 50 HG LEU 50 3.413 4.162 -16.694 369 HD11 LEU 50 HD11 LEU 50 5.417 4.911 -17.425 370 HD12 LEU 50 HD12 LEU 50 5.561 6.116 -16.147 371 HD13 LEU 50 HD13 LEU 50 4.537 6.434 -17.547 372 HD21 LEU 50 HD21 LEU 50 5.149 4.850 -14.575 373 HD22 LEU 50 HD22 LEU 50 3.956 3.552 -14.633 374 HD23 LEU 50 HD23 LEU 50 3.502 5.143 -14.018 375 H LYS 51 H LYS 51 -0.393 5.885 -17.692 376 HA LYS 51 HA LYS 51 -1.245 8.486 -17.079 377 HB2 LYS 51 HB2 LYS 51 -2.673 6.368 -18.706 378 HB3 LYS 51 HB1 LYS 51 -3.009 8.107 -18.745 379 HG2 LYS 51 HG1 LYS 51 -0.227 7.719 -19.241 380 HG3 LYS 51 HG2 LYS 51 -1.159 6.643 -20.297 381 HD2 LYS 51 HD1 LYS 51 -1.626 9.619 -19.994 382 HD3 LYS 51 HD2 LYS 51 -0.746 8.847 -21.325 383 HE2 LYS 51 HE1 LYS 51 -3.666 8.486 -20.618 384 HE3 LYS 51 HE2 LYS 51 -2.998 9.307 -22.037 385 HZ1 LYS 51 3HZ LYS 51 -3.716 7.128 -22.662 386 HZ2 LYS 51 1HZ LYS 51 -2.816 6.408 -21.423 387 HZ3 LYS 51 2HZ LYS 51 -2.026 7.158 -22.717 388 H ALA 52 H ALA 52 -2.455 5.349 -16.107 389 HA ALA 52 HA ALA 52 -4.955 6.232 -15.096 390 HB1 ALA 52 HB1 ALA 52 -3.530 3.765 -15.300 391 HB2 ALA 52 HB2 ALA 52 -5.252 4.035 -15.029 392 HB3 ALA 52 HB3 ALA 52 -4.146 3.947 -13.657 393 H LEU 53 H LEU 53 -1.737 5.928 -13.708 394 HA LEU 53 HA LEU 53 -2.385 6.236 -11.007 395 HB2 LEU 53 HB2 LEU 53 0.078 7.181 -12.484 396 HB3 LEU 53 HB1 LEU 53 -0.074 7.019 -10.726 397 HG LEU 53 HG LEU 53 -0.266 4.720 -12.670 398 HD11 LEU 53 HD11 LEU 53 1.987 5.982 -12.412 399 HD12 LEU 53 HD12 LEU 53 1.958 4.223 -12.296 400 HD13 LEU 53 HD13 LEU 53 2.040 5.201 -10.831 401 HD21 LEU 53 HD21 LEU 53 0.429 4.193 -9.890 402 HD22 LEU 53 HD22 LEU 53 -0.760 3.409 -10.931 403 HD23 LEU 53 HD23 LEU 53 -1.176 4.899 -10.084 404 H GLU 54 H GLU 54 -2.448 8.494 -13.594 405 HA GLU 54 HA GLU 54 -2.096 10.889 -12.134 406 HB2 GLU 54 HB2 GLU 54 -3.631 10.390 -14.695 407 HB3 GLU 54 HB1 GLU 54 -3.171 11.982 -14.072 408 HG2 GLU 54 HG1 GLU 54 -0.808 10.448 -14.158 409 HG3 GLU 54 HG2 GLU 54 -1.661 10.169 -15.682 410 HE2 GLU 54 HE2 GLU 54 -1.550 13.817 -16.121 411 H ARG 55 H ARG 55 -4.952 8.974 -12.951 412 HA ARG 55 HA ARG 55 -6.785 10.832 -11.756 413 HB2 ARG 55 HB2 ARG 55 -7.636 9.508 -13.534 414 HB3 ARG 55 HB1 ARG 55 -7.070 8.011 -12.779 415 HG2 ARG 55 HG1 ARG 55 -9.507 8.288 -12.606 416 HG3 ARG 55 HG2 ARG 55 -8.712 8.218 -11.024 417 HD2 ARG 55 HD1 ARG 55 -9.344 10.303 -10.473 418 HD3 ARG 55 HD2 ARG 55 -8.939 10.929 -12.077 419 HE ARG 55 HE ARG 55 -11.230 9.522 -12.491 420 HH11 ARG 55 1HH1 ARG 55 -10.298 12.077 -10.316 421 HH12 ARG 55 2HH1 ARG 55 -11.888 12.759 -10.229 422 HH21 ARG 55 1HH2 ARG 55 -13.327 10.412 -12.382 423 HH22 ARG 55 2HH2 ARG 55 -13.611 11.811 -11.403 424 H THR 56 H THR 56 -5.079 7.947 -10.743 425 HA THR 56 HA THR 56 -6.567 7.568 -8.330 426 HB THR 56 HB THR 56 -5.080 5.833 -7.806 427 HG1 THR 56 HG1 THR 56 -3.213 7.181 -9.480 428 HG21 THR 56 HG21 THR 56 -5.427 4.510 -9.592 429 HG22 THR 56 HG22 THR 56 -4.526 5.571 -10.674 430 HG23 THR 56 HG23 THR 56 -6.210 5.926 -10.292 431 H ARG 57 H ARG 57 -3.454 9.057 -9.134 432 HA ARG 57 HA ARG 57 -2.588 9.628 -6.546 433 HB2 ARG 57 HB2 ARG 57 -1.100 11.240 -7.525 434 HB3 ARG 57 HB1 ARG 57 -1.218 9.851 -8.616 435 HG2 ARG 57 HG1 ARG 57 -2.490 11.014 -10.187 436 HG3 ARG 57 HG2 ARG 57 -2.937 12.268 -9.018 437 HD2 ARG 57 HD1 ARG 57 -1.274 13.075 -10.650 438 HD3 ARG 57 HD2 ARG 57 -0.665 13.107 -8.989 439 HE ARG 57 HE ARG 57 0.023 10.686 -10.339 440 HH11 ARG 57 1HH1 ARG 57 0.898 14.032 -9.942 441 HH12 ARG 57 2HH1 ARG 57 2.560 13.781 -10.360 442 HH21 ARG 57 1HH2 ARG 57 2.209 10.343 -10.891 443 HH22 ARG 57 2HH2 ARG 57 3.305 11.684 -10.900 444 H GLN 58 H GLN 58 -5.022 11.137 -8.498 445 HA GLN 58 HA GLN 58 -5.140 13.638 -7.197 446 HB2 GLN 58 HB2 GLN 58 -7.124 12.045 -8.810 447 HB3 GLN 58 HB1 GLN 58 -7.553 13.604 -8.091 448 HG2 GLN 58 HG1 GLN 58 -5.224 13.209 -9.965 449 HG3 GLN 58 HG2 GLN 58 -6.842 13.707 -10.478 450 HE21 GLN 58 HE21 GLN 58 -4.026 14.624 -8.625 451 HE22 GLN 58 HE22 GLN 58 -4.357 16.320 -8.595 452 H LEU 59 H LEU 59 -6.734 10.549 -6.584 453 HA LEU 59 HA LEU 59 -8.146 11.665 -4.290 454 HB2 LEU 59 HB2 LEU 59 -8.165 8.797 -5.224 455 HB3 LEU 59 HB1 LEU 59 -9.349 9.625 -4.199 456 HG LEU 59 HG LEU 59 -9.172 10.917 -6.767 457 HD11 LEU 59 HD11 LEU 59 -10.135 9.078 -8.098 458 HD12 LEU 59 HD12 LEU 59 -9.778 7.965 -6.778 459 HD13 LEU 59 HD13 LEU 59 -8.462 8.778 -7.626 460 HD21 LEU 59 HD21 LEU 59 -11.008 10.979 -5.032 461 HD22 LEU 59 HD22 LEU 59 -11.459 9.365 -5.580 462 HD23 LEU 59 HD23 LEU 59 -11.527 10.728 -6.698 463 H ASP 60 H ASP 60 -5.122 11.013 -4.607 464 HA ASP 60 HA ASP 60 -3.430 10.414 -3.209 465 HB2 ASP 60 HB2 ASP 60 -5.424 9.943 -1.004 466 HB3 ASP 60 HB1 ASP 60 -3.766 10.548 -0.893 467 HD2 ASP 60 HD2 ASP 60 -4.799 13.783 -1.869 468 H ILE 61 H ILE 61 -3.408 8.482 -4.622 469 HA ILE 61 HA ILE 61 -3.896 6.059 -3.023 470 HB ILE 61 HB ILE 61 -4.256 6.176 -6.015 471 HG12 ILE 61 HG11 ILE 61 -6.397 6.124 -3.874 472 HG13 ILE 61 HG12 ILE 61 -5.957 7.554 -4.823 473 HG21 ILE 61 HG21 ILE 61 -5.177 3.984 -5.801 474 HG22 ILE 61 HG22 ILE 61 -3.630 4.002 -4.957 475 HG23 ILE 61 HG23 ILE 61 -5.135 4.079 -4.040 476 HD11 ILE 61 HD11 ILE 61 -6.544 5.326 -6.550 477 HD12 ILE 61 HD12 ILE 61 -7.888 5.670 -5.461 478 HD13 ILE 61 HD13 ILE 61 -7.253 6.940 -6.506 479 HA PRO 62 HA PRO 62 0.410 5.400 -3.825 480 HB2 PRO 62 HB2 PRO 62 0.551 2.854 -2.825 481 HB3 PRO 62 HB1 PRO 62 0.447 4.293 -1.812 482 HG2 PRO 62 HG1 PRO 62 -1.729 2.426 -2.693 483 HG3 PRO 62 HG2 PRO 62 -1.410 3.114 -1.057 484 HD2 PRO 62 HD1 PRO 62 -3.330 4.094 -2.708 485 HD3 PRO 62 HD2 PRO 62 -2.407 5.121 -1.598 486 H ASP 63 H ASP 63 1.567 4.604 -5.494 487 HA ASP 63 HA ASP 63 0.243 3.345 -7.661 488 HB2 ASP 63 HB2 ASP 63 3.237 3.514 -7.269 489 HB3 ASP 63 HB1 ASP 63 2.345 3.421 -8.793 490 HD2 ASP 63 HD2 ASP 63 3.261 6.908 -7.848 491 H GLU 64 H GLU 64 1.482 2.099 -4.808 492 HA GLU 64 HA GLU 64 2.441 -0.413 -5.797 493 HB2 GLU 64 HB2 GLU 64 1.517 0.157 -2.981 494 HB3 GLU 64 HB1 GLU 64 2.704 -1.041 -3.522 495 HG2 GLU 64 HG1 GLU 64 4.226 0.775 -4.184 496 HG3 GLU 64 HG2 GLU 64 3.049 1.948 -3.578 497 HE2 GLU 64 HE2 GLU 64 5.181 1.568 -0.798 498 H LYS 65 H LYS 65 -0.583 0.759 -4.403 499 HA LYS 65 HA LYS 65 -1.803 -1.872 -4.634 500 HB2 LYS 65 HB2 LYS 65 -3.552 -1.073 -3.334 501 HB3 LYS 65 HB1 LYS 65 -2.166 -0.162 -2.714 502 HG2 LYS 65 HG1 LYS 65 -2.819 1.716 -4.247 503 HG3 LYS 65 HG2 LYS 65 -4.305 0.812 -4.591 504 HD2 LYS 65 HD1 LYS 65 -3.411 1.667 -1.830 505 HD3 LYS 65 HD2 LYS 65 -4.592 2.532 -2.828 506 HE2 LYS 65 HE1 LYS 65 -6.245 1.130 -2.268 507 HE3 LYS 65 HE2 LYS 65 -5.237 -0.285 -2.609 508 HZ1 LYS 65 3HZ LYS 65 -5.581 -0.513 -0.376 509 HZ2 LYS 65 1HZ LYS 65 -5.619 1.152 -0.080 510 HZ3 LYS 65 2HZ LYS 65 -4.142 0.375 -0.353 511 H THR 66 H THR 66 -1.716 1.175 -6.295 512 HA THR 66 HA THR 66 -4.070 0.778 -7.858 513 HB THR 66 HB THR 66 -1.700 2.599 -8.321 514 HG1 THR 66 HG1 THR 66 -4.261 3.460 -7.542 515 HG21 THR 66 HG21 THR 66 -2.840 2.193 -10.422 516 HG22 THR 66 HG22 THR 66 -3.220 3.817 -9.849 517 HG23 THR 66 HG23 THR 66 -4.400 2.521 -9.670 518 H MET 67 H MET 67 -0.708 -0.107 -8.186 519 HA MET 67 HA MET 67 -0.476 -0.589 -10.886 520 HB2 MET 67 HB2 MET 67 0.794 -1.614 -8.438 521 HB3 MET 67 HB1 MET 67 0.883 -2.715 -9.821 522 HG2 MET 67 HG1 MET 67 1.610 0.150 -10.227 523 HG3 MET 67 HG2 MET 67 2.741 -0.913 -9.386 524 HE1 MET 67 HE1 MET 67 1.057 0.260 -12.282 525 HE2 MET 67 HE2 MET 67 2.173 -0.150 -13.585 526 HE3 MET 67 HE3 MET 67 0.773 -1.175 -13.268 527 HA PRO 68 HA PRO 68 -2.269 -5.034 -10.305 528 HB2 PRO 68 HB2 PRO 68 -3.410 -5.637 -7.890 529 HB3 PRO 68 HB1 PRO 68 -1.700 -5.878 -8.245 530 HG2 PRO 68 HG1 PRO 68 -3.047 -3.598 -6.836 531 HG3 PRO 68 HG2 PRO 68 -1.550 -4.494 -6.382 532 HD2 PRO 68 HD1 PRO 68 -1.493 -2.056 -7.572 533 HD3 PRO 68 HD2 PRO 68 -0.263 -3.296 -7.870 534 H VAL 69 H VAL 69 -3.768 -2.169 -9.153 535 HA VAL 69 HA VAL 69 -6.480 -3.118 -9.401 536 HB VAL 69 HB VAL 69 -5.292 -0.393 -8.927 537 HG11 VAL 69 HG11 VAL 69 -8.017 -1.119 -9.797 538 HG12 VAL 69 HG12 VAL 69 -7.903 0.020 -8.455 539 HG13 VAL 69 HG13 VAL 69 -7.124 0.389 -9.994 540 HG21 VAL 69 HG21 VAL 69 -7.269 -1.582 -7.096 541 HG22 VAL 69 HG22 VAL 69 -5.723 -2.424 -7.200 542 HG23 VAL 69 HG23 VAL 69 -5.770 -0.721 -6.747 543 H LEU 70 H LEU 70 -4.545 -0.674 -11.141 544 HA LEU 70 HA LEU 70 -6.365 -0.216 -13.205 545 HB2 LEU 70 HB2 LEU 70 -4.547 0.781 -14.421 546 HB3 LEU 70 HB1 LEU 70 -4.408 1.196 -12.703 547 HG LEU 70 HG LEU 70 -2.787 -0.938 -12.760 548 HD11 LEU 70 HD11 LEU 70 -2.113 0.315 -15.381 549 HD12 LEU 70 HD12 LEU 70 -3.309 -0.980 -15.319 550 HD13 LEU 70 HD13 LEU 70 -1.669 -1.267 -14.740 551 HD21 LEU 70 HD21 LEU 70 -2.250 1.955 -13.331 552 HD22 LEU 70 HD22 LEU 70 -0.934 0.786 -13.219 553 HD23 LEU 70 HD23 LEU 70 -1.999 1.049 -11.839 554 H MET 71 H MET 71 -3.717 -2.557 -12.969 555 HA MET 71 HA MET 71 -3.865 -3.569 -15.575 556 HB2 MET 71 HB2 MET 71 -2.511 -5.339 -14.846 557 HB3 MET 71 HB1 MET 71 -2.082 -3.990 -13.783 558 HG2 MET 71 HG1 MET 71 -3.329 -4.887 -11.970 559 HG3 MET 71 HG2 MET 71 -4.085 -6.091 -13.018 560 HE1 MET 71 HE1 MET 71 -3.697 -8.186 -12.128 561 HE2 MET 71 HE2 MET 71 -2.860 -8.501 -13.649 562 HE3 MET 71 HE3 MET 71 -2.158 -9.048 -12.125 563 H LYS 72 H LYS 72 -5.924 -4.015 -12.847 564 HA LYS 72 HA LYS 72 -7.099 -6.485 -13.651 565 HB2 LYS 72 HB2 LYS 72 -7.115 -5.459 -11.321 566 HB3 LYS 72 HB1 LYS 72 -8.391 -4.384 -11.915 567 HG2 LYS 72 HG1 LYS 72 -9.962 -6.027 -11.980 568 HG3 LYS 72 HG2 LYS 72 -8.771 -7.292 -12.324 569 HD2 LYS 72 HD1 LYS 72 -8.961 -5.899 -9.653 570 HD3 LYS 72 HD2 LYS 72 -9.845 -7.385 -10.039 571 HE2 LYS 72 HE1 LYS 72 -6.888 -7.277 -10.510 572 HE3 LYS 72 HE2 LYS 72 -7.504 -7.494 -8.866 573 HZ1 LYS 72 3HZ LYS 72 -8.760 -9.426 -9.643 574 HZ2 LYS 72 1HZ LYS 72 -7.098 -9.619 -9.897 575 HZ3 LYS 72 2HZ LYS 72 -8.112 -9.234 -11.194 576 H LEU 73 H LEU 73 -7.675 -3.132 -14.406 577 HA LEU 73 HA LEU 73 -10.279 -3.487 -15.513 578 HB2 LEU 73 HB2 LEU 73 -8.436 -1.286 -16.364 579 HB3 LEU 73 HB1 LEU 73 -10.189 -1.254 -16.107 580 HG LEU 73 HG LEU 73 -8.026 -1.212 -14.011 581 HD11 LEU 73 HD11 LEU 73 -9.167 0.908 -13.393 582 HD12 LEU 73 HD12 LEU 73 -10.168 0.739 -14.836 583 HD13 LEU 73 HD13 LEU 73 -8.423 0.936 -14.992 584 HD21 LEU 73 HD21 LEU 73 -10.941 -1.821 -13.807 585 HD22 LEU 73 HD22 LEU 73 -10.146 -0.929 -12.510 586 HD23 LEU 73 HD23 LEU 73 -9.578 -2.541 -12.950 587 H LEU 74 H LEU 74 -7.006 -3.438 -16.841 588 HA LEU 74 HA LEU 74 -7.807 -3.594 -19.565 589 HB2 LEU 74 HB2 LEU 74 -5.212 -4.228 -18.160 590 HB3 LEU 74 HB1 LEU 74 -5.422 -4.328 -19.916 591 HG LEU 74 HG LEU 74 -4.352 -2.264 -19.460 592 HD11 LEU 74 HD11 LEU 74 -6.860 -2.415 -20.693 593 HD12 LEU 74 HD12 LEU 74 -5.616 -1.188 -20.930 594 HD13 LEU 74 HD13 LEU 74 -6.884 -0.937 -19.731 595 HD21 LEU 74 HD21 LEU 74 -5.062 -2.236 -17.036 596 HD22 LEU 74 HD22 LEU 74 -6.577 -1.516 -17.577 597 HD23 LEU 74 HD23 LEU 74 -5.052 -0.675 -17.855 598 H GLU 75 H GLU 75 -7.484 -5.904 -17.028 599 HA GLU 75 HA GLU 75 -7.018 -8.240 -18.508 600 HB2 GLU 75 HB2 GLU 75 -8.181 -7.611 -15.835 601 HB3 GLU 75 HB1 GLU 75 -8.450 -9.232 -16.492 602 HG2 GLU 75 HG1 GLU 75 -5.909 -9.296 -16.871 603 HG3 GLU 75 HG2 GLU 75 -5.862 -7.913 -15.769 604 HE2 GLU 75 HE2 GLU 75 -6.646 -11.490 -14.278 605 H GLU 76 H GLU 76 -10.088 -6.786 -17.438 606 HA GLU 76 HA GLU 76 -11.666 -8.703 -18.877 607 HB2 GLU 76 HB2 GLU 76 -13.527 -6.983 -18.316 608 HB3 GLU 76 HB1 GLU 76 -12.769 -7.891 -17.000 609 HG2 GLU 76 HG1 GLU 76 -11.465 -6.043 -16.322 610 HG3 GLU 76 HG2 GLU 76 -11.848 -5.150 -17.800 611 HE2 GLU 76 HE2 GLU 76 -14.088 -4.456 -14.801 612 H ALA 77 H ALA 77 -10.744 -5.318 -19.347 613 HA ALA 77 HA ALA 77 -12.236 -5.016 -21.769 614 HB1 ALA 77 HB1 ALA 77 -11.365 -3.214 -20.080 615 HB2 ALA 77 HB2 ALA 77 -11.498 -2.842 -21.798 616 HB3 ALA 77 HB3 ALA 77 -9.930 -3.248 -21.104 617 H GLY 78 H GLY 78 -9.543 -6.789 -21.105 618 HA2 GLY 78 HA2 GLY 78 -7.969 -7.812 -22.425 619 HA3 GLY 78 3HA GLY 78 -8.966 -7.352 -23.798 620 H GLY 79 H GLY 79 -7.794 -4.859 -21.710 621 HA2 GLY 79 HA2 GLY 79 -5.844 -3.539 -21.914 622 HA3 GLY 79 3HA GLY 79 -5.502 -4.322 -23.449 623 H ASN 80 H ASN 80 -8.571 -2.873 -22.490 624 HA ASN 80 HA ASN 80 -8.196 -0.881 -24.630 625 HB2 ASN 80 HB2 ASN 80 -10.112 -2.829 -24.537 626 HB3 ASN 80 HB1 ASN 80 -10.957 -1.471 -23.784 627 HD21 ASN 80 HD21 ASN 80 -10.431 0.688 -25.024 628 HD22 ASN 80 HD22 ASN 80 -10.697 0.599 -26.728 629 H TRP 81 H TRP 81 -7.663 0.982 -23.675 630 HA TRP 81 HA TRP 81 -8.683 1.708 -21.077 631 HB2 TRP 81 HB2 TRP 81 -6.980 3.246 -23.059 632 HB3 TRP 81 HB1 TRP 81 -7.361 3.789 -21.425 633 HD1 TRP 81 HD1 TRP 81 -5.387 1.000 -23.212 634 HE1 TRP 81 HE1 TRP 81 -3.571 0.142 -21.602 635 HE3 TRP 81 HE3 TRP 81 -6.689 3.645 -19.035 636 HZ2 TRP 81 2HZ TRP 81 -2.794 0.534 -18.918 637 HZ3 TRP 81 3HZ TRP 81 -5.358 3.347 -16.988 638 HH2 TRP 81 HH TRP 81 -3.451 1.823 -16.932 639 H SER 82 H SER 82 -9.553 2.251 -24.364 640 HA SER 82 HA SER 82 -10.847 4.685 -24.300 641 HB2 SER 82 HB2 SER 82 -10.520 3.233 -26.321 642 HB3 SER 82 HB1 SER 82 -11.861 2.227 -25.745 643 HG SER 82 HG SER 82 -11.904 4.810 -26.800 644 H TYR 83 H TYR 83 -12.254 1.495 -23.569 645 HA TYR 83 HA TYR 83 -14.734 2.629 -22.682 646 HB2 TYR 83 HB2 TYR 83 -15.004 0.494 -23.562 647 HB3 TYR 83 HB1 TYR 83 -13.564 -0.130 -22.754 648 HD1 TYR 83 HD1 TYR 83 -17.121 0.638 -22.347 649 HD2 TYR 83 HD2 TYR 83 -13.627 -0.862 -20.438 650 HE1 TYR 83 HE1 TYR 83 -18.510 -0.271 -20.532 651 HE2 TYR 83 HE2 TYR 83 -15.006 -1.775 -18.618 652 HH TYR 83 HH TYR 83 -18.418 -1.067 -18.366 653 H ILE 84 H ILE 84 -11.890 1.229 -21.106 654 HA ILE 84 HA ILE 84 -12.812 1.271 -18.471 655 HB ILE 84 HB ILE 84 -9.998 1.635 -19.505 656 HG12 ILE 84 HG11 ILE 84 -11.329 -0.814 -18.329 657 HG13 ILE 84 HG12 ILE 84 -11.218 -0.501 -20.070 658 HG21 ILE 84 HG21 ILE 84 -10.048 2.491 -17.283 659 HG22 ILE 84 HG22 ILE 84 -11.017 1.133 -16.718 660 HG23 ILE 84 HG23 ILE 84 -9.343 0.877 -17.208 661 HD11 ILE 84 HD11 ILE 84 -9.485 -2.049 -19.242 662 HD12 ILE 84 HD12 ILE 84 -8.823 -0.600 -19.999 663 HD13 ILE 84 HD13 ILE 84 -8.843 -0.747 -18.242 664 H LYS 85 H LYS 85 -11.778 3.843 -20.537 665 HA LYS 85 HA LYS 85 -11.599 5.711 -18.287 666 HB2 LYS 85 HB2 LYS 85 -10.326 7.084 -19.599 667 HB3 LYS 85 HB1 LYS 85 -9.952 5.528 -20.357 668 HG2 LYS 85 HG1 LYS 85 -12.083 6.188 -21.828 669 HG3 LYS 85 HG2 LYS 85 -11.522 7.810 -21.388 670 HD2 LYS 85 HD1 LYS 85 -9.968 5.647 -22.817 671 HD3 LYS 85 HD2 LYS 85 -10.477 7.220 -23.454 672 HE2 LYS 85 HE1 LYS 85 -9.040 7.923 -21.209 673 HE3 LYS 85 HE2 LYS 85 -8.156 6.521 -21.827 674 HZ1 LYS 85 3HZ LYS 85 -7.214 8.342 -22.905 675 HZ2 LYS 85 1HZ LYS 85 -8.708 9.080 -23.196 676 HZ3 LYS 85 2HZ LYS 85 -8.266 7.696 -24.061 677 H LEU 86 H LEU 86 -13.944 4.485 -20.196 678 HA LEU 86 HA LEU 86 -15.375 6.631 -21.214 679 HB2 LEU 86 HB2 LEU 86 -15.923 4.283 -21.649 680 HB3 LEU 86 HB1 LEU 86 -16.451 4.105 -19.967 681 HG LEU 86 HG LEU 86 -18.082 6.092 -20.703 682 HD11 LEU 86 HD11 LEU 86 -17.149 4.817 -23.208 683 HD12 LEU 86 HD12 LEU 86 -17.700 6.465 -22.908 684 HD13 LEU 86 HD13 LEU 86 -18.874 5.157 -23.060 685 HD21 LEU 86 HD21 LEU 86 -18.511 3.156 -21.240 686 HD22 LEU 86 HD22 LEU 86 -19.787 4.367 -21.114 687 HD23 LEU 86 HD23 LEU 86 -18.782 3.994 -19.712 688 H ASP 87 H ASP 87 -14.930 5.625 -17.933 689 HA ASP 87 HA ASP 87 -16.767 7.758 -17.061 690 HB2 ASP 87 HB2 ASP 87 -16.157 5.246 -15.487 691 HB3 ASP 87 HB1 ASP 87 -17.385 6.471 -15.136 692 HD2 ASP 87 HD2 ASP 87 -18.263 3.599 -17.657 693 H ASN 88 H ASN 88 -13.853 7.761 -17.634 694 HA ASN 88 HA ASN 88 -11.987 8.744 -16.781 695 HB2 ASN 88 HB2 ASN 88 -14.019 10.104 -15.617 696 HB3 ASN 88 HB1 ASN 88 -13.220 9.449 -14.182 697 HD21 ASN 88 HD21 ASN 88 -10.623 9.518 -14.719 698 HD22 ASN 88 HD22 ASN 88 -10.086 11.133 -15.024 699 H TYR 89 H TYR 89 -12.258 6.011 -16.455 700 HA TYR 89 HA TYR 89 -11.341 4.241 -15.362 701 HB2 TYR 89 HB2 TYR 89 -9.836 6.377 -13.827 702 HB3 TYR 89 HB1 TYR 89 -9.413 4.665 -13.907 703 HD1 TYR 89 HD2 TYR 89 -10.134 4.426 -16.936 704 HD2 TYR 89 HD1 TYR 89 -7.692 7.104 -14.708 705 HE1 TYR 89 HE2 TYR 89 -8.762 4.829 -18.936 706 HE2 TYR 89 HE1 TYR 89 -6.313 7.515 -16.702 707 HH TYR 89 HH TYR 89 -7.182 6.184 -19.843 708 H THR 90 H THR 90 -13.822 5.087 -14.453 709 HA THR 90 HA THR 90 -14.093 5.530 -11.722 710 HB THR 90 HB THR 90 -15.893 4.105 -13.676 711 HG1 THR 90 HG1 THR 90 -15.641 6.695 -12.628 712 HG21 THR 90 HG21 THR 90 -16.258 4.573 -10.734 713 HG22 THR 90 HG22 THR 90 -16.574 3.114 -11.674 714 HG23 THR 90 HG23 THR 90 -17.643 4.508 -11.823 715 H ALA 91 H ALA 91 -13.375 2.595 -13.466 716 HA ALA 91 HA ALA 91 -14.046 0.660 -11.594 717 HB1 ALA 91 HB1 ALA 91 -12.389 -0.758 -12.673 718 HB2 ALA 91 HB2 ALA 91 -11.665 0.651 -13.447 719 HB3 ALA 91 HB3 ALA 91 -13.303 0.154 -13.874 720 H LEU 92 H LEU 92 -11.219 2.752 -11.755 721 HA LEU 92 HA LEU 92 -9.734 1.456 -9.719 722 HB2 LEU 92 HB2 LEU 92 -8.211 3.181 -9.900 723 HB3 LEU 92 HB1 LEU 92 -8.979 3.172 -11.497 724 HG LEU 92 HG LEU 92 -10.526 5.002 -10.350 725 HD11 LEU 92 HD11 LEU 92 -8.637 6.404 -9.062 726 HD12 LEU 92 HD12 LEU 92 -8.164 4.769 -8.599 727 HD13 LEU 92 HD13 LEU 92 -9.791 5.349 -8.245 728 HD21 LEU 92 HD21 LEU 92 -8.014 6.258 -11.049 729 HD22 LEU 92 HD22 LEU 92 -9.571 6.307 -11.878 730 HD23 LEU 92 HD23 LEU 92 -8.448 4.981 -12.185 731 H VAL 93 H VAL 93 -12.181 3.968 -9.709 732 HA VAL 93 HA VAL 93 -11.827 4.882 -7.072 733 HB VAL 93 HB VAL 93 -14.239 4.860 -8.876 734 HG11 VAL 93 HG11 VAL 93 -15.323 4.913 -6.847 735 HG12 VAL 93 HG12 VAL 93 -13.986 5.728 -6.032 736 HG13 VAL 93 HG13 VAL 93 -15.036 6.631 -7.126 737 HG21 VAL 93 HG21 VAL 93 -11.954 6.443 -8.797 738 HG22 VAL 93 HG22 VAL 93 -13.452 6.792 -9.659 739 HG23 VAL 93 HG23 VAL 93 -13.205 7.424 -8.031 740 H ASP 94 H ASP 94 -14.017 2.413 -8.400 741 HA ASP 94 HA ASP 94 -15.044 1.681 -5.831 742 HB2 ASP 94 HB2 ASP 94 -16.094 1.398 -8.222 743 HB3 ASP 94 HB1 ASP 94 -15.197 -0.127 -8.216 744 HD2 ASP 94 HD2 ASP 94 -17.864 0.095 -5.292 745 H ALA 95 H ALA 95 -12.404 0.633 -7.846 746 HA ALA 95 HA ALA 95 -11.933 -1.848 -6.527 747 HB1 ALA 95 HB1 ALA 95 -9.566 -1.404 -7.617 748 HB2 ALA 95 HB2 ALA 95 -10.473 -0.178 -8.501 749 HB3 ALA 95 HB3 ALA 95 -10.961 -1.870 -8.589 750 H ILE 96 H ILE 96 -10.172 1.255 -6.423 751 HA ILE 96 HA ILE 96 -8.431 0.562 -4.346 752 HB ILE 96 HB ILE 96 -9.471 3.289 -5.120 753 HG12 ILE 96 HG11 ILE 96 -8.279 2.069 -6.904 754 HG13 ILE 96 HG12 ILE 96 -7.385 3.498 -6.358 755 HG21 ILE 96 HG21 ILE 96 -7.472 4.152 -3.953 756 HG22 ILE 96 HG22 ILE 96 -8.614 3.364 -2.865 757 HG23 ILE 96 HG23 ILE 96 -7.146 2.523 -3.362 758 HD11 ILE 96 HD11 ILE 96 -6.808 0.672 -5.501 759 HD12 ILE 96 HD12 ILE 96 -5.912 1.582 -6.717 760 HD13 ILE 96 HD13 ILE 96 -5.904 2.113 -5.036 761 H TYR 97 H TYR 97 -11.643 2.031 -4.278 762 HA TYR 97 HA TYR 97 -11.734 2.665 -1.551 763 HB2 TYR 97 HB2 TYR 97 -13.765 2.182 -3.687 764 HB3 TYR 97 HB1 TYR 97 -14.317 2.212 -2.010 765 HD1 TYR 97 HD1 TYR 97 -11.617 4.266 -3.529 766 HD2 TYR 97 HD2 TYR 97 -15.544 4.207 -1.892 767 HE1 TYR 97 HE1 TYR 97 -11.664 6.724 -3.569 768 HE2 TYR 97 HE2 TYR 97 -15.602 6.665 -1.929 769 HH TYR 97 HH TYR 97 -12.817 8.562 -2.483 770 H SER 98 H SER 98 -12.270 -0.343 -3.254 771 HA SER 98 HA SER 98 -13.412 -1.714 -1.010 772 HB2 SER 98 HB2 SER 98 -14.086 -2.724 -2.972 773 HB3 SER 98 HB1 SER 98 -12.516 -2.476 -3.756 774 HG SER 98 HG SER 98 -12.560 -4.608 -3.300 775 H VAL 99 H VAL 99 -10.270 -1.952 -2.681 776 HA VAL 99 HA VAL 99 -9.078 -3.720 -0.860 777 HB VAL 99 HB VAL 99 -7.632 -1.636 -2.496 778 HG11 VAL 99 HG11 VAL 99 -6.183 -2.697 -0.911 779 HG12 VAL 99 HG12 VAL 99 -6.794 -4.294 -1.347 780 HG13 VAL 99 HG13 VAL 99 -5.838 -3.367 -2.505 781 HG21 VAL 99 HG21 VAL 99 -9.181 -3.954 -3.322 782 HG22 VAL 99 HG22 VAL 99 -8.528 -2.629 -4.285 783 HG23 VAL 99 HG23 VAL 99 -7.511 -4.014 -3.886 784 H GLU 100 H GLU 100 -8.735 -0.179 -1.121 785 HA GLU 100 HA GLU 100 -7.077 0.262 1.035 786 HB2 GLU 100 HB2 GLU 100 -7.702 2.509 0.952 787 HB3 GLU 100 HB1 GLU 100 -8.021 1.928 -0.689 788 HG2 GLU 100 HG1 GLU 100 -10.408 1.632 -0.082 789 HG3 GLU 100 HG2 GLU 100 -10.048 2.356 1.492 790 HE2 GLU 100 HE2 GLU 100 -11.135 5.137 -0.400 791 H ASP 101 H ASP 101 -10.491 -0.463 1.007 792 HA ASP 101 HA ASP 101 -11.255 0.356 3.541 793 HB2 ASP 101 HB2 ASP 101 -12.704 -0.643 1.698 794 HB3 ASP 101 HB1 ASP 101 -12.171 -2.227 2.277 795 HD2 ASP 101 HD2 ASP 101 -14.382 -2.162 4.889 796 H GLU 102 H GLU 102 -10.444 -3.024 2.738 797 HA GLU 102 HA GLU 102 -9.329 -3.289 5.453 798 HB2 GLU 102 HB2 GLU 102 -9.948 -5.652 5.379 799 HB3 GLU 102 HB1 GLU 102 -11.363 -4.615 5.140 800 HG2 GLU 102 HG1 GLU 102 -11.733 -6.186 3.527 801 HG3 GLU 102 HG2 GLU 102 -10.827 -4.976 2.606 802 HE2 GLU 102 HE2 GLU 102 -8.496 -7.979 3.686 803 H ASN 103 H ASN 103 -7.317 -4.110 5.701 804 HA ASN 103 HA ASN 103 -5.954 -5.206 3.345 805 HB2 ASN 103 HB2 ASN 103 -4.985 -2.951 5.111 806 HB3 ASN 103 HB1 ASN 103 -3.901 -3.888 4.076 807 HD21 ASN 103 HD21 ASN 103 -6.939 -2.072 3.915 808 HD22 ASN 103 HD22 ASN 103 -6.647 -1.389 2.355 809 H LYS 104 H LYS 104 -5.927 -4.716 6.846 810 HA LYS 104 HA LYS 104 -4.072 -6.940 7.195 811 HB2 LYS 104 HB2 LYS 104 -4.085 -6.318 9.572 812 HB3 LYS 104 HB1 LYS 104 -3.691 -4.938 8.534 813 HG2 LYS 104 HG1 LYS 104 -6.058 -4.188 8.711 814 HG3 LYS 104 HG2 LYS 104 -6.325 -5.493 9.881 815 HD2 LYS 104 HD1 LYS 104 -4.978 -4.513 11.499 816 HD3 LYS 104 HD2 LYS 104 -4.091 -3.548 10.307 817 HE2 LYS 104 HE1 LYS 104 -7.026 -3.078 10.731 818 HE3 LYS 104 HE2 LYS 104 -5.840 -2.400 11.856 819 HZ1 LYS 104 3HZ LYS 104 -4.728 -1.571 9.671 820 HZ2 LYS 104 1HZ LYS 104 -6.033 -0.722 10.333 821 HZ3 LYS 104 2HZ LYS 104 -6.278 -1.765 9.024 822 H GLN 105 H GLN 105 -7.385 -6.436 7.006 823 HA GLN 105 HA GLN 105 -8.279 -8.329 8.939 824 HB2 GLN 105 HB2 GLN 105 -9.767 -7.483 6.450 825 HB3 GLN 105 HB1 GLN 105 -10.444 -8.055 7.983 826 HG2 GLN 105 HG1 GLN 105 -8.957 -5.457 7.595 827 HG3 GLN 105 HG2 GLN 105 -10.715 -5.640 7.683 828 HE21 GLN 105 HE21 GLN 105 -8.134 -4.729 9.407 829 HE22 GLN 105 HE22 GLN 105 -8.684 -5.082 11.006 830 H SER 106 H SER 106 -6.667 -8.693 6.036 831 HA SER 106 HA SER 106 -6.281 -10.433 4.615 832 HB2 SER 106 HB2 SER 106 -5.382 -11.463 6.614 833 HB3 SER 106 HB1 SER 106 -7.005 -11.967 7.123 834 HG SER 106 HG SER 106 -5.503 -13.510 5.911 835 H GLU 107 H GLU 107 -8.557 -9.415 3.884 836 HA GLU 107 HA GLU 107 -10.418 -11.684 3.610 837 HB2 GLU 107 HB2 GLU 107 -11.081 -9.425 4.830 838 HB3 GLU 107 HB1 GLU 107 -11.341 -8.884 3.163 839 HG2 GLU 107 HG1 GLU 107 -12.969 -10.586 2.772 840 HG3 GLU 107 HG2 GLU 107 -12.603 -11.354 4.323 841 HE2 GLU 107 HE2 GLU 107 -14.101 -8.017 5.446 842 H GLY 108 H GLY 108 -8.654 -9.138 2.007 843 HA2 GLY 108 HA2 GLY 108 -9.481 -10.292 -0.583 844 HA3 GLY 108 3HA GLY 108 -9.325 -8.556 -0.355 845 H SER 109 H SER 109 -7.874 -10.974 -1.831 846 HA SER 109 HA SER 109 -5.133 -10.273 -1.073 847 HB2 SER 109 HB2 SER 109 -5.461 -12.634 -1.177 848 HB3 SER 109 HB1 SER 109 -6.284 -12.512 -2.742 849 HG SER 109 HG SER 109 -3.575 -12.478 -2.160 Start of MODEL 8 1 H1 MET 1 H MET 1 66.849 -48.167 47.232 2 HA MET 1 HA MET 1 66.097 -45.381 47.609 3 HB2 MET 1 HB2 MET 1 68.324 -46.622 45.972 4 HB3 MET 1 HB1 MET 1 68.094 -44.890 46.253 5 HG2 MET 1 HG1 MET 1 68.368 -45.292 48.694 6 HG3 MET 1 HG2 MET 1 68.743 -46.976 48.319 7 HE1 MET 1 HE1 MET 1 71.749 -46.927 46.202 8 HE2 MET 1 HE2 MET 1 71.822 -47.505 47.867 9 HE3 MET 1 HE3 MET 1 70.367 -47.769 46.904 10 H GLY 2 H GLY 2 64.580 -44.497 46.375 11 HA2 GLY 2 HA2 GLY 2 64.637 -44.751 43.521 12 HA3 GLY 2 3HA GLY 2 63.286 -45.621 44.235 13 H SER 3 H SER 3 64.086 -42.818 42.795 14 HA SER 3 HA SER 3 62.758 -40.902 44.433 15 HB2 SER 3 HB2 SER 3 63.062 -40.587 41.454 16 HB3 SER 3 HB1 SER 3 63.181 -39.361 42.727 17 HG SER 3 HG SER 3 65.137 -40.831 41.638 18 H SER 4 H SER 4 60.771 -39.791 43.917 19 HA SER 4 HA SER 4 58.822 -41.541 42.563 20 HB2 SER 4 HB2 SER 4 58.059 -41.629 44.736 21 HB3 SER 4 HB1 SER 4 58.676 -40.014 45.125 22 HG SER 4 HG SER 4 56.233 -40.536 44.659 23 H HIS 5 H HIS 5 58.140 -40.707 40.715 24 HA HIS 5 HA HIS 5 58.310 -37.841 40.243 25 HB2 HIS 5 HB2 HIS 5 57.920 -40.266 38.532 26 HB3 HIS 5 HB1 HIS 5 57.384 -38.699 37.919 27 HD1 HIS 5 HD1 HIS 5 59.461 -36.768 38.335 28 HD2 HIS 5 HD2 HIS 5 60.441 -40.752 37.682 29 HE1 HIS 5 HE1 HIS 5 61.849 -36.752 37.545 30 HE2 HIS 5 HE2 HIS 5 62.448 -39.187 37.146 31 H HIS 6 H HIS 6 56.406 -36.954 38.844 32 HA HIS 6 HA HIS 6 54.046 -37.166 40.491 33 HB2 HIS 6 HB2 HIS 6 54.981 -35.377 38.291 34 HB3 HIS 6 HB1 HIS 6 53.244 -35.478 38.594 35 HD1 HIS 6 HD1 HIS 6 52.998 -35.448 41.559 36 HD2 HIS 6 HD2 HIS 6 55.791 -33.117 39.553 37 HE1 HIS 6 HE1 HIS 6 53.558 -33.566 43.131 38 HE2 HIS 6 HE2 HIS 6 55.264 -32.141 41.905 39 H HIS 7 H HIS 7 51.909 -37.556 39.642 40 HA HIS 7 HA HIS 7 51.908 -39.324 37.285 41 HB2 HIS 7 HB2 HIS 7 50.411 -39.597 39.895 42 HB3 HIS 7 HB1 HIS 7 49.982 -40.509 38.445 43 HD1 HIS 7 HD1 HIS 7 53.253 -39.915 40.319 44 HD2 HIS 7 HD2 HIS 7 51.068 -42.969 38.540 45 HE1 HIS 7 HE1 HIS 7 54.620 -41.999 40.647 46 HE2 HIS 7 HE2 HIS 7 53.287 -43.867 39.561 47 H HIS 8 H HIS 8 49.431 -39.684 36.647 48 HA HIS 8 HA HIS 8 47.651 -38.760 35.570 49 HB2 HIS 8 HB2 HIS 8 47.812 -37.078 38.065 50 HB3 HIS 8 HB1 HIS 8 46.563 -36.796 36.849 51 HD1 HIS 8 HD1 HIS 8 47.546 -40.320 37.473 52 HD2 HIS 8 HD2 HIS 8 44.601 -37.660 38.702 53 HE1 HIS 8 HE1 HIS 8 45.798 -41.729 38.605 54 HE2 HIS 8 HE2 HIS 8 43.997 -40.103 39.357 55 H HIS 9 H HIS 9 50.127 -37.983 34.578 56 HA HIS 9 HA HIS 9 50.472 -35.213 34.273 57 HB2 HIS 9 HB2 HIS 9 51.423 -37.649 32.838 58 HB3 HIS 9 HB1 HIS 9 51.601 -36.093 32.021 59 HD1 HIS 9 HD1 HIS 9 52.650 -34.193 33.937 60 HD2 HIS 9 HD2 HIS 9 53.729 -38.200 34.136 61 HE1 HIS 9 HE1 HIS 9 54.809 -34.246 35.227 62 HE2 HIS 9 HE2 HIS 9 55.469 -36.694 35.348 63 H HIS 10 H HIS 10 49.595 -33.732 32.942 64 HA HIS 10 HA HIS 10 47.700 -34.675 30.895 65 HB2 HIS 10 HB2 HIS 10 46.340 -32.622 31.403 66 HB3 HIS 10 HB1 HIS 10 46.357 -33.835 32.686 67 HD1 HIS 10 HD1 HIS 10 47.562 -33.244 34.892 68 HD2 HIS 10 HD2 HIS 10 47.604 -30.198 32.066 69 HE1 HIS 10 HE1 HIS 10 48.319 -31.189 36.130 70 HE2 HIS 10 HE2 HIS 10 48.345 -29.328 34.403 71 H SER 11 H SER 11 48.080 -33.933 28.914 72 HA SER 11 HA SER 11 49.933 -31.667 28.616 73 HB2 SER 11 HB2 SER 11 49.282 -33.620 26.415 74 HB3 SER 11 HB1 SER 11 50.726 -32.615 26.623 75 HG SER 11 HG SER 11 50.583 -35.078 27.257 76 H SER 12 H SER 12 49.109 -29.817 27.925 77 HA SER 12 HA SER 12 46.405 -29.687 26.934 78 HB2 SER 12 HB2 SER 12 46.619 -27.308 27.091 79 HB3 SER 12 HB1 SER 12 47.442 -27.993 28.503 80 HG SER 12 HG SER 12 48.891 -26.582 27.732 81 H GLY 13 H GLY 13 45.874 -28.405 24.971 82 HA2 GLY 13 HA2 GLY 13 47.619 -27.794 22.915 83 HA3 GLY 13 3HA GLY 13 47.224 -29.494 22.711 84 H LEU 14 H LEU 14 46.505 -26.669 21.463 85 HA LEU 14 HA LEU 14 43.972 -27.529 20.452 86 HB2 LEU 14 HB2 LEU 14 43.562 -26.424 22.766 87 HB3 LEU 14 HB1 LEU 14 43.886 -24.911 21.902 88 HG LEU 14 HG LEU 14 41.797 -26.789 20.874 89 HD11 LEU 14 HD11 LEU 14 41.526 -24.889 23.188 90 HD12 LEU 14 HD12 LEU 14 41.127 -26.605 23.133 91 HD13 LEU 14 HD13 LEU 14 40.154 -25.444 22.230 92 HD21 LEU 14 HD21 LEU 14 40.827 -24.395 20.409 93 HD22 LEU 14 HD22 LEU 14 42.072 -25.083 19.366 94 HD23 LEU 14 HD23 LEU 14 42.511 -23.909 20.607 95 H VAL 15 H VAL 15 44.068 -27.008 18.379 96 HA VAL 15 HA VAL 15 45.230 -24.410 17.624 97 HB VAL 15 HB VAL 15 45.989 -25.602 15.485 98 HG11 VAL 15 HG11 VAL 15 47.596 -24.767 17.038 99 HG12 VAL 15 HG12 VAL 15 47.309 -26.110 18.146 100 HG13 VAL 15 HG13 VAL 15 48.088 -26.399 16.589 101 HG21 VAL 15 HG21 VAL 15 46.224 -28.080 17.091 102 HG22 VAL 15 HG22 VAL 15 44.643 -27.716 16.399 103 HG23 VAL 15 HG23 VAL 15 46.050 -27.870 15.348 104 HA PRO 16 HA PRO 16 41.622 -23.726 15.219 105 HB2 PRO 16 HB2 PRO 16 42.628 -22.281 13.122 106 HB3 PRO 16 HB1 PRO 16 42.464 -21.640 14.756 107 HG2 PRO 16 HG1 PRO 16 44.873 -22.810 13.406 108 HG3 PRO 16 HG2 PRO 16 44.740 -21.315 14.405 109 HD2 PRO 16 HD1 PRO 16 45.733 -23.646 15.379 110 HD3 PRO 16 HD2 PRO 16 44.808 -22.510 16.375 111 H ARG 17 H ARG 17 40.884 -25.666 14.438 112 HA ARG 17 HA ARG 17 41.961 -26.523 11.832 113 HB2 ARG 17 HB2 ARG 17 42.516 -28.203 13.446 114 HB3 ARG 17 HB1 ARG 17 40.870 -28.194 14.097 115 HG2 ARG 17 HG1 ARG 17 40.005 -29.404 12.342 116 HG3 ARG 17 HG2 ARG 17 41.291 -28.898 11.233 117 HD2 ARG 17 HD1 ARG 17 42.622 -30.616 11.797 118 HD3 ARG 17 HD2 ARG 17 42.287 -30.404 13.522 119 HE ARG 17 HE ARG 17 41.091 -32.304 11.790 120 HH11 ARG 17 1HH1 ARG 17 40.413 -30.234 14.505 121 HH12 ARG 17 2HH1 ARG 17 39.145 -31.239 15.122 122 HH21 ARG 17 1HH2 ARG 17 39.423 -33.637 12.592 123 HH22 ARG 17 2HH2 ARG 17 38.583 -33.176 14.034 124 H GLY 18 H GLY 18 40.552 -25.715 10.386 125 HA2 GLY 18 HA2 GLY 18 37.930 -26.812 10.222 126 HA3 GLY 18 3HA GLY 18 37.872 -25.137 10.750 127 H SER 19 H SER 19 36.620 -24.960 8.702 128 HA SER 19 HA SER 19 38.416 -24.111 6.573 129 HB2 SER 19 HB2 SER 19 36.245 -26.190 6.210 130 HB3 SER 19 HB1 SER 19 36.948 -25.278 4.864 131 HG SER 19 HG SER 19 37.961 -27.405 6.204 132 H HIS 20 H HIS 20 37.732 -22.296 5.597 133 HA HIS 20 HA HIS 20 34.909 -21.549 5.761 134 HB2 HIS 20 HB2 HIS 20 35.482 -19.269 6.513 135 HB3 HIS 20 HB1 HIS 20 35.911 -20.494 7.710 136 HD1 HIS 20 HD1 HIS 20 37.337 -17.738 5.795 137 HD2 HIS 20 HD2 HIS 20 38.763 -21.095 7.783 138 HE1 HIS 20 HE1 HIS 20 39.798 -17.335 6.113 139 HE2 HIS 20 HE2 HIS 20 40.672 -19.386 7.327 140 H MET 21 H MET 21 34.177 -20.397 4.035 141 HA MET 21 HA MET 21 34.123 -19.563 1.920 142 HB2 MET 21 HB2 MET 21 36.932 -18.587 2.475 143 HB3 MET 21 HB1 MET 21 35.770 -17.921 1.317 144 HG2 MET 21 HG1 MET 21 35.405 -17.914 4.315 145 HG3 MET 21 HG2 MET 21 36.016 -16.560 3.359 146 HE1 MET 21 HE1 MET 21 34.084 -16.275 5.295 147 HE2 MET 21 HE2 MET 21 33.115 -15.061 4.459 148 HE3 MET 21 HE3 MET 21 32.370 -16.570 4.992 149 H ILE 22 H ILE 22 34.545 -22.150 1.816 150 HA ILE 22 HA ILE 22 36.936 -22.709 0.241 151 HB ILE 22 HB ILE 22 36.123 -24.265 2.064 152 HG12 ILE 22 HG11 ILE 22 36.583 -26.317 0.732 153 HG13 ILE 22 HG12 ILE 22 36.457 -25.345 -0.743 154 HG21 ILE 22 HG21 ILE 22 33.712 -24.063 1.368 155 HG22 ILE 22 HG22 ILE 22 34.096 -25.123 0.013 156 HG23 ILE 22 HG23 ILE 22 34.281 -25.706 1.668 157 HD11 ILE 22 HD11 ILE 22 38.449 -24.280 -0.391 158 HD12 ILE 22 HD12 ILE 22 38.386 -24.503 1.357 159 HD13 ILE 22 HD13 ILE 22 38.788 -25.863 0.308 160 H SER 23 H SER 23 36.883 -23.544 -1.859 161 HA SER 23 HA SER 23 35.094 -22.393 -3.636 162 HB2 SER 23 HB2 SER 23 37.261 -23.181 -4.380 163 HB3 SER 23 HB1 SER 23 36.824 -24.853 -3.985 164 HG SER 23 HG SER 23 35.614 -24.983 -5.738 165 H LEU 24 H LEU 24 34.826 -25.325 -1.811 166 HA LEU 24 HA LEU 24 32.423 -26.097 -3.316 167 HB2 LEU 24 HB2 LEU 24 34.367 -27.722 -2.888 168 HB3 LEU 24 HB1 LEU 24 33.783 -27.754 -1.215 169 HG LEU 24 HG LEU 24 31.505 -28.409 -2.333 170 HD11 LEU 24 HD11 LEU 24 32.314 -28.050 -4.633 171 HD12 LEU 24 HD12 LEU 24 31.755 -29.699 -4.359 172 HD13 LEU 24 HD13 LEU 24 33.484 -29.350 -4.404 173 HD21 LEU 24 HD21 LEU 24 33.651 -30.503 -2.332 174 HD22 LEU 24 HD22 LEU 24 31.961 -30.643 -1.844 175 HD23 LEU 24 HD23 LEU 24 33.101 -29.751 -0.835 176 H SER 25 H SER 25 32.011 -23.917 -1.796 177 HA SER 25 HA SER 25 31.188 -24.487 0.868 178 HB2 SER 25 HB2 SER 25 31.730 -22.229 0.441 179 HB3 SER 25 HB1 SER 25 30.711 -22.176 -1.007 180 HG SER 25 HG SER 25 30.015 -21.404 1.359 181 H GLY 26 H GLY 26 29.350 -25.344 1.598 182 HA2 GLY 26 HA2 GLY 26 26.946 -25.239 -0.076 183 HA3 GLY 26 3HA GLY 26 27.545 -26.821 0.403 184 H LEU 27 H LEU 27 27.011 -23.688 2.027 185 HA LEU 27 HA LEU 27 25.876 -25.143 4.302 186 HB2 LEU 27 HB2 LEU 27 26.136 -23.046 5.540 187 HB3 LEU 27 HB1 LEU 27 27.661 -23.597 4.823 188 HG LEU 27 HG LEU 27 26.905 -21.913 2.898 189 HD11 LEU 27 HD11 LEU 27 25.089 -20.761 3.478 190 HD12 LEU 27 HD12 LEU 27 26.128 -19.917 4.626 191 HD13 LEU 27 HD13 LEU 27 25.175 -21.304 5.155 192 HD21 LEU 27 HD21 LEU 27 29.018 -21.880 4.147 193 HD22 LEU 27 HD22 LEU 27 28.207 -21.061 5.483 194 HD23 LEU 27 HD23 LEU 27 28.361 -20.258 3.919 195 H THR 28 H THR 28 24.289 -23.245 5.444 196 HA THR 28 HA THR 28 21.822 -23.597 4.339 197 HB THR 28 HB THR 28 20.989 -21.829 5.705 198 HG1 THR 28 HG1 THR 28 22.077 -20.024 5.761 199 HG21 THR 28 HG21 THR 28 22.035 -23.827 6.848 200 HG22 THR 28 HG22 THR 28 21.887 -22.376 7.840 201 HG23 THR 28 HG23 THR 28 23.447 -22.814 7.145 202 H SER 29 H SER 29 21.229 -23.191 2.308 203 HA SER 29 HA SER 29 22.346 -21.391 0.540 204 HB2 SER 29 HB2 SER 29 20.845 -23.194 -0.167 205 HB3 SER 29 HB1 SER 29 19.481 -22.371 0.609 206 HG SER 29 HG SER 29 19.403 -21.788 -1.511 207 H SER 30 H SER 30 21.217 -19.484 -0.476 208 HA SER 30 HA SER 30 19.788 -17.853 1.504 209 HB2 SER 30 HB2 SER 30 22.308 -17.359 1.410 210 HB3 SER 30 HB1 SER 30 21.989 -16.693 -0.201 211 HG SER 30 HG SER 30 21.840 -15.324 1.897 212 H VAL 31 H VAL 31 19.464 -15.551 0.134 213 HA VAL 31 HA VAL 31 17.833 -14.708 -1.265 214 HB VAL 31 HB VAL 31 18.502 -14.821 -3.638 215 HG11 VAL 31 HG11 VAL 31 19.576 -13.241 -2.073 216 HG12 VAL 31 HG12 VAL 31 20.851 -14.428 -1.788 217 HG13 VAL 31 HG13 VAL 31 20.641 -13.725 -3.393 218 HG21 VAL 31 HG21 VAL 31 20.317 -16.145 -4.396 219 HG22 VAL 31 HG22 VAL 31 20.735 -16.637 -2.754 220 HG23 VAL 31 HG23 VAL 31 19.249 -17.226 -3.500 221 H GLU 32 H GLU 32 16.856 -17.048 -0.184 222 HA GLU 32 HA GLU 32 15.972 -18.897 -2.157 223 HB2 GLU 32 HB2 GLU 32 14.553 -19.816 -0.423 224 HB3 GLU 32 HB1 GLU 32 16.155 -19.459 0.243 225 HG2 GLU 32 HG1 GLU 32 15.096 -17.212 0.975 226 HG3 GLU 32 HG2 GLU 32 13.562 -18.057 0.724 227 HE2 GLU 32 HE2 GLU 32 14.876 -20.410 3.283 228 H SER 33 H SER 33 14.768 -15.871 -0.951 229 HA SER 33 HA SER 33 12.506 -16.074 -2.818 230 HB2 SER 33 HB2 SER 33 12.427 -14.965 0.005 231 HB3 SER 33 HB1 SER 33 11.121 -14.789 -1.181 232 HG SER 33 HG SER 33 11.614 -16.852 0.432 233 H ASP 34 H ASP 34 15.278 -14.716 -2.591 234 HA ASP 34 HA ASP 34 14.546 -11.910 -2.800 235 HB2 ASP 34 HB2 ASP 34 16.575 -12.310 -1.617 236 HB3 ASP 34 HB1 ASP 34 17.187 -13.367 -2.896 237 HD2 ASP 34 HD2 ASP 34 17.312 -9.453 -3.582 238 H LEU 35 H LEU 35 15.241 -14.611 -4.849 239 HA LEU 35 HA LEU 35 15.577 -12.923 -7.203 240 HB2 LEU 35 HB2 LEU 35 16.081 -15.750 -6.510 241 HB3 LEU 35 HB1 LEU 35 15.547 -15.445 -8.172 242 HG LEU 35 HG LEU 35 17.513 -13.616 -7.982 243 HD11 LEU 35 HD11 LEU 35 17.890 -14.708 -5.613 244 HD12 LEU 35 HD12 LEU 35 19.247 -14.198 -6.616 245 HD13 LEU 35 HD13 LEU 35 18.783 -15.898 -6.561 246 HD21 LEU 35 HD21 LEU 35 18.978 -15.447 -9.004 247 HD22 LEU 35 HD22 LEU 35 17.451 -15.080 -9.807 248 HD23 LEU 35 HD23 LEU 35 17.587 -16.509 -8.781 249 H ASP 36 H ASP 36 13.008 -13.463 -5.561 250 HA ASP 36 HA ASP 36 11.254 -14.726 -7.463 251 HB2 ASP 36 HB2 ASP 36 11.089 -14.517 -4.820 252 HB3 ASP 36 HB1 ASP 36 10.202 -13.042 -5.234 253 HD2 ASP 36 HD2 ASP 36 8.522 -16.325 -6.691 254 H MET 37 H MET 37 12.278 -11.491 -6.707 255 HA MET 37 HA MET 37 10.170 -10.063 -7.906 256 HB2 MET 37 HB2 MET 37 13.083 -9.279 -7.643 257 HB3 MET 37 HB1 MET 37 11.740 -8.177 -7.982 258 HG2 MET 37 HG1 MET 37 10.799 -8.501 -5.821 259 HG3 MET 37 HG2 MET 37 11.899 -9.841 -5.488 260 HE1 MET 37 HE1 MET 37 14.955 -9.019 -4.844 261 HE2 MET 37 HE2 MET 37 14.222 -8.444 -3.346 262 HE3 MET 37 HE3 MET 37 13.512 -9.810 -4.206 263 H GLN 38 H GLN 38 12.734 -11.900 -9.247 264 HA GLN 38 HA GLN 38 13.234 -10.681 -11.670 265 HB2 GLN 38 HB2 GLN 38 14.050 -12.970 -10.540 266 HB3 GLN 38 HB1 GLN 38 12.893 -13.631 -11.704 267 HG2 GLN 38 HG1 GLN 38 15.078 -13.645 -12.689 268 HG3 GLN 38 HG2 GLN 38 14.075 -12.442 -13.512 269 HE21 GLN 38 HE21 GLN 38 16.654 -12.891 -11.185 270 HE22 GLN 38 HE22 GLN 38 17.319 -11.304 -11.330 271 H GLN 39 H GLN 39 10.451 -12.568 -10.680 272 HA GLN 39 HA GLN 39 9.298 -13.066 -13.168 273 HB2 GLN 39 HB2 GLN 39 7.251 -13.459 -12.020 274 HB3 GLN 39 HB1 GLN 39 8.555 -13.984 -10.942 275 HG2 GLN 39 HG1 GLN 39 8.385 -11.770 -9.783 276 HG3 GLN 39 HG2 GLN 39 6.940 -11.457 -10.752 277 HE21 GLN 39 HE21 GLN 39 8.237 -13.069 -8.036 278 HE22 GLN 39 HE22 GLN 39 6.777 -13.812 -7.491 279 H ALA 40 H ALA 40 9.315 -10.172 -11.196 280 HA ALA 40 HA ALA 40 7.260 -8.767 -12.521 281 HB1 ALA 40 HB1 ALA 40 8.454 -8.245 -10.290 282 HB2 ALA 40 HB2 ALA 40 7.921 -6.905 -11.307 283 HB3 ALA 40 HB3 ALA 40 9.618 -7.388 -11.299 284 H MET 41 H MET 41 10.682 -9.169 -13.196 285 HA MET 41 HA MET 41 11.095 -7.126 -15.022 286 HB2 MET 41 HB2 MET 41 12.231 -9.933 -15.053 287 HB3 MET 41 HB1 MET 41 12.871 -8.565 -15.977 288 HG2 MET 41 HG1 MET 41 12.709 -8.694 -12.964 289 HG3 MET 41 HG2 MET 41 14.150 -9.021 -13.930 290 HE1 MET 41 HE1 MET 41 14.847 -5.534 -15.576 291 HE2 MET 41 HE2 MET 41 15.283 -7.242 -15.518 292 HE3 MET 41 HE3 MET 41 13.763 -6.743 -16.263 293 H LEU 42 H LEU 42 9.934 -10.432 -15.638 294 HA LEU 42 HA LEU 42 9.630 -10.161 -18.417 295 HB2 LEU 42 HB2 LEU 42 8.608 -12.008 -16.322 296 HB3 LEU 42 HB1 LEU 42 7.770 -11.993 -17.884 297 HG LEU 42 HG LEU 42 9.912 -12.528 -19.003 298 HD11 LEU 42 HD11 LEU 42 11.378 -11.557 -17.259 299 HD12 LEU 42 HD12 LEU 42 11.833 -13.195 -17.724 300 HD13 LEU 42 HD13 LEU 42 10.975 -12.915 -16.209 301 HD21 LEU 42 HD21 LEU 42 8.188 -14.217 -17.960 302 HD22 LEU 42 HD22 LEU 42 9.545 -14.606 -16.901 303 HD23 LEU 42 HD23 LEU 42 9.711 -14.782 -18.649 304 H THR 43 H THR 43 7.817 -8.875 -15.829 305 HA THR 43 HA THR 43 5.755 -7.973 -17.725 306 HB THR 43 HB THR 43 4.642 -9.638 -16.423 307 HG1 THR 43 HG1 THR 43 3.173 -8.225 -15.180 308 HG21 THR 43 HG21 THR 43 4.740 -8.694 -13.770 309 HG22 THR 43 HG22 THR 43 6.406 -8.741 -14.346 310 HG23 THR 43 HG23 THR 43 5.411 -10.195 -14.407 311 H ASN 44 H ASN 44 7.505 -6.208 -17.657 312 HA ASN 44 HA ASN 44 7.655 -4.540 -15.353 313 HB2 ASN 44 HB2 ASN 44 9.180 -4.788 -17.566 314 HB3 ASN 44 HB1 ASN 44 8.228 -3.368 -18.015 315 HD21 ASN 44 HD21 ASN 44 10.048 -2.045 -17.938 316 HD22 ASN 44 HD22 ASN 44 10.749 -1.542 -16.442 317 H LYS 45 H LYS 45 7.295 -1.989 -16.161 318 HA LYS 45 HA LYS 45 4.385 -1.859 -16.541 319 HB2 LYS 45 HB2 LYS 45 6.375 -0.025 -15.213 320 HB3 LYS 45 HB1 LYS 45 4.753 0.532 -15.654 321 HG2 LYS 45 HG1 LYS 45 4.599 -0.086 -13.395 322 HG3 LYS 45 HG2 LYS 45 3.864 -1.418 -14.303 323 HD2 LYS 45 HD1 LYS 45 6.699 -1.861 -14.008 324 HD3 LYS 45 HD2 LYS 45 5.946 -1.573 -12.430 325 HE2 LYS 45 HE1 LYS 45 4.410 -3.366 -12.718 326 HE3 LYS 45 HE2 LYS 45 4.818 -3.515 -14.434 327 HZ1 LYS 45 3HZ LYS 45 6.084 -5.187 -13.629 328 HZ2 LYS 45 1HZ LYS 45 6.258 -4.492 -12.096 329 HZ3 LYS 45 2HZ LYS 45 7.199 -3.939 -13.387 330 H ASP 46 H ASP 46 3.611 0.183 -17.652 331 HA ASP 46 HA ASP 46 5.356 0.799 -19.947 332 HB2 ASP 46 HB2 ASP 46 2.818 -0.452 -19.948 333 HB3 ASP 46 HB1 ASP 46 2.578 1.183 -20.581 334 HD2 ASP 46 HD2 ASP 46 4.809 -1.317 -22.704 335 H GLU 47 H GLU 47 4.789 2.878 -21.038 336 HA GLU 47 HA GLU 47 4.755 4.980 -19.120 337 HB2 GLU 47 HB2 GLU 47 4.789 6.480 -21.100 338 HB3 GLU 47 HB1 GLU 47 6.048 5.236 -21.138 339 HG2 GLU 47 HG1 GLU 47 4.086 3.968 -22.494 340 HG3 GLU 47 HG2 GLU 47 3.746 5.652 -22.918 341 HE2 GLU 47 HE2 GLU 47 7.042 5.863 -24.378 342 H LYS 48 H LYS 48 2.423 3.796 -21.508 343 HA LYS 48 HA LYS 48 0.466 5.773 -21.122 344 HB2 LYS 48 HB2 LYS 48 -1.118 4.014 -22.023 345 HB3 LYS 48 HB1 LYS 48 0.279 4.394 -23.043 346 HG2 LYS 48 HG1 LYS 48 0.248 2.103 -23.165 347 HG3 LYS 48 HG2 LYS 48 1.376 2.371 -21.824 348 HD2 LYS 48 HD1 LYS 48 0.026 1.376 -20.337 349 HD3 LYS 48 HD2 LYS 48 -1.399 2.236 -20.947 350 HE2 LYS 48 HE1 LYS 48 -1.729 -0.133 -21.266 351 HE3 LYS 48 HE2 LYS 48 -1.502 0.641 -22.842 352 HZ1 LYS 48 3HZ LYS 48 0.839 -0.064 -22.772 353 HZ2 LYS 48 1HZ LYS 48 -0.232 -1.374 -22.748 354 HZ3 LYS 48 2HZ LYS 48 0.541 -0.888 -21.324 355 H VAL 49 H VAL 49 1.247 2.882 -19.330 356 HA VAL 49 HA VAL 49 -1.119 2.548 -17.880 357 HB VAL 49 HB VAL 49 1.738 1.943 -17.124 358 HG11 VAL 49 HG11 VAL 49 0.201 0.306 -15.570 359 HG12 VAL 49 HG12 VAL 49 0.977 1.793 -15.019 360 HG13 VAL 49 HG13 VAL 49 -0.712 1.815 -15.527 361 HG21 VAL 49 HG21 VAL 49 -0.418 0.529 -18.558 362 HG22 VAL 49 HG22 VAL 49 1.332 0.405 -18.731 363 HG23 VAL 49 HG23 VAL 49 0.515 -0.436 -17.414 364 H LEU 50 H LEU 50 1.567 4.756 -17.434 365 HA LEU 50 HA LEU 50 1.050 5.585 -14.813 366 HB2 LEU 50 HB2 LEU 50 2.104 7.320 -17.049 367 HB3 LEU 50 HB1 LEU 50 2.368 7.522 -15.309 368 HG LEU 50 HG LEU 50 3.387 5.135 -16.834 369 HD11 LEU 50 HD11 LEU 50 4.735 7.779 -16.322 370 HD12 LEU 50 HD12 LEU 50 4.390 7.033 -17.882 371 HD13 LEU 50 HD13 LEU 50 5.582 6.309 -16.804 372 HD21 LEU 50 HD21 LEU 50 4.112 6.360 -14.174 373 HD22 LEU 50 HD22 LEU 50 4.931 4.989 -14.922 374 HD23 LEU 50 HD23 LEU 50 3.241 4.848 -14.432 375 H LYS 51 H LYS 51 -0.450 6.451 -17.845 376 HA LYS 51 HA LYS 51 -1.713 8.820 -17.235 377 HB2 LYS 51 HB2 LYS 51 -2.776 6.473 -18.825 378 HB3 LYS 51 HB1 LYS 51 -3.490 8.094 -18.829 379 HG2 LYS 51 HG1 LYS 51 -0.603 7.736 -19.533 380 HG3 LYS 51 HG2 LYS 51 -1.868 7.392 -20.727 381 HD2 LYS 51 HD1 LYS 51 -2.800 9.702 -20.217 382 HD3 LYS 51 HD2 LYS 51 -1.291 9.999 -19.338 383 HE2 LYS 51 HE1 LYS 51 -1.600 9.342 -22.274 384 HE3 LYS 51 HE2 LYS 51 -1.060 10.869 -21.561 385 HZ1 LYS 51 3HZ LYS 51 0.817 9.500 -20.563 386 HZ2 LYS 51 1HZ LYS 51 0.886 9.805 -22.226 387 HZ3 LYS 51 2HZ LYS 51 0.382 8.292 -21.665 388 H ALA 52 H ALA 52 -2.522 5.573 -16.194 389 HA ALA 52 HA ALA 52 -5.083 6.229 -15.120 390 HB1 ALA 52 HB1 ALA 52 -4.398 3.991 -13.774 391 HB2 ALA 52 HB2 ALA 52 -3.316 3.875 -15.163 392 HB3 ALA 52 HB3 ALA 52 -5.059 3.997 -15.409 393 H LEU 53 H LEU 53 -1.830 5.916 -13.754 394 HA LEU 53 HA LEU 53 -2.503 6.237 -11.058 395 HB2 LEU 53 HB2 LEU 53 0.012 7.056 -12.521 396 HB3 LEU 53 HB1 LEU 53 -0.159 6.960 -10.761 397 HG LEU 53 HG LEU 53 -0.388 4.621 -12.652 398 HD11 LEU 53 HD11 LEU 53 1.878 5.349 -12.642 399 HD12 LEU 53 HD12 LEU 53 1.770 3.945 -11.581 400 HD13 LEU 53 HD13 LEU 53 1.863 5.566 -10.892 401 HD21 LEU 53 HD21 LEU 53 -0.950 5.000 -9.802 402 HD22 LEU 53 HD22 LEU 53 0.093 3.626 -10.167 403 HD23 LEU 53 HD23 LEU 53 -1.501 3.747 -10.913 404 H GLU 54 H GLU 54 -2.497 8.487 -13.638 405 HA GLU 54 HA GLU 54 -2.040 10.874 -12.196 406 HB2 GLU 54 HB2 GLU 54 -3.701 10.501 -14.698 407 HB3 GLU 54 HB1 GLU 54 -2.989 12.014 -14.119 408 HG2 GLU 54 HG1 GLU 54 -1.576 9.604 -15.234 409 HG3 GLU 54 HG2 GLU 54 -1.610 11.254 -15.871 410 HE2 GLU 54 HE2 GLU 54 0.683 12.311 -13.369 411 H ARG 55 H ARG 55 -4.968 9.046 -12.945 412 HA ARG 55 HA ARG 55 -6.721 10.977 -11.747 413 HB2 ARG 55 HB2 ARG 55 -7.668 9.682 -13.483 414 HB3 ARG 55 HB1 ARG 55 -7.101 8.167 -12.761 415 HG2 ARG 55 HG1 ARG 55 -9.524 8.473 -12.505 416 HG3 ARG 55 HG2 ARG 55 -8.682 8.388 -10.949 417 HD2 ARG 55 HD1 ARG 55 -9.482 10.380 -10.355 418 HD3 ARG 55 HD2 ARG 55 -8.769 11.111 -11.799 419 HE ARG 55 HE ARG 55 -11.079 9.863 -12.646 420 HH11 ARG 55 1HH1 ARG 55 -10.224 12.378 -10.395 421 HH12 ARG 55 2HH1 ARG 55 -11.723 13.227 -10.574 422 HH21 ARG 55 1HH2 ARG 55 -13.056 10.972 -12.891 423 HH22 ARG 55 2HH2 ARG 55 -13.334 12.426 -11.994 424 H THR 56 H THR 56 -5.107 8.039 -10.731 425 HA THR 56 HA THR 56 -6.565 7.747 -8.288 426 HB THR 56 HB THR 56 -5.063 5.995 -7.734 427 HG1 THR 56 HG1 THR 56 -3.010 6.082 -8.247 428 HG21 THR 56 HG21 THR 56 -6.356 6.083 -10.198 429 HG22 THR 56 HG22 THR 56 -5.771 4.644 -9.365 430 HG23 THR 56 HG23 THR 56 -4.753 5.446 -10.560 431 H ARG 57 H ARG 57 -3.348 9.004 -9.124 432 HA ARG 57 HA ARG 57 -2.429 9.591 -6.577 433 HB2 ARG 57 HB2 ARG 57 -0.884 11.110 -7.593 434 HB3 ARG 57 HB1 ARG 57 -1.113 9.750 -8.701 435 HG2 ARG 57 HG1 ARG 57 -2.444 11.020 -10.176 436 HG3 ARG 57 HG2 ARG 57 -2.637 12.319 -8.986 437 HD2 ARG 57 HD1 ARG 57 -1.040 12.961 -10.724 438 HD3 ARG 57 HD2 ARG 57 -0.257 12.836 -9.143 439 HE ARG 57 HE ARG 57 0.050 10.373 -10.375 440 HH11 ARG 57 1HH1 ARG 57 1.000 13.676 -10.934 441 HH12 ARG 57 2HH1 ARG 57 2.458 13.252 -11.770 442 HH21 ARG 57 1HH2 ARG 57 1.966 9.802 -11.473 443 HH22 ARG 57 2HH2 ARG 57 3.006 11.049 -12.075 444 H GLN 58 H GLN 58 -4.822 11.213 -8.498 445 HA GLN 58 HA GLN 58 -4.813 13.721 -7.228 446 HB2 GLN 58 HB2 GLN 58 -6.900 12.167 -8.743 447 HB3 GLN 58 HB1 GLN 58 -7.278 13.734 -8.009 448 HG2 GLN 58 HG1 GLN 58 -5.031 13.300 -9.972 449 HG3 GLN 58 HG2 GLN 58 -6.659 13.829 -10.420 450 HE21 GLN 58 HE21 GLN 58 -3.748 14.692 -8.692 451 HE22 GLN 58 HE22 GLN 58 -4.049 16.394 -8.643 452 H LEU 59 H LEU 59 -6.511 10.713 -6.490 453 HA LEU 59 HA LEU 59 -7.767 11.926 -4.156 454 HB2 LEU 59 HB2 LEU 59 -7.952 9.045 -5.021 455 HB3 LEU 59 HB1 LEU 59 -9.061 9.954 -3.980 456 HG LEU 59 HG LEU 59 -8.923 11.178 -6.580 457 HD11 LEU 59 HD11 LEU 59 -9.603 8.243 -6.509 458 HD12 LEU 59 HD12 LEU 59 -8.322 9.017 -7.441 459 HD13 LEU 59 HD13 LEU 59 -10.011 9.338 -7.830 460 HD21 LEU 59 HD21 LEU 59 -11.283 11.063 -6.437 461 HD22 LEU 59 HD22 LEU 59 -10.700 11.344 -4.796 462 HD23 LEU 59 HD23 LEU 59 -11.220 9.729 -5.283 463 H ASP 60 H ASP 60 -4.793 11.154 -4.583 464 HA ASP 60 HA ASP 60 -3.068 10.507 -3.247 465 HB2 ASP 60 HB2 ASP 60 -4.469 11.797 -1.548 466 HB3 ASP 60 HB1 ASP 60 -5.061 10.223 -1.000 467 HD2 ASP 60 HD2 ASP 60 -1.221 11.009 -0.325 468 H ILE 61 H ILE 61 -3.196 8.559 -4.644 469 HA ILE 61 HA ILE 61 -3.697 6.175 -2.993 470 HB ILE 61 HB ILE 61 -4.169 6.238 -5.969 471 HG12 ILE 61 HG11 ILE 61 -6.234 6.413 -3.759 472 HG13 ILE 61 HG12 ILE 61 -5.742 7.766 -4.791 473 HG21 ILE 61 HG21 ILE 61 -5.103 4.275 -3.882 474 HG22 ILE 61 HG22 ILE 61 -5.233 4.121 -5.633 475 HG23 ILE 61 HG23 ILE 61 -3.650 4.067 -4.859 476 HD11 ILE 61 HD11 ILE 61 -7.782 5.914 -5.270 477 HD12 ILE 61 HD12 ILE 61 -7.187 7.172 -6.352 478 HD13 ILE 61 HD13 ILE 61 -6.504 5.549 -6.429 479 HA PRO 62 HA PRO 62 0.538 5.335 -3.981 480 HB2 PRO 62 HB2 PRO 62 0.621 2.790 -2.971 481 HB3 PRO 62 HB1 PRO 62 0.619 4.238 -1.964 482 HG2 PRO 62 HG1 PRO 62 -1.667 2.456 -2.736 483 HG3 PRO 62 HG2 PRO 62 -1.248 3.137 -1.121 484 HD2 PRO 62 HD1 PRO 62 -3.198 4.184 -2.693 485 HD3 PRO 62 HD2 PRO 62 -2.187 5.180 -1.631 486 H ASP 63 H ASP 63 1.579 4.500 -5.704 487 HA ASP 63 HA ASP 63 0.111 3.272 -7.794 488 HB2 ASP 63 HB2 ASP 63 3.118 3.472 -7.475 489 HB3 ASP 63 HB1 ASP 63 2.237 3.167 -8.980 490 HD2 ASP 63 HD2 ASP 63 2.987 6.715 -8.786 491 H GLU 64 H GLU 64 1.445 2.002 -4.997 492 HA GLU 64 HA GLU 64 2.277 -0.544 -6.013 493 HB2 GLU 64 HB2 GLU 64 1.510 0.105 -3.164 494 HB3 GLU 64 HB1 GLU 64 2.590 -1.178 -3.732 495 HG2 GLU 64 HG1 GLU 64 3.120 1.791 -3.861 496 HG3 GLU 64 HG2 GLU 64 3.858 0.631 -2.746 497 HE2 GLU 64 HE2 GLU 64 5.292 -0.735 -5.940 498 H LYS 65 H LYS 65 -0.661 0.764 -4.584 499 HA LYS 65 HA LYS 65 -1.968 -1.840 -4.697 500 HB2 LYS 65 HB2 LYS 65 -3.648 -0.960 -3.356 501 HB3 LYS 65 HB1 LYS 65 -2.209 -0.094 -2.794 502 HG2 LYS 65 HG1 LYS 65 -2.829 1.805 -4.280 503 HG3 LYS 65 HG2 LYS 65 -4.334 0.948 -4.654 504 HD2 LYS 65 HD1 LYS 65 -3.428 1.886 -1.922 505 HD3 LYS 65 HD2 LYS 65 -4.724 2.586 -2.908 506 HE2 LYS 65 HE1 LYS 65 -4.655 -0.105 -1.545 507 HE3 LYS 65 HE2 LYS 65 -5.799 1.224 -1.309 508 HZ1 LYS 65 3HZ LYS 65 -5.557 -0.477 -3.730 509 HZ2 LYS 65 1HZ LYS 65 -6.586 0.860 -3.597 510 HZ3 LYS 65 2HZ LYS 65 -6.822 -0.492 -2.609 511 H THR 66 H THR 66 -1.910 1.224 -6.362 512 HA THR 66 HA THR 66 -4.298 0.786 -7.876 513 HB THR 66 HB THR 66 -2.006 2.700 -8.354 514 HG1 THR 66 HG1 THR 66 -3.284 4.161 -7.288 515 HG21 THR 66 HG21 THR 66 -3.538 3.884 -9.846 516 HG22 THR 66 HG22 THR 66 -4.760 2.637 -9.596 517 HG23 THR 66 HG23 THR 66 -3.251 2.240 -10.418 518 H MET 67 H MET 67 -0.912 0.037 -8.286 519 HA MET 67 HA MET 67 -0.717 -0.380 -11.000 520 HB2 MET 67 HB2 MET 67 0.655 -1.362 -8.604 521 HB3 MET 67 HB1 MET 67 0.728 -2.487 -9.968 522 HG2 MET 67 HG1 MET 67 1.420 0.412 -10.324 523 HG3 MET 67 HG2 MET 67 2.596 -0.748 -9.700 524 HE1 MET 67 HE1 MET 67 0.285 -0.691 -13.461 525 HE2 MET 67 HE2 MET 67 0.503 0.586 -12.264 526 HE3 MET 67 HE3 MET 67 1.594 0.478 -13.646 527 HA PRO 68 HA PRO 68 -2.334 -4.900 -10.467 528 HB2 PRO 68 HB2 PRO 68 -3.428 -5.577 -8.048 529 HB3 PRO 68 HB1 PRO 68 -1.715 -5.751 -8.424 530 HG2 PRO 68 HG1 PRO 68 -3.128 -3.540 -6.972 531 HG3 PRO 68 HG2 PRO 68 -1.594 -4.389 -6.543 532 HD2 PRO 68 HD1 PRO 68 -1.636 -1.934 -7.701 533 HD3 PRO 68 HD2 PRO 68 -0.367 -3.124 -8.028 534 H VAL 69 H VAL 69 -3.927 -2.113 -9.237 535 HA VAL 69 HA VAL 69 -6.604 -3.156 -9.485 536 HB VAL 69 HB VAL 69 -5.511 -0.399 -8.966 537 HG11 VAL 69 HG11 VAL 69 -7.381 0.323 -10.021 538 HG12 VAL 69 HG12 VAL 69 -8.227 -1.211 -9.809 539 HG13 VAL 69 HG13 VAL 69 -8.119 -0.069 -8.469 540 HG21 VAL 69 HG21 VAL 69 -5.895 -2.502 -7.288 541 HG22 VAL 69 HG22 VAL 69 -5.918 -0.809 -6.793 542 HG23 VAL 69 HG23 VAL 69 -7.430 -1.650 -7.131 543 H LEU 70 H LEU 70 -4.770 -0.616 -11.197 544 HA LEU 70 HA LEU 70 -6.618 -0.156 -13.227 545 HB2 LEU 70 HB2 LEU 70 -4.888 0.952 -14.408 546 HB3 LEU 70 HB1 LEU 70 -4.598 1.219 -12.679 547 HG LEU 70 HG LEU 70 -3.030 -0.935 -13.084 548 HD11 LEU 70 HD11 LEU 70 -2.406 -1.276 -15.189 549 HD12 LEU 70 HD12 LEU 70 -2.157 0.447 -15.471 550 HD13 LEU 70 HD13 LEU 70 -3.762 -0.256 -15.669 551 HD21 LEU 70 HD21 LEU 70 -1.248 0.966 -13.634 552 HD22 LEU 70 HD22 LEU 70 -1.968 0.776 -12.035 553 HD23 LEU 70 HD23 LEU 70 -2.596 1.995 -13.145 554 H MET 71 H MET 71 -4.044 -2.554 -12.987 555 HA MET 71 HA MET 71 -4.264 -3.507 -15.651 556 HB2 MET 71 HB2 MET 71 -2.774 -5.207 -15.035 557 HB3 MET 71 HB1 MET 71 -2.332 -3.841 -13.998 558 HG2 MET 71 HG1 MET 71 -3.440 -4.804 -12.109 559 HG3 MET 71 HG2 MET 71 -4.142 -6.072 -13.117 560 HE1 MET 71 HE1 MET 71 -2.157 -7.339 -14.862 561 HE2 MET 71 HE2 MET 71 -1.264 -8.473 -13.849 562 HE3 MET 71 HE3 MET 71 -3.010 -8.313 -13.663 563 H LYS 72 H LYS 72 -6.048 -4.089 -12.746 564 HA LYS 72 HA LYS 72 -7.145 -6.608 -13.349 565 HB2 LYS 72 HB2 LYS 72 -7.210 -5.297 -11.143 566 HB3 LYS 72 HB1 LYS 72 -8.605 -4.453 -11.835 567 HG2 LYS 72 HG1 LYS 72 -9.576 -6.140 -10.571 568 HG3 LYS 72 HG2 LYS 72 -9.581 -6.797 -12.218 569 HD2 LYS 72 HD1 LYS 72 -8.846 -8.531 -10.733 570 HD3 LYS 72 HD2 LYS 72 -7.452 -7.985 -11.683 571 HE2 LYS 72 HE1 LYS 72 -6.373 -7.131 -9.883 572 HE3 LYS 72 HE2 LYS 72 -7.876 -6.567 -9.137 573 HZ1 LYS 72 3HZ LYS 72 -8.118 -9.251 -8.980 574 HZ2 LYS 72 1HZ LYS 72 -7.557 -8.254 -7.732 575 HZ3 LYS 72 2HZ LYS 72 -6.456 -9.040 -8.747 576 H LEU 73 H LEU 73 -7.959 -3.383 -14.405 577 HA LEU 73 HA LEU 73 -10.491 -4.157 -15.546 578 HB2 LEU 73 HB2 LEU 73 -9.094 -1.651 -16.354 579 HB3 LEU 73 HB1 LEU 73 -10.811 -1.944 -16.032 580 HG LEU 73 HG LEU 73 -8.637 -1.623 -13.964 581 HD11 LEU 73 HD11 LEU 73 -10.748 0.176 -15.069 582 HD12 LEU 73 HD12 LEU 73 -9.059 0.519 -14.699 583 HD13 LEU 73 HD13 LEU 73 -10.231 0.352 -13.392 584 HD21 LEU 73 HD21 LEU 73 -10.648 -1.566 -12.410 585 HD22 LEU 73 HD22 LEU 73 -10.174 -3.144 -13.041 586 HD23 LEU 73 HD23 LEU 73 -11.556 -2.295 -13.735 587 H LEU 74 H LEU 74 -7.311 -3.195 -16.823 588 HA LEU 74 HA LEU 74 -7.970 -3.623 -19.539 589 HB2 LEU 74 HB2 LEU 74 -5.253 -3.701 -18.213 590 HB3 LEU 74 HB1 LEU 74 -5.571 -3.515 -19.946 591 HG LEU 74 HG LEU 74 -6.942 -1.444 -18.532 592 HD11 LEU 74 HD11 LEU 74 -4.857 -2.180 -16.996 593 HD12 LEU 74 HD12 LEU 74 -5.446 -0.524 -17.124 594 HD13 LEU 74 HD13 LEU 74 -4.060 -1.043 -18.083 595 HD21 LEU 74 HD21 LEU 74 -5.667 -1.786 -20.912 596 HD22 LEU 74 HD22 LEU 74 -4.518 -0.774 -20.038 597 HD23 LEU 74 HD23 LEU 74 -6.182 -0.231 -20.259 598 H GLU 75 H GLU 75 -7.111 -5.755 -16.979 599 HA GLU 75 HA GLU 75 -6.090 -7.890 -18.560 600 HB2 GLU 75 HB2 GLU 75 -6.984 -7.530 -15.742 601 HB3 GLU 75 HB1 GLU 75 -6.935 -9.183 -16.377 602 HG2 GLU 75 HG1 GLU 75 -4.542 -7.502 -16.854 603 HG3 GLU 75 HG2 GLU 75 -4.852 -8.016 -15.190 604 HE2 GLU 75 HE2 GLU 75 -3.607 -11.124 -15.860 605 H GLU 76 H GLU 76 -9.254 -7.357 -17.006 606 HA GLU 76 HA GLU 76 -10.425 -9.631 -18.312 607 HB2 GLU 76 HB2 GLU 76 -11.714 -7.364 -16.774 608 HB3 GLU 76 HB1 GLU 76 -12.528 -8.850 -17.285 609 HG2 GLU 76 HG1 GLU 76 -10.219 -8.666 -15.350 610 HG3 GLU 76 HG2 GLU 76 -11.915 -8.953 -14.940 611 HE2 GLU 76 HE2 GLU 76 -11.748 -12.259 -16.130 612 H ALA 77 H ALA 77 -10.451 -6.137 -18.772 613 HA ALA 77 HA ALA 77 -12.406 -6.169 -20.857 614 HB1 ALA 77 HB1 ALA 77 -11.818 -3.833 -21.181 615 HB2 ALA 77 HB2 ALA 77 -10.400 -4.031 -20.151 616 HB3 ALA 77 HB3 ALA 77 -12.017 -4.189 -19.466 617 H GLY 78 H GLY 78 -9.192 -7.117 -20.742 618 HA2 GLY 78 HA2 GLY 78 -7.984 -8.058 -22.510 619 HA3 GLY 78 3HA GLY 78 -9.095 -7.302 -23.643 620 H GLY 79 H GLY 79 -8.513 -4.782 -21.833 621 HA2 GLY 79 HA2 GLY 79 -6.528 -3.386 -21.623 622 HA3 GLY 79 3HA GLY 79 -5.935 -4.115 -23.109 623 H ASN 80 H ASN 80 -9.110 -2.736 -22.300 624 HA ASN 80 HA ASN 80 -8.807 -0.953 -24.621 625 HB2 ASN 80 HB2 ASN 80 -10.795 -2.770 -24.120 626 HB3 ASN 80 HB1 ASN 80 -11.503 -1.279 -23.486 627 HD21 ASN 80 HD21 ASN 80 -11.230 0.653 -24.980 628 HD22 ASN 80 HD22 ASN 80 -11.554 0.370 -26.653 629 H TRP 81 H TRP 81 -7.975 0.901 -23.816 630 HA TRP 81 HA TRP 81 -8.650 1.983 -21.279 631 HB2 TRP 81 HB2 TRP 81 -7.301 3.190 -23.705 632 HB3 TRP 81 HB1 TRP 81 -7.496 4.048 -22.176 633 HD1 TRP 81 HD1 TRP 81 -5.450 1.271 -23.782 634 HE1 TRP 81 HE1 TRP 81 -3.514 0.641 -22.207 635 HE3 TRP 81 HE3 TRP 81 -6.845 3.964 -19.666 636 HZ2 TRP 81 2HZ TRP 81 -2.688 1.210 -19.568 637 HZ3 TRP 81 3HZ TRP 81 -5.427 3.866 -17.658 638 HH2 TRP 81 HH TRP 81 -3.393 2.517 -17.612 639 H SER 82 H SER 82 -9.950 2.350 -24.496 640 HA SER 82 HA SER 82 -11.343 4.734 -24.256 641 HB2 SER 82 HB2 SER 82 -11.098 3.351 -26.343 642 HB3 SER 82 HB1 SER 82 -12.348 2.272 -25.699 643 HG SER 82 HG SER 82 -13.470 3.692 -26.899 644 H TYR 83 H TYR 83 -12.560 1.449 -23.591 645 HA TYR 83 HA TYR 83 -15.004 2.403 -22.461 646 HB2 TYR 83 HB2 TYR 83 -15.214 0.276 -23.370 647 HB3 TYR 83 HB1 TYR 83 -13.675 -0.272 -22.700 648 HD1 TYR 83 HD2 TYR 83 -13.498 -1.055 -20.405 649 HD2 TYR 83 HD1 TYR 83 -17.228 0.245 -21.986 650 HE1 TYR 83 HE2 TYR 83 -14.661 -2.101 -18.507 651 HE2 TYR 83 HE1 TYR 83 -18.401 -0.796 -20.092 652 HH TYR 83 HH TYR 83 -18.121 -1.694 -18.022 653 H ILE 84 H ILE 84 -11.910 1.327 -21.172 654 HA ILE 84 HA ILE 84 -12.675 1.235 -18.453 655 HB ILE 84 HB ILE 84 -9.975 1.608 -19.741 656 HG12 ILE 84 HG11 ILE 84 -11.093 -0.767 -18.242 657 HG13 ILE 84 HG12 ILE 84 -11.246 -0.577 -19.997 658 HG21 ILE 84 HG21 ILE 84 -10.666 1.249 -16.831 659 HG22 ILE 84 HG22 ILE 84 -9.046 1.059 -17.501 660 HG23 ILE 84 HG23 ILE 84 -9.852 2.626 -17.573 661 HD11 ILE 84 HD11 ILE 84 -9.344 -1.744 -20.074 662 HD12 ILE 84 HD12 ILE 84 -8.580 -0.208 -19.665 663 HD13 ILE 84 HD13 ILE 84 -8.936 -1.380 -18.397 664 H LYS 85 H LYS 85 -11.853 3.833 -20.578 665 HA LYS 85 HA LYS 85 -11.602 5.700 -18.329 666 HB2 LYS 85 HB2 LYS 85 -10.385 7.093 -19.671 667 HB3 LYS 85 HB1 LYS 85 -10.011 5.544 -20.445 668 HG2 LYS 85 HG1 LYS 85 -12.190 6.177 -21.853 669 HG3 LYS 85 HG2 LYS 85 -11.644 7.807 -21.421 670 HD2 LYS 85 HD1 LYS 85 -10.103 5.676 -22.909 671 HD3 LYS 85 HD2 LYS 85 -10.644 7.253 -23.514 672 HE2 LYS 85 HE1 LYS 85 -9.149 7.932 -21.293 673 HE3 LYS 85 HE2 LYS 85 -8.268 6.555 -21.971 674 HZ1 LYS 85 3HZ LYS 85 -8.442 7.769 -24.171 675 HZ2 LYS 85 1HZ LYS 85 -7.390 8.431 -23.023 676 HZ3 LYS 85 2HZ LYS 85 -8.909 9.128 -23.280 677 H LEU 86 H LEU 86 -13.972 4.448 -20.202 678 HA LEU 86 HA LEU 86 -15.474 6.522 -21.205 679 HB2 LEU 86 HB2 LEU 86 -15.853 3.900 -21.061 680 HB3 LEU 86 HB1 LEU 86 -16.893 4.380 -19.709 681 HG LEU 86 HG LEU 86 -18.152 4.076 -21.793 682 HD11 LEU 86 HD11 LEU 86 -18.192 7.010 -21.255 683 HD12 LEU 86 HD12 LEU 86 -18.622 5.882 -19.969 684 HD13 LEU 86 HD13 LEU 86 -19.533 5.887 -21.479 685 HD21 LEU 86 HD21 LEU 86 -16.918 6.538 -22.930 686 HD22 LEU 86 HD22 LEU 86 -17.742 5.207 -23.744 687 HD23 LEU 86 HD23 LEU 86 -16.096 4.991 -23.145 688 H ASP 87 H ASP 87 -15.010 5.575 -17.878 689 HA ASP 87 HA ASP 87 -16.755 7.801 -17.047 690 HB2 ASP 87 HB2 ASP 87 -16.142 5.242 -15.541 691 HB3 ASP 87 HB1 ASP 87 -17.137 6.575 -14.940 692 HD2 ASP 87 HD2 ASP 87 -19.760 5.733 -17.140 693 H ASN 88 H ASN 88 -13.860 7.752 -17.721 694 HA ASN 88 HA ASN 88 -11.956 8.754 -16.981 695 HB2 ASN 88 HB2 ASN 88 -13.886 10.250 -15.897 696 HB3 ASN 88 HB1 ASN 88 -13.192 9.601 -14.405 697 HD21 ASN 88 HD21 ASN 88 -10.631 9.584 -14.606 698 HD22 ASN 88 HD22 ASN 88 -9.967 11.124 -15.021 699 H TYR 89 H TYR 89 -12.209 6.055 -16.511 700 HA TYR 89 HA TYR 89 -11.253 4.343 -15.359 701 HB2 TYR 89 HB2 TYR 89 -9.761 6.559 -13.930 702 HB3 TYR 89 HB1 TYR 89 -9.324 4.848 -13.929 703 HD1 TYR 89 HD2 TYR 89 -10.079 4.485 -16.951 704 HD2 TYR 89 HD1 TYR 89 -7.606 7.234 -14.845 705 HE1 TYR 89 HE2 TYR 89 -8.720 4.803 -18.975 706 HE2 TYR 89 HE1 TYR 89 -6.241 7.561 -16.864 707 HH TYR 89 HH TYR 89 -5.944 7.024 -18.994 708 H THR 90 H THR 90 -13.724 5.474 -14.420 709 HA THR 90 HA THR 90 -13.932 5.904 -11.705 710 HB THR 90 HB THR 90 -15.807 4.641 -13.678 711 HG1 THR 90 HG1 THR 90 -16.998 6.608 -12.887 712 HG21 THR 90 HG21 THR 90 -16.589 3.471 -11.857 713 HG22 THR 90 HG22 THR 90 -17.494 4.973 -11.682 714 HG23 THR 90 HG23 THR 90 -16.052 4.693 -10.706 715 H ALA 91 H ALA 91 -13.514 2.879 -13.430 716 HA ALA 91 HA ALA 91 -14.201 1.024 -11.513 717 HB1 ALA 91 HB1 ALA 91 -12.162 -0.272 -12.577 718 HB2 ALA 91 HB2 ALA 91 -12.229 1.055 -13.737 719 HB3 ALA 91 HB3 ALA 91 -13.641 0.027 -13.490 720 H LEU 92 H LEU 92 -11.280 2.971 -11.743 721 HA LEU 92 HA LEU 92 -9.799 1.624 -9.747 722 HB2 LEU 92 HB2 LEU 92 -8.245 3.333 -9.916 723 HB3 LEU 92 HB1 LEU 92 -9.018 3.324 -11.511 724 HG LEU 92 HG LEU 92 -10.533 5.186 -10.373 725 HD11 LEU 92 HD11 LEU 92 -8.822 4.727 -8.309 726 HD12 LEU 92 HD12 LEU 92 -9.711 6.227 -8.569 727 HD13 LEU 92 HD13 LEU 92 -8.042 6.085 -9.122 728 HD21 LEU 92 HD21 LEU 92 -8.081 6.486 -11.071 729 HD22 LEU 92 HD22 LEU 92 -9.584 6.375 -11.989 730 HD23 LEU 92 HD23 LEU 92 -8.355 5.122 -12.154 731 H VAL 93 H VAL 93 -12.146 4.237 -9.649 732 HA VAL 93 HA VAL 93 -11.717 5.079 -7.001 733 HB VAL 93 HB VAL 93 -14.149 5.193 -8.773 734 HG11 VAL 93 HG11 VAL 93 -13.842 5.980 -5.909 735 HG12 VAL 93 HG12 VAL 93 -14.881 6.931 -6.972 736 HG13 VAL 93 HG13 VAL 93 -15.206 5.215 -6.723 737 HG21 VAL 93 HG21 VAL 93 -11.794 6.747 -8.519 738 HG22 VAL 93 HG22 VAL 93 -13.184 7.029 -9.568 739 HG23 VAL 93 HG23 VAL 93 -13.147 7.724 -7.947 740 H ASP 94 H ASP 94 -14.047 2.741 -8.333 741 HA ASP 94 HA ASP 94 -15.032 1.991 -5.752 742 HB2 ASP 94 HB2 ASP 94 -16.158 1.830 -8.129 743 HB3 ASP 94 HB1 ASP 94 -15.364 0.250 -8.164 744 HD2 ASP 94 HD2 ASP 94 -17.784 0.463 -5.064 745 H ALA 95 H ALA 95 -12.542 0.840 -7.910 746 HA ALA 95 HA ALA 95 -12.154 -1.693 -6.680 747 HB1 ALA 95 HB1 ALA 95 -10.310 -0.033 -8.393 748 HB2 ALA 95 HB2 ALA 95 -11.390 -1.319 -8.933 749 HB3 ALA 95 HB3 ALA 95 -10.005 -1.701 -7.910 750 H ILE 96 H ILE 96 -10.212 1.301 -6.530 751 HA ILE 96 HA ILE 96 -8.432 0.467 -4.560 752 HB ILE 96 HB ILE 96 -9.446 3.251 -5.141 753 HG12 ILE 96 HG11 ILE 96 -8.308 2.083 -7.009 754 HG13 ILE 96 HG12 ILE 96 -7.409 3.497 -6.434 755 HG21 ILE 96 HG21 ILE 96 -6.876 3.387 -4.055 756 HG22 ILE 96 HG22 ILE 96 -8.384 3.907 -3.303 757 HG23 ILE 96 HG23 ILE 96 -7.769 2.279 -3.014 758 HD11 ILE 96 HD11 ILE 96 -5.929 1.616 -6.898 759 HD12 ILE 96 HD12 ILE 96 -5.893 2.066 -5.193 760 HD13 ILE 96 HD13 ILE 96 -6.795 0.641 -5.712 761 H TYR 97 H TYR 97 -11.518 2.192 -4.214 762 HA TYR 97 HA TYR 97 -11.447 2.495 -1.430 763 HB2 TYR 97 HB2 TYR 97 -13.571 2.538 -3.523 764 HB3 TYR 97 HB1 TYR 97 -14.086 2.385 -1.842 765 HD1 TYR 97 HD1 TYR 97 -11.575 4.437 -3.716 766 HD2 TYR 97 HD2 TYR 97 -14.699 4.356 -0.829 767 HE1 TYR 97 HE1 TYR 97 -11.344 6.866 -3.406 768 HE2 TYR 97 HE2 TYR 97 -14.478 6.784 -0.512 769 HH TYR 97 HH TYR 97 -11.845 8.578 -1.835 770 H SER 98 H SER 98 -12.319 -0.214 -3.446 771 HA SER 98 HA SER 98 -13.598 -1.709 -1.359 772 HB2 SER 98 HB2 SER 98 -14.347 -2.317 -3.489 773 HB3 SER 98 HB1 SER 98 -12.706 -2.325 -4.161 774 HG SER 98 HG SER 98 -14.084 -4.351 -3.045 775 H VAL 99 H VAL 99 -10.504 -2.088 -3.091 776 HA VAL 99 HA VAL 99 -9.507 -4.155 -1.469 777 HB VAL 99 HB VAL 99 -7.825 -2.116 -2.923 778 HG11 VAL 99 HG11 VAL 99 -6.094 -3.412 -2.415 779 HG12 VAL 99 HG12 VAL 99 -7.160 -4.334 -1.352 780 HG13 VAL 99 HG13 VAL 99 -6.921 -4.844 -3.023 781 HG21 VAL 99 HG21 VAL 99 -8.897 -2.760 -4.778 782 HG22 VAL 99 HG22 VAL 99 -8.042 -4.292 -4.590 783 HG23 VAL 99 HG23 VAL 99 -9.680 -4.112 -3.962 784 H GLU 100 H GLU 100 -8.841 -0.655 -1.398 785 HA GLU 100 HA GLU 100 -7.074 -0.569 0.711 786 HB2 GLU 100 HB2 GLU 100 -7.552 1.720 0.917 787 HB3 GLU 100 HB1 GLU 100 -7.905 1.342 -0.777 788 HG2 GLU 100 HG1 GLU 100 -9.740 2.587 -0.263 789 HG3 GLU 100 HG2 GLU 100 -10.333 0.970 0.142 790 HE2 GLU 100 HE2 GLU 100 -11.135 2.249 3.220 791 H ASP 101 H ASP 101 -10.536 -1.012 0.772 792 HA ASP 101 HA ASP 101 -11.123 -0.415 3.413 793 HB2 ASP 101 HB2 ASP 101 -12.622 -1.244 1.401 794 HB3 ASP 101 HB1 ASP 101 -12.371 -2.823 2.155 795 HD2 ASP 101 HD2 ASP 101 -15.294 -1.562 3.741 796 H GLU 102 H GLU 102 -9.959 -3.478 2.040 797 HA GLU 102 HA GLU 102 -9.048 -4.237 4.728 798 HB2 GLU 102 HB2 GLU 102 -10.421 -6.071 2.749 799 HB3 GLU 102 HB1 GLU 102 -9.711 -6.570 4.293 800 HG2 GLU 102 HG1 GLU 102 -11.315 -5.241 5.520 801 HG3 GLU 102 HG2 GLU 102 -11.984 -4.619 4.006 802 HE2 GLU 102 HE2 GLU 102 -13.250 -8.068 5.328 803 H ASN 103 H ASN 103 -6.963 -4.746 4.773 804 HA ASN 103 HA ASN 103 -5.657 -5.497 2.241 805 HB2 ASN 103 HB2 ASN 103 -4.715 -3.819 4.557 806 HB3 ASN 103 HB1 ASN 103 -3.557 -4.597 3.471 807 HD21 ASN 103 HD21 ASN 103 -6.634 -2.876 3.044 808 HD22 ASN 103 HD22 ASN 103 -6.051 -1.788 1.836 809 H LYS 104 H LYS 104 -5.365 -5.872 5.773 810 HA LYS 104 HA LYS 104 -3.928 -8.386 5.374 811 HB2 LYS 104 HB2 LYS 104 -3.361 -8.281 7.704 812 HB3 LYS 104 HB1 LYS 104 -3.076 -6.684 6.993 813 HG2 LYS 104 HG1 LYS 104 -5.102 -5.817 7.953 814 HG3 LYS 104 HG2 LYS 104 -5.550 -7.429 8.538 815 HD2 LYS 104 HD1 LYS 104 -2.995 -6.063 9.379 816 HD3 LYS 104 HD2 LYS 104 -4.529 -5.837 10.240 817 HE2 LYS 104 HE1 LYS 104 -3.639 -8.630 9.679 818 HE3 LYS 104 HE2 LYS 104 -2.794 -7.716 10.937 819 HZ1 LYS 104 3HZ LYS 104 -5.739 -8.069 10.849 820 HZ2 LYS 104 1HZ LYS 104 -4.833 -7.387 12.104 821 HZ3 LYS 104 2HZ LYS 104 -4.694 -9.038 11.763 822 H GLN 105 H GLN 105 -6.979 -7.135 6.521 823 HA GLN 105 HA GLN 105 -7.971 -9.264 7.968 824 HB2 GLN 105 HB2 GLN 105 -9.378 -7.362 6.088 825 HB3 GLN 105 HB1 GLN 105 -10.234 -8.511 7.127 826 HG2 GLN 105 HG1 GLN 105 -10.314 -6.752 8.529 827 HG3 GLN 105 HG2 GLN 105 -8.703 -7.333 8.972 828 HE21 GLN 105 HE21 GLN 105 -7.103 -5.926 8.897 829 HE22 GLN 105 HE22 GLN 105 -7.110 -4.427 8.039 830 H SER 106 H SER 106 -9.465 -10.964 7.381 831 HA SER 106 HA SER 106 -10.013 -12.848 6.228 832 HB2 SER 106 HB2 SER 106 -11.264 -11.400 4.773 833 HB3 SER 106 HB1 SER 106 -9.791 -10.907 3.918 834 HG SER 106 HG SER 106 -11.336 -13.152 3.594 835 H GLU 107 H GLU 107 -7.677 -13.298 7.039 836 HA GLU 107 HA GLU 107 -6.183 -14.325 4.733 837 HB2 GLU 107 HB2 GLU 107 -5.209 -12.464 6.844 838 HB3 GLU 107 HB1 GLU 107 -4.108 -13.742 6.308 839 HG2 GLU 107 HG1 GLU 107 -4.562 -12.948 3.937 840 HG3 GLU 107 HG2 GLU 107 -5.311 -11.528 4.681 841 HE2 GLU 107 HE2 GLU 107 -2.013 -10.394 4.311 842 H GLY 108 H GLY 108 -5.138 -16.271 5.064 843 HA2 GLY 108 HA2 GLY 108 -4.555 -18.237 6.121 844 HA3 GLY 108 3HA GLY 108 -4.824 -17.431 7.660 845 H SER 109 H SER 109 -7.093 -17.191 8.360 846 HA SER 109 HA SER 109 -8.602 -19.602 7.640 847 HB2 SER 109 HB2 SER 109 -7.956 -19.226 10.037 848 HB3 SER 109 HB1 SER 109 -9.000 -17.793 10.035 849 HG SER 109 HG SER 109 -9.845 -20.448 9.483 Start of MODEL 9 1 H1 MET 1 H MET 1 28.721 -63.995 -21.405 2 HA MET 1 HA MET 1 31.534 -63.704 -21.779 3 HB2 MET 1 HB2 MET 1 30.150 -66.185 -22.765 4 HB3 MET 1 HB1 MET 1 31.534 -65.515 -23.643 5 HG2 MET 1 HG1 MET 1 31.766 -66.022 -20.704 6 HG3 MET 1 HG2 MET 1 31.880 -67.365 -21.843 7 HE1 MET 1 HE1 MET 1 35.482 -67.506 -22.177 8 HE2 MET 1 HE2 MET 1 34.681 -67.535 -20.606 9 HE3 MET 1 HE3 MET 1 33.899 -68.266 -22.008 10 H GLY 2 H GLY 2 31.987 -62.489 -23.564 11 HA2 GLY 2 HA2 GLY 2 31.243 -62.068 -25.951 12 HA3 GLY 2 3HA GLY 2 29.666 -61.763 -25.238 13 H SER 3 H SER 3 31.391 -59.997 -26.828 14 HA SER 3 HA SER 3 31.286 -57.704 -25.045 15 HB2 SER 3 HB2 SER 3 33.824 -58.747 -26.294 16 HB3 SER 3 HB1 SER 3 33.626 -57.022 -25.941 17 HG SER 3 HG SER 3 33.514 -57.445 -23.806 18 H SER 4 H SER 4 30.685 -55.882 -26.076 19 HA SER 4 HA SER 4 30.952 -55.717 -28.983 20 HB2 SER 4 HB2 SER 4 28.310 -55.307 -27.545 21 HB3 SER 4 HB1 SER 4 28.603 -55.109 -29.282 22 HG SER 4 HG SER 4 28.227 -57.156 -29.467 23 H HIS 5 H HIS 5 31.158 -53.656 -29.764 24 HA HIS 5 HA HIS 5 31.209 -51.513 -27.744 25 HB2 HIS 5 HB2 HIS 5 32.916 -50.411 -29.103 26 HB3 HIS 5 HB1 HIS 5 33.428 -52.042 -28.652 27 HD1 HIS 5 HD1 HIS 5 34.389 -53.360 -30.501 28 HD2 HIS 5 HD2 HIS 5 31.721 -50.490 -31.883 29 HE1 HIS 5 HE1 HIS 5 34.447 -53.540 -33.009 30 HE2 HIS 5 HE2 HIS 5 32.818 -51.785 -33.855 31 H HIS 6 H HIS 6 30.456 -49.444 -28.323 32 HA HIS 6 HA HIS 6 28.810 -49.353 -30.764 33 HB2 HIS 6 HB2 HIS 6 28.106 -48.410 -27.979 34 HB3 HIS 6 HB1 HIS 6 27.212 -47.913 -29.418 35 HD1 HIS 6 HD1 HIS 6 26.172 -50.006 -30.853 36 HD2 HIS 6 HD2 HIS 6 27.170 -50.722 -26.884 37 HE1 HIS 6 HE1 HIS 6 24.925 -52.094 -30.212 38 HE2 HIS 6 HE2 HIS 6 25.535 -52.533 -27.786 39 H HIS 7 H HIS 7 28.581 -47.321 -31.759 40 HA HIS 7 HA HIS 7 30.251 -45.146 -30.729 41 HB2 HIS 7 HB2 HIS 7 31.113 -44.764 -33.068 42 HB3 HIS 7 HB1 HIS 7 31.737 -46.208 -32.264 43 HD1 HIS 7 HD1 HIS 7 31.046 -48.506 -33.200 44 HD2 HIS 7 HD2 HIS 7 29.452 -45.284 -35.285 45 HE1 HIS 7 HE1 HIS 7 30.119 -49.474 -35.328 46 HE2 HIS 7 HE2 HIS 7 29.143 -47.507 -36.603 47 H HIS 8 H HIS 8 29.066 -43.366 -30.638 48 HA HIS 8 HA HIS 8 26.828 -43.062 -32.527 49 HB2 HIS 8 HB2 HIS 8 27.248 -41.986 -29.733 50 HB3 HIS 8 HB1 HIS 8 25.959 -41.418 -30.797 51 HD1 HIS 8 HD1 HIS 8 24.610 -43.753 -31.874 52 HD2 HIS 8 HD2 HIS 8 26.194 -43.806 -28.033 53 HE1 HIS 8 HE1 HIS 8 23.382 -45.584 -30.666 54 HE2 HIS 8 HE2 HIS 8 24.350 -45.618 -28.317 55 H HIS 9 H HIS 9 26.528 -41.131 -33.618 56 HA HIS 9 HA HIS 9 28.837 -39.301 -33.574 57 HB2 HIS 9 HB2 HIS 9 26.970 -40.033 -35.842 58 HB3 HIS 9 HB1 HIS 9 28.193 -38.761 -35.936 59 HD1 HIS 9 HD1 HIS 9 27.777 -42.114 -36.906 60 HD2 HIS 9 HD2 HIS 9 30.899 -39.999 -35.164 61 HE1 HIS 9 HE1 HIS 9 29.844 -43.471 -37.360 62 HE2 HIS 9 HE2 HIS 9 31.753 -42.180 -36.296 63 H HIS 10 H HIS 10 28.504 -37.115 -33.480 64 HA HIS 10 HA HIS 10 25.933 -36.263 -32.480 65 HB2 HIS 10 HB2 HIS 10 28.275 -35.524 -31.658 66 HB3 HIS 10 HB1 HIS 10 28.252 -34.434 -33.048 67 HD1 HIS 10 HD1 HIS 10 28.109 -33.678 -29.899 68 HD2 HIS 10 HD2 HIS 10 25.026 -33.553 -32.683 69 HE1 HIS 10 HE1 HIS 10 26.443 -32.033 -28.983 70 HE2 HIS 10 HE2 HIS 10 24.557 -31.956 -30.684 71 H SER 11 H SER 11 24.616 -36.523 -34.335 72 HA SER 11 HA SER 11 25.123 -35.401 -36.849 73 HB2 SER 11 HB2 SER 11 22.453 -35.919 -35.501 74 HB3 SER 11 HB1 SER 11 22.693 -35.629 -37.234 75 HG SER 11 HG SER 11 22.632 -37.923 -36.282 76 H SER 12 H SER 12 24.575 -33.465 -37.800 77 HA SER 12 HA SER 12 24.532 -31.184 -36.095 78 HB2 SER 12 HB2 SER 12 25.612 -31.306 -38.381 79 HB3 SER 12 HB1 SER 12 23.979 -31.227 -39.067 80 HG SER 12 HG SER 12 25.394 -29.192 -38.532 81 H GLY 13 H GLY 13 22.909 -29.398 -36.388 82 HA2 GLY 13 HA2 GLY 13 20.642 -28.776 -36.963 83 HA3 GLY 13 3HA GLY 13 20.191 -30.466 -36.801 84 H LEU 14 H LEU 14 18.772 -30.557 -35.181 85 HA LEU 14 HA LEU 14 17.814 -30.307 -33.132 86 HB2 LEU 14 HB2 LEU 14 20.655 -29.995 -32.158 87 HB3 LEU 14 HB1 LEU 14 19.251 -30.547 -31.229 88 HG LEU 14 HG LEU 14 20.190 -32.113 -33.601 89 HD11 LEU 14 HD11 LEU 14 21.906 -33.115 -32.508 90 HD12 LEU 14 HD12 LEU 14 21.195 -32.853 -30.915 91 HD13 LEU 14 HD13 LEU 14 22.005 -31.526 -31.749 92 HD21 LEU 14 HD21 LEU 14 18.395 -32.479 -31.290 93 HD22 LEU 14 HD22 LEU 14 19.382 -33.872 -31.731 94 HD23 LEU 14 HD23 LEU 14 18.302 -33.144 -32.921 95 H VAL 15 H VAL 15 18.042 -27.939 -34.665 96 HA VAL 15 HA VAL 15 19.068 -25.706 -33.416 97 HB VAL 15 HB VAL 15 17.093 -24.470 -34.471 98 HG11 VAL 15 HG11 VAL 15 17.937 -25.249 -36.846 99 HG12 VAL 15 HG12 VAL 15 18.982 -24.340 -35.754 100 HG13 VAL 15 HG13 VAL 15 19.150 -26.091 -35.882 101 HG21 VAL 15 HG21 VAL 15 15.662 -26.585 -34.406 102 HG22 VAL 15 HG22 VAL 15 15.613 -25.622 -35.883 103 HG23 VAL 15 HG23 VAL 15 16.572 -27.100 -35.826 104 HA PRO 16 HA PRO 16 16.769 -24.995 -29.744 105 HB2 PRO 16 HB2 PRO 16 16.669 -22.258 -29.685 106 HB3 PRO 16 HB1 PRO 16 18.136 -23.185 -29.376 107 HG2 PRO 16 HG1 PRO 16 17.221 -21.862 -31.907 108 HG3 PRO 16 HG2 PRO 16 18.851 -21.844 -31.135 109 HD2 PRO 16 HD1 PRO 16 18.250 -23.434 -33.253 110 HD3 PRO 16 HD2 PRO 16 19.381 -23.923 -31.979 111 H ARG 17 H ARG 17 14.868 -23.588 -28.898 112 HA ARG 17 HA ARG 17 12.899 -22.750 -30.788 113 HB2 ARG 17 HB2 ARG 17 11.195 -24.458 -30.183 114 HB3 ARG 17 HB1 ARG 17 12.561 -25.114 -31.098 115 HG2 ARG 17 HG1 ARG 17 12.719 -25.221 -28.131 116 HG3 ARG 17 HG2 ARG 17 11.596 -26.320 -28.949 117 HD2 ARG 17 HD1 ARG 17 13.361 -27.680 -29.200 118 HD3 ARG 17 HD2 ARG 17 13.857 -26.559 -30.476 119 HE ARG 17 HE ARG 17 14.892 -25.458 -28.218 120 HH11 ARG 17 1HH1 ARG 17 15.083 -28.605 -29.694 121 HH12 ARG 17 2HH1 ARG 17 16.670 -28.939 -29.085 122 HH21 ARG 17 1HH2 ARG 17 16.982 -25.885 -27.410 123 HH22 ARG 17 2HH2 ARG 17 17.749 -27.391 -27.785 124 H GLY 18 H GLY 18 10.859 -22.093 -29.708 125 HA2 GLY 18 HA2 GLY 18 11.453 -20.707 -27.279 126 HA3 GLY 18 3HA GLY 18 9.906 -20.727 -28.113 127 H SER 19 H SER 19 11.657 -21.839 -25.440 128 HA SER 19 HA SER 19 9.416 -23.596 -24.691 129 HB2 SER 19 HB2 SER 19 11.156 -24.935 -23.376 130 HB3 SER 19 HB1 SER 19 11.185 -25.113 -25.139 131 HG SER 19 HG SER 19 13.267 -24.751 -24.596 132 H HIS 20 H HIS 20 8.696 -23.453 -22.602 133 HA HIS 20 HA HIS 20 10.007 -21.438 -20.897 134 HB2 HIS 20 HB2 HIS 20 7.827 -20.737 -20.089 135 HB3 HIS 20 HB1 HIS 20 7.887 -20.597 -21.850 136 HD1 HIS 20 HD1 HIS 20 6.212 -22.508 -19.118 137 HD2 HIS 20 HD2 HIS 20 6.209 -22.343 -23.270 138 HE1 HIS 20 HE1 HIS 20 4.210 -23.848 -19.843 139 HE2 HIS 20 HE2 HIS 20 4.207 -23.747 -22.380 140 H MET 21 H MET 21 10.376 -24.335 -20.931 141 HA MET 21 HA MET 21 9.227 -25.049 -18.317 142 HB2 MET 21 HB2 MET 21 9.882 -26.606 -20.759 143 HB3 MET 21 HB1 MET 21 10.183 -27.399 -19.204 144 HG2 MET 21 HG1 MET 21 8.042 -28.081 -19.564 145 HG3 MET 21 HG2 MET 21 7.744 -26.582 -18.680 146 HE1 MET 21 HE1 MET 21 6.636 -28.218 -22.380 147 HE2 MET 21 HE2 MET 21 6.361 -28.586 -20.678 148 HE3 MET 21 HE3 MET 21 5.207 -27.587 -21.563 149 H ILE 22 H ILE 22 10.588 -26.168 -16.800 150 HA ILE 22 HA ILE 22 13.402 -26.382 -17.193 151 HB ILE 22 HB ILE 22 13.184 -23.917 -16.919 152 HG12 ILE 22 HG11 ILE 22 14.920 -23.705 -15.164 153 HG13 ILE 22 HG12 ILE 22 14.620 -25.388 -14.699 154 HG21 ILE 22 HG21 ILE 22 11.238 -24.279 -15.227 155 HG22 ILE 22 HG22 ILE 22 12.537 -24.355 -14.038 156 HG23 ILE 22 HG23 ILE 22 12.331 -22.910 -15.027 157 HD11 ILE 22 HD11 ILE 22 15.171 -25.111 -17.533 158 HD12 ILE 22 HD12 ILE 22 16.489 -24.530 -16.515 159 HD13 ILE 22 HD13 ILE 22 15.896 -26.180 -16.333 160 H SER 23 H SER 23 14.411 -27.531 -15.560 161 HA SER 23 HA SER 23 12.652 -28.999 -13.822 162 HB2 SER 23 HB2 SER 23 14.935 -30.001 -13.055 163 HB3 SER 23 HB1 SER 23 14.351 -30.342 -14.693 164 HG SER 23 HG SER 23 16.394 -28.587 -13.873 165 H LEU 24 H LEU 24 12.173 -26.671 -12.880 166 HA LEU 24 HA LEU 24 14.047 -25.780 -10.882 167 HB2 LEU 24 HB2 LEU 24 11.733 -24.745 -12.187 168 HB3 LEU 24 HB1 LEU 24 11.464 -24.692 -10.436 169 HG LEU 24 HG LEU 24 12.371 -22.584 -11.295 170 HD11 LEU 24 HD11 LEU 24 14.594 -22.773 -9.825 171 HD12 LEU 24 HD12 LEU 24 13.781 -24.246 -9.299 172 HD13 LEU 24 HD13 LEU 24 12.981 -22.685 -9.119 173 HD21 LEU 24 HD21 LEU 24 13.908 -22.602 -12.893 174 HD22 LEU 24 HD22 LEU 24 14.115 -24.345 -12.723 175 HD23 LEU 24 HD23 LEU 24 15.071 -23.243 -11.732 176 H SER 25 H SER 25 10.688 -26.976 -10.703 177 HA SER 25 HA SER 25 11.136 -27.723 -7.915 178 HB2 SER 25 HB2 SER 25 9.100 -26.456 -8.427 179 HB3 SER 25 HB1 SER 25 8.599 -27.716 -9.569 180 HG SER 25 HG SER 25 7.983 -27.639 -7.073 181 H GLY 26 H GLY 26 12.662 -29.337 -9.300 182 HA2 GLY 26 HA2 GLY 26 11.132 -31.860 -9.464 183 HA3 GLY 26 3HA GLY 26 12.426 -31.476 -10.590 184 H LEU 27 H LEU 27 11.760 -31.967 -7.139 185 HA LEU 27 HA LEU 27 13.142 -32.591 -5.418 186 HB2 LEU 27 HB2 LEU 27 14.056 -34.763 -5.687 187 HB3 LEU 27 HB1 LEU 27 12.577 -34.686 -6.660 188 HG LEU 27 HG LEU 27 15.112 -34.104 -8.072 189 HD11 LEU 27 HD11 LEU 27 14.635 -36.594 -6.603 190 HD12 LEU 27 HD12 LEU 27 16.130 -35.927 -7.258 191 HD13 LEU 27 HD13 LEU 27 15.023 -36.809 -8.310 192 HD21 LEU 27 HD21 LEU 27 13.939 -34.743 -9.888 193 HD22 LEU 27 HD22 LEU 27 12.553 -34.419 -8.845 194 HD23 LEU 27 HD23 LEU 27 13.142 -36.070 -9.043 195 H THR 28 H THR 28 14.221 -30.432 -6.922 196 HA THR 28 HA THR 28 17.098 -30.962 -6.574 197 HB THR 28 HB THR 28 17.513 -29.249 -8.362 198 HG1 THR 28 HG1 THR 28 14.859 -29.699 -9.217 199 HG21 THR 28 HG21 THR 28 17.859 -31.049 -9.626 200 HG22 THR 28 HG22 THR 28 16.142 -31.097 -10.025 201 HG23 THR 28 HG23 THR 28 16.747 -31.977 -8.622 202 H SER 29 H SER 29 14.466 -28.629 -6.403 203 HA SER 29 HA SER 29 15.558 -27.356 -4.117 204 HB2 SER 29 HB2 SER 29 16.894 -26.458 -6.212 205 HB3 SER 29 HB1 SER 29 15.447 -25.460 -6.431 206 HG SER 29 HG SER 29 17.294 -24.677 -5.022 207 H SER 30 H SER 30 14.045 -26.134 -3.062 208 HA SER 30 HA SER 30 11.338 -26.446 -3.855 209 HB2 SER 30 HB2 SER 30 10.789 -25.165 -1.847 210 HB3 SER 30 HB1 SER 30 12.046 -26.361 -1.487 211 HG SER 30 HG SER 30 13.590 -24.719 -1.590 212 H VAL 31 H VAL 31 9.986 -24.196 -3.377 213 HA VAL 31 HA VAL 31 10.781 -22.482 -5.616 214 HB VAL 31 HB VAL 31 8.465 -21.596 -5.484 215 HG11 VAL 31 HG11 VAL 31 8.381 -24.595 -5.638 216 HG12 VAL 31 HG12 VAL 31 7.469 -23.414 -6.581 217 HG13 VAL 31 HG13 VAL 31 9.198 -23.620 -6.859 218 HG21 VAL 31 HG21 VAL 31 7.011 -22.112 -3.851 219 HG22 VAL 31 HG22 VAL 31 7.523 -23.798 -3.789 220 HG23 VAL 31 HG23 VAL 31 8.453 -22.563 -2.942 221 H GLU 32 H GLU 32 12.212 -22.185 -3.196 222 HA GLU 32 HA GLU 32 11.173 -19.999 -1.677 223 HB2 GLU 32 HB2 GLU 32 13.302 -19.972 -0.554 224 HB3 GLU 32 HB1 GLU 32 12.799 -21.655 -0.780 225 HG2 GLU 32 HG1 GLU 32 14.307 -21.903 -2.659 226 HG3 GLU 32 HG2 GLU 32 14.767 -20.200 -2.530 227 HE2 GLU 32 HE2 GLU 32 17.342 -21.868 -0.755 228 H SER 33 H SER 33 12.976 -20.301 -4.600 229 HA SER 33 HA SER 33 13.493 -17.400 -4.600 230 HB2 SER 33 HB2 SER 33 14.864 -19.425 -6.380 231 HB3 SER 33 HB1 SER 33 15.358 -17.758 -6.032 232 HG SER 33 HG SER 33 16.532 -18.628 -4.527 233 H ASP 34 H ASP 34 11.855 -19.999 -6.137 234 HA ASP 34 HA ASP 34 11.482 -19.040 -8.718 235 HB2 ASP 34 HB2 ASP 34 10.796 -21.288 -7.961 236 HB3 ASP 34 HB1 ASP 34 9.490 -20.557 -7.019 237 HD2 ASP 34 HD2 ASP 34 8.977 -20.077 -10.915 238 H LEU 35 H LEU 35 10.119 -17.961 -5.722 239 HA LEU 35 HA LEU 35 7.830 -16.644 -6.657 240 HB2 LEU 35 HB2 LEU 35 9.554 -16.503 -4.253 241 HB3 LEU 35 HB1 LEU 35 8.546 -15.084 -4.589 242 HG LEU 35 HG LEU 35 6.675 -16.988 -4.796 243 HD11 LEU 35 HD11 LEU 35 7.093 -18.561 -2.858 244 HD12 LEU 35 HD12 LEU 35 8.791 -18.100 -2.975 245 HD13 LEU 35 HD13 LEU 35 7.995 -18.885 -4.339 246 HD21 LEU 35 HD21 LEU 35 6.074 -16.464 -2.475 247 HD22 LEU 35 HD22 LEU 35 6.551 -15.023 -3.373 248 HD23 LEU 35 HD23 LEU 35 7.672 -15.760 -2.227 249 H ASP 36 H ASP 36 11.187 -15.821 -6.848 250 HA ASP 36 HA ASP 36 11.125 -13.072 -7.130 251 HB2 ASP 36 HB2 ASP 36 13.186 -14.463 -7.052 252 HB3 ASP 36 HB1 ASP 36 12.855 -14.986 -8.710 253 HD2 ASP 36 HD2 ASP 36 13.790 -11.878 -10.016 254 H MET 37 H MET 37 10.085 -15.545 -9.347 255 HA MET 37 HA MET 37 10.087 -14.204 -11.762 256 HB2 MET 37 HB2 MET 37 9.373 -16.632 -11.155 257 HB3 MET 37 HB1 MET 37 7.760 -15.925 -10.972 258 HG2 MET 37 HG1 MET 37 8.269 -14.933 -13.359 259 HG3 MET 37 HG2 MET 37 9.400 -16.289 -13.423 260 HE1 MET 37 HE1 MET 37 8.004 -17.116 -15.607 261 HE2 MET 37 HE2 MET 37 6.267 -17.423 -15.570 262 HE3 MET 37 HE3 MET 37 6.876 -15.777 -15.388 263 H GLN 38 H GLN 38 7.995 -13.790 -9.009 264 HA GLN 38 HA GLN 38 5.831 -12.488 -10.173 265 HB2 GLN 38 HB2 GLN 38 7.126 -12.263 -7.463 266 HB3 GLN 38 HB1 GLN 38 5.711 -11.290 -7.893 267 HG2 GLN 38 HG1 GLN 38 4.714 -13.628 -8.586 268 HG3 GLN 38 HG2 GLN 38 5.930 -14.218 -7.444 269 HE21 GLN 38 HE21 GLN 38 5.852 -13.435 -5.261 270 HE22 GLN 38 HE22 GLN 38 4.345 -12.939 -4.577 271 H GLN 39 H GLN 39 9.066 -11.390 -9.636 272 HA GLN 39 HA GLN 39 8.754 -8.638 -9.569 273 HB2 GLN 39 HB2 GLN 39 10.915 -10.427 -10.651 274 HB3 GLN 39 HB1 GLN 39 11.034 -8.666 -10.811 275 HG2 GLN 39 HG1 GLN 39 10.684 -8.549 -8.298 276 HG3 GLN 39 HG2 GLN 39 10.964 -10.296 -8.294 277 HE21 GLN 39 HE21 GLN 39 12.937 -10.571 -10.151 278 HE22 GLN 39 HE22 GLN 39 14.371 -9.774 -9.610 279 H ALA 40 H ALA 40 8.591 -10.848 -12.283 280 HA ALA 40 HA ALA 40 8.749 -8.974 -14.370 281 HB1 ALA 40 HB1 ALA 40 7.745 -10.693 -15.765 282 HB2 ALA 40 HB2 ALA 40 7.258 -11.596 -14.330 283 HB3 ALA 40 HB3 ALA 40 8.970 -11.392 -14.707 284 H MET 41 H MET 41 6.200 -9.762 -12.169 285 HA MET 41 HA MET 41 4.074 -8.680 -13.766 286 HB2 MET 41 HB2 MET 41 4.214 -9.357 -10.819 287 HB3 MET 41 HB1 MET 41 2.739 -8.889 -11.680 288 HG2 MET 41 HG1 MET 41 4.405 -11.283 -12.444 289 HG3 MET 41 HG2 MET 41 3.055 -11.350 -11.309 290 HE1 MET 41 HE1 MET 41 3.161 -12.677 -14.987 291 HE2 MET 41 HE2 MET 41 3.230 -11.078 -15.727 292 HE3 MET 41 HE3 MET 41 4.410 -11.533 -14.498 293 H LEU 42 H LEU 42 5.985 -7.557 -10.997 294 HA LEU 42 HA LEU 42 4.654 -5.069 -10.729 295 HB2 LEU 42 HB2 LEU 42 7.168 -6.287 -9.702 296 HB3 LEU 42 HB1 LEU 42 7.013 -4.523 -9.627 297 HG LEU 42 HG LEU 42 6.378 -5.654 -7.524 298 HD11 LEU 42 HD11 LEU 42 3.886 -4.458 -8.648 299 HD12 LEU 42 HD12 LEU 42 5.339 -3.473 -8.491 300 HD13 LEU 42 HD13 LEU 42 4.628 -4.229 -7.065 301 HD21 LEU 42 HD21 LEU 42 5.456 -7.702 -8.479 302 HD22 LEU 42 HD22 LEU 42 4.119 -6.785 -9.174 303 HD23 LEU 42 HD23 LEU 42 4.287 -6.912 -7.422 304 H THR 43 H THR 43 7.294 -6.189 -12.711 305 HA THR 43 HA THR 43 7.839 -3.462 -13.637 306 HB THR 43 HB THR 43 9.787 -4.846 -13.028 307 HG1 THR 43 HG1 THR 43 10.939 -4.150 -14.743 308 HG21 THR 43 HG21 THR 43 10.222 -6.907 -13.868 309 HG22 THR 43 HG22 THR 43 9.534 -6.525 -15.447 310 HG23 THR 43 HG23 THR 43 8.475 -6.939 -14.099 311 H ASN 44 H ASN 44 5.380 -4.878 -14.334 312 HA ASN 44 HA ASN 44 5.757 -5.353 -17.205 313 HB2 ASN 44 HB2 ASN 44 4.608 -7.123 -15.921 314 HB3 ASN 44 HB1 ASN 44 3.365 -5.958 -15.452 315 HD21 ASN 44 HD21 ASN 44 1.736 -5.493 -16.823 316 HD22 ASN 44 HD22 ASN 44 1.543 -6.211 -18.383 317 H LYS 45 H LYS 45 5.091 -2.852 -15.229 318 HA LYS 45 HA LYS 45 2.803 -1.617 -16.178 319 HB2 LYS 45 HB2 LYS 45 3.517 0.262 -15.092 320 HB3 LYS 45 HB1 LYS 45 4.597 -0.929 -14.348 321 HG2 LYS 45 HG1 LYS 45 5.284 0.904 -16.649 322 HG3 LYS 45 HG2 LYS 45 5.821 1.069 -14.968 323 HD2 LYS 45 HD1 LYS 45 7.145 -0.894 -15.081 324 HD3 LYS 45 HD2 LYS 45 6.396 -1.386 -16.611 325 HE2 LYS 45 HE1 LYS 45 7.953 -0.290 -17.766 326 HE3 LYS 45 HE2 LYS 45 7.506 1.215 -16.949 327 HZ1 LYS 45 3HZ LYS 45 9.170 -0.640 -15.439 328 HZ2 LYS 45 1HZ LYS 45 9.211 1.050 -15.499 329 HZ3 LYS 45 2HZ LYS 45 9.907 0.142 -16.746 330 H ASP 46 H ASP 46 2.870 0.501 -17.502 331 HA ASP 46 HA ASP 46 4.678 0.320 -19.791 332 HB2 ASP 46 HB2 ASP 46 2.264 -0.861 -20.018 333 HB3 ASP 46 HB1 ASP 46 1.829 0.793 -20.471 334 HD2 ASP 46 HD2 ASP 46 4.621 0.089 -22.963 335 H GLU 47 H GLU 47 4.028 2.236 -21.374 336 HA GLU 47 HA GLU 47 4.483 4.619 -19.908 337 HB2 GLU 47 HB2 GLU 47 4.276 5.756 -22.098 338 HB3 GLU 47 HB1 GLU 47 5.376 4.368 -22.144 339 HG2 GLU 47 HG1 GLU 47 3.513 2.999 -23.084 340 HG3 GLU 47 HG2 GLU 47 2.560 4.485 -23.190 341 HE2 GLU 47 HE2 GLU 47 4.303 5.589 -25.968 342 H LYS 48 H LYS 48 1.649 3.288 -21.551 343 HA LYS 48 HA LYS 48 -0.015 5.551 -21.079 344 HB2 LYS 48 HB2 LYS 48 -1.876 3.993 -21.687 345 HB3 LYS 48 HB1 LYS 48 -0.573 4.075 -22.884 346 HG2 LYS 48 HG1 LYS 48 -0.266 1.960 -20.859 347 HG3 LYS 48 HG2 LYS 48 -1.650 1.779 -21.950 348 HD2 LYS 48 HD1 LYS 48 0.555 2.566 -23.545 349 HD3 LYS 48 HD2 LYS 48 1.118 1.280 -22.464 350 HE2 LYS 48 HE1 LYS 48 -0.387 -0.282 -23.303 351 HE3 LYS 48 HE2 LYS 48 -1.477 0.970 -23.916 352 HZ1 LYS 48 3HZ LYS 48 1.227 0.519 -25.042 353 HZ2 LYS 48 1HZ LYS 48 -0.037 1.426 -25.707 354 HZ3 LYS 48 2HZ LYS 48 -0.155 -0.258 -25.634 355 H VAL 49 H VAL 49 0.722 2.627 -19.304 356 HA VAL 49 HA VAL 49 -1.394 2.591 -17.491 357 HB VAL 49 HB VAL 49 1.481 1.792 -17.015 358 HG11 VAL 49 HG11 VAL 49 0.867 1.509 -14.893 359 HG12 VAL 49 HG12 VAL 49 -0.827 1.834 -15.267 360 HG13 VAL 49 HG13 VAL 49 -0.178 0.205 -15.457 361 HG21 VAL 49 HG21 VAL 49 0.800 -0.430 -17.618 362 HG22 VAL 49 HG22 VAL 49 -0.879 0.080 -17.785 363 HG23 VAL 49 HG23 VAL 49 0.338 0.667 -18.918 364 H LEU 50 H LEU 50 1.431 4.625 -17.638 365 HA LEU 50 HA LEU 50 1.372 5.578 -14.975 366 HB2 LEU 50 HB2 LEU 50 2.369 7.072 -17.402 367 HB3 LEU 50 HB1 LEU 50 2.862 7.292 -15.714 368 HG LEU 50 HG LEU 50 3.401 4.783 -17.295 369 HD11 LEU 50 HD11 LEU 50 5.809 6.041 -16.910 370 HD12 LEU 50 HD12 LEU 50 4.733 7.374 -17.329 371 HD13 LEU 50 HD13 LEU 50 4.897 5.998 -18.419 372 HD21 LEU 50 HD21 LEU 50 4.428 5.833 -14.663 373 HD22 LEU 50 HD22 LEU 50 5.082 4.426 -15.503 374 HD23 LEU 50 HD23 LEU 50 3.416 4.413 -14.922 375 H LYS 51 H LYS 51 -0.555 6.247 -17.736 376 HA LYS 51 HA LYS 51 -1.419 8.861 -17.009 377 HB2 LYS 51 HB2 LYS 51 -2.748 6.785 -18.770 378 HB3 LYS 51 HB1 LYS 51 -3.204 8.494 -18.672 379 HG2 LYS 51 HG1 LYS 51 -0.518 8.632 -19.234 380 HG3 LYS 51 HG2 LYS 51 -1.048 7.214 -20.156 381 HD2 LYS 51 HD1 LYS 51 -2.340 9.950 -20.264 382 HD3 LYS 51 HD2 LYS 51 -1.214 9.295 -21.466 383 HE2 LYS 51 HE1 LYS 51 -3.899 8.099 -20.735 384 HE3 LYS 51 HE2 LYS 51 -3.551 9.061 -22.178 385 HZ1 LYS 51 3HZ LYS 51 -3.517 6.675 -22.630 386 HZ2 LYS 51 1HZ LYS 51 -2.260 6.471 -21.517 387 HZ3 LYS 51 2HZ LYS 51 -2.007 7.380 -22.919 388 H ALA 52 H ALA 52 -2.585 5.607 -16.349 389 HA ALA 52 HA ALA 52 -5.075 6.299 -15.238 390 HB1 ALA 52 HB1 ALA 52 -5.123 4.077 -15.520 391 HB2 ALA 52 HB2 ALA 52 -4.401 4.016 -13.911 392 HB3 ALA 52 HB3 ALA 52 -3.375 3.919 -15.343 393 H LEU 53 H LEU 53 -1.871 5.915 -13.784 394 HA LEU 53 HA LEU 53 -2.581 6.144 -11.102 395 HB2 LEU 53 HB2 LEU 53 -0.070 7.287 -12.323 396 HB3 LEU 53 HB1 LEU 53 -0.307 6.700 -10.668 397 HG LEU 53 HG LEU 53 -0.238 5.003 -13.163 398 HD11 LEU 53 HD11 LEU 53 1.928 4.609 -12.768 399 HD12 LEU 53 HD12 LEU 53 1.699 4.543 -11.021 400 HD13 LEU 53 HD13 LEU 53 1.871 6.101 -11.829 401 HD21 LEU 53 HD21 LEU 53 -1.722 3.920 -11.702 402 HD22 LEU 53 HD22 LEU 53 -0.772 4.351 -10.279 403 HD23 LEU 53 HD23 LEU 53 -0.162 3.148 -11.416 404 H GLU 54 H GLU 54 -2.496 8.524 -13.595 405 HA GLU 54 HA GLU 54 -2.129 10.868 -12.139 406 HB2 GLU 54 HB2 GLU 54 -3.951 10.446 -14.521 407 HB3 GLU 54 HB1 GLU 54 -3.320 12.000 -13.953 408 HG2 GLU 54 HG1 GLU 54 -1.337 9.889 -14.596 409 HG3 GLU 54 HG2 GLU 54 -2.205 10.639 -15.943 410 HE2 GLU 54 HE2 GLU 54 -0.798 13.821 -14.915 411 H ARG 55 H ARG 55 -5.186 9.234 -12.964 412 HA ARG 55 HA ARG 55 -6.811 11.003 -11.456 413 HB2 ARG 55 HB2 ARG 55 -7.894 9.825 -13.184 414 HB3 ARG 55 HB1 ARG 55 -7.255 8.269 -12.631 415 HG2 ARG 55 HG1 ARG 55 -9.623 8.438 -12.136 416 HG3 ARG 55 HG2 ARG 55 -8.672 8.390 -10.642 417 HD2 ARG 55 HD1 ARG 55 -9.562 10.321 -9.975 418 HD3 ARG 55 HD2 ARG 55 -8.955 11.108 -11.438 419 HE ARG 55 HE ARG 55 -11.303 9.672 -12.045 420 HH11 ARG 55 1HH1 ARG 55 -10.225 12.523 -10.362 421 HH12 ARG 55 2HH1 ARG 55 -11.713 13.380 -10.592 422 HH21 ARG 55 1HH2 ARG 55 -13.268 10.789 -12.352 423 HH22 ARG 55 2HH2 ARG 55 -13.443 12.392 -11.723 424 H THR 56 H THR 56 -5.116 8.037 -10.709 425 HA THR 56 HA THR 56 -6.426 7.572 -8.211 426 HB THR 56 HB THR 56 -4.912 5.803 -7.865 427 HG1 THR 56 HG1 THR 56 -3.189 7.406 -9.369 428 HG21 THR 56 HG21 THR 56 -6.252 6.038 -10.268 429 HG22 THR 56 HG22 THR 56 -5.539 4.561 -9.620 430 HG23 THR 56 HG23 THR 56 -4.627 5.557 -10.753 431 H ARG 57 H ARG 57 -3.609 9.363 -9.249 432 HA ARG 57 HA ARG 57 -2.428 9.697 -6.693 433 HB2 ARG 57 HB2 ARG 57 -2.169 11.071 -9.347 434 HB3 ARG 57 HB1 ARG 57 -1.409 11.778 -7.914 435 HG2 ARG 57 HG1 ARG 57 0.179 10.168 -7.768 436 HG3 ARG 57 HG2 ARG 57 -0.897 8.909 -8.399 437 HD2 ARG 57 HD1 ARG 57 1.113 9.776 -9.843 438 HD3 ARG 57 HD2 ARG 57 -0.450 9.426 -10.593 439 HE ARG 57 HE ARG 57 -0.616 11.630 -11.140 440 HH11 ARG 57 1HH1 ARG 57 1.633 11.312 -8.502 441 HH12 ARG 57 2HH1 ARG 57 2.074 12.988 -8.504 442 HH21 ARG 57 1HH2 ARG 57 -0.044 13.839 -11.153 443 HH22 ARG 57 2HH2 ARG 57 1.119 14.424 -10.012 444 H GLN 58 H GLN 58 -4.856 11.486 -8.499 445 HA GLN 58 HA GLN 58 -4.917 13.775 -6.841 446 HB2 GLN 58 HB2 GLN 58 -7.172 12.625 -8.499 447 HB3 GLN 58 HB1 GLN 58 -7.025 14.293 -7.924 448 HG2 GLN 58 HG1 GLN 58 -5.660 12.928 -10.177 449 HG3 GLN 58 HG2 GLN 58 -6.304 14.570 -10.056 450 HE21 GLN 58 HE21 GLN 58 -3.556 12.571 -9.720 451 HE22 GLN 58 HE22 GLN 58 -2.430 13.802 -9.270 452 H LEU 59 H LEU 59 -6.563 10.672 -6.715 453 HA LEU 59 HA LEU 59 -8.196 11.494 -4.460 454 HB2 LEU 59 HB2 LEU 59 -7.921 8.705 -5.569 455 HB3 LEU 59 HB1 LEU 59 -9.261 9.392 -4.634 456 HG LEU 59 HG LEU 59 -8.639 10.532 -7.322 457 HD11 LEU 59 HD11 LEU 59 -8.709 8.331 -8.020 458 HD12 LEU 59 HD12 LEU 59 -10.401 8.815 -8.138 459 HD13 LEU 59 HD13 LEU 59 -9.851 7.859 -6.761 460 HD21 LEU 59 HD21 LEU 59 -10.827 10.540 -5.371 461 HD22 LEU 59 HD22 LEU 59 -11.337 10.333 -7.046 462 HD23 LEU 59 HD23 LEU 59 -10.379 11.740 -6.584 463 H ASP 60 H ASP 60 -5.078 10.853 -4.678 464 HA ASP 60 HA ASP 60 -3.466 10.241 -3.193 465 HB2 ASP 60 HB2 ASP 60 -5.603 9.812 -1.109 466 HB3 ASP 60 HB1 ASP 60 -3.927 10.329 -0.883 467 HD2 ASP 60 HD2 ASP 60 -4.696 13.639 -1.683 468 H ILE 61 H ILE 61 -3.352 8.316 -4.585 469 HA ILE 61 HA ILE 61 -3.872 5.898 -3.006 470 HB ILE 61 HB ILE 61 -4.340 5.983 -5.983 471 HG12 ILE 61 HG11 ILE 61 -6.434 5.978 -3.797 472 HG13 ILE 61 HG12 ILE 61 -5.966 7.418 -4.717 473 HG21 ILE 61 HG21 ILE 61 -5.356 3.942 -4.038 474 HG22 ILE 61 HG22 ILE 61 -5.135 3.803 -5.782 475 HG23 ILE 61 HG23 ILE 61 -3.731 3.831 -4.714 476 HD11 ILE 61 HD11 ILE 61 -7.861 5.410 -5.401 477 HD12 ILE 61 HD12 ILE 61 -7.459 6.901 -6.256 478 HD13 ILE 61 HD13 ILE 61 -6.570 5.418 -6.603 479 HA PRO 62 HA PRO 62 0.393 5.211 -3.979 480 HB2 PRO 62 HB2 PRO 62 0.558 2.662 -2.989 481 HB3 PRO 62 HB1 PRO 62 0.502 4.099 -1.970 482 HG2 PRO 62 HG1 PRO 62 -1.718 2.247 -2.768 483 HG3 PRO 62 HG2 PRO 62 -1.331 2.930 -1.145 484 HD2 PRO 62 HD1 PRO 62 -3.308 3.923 -2.718 485 HD3 PRO 62 HD2 PRO 62 -2.337 4.943 -1.645 486 H ASP 63 H ASP 63 1.486 4.402 -5.686 487 HA ASP 63 HA ASP 63 0.074 3.167 -7.810 488 HB2 ASP 63 HB2 ASP 63 3.081 3.314 -7.497 489 HB3 ASP 63 HB1 ASP 63 2.157 3.187 -9.000 490 HD2 ASP 63 HD2 ASP 63 3.083 6.701 -8.067 491 H GLU 64 H GLU 64 1.399 1.894 -5.004 492 HA GLU 64 HA GLU 64 2.270 -0.633 -6.038 493 HB2 GLU 64 HB2 GLU 64 1.498 -0.013 -3.184 494 HB3 GLU 64 HB1 GLU 64 2.591 -1.279 -3.762 495 HG2 GLU 64 HG1 GLU 64 4.174 0.444 -4.526 496 HG3 GLU 64 HG2 GLU 64 3.093 1.686 -3.880 497 HE2 GLU 64 HE2 GLU 64 4.614 -0.610 -1.033 498 H LYS 65 H LYS 65 -0.714 0.682 -4.785 499 HA LYS 65 HA LYS 65 -1.983 -1.958 -4.884 500 HB2 LYS 65 HB2 LYS 65 -3.677 -1.130 -3.518 501 HB3 LYS 65 HB1 LYS 65 -2.233 -0.303 -2.913 502 HG2 LYS 65 HG1 LYS 65 -2.834 1.668 -4.311 503 HG3 LYS 65 HG2 LYS 65 -4.345 0.841 -4.727 504 HD2 LYS 65 HD1 LYS 65 -3.454 1.548 -1.922 505 HD3 LYS 65 HD2 LYS 65 -4.642 2.445 -2.884 506 HE2 LYS 65 HE1 LYS 65 -6.188 1.137 -1.920 507 HE3 LYS 65 HE2 LYS 65 -5.597 -0.125 -3.012 508 HZ1 LYS 65 3HZ LYS 65 -5.667 -0.368 -0.356 509 HZ2 LYS 65 1HZ LYS 65 -4.083 0.190 -0.562 510 HZ3 LYS 65 2HZ LYS 65 -4.592 -1.219 -1.348 511 H THR 66 H THR 66 -1.827 1.074 -6.538 512 HA THR 66 HA THR 66 -4.274 0.787 -7.997 513 HB THR 66 HB THR 66 -1.871 2.523 -8.599 514 HG1 THR 66 HG1 THR 66 -2.615 3.573 -6.919 515 HG21 THR 66 HG21 THR 66 -3.349 2.129 -10.548 516 HG22 THR 66 HG22 THR 66 -3.364 3.808 -10.010 517 HG23 THR 66 HG23 THR 66 -4.709 2.742 -9.608 518 H MET 67 H MET 67 -0.957 -0.200 -8.466 519 HA MET 67 HA MET 67 -0.828 -0.648 -11.173 520 HB2 MET 67 HB2 MET 67 0.548 -1.598 -8.815 521 HB3 MET 67 HB1 MET 67 0.390 -2.896 -10.009 522 HG2 MET 67 HG1 MET 67 1.426 -0.175 -10.760 523 HG3 MET 67 HG2 MET 67 2.476 -1.436 -10.107 524 HE1 MET 67 HE1 MET 67 1.035 -0.863 -14.286 525 HE2 MET 67 HE2 MET 67 -0.330 -1.206 -13.223 526 HE3 MET 67 HE3 MET 67 0.764 0.128 -12.852 527 HA PRO 68 HA PRO 68 -2.811 -5.017 -10.611 528 HB2 PRO 68 HB2 PRO 68 -3.939 -5.593 -8.183 529 HB3 PRO 68 HB1 PRO 68 -2.249 -5.911 -8.570 530 HG2 PRO 68 HG1 PRO 68 -3.462 -3.585 -7.115 531 HG3 PRO 68 HG2 PRO 68 -2.002 -4.557 -6.695 532 HD2 PRO 68 HD1 PRO 68 -1.847 -2.110 -7.862 533 HD3 PRO 68 HD2 PRO 68 -0.683 -3.404 -8.193 534 H VAL 69 H VAL 69 -4.155 -2.100 -9.391 535 HA VAL 69 HA VAL 69 -6.912 -2.916 -9.609 536 HB VAL 69 HB VAL 69 -5.603 -0.243 -9.142 537 HG11 VAL 69 HG11 VAL 69 -8.415 -0.896 -9.828 538 HG12 VAL 69 HG12 VAL 69 -8.134 0.310 -8.571 539 HG13 VAL 69 HG13 VAL 69 -7.466 0.546 -10.187 540 HG21 VAL 69 HG21 VAL 69 -6.087 -2.309 -7.429 541 HG22 VAL 69 HG22 VAL 69 -5.935 -0.617 -6.954 542 HG23 VAL 69 HG23 VAL 69 -7.531 -1.319 -7.219 543 H LEU 70 H LEU 70 -4.766 -0.723 -11.417 544 HA LEU 70 HA LEU 70 -6.665 -0.160 -13.450 545 HB2 LEU 70 HB2 LEU 70 -4.881 0.927 -14.613 546 HB3 LEU 70 HB1 LEU 70 -4.731 1.282 -12.884 547 HG LEU 70 HG LEU 70 -3.076 -0.838 -13.066 548 HD11 LEU 70 HD11 LEU 70 -3.585 -0.751 -15.607 549 HD12 LEU 70 HD12 LEU 70 -1.923 -0.971 -15.061 550 HD13 LEU 70 HD13 LEU 70 -2.470 0.616 -15.605 551 HD21 LEU 70 HD21 LEU 70 -2.534 2.087 -13.506 552 HD22 LEU 70 HD22 LEU 70 -1.246 0.897 -13.320 553 HD23 LEU 70 HD23 LEU 70 -2.399 1.160 -12.011 554 H MET 71 H MET 71 -4.033 -2.493 -13.145 555 HA MET 71 HA MET 71 -4.185 -3.467 -15.806 556 HB2 MET 71 HB2 MET 71 -2.644 -5.100 -15.166 557 HB3 MET 71 HB1 MET 71 -2.279 -3.738 -14.095 558 HG2 MET 71 HG1 MET 71 -2.307 -5.316 -12.496 559 HG3 MET 71 HG2 MET 71 -4.049 -5.047 -12.566 560 HE1 MET 71 HE1 MET 71 -1.771 -7.140 -15.261 561 HE2 MET 71 HE2 MET 71 -1.069 -7.098 -13.644 562 HE3 MET 71 HE3 MET 71 -1.729 -8.605 -14.279 563 H LYS 72 H LYS 72 -6.041 -4.036 -12.959 564 HA LYS 72 HA LYS 72 -7.047 -6.604 -13.564 565 HB2 LYS 72 HB2 LYS 72 -7.265 -5.753 -11.334 566 HB3 LYS 72 HB1 LYS 72 -8.172 -4.344 -11.907 567 HG2 LYS 72 HG1 LYS 72 -10.124 -5.488 -12.116 568 HG3 LYS 72 HG2 LYS 72 -9.307 -7.014 -12.500 569 HD2 LYS 72 HD1 LYS 72 -9.193 -5.769 -9.754 570 HD3 LYS 72 HD2 LYS 72 -10.480 -6.884 -10.247 571 HE2 LYS 72 HE1 LYS 72 -9.074 -8.701 -10.348 572 HE3 LYS 72 HE2 LYS 72 -7.655 -7.705 -10.700 573 HZ1 LYS 72 3HZ LYS 72 -8.793 -8.460 -8.139 574 HZ2 LYS 72 1HZ LYS 72 -8.241 -6.864 -8.247 575 HZ3 LYS 72 2HZ LYS 72 -7.185 -8.147 -8.561 576 H LEU 73 H LEU 73 -7.920 -3.398 -14.625 577 HA LEU 73 HA LEU 73 -10.409 -4.257 -15.818 578 HB2 LEU 73 HB2 LEU 73 -9.095 -1.658 -16.491 579 HB3 LEU 73 HB1 LEU 73 -10.814 -2.041 -16.290 580 HG LEU 73 HG LEU 73 -8.832 -1.815 -14.027 581 HD11 LEU 73 HD11 LEU 73 -9.201 0.334 -15.155 582 HD12 LEU 73 HD12 LEU 73 -9.887 0.310 -13.531 583 HD13 LEU 73 HD13 LEU 73 -10.941 0.140 -14.935 584 HD21 LEU 73 HD21 LEU 73 -10.713 -3.309 -13.565 585 HD22 LEU 73 HD22 LEU 73 -11.841 -2.036 -14.032 586 HD23 LEU 73 HD23 LEU 73 -10.815 -1.828 -12.611 587 H LEU 74 H LEU 74 -7.179 -3.308 -16.920 588 HA LEU 74 HA LEU 74 -7.765 -3.596 -19.692 589 HB2 LEU 74 HB2 LEU 74 -5.102 -3.644 -18.260 590 HB3 LEU 74 HB1 LEU 74 -5.343 -3.456 -20.005 591 HG LEU 74 HG LEU 74 -6.775 -1.441 -18.476 592 HD11 LEU 74 HD11 LEU 74 -5.127 -0.422 -17.308 593 HD12 LEU 74 HD12 LEU 74 -3.858 -0.975 -18.399 594 HD13 LEU 74 HD13 LEU 74 -4.521 -2.074 -17.190 595 HD21 LEU 74 HD21 LEU 74 -5.606 0.038 -20.059 596 HD22 LEU 74 HD22 LEU 74 -6.423 -1.300 -20.867 597 HD23 LEU 74 HD23 LEU 74 -4.674 -1.343 -20.637 598 H GLU 75 H GLU 75 -6.895 -5.785 -17.172 599 HA GLU 75 HA GLU 75 -5.774 -7.848 -18.751 600 HB2 GLU 75 HB2 GLU 75 -6.820 -7.572 -15.992 601 HB3 GLU 75 HB1 GLU 75 -6.803 -9.211 -16.661 602 HG2 GLU 75 HG1 GLU 75 -4.429 -7.361 -16.431 603 HG3 GLU 75 HG2 GLU 75 -4.778 -8.759 -15.403 604 HE2 GLU 75 HE2 GLU 75 -3.935 -10.979 -18.033 605 H GLU 76 H GLU 76 -9.053 -7.425 -17.421 606 HA GLU 76 HA GLU 76 -10.081 -9.675 -18.878 607 HB2 GLU 76 HB2 GLU 76 -11.573 -7.473 -17.430 608 HB3 GLU 76 HB1 GLU 76 -12.250 -9.018 -17.967 609 HG2 GLU 76 HG1 GLU 76 -10.640 -10.182 -16.457 610 HG3 GLU 76 HG2 GLU 76 -10.173 -8.593 -15.835 611 HE2 GLU 76 HE2 GLU 76 -12.662 -9.433 -13.526 612 H ALA 77 H ALA 77 -10.156 -6.168 -19.233 613 HA ALA 77 HA ALA 77 -11.929 -6.188 -21.478 614 HB1 ALA 77 HB1 ALA 77 -11.386 -3.820 -21.676 615 HB2 ALA 77 HB2 ALA 77 -10.075 -4.014 -20.511 616 HB3 ALA 77 HB3 ALA 77 -11.748 -4.246 -20.003 617 H GLY 78 H GLY 78 -8.662 -6.948 -21.092 618 HA2 GLY 78 HA2 GLY 78 -7.244 -7.776 -22.754 619 HA3 GLY 78 3HA GLY 78 -8.321 -7.111 -23.973 620 H GLY 79 H GLY 79 -8.036 -4.583 -22.053 621 HA2 GLY 79 HA2 GLY 79 -6.170 -3.053 -21.721 622 HA3 GLY 79 3HA GLY 79 -5.467 -3.688 -23.202 623 H ASN 80 H ASN 80 -8.721 -2.483 -22.398 624 HA ASN 80 HA ASN 80 -8.490 -0.657 -24.696 625 HB2 ASN 80 HB2 ASN 80 -10.418 -2.587 -24.167 626 HB3 ASN 80 HB1 ASN 80 -11.194 -1.074 -23.686 627 HD21 ASN 80 HD21 ASN 80 -10.714 0.766 -25.334 628 HD22 ASN 80 HD22 ASN 80 -11.005 0.345 -26.985 629 H TRP 81 H TRP 81 -7.808 1.239 -23.866 630 HA TRP 81 HA TRP 81 -8.620 2.219 -21.312 631 HB2 TRP 81 HB2 TRP 81 -7.216 3.565 -23.636 632 HB3 TRP 81 HB1 TRP 81 -7.481 4.329 -22.068 633 HD1 TRP 81 HD1 TRP 81 -5.352 1.635 -23.737 634 HE1 TRP 81 HE1 TRP 81 -3.426 1.002 -22.152 635 HE3 TRP 81 HE3 TRP 81 -6.836 4.224 -19.585 636 HZ2 TRP 81 2HZ TRP 81 -2.640 1.530 -19.492 637 HZ3 TRP 81 3HZ TRP 81 -5.441 4.106 -17.562 638 HH2 TRP 81 HH TRP 81 -3.387 2.787 -17.518 639 H SER 82 H SER 82 -9.815 2.540 -24.558 640 HA SER 82 HA SER 82 -11.285 4.890 -24.379 641 HB2 SER 82 HB2 SER 82 -11.078 3.866 -26.516 642 HB3 SER 82 HB1 SER 82 -11.775 2.346 -25.928 643 HG SER 82 HG SER 82 -13.750 3.180 -26.014 644 H TYR 83 H TYR 83 -12.196 1.591 -23.461 645 HA TYR 83 HA TYR 83 -14.775 2.486 -22.477 646 HB2 TYR 83 HB2 TYR 83 -14.967 0.389 -23.458 647 HB3 TYR 83 HB1 TYR 83 -13.431 -0.173 -22.794 648 HD1 TYR 83 HD1 TYR 83 -16.991 0.316 -22.084 649 HD2 TYR 83 HD2 TYR 83 -13.268 -1.044 -20.535 650 HE1 TYR 83 HE1 TYR 83 -18.173 -0.794 -20.234 651 HE2 TYR 83 HE2 TYR 83 -14.441 -2.158 -18.681 652 HH TYR 83 HH TYR 83 -16.453 -2.809 -17.902 653 H ILE 84 H ILE 84 -11.687 1.374 -21.201 654 HA ILE 84 HA ILE 84 -12.471 1.189 -18.492 655 HB ILE 84 HB ILE 84 -9.759 1.627 -19.740 656 HG12 ILE 84 HG11 ILE 84 -10.870 -0.819 -18.357 657 HG13 ILE 84 HG12 ILE 84 -11.024 -0.552 -20.102 658 HG21 ILE 84 HG21 ILE 84 -8.857 0.977 -17.512 659 HG22 ILE 84 HG22 ILE 84 -9.659 2.547 -17.532 660 HG23 ILE 84 HG23 ILE 84 -10.486 1.143 -16.857 661 HD11 ILE 84 HD11 ILE 84 -8.769 -1.529 -18.588 662 HD12 ILE 84 HD12 ILE 84 -9.082 -1.594 -20.322 663 HD13 ILE 84 HD13 ILE 84 -8.333 -0.164 -19.613 664 H LYS 85 H LYS 85 -11.603 3.861 -20.520 665 HA LYS 85 HA LYS 85 -11.408 5.650 -18.203 666 HB2 LYS 85 HB2 LYS 85 -10.119 7.050 -19.446 667 HB3 LYS 85 HB1 LYS 85 -9.791 5.550 -20.328 668 HG2 LYS 85 HG1 LYS 85 -11.905 6.307 -21.724 669 HG3 LYS 85 HG2 LYS 85 -11.414 7.902 -21.129 670 HD2 LYS 85 HD1 LYS 85 -9.814 5.965 -22.802 671 HD3 LYS 85 HD2 LYS 85 -10.326 7.612 -23.213 672 HE2 LYS 85 HE1 LYS 85 -8.258 6.779 -21.170 673 HE3 LYS 85 HE2 LYS 85 -8.004 7.689 -22.666 674 HZ1 LYS 85 3HZ LYS 85 -9.829 9.188 -21.339 675 HZ2 LYS 85 1HZ LYS 85 -8.162 9.480 -21.375 676 HZ3 LYS 85 2HZ LYS 85 -8.843 8.623 -20.086 677 H LEU 86 H LEU 86 -13.737 4.463 -20.161 678 HA LEU 86 HA LEU 86 -15.212 6.565 -21.144 679 HB2 LEU 86 HB2 LEU 86 -15.600 3.938 -21.062 680 HB3 LEU 86 HB1 LEU 86 -16.675 4.398 -19.731 681 HG LEU 86 HG LEU 86 -17.887 4.144 -21.841 682 HD11 LEU 86 HD11 LEU 86 -19.262 5.939 -21.508 683 HD12 LEU 86 HD12 LEU 86 -17.925 7.074 -21.326 684 HD13 LEU 86 HD13 LEU 86 -18.334 5.976 -20.009 685 HD21 LEU 86 HD21 LEU 86 -16.557 6.591 -22.916 686 HD22 LEU 86 HD22 LEU 86 -17.427 5.315 -23.769 687 HD23 LEU 86 HD23 LEU 86 -15.803 5.015 -23.152 688 H ASP 87 H ASP 87 -14.835 5.525 -17.831 689 HA ASP 87 HA ASP 87 -16.581 7.746 -16.985 690 HB2 ASP 87 HB2 ASP 87 -15.987 5.247 -15.383 691 HB3 ASP 87 HB1 ASP 87 -17.178 6.502 -15.016 692 HD2 ASP 87 HD2 ASP 87 -18.224 3.585 -17.382 693 H ASN 88 H ASN 88 -13.677 7.707 -17.591 694 HA ASN 88 HA ASN 88 -11.783 8.669 -16.778 695 HB2 ASN 88 HB2 ASN 88 -13.728 10.147 -15.701 696 HB3 ASN 88 HB1 ASN 88 -13.073 9.455 -14.211 697 HD21 ASN 88 HD21 ASN 88 -10.545 9.466 -14.253 698 HD22 ASN 88 HD22 ASN 88 -9.847 10.996 -14.648 699 H TYR 89 H TYR 89 -12.160 5.938 -16.344 700 HA TYR 89 HA TYR 89 -11.232 4.192 -15.222 701 HB2 TYR 89 HB2 TYR 89 -9.714 6.293 -13.657 702 HB3 TYR 89 HB1 TYR 89 -9.282 4.591 -13.843 703 HD1 TYR 89 HD2 TYR 89 -9.918 4.378 -16.826 704 HD2 TYR 89 HD1 TYR 89 -7.713 7.232 -14.569 705 HE1 TYR 89 HE2 TYR 89 -8.575 4.907 -18.818 706 HE2 TYR 89 HE1 TYR 89 -6.364 7.770 -16.554 707 HH TYR 89 HH TYR 89 -5.715 6.458 -18.749 708 H THR 90 H THR 90 -13.702 5.241 -14.319 709 HA THR 90 HA THR 90 -13.981 5.704 -11.617 710 HB THR 90 HB THR 90 -15.786 4.270 -13.554 711 HG1 THR 90 HG1 THR 90 -16.093 6.760 -12.207 712 HG21 THR 90 HG21 THR 90 -17.540 4.697 -11.698 713 HG22 THR 90 HG22 THR 90 -16.150 4.724 -10.613 714 HG23 THR 90 HG23 THR 90 -16.496 3.282 -11.568 715 H ALA 91 H ALA 91 -13.413 2.672 -13.281 716 HA ALA 91 HA ALA 91 -14.081 0.822 -11.350 717 HB1 ALA 91 HB1 ALA 91 -12.586 0.834 -13.751 718 HB2 ALA 91 HB2 ALA 91 -13.266 -0.547 -12.889 719 HB3 ALA 91 HB3 ALA 91 -11.626 -0.004 -12.530 720 H LEU 92 H LEU 92 -11.229 2.872 -11.545 721 HA LEU 92 HA LEU 92 -9.747 1.609 -9.494 722 HB2 LEU 92 HB2 LEU 92 -8.244 3.356 -9.670 723 HB3 LEU 92 HB1 LEU 92 -8.997 3.317 -11.274 724 HG LEU 92 HG LEU 92 -10.579 5.140 -10.153 725 HD11 LEU 92 HD11 LEU 92 -8.291 4.902 -8.347 726 HD12 LEU 92 HD12 LEU 92 -9.872 5.638 -8.090 727 HD13 LEU 92 HD13 LEU 92 -8.600 6.544 -8.909 728 HD21 LEU 92 HD21 LEU 92 -8.092 6.427 -10.873 729 HD22 LEU 92 HD22 LEU 92 -9.645 6.427 -11.707 730 HD23 LEU 92 HD23 LEU 92 -8.494 5.120 -11.987 731 H VAL 93 H VAL 93 -12.220 4.094 -9.492 732 HA VAL 93 HA VAL 93 -11.868 4.995 -6.841 733 HB VAL 93 HB VAL 93 -14.251 5.040 -8.683 734 HG11 VAL 93 HG11 VAL 93 -14.038 5.844 -5.819 735 HG12 VAL 93 HG12 VAL 93 -15.045 6.796 -6.912 736 HG13 VAL 93 HG13 VAL 93 -15.375 5.078 -6.677 737 HG21 VAL 93 HG21 VAL 93 -13.315 6.892 -9.470 738 HG22 VAL 93 HG22 VAL 93 -13.310 7.599 -7.854 739 HG23 VAL 93 HG23 VAL 93 -11.934 6.640 -8.401 740 H ASP 94 H ASP 94 -14.081 2.580 -8.229 741 HA ASP 94 HA ASP 94 -15.146 1.833 -5.678 742 HB2 ASP 94 HB2 ASP 94 -16.185 1.616 -8.084 743 HB3 ASP 94 HB1 ASP 94 -15.333 0.065 -8.090 744 HD2 ASP 94 HD2 ASP 94 -17.571 -0.196 -4.974 745 H ALA 95 H ALA 95 -12.526 0.751 -7.707 746 HA ALA 95 HA ALA 95 -12.120 -1.753 -6.395 747 HB1 ALA 95 HB1 ALA 95 -9.835 -1.568 -7.552 748 HB2 ALA 95 HB2 ALA 95 -10.488 -0.108 -8.299 749 HB3 ALA 95 HB3 ALA 95 -11.274 -1.664 -8.567 750 H ILE 96 H ILE 96 -10.246 1.287 -6.352 751 HA ILE 96 HA ILE 96 -8.486 0.559 -4.312 752 HB ILE 96 HB ILE 96 -9.484 3.307 -5.070 753 HG12 ILE 96 HG11 ILE 96 -8.337 2.062 -6.864 754 HG13 ILE 96 HG12 ILE 96 -7.405 3.472 -6.331 755 HG21 ILE 96 HG21 ILE 96 -7.439 4.125 -3.935 756 HG22 ILE 96 HG22 ILE 96 -8.603 3.393 -2.833 757 HG23 ILE 96 HG23 ILE 96 -7.167 2.494 -3.323 758 HD11 ILE 96 HD11 ILE 96 -6.878 0.596 -5.631 759 HD12 ILE 96 HD12 ILE 96 -5.899 1.650 -6.651 760 HD13 ILE 96 HD13 ILE 96 -6.026 1.968 -4.922 761 H TYR 97 H TYR 97 -11.706 1.970 -4.174 762 HA TYR 97 HA TYR 97 -11.742 2.700 -1.473 763 HB2 TYR 97 HB2 TYR 97 -13.769 2.137 -3.565 764 HB3 TYR 97 HB1 TYR 97 -14.329 2.037 -1.894 765 HD1 TYR 97 HD1 TYR 97 -11.777 4.358 -3.276 766 HD2 TYR 97 HD2 TYR 97 -15.697 3.928 -1.677 767 HE1 TYR 97 HE1 TYR 97 -12.002 6.806 -3.182 768 HE2 TYR 97 HE2 TYR 97 -15.932 6.375 -1.580 769 HH TYR 97 HH TYR 97 -14.477 8.360 -1.471 770 H SER 98 H SER 98 -12.253 -0.390 -3.048 771 HA SER 98 HA SER 98 -13.233 -1.710 -0.699 772 HB2 SER 98 HB2 SER 98 -13.900 -2.571 -2.851 773 HB3 SER 98 HB1 SER 98 -12.208 -2.773 -3.340 774 HG SER 98 HG SER 98 -12.035 -4.527 -2.130 775 H VAL 99 H VAL 99 -10.180 -1.922 -2.530 776 HA VAL 99 HA VAL 99 -8.833 -3.597 -0.737 777 HB VAL 99 HB VAL 99 -7.547 -1.488 -2.472 778 HG11 VAL 99 HG11 VAL 99 -5.628 -2.943 -2.468 779 HG12 VAL 99 HG12 VAL 99 -6.099 -2.610 -0.801 780 HG13 VAL 99 HG13 VAL 99 -6.505 -4.160 -1.540 781 HG21 VAL 99 HG21 VAL 99 -9.020 -3.906 -3.178 782 HG22 VAL 99 HG22 VAL 99 -8.524 -2.547 -4.186 783 HG23 VAL 99 HG23 VAL 99 -7.391 -3.856 -3.851 784 H GLU 100 H GLU 100 -8.602 -0.051 -1.078 785 HA GLU 100 HA GLU 100 -6.875 0.474 1.002 786 HB2 GLU 100 HB2 GLU 100 -7.552 2.702 0.894 787 HB3 GLU 100 HB1 GLU 100 -7.933 2.079 -0.719 788 HG2 GLU 100 HG1 GLU 100 -10.284 1.734 0.021 789 HG3 GLU 100 HG2 GLU 100 -9.862 2.530 1.544 790 HE2 GLU 100 HE2 GLU 100 -9.207 5.233 -1.139 791 H ASP 101 H ASP 101 -10.268 -0.333 1.123 792 HA ASP 101 HA ASP 101 -10.962 0.520 3.661 793 HB2 ASP 101 HB2 ASP 101 -12.393 -0.637 1.847 794 HB3 ASP 101 HB1 ASP 101 -11.854 -2.147 2.591 795 HD2 ASP 101 HD2 ASP 101 -14.940 -0.818 4.170 796 H GLU 102 H GLU 102 -10.069 -2.852 2.917 797 HA GLU 102 HA GLU 102 -8.693 -2.960 5.520 798 HB2 GLU 102 HB2 GLU 102 -9.410 -5.408 5.561 799 HB3 GLU 102 HB1 GLU 102 -10.663 -4.200 5.879 800 HG2 GLU 102 HG1 GLU 102 -10.255 -5.239 3.101 801 HG3 GLU 102 HG2 GLU 102 -11.162 -6.184 4.291 802 HE2 GLU 102 HE2 GLU 102 -13.346 -3.819 2.467 803 H ASN 103 H ASN 103 -6.617 -3.459 5.352 804 HA ASN 103 HA ASN 103 -5.719 -4.943 2.970 805 HB2 ASN 103 HB2 ASN 103 -4.294 -2.820 4.592 806 HB3 ASN 103 HB1 ASN 103 -3.511 -3.796 3.343 807 HD21 ASN 103 HD21 ASN 103 -6.350 -1.727 3.803 808 HD22 ASN 103 HD22 ASN 103 -6.279 -0.990 2.241 809 H LYS 104 H LYS 104 -5.784 -4.800 6.404 810 HA LYS 104 HA LYS 104 -3.941 -7.095 6.555 811 HB2 LYS 104 HB2 LYS 104 -3.845 -6.409 9.050 812 HB3 LYS 104 HB1 LYS 104 -2.940 -5.450 7.867 813 HG2 LYS 104 HG1 LYS 104 -3.971 -3.890 9.294 814 HG3 LYS 104 HG2 LYS 104 -4.928 -3.889 7.802 815 HD2 LYS 104 HD1 LYS 104 -5.974 -5.889 9.562 816 HD3 LYS 104 HD2 LYS 104 -5.814 -4.362 10.446 817 HE2 LYS 104 HE1 LYS 104 -7.167 -4.628 7.752 818 HE3 LYS 104 HE2 LYS 104 -8.014 -4.661 9.305 819 HZ1 LYS 104 3HZ LYS 104 -8.184 -2.464 8.854 820 HZ2 LYS 104 1HZ LYS 104 -6.775 -2.414 7.919 821 HZ3 LYS 104 2HZ LYS 104 -6.669 -2.419 9.607 822 H GLN 105 H GLN 105 -7.141 -6.234 6.673 823 HA GLN 105 HA GLN 105 -9.050 -7.228 7.416 824 HB2 GLN 105 HB2 GLN 105 -7.411 -9.749 7.668 825 HB3 GLN 105 HB1 GLN 105 -9.136 -9.598 7.299 826 HG2 GLN 105 HG1 GLN 105 -6.798 -8.945 5.518 827 HG3 GLN 105 HG2 GLN 105 -8.039 -10.182 5.287 828 HE21 GLN 105 HE21 GLN 105 -7.121 -7.000 4.654 829 HE22 GLN 105 HE22 GLN 105 -8.589 -6.458 3.922 830 H SER 106 H SER 106 -9.299 -6.177 9.373 831 HA SER 106 HA SER 106 -9.059 -7.845 11.706 832 HB2 SER 106 HB2 SER 106 -7.547 -5.214 11.629 833 HB3 SER 106 HB1 SER 106 -7.701 -6.295 13.024 834 HG SER 106 HG SER 106 -5.723 -6.606 11.904 835 H GLU 107 H GLU 107 -9.602 -6.222 13.720 836 HA GLU 107 HA GLU 107 -12.005 -4.747 12.862 837 HB2 GLU 107 HB2 GLU 107 -11.541 -6.722 15.005 838 HB3 GLU 107 HB1 GLU 107 -12.481 -5.301 15.484 839 HG2 GLU 107 HG1 GLU 107 -13.783 -5.858 13.240 840 HG3 GLU 107 HG2 GLU 107 -13.166 -7.477 13.594 841 HE2 GLU 107 HE2 GLU 107 -14.981 -7.090 16.802 842 H GLY 108 H GLY 108 -10.819 -2.791 12.667 843 HA2 GLY 108 HA2 GLY 108 -10.121 -1.604 15.282 844 HA3 GLY 108 3HA GLY 108 -9.148 -1.321 13.846 845 H SER 109 H SER 109 -9.759 0.215 12.390 846 HA SER 109 HA SER 109 -11.308 2.351 13.212 847 HB2 SER 109 HB2 SER 109 -11.369 2.968 10.733 848 HB3 SER 109 HB1 SER 109 -9.764 2.718 11.445 849 HG SER 109 HG SER 109 -9.529 1.376 9.840 Start of MODEL 10 1 H1 MET 1 H MET 1 50.199 7.070 12.508 2 HA MET 1 HA MET 1 47.815 7.912 11.468 3 HB2 MET 1 HB2 MET 1 50.535 7.875 10.143 4 HB3 MET 1 HB1 MET 1 49.145 8.782 9.527 5 HG2 MET 1 HG1 MET 1 49.076 9.917 11.818 6 HG3 MET 1 HG2 MET 1 50.685 9.229 12.058 7 HE1 MET 1 HE1 MET 1 48.489 11.685 10.843 8 HE2 MET 1 HE2 MET 1 49.541 13.015 10.360 9 HE3 MET 1 HE3 MET 1 48.923 11.893 9.147 10 H GLY 2 H GLY 2 46.815 7.646 9.368 11 HA2 GLY 2 HA2 GLY 2 47.261 5.956 7.349 12 HA3 GLY 2 3HA GLY 2 46.743 4.839 8.603 13 H SER 3 H SER 3 45.732 6.781 6.085 14 HA SER 3 HA SER 3 42.937 6.531 6.962 15 HB2 SER 3 HB2 SER 3 43.921 8.917 7.115 16 HB3 SER 3 HB1 SER 3 43.874 8.892 5.343 17 HG SER 3 HG SER 3 41.864 9.439 5.558 18 H SER 4 H SER 4 42.103 5.041 5.655 19 HA SER 4 HA SER 4 42.134 5.486 2.797 20 HB2 SER 4 HB2 SER 4 44.200 4.124 3.279 21 HB3 SER 4 HB1 SER 4 43.131 2.841 3.871 22 HG SER 4 HG SER 4 43.454 3.812 1.255 23 H HIS 5 H HIS 5 40.476 4.396 1.698 24 HA HIS 5 HA HIS 5 38.242 3.674 3.374 25 HB2 HIS 5 HB2 HIS 5 38.646 4.084 0.426 26 HB3 HIS 5 HB1 HIS 5 37.180 3.296 1.016 27 HD1 HIS 5 HD1 HIS 5 35.397 5.007 0.813 28 HD2 HIS 5 HD2 HIS 5 38.868 6.565 2.483 29 HE1 HIS 5 HE1 HIS 5 34.827 7.366 1.470 30 HE2 HIS 5 HE2 HIS 5 36.947 8.320 2.490 31 H HIS 6 H HIS 6 38.078 1.693 4.180 32 HA HIS 6 HA HIS 6 38.879 -0.581 2.484 33 HB2 HIS 6 HB2 HIS 6 38.966 -0.324 5.501 34 HB3 HIS 6 HB1 HIS 6 39.290 -1.818 4.615 35 HD1 HIS 6 HD1 HIS 6 41.058 -0.620 2.347 36 HD2 HIS 6 HD2 HIS 6 41.515 0.180 6.399 37 HE1 HIS 6 HE1 HIS 6 43.450 0.104 2.625 38 HE2 HIS 6 HE2 HIS 6 43.730 0.595 5.101 39 H HIS 7 H HIS 7 37.322 -1.959 1.941 40 HA HIS 7 HA HIS 7 34.773 -1.824 3.406 41 HB2 HIS 7 HB2 HIS 7 35.037 -1.288 0.836 42 HB3 HIS 7 HB1 HIS 7 34.996 -3.047 0.685 43 HD1 HIS 7 HD1 HIS 7 32.881 -0.618 2.728 44 HD2 HIS 7 HD2 HIS 7 32.480 -3.772 0.054 45 HE1 HIS 7 HE1 HIS 7 30.406 -0.992 2.497 46 HE2 HIS 7 HE2 HIS 7 30.159 -2.920 0.862 47 H HIS 8 H HIS 8 33.660 -3.743 3.903 48 HA HIS 8 HA HIS 8 35.247 -6.214 3.697 49 HB2 HIS 8 HB2 HIS 8 33.790 -5.127 6.114 50 HB3 HIS 8 HB1 HIS 8 34.318 -6.807 5.983 51 HD1 HIS 8 HD1 HIS 8 35.616 -3.370 6.564 52 HD2 HIS 8 HD2 HIS 8 37.101 -7.228 6.156 53 HE1 HIS 8 HE1 HIS 8 38.005 -3.257 7.344 54 HE2 HIS 8 HE2 HIS 8 38.914 -5.615 7.094 55 H HIS 9 H HIS 9 34.155 -8.003 3.096 56 HA HIS 9 HA HIS 9 31.272 -7.699 2.617 57 HB2 HIS 9 HB2 HIS 9 31.460 -9.307 0.874 58 HB3 HIS 9 HB1 HIS 9 32.810 -8.185 0.673 59 HD1 HIS 9 HD1 HIS 9 35.187 -9.086 1.012 60 HD2 HIS 9 HD2 HIS 9 32.218 -11.919 1.659 61 HE1 HIS 9 HE1 HIS 9 36.381 -11.296 1.130 62 HE2 HIS 9 HE2 HIS 9 34.567 -13.028 1.526 63 H HIS 10 H HIS 10 30.181 -10.010 2.552 64 HA HIS 10 HA HIS 10 30.992 -11.465 4.982 65 HB2 HIS 10 HB2 HIS 10 28.587 -11.829 5.470 66 HB3 HIS 10 HB1 HIS 10 29.052 -10.126 5.536 67 HD1 HIS 10 HD1 HIS 10 28.125 -8.549 3.704 68 HD2 HIS 10 HD2 HIS 10 26.777 -12.469 3.423 69 HE1 HIS 10 HE1 HIS 10 26.199 -8.484 2.087 70 HE2 HIS 10 HE2 HIS 10 25.375 -10.879 1.914 71 H SER 11 H SER 11 30.584 -13.697 5.018 72 HA SER 11 HA SER 11 30.187 -14.867 2.349 73 HB2 SER 11 HB2 SER 11 32.353 -15.213 3.808 74 HB3 SER 11 HB1 SER 11 31.345 -16.408 4.643 75 HG SER 11 HG SER 11 31.505 -17.693 2.987 76 H SER 12 H SER 12 28.877 -16.708 2.095 77 HA SER 12 HA SER 12 27.049 -17.273 4.333 78 HB2 SER 12 HB2 SER 12 25.229 -17.541 2.589 79 HB3 SER 12 HB1 SER 12 25.790 -15.880 2.854 80 HG SER 12 HG SER 12 26.032 -15.915 0.758 81 H GLY 13 H GLY 13 26.430 -19.382 4.604 82 HA2 GLY 13 HA2 GLY 13 27.417 -21.339 2.632 83 HA3 GLY 13 3HA GLY 13 27.807 -21.530 4.335 84 H LEU 14 H LEU 14 25.636 -22.305 1.901 85 HA LEU 14 HA LEU 14 23.584 -23.097 3.862 86 HB2 LEU 14 HB2 LEU 14 22.739 -21.513 2.233 87 HB3 LEU 14 HB1 LEU 14 23.326 -22.537 0.911 88 HG LEU 14 HG LEU 14 21.708 -24.312 1.848 89 HD11 LEU 14 HD11 LEU 14 20.766 -23.697 3.784 90 HD12 LEU 14 HD12 LEU 14 19.689 -22.737 2.769 91 HD13 LEU 14 HD13 LEU 14 21.098 -21.985 3.519 92 HD21 LEU 14 HD21 LEU 14 21.491 -22.950 -0.270 93 HD22 LEU 14 HD22 LEU 14 20.453 -21.856 0.644 94 HD23 LEU 14 HD23 LEU 14 19.983 -23.543 0.426 95 H VAL 15 H VAL 15 24.814 -24.123 0.669 96 HA VAL 15 HA VAL 15 25.196 -26.182 -0.224 97 HB VAL 15 HB VAL 15 26.654 -27.421 0.941 98 HG11 VAL 15 HG11 VAL 15 27.758 -26.293 2.664 99 HG12 VAL 15 HG12 VAL 15 26.960 -25.007 1.756 100 HG13 VAL 15 HG13 VAL 15 26.267 -25.577 3.275 101 HG21 VAL 15 HG21 VAL 15 26.164 -28.258 3.276 102 HG22 VAL 15 HG22 VAL 15 24.578 -27.500 3.120 103 HG23 VAL 15 HG23 VAL 15 25.052 -28.791 2.016 104 HA PRO 16 HA PRO 16 21.535 -28.598 -0.114 105 HB2 PRO 16 HB2 PRO 16 22.446 -31.084 -0.813 106 HB3 PRO 16 HB1 PRO 16 22.342 -29.733 -1.941 107 HG2 PRO 16 HG1 PRO 16 24.704 -30.737 -0.388 108 HG3 PRO 16 HG2 PRO 16 24.599 -30.259 -2.125 109 HD2 PRO 16 HD1 PRO 16 25.649 -28.635 -0.219 110 HD3 PRO 16 HD2 PRO 16 24.756 -28.016 -1.618 111 H ARG 17 H ARG 17 20.568 -28.941 1.797 112 HA ARG 17 HA ARG 17 21.849 -30.739 3.734 113 HB2 ARG 17 HB2 ARG 17 19.688 -28.648 4.041 114 HB3 ARG 17 HB1 ARG 17 20.153 -29.768 5.332 115 HG2 ARG 17 HG1 ARG 17 22.571 -28.813 4.794 116 HG3 ARG 17 HG2 ARG 17 21.610 -27.435 4.230 117 HD2 ARG 17 HD1 ARG 17 21.151 -28.687 6.933 118 HD3 ARG 17 HD2 ARG 17 22.370 -27.430 6.674 119 HE ARG 17 HE ARG 17 19.762 -26.718 5.697 120 HH11 ARG 17 1HH1 ARG 17 21.867 -26.771 8.470 121 HH12 ARG 17 2HH1 ARG 17 21.052 -25.474 9.277 122 HH21 ARG 17 1HH2 ARG 17 18.679 -25.009 6.752 123 HH22 ARG 17 2HH2 ARG 17 19.237 -24.472 8.300 124 H GLY 18 H GLY 18 18.437 -29.928 3.129 125 HA2 GLY 18 HA2 GLY 18 17.890 -32.754 2.569 126 HA3 GLY 18 3HA GLY 18 17.063 -32.004 3.926 127 H SER 19 H SER 19 16.129 -33.137 1.293 128 HA SER 19 HA SER 19 14.954 -30.778 0.037 129 HB2 SER 19 HB2 SER 19 14.606 -33.673 -0.785 130 HB3 SER 19 HB1 SER 19 14.305 -32.225 -1.761 131 HG SER 19 HG SER 19 16.275 -32.643 -2.421 132 H HIS 20 H HIS 20 14.038 -33.634 1.869 133 HA HIS 20 HA HIS 20 11.212 -32.990 1.697 134 HB2 HIS 20 HB2 HIS 20 12.832 -35.254 2.772 135 HB3 HIS 20 HB1 HIS 20 11.226 -34.991 3.455 136 HD1 HIS 20 HD1 HIS 20 11.705 -34.261 -0.159 137 HD2 HIS 20 HD2 HIS 20 10.299 -37.359 2.226 138 HE1 HIS 20 HE1 HIS 20 10.514 -35.828 -1.725 139 HE2 HIS 20 HE2 HIS 20 9.654 -37.721 -0.267 140 H MET 21 H MET 21 10.038 -33.289 3.957 141 HA MET 21 HA MET 21 11.350 -32.280 6.260 142 HB2 MET 21 HB2 MET 21 10.295 -30.085 6.402 143 HB3 MET 21 HB1 MET 21 11.317 -30.196 4.961 144 HG2 MET 21 HG1 MET 21 8.424 -30.844 4.674 145 HG3 MET 21 HG2 MET 21 8.896 -29.155 4.877 146 HE1 MET 21 HE1 MET 21 9.124 -31.791 1.296 147 HE2 MET 21 HE2 MET 21 8.413 -32.051 2.889 148 HE3 MET 21 HE3 MET 21 7.694 -30.881 1.782 149 H ILE 22 H ILE 22 10.022 -32.297 8.093 150 HA ILE 22 HA ILE 22 7.233 -33.126 7.682 151 HB ILE 22 HB ILE 22 8.707 -35.121 8.113 152 HG12 ILE 22 HG11 ILE 22 6.693 -34.578 10.305 153 HG13 ILE 22 HG12 ILE 22 6.246 -34.990 8.641 154 HG21 ILE 22 HG21 ILE 22 9.531 -35.479 10.378 155 HG22 ILE 22 HG22 ILE 22 10.264 -34.045 9.660 156 HG23 ILE 22 HG23 ILE 22 8.970 -33.873 10.845 157 HD11 ILE 22 HD11 ILE 22 7.972 -36.762 10.342 158 HD12 ILE 22 HD12 ILE 22 6.214 -36.895 10.272 159 HD13 ILE 22 HD13 ILE 22 7.177 -37.154 8.817 160 H SER 23 H SER 23 5.837 -32.748 9.484 161 HA SER 23 HA SER 23 6.122 -30.280 10.703 162 HB2 SER 23 HB2 SER 23 4.517 -32.554 11.894 163 HB3 SER 23 HB1 SER 23 4.187 -30.815 11.992 164 HG SER 23 HG SER 23 3.246 -30.891 10.112 165 H LEU 24 H LEU 24 7.302 -33.392 11.708 166 HA LEU 24 HA LEU 24 7.718 -32.993 14.420 167 HB2 LEU 24 HB2 LEU 24 9.680 -34.407 12.622 168 HB3 LEU 24 HB1 LEU 24 9.316 -34.734 14.326 169 HG LEU 24 HG LEU 24 7.542 -35.314 11.957 170 HD11 LEU 24 HD11 LEU 24 8.827 -37.185 13.937 171 HD12 LEU 24 HD12 LEU 24 9.470 -36.837 12.332 172 HD13 LEU 24 HD13 LEU 24 7.898 -37.618 12.501 173 HD21 LEU 24 HD21 LEU 24 6.127 -36.444 13.730 174 HD22 LEU 24 HD22 LEU 24 6.076 -34.681 13.692 175 HD23 LEU 24 HD23 LEU 24 7.040 -35.511 14.915 176 H SER 25 H SER 25 9.406 -31.664 11.691 177 HA SER 25 HA SER 25 11.093 -30.127 13.538 178 HB2 SER 25 HB2 SER 25 12.993 -30.320 11.937 179 HB3 SER 25 HB1 SER 25 12.529 -31.874 12.651 180 HG SER 25 HG SER 25 12.214 -32.566 10.705 181 H GLY 26 H GLY 26 11.050 -28.002 13.164 182 HA2 GLY 26 HA2 GLY 26 10.211 -27.074 10.492 183 HA3 GLY 26 3HA GLY 26 9.475 -26.418 11.947 184 H LEU 27 H LEU 27 12.407 -26.586 10.035 185 HA LEU 27 HA LEU 27 13.447 -24.270 11.530 186 HB2 LEU 27 HB2 LEU 27 14.994 -25.994 11.863 187 HB3 LEU 27 HB1 LEU 27 14.835 -26.563 10.191 188 HG LEU 27 HG LEU 27 16.063 -24.594 9.404 189 HD11 LEU 27 HD11 LEU 27 17.020 -23.000 10.862 190 HD12 LEU 27 HD12 LEU 27 16.571 -23.929 12.291 191 HD13 LEU 27 HD13 LEU 27 15.324 -23.139 11.327 192 HD21 LEU 27 HD21 LEU 27 17.545 -26.006 11.617 193 HD22 LEU 27 HD22 LEU 27 18.238 -25.251 10.181 194 HD23 LEU 27 HD23 LEU 27 17.236 -26.695 10.022 195 H THR 28 H THR 28 12.322 -25.424 8.535 196 HA THR 28 HA THR 28 13.556 -23.207 7.061 197 HB THR 28 HB THR 28 12.969 -24.317 5.039 198 HG1 THR 28 HG1 THR 28 11.609 -26.129 5.018 199 HG21 THR 28 HG21 THR 28 13.831 -26.437 7.011 200 HG22 THR 28 HG22 THR 28 14.902 -25.265 6.241 201 HG23 THR 28 HG23 THR 28 14.070 -26.475 5.264 202 H SER 29 H SER 29 12.127 -22.102 5.442 203 HA SER 29 HA SER 29 9.536 -21.503 6.697 204 HB2 SER 29 HB2 SER 29 9.746 -19.303 6.045 205 HB3 SER 29 HB1 SER 29 11.456 -19.733 6.230 206 HG SER 29 HG SER 29 11.150 -18.720 4.244 207 H SER 30 H SER 30 8.218 -20.256 4.686 208 HA SER 30 HA SER 30 7.856 -22.415 2.715 209 HB2 SER 30 HB2 SER 30 5.880 -20.478 3.942 210 HB3 SER 30 HB1 SER 30 5.506 -21.451 2.508 211 HG SER 30 HG SER 30 5.359 -22.190 5.041 212 H VAL 31 H VAL 31 6.574 -21.455 0.712 213 HA VAL 31 HA VAL 31 8.253 -19.271 -0.299 214 HB VAL 31 HB VAL 31 7.444 -19.991 -2.548 215 HG11 VAL 31 HG11 VAL 31 9.551 -20.809 -2.034 216 HG12 VAL 31 HG12 VAL 31 8.945 -21.845 -0.740 217 HG13 VAL 31 HG13 VAL 31 8.655 -22.276 -2.426 218 HG21 VAL 31 HG21 VAL 31 6.510 -22.579 -1.484 219 HG22 VAL 31 HG22 VAL 31 5.423 -21.210 -1.252 220 HG23 VAL 31 HG23 VAL 31 5.948 -21.653 -2.876 221 H GLU 32 H GLU 32 6.289 -18.413 1.401 222 HA GLU 32 HA GLU 32 3.868 -17.728 0.068 223 HB2 GLU 32 HB2 GLU 32 3.474 -16.233 1.984 224 HB3 GLU 32 HB1 GLU 32 3.962 -17.857 2.495 225 HG2 GLU 32 HG1 GLU 32 6.359 -16.821 2.551 226 HG3 GLU 32 HG2 GLU 32 5.471 -15.293 2.653 227 HE2 GLU 32 HE2 GLU 32 5.609 -15.974 6.053 228 H SER 33 H SER 33 7.026 -16.331 0.212 229 HA SER 33 HA SER 33 6.038 -13.955 -1.224 230 HB2 SER 33 HB2 SER 33 7.033 -13.316 0.895 231 HB3 SER 33 HB1 SER 33 8.488 -14.257 0.526 232 HG SER 33 HG SER 33 9.161 -12.746 -0.817 233 H ASP 34 H ASP 34 8.140 -16.684 -1.283 234 HA ASP 34 HA ASP 34 9.999 -15.905 -3.218 235 HB2 ASP 34 HB2 ASP 34 10.477 -17.910 -2.100 236 HB3 ASP 34 HB1 ASP 34 8.866 -18.570 -2.412 237 HD2 ASP 34 HD2 ASP 34 11.419 -18.676 -5.459 238 H LEU 35 H LEU 35 6.651 -16.670 -3.495 239 HA LEU 35 HA LEU 35 6.812 -17.051 -6.382 240 HB2 LEU 35 HB2 LEU 35 4.802 -17.540 -4.270 241 HB3 LEU 35 HB1 LEU 35 4.166 -17.048 -5.849 242 HG LEU 35 HG LEU 35 5.789 -19.000 -6.666 243 HD11 LEU 35 HD11 LEU 35 4.882 -20.572 -4.448 244 HD12 LEU 35 HD12 LEU 35 5.912 -19.260 -3.878 245 HD13 LEU 35 HD13 LEU 35 6.512 -20.385 -5.095 246 HD21 LEU 35 HD21 LEU 35 3.859 -20.426 -6.770 247 HD22 LEU 35 HD22 LEU 35 3.346 -18.761 -7.041 248 HD23 LEU 35 HD23 LEU 35 3.070 -19.527 -5.475 249 H ASP 36 H ASP 36 7.211 -14.452 -4.748 250 HA ASP 36 HA ASP 36 5.102 -12.732 -5.669 251 HB2 ASP 36 HB2 ASP 36 6.431 -12.350 -3.570 252 HB3 ASP 36 HB1 ASP 36 7.813 -11.936 -4.594 253 HD2 ASP 36 HD2 ASP 36 6.235 -8.943 -5.632 254 H MET 37 H MET 37 8.162 -13.815 -6.876 255 HA MET 37 HA MET 37 8.825 -11.771 -8.641 256 HB2 MET 37 HB2 MET 37 9.195 -14.750 -9.046 257 HB3 MET 37 HB1 MET 37 10.075 -13.468 -9.892 258 HG2 MET 37 HG1 MET 37 10.186 -14.013 -6.924 259 HG3 MET 37 HG2 MET 37 11.410 -14.465 -8.113 260 HE1 MET 37 HE1 MET 37 13.161 -13.690 -7.159 261 HE2 MET 37 HE2 MET 37 13.820 -12.174 -7.776 262 HE3 MET 37 HE3 MET 37 13.235 -12.270 -6.114 263 H GLN 38 H GLN 38 6.668 -14.544 -9.103 264 HA GLN 38 HA GLN 38 6.107 -14.246 -11.799 265 HB2 GLN 38 HB2 GLN 38 4.479 -15.272 -9.485 266 HB3 GLN 38 HB1 GLN 38 3.812 -15.230 -11.125 267 HG2 GLN 38 HG1 GLN 38 6.124 -16.465 -11.654 268 HG3 GLN 38 HG2 GLN 38 5.905 -16.967 -9.972 269 HE21 GLN 38 HE21 GLN 38 3.835 -17.968 -9.419 270 HE22 GLN 38 HE22 GLN 38 3.046 -18.950 -10.602 271 H GLN 39 H GLN 39 4.818 -12.505 -9.035 272 HA GLN 39 HA GLN 39 2.652 -11.239 -10.255 273 HB2 GLN 39 HB2 GLN 39 4.462 -10.103 -8.111 274 HB3 GLN 39 HB1 GLN 39 2.807 -9.588 -8.471 275 HG2 GLN 39 HG1 GLN 39 2.047 -11.909 -7.888 276 HG3 GLN 39 HG2 GLN 39 3.692 -12.217 -7.315 277 HE21 GLN 39 HE21 GLN 39 4.310 -9.839 -6.109 278 HE22 GLN 39 HE22 GLN 39 3.287 -9.598 -4.739 279 H ALA 40 H ALA 40 6.038 -10.726 -10.616 280 HA ALA 40 HA ALA 40 6.084 -8.049 -11.444 281 HB1 ALA 40 HB1 ALA 40 7.890 -10.240 -12.450 282 HB2 ALA 40 HB2 ALA 40 8.075 -9.448 -10.885 283 HB3 ALA 40 HB3 ALA 40 8.236 -8.513 -12.373 284 H MET 41 H MET 41 4.861 -10.854 -12.990 285 HA MET 41 HA MET 41 5.024 -9.760 -15.667 286 HB2 MET 41 HB2 MET 41 3.439 -12.175 -14.785 287 HB3 MET 41 HB1 MET 41 4.050 -11.803 -16.404 288 HG2 MET 41 HG1 MET 41 5.738 -12.491 -13.995 289 HG3 MET 41 HG2 MET 41 5.348 -13.565 -15.341 290 HE1 MET 41 HE1 MET 41 5.852 -13.370 -17.510 291 HE2 MET 41 HE2 MET 41 6.519 -11.948 -18.312 292 HE3 MET 41 HE3 MET 41 7.583 -13.271 -17.833 293 H LEU 42 H LEU 42 2.522 -10.402 -13.239 294 HA LEU 42 HA LEU 42 0.367 -9.454 -14.835 295 HB2 LEU 42 HB2 LEU 42 0.752 -10.124 -11.945 296 HB3 LEU 42 HB1 LEU 42 -0.700 -9.241 -12.452 297 HG LEU 42 HG LEU 42 -1.097 -11.653 -12.243 298 HD11 LEU 42 HD11 LEU 42 -1.500 -11.697 -15.022 299 HD12 LEU 42 HD12 LEU 42 -1.652 -10.012 -14.523 300 HD13 LEU 42 HD13 LEU 42 -2.655 -11.250 -13.766 301 HD21 LEU 42 HD21 LEU 42 0.745 -12.011 -14.595 302 HD22 LEU 42 HD22 LEU 42 -0.038 -13.256 -13.621 303 HD23 LEU 42 HD23 LEU 42 1.256 -12.277 -12.927 304 H THR 43 H THR 43 2.707 -7.937 -12.781 305 HA THR 43 HA THR 43 1.217 -5.416 -12.772 306 HB THR 43 HB THR 43 2.247 -6.186 -10.648 307 HG1 THR 43 HG1 THR 43 3.559 -4.081 -10.459 308 HG21 THR 43 HG21 THR 43 4.483 -6.561 -10.364 309 HG22 THR 43 HG22 THR 43 4.945 -5.418 -11.626 310 HG23 THR 43 HG23 THR 43 4.344 -7.017 -12.061 311 H ASN 44 H ASN 44 2.252 -6.372 -15.256 312 HA ASN 44 HA ASN 44 4.719 -5.235 -15.961 313 HB2 ASN 44 HB2 ASN 44 3.136 -6.896 -17.242 314 HB3 ASN 44 HB1 ASN 44 2.474 -5.411 -17.938 315 HD21 ASN 44 HD21 ASN 44 5.660 -6.812 -17.229 316 HD22 ASN 44 HD22 ASN 44 6.377 -6.368 -18.737 317 H LYS 45 H LYS 45 5.297 -3.177 -15.983 318 HA LYS 45 HA LYS 45 3.329 -1.070 -15.917 319 HB2 LYS 45 HB2 LYS 45 6.324 -1.194 -15.728 320 HB3 LYS 45 HB1 LYS 45 5.510 0.357 -15.984 321 HG2 LYS 45 HG1 LYS 45 5.666 0.354 -13.706 322 HG3 LYS 45 HG2 LYS 45 4.080 -0.407 -13.923 323 HD2 LYS 45 HD1 LYS 45 5.130 -1.799 -12.372 324 HD3 LYS 45 HD2 LYS 45 5.378 -2.634 -13.916 325 HE2 LYS 45 HE1 LYS 45 7.467 -2.695 -12.785 326 HE3 LYS 45 HE2 LYS 45 7.612 -1.476 -14.058 327 HZ1 LYS 45 3HZ LYS 45 8.554 -0.633 -12.038 328 HZ2 LYS 45 1HZ LYS 45 7.136 -0.959 -11.174 329 HZ3 LYS 45 2HZ LYS 45 7.141 0.235 -12.372 330 H ASP 46 H ASP 46 3.189 0.663 -17.414 331 HA ASP 46 HA ASP 46 4.523 0.390 -19.978 332 HB2 ASP 46 HB2 ASP 46 1.497 0.400 -19.811 333 HB3 ASP 46 HB1 ASP 46 2.477 0.333 -21.282 334 HD2 ASP 46 HD2 ASP 46 3.156 -3.053 -20.857 335 H GLU 47 H GLU 47 3.934 2.233 -21.455 336 HA GLU 47 HA GLU 47 4.305 4.677 -20.125 337 HB2 GLU 47 HB2 GLU 47 3.876 5.720 -22.339 338 HB3 GLU 47 HB1 GLU 47 5.053 4.399 -22.399 339 HG2 GLU 47 HG1 GLU 47 2.786 3.033 -22.925 340 HG3 GLU 47 HG2 GLU 47 2.387 4.611 -23.617 341 HE2 GLU 47 HE2 GLU 47 5.292 2.510 -25.320 342 H LYS 48 H LYS 48 1.416 3.215 -21.559 343 HA LYS 48 HA LYS 48 -0.304 5.413 -21.070 344 HB2 LYS 48 HB2 LYS 48 -2.137 3.747 -21.416 345 HB3 LYS 48 HB1 LYS 48 -0.934 3.785 -22.715 346 HG2 LYS 48 HG1 LYS 48 -0.382 1.842 -20.574 347 HG3 LYS 48 HG2 LYS 48 -1.838 1.529 -21.534 348 HD2 LYS 48 HD1 LYS 48 0.165 2.263 -23.376 349 HD3 LYS 48 HD2 LYS 48 0.917 1.131 -22.238 350 HE2 LYS 48 HE1 LYS 48 0.042 -0.434 -23.619 351 HE3 LYS 48 HE2 LYS 48 -1.422 -0.133 -22.670 352 HZ1 LYS 48 3HZ LYS 48 -0.753 0.800 -25.380 353 HZ2 LYS 48 1HZ LYS 48 -1.845 1.685 -24.438 354 HZ3 LYS 48 2HZ LYS 48 -2.173 0.071 -24.820 355 H VAL 49 H VAL 49 0.691 2.657 -19.157 356 HA VAL 49 HA VAL 49 -1.271 2.669 -17.183 357 HB VAL 49 HB VAL 49 1.668 2.023 -16.915 358 HG11 VAL 49 HG11 VAL 49 1.252 2.017 -14.716 359 HG12 VAL 49 HG12 VAL 49 -0.495 2.088 -14.954 360 HG13 VAL 49 HG13 VAL 49 0.344 0.538 -15.031 361 HG21 VAL 49 HG21 VAL 49 -0.137 0.747 -18.458 362 HG22 VAL 49 HG22 VAL 49 1.220 -0.058 -17.670 363 HG23 VAL 49 HG23 VAL 49 -0.380 -0.097 -16.928 364 H LEU 50 H LEU 50 1.380 4.846 -17.733 365 HA LEU 50 HA LEU 50 1.518 5.984 -15.145 366 HB2 LEU 50 HB2 LEU 50 2.174 7.315 -17.778 367 HB3 LEU 50 HB1 LEU 50 2.774 7.761 -16.171 368 HG LEU 50 HG LEU 50 3.403 5.117 -17.468 369 HD11 LEU 50 HD11 LEU 50 4.370 7.732 -18.160 370 HD12 LEU 50 HD12 LEU 50 4.752 6.167 -18.880 371 HD13 LEU 50 HD13 LEU 50 5.675 6.750 -17.494 372 HD21 LEU 50 HD21 LEU 50 4.555 6.647 -15.142 373 HD22 LEU 50 HD22 LEU 50 5.312 5.225 -15.860 374 HD23 LEU 50 HD23 LEU 50 3.725 5.092 -15.103 375 H LYS 51 H LYS 51 -0.715 6.325 -17.730 376 HA LYS 51 HA LYS 51 -1.694 8.921 -17.026 377 HB2 LYS 51 HB2 LYS 51 -2.837 6.700 -18.730 378 HB3 LYS 51 HB1 LYS 51 -3.618 8.275 -18.522 379 HG2 LYS 51 HG1 LYS 51 -1.141 9.066 -19.265 380 HG3 LYS 51 HG2 LYS 51 -1.274 7.525 -20.131 381 HD2 LYS 51 HD1 LYS 51 -2.216 8.900 -21.695 382 HD3 LYS 51 HD2 LYS 51 -3.662 8.496 -20.752 383 HE2 LYS 51 HE1 LYS 51 -3.271 10.570 -19.393 384 HE3 LYS 51 HE2 LYS 51 -1.976 10.985 -20.526 385 HZ1 LYS 51 3HZ LYS 51 -4.866 11.032 -20.918 386 HZ2 LYS 51 1HZ LYS 51 -3.921 10.581 -22.247 387 HZ3 LYS 51 2HZ LYS 51 -3.676 12.082 -21.506 388 H ALA 52 H ALA 52 -2.582 5.605 -16.252 389 HA ALA 52 HA ALA 52 -5.045 6.131 -15.002 390 HB1 ALA 52 HB1 ALA 52 -3.202 3.885 -15.211 391 HB2 ALA 52 HB2 ALA 52 -4.966 3.909 -15.188 392 HB3 ALA 52 HB3 ALA 52 -4.062 3.937 -13.674 393 H LEU 53 H LEU 53 -1.747 5.983 -13.713 394 HA LEU 53 HA LEU 53 -2.373 6.279 -11.003 395 HB2 LEU 53 HB2 LEU 53 0.068 7.260 -12.495 396 HB3 LEU 53 HB1 LEU 53 -0.068 7.071 -10.738 397 HG LEU 53 HG LEU 53 -0.224 4.810 -12.730 398 HD11 LEU 53 HD11 LEU 53 1.994 4.356 -12.379 399 HD12 LEU 53 HD12 LEU 53 2.036 5.200 -10.832 400 HD13 LEU 53 HD13 LEU 53 2.012 6.119 -12.337 401 HD21 LEU 53 HD21 LEU 53 0.423 3.798 -10.257 402 HD22 LEU 53 HD22 LEU 53 -1.170 3.746 -11.011 403 HD23 LEU 53 HD23 LEU 53 -0.772 5.040 -9.880 404 H GLU 54 H GLU 54 -2.515 8.528 -13.589 405 HA GLU 54 HA GLU 54 -2.160 10.931 -12.139 406 HB2 GLU 54 HB2 GLU 54 -3.841 10.535 -14.622 407 HB3 GLU 54 HB1 GLU 54 -3.103 12.042 -14.056 408 HG2 GLU 54 HG1 GLU 54 -1.708 9.609 -15.160 409 HG3 GLU 54 HG2 GLU 54 -1.799 11.229 -15.865 410 HE2 GLU 54 HE2 GLU 54 0.938 12.285 -14.096 411 H ARG 55 H ARG 55 -5.013 8.997 -12.928 412 HA ARG 55 HA ARG 55 -6.840 10.832 -11.692 413 HB2 ARG 55 HB2 ARG 55 -7.725 9.533 -13.462 414 HB3 ARG 55 HB1 ARG 55 -7.115 8.029 -12.758 415 HG2 ARG 55 HG1 ARG 55 -9.555 8.269 -12.523 416 HG3 ARG 55 HG2 ARG 55 -8.718 8.154 -10.966 417 HD2 ARG 55 HD1 ARG 55 -9.528 10.124 -10.311 418 HD3 ARG 55 HD2 ARG 55 -8.889 10.901 -11.766 419 HE ARG 55 HE ARG 55 -11.242 9.502 -12.419 420 HH11 ARG 55 1HH1 ARG 55 -10.171 12.319 -10.676 421 HH12 ARG 55 2HH1 ARG 55 -11.649 13.190 -10.918 422 HH21 ARG 55 1HH2 ARG 55 -13.192 10.639 -12.744 423 HH22 ARG 55 2HH2 ARG 55 -13.367 12.233 -12.092 424 H THR 56 H THR 56 -5.107 7.945 -10.731 425 HA THR 56 HA THR 56 -6.560 7.531 -8.304 426 HB THR 56 HB THR 56 -4.932 5.868 -7.759 427 HG1 THR 56 HG1 THR 56 -2.913 6.209 -8.258 428 HG21 THR 56 HG21 THR 56 -6.272 5.927 -10.238 429 HG22 THR 56 HG22 THR 56 -5.731 4.512 -9.335 430 HG23 THR 56 HG23 THR 56 -4.676 5.243 -10.544 431 H ARG 57 H ARG 57 -3.388 8.938 -9.078 432 HA ARG 57 HA ARG 57 -2.536 9.525 -6.507 433 HB2 ARG 57 HB2 ARG 57 -1.022 11.096 -7.473 434 HB3 ARG 57 HB1 ARG 57 -1.204 9.764 -8.624 435 HG2 ARG 57 HG1 ARG 57 -2.580 11.048 -10.062 436 HG3 ARG 57 HG2 ARG 57 -2.774 12.316 -8.840 437 HD2 ARG 57 HD1 ARG 57 -1.181 12.946 -10.632 438 HD3 ARG 57 HD2 ARG 57 -0.449 12.923 -9.021 439 HE ARG 57 HE ARG 57 -0.099 10.433 -10.350 440 HH11 ARG 57 1HH1 ARG 57 1.090 13.702 -10.206 441 HH12 ARG 57 2HH1 ARG 57 2.672 13.291 -10.778 442 HH21 ARG 57 1HH2 ARG 57 1.981 9.878 -11.104 443 HH22 ARG 57 2HH2 ARG 57 3.178 11.115 -11.290 444 H GLN 58 H GLN 58 -4.943 11.093 -8.462 445 HA GLN 58 HA GLN 58 -5.056 13.574 -7.144 446 HB2 GLN 58 HB2 GLN 58 -7.032 11.980 -8.756 447 HB3 GLN 58 HB1 GLN 58 -7.507 13.504 -7.988 448 HG2 GLN 58 HG1 GLN 58 -5.186 13.233 -9.897 449 HG3 GLN 58 HG2 GLN 58 -6.823 13.709 -10.373 450 HE21 GLN 58 HE21 GLN 58 -3.995 14.636 -8.549 451 HE22 GLN 58 HE22 GLN 58 -4.370 16.319 -8.449 452 H LEU 59 H LEU 59 -6.664 10.494 -6.510 453 HA LEU 59 HA LEU 59 -8.038 11.613 -4.198 454 HB2 LEU 59 HB2 LEU 59 -8.058 8.742 -5.116 455 HB3 LEU 59 HB1 LEU 59 -9.232 9.571 -4.079 456 HG LEU 59 HG LEU 59 -9.091 10.848 -6.659 457 HD11 LEU 59 HD11 LEU 59 -9.644 7.887 -6.630 458 HD12 LEU 59 HD12 LEU 59 -8.400 8.735 -7.549 459 HD13 LEU 59 HD13 LEU 59 -10.103 8.975 -7.940 460 HD21 LEU 59 HD21 LEU 59 -11.372 9.294 -5.469 461 HD22 LEU 59 HD22 LEU 59 -11.435 10.688 -6.547 462 HD23 LEU 59 HD23 LEU 59 -10.904 10.888 -4.876 463 H ASP 60 H ASP 60 -5.014 10.943 -4.566 464 HA ASP 60 HA ASP 60 -3.300 10.352 -3.191 465 HB2 ASP 60 HB2 ASP 60 -5.237 9.920 -0.931 466 HB3 ASP 60 HB1 ASP 60 -3.585 10.551 -0.880 467 HD2 ASP 60 HD2 ASP 60 -6.487 13.097 -1.153 468 H ILE 61 H ILE 61 -3.327 8.397 -4.574 469 HA ILE 61 HA ILE 61 -3.809 6.006 -2.928 470 HB ILE 61 HB ILE 61 -4.192 6.060 -5.917 471 HG12 ILE 61 HG11 ILE 61 -6.330 6.107 -3.773 472 HG13 ILE 61 HG12 ILE 61 -5.855 7.509 -4.746 473 HG21 ILE 61 HG21 ILE 61 -3.620 3.918 -4.623 474 HG22 ILE 61 HG22 ILE 61 -5.254 4.039 -3.975 475 HG23 ILE 61 HG23 ILE 61 -5.006 3.882 -5.714 476 HD11 ILE 61 HD11 ILE 61 -7.751 5.498 -5.366 477 HD12 ILE 61 HD12 ILE 61 -7.302 6.922 -6.304 478 HD13 ILE 61 HD13 ILE 61 -6.436 5.403 -6.537 479 HA PRO 62 HA PRO 62 0.478 5.283 -3.767 480 HB2 PRO 62 HB2 PRO 62 0.599 2.743 -2.750 481 HB3 PRO 62 HB1 PRO 62 0.521 4.191 -1.746 482 HG2 PRO 62 HG1 PRO 62 -1.684 2.343 -2.595 483 HG3 PRO 62 HG2 PRO 62 -1.343 3.038 -0.966 484 HD2 PRO 62 HD1 PRO 62 -3.266 4.026 -2.608 485 HD3 PRO 62 HD2 PRO 62 -2.322 5.051 -1.514 486 H ASP 63 H ASP 63 1.621 4.447 -5.431 487 HA ASP 63 HA ASP 63 0.265 3.201 -7.585 488 HB2 ASP 63 HB2 ASP 63 3.259 3.364 -7.167 489 HB3 ASP 63 HB1 ASP 63 2.400 3.177 -8.701 490 HD2 ASP 63 HD2 ASP 63 1.224 6.630 -8.088 491 H GLU 64 H GLU 64 1.486 1.948 -4.727 492 HA GLU 64 HA GLU 64 2.388 -0.590 -5.703 493 HB2 GLU 64 HB2 GLU 64 1.494 0.055 -2.890 494 HB3 GLU 64 HB1 GLU 64 2.607 -1.219 -3.410 495 HG2 GLU 64 HG1 GLU 64 4.057 0.747 -4.294 496 HG3 GLU 64 HG2 GLU 64 3.081 1.718 -3.182 497 HE2 GLU 64 HE2 GLU 64 5.867 0.641 -1.231 498 H LYS 65 H LYS 65 -0.637 0.721 -4.518 499 HA LYS 65 HA LYS 65 -1.907 -1.910 -4.672 500 HB2 LYS 65 HB2 LYS 65 -3.676 -1.049 -3.411 501 HB3 LYS 65 HB1 LYS 65 -2.246 -0.256 -2.728 502 HG2 LYS 65 HG1 LYS 65 -2.730 1.724 -4.172 503 HG3 LYS 65 HG2 LYS 65 -4.248 0.934 -4.632 504 HD2 LYS 65 HD1 LYS 65 -3.423 1.667 -1.813 505 HD3 LYS 65 HD2 LYS 65 -4.586 2.549 -2.819 506 HE2 LYS 65 HE1 LYS 65 -6.144 1.268 -1.828 507 HE3 LYS 65 HE2 LYS 65 -5.573 0.005 -2.928 508 HZ1 LYS 65 3HZ LYS 65 -5.696 -0.481 -0.417 509 HZ2 LYS 65 1HZ LYS 65 -4.249 0.393 -0.325 510 HZ3 LYS 65 2HZ LYS 65 -4.338 -1.000 -1.280 511 H THR 66 H THR 66 -1.820 1.196 -6.260 512 HA THR 66 HA THR 66 -4.150 0.831 -7.853 513 HB THR 66 HB THR 66 -1.767 2.626 -8.351 514 HG1 THR 66 HG1 THR 66 -2.650 3.903 -6.916 515 HG21 THR 66 HG21 THR 66 -3.173 2.204 -10.352 516 HG22 THR 66 HG22 THR 66 -3.230 3.883 -9.813 517 HG23 THR 66 HG23 THR 66 -4.572 2.796 -9.457 518 H MET 67 H MET 67 -0.793 -0.075 -8.182 519 HA MET 67 HA MET 67 -0.551 -0.509 -10.889 520 HB2 MET 67 HB2 MET 67 0.693 -1.600 -8.454 521 HB3 MET 67 HB1 MET 67 0.787 -2.663 -9.866 522 HG2 MET 67 HG1 MET 67 1.582 0.224 -10.057 523 HG3 MET 67 HG2 MET 67 2.696 -0.999 -9.440 524 HE1 MET 67 HE1 MET 67 0.486 -0.686 -13.204 525 HE2 MET 67 HE2 MET 67 0.843 0.584 -12.034 526 HE3 MET 67 HE3 MET 67 1.888 0.357 -13.437 527 HA PRO 68 HA PRO 68 -2.378 -4.950 -10.414 528 HB2 PRO 68 HB2 PRO 68 -3.509 -5.613 -8.010 529 HB3 PRO 68 HB1 PRO 68 -1.802 -5.853 -8.381 530 HG2 PRO 68 HG1 PRO 68 -3.128 -3.605 -6.903 531 HG3 PRO 68 HG2 PRO 68 -1.634 -4.521 -6.481 532 HD2 PRO 68 HD1 PRO 68 -1.569 -2.051 -7.606 533 HD3 PRO 68 HD2 PRO 68 -0.348 -3.290 -7.945 534 H VAL 69 H VAL 69 -3.851 -2.105 -9.193 535 HA VAL 69 HA VAL 69 -6.572 -3.022 -9.416 536 HB VAL 69 HB VAL 69 -5.344 -0.313 -8.958 537 HG11 VAL 69 HG11 VAL 69 -7.173 0.485 -10.029 538 HG12 VAL 69 HG12 VAL 69 -8.096 -1.001 -9.790 539 HG13 VAL 69 HG13 VAL 69 -7.933 0.160 -8.472 540 HG21 VAL 69 HG21 VAL 69 -7.324 -1.386 -7.091 541 HG22 VAL 69 HG22 VAL 69 -5.872 -2.375 -7.244 542 HG23 VAL 69 HG23 VAL 69 -5.738 -0.679 -6.781 543 H LEU 70 H LEU 70 -4.646 -0.594 -11.187 544 HA LEU 70 HA LEU 70 -6.495 -0.140 -13.229 545 HB2 LEU 70 HB2 LEU 70 -4.650 0.813 -14.494 546 HB3 LEU 70 HB1 LEU 70 -4.595 1.320 -12.796 547 HG LEU 70 HG LEU 70 -2.921 -0.759 -12.656 548 HD11 LEU 70 HD11 LEU 70 -3.278 -0.306 -15.475 549 HD12 LEU 70 HD12 LEU 70 -2.360 -1.563 -14.646 550 HD13 LEU 70 HD13 LEU 70 -1.606 -0.009 -15.001 551 HD21 LEU 70 HD21 LEU 70 -2.425 2.098 -13.419 552 HD22 LEU 70 HD22 LEU 70 -1.090 0.973 -13.172 553 HD23 LEU 70 HD23 LEU 70 -2.215 1.311 -11.855 554 H MET 71 H MET 71 -3.796 -2.434 -13.053 555 HA MET 71 HA MET 71 -3.985 -3.455 -15.647 556 HB2 MET 71 HB2 MET 71 -2.722 -4.234 -13.123 557 HB3 MET 71 HB1 MET 71 -3.174 -5.614 -14.134 558 HG2 MET 71 HG1 MET 71 -1.476 -3.283 -15.029 559 HG3 MET 71 HG2 MET 71 -0.874 -4.867 -14.533 560 HE1 MET 71 HE1 MET 71 -2.910 -2.941 -17.441 561 HE2 MET 71 HE2 MET 71 -1.165 -2.770 -17.243 562 HE3 MET 71 HE3 MET 71 -1.815 -3.624 -18.645 563 H LYS 72 H LYS 72 -5.940 -3.999 -12.841 564 HA LYS 72 HA LYS 72 -7.101 -6.465 -13.598 565 HB2 LYS 72 HB2 LYS 72 -7.153 -5.400 -11.305 566 HB3 LYS 72 HB1 LYS 72 -8.408 -4.317 -11.928 567 HG2 LYS 72 HG1 LYS 72 -9.543 -6.042 -10.791 568 HG3 LYS 72 HG2 LYS 72 -9.732 -6.378 -12.521 569 HD2 LYS 72 HD1 LYS 72 -9.209 -8.460 -11.537 570 HD3 LYS 72 HD2 LYS 72 -7.709 -7.903 -12.300 571 HE2 LYS 72 HE1 LYS 72 -7.161 -8.763 -10.125 572 HE3 LYS 72 HE2 LYS 72 -6.989 -7.003 -10.093 573 HZ1 LYS 72 3HZ LYS 72 -9.064 -6.794 -8.964 574 HZ2 LYS 72 1HZ LYS 72 -8.144 -7.943 -8.132 575 HZ3 LYS 72 2HZ LYS 72 -9.405 -8.441 -9.142 576 H LEU 73 H LEU 73 -7.752 -3.150 -14.461 577 HA LEU 73 HA LEU 73 -10.331 -3.645 -15.600 578 HB2 LEU 73 HB2 LEU 73 -8.619 -1.336 -16.426 579 HB3 LEU 73 HB1 LEU 73 -10.369 -1.411 -16.163 580 HG LEU 73 HG LEU 73 -8.213 -1.266 -14.063 581 HD11 LEU 73 HD11 LEU 73 -8.604 0.883 -14.910 582 HD12 LEU 73 HD12 LEU 73 -9.594 0.787 -13.455 583 HD13 LEU 73 HD13 LEU 73 -10.341 0.610 -15.043 584 HD21 LEU 73 HD21 LEU 73 -9.781 -2.711 -13.107 585 HD22 LEU 73 HD22 LEU 73 -11.144 -1.867 -13.840 586 HD23 LEU 73 HD23 LEU 73 -10.249 -1.117 -12.517 587 H LEU 74 H LEU 74 -7.045 -3.325 -16.875 588 HA LEU 74 HA LEU 74 -7.756 -3.531 -19.606 589 HB2 LEU 74 HB2 LEU 74 -5.182 -4.034 -18.119 590 HB3 LEU 74 HB1 LEU 74 -5.324 -4.180 -19.880 591 HG LEU 74 HG LEU 74 -4.367 -2.055 -19.408 592 HD11 LEU 74 HD11 LEU 74 -5.593 -1.116 -20.995 593 HD12 LEU 74 HD12 LEU 74 -6.914 -0.840 -19.861 594 HD13 LEU 74 HD13 LEU 74 -6.819 -2.360 -20.750 595 HD21 LEU 74 HD21 LEU 74 -5.180 -1.985 -17.035 596 HD22 LEU 74 HD22 LEU 74 -6.730 -1.415 -17.655 597 HD23 LEU 74 HD23 LEU 74 -5.271 -0.453 -17.902 598 H GLU 75 H GLU 75 -7.376 -5.856 -17.086 599 HA GLU 75 HA GLU 75 -6.765 -8.151 -18.563 600 HB2 GLU 75 HB2 GLU 75 -8.136 -7.636 -15.950 601 HB3 GLU 75 HB1 GLU 75 -8.162 -9.269 -16.635 602 HG2 GLU 75 HG1 GLU 75 -5.579 -7.778 -16.326 603 HG3 GLU 75 HG2 GLU 75 -6.305 -8.647 -14.967 604 HE2 GLU 75 HE2 GLU 75 -4.099 -10.792 -17.083 605 H GLU 76 H GLU 76 -9.957 -6.944 -17.530 606 HA GLU 76 HA GLU 76 -11.346 -8.874 -19.139 607 HB2 GLU 76 HB2 GLU 76 -12.483 -6.389 -17.846 608 HB3 GLU 76 HB1 GLU 76 -13.363 -7.843 -18.343 609 HG2 GLU 76 HG1 GLU 76 -11.268 -7.771 -16.173 610 HG3 GLU 76 HG2 GLU 76 -13.014 -7.672 -15.901 611 HE2 GLU 76 HE2 GLU 76 -13.381 -11.073 -16.907 612 H ALA 77 H ALA 77 -10.328 -5.553 -19.482 613 HA ALA 77 HA ALA 77 -11.914 -5.106 -21.859 614 HB1 ALA 77 HB1 ALA 77 -9.740 -3.405 -20.644 615 HB2 ALA 77 HB2 ALA 77 -11.465 -3.271 -20.295 616 HB3 ALA 77 HB3 ALA 77 -10.862 -2.916 -21.915 617 H GLY 78 H GLY 78 -9.320 -6.962 -21.349 618 HA2 GLY 78 HA2 GLY 78 -7.631 -7.793 -22.663 619 HA3 GLY 78 3HA GLY 78 -8.640 -7.311 -24.017 620 H GLY 79 H GLY 79 -7.536 -4.898 -21.788 621 HA2 GLY 79 HA2 GLY 79 -5.694 -3.449 -21.925 622 HA3 GLY 79 3HA GLY 79 -5.245 -4.199 -23.449 623 H ASN 80 H ASN 80 -8.402 -2.872 -22.581 624 HA ASN 80 HA ASN 80 -8.045 -0.876 -24.720 625 HB2 ASN 80 HB2 ASN 80 -9.858 -2.868 -24.757 626 HB3 ASN 80 HB1 ASN 80 -10.789 -1.644 -23.884 627 HD21 ASN 80 HD21 ASN 80 -10.419 0.646 -24.947 628 HD22 ASN 80 HD22 ASN 80 -10.713 0.678 -26.649 629 H TRP 81 H TRP 81 -7.542 0.977 -23.711 630 HA TRP 81 HA TRP 81 -8.676 1.687 -21.162 631 HB2 TRP 81 HB2 TRP 81 -6.966 3.307 -23.073 632 HB3 TRP 81 HB1 TRP 81 -7.364 3.764 -21.416 633 HD1 TRP 81 HD1 TRP 81 -5.330 1.099 -23.324 634 HE1 TRP 81 HE1 TRP 81 -3.501 0.204 -21.750 635 HE3 TRP 81 HE3 TRP 81 -6.692 3.526 -19.036 636 HZ2 TRP 81 2HZ TRP 81 -2.737 0.490 -19.047 637 HZ3 TRP 81 3HZ TRP 81 -5.359 3.161 -17.000 638 HH2 TRP 81 HH TRP 81 -3.423 1.673 -17.007 639 H SER 82 H SER 82 -9.448 2.208 -24.474 640 HA SER 82 HA SER 82 -10.784 4.620 -24.466 641 HB2 SER 82 HB2 SER 82 -10.363 2.980 -26.414 642 HB3 SER 82 HB1 SER 82 -11.882 2.216 -25.914 643 HG SER 82 HG SER 82 -11.839 4.991 -26.279 644 H TYR 83 H TYR 83 -12.163 1.414 -23.749 645 HA TYR 83 HA TYR 83 -14.679 2.527 -22.933 646 HB2 TYR 83 HB2 TYR 83 -14.917 0.394 -23.823 647 HB3 TYR 83 HB1 TYR 83 -13.487 -0.222 -22.988 648 HD1 TYR 83 HD1 TYR 83 -17.059 0.513 -22.651 649 HD2 TYR 83 HD2 TYR 83 -13.591 -0.965 -20.678 650 HE1 TYR 83 HE1 TYR 83 -18.476 -0.417 -20.869 651 HE2 TYR 83 HE2 TYR 83 -14.999 -1.900 -18.891 652 HH TYR 83 HH TYR 83 -18.005 -1.019 -18.269 653 H ILE 84 H ILE 84 -11.849 1.179 -21.296 654 HA ILE 84 HA ILE 84 -12.840 1.189 -18.682 655 HB ILE 84 HB ILE 84 -10.012 1.575 -19.665 656 HG12 ILE 84 HG11 ILE 84 -11.352 -0.859 -18.466 657 HG13 ILE 84 HG12 ILE 84 -11.188 -0.582 -20.208 658 HG21 ILE 84 HG21 ILE 84 -9.628 2.275 -17.565 659 HG22 ILE 84 HG22 ILE 84 -11.154 1.630 -16.962 660 HG23 ILE 84 HG23 ILE 84 -9.764 0.563 -17.162 661 HD11 ILE 84 HD11 ILE 84 -8.876 -0.836 -20.164 662 HD12 ILE 84 HD12 ILE 84 -8.792 -0.612 -18.416 663 HD13 ILE 84 HD13 ILE 84 -9.473 -2.096 -19.084 664 H LYS 85 H LYS 85 -11.739 3.778 -20.705 665 HA LYS 85 HA LYS 85 -11.639 5.641 -18.452 666 HB2 LYS 85 HB2 LYS 85 -10.390 7.047 -19.756 667 HB3 LYS 85 HB1 LYS 85 -9.970 5.496 -20.500 668 HG2 LYS 85 HG1 LYS 85 -12.102 6.103 -21.998 669 HG3 LYS 85 HG2 LYS 85 -11.572 7.738 -21.567 670 HD2 LYS 85 HD1 LYS 85 -9.967 5.590 -22.960 671 HD3 LYS 85 HD2 LYS 85 -10.496 7.149 -23.616 672 HE2 LYS 85 HE1 LYS 85 -9.093 7.885 -21.356 673 HE3 LYS 85 HE2 LYS 85 -8.175 6.503 -21.972 674 HZ1 LYS 85 3HZ LYS 85 -8.096 9.105 -22.896 675 HZ2 LYS 85 1HZ LYS 85 -8.892 8.223 -24.102 676 HZ3 LYS 85 2HZ LYS 85 -7.352 7.752 -23.587 677 H LEU 86 H LEU 86 -14.031 4.354 -20.104 678 HA LEU 86 HA LEU 86 -15.476 6.493 -21.217 679 HB2 LEU 86 HB2 LEU 86 -15.939 4.070 -21.577 680 HB3 LEU 86 HB1 LEU 86 -16.589 4.004 -19.929 681 HG LEU 86 HG LEU 86 -17.806 6.020 -21.711 682 HD11 LEU 86 HD11 LEU 86 -18.220 3.063 -22.124 683 HD12 LEU 86 HD12 LEU 86 -17.552 4.206 -23.288 684 HD13 LEU 86 HD13 LEU 86 -19.240 4.336 -22.794 685 HD21 LEU 86 HD21 LEU 86 -18.515 4.308 -19.422 686 HD22 LEU 86 HD22 LEU 86 -19.803 4.588 -20.595 687 HD23 LEU 86 HD23 LEU 86 -19.012 5.955 -19.810 688 H ASP 87 H ASP 87 -14.792 5.703 -17.977 689 HA ASP 87 HA ASP 87 -16.677 7.768 -17.079 690 HB2 ASP 87 HB2 ASP 87 -16.146 5.306 -15.420 691 HB3 ASP 87 HB1 ASP 87 -17.441 6.498 -15.244 692 HD2 ASP 87 HD2 ASP 87 -17.960 3.504 -17.747 693 H ASN 88 H ASN 88 -13.763 7.687 -17.638 694 HA ASN 88 HA ASN 88 -11.878 8.619 -16.770 695 HB2 ASN 88 HB2 ASN 88 -13.858 10.019 -15.592 696 HB3 ASN 88 HB1 ASN 88 -13.118 9.294 -14.159 697 HD21 ASN 88 HD21 ASN 88 -10.535 9.306 -14.520 698 HD22 ASN 88 HD22 ASN 88 -9.919 10.893 -14.812 699 H TYR 89 H TYR 89 -12.307 5.867 -16.460 700 HA TYR 89 HA TYR 89 -11.438 4.050 -15.403 701 HB2 TYR 89 HB2 TYR 89 -9.784 6.087 -13.885 702 HB3 TYR 89 HB1 TYR 89 -9.442 4.361 -14.031 703 HD1 TYR 89 HD2 TYR 89 -10.220 4.168 -17.015 704 HD2 TYR 89 HD1 TYR 89 -7.703 6.826 -14.846 705 HE1 TYR 89 HE2 TYR 89 -8.902 4.572 -19.052 706 HE2 TYR 89 HE1 TYR 89 -6.378 7.239 -16.877 707 HH TYR 89 HH TYR 89 -6.153 6.823 -19.045 708 H THR 90 H THR 90 -13.843 5.066 -14.406 709 HA THR 90 HA THR 90 -14.047 5.526 -11.697 710 HB THR 90 HB THR 90 -15.916 4.011 -13.521 711 HG1 THR 90 HG1 THR 90 -15.587 6.680 -12.713 712 HG21 THR 90 HG21 THR 90 -16.707 3.227 -11.518 713 HG22 THR 90 HG22 THR 90 -17.560 4.769 -11.588 714 HG23 THR 90 HG23 THR 90 -16.100 4.612 -10.611 715 H ALA 91 H ALA 91 -13.502 2.503 -13.380 716 HA ALA 91 HA ALA 91 -14.109 0.645 -11.434 717 HB1 ALA 91 HB1 ALA 91 -12.417 -0.801 -12.493 718 HB2 ALA 91 HB2 ALA 91 -11.821 0.592 -13.398 719 HB3 ALA 91 HB3 ALA 91 -13.459 -0.005 -13.672 720 H LEU 92 H LEU 92 -11.279 2.714 -11.704 721 HA LEU 92 HA LEU 92 -9.749 1.450 -9.678 722 HB2 LEU 92 HB2 LEU 92 -8.228 3.174 -9.920 723 HB3 LEU 92 HB1 LEU 92 -9.016 3.113 -11.506 724 HG LEU 92 HG LEU 92 -10.551 4.978 -10.399 725 HD11 LEU 92 HD11 LEU 92 -9.790 5.403 -8.320 726 HD12 LEU 92 HD12 LEU 92 -8.637 6.420 -9.185 727 HD13 LEU 92 HD13 LEU 92 -8.170 4.800 -8.669 728 HD21 LEU 92 HD21 LEU 92 -8.005 6.158 -11.184 729 HD22 LEU 92 HD22 LEU 92 -9.594 6.284 -11.938 730 HD23 LEU 92 HD23 LEU 92 -8.558 4.901 -12.291 731 H VAL 93 H VAL 93 -12.169 3.991 -9.666 732 HA VAL 93 HA VAL 93 -11.751 4.948 -7.054 733 HB VAL 93 HB VAL 93 -14.201 4.923 -8.808 734 HG11 VAL 93 HG11 VAL 93 -15.259 5.043 -6.775 735 HG12 VAL 93 HG12 VAL 93 -13.883 5.812 -5.980 736 HG13 VAL 93 HG13 VAL 93 -14.916 6.748 -7.061 737 HG21 VAL 93 HG21 VAL 93 -13.078 7.478 -8.010 738 HG22 VAL 93 HG22 VAL 93 -11.902 6.462 -8.845 739 HG23 VAL 93 HG23 VAL 93 -13.437 6.856 -9.621 740 H ASP 94 H ASP 94 -14.014 2.493 -8.289 741 HA ASP 94 HA ASP 94 -14.983 1.817 -5.683 742 HB2 ASP 94 HB2 ASP 94 -16.168 1.536 -7.966 743 HB3 ASP 94 HB1 ASP 94 -15.223 0.048 -8.105 744 HD2 ASP 94 HD2 ASP 94 -17.581 -1.583 -6.259 745 H ALA 95 H ALA 95 -12.419 0.691 -7.756 746 HA ALA 95 HA ALA 95 -11.957 -1.784 -6.428 747 HB1 ALA 95 HB1 ALA 95 -11.056 -1.777 -8.542 748 HB2 ALA 95 HB2 ALA 95 -9.624 -1.446 -7.565 749 HB3 ALA 95 HB3 ALA 95 -10.450 -0.127 -8.396 750 H ILE 96 H ILE 96 -10.146 1.292 -6.367 751 HA ILE 96 HA ILE 96 -8.381 0.577 -4.317 752 HB ILE 96 HB ILE 96 -9.387 3.318 -5.089 753 HG12 ILE 96 HG11 ILE 96 -8.242 2.077 -6.886 754 HG13 ILE 96 HG12 ILE 96 -7.307 3.483 -6.351 755 HG21 ILE 96 HG21 ILE 96 -7.063 2.513 -3.346 756 HG22 ILE 96 HG22 ILE 96 -7.341 4.142 -3.962 757 HG23 ILE 96 HG23 ILE 96 -8.500 3.409 -2.854 758 HD11 ILE 96 HD11 ILE 96 -5.853 1.581 -6.713 759 HD12 ILE 96 HD12 ILE 96 -5.876 2.028 -5.006 760 HD13 ILE 96 HD13 ILE 96 -6.789 0.627 -5.563 761 H TYR 97 H TYR 97 -11.595 2.017 -4.210 762 HA TYR 97 HA TYR 97 -11.647 2.734 -1.505 763 HB2 TYR 97 HB2 TYR 97 -13.651 2.233 -3.629 764 HB3 TYR 97 HB1 TYR 97 -14.241 2.091 -1.971 765 HD1 TYR 97 HD1 TYR 97 -11.730 4.435 -3.427 766 HD2 TYR 97 HD2 TYR 97 -15.516 3.982 -1.542 767 HE1 TYR 97 HE1 TYR 97 -11.938 6.880 -3.270 768 HE2 TYR 97 HE2 TYR 97 -15.735 6.426 -1.381 769 HH TYR 97 HH TYR 97 -14.493 8.493 -2.963 770 H SER 98 H SER 98 -12.178 -0.341 -3.101 771 HA SER 98 HA SER 98 -13.206 -1.661 -0.772 772 HB2 SER 98 HB2 SER 98 -12.299 -2.566 -3.498 773 HB3 SER 98 HB1 SER 98 -12.633 -3.748 -2.220 774 HG SER 98 HG SER 98 -14.492 -3.352 -3.471 775 H VAL 99 H VAL 99 -10.131 -1.905 -2.562 776 HA VAL 99 HA VAL 99 -8.831 -3.602 -0.756 777 HB VAL 99 HB VAL 99 -7.497 -1.505 -2.468 778 HG11 VAL 99 HG11 VAL 99 -5.572 -2.898 -2.396 779 HG12 VAL 99 HG12 VAL 99 -6.132 -2.707 -0.733 780 HG13 VAL 99 HG13 VAL 99 -6.466 -4.200 -1.610 781 HG21 VAL 99 HG21 VAL 99 -8.575 -2.561 -4.146 782 HG22 VAL 99 HG22 VAL 99 -7.312 -3.771 -3.919 783 HG23 VAL 99 HG23 VAL 99 -8.897 -4.000 -3.177 784 H GLU 100 H GLU 100 -8.595 -0.056 -1.065 785 HA GLU 100 HA GLU 100 -6.872 0.456 1.021 786 HB2 GLU 100 HB2 GLU 100 -7.582 2.684 0.955 787 HB3 GLU 100 HB1 GLU 100 -7.916 2.080 -0.676 788 HG2 GLU 100 HG1 GLU 100 -10.276 1.709 -0.024 789 HG3 GLU 100 HG2 GLU 100 -9.912 2.437 1.547 790 HE2 GLU 100 HE2 GLU 100 -11.123 5.200 -0.284 791 H ASP 101 H ASP 101 -10.265 -0.358 1.132 792 HA ASP 101 HA ASP 101 -10.424 0.187 3.990 793 HB2 ASP 101 HB2 ASP 101 -12.285 0.646 2.242 794 HB3 ASP 101 HB1 ASP 101 -12.600 -1.091 2.357 795 HD2 ASP 101 HD2 ASP 101 -13.260 0.990 5.680 796 H GLU 102 H GLU 102 -11.360 -1.504 5.424 797 HA GLU 102 HA GLU 102 -11.064 -3.498 6.487 798 HB2 GLU 102 HB2 GLU 102 -11.387 -4.699 3.731 799 HB3 GLU 102 HB1 GLU 102 -11.777 -5.446 5.288 800 HG2 GLU 102 HG1 GLU 102 -13.596 -3.897 5.640 801 HG3 GLU 102 HG2 GLU 102 -13.170 -3.032 4.156 802 HE2 GLU 102 HE2 GLU 102 -15.686 -5.862 3.776 803 H ASN 103 H ASN 103 -8.768 -2.773 6.727 804 HA ASN 103 HA ASN 103 -6.869 -4.309 5.119 805 HB2 ASN 103 HB2 ASN 103 -6.668 -1.925 6.922 806 HB3 ASN 103 HB1 ASN 103 -5.232 -2.923 6.664 807 HD21 ASN 103 HD21 ASN 103 -7.837 -2.074 4.431 808 HD22 ASN 103 HD22 ASN 103 -6.823 -1.293 3.270 809 H LYS 104 H LYS 104 -8.295 -4.197 8.267 810 HA LYS 104 HA LYS 104 -6.429 -6.264 9.220 811 HB2 LYS 104 HB2 LYS 104 -7.214 -5.706 11.487 812 HB3 LYS 104 HB1 LYS 104 -6.518 -4.303 10.659 813 HG2 LYS 104 HG1 LYS 104 -8.360 -3.278 11.460 814 HG3 LYS 104 HG2 LYS 104 -9.091 -3.966 9.998 815 HD2 LYS 104 HD1 LYS 104 -10.550 -4.459 11.826 816 HD3 LYS 104 HD2 LYS 104 -9.742 -5.966 11.358 817 HE2 LYS 104 HE1 LYS 104 -9.850 -5.650 13.818 818 HE3 LYS 104 HE2 LYS 104 -8.197 -5.775 13.196 819 HZ1 LYS 104 3HZ LYS 104 -7.724 -3.670 13.770 820 HZ2 LYS 104 1HZ LYS 104 -9.012 -3.858 14.852 821 HZ3 LYS 104 2HZ LYS 104 -9.259 -3.082 13.370 822 H GLN 105 H GLN 105 -9.536 -5.789 8.029 823 HA GLN 105 HA GLN 105 -11.059 -7.609 9.521 824 HB2 GLN 105 HB2 GLN 105 -11.344 -7.009 6.569 825 HB3 GLN 105 HB1 GLN 105 -12.600 -7.617 7.660 826 HG2 GLN 105 HG1 GLN 105 -11.262 -4.934 7.982 827 HG3 GLN 105 HG2 GLN 105 -12.772 -5.191 7.096 828 HE21 GLN 105 HE21 GLN 105 -11.411 -4.523 10.074 829 HE22 GLN 105 HE22 GLN 105 -12.804 -4.777 11.063 830 H SER 106 H SER 106 -12.090 -9.490 7.857 831 HA SER 106 HA SER 106 -10.386 -11.646 8.126 832 HB2 SER 106 HB2 SER 106 -12.617 -12.236 7.812 833 HB3 SER 106 HB1 SER 106 -12.805 -11.152 6.423 834 HG SER 106 HG SER 106 -12.308 -13.713 6.345 835 H GLU 107 H GLU 107 -10.872 -9.546 5.323 836 HA GLU 107 HA GLU 107 -8.408 -10.665 4.164 837 HB2 GLU 107 HB2 GLU 107 -11.085 -10.272 2.926 838 HB3 GLU 107 HB1 GLU 107 -9.669 -9.897 1.932 839 HG2 GLU 107 HG1 GLU 107 -8.795 -12.147 2.283 840 HG3 GLU 107 HG2 GLU 107 -10.195 -12.527 3.295 841 HE2 GLU 107 HE2 GLU 107 -10.566 -12.802 -0.583 842 H GLY 108 H GLY 108 -7.119 -9.214 2.951 843 HA2 GLY 108 HA2 GLY 108 -7.823 -6.471 2.608 844 HA3 GLY 108 3HA GLY 108 -6.776 -6.687 4.003 845 H SER 109 H SER 109 -4.886 -8.344 3.382 846 HA SER 109 HA SER 109 -3.753 -7.408 0.828 847 HB2 SER 109 HB2 SER 109 -2.534 -6.209 2.455 848 HB3 SER 109 HB1 SER 109 -2.457 -7.608 3.542 849 HG SER 109 HG SER 109 -0.477 -7.414 2.541 Start of MODEL 11 1 H1 MET 1 H MET 1 52.204 41.686 67.297 2 HA MET 1 HA MET 1 53.373 41.887 64.925 3 HB2 MET 1 HB2 MET 1 51.936 39.425 65.942 4 HB3 MET 1 HB1 MET 1 53.104 39.417 64.612 5 HG2 MET 1 HG1 MET 1 54.909 39.801 65.986 6 HG3 MET 1 HG2 MET 1 53.919 40.568 67.230 7 HE1 MET 1 HE1 MET 1 55.625 37.671 65.896 8 HE2 MET 1 HE2 MET 1 55.196 36.284 66.898 9 HE3 MET 1 HE3 MET 1 54.156 36.758 65.555 10 H GLY 2 H GLY 2 52.947 41.448 62.730 11 HA2 GLY 2 HA2 GLY 2 50.219 40.942 61.885 12 HA3 GLY 2 3HA GLY 2 50.817 42.555 61.525 13 H SER 3 H SER 3 51.619 39.121 61.099 14 HA SER 3 HA SER 3 53.492 39.577 59.012 15 HB2 SER 3 HB2 SER 3 53.030 37.056 58.566 16 HB3 SER 3 HB1 SER 3 53.774 37.526 60.104 17 HG SER 3 HG SER 3 52.076 36.832 61.126 18 H SER 4 H SER 4 53.061 40.246 57.027 19 HA SER 4 HA SER 4 50.372 39.873 55.936 20 HB2 SER 4 HB2 SER 4 51.260 41.477 54.139 21 HB3 SER 4 HB1 SER 4 51.047 42.133 55.771 22 HG SER 4 HG SER 4 53.057 42.759 55.060 23 H HIS 5 H HIS 5 49.937 38.630 54.201 24 HA HIS 5 HA HIS 5 51.936 37.778 52.344 25 HB2 HIS 5 HB2 HIS 5 52.128 36.318 54.532 26 HB3 HIS 5 HB1 HIS 5 50.725 35.491 53.848 27 HD1 HIS 5 HD1 HIS 5 54.131 36.571 52.508 28 HD2 HIS 5 HD2 HIS 5 51.464 33.389 52.339 29 HE1 HIS 5 HE1 HIS 5 55.241 34.839 51.061 30 HE2 HIS 5 HE2 HIS 5 53.614 32.893 50.958 31 H HIS 6 H HIS 6 50.859 37.871 50.496 32 HA HIS 6 HA HIS 6 48.252 36.560 50.297 33 HB2 HIS 6 HB2 HIS 6 48.844 39.441 49.659 34 HB3 HIS 6 HB1 HIS 6 47.556 38.577 48.815 35 HD1 HIS 6 HD1 HIS 6 45.928 37.212 50.748 36 HD2 HIS 6 HD2 HIS 6 47.794 40.786 51.756 37 HE1 HIS 6 HE1 HIS 6 44.636 38.117 52.707 38 HE2 HIS 6 HE2 HIS 6 45.775 40.301 53.324 39 H HIS 7 H HIS 7 47.557 36.854 47.797 40 HA HIS 7 HA HIS 7 49.680 36.818 45.903 41 HB2 HIS 7 HB2 HIS 7 49.982 34.609 47.088 42 HB3 HIS 7 HB1 HIS 7 48.403 34.136 46.454 43 HD1 HIS 7 HD1 HIS 7 48.729 32.596 44.558 44 HD2 HIS 7 HD2 HIS 7 51.535 35.659 44.549 45 HE1 HIS 7 HE1 HIS 7 50.115 32.232 42.492 46 HE2 HIS 7 HE2 HIS 7 51.831 34.103 42.485 47 H HIS 8 H HIS 8 48.938 36.557 43.736 48 HA HIS 8 HA HIS 8 46.036 36.387 43.377 49 HB2 HIS 8 HB2 HIS 8 47.802 38.707 42.695 50 HB3 HIS 8 HB1 HIS 8 46.431 38.340 41.644 51 HD1 HIS 8 HD1 HIS 8 47.148 40.528 44.238 52 HD2 HIS 8 HD2 HIS 8 43.990 37.917 43.550 53 HE1 HIS 8 HE1 HIS 8 45.250 41.382 45.651 54 HE2 HIS 8 HE2 HIS 8 43.319 39.786 45.231 55 H HIS 9 H HIS 9 45.403 35.406 41.517 56 HA HIS 9 HA HIS 9 47.212 35.071 39.296 57 HB2 HIS 9 HB2 HIS 9 47.173 32.610 39.332 58 HB3 HIS 9 HB1 HIS 9 47.989 33.275 40.750 59 HD1 HIS 9 HD1 HIS 9 44.817 31.521 39.759 60 HD2 HIS 9 HD2 HIS 9 46.830 32.695 43.199 61 HE1 HIS 9 HE1 HIS 9 43.614 30.394 41.659 62 HE2 HIS 9 HE2 HIS 9 44.843 31.112 43.762 63 H HIS 10 H HIS 10 46.174 34.481 37.400 64 HA HIS 10 HA HIS 10 43.289 33.958 37.567 65 HB2 HIS 10 HB2 HIS 10 43.881 36.415 37.108 66 HB3 HIS 10 HB1 HIS 10 44.441 35.856 35.529 67 HD1 HIS 10 HD1 HIS 10 42.740 36.073 33.764 68 HD2 HIS 10 HD2 HIS 10 41.011 35.412 37.483 69 HE1 HIS 10 HE1 HIS 10 40.258 36.105 33.366 70 HE2 HIS 10 HE2 HIS 10 39.200 35.700 35.639 71 H SER 11 H SER 11 42.379 33.009 35.626 72 HA SER 11 HA SER 11 43.991 32.135 33.468 73 HB2 SER 11 HB2 SER 11 44.832 30.684 35.389 74 HB3 SER 11 HB1 SER 11 43.231 29.921 35.377 75 HG SER 11 HG SER 11 43.749 29.672 32.987 76 H SER 12 H SER 12 42.803 30.977 31.889 77 HA SER 12 HA SER 12 40.007 30.388 32.415 78 HB2 SER 12 HB2 SER 12 39.285 31.768 30.424 79 HB3 SER 12 HB1 SER 12 39.803 32.706 31.835 80 HG SER 12 HG SER 12 41.891 32.860 30.793 81 H GLY 13 H GLY 13 39.310 28.696 31.246 82 HA2 GLY 13 HA2 GLY 13 40.901 27.907 28.888 83 HA3 GLY 13 3HA GLY 13 40.447 26.734 30.115 84 H LEU 14 H LEU 14 39.647 25.850 27.894 85 HA LEU 14 HA LEU 14 36.855 26.724 27.538 86 HB2 LEU 14 HB2 LEU 14 38.718 25.474 25.511 87 HB3 LEU 14 HB1 LEU 14 37.010 25.863 25.237 88 HG LEU 14 HG LEU 14 39.218 27.853 25.760 89 HD11 LEU 14 HD11 LEU 14 38.875 28.513 23.446 90 HD12 LEU 14 HD12 LEU 14 37.655 27.255 23.252 91 HD13 LEU 14 HD13 LEU 14 39.337 26.814 23.547 92 HD21 LEU 14 HD21 LEU 14 36.313 28.047 25.877 93 HD22 LEU 14 HD22 LEU 14 37.041 29.202 24.758 94 HD23 LEU 14 HD23 LEU 14 37.550 29.169 26.448 95 H VAL 15 H VAL 15 35.746 24.726 26.191 96 HA VAL 15 HA VAL 15 36.267 22.297 27.776 97 HB VAL 15 HB VAL 15 33.742 21.895 27.570 98 HG11 VAL 15 HG11 VAL 15 33.852 24.128 29.388 99 HG12 VAL 15 HG12 VAL 15 33.730 22.402 29.735 100 HG13 VAL 15 HG13 VAL 15 35.312 23.148 29.507 101 HG21 VAL 15 HG21 VAL 15 33.554 24.877 27.396 102 HG22 VAL 15 HG22 VAL 15 33.582 23.895 25.933 103 HG23 VAL 15 HG23 VAL 15 32.304 23.663 27.125 104 HA PRO 16 HA PRO 16 36.297 20.041 24.010 105 HB2 PRO 16 HB2 PRO 16 35.218 17.649 24.797 106 HB3 PRO 16 HB1 PRO 16 36.832 18.187 25.258 107 HG2 PRO 16 HG1 PRO 16 34.259 18.361 26.789 108 HG3 PRO 16 HG2 PRO 16 35.890 17.840 27.355 109 HD2 PRO 16 HD1 PRO 16 34.882 20.308 27.866 110 HD3 PRO 16 HD2 PRO 16 36.609 20.017 27.599 111 H ARG 17 H ARG 17 34.692 18.298 22.862 112 HA ARG 17 HA ARG 17 31.980 19.425 22.870 113 HB2 ARG 17 HB2 ARG 17 31.970 19.314 20.377 114 HB3 ARG 17 HB1 ARG 17 33.081 20.524 21.038 115 HG2 ARG 17 HG1 ARG 17 34.194 17.829 20.477 116 HG3 ARG 17 HG2 ARG 17 33.779 18.857 19.094 117 HD2 ARG 17 HD1 ARG 17 35.097 20.703 20.360 118 HD3 ARG 17 HD2 ARG 17 35.774 19.347 21.273 119 HE ARG 17 HE ARG 17 36.997 18.738 19.424 120 HH11 ARG 17 1HH1 ARG 17 34.600 21.096 18.520 121 HH12 ARG 17 2HH1 ARG 17 35.250 21.340 16.933 122 HH21 ARG 17 1HH2 ARG 17 37.861 19.050 17.337 123 HH22 ARG 17 2HH2 ARG 17 37.104 20.174 16.259 124 H GLY 18 H GLY 18 30.513 18.016 21.407 125 HA2 GLY 18 HA2 GLY 18 30.720 15.320 22.407 126 HA3 GLY 18 3HA GLY 18 29.410 15.977 21.437 127 H SER 19 H SER 19 30.307 13.444 20.957 128 HA SER 19 HA SER 19 31.905 13.716 18.497 129 HB2 SER 19 HB2 SER 19 32.794 11.585 18.825 130 HB3 SER 19 HB1 SER 19 32.687 12.214 20.479 131 HG SER 19 HG SER 19 31.117 10.267 19.214 132 H HIS 20 H HIS 20 31.372 11.985 16.833 133 HA HIS 20 HA HIS 20 28.540 12.141 16.281 134 HB2 HIS 20 HB2 HIS 20 30.758 10.852 14.673 135 HB3 HIS 20 HB1 HIS 20 29.121 11.188 14.102 136 HD1 HIS 20 HD1 HIS 20 28.481 13.726 13.751 137 HD2 HIS 20 HD2 HIS 20 32.499 12.998 14.511 138 HE1 HIS 20 HE1 HIS 20 29.681 15.836 13.095 139 HE2 HIS 20 HE2 HIS 20 32.139 15.392 13.558 140 H MET 21 H MET 21 27.542 10.085 15.244 141 HA MET 21 HA MET 21 28.204 7.757 16.923 142 HB2 MET 21 HB2 MET 21 25.549 9.028 16.333 143 HB3 MET 21 HB1 MET 21 25.642 7.295 16.676 144 HG2 MET 21 HG1 MET 21 25.189 8.185 18.757 145 HG3 MET 21 HG2 MET 21 26.945 8.001 18.782 146 HE1 MET 21 HE1 MET 21 23.954 10.006 18.516 147 HE2 MET 21 HE2 MET 21 24.397 10.902 19.969 148 HE3 MET 21 HE3 MET 21 24.416 11.704 18.398 149 H ILE 22 H ILE 22 29.371 6.738 15.296 150 HA ILE 22 HA ILE 22 28.371 6.399 12.650 151 HB ILE 22 HB ILE 22 30.785 6.307 13.205 152 HG12 ILE 22 HG11 ILE 22 31.312 4.312 11.795 153 HG13 ILE 22 HG12 ILE 22 29.603 3.853 11.890 154 HG21 ILE 22 HG21 ILE 22 30.049 4.648 15.231 155 HG22 ILE 22 HG22 ILE 22 30.691 3.503 14.053 156 HG23 ILE 22 HG23 ILE 22 31.696 4.832 14.631 157 HD11 ILE 22 HD11 ILE 22 29.250 5.068 10.078 158 HD12 ILE 22 HD12 ILE 22 29.585 6.505 11.045 159 HD13 ILE 22 HD13 ILE 22 30.883 5.731 10.137 160 H SER 23 H SER 23 27.348 4.678 11.709 161 HA SER 23 HA SER 23 25.855 2.957 13.478 162 HB2 SER 23 HB2 SER 23 24.683 2.218 11.474 163 HB3 SER 23 HB1 SER 23 24.818 3.985 11.471 164 HG SER 23 HG SER 23 25.990 3.886 9.731 165 H LEU 24 H LEU 24 28.250 2.187 14.056 166 HA LEU 24 HA LEU 24 29.606 0.383 12.432 167 HB2 LEU 24 HB2 LEU 24 30.123 1.411 14.813 168 HB3 LEU 24 HB1 LEU 24 29.436 -0.127 15.361 169 HG LEU 24 HG LEU 24 31.853 -0.255 15.289 170 HD11 LEU 24 HD11 LEU 24 30.842 -1.855 12.961 171 HD12 LEU 24 HD12 LEU 24 30.355 -2.204 14.619 172 HD13 LEU 24 HD13 LEU 24 32.056 -2.297 14.161 173 HD21 LEU 24 HD21 LEU 24 31.701 1.400 13.130 174 HD22 LEU 24 HD22 LEU 24 32.075 -0.147 12.371 175 HD23 LEU 24 HD23 LEU 24 33.139 0.504 13.618 176 H SER 25 H SER 25 27.423 -0.481 15.122 177 HA SER 25 HA SER 25 27.175 -3.182 14.203 178 HB2 SER 25 HB2 SER 25 26.994 -2.265 16.630 179 HB3 SER 25 HB1 SER 25 25.315 -1.905 16.193 180 HG SER 25 HG SER 25 25.129 -3.920 16.898 181 H GLY 26 H GLY 26 24.754 -4.050 14.189 182 HA2 GLY 26 HA2 GLY 26 23.501 -2.668 11.946 183 HA3 GLY 26 3HA GLY 26 23.129 -4.291 12.508 184 H LEU 27 H LEU 27 20.914 -3.307 12.086 185 HA LEU 27 HA LEU 27 19.772 -2.618 14.638 186 HB2 LEU 27 HB2 LEU 27 20.556 -0.442 13.545 187 HB3 LEU 27 HB1 LEU 27 19.262 -0.721 12.367 188 HG LEU 27 HG LEU 27 17.607 -0.638 14.189 189 HD11 LEU 27 HD11 LEU 27 20.010 0.000 15.890 190 HD12 LEU 27 HD12 LEU 27 18.939 -1.392 16.041 191 HD13 LEU 27 HD13 LEU 27 18.336 0.227 16.393 192 HD21 LEU 27 HD21 LEU 27 18.846 1.886 14.761 193 HD22 LEU 27 HD22 LEU 27 17.434 1.533 13.764 194 HD23 LEU 27 HD23 LEU 27 19.048 1.482 13.056 195 H THR 28 H THR 28 17.381 -2.548 14.544 196 HA THR 28 HA THR 28 16.321 -4.754 13.231 197 HB THR 28 HB THR 28 14.152 -4.031 13.940 198 HG1 THR 28 HG1 THR 28 13.934 -1.822 14.765 199 HG21 THR 28 HG21 THR 28 14.490 -3.886 16.230 200 HG22 THR 28 HG22 THR 28 15.897 -2.835 16.059 201 HG23 THR 28 HG23 THR 28 16.026 -4.551 15.674 202 H SER 29 H SER 29 14.241 -4.504 11.805 203 HA SER 29 HA SER 29 15.010 -3.775 9.256 204 HB2 SER 29 HB2 SER 29 13.143 -5.263 9.584 205 HB3 SER 29 HB1 SER 29 12.231 -4.001 10.430 206 HG SER 29 HG SER 29 13.102 -3.687 7.758 207 H SER 30 H SER 30 15.602 -1.828 8.575 208 HA SER 30 HA SER 30 14.045 0.507 9.473 209 HB2 SER 30 HB2 SER 30 16.526 0.340 10.118 210 HB3 SER 30 HB1 SER 30 16.861 0.630 8.402 211 HG SER 30 HG SER 30 16.817 2.629 9.232 212 H VAL 31 H VAL 31 13.701 2.210 7.934 213 HA VAL 31 HA VAL 31 12.692 2.778 5.937 214 HB VAL 31 HB VAL 31 14.325 2.978 4.099 215 HG11 VAL 31 HG11 VAL 31 16.121 3.891 6.114 216 HG12 VAL 31 HG12 VAL 31 14.990 4.825 5.133 217 HG13 VAL 31 HG13 VAL 31 14.467 4.141 6.672 218 HG21 VAL 31 HG21 VAL 31 16.535 2.129 4.250 219 HG22 VAL 31 HG22 VAL 31 16.302 1.624 5.923 220 HG23 VAL 31 HG23 VAL 31 15.456 0.784 4.622 221 H GLU 32 H GLU 32 11.900 0.210 6.560 222 HA GLU 32 HA GLU 32 12.315 -1.479 4.241 223 HB2 GLU 32 HB2 GLU 32 11.117 -3.159 5.404 224 HB3 GLU 32 HB1 GLU 32 12.124 -2.346 6.611 225 HG2 GLU 32 HG1 GLU 32 10.213 -1.052 7.383 226 HG3 GLU 32 HG2 GLU 32 9.197 -1.816 6.152 227 HE2 GLU 32 HE2 GLU 32 9.717 -4.936 8.028 228 H SER 33 H SER 33 10.147 0.946 5.236 229 HA SER 33 HA SER 33 8.186 0.103 3.204 230 HB2 SER 33 HB2 SER 33 7.593 2.101 5.383 231 HB3 SER 33 HB1 SER 33 6.463 1.111 4.442 232 HG SER 33 HG SER 33 7.552 -0.734 5.530 233 H ASP 34 H ASP 34 10.434 2.508 4.158 234 HA ASP 34 HA ASP 34 9.411 4.766 2.853 235 HB2 ASP 34 HB2 ASP 34 11.265 4.901 4.439 236 HB3 ASP 34 HB1 ASP 34 12.291 3.975 3.335 237 HD2 ASP 34 HD2 ASP 34 11.380 7.586 1.967 238 H LEU 35 H LEU 35 11.052 1.947 1.646 239 HA LEU 35 HA LEU 35 11.399 3.151 -0.993 240 HB2 LEU 35 HB2 LEU 35 12.360 0.637 0.327 241 HB3 LEU 35 HB1 LEU 35 12.355 0.771 -1.441 242 HG LEU 35 HG LEU 35 13.826 2.641 0.416 243 HD11 LEU 35 HD11 LEU 35 14.729 0.352 0.471 244 HD12 LEU 35 HD12 LEU 35 15.840 1.499 -0.275 245 HD13 LEU 35 HD13 LEU 35 14.904 0.396 -1.283 246 HD21 LEU 35 HD21 LEU 35 15.017 3.061 -1.864 247 HD22 LEU 35 HD22 LEU 35 13.490 3.868 -1.507 248 HD23 LEU 35 HD23 LEU 35 13.513 2.444 -2.549 249 H ASP 36 H ASP 36 8.805 2.199 0.403 250 HA ASP 36 HA ASP 36 7.784 0.016 -1.051 251 HB2 ASP 36 HB2 ASP 36 6.507 2.295 0.451 252 HB3 ASP 36 HB1 ASP 36 5.522 1.119 -0.429 253 HD2 ASP 36 HD2 ASP 36 5.963 -0.095 2.958 254 H MET 37 H MET 37 8.123 3.388 -1.824 255 HA MET 37 HA MET 37 6.283 3.362 -4.026 256 HB2 MET 37 HB2 MET 37 6.627 5.463 -2.980 257 HB3 MET 37 HB1 MET 37 8.387 5.314 -3.104 258 HG2 MET 37 HG1 MET 37 8.448 5.960 -5.288 259 HG3 MET 37 HG2 MET 37 6.844 5.305 -5.629 260 HE1 MET 37 HE1 MET 37 4.759 7.867 -6.060 261 HE2 MET 37 HE2 MET 37 4.929 6.179 -5.580 262 HE3 MET 37 HE3 MET 37 4.364 7.375 -4.413 263 H GLN 38 H GLN 38 9.626 2.595 -3.560 264 HA GLN 38 HA GLN 38 10.423 2.838 -6.290 265 HB2 GLN 38 HB2 GLN 38 11.703 2.412 -3.846 266 HB3 GLN 38 HB1 GLN 38 11.983 0.925 -4.766 267 HG2 GLN 38 HG1 GLN 38 12.913 2.211 -6.615 268 HG3 GLN 38 HG2 GLN 38 12.612 3.708 -5.723 269 HE21 GLN 38 HE21 GLN 38 14.287 4.505 -4.693 270 HE22 GLN 38 HE22 GLN 38 15.642 3.612 -4.100 271 H GLN 39 H GLN 39 8.718 0.472 -4.488 272 HA GLN 39 HA GLN 39 9.344 -1.902 -5.747 273 HB2 GLN 39 HB2 GLN 39 6.657 -0.912 -4.771 274 HB3 GLN 39 HB1 GLN 39 6.993 -2.588 -5.233 275 HG2 GLN 39 HG1 GLN 39 8.241 -1.046 -2.961 276 HG3 GLN 39 HG2 GLN 39 7.099 -2.394 -2.849 277 HE21 GLN 39 HE21 GLN 39 10.376 -1.463 -3.504 278 HE22 GLN 39 HE22 GLN 39 11.056 -3.050 -3.443 279 H ALA 40 H ALA 40 6.710 0.320 -6.674 280 HA ALA 40 HA ALA 40 6.058 -1.018 -9.063 281 HB1 ALA 40 HB1 ALA 40 5.629 1.919 -8.600 282 HB2 ALA 40 HB2 ALA 40 4.665 0.684 -7.789 283 HB3 ALA 40 HB3 ALA 40 4.651 0.801 -9.549 284 H MET 41 H MET 41 8.550 1.256 -8.275 285 HA MET 41 HA MET 41 9.088 2.054 -10.981 286 HB2 MET 41 HB2 MET 41 10.846 2.295 -8.527 287 HB3 MET 41 HB1 MET 41 11.047 3.166 -10.055 288 HG2 MET 41 HG1 MET 41 8.511 3.436 -8.478 289 HG3 MET 41 HG2 MET 41 9.950 4.364 -8.051 290 HE1 MET 41 HE1 MET 41 11.266 5.693 -10.712 291 HE2 MET 41 HE2 MET 41 10.251 7.104 -10.426 292 HE3 MET 41 HE3 MET 41 10.865 6.169 -9.062 293 H LEU 42 H LEU 42 10.047 -0.542 -8.904 294 HA LEU 42 HA LEU 42 12.398 -1.254 -10.393 295 HB2 LEU 42 HB2 LEU 42 10.928 -2.270 -8.045 296 HB3 LEU 42 HB1 LEU 42 11.776 -3.495 -9.005 297 HG LEU 42 HG LEU 42 13.156 -2.764 -7.153 298 HD11 LEU 42 HD11 LEU 42 14.555 -1.420 -9.368 299 HD12 LEU 42 HD12 LEU 42 13.973 -3.050 -9.702 300 HD13 LEU 42 HD13 LEU 42 15.064 -2.765 -8.347 301 HD21 LEU 42 HD21 LEU 42 12.446 -0.073 -8.191 302 HD22 LEU 42 HD22 LEU 42 14.048 -0.295 -7.487 303 HD23 LEU 42 HD23 LEU 42 12.607 -0.641 -6.529 304 H THR 43 H THR 43 9.122 -1.561 -10.961 305 HA THR 43 HA THR 43 9.574 -3.828 -12.792 306 HB THR 43 HB THR 43 7.997 -4.850 -11.538 307 HG1 THR 43 HG1 THR 43 5.949 -4.531 -12.409 308 HG21 THR 43 HG21 THR 43 6.197 -3.429 -10.300 309 HG22 THR 43 HG22 THR 43 7.298 -2.089 -10.620 310 HG23 THR 43 HG23 THR 43 7.847 -3.475 -9.678 311 H ASN 44 H ASN 44 7.074 -1.325 -12.328 312 HA ASN 44 HA ASN 44 6.002 0.032 -13.811 313 HB2 ASN 44 HB2 ASN 44 8.173 1.157 -13.793 314 HB3 ASN 44 HB1 ASN 44 8.754 0.080 -15.068 315 HD21 ASN 44 HD21 ASN 44 6.041 2.275 -14.428 316 HD22 ASN 44 HD22 ASN 44 5.998 2.958 -16.014 317 H LYS 45 H LYS 45 4.537 -1.389 -14.711 318 HA LYS 45 HA LYS 45 5.029 -3.335 -16.628 319 HB2 LYS 45 HB2 LYS 45 2.516 -1.661 -16.492 320 HB3 LYS 45 HB1 LYS 45 2.676 -3.327 -17.070 321 HG2 LYS 45 HG1 LYS 45 2.763 -2.299 -14.249 322 HG3 LYS 45 HG2 LYS 45 1.709 -3.534 -14.961 323 HD2 LYS 45 HD1 LYS 45 4.669 -3.765 -14.387 324 HD3 LYS 45 HD2 LYS 45 3.346 -4.631 -13.588 325 HE2 LYS 45 HE1 LYS 45 2.975 -5.200 -16.283 326 HE3 LYS 45 HE2 LYS 45 4.731 -5.235 -16.068 327 HZ1 LYS 45 3HZ LYS 45 2.875 -7.187 -15.339 328 HZ2 LYS 45 1HZ LYS 45 3.548 -6.579 -13.911 329 HZ3 LYS 45 2HZ LYS 45 4.551 -7.209 -15.118 330 H ASP 46 H ASP 46 3.465 -0.214 -17.352 331 HA ASP 46 HA ASP 46 5.153 0.091 -19.708 332 HB2 ASP 46 HB2 ASP 46 2.408 -0.823 -19.808 333 HB3 ASP 46 HB1 ASP 46 2.581 0.728 -20.639 334 HD2 ASP 46 HD2 ASP 46 4.773 -0.700 -23.015 335 H GLU 47 H GLU 47 4.805 2.229 -20.767 336 HA GLU 47 HA GLU 47 4.829 4.287 -18.812 337 HB2 GLU 47 HB2 GLU 47 4.591 4.629 -21.807 338 HB3 GLU 47 HB1 GLU 47 5.221 5.799 -20.638 339 HG2 GLU 47 HG1 GLU 47 6.482 3.212 -21.525 340 HG3 GLU 47 HG2 GLU 47 7.079 4.862 -21.763 341 HE2 GLU 47 HE2 GLU 47 8.061 2.997 -18.493 342 H LYS 48 H LYS 48 2.525 3.418 -21.371 343 HA LYS 48 HA LYS 48 0.691 5.476 -20.983 344 HB2 LYS 48 HB2 LYS 48 -0.996 3.814 -21.918 345 HB3 LYS 48 HB1 LYS 48 0.432 4.140 -22.915 346 HG2 LYS 48 HG1 LYS 48 0.312 1.860 -23.079 347 HG3 LYS 48 HG2 LYS 48 1.401 2.042 -21.692 348 HD2 LYS 48 HD1 LYS 48 -0.064 1.119 -20.261 349 HD3 LYS 48 HD2 LYS 48 -1.425 2.020 -20.951 350 HE2 LYS 48 HE1 LYS 48 -0.186 -0.498 -22.089 351 HE3 LYS 48 HE2 LYS 48 -1.743 -0.371 -21.257 352 HZ1 LYS 48 3HZ LYS 48 -2.456 -0.238 -23.387 353 HZ2 LYS 48 1HZ LYS 48 -1.019 0.441 -23.965 354 HZ3 LYS 48 2HZ LYS 48 -2.142 1.408 -23.149 355 H VAL 49 H VAL 49 1.189 2.512 -19.200 356 HA VAL 49 HA VAL 49 -1.220 2.335 -17.815 357 HB VAL 49 HB VAL 49 1.572 1.572 -16.973 358 HG11 VAL 49 HG11 VAL 49 -0.045 0.051 -15.419 359 HG12 VAL 49 HG12 VAL 49 0.733 1.542 -14.885 360 HG13 VAL 49 HG13 VAL 49 -0.939 1.570 -15.447 361 HG21 VAL 49 HG21 VAL 49 1.151 -0.010 -18.508 362 HG22 VAL 49 HG22 VAL 49 0.124 -0.717 -17.260 363 HG23 VAL 49 HG23 VAL 49 -0.583 0.310 -18.506 364 H LEU 50 H LEU 50 1.543 4.421 -17.311 365 HA LEU 50 HA LEU 50 0.995 5.283 -14.702 366 HB2 LEU 50 HB2 LEU 50 2.205 6.932 -16.927 367 HB3 LEU 50 HB1 LEU 50 2.409 7.168 -15.182 368 HG LEU 50 HG LEU 50 3.399 4.730 -16.651 369 HD11 LEU 50 HD11 LEU 50 4.899 6.112 -17.570 370 HD12 LEU 50 HD12 LEU 50 5.616 6.153 -15.961 371 HD13 LEU 50 HD13 LEU 50 4.510 7.430 -16.465 372 HD21 LEU 50 HD21 LEU 50 3.333 4.118 -14.443 373 HD22 LEU 50 HD22 LEU 50 3.576 5.765 -13.862 374 HD23 LEU 50 HD23 LEU 50 4.935 4.854 -14.523 375 H LYS 51 H LYS 51 -0.387 6.183 -17.776 376 HA LYS 51 HA LYS 51 -1.549 8.620 -17.212 377 HB2 LYS 51 HB2 LYS 51 -2.631 6.313 -18.844 378 HB3 LYS 51 HB1 LYS 51 -3.329 7.941 -18.847 379 HG2 LYS 51 HG1 LYS 51 -0.435 7.504 -19.511 380 HG3 LYS 51 HG2 LYS 51 -1.706 7.295 -20.729 381 HD2 LYS 51 HD1 LYS 51 -2.499 9.599 -20.259 382 HD3 LYS 51 HD2 LYS 51 -1.140 9.797 -19.139 383 HE2 LYS 51 HE1 LYS 51 0.462 9.652 -20.874 384 HE3 LYS 51 HE2 LYS 51 -0.734 9.016 -22.013 385 HZ1 LYS 51 3HZ LYS 51 -0.605 11.191 -22.663 386 HZ2 LYS 51 1HZ LYS 51 -0.334 11.777 -21.099 387 HZ3 LYS 51 2HZ LYS 51 -1.887 11.291 -21.563 388 H ALA 52 H ALA 52 -2.493 5.432 -16.139 389 HA ALA 52 HA ALA 52 -5.078 6.169 -15.183 390 HB1 ALA 52 HB1 ALA 52 -4.087 3.923 -13.753 391 HB2 ALA 52 HB2 ALA 52 -3.569 3.784 -15.434 392 HB3 ALA 52 HB3 ALA 52 -5.281 3.966 -15.050 393 H LEU 53 H LEU 53 -1.865 5.966 -13.742 394 HA LEU 53 HA LEU 53 -2.592 6.298 -11.059 395 HB2 LEU 53 HB2 LEU 53 -0.084 7.287 -12.428 396 HB3 LEU 53 HB1 LEU 53 -0.302 7.012 -10.691 397 HG LEU 53 HG LEU 53 -0.448 4.822 -12.757 398 HD11 LEU 53 HD11 LEU 53 1.786 4.344 -12.454 399 HD12 LEU 53 HD12 LEU 53 1.882 5.233 -10.935 400 HD13 LEU 53 HD13 LEU 53 1.796 6.108 -12.463 401 HD21 LEU 53 HD21 LEU 53 -1.439 3.857 -10.968 402 HD22 LEU 53 HD22 LEU 53 -0.716 4.985 -9.820 403 HD23 LEU 53 HD23 LEU 53 0.233 3.638 -10.449 404 H GLU 54 H GLU 54 -2.631 8.506 -13.677 405 HA GLU 54 HA GLU 54 -2.271 10.936 -12.299 406 HB2 GLU 54 HB2 GLU 54 -3.927 10.395 -14.776 407 HB3 GLU 54 HB1 GLU 54 -3.358 11.981 -14.230 408 HG2 GLU 54 HG1 GLU 54 -0.999 10.766 -14.359 409 HG3 GLU 54 HG2 GLU 54 -1.872 9.780 -15.542 410 HE2 GLU 54 HE2 GLU 54 -1.988 12.366 -17.842 411 H ARG 55 H ARG 55 -5.167 9.030 -13.015 412 HA ARG 55 HA ARG 55 -6.937 10.910 -11.760 413 HB2 ARG 55 HB2 ARG 55 -7.858 9.616 -13.526 414 HB3 ARG 55 HB1 ARG 55 -7.299 8.103 -12.797 415 HG2 ARG 55 HG1 ARG 55 -9.716 8.398 -12.548 416 HG3 ARG 55 HG2 ARG 55 -8.885 8.345 -10.985 417 HD2 ARG 55 HD1 ARG 55 -9.569 10.403 -10.435 418 HD3 ARG 55 HD2 ARG 55 -9.065 11.049 -12.003 419 HE ARG 55 HE ARG 55 -11.387 9.672 -12.505 420 HH11 ARG 55 1HH1 ARG 55 -10.428 12.315 -10.453 421 HH12 ARG 55 2HH1 ARG 55 -11.984 13.077 -10.487 422 HH21 ARG 55 1HH2 ARG 55 -13.440 10.665 -12.557 423 HH22 ARG 55 2HH2 ARG 55 -13.696 12.137 -11.683 424 H THR 56 H THR 56 -5.245 7.996 -10.817 425 HA THR 56 HA THR 56 -6.675 7.574 -8.386 426 HB THR 56 HB THR 56 -5.066 5.912 -7.859 427 HG1 THR 56 HG1 THR 56 -3.064 6.573 -8.149 428 HG21 THR 56 HG21 THR 56 -6.333 5.981 -10.344 429 HG22 THR 56 HG22 THR 56 -5.684 4.560 -9.526 430 HG23 THR 56 HG23 THR 56 -4.691 5.441 -10.687 431 H ARG 57 H ARG 57 -3.548 9.070 -9.168 432 HA ARG 57 HA ARG 57 -2.714 9.661 -6.582 433 HB2 ARG 57 HB2 ARG 57 -1.224 11.270 -7.550 434 HB3 ARG 57 HB1 ARG 57 -1.342 9.895 -8.658 435 HG2 ARG 57 HG1 ARG 57 -2.658 11.083 -10.196 436 HG3 ARG 57 HG2 ARG 57 -3.023 12.352 -9.013 437 HD2 ARG 57 HD1 ARG 57 -1.363 13.048 -10.735 438 HD3 ARG 57 HD2 ARG 57 -0.760 13.150 -9.074 439 HE ARG 57 HE ARG 57 -0.117 10.657 -10.326 440 HH11 ARG 57 1HH1 ARG 57 0.838 13.989 -9.992 441 HH12 ARG 57 2HH1 ARG 57 2.502 13.684 -10.365 442 HH21 ARG 57 1HH2 ARG 57 2.072 10.245 -10.818 443 HH22 ARG 57 2HH2 ARG 57 3.203 11.555 -10.836 444 H GLN 58 H GLN 58 -5.134 11.168 -8.558 445 HA GLN 58 HA GLN 58 -5.281 13.665 -7.261 446 HB2 GLN 58 HB2 GLN 58 -7.252 12.047 -8.865 447 HB3 GLN 58 HB1 GLN 58 -7.695 13.607 -8.152 448 HG2 GLN 58 HG1 GLN 58 -5.356 13.232 -10.017 449 HG3 GLN 58 HG2 GLN 58 -6.980 13.694 -10.545 450 HE21 GLN 58 HE21 GLN 58 -4.197 14.682 -8.675 451 HE22 GLN 58 HE22 GLN 58 -4.559 16.371 -8.667 452 H LEU 59 H LEU 59 -6.857 10.568 -6.635 453 HA LEU 59 HA LEU 59 -8.281 11.681 -4.349 454 HB2 LEU 59 HB2 LEU 59 -8.254 8.805 -5.252 455 HB3 LEU 59 HB1 LEU 59 -9.456 9.628 -4.242 456 HG LEU 59 HG LEU 59 -9.278 10.886 -6.831 457 HD11 LEU 59 HD11 LEU 59 -8.543 8.711 -7.618 458 HD12 LEU 59 HD12 LEU 59 -10.192 9.035 -8.154 459 HD13 LEU 59 HD13 LEU 59 -9.902 7.936 -6.804 460 HD21 LEU 59 HD21 LEU 59 -11.130 11.067 -5.204 461 HD22 LEU 59 HD22 LEU 59 -11.515 9.369 -5.490 462 HD23 LEU 59 HD23 LEU 59 -11.666 10.542 -6.801 463 H ASP 60 H ASP 60 -5.246 11.068 -4.657 464 HA ASP 60 HA ASP 60 -3.548 10.512 -3.247 465 HB2 ASP 60 HB2 ASP 60 -5.516 10.007 -1.031 466 HB3 ASP 60 HB1 ASP 60 -3.887 10.691 -0.944 467 HD2 ASP 60 HD2 ASP 60 -5.204 13.802 -2.209 468 H ILE 61 H ILE 61 -3.531 8.567 -4.664 469 HA ILE 61 HA ILE 61 -3.924 6.154 -3.030 470 HB ILE 61 HB ILE 61 -4.439 6.260 -6.001 471 HG12 ILE 61 HG11 ILE 61 -6.480 6.027 -3.779 472 HG13 ILE 61 HG12 ILE 61 -6.108 7.547 -4.612 473 HG21 ILE 61 HG21 ILE 61 -5.097 4.030 -5.853 474 HG22 ILE 61 HG22 ILE 61 -3.663 4.111 -4.831 475 HG23 ILE 61 HG23 ILE 61 -5.267 4.098 -4.099 476 HD11 ILE 61 HD11 ILE 61 -6.625 5.692 -6.638 477 HD12 ILE 61 HD12 ILE 61 -7.867 5.437 -5.412 478 HD13 ILE 61 HD13 ILE 61 -7.641 7.036 -6.118 479 HA PRO 62 HA PRO 62 0.352 5.555 -4.013 480 HB2 PRO 62 HB2 PRO 62 0.579 3.020 -3.002 481 HB3 PRO 62 HB1 PRO 62 0.495 4.466 -1.996 482 HG2 PRO 62 HG1 PRO 62 -1.686 2.557 -2.769 483 HG3 PRO 62 HG2 PRO 62 -1.308 3.263 -1.153 484 HD2 PRO 62 HD1 PRO 62 -3.313 4.196 -2.727 485 HD3 PRO 62 HD2 PRO 62 -2.361 5.247 -1.665 486 H ASP 63 H ASP 63 1.443 4.774 -5.733 487 HA ASP 63 HA ASP 63 0.048 3.471 -7.826 488 HB2 ASP 63 HB2 ASP 63 3.052 3.706 -7.570 489 HB3 ASP 63 HB1 ASP 63 2.097 3.574 -9.053 490 HD2 ASP 63 HD2 ASP 63 0.966 6.967 -8.505 491 H GLU 64 H GLU 64 1.441 2.272 -5.024 492 HA GLU 64 HA GLU 64 2.413 -0.224 -6.031 493 HB2 GLU 64 HB2 GLU 64 1.621 0.512 -3.204 494 HB3 GLU 64 HB1 GLU 64 2.612 -0.871 -3.693 495 HG2 GLU 64 HG1 GLU 64 4.455 0.435 -4.190 496 HG3 GLU 64 HG2 GLU 64 3.480 1.897 -4.389 497 HE2 GLU 64 HE2 GLU 64 3.738 0.956 -0.571 498 H LYS 65 H LYS 65 -0.602 0.912 -4.608 499 HA LYS 65 HA LYS 65 -1.765 -1.756 -4.744 500 HB2 LYS 65 HB2 LYS 65 -3.539 -0.945 -3.456 501 HB3 LYS 65 HB1 LYS 65 -2.129 -0.075 -2.830 502 HG2 LYS 65 HG1 LYS 65 -2.740 1.848 -4.307 503 HG3 LYS 65 HG2 LYS 65 -4.235 0.981 -4.701 504 HD2 LYS 65 HD1 LYS 65 -3.361 1.812 -1.924 505 HD3 LYS 65 HD2 LYS 65 -4.584 2.628 -2.916 506 HE2 LYS 65 HE1 LYS 65 -6.154 1.242 -2.161 507 HE3 LYS 65 HE2 LYS 65 -5.244 -0.134 -2.803 508 HZ1 LYS 65 3HZ LYS 65 -5.368 -0.624 -0.575 509 HZ2 LYS 65 1HZ LYS 65 -5.222 0.988 -0.083 510 HZ3 LYS 65 2HZ LYS 65 -3.866 0.150 -0.650 511 H THR 66 H THR 66 -1.817 1.282 -6.440 512 HA THR 66 HA THR 66 -4.185 0.765 -7.954 513 HB THR 66 HB THR 66 -1.921 2.700 -8.481 514 HG1 THR 66 HG1 THR 66 -2.879 3.760 -6.927 515 HG21 THR 66 HG21 THR 66 -4.681 2.570 -9.703 516 HG22 THR 66 HG22 THR 66 -3.170 2.182 -10.527 517 HG23 THR 66 HG23 THR 66 -3.483 3.831 -9.987 518 H MET 67 H MET 67 -0.787 0.056 -8.342 519 HA MET 67 HA MET 67 -0.569 -0.415 -11.042 520 HB2 MET 67 HB2 MET 67 0.757 -1.448 -8.610 521 HB3 MET 67 HB1 MET 67 0.922 -2.458 -10.055 522 HG2 MET 67 HG1 MET 67 1.428 0.428 -10.437 523 HG3 MET 67 HG2 MET 67 2.588 -0.448 -9.436 524 HE1 MET 67 HE1 MET 67 2.279 -0.418 -13.910 525 HE2 MET 67 HE2 MET 67 0.759 -0.724 -13.068 526 HE3 MET 67 HE3 MET 67 1.693 0.729 -12.705 527 HA PRO 68 HA PRO 68 -2.158 -4.936 -10.443 528 HB2 PRO 68 HB2 PRO 68 -3.257 -5.584 -8.021 529 HB3 PRO 68 HB1 PRO 68 -1.541 -5.751 -8.386 530 HG2 PRO 68 HG1 PRO 68 -2.977 -3.529 -6.973 531 HG3 PRO 68 HG2 PRO 68 -1.440 -4.358 -6.526 532 HD2 PRO 68 HD1 PRO 68 -1.496 -1.922 -7.722 533 HD3 PRO 68 HD2 PRO 68 -0.215 -3.107 -8.025 534 H VAL 69 H VAL 69 -3.761 -2.122 -9.343 535 HA VAL 69 HA VAL 69 -6.437 -3.180 -9.523 536 HB VAL 69 HB VAL 69 -5.358 -0.388 -9.178 537 HG11 VAL 69 HG11 VAL 69 -8.000 -0.142 -8.630 538 HG12 VAL 69 HG12 VAL 69 -7.257 0.300 -10.169 539 HG13 VAL 69 HG13 VAL 69 -8.044 -1.269 -9.986 540 HG21 VAL 69 HG21 VAL 69 -7.219 -1.549 -7.230 541 HG22 VAL 69 HG22 VAL 69 -5.678 -2.395 -7.369 542 HG23 VAL 69 HG23 VAL 69 -5.708 -0.676 -6.976 543 H LEU 70 H LEU 70 -4.629 -0.718 -11.371 544 HA LEU 70 HA LEU 70 -6.489 -0.407 -13.424 545 HB2 LEU 70 HB2 LEU 70 -4.721 0.611 -14.704 546 HB3 LEU 70 HB1 LEU 70 -4.598 1.107 -13.007 547 HG LEU 70 HG LEU 70 -2.883 -0.958 -12.982 548 HD11 LEU 70 HD11 LEU 70 -1.670 -1.199 -14.961 549 HD12 LEU 70 HD12 LEU 70 -2.396 0.232 -15.691 550 HD13 LEU 70 HD13 LEU 70 -3.355 -1.233 -15.481 551 HD21 LEU 70 HD21 LEU 70 -2.420 1.304 -12.212 552 HD22 LEU 70 HD22 LEU 70 -2.257 1.854 -13.879 553 HD23 LEU 70 HD23 LEU 70 -1.098 0.703 -13.212 554 H MET 71 H MET 71 -3.736 -2.621 -13.153 555 HA MET 71 HA MET 71 -3.872 -3.729 -15.719 556 HB2 MET 71 HB2 MET 71 -2.417 -5.385 -14.962 557 HB3 MET 71 HB1 MET 71 -2.073 -4.017 -13.890 558 HG2 MET 71 HG1 MET 71 -2.236 -5.580 -12.280 559 HG3 MET 71 HG2 MET 71 -3.961 -5.241 -12.442 560 HE1 MET 71 HE1 MET 71 -1.951 -8.806 -12.186 561 HE2 MET 71 HE2 MET 71 -2.487 -7.449 -11.195 562 HE3 MET 71 HE3 MET 71 -3.581 -8.796 -11.513 563 H LYS 72 H LYS 72 -5.886 -4.167 -12.955 564 HA LYS 72 HA LYS 72 -6.977 -6.701 -13.706 565 HB2 LYS 72 HB2 LYS 72 -6.952 -5.659 -11.377 566 HB3 LYS 72 HB1 LYS 72 -8.304 -4.657 -11.931 567 HG2 LYS 72 HG1 LYS 72 -9.516 -6.331 -11.018 568 HG3 LYS 72 HG2 LYS 72 -9.259 -7.052 -12.618 569 HD2 LYS 72 HD1 LYS 72 -6.989 -7.809 -11.255 570 HD3 LYS 72 HD2 LYS 72 -8.244 -7.879 -10.006 571 HE2 LYS 72 HE1 LYS 72 -9.015 -9.040 -12.608 572 HE3 LYS 72 HE2 LYS 72 -7.707 -9.880 -11.762 573 HZ1 LYS 72 3HZ LYS 72 -9.289 -10.865 -10.581 574 HZ2 LYS 72 1HZ LYS 72 -10.494 -9.834 -11.170 575 HZ3 LYS 72 2HZ LYS 72 -9.577 -9.380 -9.824 576 H LEU 73 H LEU 73 -7.706 -3.369 -14.428 577 HA LEU 73 HA LEU 73 -10.321 -3.859 -15.482 578 HB2 LEU 73 HB2 LEU 73 -8.649 -1.506 -16.283 579 HB3 LEU 73 HB1 LEU 73 -10.394 -1.607 -15.997 580 HG LEU 73 HG LEU 73 -8.240 -1.593 -13.885 581 HD11 LEU 73 HD11 LEU 73 -10.226 0.463 -14.818 582 HD12 LEU 73 HD12 LEU 73 -8.469 0.592 -14.756 583 HD13 LEU 73 HD13 LEU 73 -9.404 0.555 -13.261 584 HD21 LEU 73 HD21 LEU 73 -11.234 -1.847 -13.691 585 HD22 LEU 73 HD22 LEU 73 -10.204 -1.389 -12.335 586 HD23 LEU 73 HD23 LEU 73 -10.011 -2.969 -13.095 587 H LEU 74 H LEU 74 -7.159 -3.173 -16.972 588 HA LEU 74 HA LEU 74 -7.975 -3.412 -19.637 589 HB2 LEU 74 HB2 LEU 74 -5.325 -3.801 -18.264 590 HB3 LEU 74 HB1 LEU 74 -5.513 -4.015 -20.013 591 HG LEU 74 HG LEU 74 -4.631 -1.828 -19.590 592 HD11 LEU 74 HD11 LEU 74 -5.860 -1.090 -21.276 593 HD12 LEU 74 HD12 LEU 74 -7.177 -0.719 -20.164 594 HD13 LEU 74 HD13 LEU 74 -7.086 -2.307 -20.925 595 HD21 LEU 74 HD21 LEU 74 -7.057 -1.297 -17.881 596 HD22 LEU 74 HD22 LEU 74 -5.718 -0.195 -18.204 597 HD23 LEU 74 HD23 LEU 74 -5.450 -1.655 -17.251 598 H GLU 75 H GLU 75 -7.368 -5.810 -17.228 599 HA GLU 75 HA GLU 75 -6.742 -8.026 -18.804 600 HB2 GLU 75 HB2 GLU 75 -7.725 -7.537 -16.090 601 HB3 GLU 75 HB1 GLU 75 -8.291 -9.068 -16.772 602 HG2 GLU 75 HG1 GLU 75 -5.391 -8.298 -16.856 603 HG3 GLU 75 HG2 GLU 75 -6.111 -9.075 -15.439 604 HE2 GLU 75 HE2 GLU 75 -6.716 -12.022 -17.386 605 H GLU 76 H GLU 76 -9.940 -6.966 -17.635 606 HA GLU 76 HA GLU 76 -11.318 -8.901 -19.245 607 HB2 GLU 76 HB2 GLU 76 -12.427 -6.478 -17.808 608 HB3 GLU 76 HB1 GLU 76 -13.352 -7.859 -18.415 609 HG2 GLU 76 HG1 GLU 76 -11.268 -7.973 -16.234 610 HG3 GLU 76 HG2 GLU 76 -13.021 -7.957 -15.992 611 HE2 GLU 76 HE2 GLU 76 -11.291 -11.330 -17.073 612 H ALA 77 H ALA 77 -10.385 -5.556 -19.566 613 HA ALA 77 HA ALA 77 -12.061 -5.103 -21.882 614 HB1 ALA 77 HB1 ALA 77 -10.802 -2.915 -21.966 615 HB2 ALA 77 HB2 ALA 77 -9.989 -3.428 -20.487 616 HB3 ALA 77 HB3 ALA 77 -11.740 -3.212 -20.502 617 H GLY 78 H GLY 78 -9.422 -6.921 -21.494 618 HA2 GLY 78 HA2 GLY 78 -7.774 -7.708 -22.884 619 HA3 GLY 78 3HA GLY 78 -8.822 -7.190 -24.196 620 H GLY 79 H GLY 79 -7.693 -4.825 -21.936 621 HA2 GLY 79 HA2 GLY 79 -5.859 -3.363 -22.074 622 HA3 GLY 79 3HA GLY 79 -5.442 -4.067 -23.628 623 H ASN 80 H ASN 80 -8.573 -2.766 -22.622 624 HA ASN 80 HA ASN 80 -8.295 -0.728 -24.733 625 HB2 ASN 80 HB2 ASN 80 -10.117 -2.722 -24.724 626 HB3 ASN 80 HB1 ASN 80 -11.008 -1.495 -23.816 627 HD21 ASN 80 HD21 ASN 80 -10.957 0.730 -24.830 628 HD22 ASN 80 HD22 ASN 80 -11.187 0.800 -26.540 629 H TRP 81 H TRP 81 -7.789 1.126 -23.740 630 HA TRP 81 HA TRP 81 -8.831 1.780 -21.128 631 HB2 TRP 81 HB2 TRP 81 -7.150 3.425 -23.042 632 HB3 TRP 81 HB1 TRP 81 -7.500 3.843 -21.364 633 HD1 TRP 81 HD1 TRP 81 -5.617 1.117 -23.359 634 HE1 TRP 81 HE1 TRP 81 -3.730 0.198 -21.869 635 HE3 TRP 81 HE3 TRP 81 -6.673 3.662 -19.052 636 HZ2 TRP 81 2HZ TRP 81 -2.811 0.511 -19.218 637 HZ3 TRP 81 3HZ TRP 81 -5.242 3.295 -17.085 638 HH2 TRP 81 HH TRP 81 -3.351 1.750 -17.168 639 H SER 82 H SER 82 -9.719 2.321 -24.392 640 HA SER 82 HA SER 82 -11.003 4.764 -24.339 641 HB2 SER 82 HB2 SER 82 -10.690 3.068 -26.283 642 HB3 SER 82 HB1 SER 82 -12.241 2.405 -25.737 643 HG SER 82 HG SER 82 -11.822 5.132 -26.402 644 H TYR 83 H TYR 83 -12.380 1.585 -23.516 645 HA TYR 83 HA TYR 83 -14.851 2.752 -22.612 646 HB2 TYR 83 HB2 TYR 83 -15.163 0.626 -23.506 647 HB3 TYR 83 HB1 TYR 83 -13.725 -0.025 -22.716 648 HD1 TYR 83 HD1 TYR 83 -17.264 0.802 -22.266 649 HD2 TYR 83 HD2 TYR 83 -13.776 -0.771 -20.405 650 HE1 TYR 83 HE1 TYR 83 -18.648 -0.094 -20.440 651 HE2 TYR 83 HE2 TYR 83 -15.150 -1.671 -18.575 652 HH TYR 83 HH TYR 83 -18.289 -2.164 -18.704 653 H ILE 84 H ILE 84 -11.998 1.303 -21.097 654 HA ILE 84 HA ILE 84 -12.866 1.326 -18.447 655 HB ILE 84 HB ILE 84 -10.075 1.686 -19.541 656 HG12 ILE 84 HG11 ILE 84 -11.457 -0.743 -18.373 657 HG13 ILE 84 HG12 ILE 84 -11.242 -0.443 -20.105 658 HG21 ILE 84 HG21 ILE 84 -9.550 0.737 -17.158 659 HG22 ILE 84 HG22 ILE 84 -9.801 2.466 -17.399 660 HG23 ILE 84 HG23 ILE 84 -11.103 1.468 -16.751 661 HD11 ILE 84 HD11 ILE 84 -9.304 -1.497 -20.003 662 HD12 ILE 84 HD12 ILE 84 -8.694 -0.202 -18.971 663 HD13 ILE 84 HD13 ILE 84 -9.426 -1.634 -18.249 664 H LYS 85 H LYS 85 -11.778 3.912 -20.493 665 HA LYS 85 HA LYS 85 -11.596 5.755 -18.227 666 HB2 LYS 85 HB2 LYS 85 -10.315 7.128 -19.528 667 HB3 LYS 85 HB1 LYS 85 -9.965 5.580 -20.313 668 HG2 LYS 85 HG1 LYS 85 -12.079 6.265 -21.772 669 HG3 LYS 85 HG2 LYS 85 -11.547 7.885 -21.289 670 HD2 LYS 85 HD1 LYS 85 -9.959 5.788 -22.775 671 HD3 LYS 85 HD2 LYS 85 -10.480 7.378 -23.361 672 HE2 LYS 85 HE1 LYS 85 -8.432 6.794 -21.212 673 HE3 LYS 85 HE2 LYS 85 -8.152 7.505 -22.809 674 HZ1 LYS 85 3HZ LYS 85 -9.898 9.241 -21.859 675 HZ2 LYS 85 1HZ LYS 85 -8.233 9.397 -21.603 676 HZ3 LYS 85 2HZ LYS 85 -9.216 8.739 -20.395 677 H LEU 86 H LEU 86 -13.957 4.575 -20.152 678 HA LEU 86 HA LEU 86 -15.371 6.769 -21.108 679 HB2 LEU 86 HB2 LEU 86 -15.802 4.261 -21.433 680 HB3 LEU 86 HB1 LEU 86 -16.704 4.361 -19.911 681 HG LEU 86 HG LEU 86 -17.423 6.239 -22.110 682 HD11 LEU 86 HD11 LEU 86 -17.181 3.672 -22.813 683 HD12 LEU 86 HD12 LEU 86 -18.454 4.722 -23.431 684 HD13 LEU 86 HD13 LEU 86 -18.792 3.621 -22.097 685 HD21 LEU 86 HD21 LEU 86 -19.203 6.602 -20.828 686 HD22 LEU 86 HD22 LEU 86 -18.401 5.651 -19.578 687 HD23 LEU 86 HD23 LEU 86 -19.538 4.877 -20.685 688 H ASP 87 H ASP 87 -14.910 5.663 -17.875 689 HA ASP 87 HA ASP 87 -16.777 7.734 -16.924 690 HB2 ASP 87 HB2 ASP 87 -16.138 5.299 -15.281 691 HB3 ASP 87 HB1 ASP 87 -17.534 6.381 -15.176 692 HD2 ASP 87 HD2 ASP 87 -19.299 4.594 -17.537 693 H ASN 88 H ASN 88 -13.851 7.757 -17.494 694 HA ASN 88 HA ASN 88 -11.993 8.727 -16.607 695 HB2 ASN 88 HB2 ASN 88 -14.055 10.025 -15.392 696 HB3 ASN 88 HB1 ASN 88 -13.200 9.371 -13.991 697 HD21 ASN 88 HD21 ASN 88 -10.608 9.490 -14.710 698 HD22 ASN 88 HD22 ASN 88 -10.125 11.130 -14.965 699 H TYR 89 H TYR 89 -12.326 5.967 -16.322 700 HA TYR 89 HA TYR 89 -11.416 4.172 -15.265 701 HB2 TYR 89 HB2 TYR 89 -9.852 6.255 -13.717 702 HB3 TYR 89 HB1 TYR 89 -9.454 4.541 -13.851 703 HD1 TYR 89 HD2 TYR 89 -10.194 4.338 -16.854 704 HD2 TYR 89 HD1 TYR 89 -7.759 7.033 -14.637 705 HE1 TYR 89 HE2 TYR 89 -8.854 4.777 -18.870 706 HE2 TYR 89 HE1 TYR 89 -6.414 7.480 -16.647 707 HH TYR 89 HH TYR 89 -6.058 5.798 -19.034 708 H THR 90 H THR 90 -13.867 5.095 -14.298 709 HA THR 90 HA THR 90 -14.126 5.525 -11.587 710 HB THR 90 HB THR 90 -15.913 3.981 -13.465 711 HG1 THR 90 HG1 THR 90 -16.352 6.517 -12.266 712 HG21 THR 90 HG21 THR 90 -16.125 4.427 -10.542 713 HG22 THR 90 HG22 THR 90 -16.765 3.120 -11.539 714 HG23 THR 90 HG23 THR 90 -17.587 4.680 -11.495 715 H ALA 91 H ALA 91 -13.476 2.529 -13.290 716 HA ALA 91 HA ALA 91 -14.043 0.641 -11.363 717 HB1 ALA 91 HB1 ALA 91 -13.304 0.133 -13.661 718 HB2 ALA 91 HB2 ALA 91 -12.422 -0.788 -12.442 719 HB3 ALA 91 HB3 ALA 91 -11.664 0.605 -13.215 720 H LEU 92 H LEU 92 -11.268 2.790 -11.595 721 HA LEU 92 HA LEU 92 -9.715 1.560 -9.571 722 HB2 LEU 92 HB2 LEU 92 -8.254 3.336 -9.781 723 HB3 LEU 92 HB1 LEU 92 -9.040 3.285 -11.370 724 HG LEU 92 HG LEU 92 -10.637 5.072 -10.221 725 HD11 LEU 92 HD11 LEU 92 -9.904 5.533 -8.150 726 HD12 LEU 92 HD12 LEU 92 -8.715 6.530 -8.987 727 HD13 LEU 92 HD13 LEU 92 -8.288 4.900 -8.467 728 HD21 LEU 92 HD21 LEU 92 -8.597 5.102 -12.091 729 HD22 LEU 92 HD22 LEU 92 -8.167 6.395 -10.971 730 HD23 LEU 92 HD23 LEU 92 -9.741 6.404 -11.765 731 H VAL 93 H VAL 93 -12.235 4.000 -9.536 732 HA VAL 93 HA VAL 93 -11.868 4.928 -6.903 733 HB VAL 93 HB VAL 93 -14.295 4.859 -8.685 734 HG11 VAL 93 HG11 VAL 93 -14.043 5.695 -5.836 735 HG12 VAL 93 HG12 VAL 93 -15.096 6.619 -6.910 736 HG13 VAL 93 HG13 VAL 93 -15.379 4.895 -6.663 737 HG21 VAL 93 HG21 VAL 93 -13.392 7.456 -7.889 738 HG22 VAL 93 HG22 VAL 93 -12.034 6.529 -8.525 739 HG23 VAL 93 HG23 VAL 93 -13.481 6.757 -9.506 740 H ASP 94 H ASP 94 -14.035 2.424 -8.207 741 HA ASP 94 HA ASP 94 -15.002 1.666 -5.622 742 HB2 ASP 94 HB2 ASP 94 -16.198 1.404 -7.881 743 HB3 ASP 94 HB1 ASP 94 -15.176 -0.019 -8.115 744 HD2 ASP 94 HD2 ASP 94 -18.180 -0.251 -5.575 745 H ALA 95 H ALA 95 -12.396 0.662 -7.705 746 HA ALA 95 HA ALA 95 -11.869 -1.824 -6.413 747 HB1 ALA 95 HB1 ALA 95 -9.580 -1.485 -7.571 748 HB2 ALA 95 HB2 ALA 95 -10.356 -0.096 -8.332 749 HB3 ALA 95 HB3 ALA 95 -11.019 -1.714 -8.566 750 H ILE 96 H ILE 96 -10.135 1.297 -6.335 751 HA ILE 96 HA ILE 96 -8.338 0.611 -4.306 752 HB ILE 96 HB ILE 96 -9.425 3.330 -5.042 753 HG12 ILE 96 HG11 ILE 96 -8.256 2.138 -6.857 754 HG13 ILE 96 HG12 ILE 96 -7.359 3.567 -6.316 755 HG21 ILE 96 HG21 ILE 96 -7.063 2.579 -3.326 756 HG22 ILE 96 HG22 ILE 96 -7.402 4.205 -3.916 757 HG23 ILE 96 HG23 ILE 96 -8.525 3.417 -2.809 758 HD11 ILE 96 HD11 ILE 96 -5.835 1.741 -6.691 759 HD12 ILE 96 HD12 ILE 96 -5.896 2.124 -4.971 760 HD13 ILE 96 HD13 ILE 96 -6.752 0.712 -5.591 761 H TYR 97 H TYR 97 -11.577 2.000 -4.154 762 HA TYR 97 HA TYR 97 -11.616 2.652 -1.430 763 HB2 TYR 97 HB2 TYR 97 -13.670 2.119 -3.523 764 HB3 TYR 97 HB1 TYR 97 -14.200 2.085 -1.839 765 HD1 TYR 97 HD1 TYR 97 -11.612 4.286 -3.350 766 HD2 TYR 97 HD2 TYR 97 -15.501 4.022 -1.642 767 HE1 TYR 97 HE1 TYR 97 -11.762 6.741 -3.325 768 HE2 TYR 97 HE2 TYR 97 -15.661 6.477 -1.614 769 HH TYR 97 HH TYR 97 -13.686 8.469 -3.343 770 H SER 98 H SER 98 -12.122 -0.383 -3.101 771 HA SER 98 HA SER 98 -13.148 -1.771 -0.812 772 HB2 SER 98 HB2 SER 98 -12.275 -2.552 -3.576 773 HB3 SER 98 HB1 SER 98 -12.478 -3.808 -2.342 774 HG SER 98 HG SER 98 -14.623 -2.619 -2.021 775 H VAL 99 H VAL 99 -10.059 -1.936 -2.588 776 HA VAL 99 HA VAL 99 -8.758 -3.662 -0.803 777 HB VAL 99 HB VAL 99 -7.421 -1.537 -2.479 778 HG11 VAL 99 HG11 VAL 99 -6.515 -3.999 -1.070 779 HG12 VAL 99 HG12 VAL 99 -5.727 -3.547 -2.584 780 HG13 VAL 99 HG13 VAL 99 -5.728 -2.428 -1.220 781 HG21 VAL 99 HG21 VAL 99 -7.279 -3.886 -3.899 782 HG22 VAL 99 HG22 VAL 99 -8.924 -3.910 -3.263 783 HG23 VAL 99 HG23 VAL 99 -8.375 -2.544 -4.235 784 H GLU 100 H GLU 100 -8.510 -0.113 -1.080 785 HA GLU 100 HA GLU 100 -6.805 0.373 1.027 786 HB2 GLU 100 HB2 GLU 100 -7.479 2.602 0.952 787 HB3 GLU 100 HB1 GLU 100 -7.847 2.009 -0.676 788 HG2 GLU 100 HG1 GLU 100 -10.204 1.654 0.040 789 HG3 GLU 100 HG2 GLU 100 -9.794 2.419 1.581 790 HE2 GLU 100 HE2 GLU 100 -11.036 5.122 -0.343 791 H ASP 101 H ASP 101 -10.198 -0.437 1.098 792 HA ASP 101 HA ASP 101 -10.606 0.265 3.843 793 HB2 ASP 101 HB2 ASP 101 -12.567 0.272 2.559 794 HB3 ASP 101 HB1 ASP 101 -12.188 -1.286 1.812 795 HD2 ASP 101 HD2 ASP 101 -14.256 -2.741 4.111 796 H GLU 102 H GLU 102 -10.981 -2.964 2.401 797 HA GLU 102 HA GLU 102 -10.020 -4.141 4.888 798 HB2 GLU 102 HB2 GLU 102 -10.962 -6.189 4.153 799 HB3 GLU 102 HB1 GLU 102 -12.124 -4.925 3.722 800 HG2 GLU 102 HG1 GLU 102 -12.128 -6.138 1.793 801 HG3 GLU 102 HG2 GLU 102 -10.848 -4.971 1.432 802 HE2 GLU 102 HE2 GLU 102 -9.000 -7.775 0.639 803 H ASN 103 H ASN 103 -8.132 -5.199 5.117 804 HA ASN 103 HA ASN 103 -6.516 -5.701 2.713 805 HB2 ASN 103 HB2 ASN 103 -5.653 -4.324 5.262 806 HB3 ASN 103 HB1 ASN 103 -4.502 -5.013 4.110 807 HD21 ASN 103 HD21 ASN 103 -7.241 -2.778 4.274 808 HD22 ASN 103 HD22 ASN 103 -6.644 -1.685 3.077 809 H LYS 104 H LYS 104 -7.061 -6.407 6.131 810 HA LYS 104 HA LYS 104 -5.817 -9.047 5.713 811 HB2 LYS 104 HB2 LYS 104 -5.300 -9.098 8.093 812 HB3 LYS 104 HB1 LYS 104 -4.596 -7.659 7.336 813 HG2 LYS 104 HG1 LYS 104 -5.455 -6.670 9.181 814 HG3 LYS 104 HG2 LYS 104 -6.891 -6.589 8.144 815 HD2 LYS 104 HD1 LYS 104 -7.988 -8.269 9.274 816 HD3 LYS 104 HD2 LYS 104 -6.478 -9.020 9.821 817 HE2 LYS 104 HE1 LYS 104 -7.128 -6.282 10.820 818 HE3 LYS 104 HE2 LYS 104 -8.033 -7.656 11.473 819 HZ1 LYS 104 3HZ LYS 104 -6.330 -8.072 12.801 820 HZ2 LYS 104 1HZ LYS 104 -5.429 -6.815 12.116 821 HZ3 LYS 104 2HZ LYS 104 -5.343 -8.371 11.461 822 H GLN 105 H GLN 105 -8.599 -7.288 6.817 823 HA GLN 105 HA GLN 105 -9.910 -9.384 8.184 824 HB2 GLN 105 HB2 GLN 105 -10.897 -6.868 6.843 825 HB3 GLN 105 HB1 GLN 105 -11.992 -7.997 7.658 826 HG2 GLN 105 HG1 GLN 105 -11.258 -7.454 9.743 827 HG3 GLN 105 HG2 GLN 105 -9.636 -7.037 9.175 828 HE21 GLN 105 HE21 GLN 105 -9.173 -4.972 8.606 829 HE22 GLN 105 HE22 GLN 105 -10.286 -3.659 8.754 830 H SER 106 H SER 106 -12.305 -9.881 7.219 831 HA SER 106 HA SER 106 -12.242 -10.559 4.414 832 HB2 SER 106 HB2 SER 106 -12.680 -12.899 6.237 833 HB3 SER 106 HB1 SER 106 -12.119 -12.866 4.555 834 HG SER 106 HG SER 106 -10.113 -12.182 5.246 835 H GLU 107 H GLU 107 -14.277 -11.289 3.615 836 HA GLU 107 HA GLU 107 -16.497 -10.214 5.097 837 HB2 GLU 107 HB2 GLU 107 -16.228 -11.504 2.383 838 HB3 GLU 107 HB1 GLU 107 -17.798 -11.038 3.055 839 HG2 GLU 107 HG1 GLU 107 -16.738 -8.706 3.363 840 HG3 GLU 107 HG2 GLU 107 -15.522 -9.291 2.218 841 HE2 GLU 107 HE2 GLU 107 -19.127 -8.418 0.870 842 H GLY 108 H GLY 108 -15.592 -13.430 3.870 843 HA2 GLY 108 HA2 GLY 108 -17.370 -14.587 5.922 844 HA3 GLY 108 3HA GLY 108 -17.366 -15.205 4.276 845 H SER 109 H SER 109 -16.306 -17.051 4.100 846 HA SER 109 HA SER 109 -14.626 -18.123 6.059 847 HB2 SER 109 HB2 SER 109 -15.845 -19.425 4.294 848 HB3 SER 109 HB1 SER 109 -14.639 -18.859 3.125 849 HG SER 109 HG SER 109 -13.843 -20.156 5.497 Start of MODEL 12 1 H1 MET 1 H MET 1 -48.817 -63.017 -50.217 2 HA MET 1 HA MET 1 -47.859 -65.292 -51.786 3 HB2 MET 1 HB2 MET 1 -50.082 -66.092 -52.267 4 HB3 MET 1 HB1 MET 1 -49.858 -66.043 -50.511 5 HG2 MET 1 HG1 MET 1 -51.051 -63.847 -50.479 6 HG3 MET 1 HG2 MET 1 -51.392 -64.081 -52.195 7 HE1 MET 1 HE1 MET 1 -54.413 -65.920 -52.424 8 HE2 MET 1 HE2 MET 1 -53.024 -65.116 -53.153 9 HE3 MET 1 HE3 MET 1 -52.968 -66.848 -52.827 10 H GLY 2 H GLY 2 -48.087 -65.058 -54.018 11 HA2 GLY 2 HA2 GLY 2 -49.422 -63.655 -55.720 12 HA3 GLY 2 3HA GLY 2 -48.691 -62.304 -54.867 13 H SER 3 H SER 3 -47.057 -61.462 -55.955 14 HA SER 3 HA SER 3 -45.593 -63.078 -57.875 15 HB2 SER 3 HB2 SER 3 -46.435 -60.700 -58.314 16 HB3 SER 3 HB1 SER 3 -45.117 -60.162 -57.256 17 HG SER 3 HG SER 3 -44.884 -60.544 -59.762 18 H SER 4 H SER 4 -43.112 -62.198 -57.952 19 HA SER 4 HA SER 4 -41.906 -63.389 -55.646 20 HB2 SER 4 HB2 SER 4 -39.748 -62.587 -56.874 21 HB3 SER 4 HB1 SER 4 -40.740 -63.855 -57.615 22 HG SER 4 HG SER 4 -40.140 -61.407 -58.564 23 H HIS 5 H HIS 5 -39.784 -62.159 -54.857 24 HA HIS 5 HA HIS 5 -40.634 -59.454 -54.051 25 HB2 HIS 5 HB2 HIS 5 -39.447 -61.711 -52.488 26 HB3 HIS 5 HB1 HIS 5 -39.042 -60.056 -52.019 27 HD1 HIS 5 HD1 HIS 5 -40.423 -61.088 -49.814 28 HD2 HIS 5 HD2 HIS 5 -42.601 -59.946 -53.164 29 HE1 HIS 5 HE1 HIS 5 -42.780 -60.758 -49.003 30 HE2 HIS 5 HE2 HIS 5 -44.112 -60.060 -51.050 31 H HIS 6 H HIS 6 -38.572 -58.283 -53.053 32 HA HIS 6 HA HIS 6 -36.218 -58.777 -54.720 33 HB2 HIS 6 HB2 HIS 6 -36.065 -56.489 -55.458 34 HB3 HIS 6 HB1 HIS 6 -37.651 -57.122 -55.909 35 HD1 HIS 6 HD1 HIS 6 -36.271 -54.160 -54.653 36 HD2 HIS 6 HD2 HIS 6 -39.599 -56.419 -53.613 37 HE1 HIS 6 HE1 HIS 6 -37.779 -52.593 -53.389 38 HE2 HIS 6 HE2 HIS 6 -39.813 -53.973 -52.752 39 H HIS 7 H HIS 7 -34.473 -57.030 -54.067 40 HA HIS 7 HA HIS 7 -34.296 -57.168 -51.147 41 HB2 HIS 7 HB2 HIS 7 -32.261 -56.873 -53.348 42 HB3 HIS 7 HB1 HIS 7 -31.849 -56.491 -51.673 43 HD1 HIS 7 HD1 HIS 7 -34.085 -59.389 -52.488 44 HD2 HIS 7 HD2 HIS 7 -30.147 -58.672 -51.376 45 HE1 HIS 7 HE1 HIS 7 -33.132 -61.640 -51.899 46 HE2 HIS 7 HE2 HIS 7 -30.725 -61.204 -51.221 47 H HIS 8 H HIS 8 -32.687 -55.242 -50.386 48 HA HIS 8 HA HIS 8 -33.488 -52.698 -51.536 49 HB2 HIS 8 HB2 HIS 8 -35.279 -53.349 -49.893 50 HB3 HIS 8 HB1 HIS 8 -34.051 -53.284 -48.625 51 HD1 HIS 8 HD1 HIS 8 -34.892 -50.828 -51.416 52 HD2 HIS 8 HD2 HIS 8 -34.416 -50.969 -47.292 53 HE1 HIS 8 HE1 HIS 8 -35.205 -48.463 -50.623 54 HE2 HIS 8 HE2 HIS 8 -34.914 -48.549 -48.101 55 H HIS 9 H HIS 9 -32.295 -50.881 -50.638 56 HA HIS 9 HA HIS 9 -29.657 -51.732 -49.676 57 HB2 HIS 9 HB2 HIS 9 -30.603 -49.254 -51.121 58 HB3 HIS 9 HB1 HIS 9 -28.992 -49.380 -50.406 59 HD1 HIS 9 HD1 HIS 9 -30.853 -51.983 -52.459 60 HD2 HIS 9 HD2 HIS 9 -27.373 -49.715 -52.554 61 HE1 HIS 9 HE1 HIS 9 -29.581 -52.787 -54.474 62 HE2 HIS 9 HE2 HIS 9 -27.455 -51.401 -54.535 63 H HIS 10 H HIS 10 -28.571 -49.717 -48.450 64 HA HIS 10 HA HIS 10 -30.438 -48.963 -46.297 65 HB2 HIS 10 HB2 HIS 10 -28.667 -49.191 -44.690 66 HB3 HIS 10 HB1 HIS 10 -28.754 -50.685 -45.630 67 HD1 HIS 10 HD1 HIS 10 -26.791 -51.222 -47.227 68 HD2 HIS 10 HD2 HIS 10 -26.298 -47.724 -45.041 69 HE1 HIS 10 HE1 HIS 10 -24.373 -50.589 -47.507 70 HE2 HIS 10 HE2 HIS 10 -24.070 -48.450 -46.171 71 H SER 11 H SER 11 -29.187 -47.157 -44.895 72 HA SER 11 HA SER 11 -28.036 -45.170 -46.717 73 HB2 SER 11 HB2 SER 11 -30.194 -44.417 -44.737 74 HB3 SER 11 HB1 SER 11 -29.539 -43.451 -46.070 75 HG SER 11 HG SER 11 -30.678 -44.600 -47.505 76 H SER 12 H SER 12 -27.666 -43.070 -45.139 77 HA SER 12 HA SER 12 -26.630 -43.871 -42.556 78 HB2 SER 12 HB2 SER 12 -24.342 -42.921 -43.099 79 HB3 SER 12 HB1 SER 12 -24.723 -44.475 -43.861 80 HG SER 12 HG SER 12 -23.805 -42.635 -45.193 81 H GLY 13 H GLY 13 -27.020 -42.289 -41.157 82 HA2 GLY 13 HA2 GLY 13 -27.476 -39.580 -42.227 83 HA3 GLY 13 3HA GLY 13 -28.182 -40.213 -40.748 84 H LEU 14 H LEU 14 -27.441 -38.889 -39.200 85 HA LEU 14 HA LEU 14 -24.625 -38.965 -38.577 86 HB2 LEU 14 HB2 LEU 14 -24.646 -36.385 -38.339 87 HB3 LEU 14 HB1 LEU 14 -24.364 -37.118 -39.928 88 HG LEU 14 HG LEU 14 -25.904 -35.091 -39.826 89 HD11 LEU 14 HD11 LEU 14 -25.818 -37.269 -41.493 90 HD12 LEU 14 HD12 LEU 14 -26.693 -35.770 -41.799 91 HD13 LEU 14 HD13 LEU 14 -27.530 -37.150 -41.089 92 HD21 LEU 14 HD21 LEU 14 -27.977 -37.082 -38.965 93 HD22 LEU 14 HD22 LEU 14 -28.103 -35.325 -39.069 94 HD23 LEU 14 HD23 LEU 14 -27.129 -36.066 -37.798 95 H VAL 15 H VAL 15 -24.233 -37.511 -36.552 96 HA VAL 15 HA VAL 15 -26.574 -37.289 -34.839 97 HB VAL 15 HB VAL 15 -25.303 -38.543 -33.000 98 HG11 VAL 15 HG11 VAL 15 -26.266 -40.258 -35.276 99 HG12 VAL 15 HG12 VAL 15 -26.362 -40.587 -33.545 100 HG13 VAL 15 HG13 VAL 15 -27.354 -39.315 -34.259 101 HG21 VAL 15 HG21 VAL 15 -23.979 -39.929 -35.313 102 HG22 VAL 15 HG22 VAL 15 -23.191 -38.619 -34.432 103 HG23 VAL 15 HG23 VAL 15 -23.646 -40.100 -33.589 104 HA PRO 16 HA PRO 16 -24.402 -33.871 -33.146 105 HB2 PRO 16 HB2 PRO 16 -25.335 -33.851 -30.571 106 HB3 PRO 16 HB1 PRO 16 -26.313 -33.389 -31.964 107 HG2 PRO 16 HG1 PRO 16 -26.188 -36.012 -30.514 108 HG3 PRO 16 HG2 PRO 16 -27.630 -35.084 -31.071 109 HD2 PRO 16 HD1 PRO 16 -26.662 -37.233 -32.417 110 HD3 PRO 16 HD2 PRO 16 -27.409 -35.850 -33.234 111 H ARG 17 H ARG 17 -23.315 -33.320 -30.811 112 HA ARG 17 HA ARG 17 -21.521 -35.556 -30.146 113 HB2 ARG 17 HB2 ARG 17 -20.765 -33.335 -31.605 114 HB3 ARG 17 HB1 ARG 17 -20.277 -32.919 -29.955 115 HG2 ARG 17 HG1 ARG 17 -19.215 -35.295 -29.938 116 HG3 ARG 17 HG2 ARG 17 -19.317 -35.140 -31.700 117 HD2 ARG 17 HD1 ARG 17 -18.252 -32.729 -31.071 118 HD3 ARG 17 HD2 ARG 17 -17.588 -33.731 -29.773 119 HE ARG 17 HE ARG 17 -16.211 -34.722 -31.301 120 HH11 ARG 17 1HH1 ARG 17 -18.835 -33.178 -32.990 121 HH12 ARG 17 2HH1 ARG 17 -18.173 -33.479 -34.563 122 HH21 ARG 17 1HH2 ARG 17 -15.329 -35.124 -33.366 123 HH22 ARG 17 2HH2 ARG 17 -16.179 -34.587 -34.775 124 H GLY 18 H GLY 18 -21.060 -35.826 -28.019 125 HA2 GLY 18 HA2 GLY 18 -21.923 -33.716 -26.151 126 HA3 GLY 18 3HA GLY 18 -22.474 -35.370 -25.926 127 H SER 19 H SER 19 -19.977 -33.120 -25.361 128 HA SER 19 HA SER 19 -18.427 -35.205 -23.986 129 HB2 SER 19 HB2 SER 19 -16.327 -34.101 -24.668 130 HB3 SER 19 HB1 SER 19 -17.250 -34.674 -26.069 131 HG SER 19 HG SER 19 -16.503 -32.153 -25.432 132 H HIS 20 H HIS 20 -18.620 -34.756 -21.895 133 HA HIS 20 HA HIS 20 -19.056 -32.074 -20.943 134 HB2 HIS 20 HB2 HIS 20 -18.496 -34.553 -19.301 135 HB3 HIS 20 HB1 HIS 20 -19.282 -33.065 -18.762 136 HD1 HIS 20 HD1 HIS 20 -19.981 -36.298 -20.393 137 HD2 HIS 20 HD2 HIS 20 -21.952 -32.701 -19.733 138 HE1 HIS 20 HE1 HIS 20 -22.406 -36.764 -20.868 139 HE2 HIS 20 HE2 HIS 20 -23.612 -34.566 -20.464 140 H MET 21 H MET 21 -17.724 -31.040 -19.313 141 HA MET 21 HA MET 21 -14.906 -31.864 -19.345 142 HB2 MET 21 HB2 MET 21 -15.964 -29.085 -19.913 143 HB3 MET 21 HB1 MET 21 -14.263 -29.458 -19.594 144 HG2 MET 21 HG1 MET 21 -14.019 -30.666 -21.590 145 HG3 MET 21 HG2 MET 21 -15.766 -30.797 -21.810 146 HE1 MET 21 HE1 MET 21 -16.553 -28.376 -24.238 147 HE2 MET 21 HE2 MET 21 -16.939 -29.766 -23.222 148 HE3 MET 21 HE3 MET 21 -17.275 -28.132 -22.647 149 H ILE 22 H ILE 22 -15.158 -32.603 -17.216 150 HA ILE 22 HA ILE 22 -15.512 -30.465 -15.218 151 HB ILE 22 HB ILE 22 -17.345 -32.147 -15.184 152 HG12 ILE 22 HG11 ILE 22 -17.237 -32.591 -12.750 153 HG13 ILE 22 HG12 ILE 22 -15.533 -32.105 -12.759 154 HG21 ILE 22 HG21 ILE 22 -15.284 -33.967 -15.541 155 HG22 ILE 22 HG22 ILE 22 -15.817 -34.231 -13.882 156 HG23 ILE 22 HG23 ILE 22 -16.975 -34.342 -15.208 157 HD11 ILE 22 HD11 ILE 22 -16.006 -29.898 -12.927 158 HD12 ILE 22 HD12 ILE 22 -17.486 -30.169 -13.848 159 HD13 ILE 22 HD13 ILE 22 -17.473 -30.428 -12.103 160 H SER 23 H SER 23 -14.081 -30.368 -13.517 161 HA SER 23 HA SER 23 -11.458 -31.133 -13.914 162 HB2 SER 23 HB2 SER 23 -12.971 -30.437 -11.391 163 HB3 SER 23 HB1 SER 23 -11.230 -30.768 -11.385 164 HG SER 23 HG SER 23 -11.107 -28.713 -11.847 165 H LEU 24 H LEU 24 -13.710 -32.618 -11.575 166 HA LEU 24 HA LEU 24 -13.831 -34.710 -10.695 167 HB2 LEU 24 HB2 LEU 24 -13.916 -35.160 -13.231 168 HB3 LEU 24 HB1 LEU 24 -12.239 -35.699 -13.037 169 HG LEU 24 HG LEU 24 -13.174 -37.306 -11.256 170 HD11 LEU 24 HD11 LEU 24 -15.692 -37.566 -12.604 171 HD12 LEU 24 HD12 LEU 24 -15.538 -35.951 -11.913 172 HD13 LEU 24 HD13 LEU 24 -15.358 -37.371 -10.883 173 HD21 LEU 24 HD21 LEU 24 -12.328 -38.287 -13.182 174 HD22 LEU 24 HD22 LEU 24 -13.534 -37.526 -14.221 175 HD23 LEU 24 HD23 LEU 24 -13.998 -38.853 -13.154 176 H SER 25 H SER 25 -11.603 -33.019 -9.994 177 HA SER 25 HA SER 25 -10.023 -34.908 -8.590 178 HB2 SER 25 HB2 SER 25 -7.834 -34.418 -9.617 179 HB3 SER 25 HB1 SER 25 -8.939 -35.186 -10.772 180 HG SER 25 HG SER 25 -8.793 -33.483 -11.979 181 H GLY 26 H GLY 26 -8.077 -33.732 -7.520 182 HA2 GLY 26 HA2 GLY 26 -7.362 -31.319 -7.074 183 HA3 GLY 26 3HA GLY 26 -9.060 -31.079 -6.689 184 H LEU 27 H LEU 27 -6.301 -33.148 -5.807 185 HA LEU 27 HA LEU 27 -7.207 -32.976 -3.011 186 HB2 LEU 27 HB2 LEU 27 -6.776 -35.219 -2.606 187 HB3 LEU 27 HB1 LEU 27 -7.534 -35.223 -4.208 188 HG LEU 27 HG LEU 27 -4.562 -35.411 -3.724 189 HD11 LEU 27 HD11 LEU 27 -5.709 -37.765 -4.852 190 HD12 LEU 27 HD12 LEU 27 -6.553 -37.374 -3.354 191 HD13 LEU 27 HD13 LEU 27 -4.802 -37.581 -3.351 192 HD21 LEU 27 HD21 LEU 27 -4.871 -34.531 -5.869 193 HD22 LEU 27 HD22 LEU 27 -6.296 -35.526 -6.172 194 HD23 LEU 27 HD23 LEU 27 -4.695 -36.266 -6.132 195 H THR 28 H THR 28 -5.064 -31.708 -4.885 196 HA THR 28 HA THR 28 -2.983 -31.690 -2.844 197 HB THR 28 HB THR 28 -1.167 -32.068 -4.407 198 HG1 THR 28 HG1 THR 28 -3.105 -32.708 -6.387 199 HG21 THR 28 HG21 THR 28 -3.162 -34.289 -4.818 200 HG22 THR 28 HG22 THR 28 -2.336 -34.013 -3.284 201 HG23 THR 28 HG23 THR 28 -1.405 -34.408 -4.728 202 H SER 29 H SER 29 -1.130 -30.123 -3.777 203 HA SER 29 HA SER 29 -2.443 -27.592 -4.104 204 HB2 SER 29 HB2 SER 29 -0.274 -26.604 -3.840 205 HB3 SER 29 HB1 SER 29 -0.366 -27.972 -2.718 206 HG SER 29 HG SER 29 1.562 -28.187 -3.745 207 H SER 30 H SER 30 -1.311 -26.010 -5.734 208 HA SER 30 HA SER 30 -0.587 -27.187 -8.263 209 HB2 SER 30 HB2 SER 30 -3.168 -25.602 -8.068 210 HB3 SER 30 HB1 SER 30 -2.450 -26.272 -9.544 211 HG SER 30 HG SER 30 -4.182 -27.535 -8.474 212 H VAL 31 H VAL 31 0.024 -25.579 -9.859 213 HA VAL 31 HA VAL 31 1.458 -23.819 -10.281 214 HB VAL 31 HB VAL 31 0.298 -21.641 -10.189 215 HG11 VAL 31 HG11 VAL 31 -0.156 -23.556 -11.897 216 HG12 VAL 31 HG12 VAL 31 -1.738 -23.618 -11.118 217 HG13 VAL 31 HG13 VAL 31 -1.189 -22.127 -11.883 218 HG21 VAL 31 HG21 VAL 31 -0.850 -22.139 -8.000 219 HG22 VAL 31 HG22 VAL 31 -1.856 -21.376 -9.231 220 HG23 VAL 31 HG23 VAL 31 -2.004 -23.106 -8.918 221 H GLU 32 H GLU 32 2.176 -24.894 -7.847 222 HA GLU 32 HA GLU 32 2.266 -22.948 -5.770 223 HB2 GLU 32 HB2 GLU 32 3.924 -24.463 -4.724 224 HB3 GLU 32 HB1 GLU 32 2.444 -25.296 -5.225 225 HG2 GLU 32 HG1 GLU 32 4.199 -25.455 -7.415 226 HG3 GLU 32 HG2 GLU 32 5.158 -25.814 -5.972 227 HE2 GLU 32 HE2 GLU 32 3.322 -28.733 -5.338 228 H SER 33 H SER 33 4.222 -23.635 -8.546 229 HA SER 33 HA SER 33 6.181 -21.621 -7.653 230 HB2 SER 33 HB2 SER 33 6.776 -23.609 -9.831 231 HB3 SER 33 HB1 SER 33 7.895 -22.760 -8.750 232 HG SER 33 HG SER 33 6.716 -24.068 -7.044 233 H ASP 34 H ASP 34 3.943 -22.586 -10.103 234 HA ASP 34 HA ASP 34 4.798 -21.091 -12.286 235 HB2 ASP 34 HB2 ASP 34 3.015 -22.654 -12.578 236 HB3 ASP 34 HB1 ASP 34 2.021 -21.835 -11.364 237 HD2 ASP 34 HD2 ASP 34 0.545 -20.156 -13.955 238 H LEU 35 H LEU 35 3.352 -20.069 -9.312 239 HA LEU 35 HA LEU 35 2.345 -17.567 -10.130 240 HB2 LEU 35 HB2 LEU 35 2.915 -18.948 -7.611 241 HB3 LEU 35 HB1 LEU 35 3.107 -17.188 -7.522 242 HG LEU 35 HG LEU 35 0.872 -17.970 -6.812 243 HD11 LEU 35 HD11 LEU 35 1.473 -15.753 -8.139 244 HD12 LEU 35 HD12 LEU 35 -0.179 -16.146 -7.663 245 HD13 LEU 35 HD13 LEU 35 0.363 -16.462 -9.312 246 HD21 LEU 35 HD21 LEU 35 1.060 -19.646 -9.006 247 HD22 LEU 35 HD22 LEU 35 -0.137 -18.444 -9.490 248 HD23 LEU 35 HD23 LEU 35 -0.370 -19.377 -8.010 249 H ASP 36 H ASP 36 5.547 -18.689 -9.448 250 HA ASP 36 HA ASP 36 6.818 -16.266 -8.845 251 HB2 ASP 36 HB2 ASP 36 7.722 -18.694 -8.749 252 HB3 ASP 36 HB1 ASP 36 8.148 -18.437 -10.447 253 HD2 ASP 36 HD2 ASP 36 10.392 -16.810 -7.685 254 H MET 37 H MET 37 5.707 -17.597 -11.859 255 HA MET 37 HA MET 37 7.223 -15.772 -13.498 256 HB2 MET 37 HB2 MET 37 6.754 -17.873 -14.489 257 HB3 MET 37 HB1 MET 37 5.035 -17.760 -14.079 258 HG2 MET 37 HG1 MET 37 4.534 -16.603 -15.926 259 HG3 MET 37 HG2 MET 37 5.958 -15.572 -15.763 260 HE1 MET 37 HE1 MET 37 4.834 -16.112 -18.222 261 HE2 MET 37 HE2 MET 37 6.063 -16.730 -19.326 262 HE3 MET 37 HE3 MET 37 4.758 -17.785 -18.778 263 H GLN 38 H GLN 38 4.016 -15.935 -12.109 264 HA GLN 38 HA GLN 38 2.721 -13.998 -13.639 265 HB2 GLN 38 HB2 GLN 38 1.958 -15.591 -11.620 266 HB3 GLN 38 HB1 GLN 38 2.140 -14.071 -10.729 267 HG2 GLN 38 HG1 GLN 38 0.610 -12.969 -12.313 268 HG3 GLN 38 HG2 GLN 38 0.390 -14.521 -13.135 269 HE21 GLN 38 HE21 GLN 38 -0.588 -16.259 -11.954 270 HE22 GLN 38 HE22 GLN 38 -1.697 -15.916 -10.674 271 H GLN 39 H GLN 39 5.184 -13.682 -11.248 272 HA GLN 39 HA GLN 39 4.779 -11.116 -10.287 273 HB2 GLN 39 HB2 GLN 39 7.347 -12.587 -10.913 274 HB3 GLN 39 HB1 GLN 39 7.292 -11.038 -10.056 275 HG2 GLN 39 HG1 GLN 39 6.166 -13.683 -9.155 276 HG3 GLN 39 HG2 GLN 39 7.482 -12.751 -8.427 277 HE21 GLN 39 HE21 GLN 39 4.048 -13.027 -8.819 278 HE22 GLN 39 HE22 GLN 39 3.609 -11.896 -7.589 279 H ALA 40 H ALA 40 6.159 -12.171 -13.346 280 HA ALA 40 HA ALA 40 7.179 -9.691 -14.198 281 HB1 ALA 40 HB1 ALA 40 7.905 -11.619 -15.347 282 HB2 ALA 40 HB2 ALA 40 6.943 -10.700 -16.505 283 HB3 ALA 40 HB3 ALA 40 6.254 -12.117 -15.714 284 H MET 41 H MET 41 3.957 -10.965 -14.094 285 HA MET 41 HA MET 41 2.860 -9.084 -15.975 286 HB2 MET 41 HB2 MET 41 1.539 -10.936 -13.978 287 HB3 MET 41 HB1 MET 41 0.669 -9.961 -15.173 288 HG2 MET 41 HG1 MET 41 2.739 -12.036 -15.888 289 HG3 MET 41 HG2 MET 41 1.004 -12.348 -15.806 290 HE1 MET 41 HE1 MET 41 3.855 -10.617 -17.201 291 HE2 MET 41 HE2 MET 41 3.632 -11.283 -18.818 292 HE3 MET 41 HE3 MET 41 3.283 -9.582 -18.510 293 H LEU 42 H LEU 42 2.889 -9.442 -12.445 294 HA LEU 42 HA LEU 42 1.329 -7.135 -11.920 295 HB2 LEU 42 HB2 LEU 42 3.241 -8.756 -10.246 296 HB3 LEU 42 HB1 LEU 42 2.379 -7.343 -9.614 297 HG LEU 42 HG LEU 42 0.252 -8.632 -10.413 298 HD11 LEU 42 HD11 LEU 42 1.384 -10.413 -11.588 299 HD12 LEU 42 HD12 LEU 42 0.521 -11.072 -10.198 300 HD13 LEU 42 HD13 LEU 42 2.269 -10.854 -10.128 301 HD21 LEU 42 HD21 LEU 42 -0.022 -8.664 -8.214 302 HD22 LEU 42 HD22 LEU 42 1.716 -8.484 -7.980 303 HD23 LEU 42 HD23 LEU 42 1.005 -10.094 -8.108 304 H THR 43 H THR 43 4.715 -7.663 -12.517 305 HA THR 43 HA THR 43 5.382 -4.927 -11.727 306 HB THR 43 HB THR 43 6.881 -6.805 -11.047 307 HG1 THR 43 HG1 THR 43 8.575 -5.491 -11.242 308 HG21 THR 43 HG21 THR 43 7.953 -6.903 -13.828 309 HG22 THR 43 HG22 THR 43 6.541 -7.881 -13.430 310 HG23 THR 43 HG23 THR 43 8.047 -8.104 -12.541 311 H ASN 44 H ASN 44 3.744 -5.637 -14.122 312 HA ASN 44 HA ASN 44 5.455 -4.936 -16.359 313 HB2 ASN 44 HB2 ASN 44 3.677 -6.616 -16.653 314 HB3 ASN 44 HB1 ASN 44 2.465 -5.393 -16.249 315 HD21 ASN 44 HD21 ASN 44 5.344 -5.273 -18.309 316 HD22 ASN 44 HD22 ASN 44 4.512 -4.776 -19.739 317 H LYS 45 H LYS 45 6.112 -2.845 -16.120 318 HA LYS 45 HA LYS 45 4.071 -0.782 -15.707 319 HB2 LYS 45 HB2 LYS 45 7.092 -0.692 -15.593 320 HB3 LYS 45 HB1 LYS 45 6.058 0.736 -15.431 321 HG2 LYS 45 HG1 LYS 45 6.193 0.328 -13.236 322 HG3 LYS 45 HG2 LYS 45 4.965 -0.907 -13.569 323 HD2 LYS 45 HD1 LYS 45 6.583 -2.077 -12.362 324 HD3 LYS 45 HD2 LYS 45 6.961 -2.465 -14.050 325 HE2 LYS 45 HE1 LYS 45 8.838 -1.085 -14.096 326 HE3 LYS 45 HE2 LYS 45 8.280 -0.137 -12.710 327 HZ1 LYS 45 3HZ LYS 45 8.527 -2.571 -11.621 328 HZ2 LYS 45 1HZ LYS 45 9.739 -1.390 -11.592 329 HZ3 LYS 45 2HZ LYS 45 9.775 -2.610 -12.763 330 H ASP 46 H ASP 46 3.641 0.794 -17.193 331 HA ASP 46 HA ASP 46 5.223 0.980 -19.622 332 HB2 ASP 46 HB2 ASP 46 2.485 -0.190 -19.496 333 HB3 ASP 46 HB1 ASP 46 2.853 0.884 -20.852 334 HD2 ASP 46 HD2 ASP 46 4.474 -2.700 -20.791 335 H GLU 47 H GLU 47 4.637 2.832 -20.946 336 HA GLU 47 HA GLU 47 4.191 5.146 -19.431 337 HB2 GLU 47 HB2 GLU 47 3.999 6.305 -21.628 338 HB3 GLU 47 HB1 GLU 47 5.430 5.273 -21.487 339 HG2 GLU 47 HG1 GLU 47 3.946 3.477 -22.637 340 HG3 GLU 47 HG2 GLU 47 2.970 4.870 -23.127 341 HE2 GLU 47 HE2 GLU 47 5.168 5.651 -25.624 342 H LYS 48 H LYS 48 2.037 3.351 -21.603 343 HA LYS 48 HA LYS 48 -0.167 5.078 -21.439 344 HB2 LYS 48 HB2 LYS 48 -1.500 3.013 -22.063 345 HB3 LYS 48 HB1 LYS 48 -0.177 3.446 -23.157 346 HG2 LYS 48 HG1 LYS 48 0.113 1.177 -22.982 347 HG3 LYS 48 HG2 LYS 48 1.199 1.771 -21.713 348 HD2 LYS 48 HD1 LYS 48 0.006 0.809 -20.077 349 HD3 LYS 48 HD2 LYS 48 -1.528 1.366 -20.767 350 HE2 LYS 48 HE1 LYS 48 0.066 -1.045 -21.674 351 HE3 LYS 48 HE2 LYS 48 -1.428 -1.069 -20.725 352 HZ1 LYS 48 3HZ LYS 48 -2.442 -1.229 -22.688 353 HZ2 LYS 48 1HZ LYS 48 -1.071 -0.749 -23.556 354 HZ3 LYS 48 2HZ LYS 48 -2.101 0.416 -22.890 355 H VAL 49 H VAL 49 0.995 2.582 -19.293 356 HA VAL 49 HA VAL 49 -1.367 2.285 -17.751 357 HB VAL 49 HB VAL 49 1.517 1.617 -17.275 358 HG11 VAL 49 HG11 VAL 49 1.080 2.074 -15.084 359 HG12 VAL 49 HG12 VAL 49 -0.655 1.806 -15.258 360 HG13 VAL 49 HG13 VAL 49 0.447 0.431 -15.164 361 HG21 VAL 49 HG21 VAL 49 0.877 -0.305 -18.184 362 HG22 VAL 49 HG22 VAL 49 -0.252 -0.547 -16.851 363 HG23 VAL 49 HG23 VAL 49 -0.781 0.284 -18.313 364 H LEU 50 H LEU 50 1.483 4.355 -17.451 365 HA LEU 50 HA LEU 50 1.064 5.423 -14.938 366 HB2 LEU 50 HB2 LEU 50 2.056 6.912 -17.376 367 HB3 LEU 50 HB1 LEU 50 2.333 7.353 -15.681 368 HG LEU 50 HG LEU 50 3.436 4.926 -17.093 369 HD11 LEU 50 HD11 LEU 50 4.759 6.634 -17.855 370 HD12 LEU 50 HD12 LEU 50 5.598 6.214 -16.362 371 HD13 LEU 50 HD13 LEU 50 4.525 7.611 -16.405 372 HD21 LEU 50 HD21 LEU 50 4.828 5.027 -14.833 373 HD22 LEU 50 HD22 LEU 50 3.320 4.122 -14.968 374 HD23 LEU 50 HD23 LEU 50 3.323 5.730 -14.241 375 H LYS 51 H LYS 51 -0.535 6.174 -17.964 376 HA LYS 51 HA LYS 51 -1.751 8.579 -17.389 377 HB2 LYS 51 HB2 LYS 51 -2.851 6.203 -18.906 378 HB3 LYS 51 HB1 LYS 51 -3.583 7.814 -18.916 379 HG2 LYS 51 HG1 LYS 51 -0.961 8.332 -19.583 380 HG3 LYS 51 HG2 LYS 51 -1.302 6.796 -20.400 381 HD2 LYS 51 HD1 LYS 51 -2.893 7.703 -21.775 382 HD3 LYS 51 HD2 LYS 51 -3.343 8.949 -20.596 383 HE2 LYS 51 HE1 LYS 51 -1.401 10.252 -21.092 384 HE3 LYS 51 HE2 LYS 51 -0.711 8.940 -22.059 385 HZ1 LYS 51 3HZ LYS 51 -1.818 10.855 -23.288 386 HZ2 LYS 51 1HZ LYS 51 -3.290 10.183 -22.791 387 HZ3 LYS 51 2HZ LYS 51 -2.237 9.287 -23.765 388 H ALA 52 H ALA 52 -2.560 5.375 -16.235 389 HA ALA 52 HA ALA 52 -5.097 6.075 -15.134 390 HB1 ALA 52 HB1 ALA 52 -3.521 3.711 -15.415 391 HB2 ALA 52 HB2 ALA 52 -5.240 3.865 -15.048 392 HB3 ALA 52 HB3 ALA 52 -4.056 3.856 -13.741 393 H LEU 53 H LEU 53 -1.815 5.829 -13.835 394 HA LEU 53 HA LEU 53 -2.420 6.219 -11.133 395 HB2 LEU 53 HB2 LEU 53 0.044 7.072 -12.665 396 HB3 LEU 53 HB1 LEU 53 -0.089 6.954 -10.901 397 HG LEU 53 HG LEU 53 -0.310 4.630 -12.814 398 HD11 LEU 53 HD11 LEU 53 1.882 3.991 -12.042 399 HD12 LEU 53 HD12 LEU 53 1.949 5.388 -10.968 400 HD13 LEU 53 HD13 LEU 53 1.951 5.619 -12.717 401 HD21 LEU 53 HD21 LEU 53 0.286 3.767 -10.228 402 HD22 LEU 53 HD22 LEU 53 -1.238 3.572 -11.096 403 HD23 LEU 53 HD23 LEU 53 -0.997 4.962 -10.037 404 H GLU 54 H GLU 54 -2.507 8.398 -13.776 405 HA GLU 54 HA GLU 54 -2.058 10.830 -12.410 406 HB2 GLU 54 HB2 GLU 54 -3.716 10.296 -14.887 407 HB3 GLU 54 HB1 GLU 54 -3.162 11.886 -14.342 408 HG2 GLU 54 HG1 GLU 54 -0.798 10.639 -14.448 409 HG3 GLU 54 HG2 GLU 54 -1.672 9.716 -15.679 410 HE2 GLU 54 HE2 GLU 54 -1.676 12.375 -17.888 411 H ARG 55 H ARG 55 -4.994 8.976 -13.092 412 HA ARG 55 HA ARG 55 -6.727 10.903 -11.858 413 HB2 ARG 55 HB2 ARG 55 -7.679 9.590 -13.591 414 HB3 ARG 55 HB1 ARG 55 -7.136 8.083 -12.838 415 HG2 ARG 55 HG1 ARG 55 -9.550 8.425 -12.581 416 HG3 ARG 55 HG2 ARG 55 -8.707 8.374 -11.024 417 HD2 ARG 55 HD1 ARG 55 -9.293 10.476 -10.502 418 HD3 ARG 55 HD2 ARG 55 -8.884 11.066 -12.119 419 HE ARG 55 HE ARG 55 -11.262 9.636 -12.334 420 HH11 ARG 55 1HH1 ARG 55 -10.077 12.523 -10.792 421 HH12 ARG 55 2HH1 ARG 55 -11.607 13.334 -10.840 422 HH21 ARG 55 1HH2 ARG 55 -13.282 10.692 -12.403 423 HH22 ARG 55 2HH2 ARG 55 -13.431 12.291 -11.757 424 H THR 56 H THR 56 -5.075 7.979 -10.870 425 HA THR 56 HA THR 56 -6.493 7.652 -8.413 426 HB THR 56 HB THR 56 -4.914 5.953 -7.866 427 HG1 THR 56 HG1 THR 56 -2.886 6.304 -8.323 428 HG21 THR 56 HG21 THR 56 -4.661 5.335 -10.666 429 HG22 THR 56 HG22 THR 56 -6.257 6.005 -10.327 430 HG23 THR 56 HG23 THR 56 -5.690 4.586 -9.447 431 H ARG 57 H ARG 57 -3.313 8.992 -9.267 432 HA ARG 57 HA ARG 57 -2.421 9.611 -6.710 433 HB2 ARG 57 HB2 ARG 57 -0.868 11.112 -7.729 434 HB3 ARG 57 HB1 ARG 57 -1.091 9.747 -8.834 435 HG2 ARG 57 HG1 ARG 57 -2.419 11.017 -10.319 436 HG3 ARG 57 HG2 ARG 57 -2.603 12.322 -9.136 437 HD2 ARG 57 HD1 ARG 57 -0.973 12.805 -10.985 438 HD3 ARG 57 HD2 ARG 57 -0.320 12.956 -9.348 439 HE ARG 57 HE ARG 57 0.110 10.362 -10.493 440 HH11 ARG 57 1HH1 ARG 57 1.319 13.620 -10.286 441 HH12 ARG 57 2HH1 ARG 57 2.952 13.176 -10.658 442 HH21 ARG 57 1HH2 ARG 57 2.256 9.765 -10.985 443 HH22 ARG 57 2HH2 ARG 57 3.484 10.984 -11.057 444 H GLN 58 H GLN 58 -4.804 11.178 -8.690 445 HA GLN 58 HA GLN 58 -4.831 13.702 -7.434 446 HB2 GLN 58 HB2 GLN 58 -6.847 12.142 -9.030 447 HB3 GLN 58 HB1 GLN 58 -7.274 13.697 -8.299 448 HG2 GLN 58 HG1 GLN 58 -4.952 13.304 -10.182 449 HG3 GLN 58 HG2 GLN 58 -6.566 13.829 -10.680 450 HE21 GLN 58 HE21 GLN 58 -3.716 14.690 -8.859 451 HE22 GLN 58 HE22 GLN 58 -4.030 16.388 -8.794 452 H LEU 59 H LEU 59 -6.530 10.683 -6.747 453 HA LEU 59 HA LEU 59 -7.897 11.890 -4.476 454 HB2 LEU 59 HB2 LEU 59 -7.979 9.001 -5.332 455 HB3 LEU 59 HB1 LEU 59 -9.141 9.879 -4.321 456 HG LEU 59 HG LEU 59 -8.944 11.091 -6.932 457 HD11 LEU 59 HD11 LEU 59 -8.310 8.884 -7.701 458 HD12 LEU 59 HD12 LEU 59 -9.959 9.252 -8.205 459 HD13 LEU 59 HD13 LEU 59 -9.674 8.167 -6.844 460 HD21 LEU 59 HD21 LEU 59 -11.263 9.660 -5.652 461 HD22 LEU 59 HD22 LEU 59 -11.310 10.960 -6.845 462 HD23 LEU 59 HD23 LEU 59 -10.762 11.291 -5.201 463 H ASP 60 H ASP 60 -4.888 11.143 -4.793 464 HA ASP 60 HA ASP 60 -3.203 10.540 -3.388 465 HB2 ASP 60 HB2 ASP 60 -4.699 11.863 -1.776 466 HB3 ASP 60 HB1 ASP 60 -5.242 10.287 -1.184 467 HD2 ASP 60 HD2 ASP 60 -2.242 9.685 0.446 468 H ILE 61 H ILE 61 -3.281 8.553 -4.733 469 HA ILE 61 HA ILE 61 -3.831 6.215 -3.032 470 HB ILE 61 HB ILE 61 -4.192 6.202 -6.024 471 HG12 ILE 61 HG11 ILE 61 -6.326 6.408 -3.885 472 HG13 ILE 61 HG12 ILE 61 -5.825 7.731 -4.952 473 HG21 ILE 61 HG21 ILE 61 -3.688 4.073 -4.730 474 HG22 ILE 61 HG22 ILE 61 -5.279 4.270 -3.997 475 HG23 ILE 61 HG23 ILE 61 -5.133 4.063 -5.742 476 HD11 ILE 61 HD11 ILE 61 -6.454 5.607 -6.652 477 HD12 ILE 61 HD12 ILE 61 -7.729 5.649 -5.433 478 HD13 ILE 61 HD13 ILE 61 -7.374 7.089 -6.388 479 HA PRO 62 HA PRO 62 0.441 5.362 -3.828 480 HB2 PRO 62 HB2 PRO 62 0.490 2.843 -2.754 481 HB3 PRO 62 HB1 PRO 62 0.443 4.313 -1.783 482 HG2 PRO 62 HG1 PRO 62 -1.804 2.505 -2.605 483 HG3 PRO 62 HG2 PRO 62 -1.454 3.227 -0.991 484 HD2 PRO 62 HD1 PRO 62 -3.341 4.228 -2.665 485 HD3 PRO 62 HD2 PRO 62 -2.377 5.253 -1.588 486 H ASP 63 H ASP 63 1.554 4.488 -5.487 487 HA ASP 63 HA ASP 63 0.176 3.207 -7.606 488 HB2 ASP 63 HB2 ASP 63 3.176 3.221 -7.286 489 HB3 ASP 63 HB1 ASP 63 2.226 3.251 -8.778 490 HD2 ASP 63 HD2 ASP 63 3.372 6.632 -7.458 491 H GLU 64 H GLU 64 1.395 2.007 -4.725 492 HA GLU 64 HA GLU 64 2.269 -0.561 -5.645 493 HB2 GLU 64 HB2 GLU 64 1.384 0.146 -2.844 494 HB3 GLU 64 HB1 GLU 64 2.498 -1.138 -3.342 495 HG2 GLU 64 HG1 GLU 64 4.002 0.733 -4.221 496 HG3 GLU 64 HG2 GLU 64 2.974 1.820 -3.275 497 HE2 GLU 64 HE2 GLU 64 4.097 0.108 -0.288 498 H LYS 65 H LYS 65 -0.746 0.819 -4.532 499 HA LYS 65 HA LYS 65 -2.042 -1.806 -4.602 500 HB2 LYS 65 HB2 LYS 65 -3.802 -0.893 -3.367 501 HB3 LYS 65 HB1 LYS 65 -2.367 -0.096 -2.704 502 HG2 LYS 65 HG1 LYS 65 -2.824 1.861 -4.162 503 HG3 LYS 65 HG2 LYS 65 -4.325 1.067 -4.672 504 HD2 LYS 65 HD1 LYS 65 -3.611 1.833 -1.832 505 HD3 LYS 65 HD2 LYS 65 -4.734 2.700 -2.893 506 HE2 LYS 65 HE1 LYS 65 -6.309 1.432 -1.896 507 HE3 LYS 65 HE2 LYS 65 -5.751 0.191 -3.026 508 HZ1 LYS 65 3HZ LYS 65 -5.467 -0.994 -1.159 509 HZ2 LYS 65 1HZ LYS 65 -5.391 0.369 -0.159 510 HZ3 LYS 65 2HZ LYS 65 -4.020 -0.128 -1.017 511 H THR 66 H THR 66 -1.918 1.255 -6.272 512 HA THR 66 HA THR 66 -4.244 0.830 -7.874 513 HB THR 66 HB THR 66 -1.902 2.693 -8.308 514 HG1 THR 66 HG1 THR 66 -3.360 4.237 -7.432 515 HG21 THR 66 HG21 THR 66 -4.630 2.679 -9.607 516 HG22 THR 66 HG22 THR 66 -3.115 2.234 -10.393 517 HG23 THR 66 HG23 THR 66 -3.372 3.891 -9.848 518 H MET 67 H MET 67 -0.857 0.021 -8.157 519 HA MET 67 HA MET 67 -0.593 -0.442 -10.863 520 HB2 MET 67 HB2 MET 67 0.696 -1.437 -8.408 521 HB3 MET 67 HB1 MET 67 0.844 -2.512 -9.807 522 HG2 MET 67 HG1 MET 67 1.457 0.386 -10.164 523 HG3 MET 67 HG2 MET 67 2.621 -0.643 -9.328 524 HE1 MET 67 HE1 MET 67 2.175 0.162 -13.538 525 HE2 MET 67 HE2 MET 67 0.711 -0.764 -13.203 526 HE3 MET 67 HE3 MET 67 1.104 0.650 -12.224 527 HA PRO 68 HA PRO 68 -2.233 -4.947 -10.279 528 HB2 PRO 68 HB2 PRO 68 -3.373 -5.581 -7.871 529 HB3 PRO 68 HB1 PRO 68 -1.653 -5.763 -8.212 530 HG2 PRO 68 HG1 PRO 68 -3.088 -3.525 -6.822 531 HG3 PRO 68 HG2 PRO 68 -1.564 -4.369 -6.353 532 HD2 PRO 68 HD1 PRO 68 -1.581 -1.933 -7.553 533 HD3 PRO 68 HD2 PRO 68 -0.307 -3.132 -7.837 534 H VAL 69 H VAL 69 -3.843 -2.134 -9.137 535 HA VAL 69 HA VAL 69 -6.517 -3.182 -9.423 536 HB VAL 69 HB VAL 69 -5.421 -0.436 -8.877 537 HG11 VAL 69 HG11 VAL 69 -8.117 -1.206 -9.824 538 HG12 VAL 69 HG12 VAL 69 -8.034 -0.043 -8.499 539 HG13 VAL 69 HG13 VAL 69 -7.230 0.304 -10.031 540 HG21 VAL 69 HG21 VAL 69 -7.440 -1.686 -7.141 541 HG22 VAL 69 HG22 VAL 69 -5.884 -2.512 -7.208 542 HG23 VAL 69 HG23 VAL 69 -5.962 -0.819 -6.723 543 H LEU 70 H LEU 70 -4.487 -0.851 -11.187 544 HA LEU 70 HA LEU 70 -6.345 -0.353 -13.250 545 HB2 LEU 70 HB2 LEU 70 -4.623 0.798 -14.360 546 HB3 LEU 70 HB1 LEU 70 -4.318 1.021 -12.629 547 HG LEU 70 HG LEU 70 -2.728 -1.070 -13.020 548 HD11 LEU 70 HD11 LEU 70 -3.547 -0.451 -15.641 549 HD12 LEU 70 HD12 LEU 70 -2.310 -1.598 -15.129 550 HD13 LEU 70 HD13 LEU 70 -1.869 0.070 -15.492 551 HD21 LEU 70 HD21 LEU 70 -1.986 1.026 -12.110 552 HD22 LEU 70 HD22 LEU 70 -2.094 1.800 -13.691 553 HD23 LEU 70 HD23 LEU 70 -0.886 0.548 -13.404 554 H MET 71 H MET 71 -3.719 -2.691 -12.915 555 HA MET 71 HA MET 71 -3.750 -3.688 -15.537 556 HB2 MET 71 HB2 MET 71 -2.436 -5.473 -14.753 557 HB3 MET 71 HB1 MET 71 -2.029 -4.110 -13.698 558 HG2 MET 71 HG1 MET 71 -3.352 -4.974 -11.913 559 HG3 MET 71 HG2 MET 71 -4.053 -6.205 -12.966 560 HE1 MET 71 HE1 MET 71 -3.051 -8.629 -11.395 561 HE2 MET 71 HE2 MET 71 -1.922 -7.950 -10.221 562 HE3 MET 71 HE3 MET 71 -3.442 -7.122 -10.565 563 H LYS 72 H LYS 72 -5.887 -4.182 -12.865 564 HA LYS 72 HA LYS 72 -7.034 -6.635 -13.746 565 HB2 LYS 72 HB2 LYS 72 -7.223 -5.993 -11.429 566 HB3 LYS 72 HB1 LYS 72 -8.062 -4.498 -11.874 567 HG2 LYS 72 HG1 LYS 72 -9.714 -5.986 -11.068 568 HG3 LYS 72 HG2 LYS 72 -9.893 -5.924 -12.832 569 HD2 LYS 72 HD1 LYS 72 -8.045 -8.009 -11.913 570 HD3 LYS 72 HD2 LYS 72 -9.708 -8.213 -11.333 571 HE2 LYS 72 HE1 LYS 72 -10.286 -7.661 -13.866 572 HE3 LYS 72 HE2 LYS 72 -8.644 -8.275 -14.110 573 HZ1 LYS 72 3HZ LYS 72 -10.642 -9.795 -12.548 574 HZ2 LYS 72 1HZ LYS 72 -9.213 -10.357 -13.259 575 HZ3 LYS 72 2HZ LYS 72 -10.533 -9.939 -14.229 576 H LEU 73 H LEU 73 -7.628 -3.265 -14.431 577 HA LEU 73 HA LEU 73 -10.191 -3.603 -15.617 578 HB2 LEU 73 HB2 LEU 73 -8.298 -1.404 -16.380 579 HB3 LEU 73 HB1 LEU 73 -10.063 -1.363 -16.219 580 HG LEU 73 HG LEU 73 -8.037 -1.397 -13.986 581 HD11 LEU 73 HD11 LEU 73 -8.446 0.748 -15.225 582 HD12 LEU 73 HD12 LEU 73 -8.800 0.797 -13.498 583 HD13 LEU 73 HD13 LEU 73 -10.116 0.670 -14.664 584 HD21 LEU 73 HD21 LEU 73 -10.992 -1.833 -13.999 585 HD22 LEU 73 HD22 LEU 73 -10.230 -1.013 -12.637 586 HD23 LEU 73 HD23 LEU 73 -9.740 -2.653 -13.066 587 H LEU 74 H LEU 74 -6.906 -3.358 -16.944 588 HA LEU 74 HA LEU 74 -7.737 -3.651 -19.655 589 HB2 LEU 74 HB2 LEU 74 -5.045 -3.989 -18.323 590 HB3 LEU 74 HB1 LEU 74 -5.311 -4.056 -20.074 591 HG LEU 74 HG LEU 74 -4.479 -1.901 -19.635 592 HD11 LEU 74 HD11 LEU 74 -5.986 -0.864 -20.895 593 HD12 LEU 74 HD12 LEU 74 -7.187 -0.898 -19.604 594 HD13 LEU 74 HD13 LEU 74 -7.022 -2.277 -20.691 595 HD21 LEU 74 HD21 LEU 74 -4.990 -2.070 -17.150 596 HD22 LEU 74 HD22 LEU 74 -6.589 -1.439 -17.544 597 HD23 LEU 74 HD23 LEU 74 -5.152 -0.476 -17.889 598 H GLU 75 H GLU 75 -7.117 -5.842 -17.075 599 HA GLU 75 HA GLU 75 -6.422 -8.141 -18.553 600 HB2 GLU 75 HB2 GLU 75 -5.986 -8.316 -16.277 601 HB3 GLU 75 HB1 GLU 75 -7.572 -7.670 -15.826 602 HG2 GLU 75 HG1 GLU 75 -7.425 -10.032 -15.298 603 HG3 GLU 75 HG2 GLU 75 -8.638 -9.736 -16.551 604 HE2 GLU 75 HE2 GLU 75 -5.292 -11.297 -17.997 605 H GLU 76 H GLU 76 -9.568 -7.126 -17.216 606 HA GLU 76 HA GLU 76 -10.970 -9.207 -18.618 607 HB2 GLU 76 HB2 GLU 76 -12.061 -6.781 -17.168 608 HB3 GLU 76 HB1 GLU 76 -12.988 -8.201 -17.679 609 HG2 GLU 76 HG1 GLU 76 -11.917 -9.605 -16.109 610 HG3 GLU 76 HG2 GLU 76 -10.685 -8.383 -15.763 611 HE2 GLU 76 HE2 GLU 76 -12.917 -6.567 -13.735 612 H ALA 77 H ALA 77 -10.408 -5.763 -19.052 613 HA ALA 77 HA ALA 77 -12.243 -5.471 -21.227 614 HB1 ALA 77 HB1 ALA 77 -9.933 -3.642 -20.640 615 HB2 ALA 77 HB2 ALA 77 -11.410 -3.638 -19.675 616 HB3 ALA 77 HB3 ALA 77 -11.479 -3.255 -21.396 617 H GLY 78 H GLY 78 -9.071 -6.704 -20.921 618 HA2 GLY 78 HA2 GLY 78 -7.827 -7.795 -22.556 619 HA3 GLY 78 3HA GLY 78 -8.949 -7.197 -23.770 620 H GLY 79 H GLY 79 -7.866 -4.733 -21.733 621 HA2 GLY 79 HA2 GLY 79 -5.949 -3.342 -21.894 622 HA3 GLY 79 3HA GLY 79 -5.559 -4.102 -23.431 623 H ASN 80 H ASN 80 -8.669 -2.748 -22.434 624 HA ASN 80 HA ASN 80 -8.395 -0.770 -24.602 625 HB2 ASN 80 HB2 ASN 80 -10.254 -2.774 -24.447 626 HB3 ASN 80 HB1 ASN 80 -11.122 -1.424 -23.707 627 HD21 ASN 80 HD21 ASN 80 -10.945 0.676 -24.953 628 HD22 ASN 80 HD22 ASN 80 -11.126 0.567 -26.668 629 H TRP 81 H TRP 81 -7.953 1.143 -23.717 630 HA TRP 81 HA TRP 81 -8.972 1.855 -21.101 631 HB2 TRP 81 HB2 TRP 81 -7.304 3.477 -23.047 632 HB3 TRP 81 HB1 TRP 81 -7.625 3.888 -21.363 633 HD1 TRP 81 HD1 TRP 81 -5.753 1.200 -23.411 634 HE1 TRP 81 HE1 TRP 81 -3.849 0.266 -21.953 635 HE3 TRP 81 HE3 TRP 81 -6.789 3.660 -19.051 636 HZ2 TRP 81 2HZ TRP 81 -2.910 0.536 -19.304 637 HZ3 TRP 81 3HZ TRP 81 -5.339 3.267 -17.102 638 HH2 TRP 81 HH TRP 81 -3.441 1.737 -17.228 639 H SER 82 H SER 82 -9.843 2.314 -24.385 640 HA SER 82 HA SER 82 -11.133 4.757 -24.389 641 HB2 SER 82 HB2 SER 82 -10.796 3.202 -26.357 642 HB3 SER 82 HB1 SER 82 -12.188 2.278 -25.765 643 HG SER 82 HG SER 82 -13.038 3.708 -27.181 644 H TYR 83 H TYR 83 -12.347 1.618 -23.295 645 HA TYR 83 HA TYR 83 -14.894 2.765 -22.518 646 HB2 TYR 83 HB2 TYR 83 -15.150 0.601 -23.361 647 HB3 TYR 83 HB1 TYR 83 -13.732 -0.003 -22.502 648 HD1 TYR 83 HD1 TYR 83 -17.290 0.801 -22.199 649 HD2 TYR 83 HD2 TYR 83 -13.847 -0.643 -20.159 650 HE1 TYR 83 HE1 TYR 83 -18.722 -0.031 -20.381 651 HE2 TYR 83 HE2 TYR 83 -15.270 -1.479 -18.336 652 HH TYR 83 HH TYR 83 -18.287 -2.100 -18.494 653 H ILE 84 H ILE 84 -12.070 1.314 -20.933 654 HA ILE 84 HA ILE 84 -12.958 1.485 -18.294 655 HB ILE 84 HB ILE 84 -10.144 1.690 -19.368 656 HG12 ILE 84 HG11 ILE 84 -11.561 -0.656 -18.088 657 HG13 ILE 84 HG12 ILE 84 -11.470 -0.408 -19.840 658 HG21 ILE 84 HG21 ILE 84 -11.117 1.255 -16.549 659 HG22 ILE 84 HG22 ILE 84 -9.450 1.043 -17.082 660 HG23 ILE 84 HG23 ILE 84 -10.203 2.637 -17.154 661 HD11 ILE 84 HD11 ILE 84 -9.019 -0.591 -18.119 662 HD12 ILE 84 HD12 ILE 84 -9.783 -1.999 -18.858 663 HD13 ILE 84 HD13 ILE 84 -9.138 -0.711 -19.874 664 H LYS 85 H LYS 85 -11.821 3.939 -20.450 665 HA LYS 85 HA LYS 85 -11.557 5.870 -18.262 666 HB2 LYS 85 HB2 LYS 85 -10.190 7.113 -19.594 667 HB3 LYS 85 HB1 LYS 85 -9.929 5.531 -20.346 668 HG2 LYS 85 HG1 LYS 85 -11.978 6.272 -21.838 669 HG3 LYS 85 HG2 LYS 85 -11.426 7.887 -21.359 670 HD2 LYS 85 HD1 LYS 85 -9.881 5.758 -22.838 671 HD3 LYS 85 HD2 LYS 85 -10.323 7.381 -23.396 672 HE2 LYS 85 HE1 LYS 85 -8.329 6.656 -21.241 673 HE3 LYS 85 HE2 LYS 85 -8.005 7.407 -22.810 674 HZ1 LYS 85 3HZ LYS 85 -8.169 9.345 -21.771 675 HZ2 LYS 85 1HZ LYS 85 -8.766 8.633 -20.357 676 HZ3 LYS 85 2HZ LYS 85 -9.828 9.062 -21.602 677 H LEU 86 H LEU 86 -13.967 4.687 -20.084 678 HA LEU 86 HA LEU 86 -15.271 6.945 -21.128 679 HB2 LEU 86 HB2 LEU 86 -15.740 4.433 -21.488 680 HB3 LEU 86 HB1 LEU 86 -16.723 4.567 -20.019 681 HG LEU 86 HG LEU 86 -17.297 6.532 -22.152 682 HD11 LEU 86 HD11 LEU 86 -18.790 4.757 -23.235 683 HD12 LEU 86 HD12 LEU 86 -17.722 3.581 -22.471 684 HD13 LEU 86 HD13 LEU 86 -17.071 4.740 -23.630 685 HD21 LEU 86 HD21 LEU 86 -19.626 5.340 -21.360 686 HD22 LEU 86 HD22 LEU 86 -18.920 6.782 -20.630 687 HD23 LEU 86 HD23 LEU 86 -18.625 5.198 -19.914 688 H ASP 87 H ASP 87 -14.777 5.941 -17.916 689 HA ASP 87 HA ASP 87 -16.690 7.971 -16.984 690 HB2 ASP 87 HB2 ASP 87 -16.124 5.429 -15.453 691 HB3 ASP 87 HB1 ASP 87 -17.406 6.613 -15.170 692 HD2 ASP 87 HD2 ASP 87 -19.523 5.040 -17.350 693 H ASN 88 H ASN 88 -13.766 7.981 -17.495 694 HA ASN 88 HA ASN 88 -11.913 8.915 -16.561 695 HB2 ASN 88 HB2 ASN 88 -13.981 10.211 -15.357 696 HB3 ASN 88 HB1 ASN 88 -13.160 9.517 -13.952 697 HD21 ASN 88 HD21 ASN 88 -10.555 9.625 -14.602 698 HD22 ASN 88 HD22 ASN 88 -10.048 11.263 -14.817 699 H TYR 89 H TYR 89 -12.216 6.169 -16.360 700 HA TYR 89 HA TYR 89 -11.341 4.344 -15.323 701 HB2 TYR 89 HB2 TYR 89 -9.817 6.404 -13.705 702 HB3 TYR 89 HB1 TYR 89 -9.422 4.688 -13.830 703 HD1 TYR 89 HD2 TYR 89 -10.142 4.581 -16.883 704 HD2 TYR 89 HD1 TYR 89 -7.628 7.087 -14.537 705 HE1 TYR 89 HE2 TYR 89 -8.744 5.018 -18.858 706 HE2 TYR 89 HE1 TYR 89 -6.223 7.531 -16.505 707 HH TYR 89 HH TYR 89 -6.250 7.434 -18.846 708 H THR 90 H THR 90 -13.817 5.215 -14.396 709 HA THR 90 HA THR 90 -14.136 5.577 -11.676 710 HB THR 90 HB THR 90 -15.879 4.126 -13.663 711 HG1 THR 90 HG1 THR 90 -15.434 6.619 -13.355 712 HG21 THR 90 HG21 THR 90 -16.399 4.707 -10.750 713 HG22 THR 90 HG22 THR 90 -16.450 3.145 -11.566 714 HG23 THR 90 HG23 THR 90 -17.677 4.363 -11.914 715 H ALA 91 H ALA 91 -13.370 2.662 -13.443 716 HA ALA 91 HA ALA 91 -14.014 0.703 -11.594 717 HB1 ALA 91 HB1 ALA 91 -13.037 0.515 -13.988 718 HB2 ALA 91 HB2 ALA 91 -12.658 -0.733 -12.800 719 HB3 ALA 91 HB3 ALA 91 -11.476 0.524 -13.167 720 H LEU 92 H LEU 92 -11.230 2.853 -11.699 721 HA LEU 92 HA LEU 92 -9.737 1.563 -9.665 722 HB2 LEU 92 HB2 LEU 92 -8.258 3.331 -9.799 723 HB3 LEU 92 HB1 LEU 92 -9.001 3.321 -11.407 724 HG LEU 92 HG LEU 92 -10.614 5.096 -10.263 725 HD11 LEU 92 HD11 LEU 92 -8.839 6.553 -8.925 726 HD12 LEU 92 HD12 LEU 92 -8.226 4.952 -8.514 727 HD13 LEU 92 HD13 LEU 92 -9.893 5.384 -8.131 728 HD21 LEU 92 HD21 LEU 92 -8.544 5.148 -12.089 729 HD22 LEU 92 HD22 LEU 92 -8.104 6.399 -10.926 730 HD23 LEU 92 HD23 LEU 92 -9.667 6.465 -11.744 731 H VAL 93 H VAL 93 -12.257 3.998 -9.643 732 HA VAL 93 HA VAL 93 -11.946 4.870 -6.978 733 HB VAL 93 HB VAL 93 -14.326 4.869 -8.825 734 HG11 VAL 93 HG11 VAL 93 -14.116 5.761 -5.973 735 HG12 VAL 93 HG12 VAL 93 -15.233 6.546 -7.090 736 HG13 VAL 93 HG13 VAL 93 -15.387 4.822 -6.755 737 HG21 VAL 93 HG21 VAL 93 -13.436 6.747 -9.603 738 HG22 VAL 93 HG22 VAL 93 -13.447 7.446 -7.985 739 HG23 VAL 93 HG23 VAL 93 -12.049 6.524 -8.537 740 H ASP 94 H ASP 94 -14.098 2.422 -8.405 741 HA ASP 94 HA ASP 94 -15.150 1.612 -5.870 742 HB2 ASP 94 HB2 ASP 94 -16.221 1.407 -8.232 743 HB3 ASP 94 HB1 ASP 94 -15.266 -0.077 -8.352 744 HD2 ASP 94 HD2 ASP 94 -18.573 -0.198 -6.335 745 H ALA 95 H ALA 95 -12.490 0.629 -7.896 746 HA ALA 95 HA ALA 95 -12.024 -1.882 -6.621 747 HB1 ALA 95 HB1 ALA 95 -9.746 -1.638 -7.754 748 HB2 ALA 95 HB2 ALA 95 -10.397 -0.158 -8.461 749 HB3 ALA 95 HB3 ALA 95 -11.170 -1.708 -8.793 750 H ILE 96 H ILE 96 -10.242 1.210 -6.502 751 HA ILE 96 HA ILE 96 -8.482 0.496 -4.456 752 HB ILE 96 HB ILE 96 -9.550 3.225 -5.182 753 HG12 ILE 96 HG11 ILE 96 -8.334 2.026 -6.972 754 HG13 ILE 96 HG12 ILE 96 -7.472 3.473 -6.419 755 HG21 ILE 96 HG21 ILE 96 -7.231 2.456 -3.415 756 HG22 ILE 96 HG22 ILE 96 -7.551 4.088 -4.003 757 HG23 ILE 96 HG23 ILE 96 -8.704 3.297 -2.928 758 HD11 ILE 96 HD11 ILE 96 -5.963 2.118 -5.101 759 HD12 ILE 96 HD12 ILE 96 -6.835 0.659 -5.568 760 HD13 ILE 96 HD13 ILE 96 -5.959 1.588 -6.783 761 H TYR 97 H TYR 97 -11.729 1.860 -4.324 762 HA TYR 97 HA TYR 97 -11.805 2.507 -1.603 763 HB2 TYR 97 HB2 TYR 97 -13.816 1.962 -3.725 764 HB3 TYR 97 HB1 TYR 97 -14.378 1.865 -2.055 765 HD1 TYR 97 HD1 TYR 97 -11.818 4.180 -3.432 766 HD2 TYR 97 HD2 TYR 97 -15.744 3.759 -1.845 767 HE1 TYR 97 HE1 TYR 97 -12.037 6.628 -3.342 768 HE2 TYR 97 HE2 TYR 97 -15.974 6.207 -1.751 769 HH TYR 97 HH TYR 97 -13.715 8.325 -3.252 770 H SER 98 H SER 98 -12.277 -0.537 -3.277 771 HA SER 98 HA SER 98 -13.263 -1.932 -0.971 772 HB2 SER 98 HB2 SER 98 -14.011 -2.982 -2.878 773 HB3 SER 98 HB1 SER 98 -12.506 -2.671 -3.762 774 HG SER 98 HG SER 98 -12.901 -4.588 -1.706 775 H VAL 99 H VAL 99 -10.211 -2.085 -2.811 776 HA VAL 99 HA VAL 99 -8.857 -3.818 -1.090 777 HB VAL 99 HB VAL 99 -7.581 -1.617 -2.715 778 HG11 VAL 99 HG11 VAL 99 -5.641 -3.030 -2.758 779 HG12 VAL 99 HG12 VAL 99 -6.143 -2.819 -1.079 780 HG13 VAL 99 HG13 VAL 99 -6.509 -4.322 -1.928 781 HG21 VAL 99 HG21 VAL 99 -8.692 -2.624 -4.413 782 HG22 VAL 99 HG22 VAL 99 -7.360 -3.774 -4.293 783 HG23 VAL 99 HG23 VAL 99 -8.906 -4.132 -3.524 784 H GLU 100 H GLU 100 -8.912 -0.264 -1.159 785 HA GLU 100 HA GLU 100 -7.120 0.161 0.951 786 HB2 GLU 100 HB2 GLU 100 -7.808 2.398 0.940 787 HB3 GLU 100 HB1 GLU 100 -8.089 1.853 -0.721 788 HG2 GLU 100 HG1 GLU 100 -10.473 1.480 -0.164 789 HG3 GLU 100 HG2 GLU 100 -10.159 2.159 1.439 790 HE2 GLU 100 HE2 GLU 100 -11.274 4.995 -0.328 791 H ASP 101 H ASP 101 -10.327 -1.013 0.955 792 HA ASP 101 HA ASP 101 -10.825 -0.288 3.729 793 HB2 ASP 101 HB2 ASP 101 -12.639 -0.245 1.993 794 HB3 ASP 101 HB1 ASP 101 -12.512 -2.006 1.901 795 HD2 ASP 101 HD2 ASP 101 -13.826 -0.661 5.399 796 H GLU 102 H GLU 102 -9.350 -2.793 2.006 797 HA GLU 102 HA GLU 102 -9.554 -4.574 4.345 798 HB2 GLU 102 HB2 GLU 102 -9.150 -6.463 2.739 799 HB3 GLU 102 HB1 GLU 102 -10.709 -5.647 2.553 800 HG2 GLU 102 HG1 GLU 102 -9.516 -4.241 0.744 801 HG3 GLU 102 HG2 GLU 102 -8.308 -5.535 0.778 802 HE2 GLU 102 HE2 GLU 102 -11.938 -6.558 -0.494 803 H ASN 103 H ASN 103 -7.690 -3.722 5.300 804 HA ASN 103 HA ASN 103 -5.187 -4.375 3.889 805 HB2 ASN 103 HB2 ASN 103 -5.768 -2.066 5.759 806 HB3 ASN 103 HB1 ASN 103 -4.142 -2.520 5.233 807 HD21 ASN 103 HD21 ASN 103 -7.331 -1.848 3.827 808 HD22 ASN 103 HD22 ASN 103 -6.734 -0.938 2.485 809 H LYS 104 H LYS 104 -7.136 -4.826 6.636 810 HA LYS 104 HA LYS 104 -5.313 -5.365 8.659 811 HB2 LYS 104 HB2 LYS 104 -7.038 -6.669 9.713 812 HB3 LYS 104 HB1 LYS 104 -7.790 -5.275 8.921 813 HG2 LYS 104 HG1 LYS 104 -8.616 -6.611 7.135 814 HG3 LYS 104 HG2 LYS 104 -7.660 -8.005 7.668 815 HD2 LYS 104 HD1 LYS 104 -9.633 -6.794 9.563 816 HD3 LYS 104 HD2 LYS 104 -10.217 -7.829 8.248 817 HE2 LYS 104 HE1 LYS 104 -9.053 -9.710 9.033 818 HE3 LYS 104 HE2 LYS 104 -7.988 -8.722 10.045 819 HZ1 LYS 104 3HZ LYS 104 -10.888 -9.159 10.510 820 HZ2 LYS 104 1HZ LYS 104 -9.873 -8.207 11.471 821 HZ3 LYS 104 2HZ LYS 104 -9.626 -9.878 11.378 822 H GLN 105 H GLN 105 -5.980 -7.127 5.780 823 HA GLN 105 HA GLN 105 -5.134 -9.694 6.603 824 HB2 GLN 105 HB2 GLN 105 -4.972 -8.487 3.832 825 HB3 GLN 105 HB1 GLN 105 -4.967 -10.211 4.239 826 HG2 GLN 105 HG1 GLN 105 -7.146 -10.011 3.660 827 HG3 GLN 105 HG2 GLN 105 -7.273 -9.577 5.371 828 HE21 GLN 105 HE21 GLN 105 -8.627 -7.966 5.642 829 HE22 GLN 105 HE22 GLN 105 -8.778 -6.575 4.630 830 H SER 106 H SER 106 -3.422 -6.820 6.144 831 HA SER 106 HA SER 106 -0.890 -8.267 6.350 832 HB2 SER 106 HB2 SER 106 -0.970 -7.828 4.001 833 HB3 SER 106 HB1 SER 106 -1.518 -6.165 4.273 834 HG SER 106 HG SER 106 0.827 -6.578 3.801 835 H GLU 107 H GLU 107 0.910 -6.833 7.020 836 HA GLU 107 HA GLU 107 -0.048 -4.964 9.032 837 HB2 GLU 107 HB2 GLU 107 1.704 -6.769 9.450 838 HB3 GLU 107 HB1 GLU 107 2.816 -5.752 8.522 839 HG2 GLU 107 HG1 GLU 107 3.336 -4.953 10.560 840 HG3 GLU 107 HG2 GLU 107 1.926 -3.927 10.256 841 HE2 GLU 107 HE2 GLU 107 0.132 -6.438 12.328 842 H GLY 108 H GLY 108 2.068 -4.981 6.191 843 HA2 GLY 108 HA2 GLY 108 1.488 -2.230 5.646 844 HA3 GLY 108 3HA GLY 108 3.118 -2.447 6.267 845 H SER 109 H SER 109 4.222 -1.916 4.428 846 HA SER 109 HA SER 109 3.561 -2.853 1.842 847 HB2 SER 109 HB2 SER 109 6.381 -2.118 2.561 848 HB3 SER 109 HB1 SER 109 5.449 -1.723 1.105 849 HG SER 109 HG SER 109 5.804 -0.212 3.229 Start of MODEL 13 1 H1 MET 1 H MET 1 31.727 -30.707 -19.439 2 HA MET 1 HA MET 1 32.448 -29.065 -17.288 3 HB2 MET 1 HB2 MET 1 32.741 -28.527 -19.714 4 HB3 MET 1 HB1 MET 1 31.002 -28.209 -19.799 5 HG2 MET 1 HG1 MET 1 31.942 -26.093 -19.556 6 HG3 MET 1 HG2 MET 1 31.391 -26.516 -17.933 7 HE1 MET 1 HE1 MET 1 35.587 -25.729 -19.401 8 HE2 MET 1 HE2 MET 1 34.132 -25.982 -20.364 9 HE3 MET 1 HE3 MET 1 34.276 -24.550 -19.345 10 H GLY 2 H GLY 2 29.306 -29.989 -18.561 11 HA2 GLY 2 HA2 GLY 2 28.074 -28.751 -16.194 12 HA3 GLY 2 3HA GLY 2 27.412 -28.408 -17.785 13 H SER 3 H SER 3 26.862 -30.159 -15.132 14 HA SER 3 HA SER 3 25.743 -32.441 -16.624 15 HB2 SER 3 HB2 SER 3 25.812 -33.695 -14.490 16 HB3 SER 3 HB1 SER 3 27.420 -33.142 -14.992 17 HG SER 3 HG SER 3 27.479 -32.340 -13.046 18 H SER 4 H SER 4 23.617 -33.002 -16.335 19 HA SER 4 HA SER 4 22.001 -31.485 -14.433 20 HB2 SER 4 HB2 SER 4 22.056 -30.259 -16.661 21 HB3 SER 4 HB1 SER 4 21.198 -31.652 -17.341 22 HG SER 4 HG SER 4 20.306 -29.945 -15.260 23 H HIS 5 H HIS 5 20.705 -32.834 -13.393 24 HA HIS 5 HA HIS 5 20.412 -35.554 -14.189 25 HB2 HIS 5 HB2 HIS 5 18.931 -35.749 -12.224 26 HB3 HIS 5 HB1 HIS 5 20.459 -34.955 -11.831 27 HD1 HIS 5 HD1 HIS 5 20.178 -32.999 -10.363 28 HD2 HIS 5 HD2 HIS 5 16.877 -33.554 -12.825 29 HE1 HIS 5 HE1 HIS 5 18.560 -31.179 -9.738 30 HE2 HIS 5 HE2 HIS 5 16.543 -31.516 -11.242 31 H HIS 6 H HIS 6 18.065 -36.513 -14.038 32 HA HIS 6 HA HIS 6 16.633 -35.420 -16.275 33 HB2 HIS 6 HB2 HIS 6 16.927 -37.879 -15.823 34 HB3 HIS 6 HB1 HIS 6 15.799 -37.700 -14.476 35 HD1 HIS 6 HD1 HIS 6 15.732 -38.888 -17.739 36 HD2 HIS 6 HD2 HIS 6 13.287 -36.263 -15.644 37 HE1 HIS 6 HE1 HIS 6 13.542 -38.878 -18.975 38 HE2 HIS 6 HE2 HIS 6 12.047 -37.273 -17.695 39 H HIS 7 H HIS 7 15.153 -33.880 -16.153 40 HA HIS 7 HA HIS 7 13.838 -33.362 -13.586 41 HB2 HIS 7 HB2 HIS 7 15.089 -31.558 -14.939 42 HB3 HIS 7 HB1 HIS 7 13.690 -31.590 -16.015 43 HD1 HIS 7 HD1 HIS 7 11.292 -31.247 -14.620 44 HD2 HIS 7 HD2 HIS 7 14.785 -29.739 -12.951 45 HE1 HIS 7 HE1 HIS 7 10.549 -29.523 -12.947 46 HE2 HIS 7 HE2 HIS 7 12.682 -28.600 -11.927 47 H HIS 8 H HIS 8 11.858 -34.110 -13.278 48 HA HIS 8 HA HIS 8 10.196 -34.735 -15.618 49 HB2 HIS 8 HB2 HIS 8 8.894 -36.167 -14.084 50 HB3 HIS 8 HB1 HIS 8 10.598 -36.628 -14.144 51 HD1 HIS 8 HD1 HIS 8 8.078 -35.044 -11.858 52 HD2 HIS 8 HD2 HIS 8 12.007 -36.388 -11.764 53 HE1 HIS 8 HE1 HIS 8 8.733 -35.036 -9.430 54 HE2 HIS 8 HE2 HIS 8 11.136 -35.857 -9.372 55 H HIS 9 H HIS 9 7.725 -34.640 -14.926 56 HA HIS 9 HA HIS 9 7.085 -32.333 -13.301 57 HB2 HIS 9 HB2 HIS 9 7.713 -31.527 -15.661 58 HB3 HIS 9 HB1 HIS 9 6.206 -32.286 -16.182 59 HD1 HIS 9 HD1 HIS 9 4.067 -31.019 -15.815 60 HD2 HIS 9 HD2 HIS 9 7.296 -29.325 -13.823 61 HE1 HIS 9 HE1 HIS 9 3.232 -28.817 -14.931 62 HE2 HIS 9 HE2 HIS 9 5.204 -27.781 -13.713 63 H HIS 10 H HIS 10 4.968 -32.309 -12.604 64 HA HIS 10 HA HIS 10 3.396 -34.690 -13.314 65 HB2 HIS 10 HB2 HIS 10 2.243 -34.362 -11.157 66 HB3 HIS 10 HB1 HIS 10 3.986 -34.571 -10.956 67 HD1 HIS 10 HD1 HIS 10 1.385 -31.823 -10.921 68 HD2 HIS 10 HD2 HIS 10 5.271 -32.545 -9.643 69 HE1 HIS 10 HE1 HIS 10 2.005 -29.842 -9.501 70 HE2 HIS 10 HE2 HIS 10 4.381 -30.283 -8.720 71 H SER 11 H SER 11 1.036 -34.449 -13.340 72 HA SER 11 HA SER 11 0.213 -31.773 -14.261 73 HB2 SER 11 HB2 SER 11 -1.434 -33.033 -15.751 74 HB3 SER 11 HB1 SER 11 0.275 -33.126 -16.214 75 HG SER 11 HG SER 11 0.030 -35.201 -16.103 76 H SER 12 H SER 12 -1.063 -34.874 -13.058 77 HA SER 12 HA SER 12 -3.504 -33.703 -12.139 78 HB2 SER 12 HB2 SER 12 -4.111 -35.861 -11.411 79 HB3 SER 12 HB1 SER 12 -3.091 -36.151 -12.832 80 HG SER 12 HG SER 12 -2.134 -37.439 -11.432 81 H GLY 13 H GLY 13 -4.174 -33.333 -10.012 82 HA2 GLY 13 HA2 GLY 13 -2.436 -33.729 -7.774 83 HA3 GLY 13 3HA GLY 13 -2.442 -32.054 -8.305 84 H LEU 14 H LEU 14 -3.364 -33.150 -5.779 85 HA LEU 14 HA LEU 14 -6.066 -32.033 -5.839 86 HB2 LEU 14 HB2 LEU 14 -6.878 -33.832 -4.333 87 HB3 LEU 14 HB1 LEU 14 -6.482 -34.380 -5.971 88 HG LEU 14 HG LEU 14 -4.172 -34.985 -4.806 89 HD11 LEU 14 HD11 LEU 14 -5.119 -36.052 -2.533 90 HD12 LEU 14 HD12 LEU 14 -6.078 -34.574 -2.594 91 HD13 LEU 14 HD13 LEU 14 -4.317 -34.482 -2.612 92 HD21 LEU 14 HD21 LEU 14 -5.300 -37.249 -4.250 93 HD22 LEU 14 HD22 LEU 14 -5.286 -36.682 -5.921 94 HD23 LEU 14 HD23 LEU 14 -6.744 -36.508 -4.941 95 H VAL 15 H VAL 15 -6.874 -31.545 -3.624 96 HA VAL 15 HA VAL 15 -4.678 -31.038 -1.729 97 HB VAL 15 HB VAL 15 -5.959 -28.901 -1.125 98 HG11 VAL 15 HG11 VAL 15 -4.771 -28.744 -3.866 99 HG12 VAL 15 HG12 VAL 15 -4.588 -27.640 -2.501 100 HG13 VAL 15 HG13 VAL 15 -3.770 -29.204 -2.489 101 HG21 VAL 15 HG21 VAL 15 -7.600 -28.088 -2.457 102 HG22 VAL 15 HG22 VAL 15 -6.912 -28.788 -3.922 103 HG23 VAL 15 HG23 VAL 15 -7.840 -29.799 -2.813 104 HA PRO 16 HA PRO 16 -7.263 -32.725 1.391 105 HB2 PRO 16 HB2 PRO 16 -6.521 -31.248 3.574 106 HB3 PRO 16 HB1 PRO 16 -5.492 -32.473 2.834 107 HG2 PRO 16 HG1 PRO 16 -5.484 -29.499 2.450 108 HG3 PRO 16 HG2 PRO 16 -4.095 -30.620 2.705 109 HD2 PRO 16 HD1 PRO 16 -4.768 -29.654 0.259 110 HD3 PRO 16 HD2 PRO 16 -4.091 -31.274 0.495 111 H ARG 17 H ARG 17 -8.832 -32.076 3.173 112 HA ARG 17 HA ARG 17 -10.465 -29.836 2.198 113 HB2 ARG 17 HB2 ARG 17 -11.123 -32.401 3.624 114 HB3 ARG 17 HB1 ARG 17 -12.252 -31.037 3.643 115 HG2 ARG 17 HG1 ARG 17 -12.253 -31.048 1.160 116 HG3 ARG 17 HG2 ARG 17 -11.246 -32.505 1.217 117 HD2 ARG 17 HD1 ARG 17 -12.957 -33.785 2.244 118 HD3 ARG 17 HD2 ARG 17 -13.902 -32.335 2.612 119 HE ARG 17 HE ARG 17 -14.793 -32.427 0.509 120 HH11 ARG 17 1HH1 ARG 17 -11.915 -34.385 0.607 121 HH12 ARG 17 2HH1 ARG 17 -12.148 -35.038 -0.982 122 HH21 ARG 17 1HH2 ARG 17 -15.110 -33.278 -1.583 123 HH22 ARG 17 2HH2 ARG 17 -13.965 -34.407 -2.226 124 H GLY 18 H GLY 18 -11.551 -28.477 3.744 125 HA2 GLY 18 HA2 GLY 18 -9.895 -28.041 6.124 126 HA3 GLY 18 3HA GLY 18 -10.991 -26.873 5.401 127 H SER 19 H SER 19 -10.562 -29.084 7.888 128 HA SER 19 HA SER 19 -13.340 -28.723 8.724 129 HB2 SER 19 HB2 SER 19 -13.007 -30.983 7.548 130 HB3 SER 19 HB1 SER 19 -12.032 -31.430 8.959 131 HG SER 19 HG SER 19 -14.782 -30.960 8.778 132 H HIS 20 H HIS 20 -13.393 -27.987 10.735 133 HA HIS 20 HA HIS 20 -11.002 -28.158 12.387 134 HB2 HIS 20 HB2 HIS 20 -12.142 -25.988 12.116 135 HB3 HIS 20 HB1 HIS 20 -13.595 -26.669 12.855 136 HD1 HIS 20 HD1 HIS 20 -10.382 -27.654 14.400 137 HD2 HIS 20 HD2 HIS 20 -13.305 -24.751 14.945 138 HE1 HIS 20 HE1 HIS 20 -9.942 -26.674 16.675 139 HE2 HIS 20 HE2 HIS 20 -11.728 -24.901 17.009 140 H MET 21 H MET 21 -11.240 -30.475 12.749 141 HA MET 21 HA MET 21 -13.285 -31.092 14.781 142 HB2 MET 21 HB2 MET 21 -12.098 -32.705 12.560 143 HB3 MET 21 HB1 MET 21 -12.601 -33.538 14.039 144 HG2 MET 21 HG1 MET 21 -14.445 -31.697 12.532 145 HG3 MET 21 HG2 MET 21 -14.285 -33.412 12.145 146 HE1 MET 21 HE1 MET 21 -15.555 -35.447 14.514 147 HE2 MET 21 HE2 MET 21 -16.927 -34.785 13.625 148 HE3 MET 21 HE3 MET 21 -15.373 -35.000 12.817 149 H ILE 22 H ILE 22 -10.011 -32.090 13.766 150 HA ILE 22 HA ILE 22 -9.357 -32.508 16.605 151 HB ILE 22 HB ILE 22 -9.145 -34.424 14.877 152 HG12 ILE 22 HG11 ILE 22 -7.059 -35.245 16.000 153 HG13 ILE 22 HG12 ILE 22 -6.889 -33.643 16.735 154 HG21 ILE 22 HG21 ILE 22 -7.760 -32.702 13.412 155 HG22 ILE 22 HG22 ILE 22 -6.423 -33.371 14.345 156 HG23 ILE 22 HG23 ILE 22 -7.437 -34.435 13.371 157 HD11 ILE 22 HD11 ILE 22 -9.475 -34.354 17.365 158 HD12 ILE 22 HD12 ILE 22 -8.571 -35.860 17.524 159 HD13 ILE 22 HD13 ILE 22 -8.075 -34.433 18.433 160 H SER 23 H SER 23 -9.236 -30.039 14.746 161 HA SER 23 HA SER 23 -7.903 -28.218 14.453 162 HB2 SER 23 HB2 SER 23 -7.832 -28.650 17.029 163 HB3 SER 23 HB1 SER 23 -6.164 -29.162 16.713 164 HG SER 23 HG SER 23 -5.798 -27.107 15.759 165 H LEU 24 H LEU 24 -7.245 -30.596 12.981 166 HA LEU 24 HA LEU 24 -4.570 -31.285 12.916 167 HB2 LEU 24 HB2 LEU 24 -6.531 -32.235 11.579 168 HB3 LEU 24 HB1 LEU 24 -6.221 -30.920 10.433 169 HG LEU 24 HG LEU 24 -3.839 -31.858 10.286 170 HD11 LEU 24 HD11 LEU 24 -3.463 -33.425 11.860 171 HD12 LEU 24 HD12 LEU 24 -4.194 -34.498 10.668 172 HD13 LEU 24 HD13 LEU 24 -5.167 -33.857 11.992 173 HD21 LEU 24 HD21 LEU 24 -6.078 -33.581 9.238 174 HD22 LEU 24 HD22 LEU 24 -4.469 -33.377 8.546 175 HD23 LEU 24 HD23 LEU 24 -5.608 -32.031 8.541 176 H SER 25 H SER 25 -6.082 -28.947 10.682 177 HA SER 25 HA SER 25 -3.544 -27.448 10.696 178 HB2 SER 25 HB2 SER 25 -5.409 -27.645 8.320 179 HB3 SER 25 HB1 SER 25 -3.759 -27.000 8.360 180 HG SER 25 HG SER 25 -3.312 -28.965 7.702 181 H GLY 26 H GLY 26 -3.954 -25.161 9.692 182 HA2 GLY 26 HA2 GLY 26 -6.228 -23.741 9.626 183 HA3 GLY 26 3HA GLY 26 -5.998 -23.941 11.356 184 H LEU 27 H LEU 27 -3.714 -23.349 12.119 185 HA LEU 27 HA LEU 27 -3.252 -20.633 11.392 186 HB2 LEU 27 HB2 LEU 27 -1.772 -20.536 13.167 187 HB3 LEU 27 HB1 LEU 27 -2.917 -21.793 13.665 188 HG LEU 27 HG LEU 27 -0.195 -22.328 12.478 189 HD11 LEU 27 HD11 LEU 27 -1.148 -22.019 15.287 190 HD12 LEU 27 HD12 LEU 27 0.356 -21.480 14.541 191 HD13 LEU 27 HD13 LEU 27 0.125 -23.185 14.923 192 HD21 LEU 27 HD21 LEU 27 -0.719 -24.609 13.542 193 HD22 LEU 27 HD22 LEU 27 -1.498 -24.201 12.013 194 HD23 LEU 27 HD23 LEU 27 -2.398 -24.069 13.526 195 H THR 28 H THR 28 -2.265 -23.519 10.024 196 HA THR 28 HA THR 28 0.392 -22.993 9.280 197 HB THR 28 HB THR 28 -0.065 -24.589 7.376 198 HG1 THR 28 HG1 THR 28 -2.109 -25.601 7.388 199 HG21 THR 28 HG21 THR 28 -0.894 -25.465 10.146 200 HG22 THR 28 HG22 THR 28 0.758 -25.379 9.535 201 HG23 THR 28 HG23 THR 28 -0.379 -26.535 8.843 202 H SER 29 H SER 29 1.305 -21.905 7.608 203 HA SER 29 HA SER 29 0.028 -21.075 5.263 204 HB2 SER 29 HB2 SER 29 -1.343 -19.554 6.403 205 HB3 SER 29 HB1 SER 29 -0.060 -19.118 7.544 206 HG SER 29 HG SER 29 -0.569 -18.149 5.007 207 H SER 30 H SER 30 1.476 -20.233 3.823 208 HA SER 30 HA SER 30 3.941 -19.022 4.665 209 HB2 SER 30 HB2 SER 30 4.193 -21.638 3.170 210 HB3 SER 30 HB1 SER 30 5.470 -20.690 3.951 211 HG SER 30 HG SER 30 4.647 -22.615 5.113 212 H VAL 31 H VAL 31 5.460 -18.939 2.581 213 HA VAL 31 HA VAL 31 5.630 -17.674 0.657 214 HB VAL 31 HB VAL 31 4.816 -18.893 -1.327 215 HG11 VAL 31 HG11 VAL 31 6.011 -20.746 0.730 216 HG12 VAL 31 HG12 VAL 31 6.154 -20.871 -1.025 217 HG13 VAL 31 HG13 VAL 31 6.916 -19.530 -0.170 218 HG21 VAL 31 HG21 VAL 31 3.504 -20.863 -1.172 219 HG22 VAL 31 HG22 VAL 31 3.619 -20.885 0.588 220 HG23 VAL 31 HG23 VAL 31 2.673 -19.634 -0.217 221 H GLU 32 H GLU 32 3.685 -16.519 2.234 222 HA GLU 32 HA GLU 32 1.248 -16.143 0.771 223 HB2 GLU 32 HB2 GLU 32 0.802 -14.361 2.455 224 HB3 GLU 32 HB1 GLU 32 1.183 -15.937 3.166 225 HG2 GLU 32 HG1 GLU 32 3.435 -15.226 3.671 226 HG3 GLU 32 HG2 GLU 32 3.151 -13.682 2.856 227 HE2 GLU 32 HE2 GLU 32 2.036 -14.059 6.578 228 H SER 33 H SER 33 4.369 -14.678 0.795 229 HA SER 33 HA SER 33 3.374 -12.516 -0.943 230 HB2 SER 33 HB2 SER 33 5.598 -11.383 -0.280 231 HB3 SER 33 HB1 SER 33 4.307 -11.440 0.932 232 HG SER 33 HG SER 33 6.608 -13.083 0.768 233 H ASP 34 H ASP 34 5.518 -15.196 -0.623 234 HA ASP 34 HA ASP 34 7.402 -14.645 -2.606 235 HB2 ASP 34 HB2 ASP 34 7.525 -16.540 -0.996 236 HB3 ASP 34 HB1 ASP 34 6.243 -17.350 -1.906 237 HD2 ASP 34 HD2 ASP 34 8.821 -18.810 -3.656 238 H LEU 35 H LEU 35 4.073 -15.594 -2.846 239 HA LEU 35 HA LEU 35 4.316 -16.204 -5.688 240 HB2 LEU 35 HB2 LEU 35 2.866 -17.477 -3.956 241 HB3 LEU 35 HB1 LEU 35 1.743 -16.119 -4.156 242 HG LEU 35 HG LEU 35 1.762 -16.661 -6.641 243 HD11 LEU 35 HD11 LEU 35 3.769 -18.428 -5.857 244 HD12 LEU 35 HD12 LEU 35 2.991 -18.329 -7.436 245 HD13 LEU 35 HD13 LEU 35 2.372 -19.444 -6.217 246 HD21 LEU 35 HD21 LEU 35 0.516 -18.228 -4.456 247 HD22 LEU 35 HD22 LEU 35 0.360 -18.856 -6.096 248 HD23 LEU 35 HD23 LEU 35 -0.230 -17.238 -5.712 249 H ASP 36 H ASP 36 4.510 -13.457 -4.273 250 HA ASP 36 HA ASP 36 2.410 -12.055 -5.769 251 HB2 ASP 36 HB2 ASP 36 2.728 -11.583 -3.316 252 HB3 ASP 36 HB1 ASP 36 4.309 -10.903 -3.719 253 HD2 ASP 36 HD2 ASP 36 2.779 -8.155 -5.351 254 H MET 37 H MET 37 5.829 -12.592 -5.637 255 HA MET 37 HA MET 37 6.737 -10.368 -7.083 256 HB2 MET 37 HB2 MET 37 7.988 -12.358 -5.839 257 HB3 MET 37 HB1 MET 37 8.055 -13.011 -7.484 258 HG2 MET 37 HG1 MET 37 9.193 -11.010 -8.272 259 HG3 MET 37 HG2 MET 37 9.082 -10.306 -6.657 260 HE1 MET 37 HE1 MET 37 11.054 -13.001 -8.893 261 HE2 MET 37 HE2 MET 37 11.518 -14.099 -7.594 262 HE3 MET 37 HE3 MET 37 9.813 -13.843 -7.964 263 H GLN 38 H GLN 38 5.123 -13.271 -8.090 264 HA GLN 38 HA GLN 38 5.835 -13.097 -10.853 265 HB2 GLN 38 HB2 GLN 38 3.879 -14.687 -9.240 266 HB3 GLN 38 HB1 GLN 38 3.695 -14.631 -11.000 267 HG2 GLN 38 HG1 GLN 38 4.957 -16.549 -10.634 268 HG3 GLN 38 HG2 GLN 38 6.147 -15.329 -11.105 269 HE21 GLN 38 HE21 GLN 38 4.844 -17.179 -8.454 270 HE22 GLN 38 HE22 GLN 38 6.165 -16.929 -7.370 271 H GLN 39 H GLN 39 3.393 -11.678 -8.845 272 HA GLN 39 HA GLN 39 1.466 -11.036 -10.772 273 HB2 GLN 39 HB2 GLN 39 2.259 -9.581 -8.240 274 HB3 GLN 39 HB1 GLN 39 0.812 -9.213 -9.193 275 HG2 GLN 39 HG1 GLN 39 0.106 -11.613 -8.847 276 HG3 GLN 39 HG2 GLN 39 1.420 -11.726 -7.668 277 HE21 GLN 39 HE21 GLN 39 1.287 -9.267 -6.465 278 HE22 GLN 39 HE22 GLN 39 -0.205 -9.122 -5.607 279 H ALA 40 H ALA 40 4.590 -9.709 -10.152 280 HA ALA 40 HA ALA 40 4.277 -7.141 -11.241 281 HB1 ALA 40 HB1 ALA 40 6.255 -8.140 -9.932 282 HB2 ALA 40 HB2 ALA 40 6.598 -6.978 -11.215 283 HB3 ALA 40 HB3 ALA 40 6.820 -8.704 -11.505 284 H MET 41 H MET 41 4.524 -10.258 -12.729 285 HA MET 41 HA MET 41 5.314 -9.326 -15.316 286 HB2 MET 41 HB2 MET 41 3.912 -11.921 -14.650 287 HB3 MET 41 HB1 MET 41 4.918 -11.572 -16.063 288 HG2 MET 41 HG1 MET 41 6.795 -11.137 -14.316 289 HG3 MET 41 HG2 MET 41 5.746 -12.063 -13.239 290 HE1 MET 41 HE1 MET 41 7.398 -11.746 -16.473 291 HE2 MET 41 HE2 MET 41 8.475 -13.143 -16.461 292 HE3 MET 41 HE3 MET 41 6.936 -13.223 -17.321 293 H LEU 42 H LEU 42 2.230 -10.284 -13.845 294 HA LEU 42 HA LEU 42 0.673 -9.866 -16.176 295 HB2 LEU 42 HB2 LEU 42 0.078 -10.166 -13.254 296 HB3 LEU 42 HB1 LEU 42 -1.201 -9.670 -14.375 297 HG LEU 42 HG LEU 42 -0.841 -11.754 -15.659 298 HD11 LEU 42 HD11 LEU 42 1.447 -12.231 -15.160 299 HD12 LEU 42 HD12 LEU 42 0.464 -13.562 -14.550 300 HD13 LEU 42 HD13 LEU 42 1.099 -12.353 -13.435 301 HD21 LEU 42 HD21 LEU 42 -1.550 -11.897 -12.744 302 HD22 LEU 42 HD22 LEU 42 -1.691 -13.295 -13.810 303 HD23 LEU 42 HD23 LEU 42 -2.626 -11.836 -14.140 304 H THR 43 H THR 43 2.006 -7.744 -13.833 305 HA THR 43 HA THR 43 0.329 -5.537 -14.836 306 HB THR 43 HB THR 43 0.069 -5.875 -12.425 307 HG1 THR 43 HG1 THR 43 -0.114 -3.752 -12.952 308 HG21 THR 43 HG21 THR 43 2.781 -4.962 -11.754 309 HG22 THR 43 HG22 THR 43 2.692 -6.597 -12.408 310 HG23 THR 43 HG23 THR 43 1.765 -6.170 -10.970 311 H ASN 44 H ASN 44 2.449 -6.345 -16.393 312 HA ASN 44 HA ASN 44 4.931 -5.225 -15.955 313 HB2 ASN 44 HB2 ASN 44 4.142 -6.704 -17.896 314 HB3 ASN 44 HB1 ASN 44 3.603 -5.206 -18.663 315 HD21 ASN 44 HD21 ASN 44 6.480 -6.447 -16.993 316 HD22 ASN 44 HD22 ASN 44 7.621 -5.777 -18.104 317 H LYS 45 H LYS 45 5.441 -3.213 -15.429 318 HA LYS 45 HA LYS 45 3.775 -0.987 -15.674 319 HB2 LYS 45 HB2 LYS 45 6.724 -1.335 -15.213 320 HB3 LYS 45 HB1 LYS 45 6.038 0.285 -15.416 321 HG2 LYS 45 HG1 LYS 45 6.031 0.035 -13.122 322 HG3 LYS 45 HG2 LYS 45 4.383 -0.445 -13.564 323 HD2 LYS 45 HD1 LYS 45 4.717 -2.635 -13.039 324 HD3 LYS 45 HD2 LYS 45 6.422 -2.592 -13.522 325 HE2 LYS 45 HE1 LYS 45 5.371 -1.232 -11.035 326 HE3 LYS 45 HE2 LYS 45 5.995 -2.888 -11.056 327 HZ1 LYS 45 3HZ LYS 45 8.127 -2.182 -11.465 328 HZ2 LYS 45 1HZ LYS 45 7.563 -0.932 -10.473 329 HZ3 LYS 45 2HZ LYS 45 7.644 -0.711 -12.148 330 H ASP 46 H ASP 46 3.595 0.655 -17.146 331 HA ASP 46 HA ASP 46 5.316 0.697 -19.488 332 HB2 ASP 46 HB2 ASP 46 3.056 -0.793 -19.675 333 HB3 ASP 46 HB1 ASP 46 2.442 0.792 -20.168 334 HD2 ASP 46 HD2 ASP 46 4.662 0.795 -22.963 335 H GLU 47 H GLU 47 4.581 2.551 -20.991 336 HA GLU 47 HA GLU 47 4.523 4.928 -19.427 337 HB2 GLU 47 HB2 GLU 47 4.461 6.102 -21.602 338 HB3 GLU 47 HB1 GLU 47 5.737 4.877 -21.522 339 HG2 GLU 47 HG1 GLU 47 4.254 3.309 -22.750 340 HG3 GLU 47 HG2 GLU 47 3.088 4.628 -22.927 341 HE2 GLU 47 HE2 GLU 47 5.602 6.313 -24.977 342 H LYS 48 H LYS 48 2.159 3.272 -21.471 343 HA LYS 48 HA LYS 48 0.140 5.250 -21.254 344 HB2 LYS 48 HB2 LYS 48 -1.387 3.388 -22.001 345 HB3 LYS 48 HB1 LYS 48 -0.007 3.708 -23.063 346 HG2 LYS 48 HG1 LYS 48 0.031 1.419 -22.991 347 HG3 LYS 48 HG2 LYS 48 1.134 1.819 -21.662 348 HD2 LYS 48 HD1 LYS 48 -0.224 0.937 -20.108 349 HD3 LYS 48 HD2 LYS 48 -1.659 1.685 -20.829 350 HE2 LYS 48 HE1 LYS 48 -1.882 -0.725 -20.922 351 HE3 LYS 48 HE2 LYS 48 -1.683 -0.078 -22.556 352 HZ1 LYS 48 3HZ LYS 48 -0.306 -1.980 -22.366 353 HZ2 LYS 48 1HZ LYS 48 0.370 -1.445 -20.911 354 HZ3 LYS 48 2HZ LYS 48 0.724 -0.637 -22.354 355 H VAL 49 H VAL 49 1.084 2.536 -19.273 356 HA VAL 49 HA VAL 49 -1.240 2.229 -17.741 357 HB VAL 49 HB VAL 49 1.653 1.755 -17.030 358 HG11 VAL 49 HG11 VAL 49 0.147 0.192 -15.336 359 HG12 VAL 49 HG12 VAL 49 0.991 1.678 -14.897 360 HG13 VAL 49 HG13 VAL 49 -0.716 1.729 -15.339 361 HG21 VAL 49 HG21 VAL 49 1.241 0.103 -18.519 362 HG22 VAL 49 HG22 VAL 49 0.500 -0.670 -17.118 363 HG23 VAL 49 HG23 VAL 49 -0.506 0.182 -18.290 364 H LEU 50 H LEU 50 1.492 4.436 -17.399 365 HA LEU 50 HA LEU 50 0.976 5.454 -14.871 366 HB2 LEU 50 HB2 LEU 50 1.966 7.044 -17.242 367 HB3 LEU 50 HB1 LEU 50 2.237 7.393 -15.527 368 HG LEU 50 HG LEU 50 3.303 4.921 -16.875 369 HD11 LEU 50 HD11 LEU 50 4.130 7.060 -17.917 370 HD12 LEU 50 HD12 LEU 50 5.371 6.017 -17.224 371 HD13 LEU 50 HD13 LEU 50 4.839 7.454 -16.352 372 HD21 LEU 50 HD21 LEU 50 4.508 6.228 -14.491 373 HD22 LEU 50 HD22 LEU 50 4.460 4.525 -14.945 374 HD23 LEU 50 HD23 LEU 50 3.022 5.301 -14.278 375 H LYS 51 H LYS 51 -0.578 6.134 -17.929 376 HA LYS 51 HA LYS 51 -1.880 8.506 -17.412 377 HB2 LYS 51 HB2 LYS 51 -2.953 6.083 -18.876 378 HB3 LYS 51 HB1 LYS 51 -3.627 7.717 -18.981 379 HG2 LYS 51 HG1 LYS 51 -0.742 7.316 -19.630 380 HG3 LYS 51 HG2 LYS 51 -1.972 6.813 -20.803 381 HD2 LYS 51 HD1 LYS 51 -2.851 9.010 -20.989 382 HD3 LYS 51 HD2 LYS 51 -1.946 9.557 -19.566 383 HE2 LYS 51 HE1 LYS 51 -0.651 10.418 -21.273 384 HE3 LYS 51 HE2 LYS 51 0.141 8.865 -20.973 385 HZ1 LYS 51 3HZ LYS 51 -1.942 8.543 -22.860 386 HZ2 LYS 51 1HZ LYS 51 -0.289 8.231 -23.036 387 HZ3 LYS 51 2HZ LYS 51 -0.898 9.774 -23.366 388 H ALA 52 H ALA 52 -2.600 5.301 -16.209 389 HA ALA 52 HA ALA 52 -5.176 5.936 -15.160 390 HB1 ALA 52 HB1 ALA 52 -3.450 3.627 -15.284 391 HB2 ALA 52 HB2 ALA 52 -5.206 3.714 -15.132 392 HB3 ALA 52 HB3 ALA 52 -4.192 3.788 -13.691 393 H LEU 53 H LEU 53 -1.928 5.709 -13.746 394 HA LEU 53 HA LEU 53 -2.600 6.180 -11.087 395 HB2 LEU 53 HB2 LEU 53 -0.110 7.045 -12.569 396 HB3 LEU 53 HB1 LEU 53 -0.287 6.945 -10.809 397 HG LEU 53 HG LEU 53 -0.703 4.497 -12.474 398 HD11 LEU 53 HD11 LEU 53 1.994 4.780 -11.431 399 HD12 LEU 53 HD12 LEU 53 1.622 5.957 -12.690 400 HD13 LEU 53 HD13 LEU 53 1.442 4.232 -13.014 401 HD21 LEU 53 HD21 LEU 53 0.613 3.770 -10.233 402 HD22 LEU 53 HD22 LEU 53 -1.144 3.853 -10.362 403 HD23 LEU 53 HD23 LEU 53 -0.245 5.196 -9.652 404 H GLU 54 H GLU 54 -2.549 8.327 -13.783 405 HA GLU 54 HA GLU 54 -2.171 10.786 -12.508 406 HB2 GLU 54 HB2 GLU 54 -3.914 10.167 -14.907 407 HB3 GLU 54 HB1 GLU 54 -3.325 11.771 -14.439 408 HG2 GLU 54 HG1 GLU 54 -1.012 11.029 -14.783 409 HG3 GLU 54 HG2 GLU 54 -1.614 9.442 -15.280 410 HE2 GLU 54 HE2 GLU 54 -1.104 11.513 -18.240 411 H ARG 55 H ARG 55 -5.172 9.006 -13.184 412 HA ARG 55 HA ARG 55 -6.852 10.923 -11.909 413 HB2 ARG 55 HB2 ARG 55 -7.880 9.587 -13.559 414 HB3 ARG 55 HB1 ARG 55 -7.265 8.091 -12.840 415 HG2 ARG 55 HG1 ARG 55 -9.679 8.392 -12.472 416 HG3 ARG 55 HG2 ARG 55 -8.757 8.320 -10.961 417 HD2 ARG 55 HD1 ARG 55 -9.500 10.327 -10.341 418 HD3 ARG 55 HD2 ARG 55 -8.917 11.037 -11.853 419 HE ARG 55 HE ARG 55 -11.301 9.700 -12.409 420 HH11 ARG 55 1HH1 ARG 55 -10.187 12.436 -10.566 421 HH12 ARG 55 2HH1 ARG 55 -11.679 13.305 -10.706 422 HH21 ARG 55 1HH2 ARG 55 -13.272 10.834 -12.600 423 HH22 ARG 55 2HH2 ARG 55 -13.434 12.392 -11.862 424 H THR 56 H THR 56 -5.177 8.031 -10.873 425 HA THR 56 HA THR 56 -6.538 7.737 -8.390 426 HB THR 56 HB THR 56 -4.994 6.057 -7.857 427 HG1 THR 56 HG1 THR 56 -3.221 7.491 -9.543 428 HG21 THR 56 HG21 THR 56 -6.200 6.036 -10.309 429 HG22 THR 56 HG22 THR 56 -5.360 4.664 -9.586 430 HG23 THR 56 HG23 THR 56 -4.519 5.711 -10.730 431 H ARG 57 H ARG 57 -3.587 9.387 -9.401 432 HA ARG 57 HA ARG 57 -2.503 10.010 -6.927 433 HB2 ARG 57 HB2 ARG 57 -2.456 11.359 -9.606 434 HB3 ARG 57 HB1 ARG 57 -1.723 12.160 -8.207 435 HG2 ARG 57 HG1 ARG 57 -0.190 10.342 -7.875 436 HG3 ARG 57 HG2 ARG 57 -0.998 9.390 -9.132 437 HD2 ARG 57 HD1 ARG 57 -0.037 12.072 -9.946 438 HD3 ARG 57 HD2 ARG 57 1.205 10.867 -9.574 439 HE ARG 57 HE ARG 57 -0.866 9.937 -11.355 440 HH11 ARG 57 1HH1 ARG 57 2.238 11.489 -11.085 441 HH12 ARG 57 2HH1 ARG 57 2.727 11.083 -12.697 442 HH21 ARG 57 1HH2 ARG 57 -0.234 9.396 -13.479 443 HH22 ARG 57 2HH2 ARG 57 1.320 9.893 -14.058 444 H GLN 58 H GLN 58 -5.122 11.568 -8.689 445 HA GLN 58 HA GLN 58 -5.350 13.857 -7.059 446 HB2 GLN 58 HB2 GLN 58 -7.573 12.483 -8.581 447 HB3 GLN 58 HB1 GLN 58 -7.507 14.182 -8.087 448 HG2 GLN 58 HG1 GLN 58 -6.156 12.799 -10.340 449 HG3 GLN 58 HG2 GLN 58 -6.910 14.398 -10.265 450 HE21 GLN 58 HE21 GLN 58 -4.012 12.633 -10.045 451 HE22 GLN 58 HE22 GLN 58 -2.960 13.953 -9.679 452 H LEU 59 H LEU 59 -6.608 10.602 -6.777 453 HA LEU 59 HA LEU 59 -8.246 11.320 -4.478 454 HB2 LEU 59 HB2 LEU 59 -7.896 8.476 -5.196 455 HB3 LEU 59 HB1 LEU 59 -9.363 9.385 -4.797 456 HG LEU 59 HG LEU 59 -7.956 9.409 -7.466 457 HD11 LEU 59 HD11 LEU 59 -10.687 8.311 -6.977 458 HD12 LEU 59 HD12 LEU 59 -9.269 7.317 -6.637 459 HD13 LEU 59 HD13 LEU 59 -9.539 7.943 -8.264 460 HD21 LEU 59 HD21 LEU 59 -9.072 11.293 -7.838 461 HD22 LEU 59 HD22 LEU 59 -9.884 11.183 -6.275 462 HD23 LEU 59 HD23 LEU 59 -10.570 10.374 -7.685 463 H ASP 60 H ASP 60 -5.087 10.860 -4.883 464 HA ASP 60 HA ASP 60 -3.351 10.368 -3.496 465 HB2 ASP 60 HB2 ASP 60 -5.349 10.011 -1.260 466 HB3 ASP 60 HB1 ASP 60 -3.664 10.541 -1.155 467 HD2 ASP 60 HD2 ASP 60 -6.294 13.295 -1.360 468 H ILE 61 H ILE 61 -3.347 8.363 -4.825 469 HA ILE 61 HA ILE 61 -3.681 6.022 -3.078 470 HB ILE 61 HB ILE 61 -4.215 5.898 -6.038 471 HG12 ILE 61 HG11 ILE 61 -6.266 6.118 -3.820 472 HG13 ILE 61 HG12 ILE 61 -5.831 7.437 -4.921 473 HG21 ILE 61 HG21 ILE 61 -3.596 3.858 -4.604 474 HG22 ILE 61 HG22 ILE 61 -5.209 4.031 -3.915 475 HG23 ILE 61 HG23 ILE 61 -5.015 3.744 -5.645 476 HD11 ILE 61 HD11 ILE 61 -6.474 5.241 -6.546 477 HD12 ILE 61 HD12 ILE 61 -7.722 5.339 -5.304 478 HD13 ILE 61 HD13 ILE 61 -7.382 6.736 -6.325 479 HA PRO 62 HA PRO 62 0.575 5.429 -4.156 480 HB2 PRO 62 HB2 PRO 62 0.867 2.962 -3.001 481 HB3 PRO 62 HB1 PRO 62 0.796 4.464 -2.081 482 HG2 PRO 62 HG1 PRO 62 -1.383 2.488 -2.668 483 HG3 PRO 62 HG2 PRO 62 -0.963 3.294 -1.110 484 HD2 PRO 62 HD1 PRO 62 -3.029 4.108 -2.672 485 HD3 PRO 62 HD2 PRO 62 -2.057 5.233 -1.706 486 H ASP 63 H ASP 63 1.567 4.625 -5.911 487 HA ASP 63 HA ASP 63 0.169 3.223 -7.894 488 HB2 ASP 63 HB2 ASP 63 2.565 2.827 -8.819 489 HB3 ASP 63 HB1 ASP 63 1.958 4.484 -8.695 490 HD2 ASP 63 HD2 ASP 63 4.677 5.305 -6.808 491 H GLU 64 H GLU 64 1.737 2.109 -5.081 492 HA GLU 64 HA GLU 64 2.523 -0.468 -5.932 493 HB2 GLU 64 HB2 GLU 64 1.651 0.335 -3.150 494 HB3 GLU 64 HB1 GLU 64 2.707 -1.015 -3.595 495 HG2 GLU 64 HG1 GLU 64 3.396 1.878 -4.092 496 HG3 GLU 64 HG2 GLU 64 3.873 0.980 -2.644 497 HE2 GLU 64 HE2 GLU 64 5.601 -0.104 -6.061 498 H LYS 65 H LYS 65 -0.453 0.751 -4.443 499 HA LYS 65 HA LYS 65 -1.704 -1.866 -4.635 500 HB2 LYS 65 HB2 LYS 65 -3.390 -1.053 -3.271 501 HB3 LYS 65 HB1 LYS 65 -1.987 -0.123 -2.720 502 HG2 LYS 65 HG1 LYS 65 -2.732 1.700 -4.325 503 HG3 LYS 65 HG2 LYS 65 -4.249 0.794 -4.467 504 HD2 LYS 65 HD1 LYS 65 -3.070 1.779 -1.859 505 HD3 LYS 65 HD2 LYS 65 -4.342 2.606 -2.775 506 HE2 LYS 65 HE1 LYS 65 -5.896 0.854 -2.423 507 HE3 LYS 65 HE2 LYS 65 -4.625 -0.247 -1.870 508 HZ1 LYS 65 3HZ LYS 65 -5.929 1.947 -0.427 509 HZ2 LYS 65 1HZ LYS 65 -4.327 1.569 -0.038 510 HZ3 LYS 65 2HZ LYS 65 -5.533 0.393 0.107 511 H THR 66 H THR 66 -1.664 1.182 -6.305 512 HA THR 66 HA THR 66 -4.063 0.755 -7.802 513 HB THR 66 HB THR 66 -1.752 2.641 -8.298 514 HG1 THR 66 HG1 THR 66 -2.779 3.919 -6.955 515 HG21 THR 66 HG21 THR 66 -3.292 3.828 -9.801 516 HG22 THR 66 HG22 THR 66 -4.489 2.552 -9.574 517 HG23 THR 66 HG23 THR 66 -2.958 2.193 -10.372 518 H MET 67 H MET 67 -0.691 -0.047 -8.220 519 HA MET 67 HA MET 67 -0.496 -0.483 -10.926 520 HB2 MET 67 HB2 MET 67 0.835 -1.502 -8.520 521 HB3 MET 67 HB1 MET 67 0.888 -2.625 -9.888 522 HG2 MET 67 HG1 MET 67 1.610 0.237 -10.340 523 HG3 MET 67 HG2 MET 67 2.763 -0.835 -9.540 524 HE1 MET 67 HE1 MET 67 0.536 -1.239 -13.236 525 HE2 MET 67 HE2 MET 67 0.889 0.268 -12.388 526 HE3 MET 67 HE3 MET 67 1.870 -0.216 -13.773 527 HA PRO 68 HA PRO 68 -2.233 -4.959 -10.398 528 HB2 PRO 68 HB2 PRO 68 -3.350 -5.608 -7.983 529 HB3 PRO 68 HB1 PRO 68 -1.641 -5.827 -8.354 530 HG2 PRO 68 HG1 PRO 68 -3.000 -3.581 -6.903 531 HG3 PRO 68 HG2 PRO 68 -1.491 -4.469 -6.473 532 HD2 PRO 68 HD1 PRO 68 -1.468 -2.012 -7.629 533 HD3 PRO 68 HD2 PRO 68 -0.227 -3.235 -7.954 534 H VAL 69 H VAL 69 -3.744 -2.115 -9.229 535 HA VAL 69 HA VAL 69 -6.453 -3.084 -9.441 536 HB VAL 69 HB VAL 69 -5.290 -0.338 -9.014 537 HG11 VAL 69 HG11 VAL 69 -7.195 0.262 -10.159 538 HG12 VAL 69 HG12 VAL 69 -8.097 -1.154 -9.614 539 HG13 VAL 69 HG13 VAL 69 -7.797 0.184 -8.503 540 HG21 VAL 69 HG21 VAL 69 -7.182 -1.486 -7.094 541 HG22 VAL 69 HG22 VAL 69 -5.678 -2.392 -7.266 542 HG23 VAL 69 HG23 VAL 69 -5.633 -0.686 -6.823 543 H LEU 70 H LEU 70 -4.538 -0.656 -11.223 544 HA LEU 70 HA LEU 70 -6.405 -0.252 -13.276 545 HB2 LEU 70 HB2 LEU 70 -4.623 0.814 -14.499 546 HB3 LEU 70 HB1 LEU 70 -4.531 1.259 -12.787 547 HG LEU 70 HG LEU 70 -2.804 -0.797 -12.798 548 HD11 LEU 70 HD11 LEU 70 -1.565 -0.979 -14.762 549 HD12 LEU 70 HD12 LEU 70 -2.263 0.485 -15.453 550 HD13 LEU 70 HD13 LEU 70 -3.238 -0.979 -15.319 551 HD21 LEU 70 HD21 LEU 70 -1.044 1.046 -13.281 552 HD22 LEU 70 HD22 LEU 70 -2.091 1.197 -11.869 553 HD23 LEU 70 HD23 LEU 70 -2.439 2.123 -13.330 554 H MET 71 H MET 71 -3.646 -2.462 -13.040 555 HA MET 71 HA MET 71 -3.767 -3.486 -15.646 556 HB2 MET 71 HB2 MET 71 -2.271 -5.130 -14.948 557 HB3 MET 71 HB1 MET 71 -1.953 -3.793 -13.832 558 HG2 MET 71 HG1 MET 71 -2.077 -5.415 -12.277 559 HG3 MET 71 HG2 MET 71 -3.809 -5.103 -12.419 560 HE1 MET 71 HE1 MET 71 -2.793 -7.772 -11.180 561 HE2 MET 71 HE2 MET 71 -2.454 -9.103 -12.286 562 HE3 MET 71 HE3 MET 71 -1.312 -7.767 -12.138 563 H LYS 72 H LYS 72 -5.755 -4.038 -12.885 564 HA LYS 72 HA LYS 72 -6.800 -6.572 -13.680 565 HB2 LYS 72 HB2 LYS 72 -6.833 -5.715 -11.341 566 HB3 LYS 72 HB1 LYS 72 -8.038 -4.517 -11.839 567 HG2 LYS 72 HG1 LYS 72 -8.882 -7.147 -12.641 568 HG3 LYS 72 HG2 LYS 72 -8.491 -7.119 -10.912 569 HD2 LYS 72 HD1 LYS 72 -10.685 -6.456 -10.827 570 HD3 LYS 72 HD2 LYS 72 -9.884 -4.880 -10.972 571 HE2 LYS 72 HE1 LYS 72 -10.486 -4.616 -13.199 572 HE3 LYS 72 HE2 LYS 72 -10.701 -6.356 -13.440 573 HZ1 LYS 72 3HZ LYS 72 -12.822 -5.217 -13.387 574 HZ2 LYS 72 1HZ LYS 72 -12.490 -4.601 -11.847 575 HZ3 LYS 72 2HZ LYS 72 -12.692 -6.265 -12.066 576 H LEU 73 H LEU 73 -7.600 -3.246 -14.361 577 HA LEU 73 HA LEU 73 -10.202 -3.742 -15.411 578 HB2 LEU 73 HB2 LEU 73 -8.496 -1.422 -16.250 579 HB3 LEU 73 HB1 LEU 73 -10.250 -1.497 -16.001 580 HG LEU 73 HG LEU 73 -8.131 -1.442 -13.854 581 HD11 LEU 73 HD11 LEU 73 -8.367 0.729 -14.719 582 HD12 LEU 73 HD12 LEU 73 -9.384 0.691 -13.279 583 HD13 LEU 73 HD13 LEU 73 -10.116 0.567 -14.878 584 HD21 LEU 73 HD21 LEU 73 -9.791 -2.769 -12.922 585 HD22 LEU 73 HD22 LEU 73 -11.088 -1.912 -13.755 586 HD23 LEU 73 HD23 LEU 73 -10.248 -1.145 -12.405 587 H LEU 74 H LEU 74 -7.009 -3.264 -16.893 588 HA LEU 74 HA LEU 74 -7.851 -3.482 -19.567 589 HB2 LEU 74 HB2 LEU 74 -5.204 -3.984 -18.215 590 HB3 LEU 74 HB1 LEU 74 -5.427 -4.134 -19.966 591 HG LEU 74 HG LEU 74 -4.463 -2.003 -19.549 592 HD11 LEU 74 HD11 LEU 74 -7.051 -0.817 -19.867 593 HD12 LEU 74 HD12 LEU 74 -6.964 -2.324 -20.777 594 HD13 LEU 74 HD13 LEU 74 -5.775 -1.053 -21.061 595 HD21 LEU 74 HD21 LEU 74 -6.732 -1.400 -17.660 596 HD22 LEU 74 HD22 LEU 74 -5.327 -0.393 -18.010 597 HD23 LEU 74 HD23 LEU 74 -5.127 -1.916 -17.143 598 H GLU 75 H GLU 75 -7.331 -5.851 -17.112 599 HA GLU 75 HA GLU 75 -6.785 -8.118 -18.652 600 HB2 GLU 75 HB2 GLU 75 -7.639 -7.533 -15.937 601 HB3 GLU 75 HB1 GLU 75 -8.403 -9.005 -16.559 602 HG2 GLU 75 HG1 GLU 75 -5.633 -9.049 -17.254 603 HG3 GLU 75 HG2 GLU 75 -5.797 -8.688 -15.530 604 HE2 GLU 75 HE2 GLU 75 -6.746 -11.906 -14.807 605 H GLU 76 H GLU 76 -9.935 -6.935 -17.470 606 HA GLU 76 HA GLU 76 -11.387 -8.845 -19.048 607 HB2 GLU 76 HB2 GLU 76 -12.444 -6.380 -17.648 608 HB3 GLU 76 HB1 GLU 76 -13.376 -7.789 -18.179 609 HG2 GLU 76 HG1 GLU 76 -11.208 -7.880 -16.083 610 HG3 GLU 76 HG2 GLU 76 -12.936 -7.718 -15.739 611 HE2 GLU 76 HE2 GLU 76 -13.387 -11.095 -15.985 612 H ALA 77 H ALA 77 -10.377 -5.523 -19.393 613 HA ALA 77 HA ALA 77 -12.060 -5.045 -21.698 614 HB1 ALA 77 HB1 ALA 77 -9.803 -3.236 -21.016 615 HB2 ALA 77 HB2 ALA 77 -11.151 -3.355 -19.884 616 HB3 ALA 77 HB3 ALA 77 -11.441 -2.854 -21.551 617 H GLY 78 H GLY 78 -9.465 -6.921 -21.326 618 HA2 GLY 78 HA2 GLY 78 -7.832 -7.739 -22.718 619 HA3 GLY 78 3HA GLY 78 -8.886 -7.220 -24.024 620 H GLY 79 H GLY 79 -7.691 -4.854 -21.796 621 HA2 GLY 79 HA2 GLY 79 -5.849 -3.411 -21.970 622 HA3 GLY 79 3HA GLY 79 -5.447 -4.146 -23.515 623 H ASN 80 H ASN 80 -8.561 -2.796 -22.526 624 HA ASN 80 HA ASN 80 -8.261 -0.791 -24.665 625 HB2 ASN 80 HB2 ASN 80 -10.093 -2.761 -24.657 626 HB3 ASN 80 HB1 ASN 80 -10.979 -1.542 -23.733 627 HD21 ASN 80 HD21 ASN 80 -11.184 0.601 -24.706 628 HD22 ASN 80 HD22 ASN 80 -11.329 0.720 -26.424 629 H TRP 81 H TRP 81 -7.758 1.084 -23.715 630 HA TRP 81 HA TRP 81 -8.781 1.780 -21.105 631 HB2 TRP 81 HB2 TRP 81 -7.112 3.395 -23.054 632 HB3 TRP 81 HB1 TRP 81 -7.447 3.834 -21.379 633 HD1 TRP 81 HD1 TRP 81 -5.541 1.134 -23.377 634 HE1 TRP 81 HE1 TRP 81 -3.661 0.210 -21.884 635 HE3 TRP 81 HE3 TRP 81 -6.659 3.603 -19.043 636 HZ2 TRP 81 2HZ TRP 81 -2.770 0.489 -19.220 637 HZ3 TRP 81 3HZ TRP 81 -5.243 3.219 -17.067 638 HH2 TRP 81 HH TRP 81 -3.340 1.693 -17.156 639 H SER 82 H SER 82 -9.685 2.276 -24.373 640 HA SER 82 HA SER 82 -10.970 4.722 -24.337 641 HB2 SER 82 HB2 SER 82 -10.658 2.937 -26.246 642 HB3 SER 82 HB1 SER 82 -12.267 2.403 -25.725 643 HG SER 82 HG SER 82 -11.691 5.105 -26.343 644 H TYR 83 H TYR 83 -12.366 1.544 -23.537 645 HA TYR 83 HA TYR 83 -14.835 2.700 -22.640 646 HB2 TYR 83 HB2 TYR 83 -15.123 0.560 -23.506 647 HB3 TYR 83 HB1 TYR 83 -13.685 -0.068 -22.698 648 HD1 TYR 83 HD1 TYR 83 -17.234 0.726 -22.287 649 HD2 TYR 83 HD2 TYR 83 -13.742 -0.773 -20.373 650 HE1 TYR 83 HE1 TYR 83 -18.622 -0.156 -20.458 651 HE2 TYR 83 HE2 TYR 83 -15.121 -1.660 -18.539 652 HH TYR 83 HH TYR 83 -17.275 -2.191 -17.945 653 H ILE 84 H ILE 84 -11.974 1.308 -21.092 654 HA ILE 84 HA ILE 84 -12.862 1.362 -18.446 655 HB ILE 84 HB ILE 84 -10.065 1.713 -19.528 656 HG12 ILE 84 HG11 ILE 84 -11.440 -0.703 -18.324 657 HG13 ILE 84 HG12 ILE 84 -11.230 -0.429 -20.062 658 HG21 ILE 84 HG21 ILE 84 -11.111 1.537 -16.742 659 HG22 ILE 84 HG22 ILE 84 -9.555 0.802 -17.126 660 HG23 ILE 84 HG23 ILE 84 -9.805 2.526 -17.396 661 HD11 ILE 84 HD11 ILE 84 -9.409 -1.594 -18.200 662 HD12 ILE 84 HD12 ILE 84 -9.279 -1.456 -19.954 663 HD13 ILE 84 HD13 ILE 84 -8.682 -0.157 -18.920 664 H LYS 85 H LYS 85 -11.782 3.919 -20.527 665 HA LYS 85 HA LYS 85 -11.612 5.798 -18.290 666 HB2 LYS 85 HB2 LYS 85 -10.338 7.160 -19.612 667 HB3 LYS 85 HB1 LYS 85 -9.971 5.599 -20.362 668 HG2 LYS 85 HG1 LYS 85 -12.081 6.237 -21.848 669 HG3 LYS 85 HG2 LYS 85 -11.565 7.871 -21.396 670 HD2 LYS 85 HD1 LYS 85 -9.953 5.755 -22.830 671 HD3 LYS 85 HD2 LYS 85 -10.481 7.330 -23.449 672 HE2 LYS 85 HE1 LYS 85 -8.442 6.804 -21.277 673 HE3 LYS 85 HE2 LYS 85 -8.157 7.483 -22.886 674 HZ1 LYS 85 3HZ LYS 85 -8.413 9.466 -21.959 675 HZ2 LYS 85 1HZ LYS 85 -8.954 8.805 -20.499 676 HZ3 LYS 85 2HZ LYS 85 -10.054 9.111 -21.747 677 H LEU 86 H LEU 86 -14.029 4.546 -19.964 678 HA LEU 86 HA LEU 86 -15.437 6.732 -21.039 679 HB2 LEU 86 HB2 LEU 86 -15.868 4.238 -21.357 680 HB3 LEU 86 HB1 LEU 86 -16.711 4.308 -19.799 681 HG LEU 86 HG LEU 86 -17.574 6.235 -21.879 682 HD11 LEU 86 HD11 LEU 86 -19.164 4.187 -22.538 683 HD12 LEU 86 HD12 LEU 86 -17.677 3.301 -22.199 684 HD13 LEU 86 HD13 LEU 86 -17.683 4.580 -23.413 685 HD21 LEU 86 HD21 LEU 86 -19.672 4.773 -20.665 686 HD22 LEU 86 HD22 LEU 86 -19.217 6.458 -20.407 687 HD23 LEU 86 HD23 LEU 86 -18.511 5.189 -19.405 688 H ASP 87 H ASP 87 -14.768 5.872 -17.822 689 HA ASP 87 HA ASP 87 -16.659 7.910 -16.880 690 HB2 ASP 87 HB2 ASP 87 -16.116 5.371 -15.333 691 HB3 ASP 87 HB1 ASP 87 -17.356 6.594 -15.021 692 HD2 ASP 87 HD2 ASP 87 -18.041 3.986 -17.936 693 H ASN 88 H ASN 88 -13.758 7.886 -17.448 694 HA ASN 88 HA ASN 88 -11.870 8.798 -16.563 695 HB2 ASN 88 HB2 ASN 88 -13.873 10.151 -15.346 696 HB3 ASN 88 HB1 ASN 88 -13.087 9.427 -13.937 697 HD21 ASN 88 HD21 ASN 88 -10.467 9.436 -14.638 698 HD22 ASN 88 HD22 ASN 88 -9.906 11.061 -14.819 699 H TYR 89 H TYR 89 -12.232 6.049 -16.323 700 HA TYR 89 HA TYR 89 -11.361 4.221 -15.293 701 HB2 TYR 89 HB2 TYR 89 -9.744 6.263 -13.747 702 HB3 TYR 89 HB1 TYR 89 -9.386 4.539 -13.874 703 HD1 TYR 89 HD2 TYR 89 -10.196 4.409 -16.893 704 HD2 TYR 89 HD1 TYR 89 -7.585 6.918 -14.659 705 HE1 TYR 89 HE2 TYR 89 -8.856 4.808 -18.917 706 HE2 TYR 89 HE1 TYR 89 -6.239 7.324 -16.677 707 HH TYR 89 HH TYR 89 -7.163 6.955 -19.609 708 H THR 90 H THR 90 -13.786 5.166 -14.296 709 HA THR 90 HA THR 90 -14.022 5.575 -11.581 710 HB THR 90 HB THR 90 -15.837 4.077 -13.468 711 HG1 THR 90 HG1 THR 90 -16.047 6.644 -12.241 712 HG21 THR 90 HG21 THR 90 -16.249 4.769 -10.564 713 HG22 THR 90 HG22 THR 90 -16.372 3.185 -11.331 714 HG23 THR 90 HG23 THR 90 -17.579 4.426 -11.670 715 H ALA 91 H ALA 91 -13.414 2.586 -13.310 716 HA ALA 91 HA ALA 91 -13.991 0.689 -11.396 717 HB1 ALA 91 HB1 ALA 91 -11.623 0.645 -13.263 718 HB2 ALA 91 HB2 ALA 91 -13.271 0.191 -13.700 719 HB3 ALA 91 HB3 ALA 91 -12.388 -0.747 -12.496 720 H LEU 92 H LEU 92 -11.175 2.789 -11.641 721 HA LEU 92 HA LEU 92 -9.634 1.533 -9.629 722 HB2 LEU 92 HB2 LEU 92 -8.151 3.292 -9.835 723 HB3 LEU 92 HB1 LEU 92 -8.944 3.259 -11.419 724 HG LEU 92 HG LEU 92 -10.513 5.060 -10.254 725 HD11 LEU 92 HD11 LEU 92 -8.472 6.442 -9.040 726 HD12 LEU 92 HD12 LEU 92 -8.235 4.794 -8.462 727 HD13 LEU 92 HD13 LEU 92 -9.785 5.600 -8.217 728 HD21 LEU 92 HD21 LEU 92 -8.026 6.350 -11.010 729 HD22 LEU 92 HD22 LEU 92 -9.608 6.396 -11.790 730 HD23 LEU 92 HD23 LEU 92 -8.491 5.075 -12.138 731 H VAL 93 H VAL 93 -12.129 3.995 -9.562 732 HA VAL 93 HA VAL 93 -11.725 4.880 -6.910 733 HB VAL 93 HB VAL 93 -14.158 4.924 -8.690 734 HG11 VAL 93 HG11 VAL 93 -13.821 5.926 -5.878 735 HG12 VAL 93 HG12 VAL 93 -15.017 6.607 -6.982 736 HG13 VAL 93 HG13 VAL 93 -15.098 4.903 -6.536 737 HG21 VAL 93 HG21 VAL 93 -13.370 6.865 -9.452 738 HG22 VAL 93 HG22 VAL 93 -13.028 7.452 -7.825 739 HG23 VAL 93 HG23 VAL 93 -11.846 6.450 -8.667 740 H ASP 94 H ASP 94 -13.957 2.470 -8.279 741 HA ASP 94 HA ASP 94 -14.985 1.700 -5.722 742 HB2 ASP 94 HB2 ASP 94 -16.140 1.498 -8.011 743 HB3 ASP 94 HB1 ASP 94 -15.156 0.045 -8.233 744 HD2 ASP 94 HD2 ASP 94 -17.235 -0.618 -5.026 745 H ALA 95 H ALA 95 -12.373 0.648 -7.776 746 HA ALA 95 HA ALA 95 -11.930 -1.871 -6.535 747 HB1 ALA 95 HB1 ALA 95 -9.573 -1.493 -7.584 748 HB2 ALA 95 HB2 ALA 95 -10.354 -0.118 -8.366 749 HB3 ALA 95 HB3 ALA 95 -10.972 -1.749 -8.626 750 H ILE 96 H ILE 96 -10.142 1.209 -6.282 751 HA ILE 96 HA ILE 96 -8.460 0.397 -4.187 752 HB ILE 96 HB ILE 96 -9.380 3.184 -4.899 753 HG12 ILE 96 HG11 ILE 96 -8.238 1.951 -6.719 754 HG13 ILE 96 HG12 ILE 96 -7.305 3.345 -6.148 755 HG21 ILE 96 HG21 ILE 96 -7.374 3.936 -3.697 756 HG22 ILE 96 HG22 ILE 96 -8.514 3.111 -2.634 757 HG23 ILE 96 HG23 ILE 96 -7.066 2.274 -3.194 758 HD11 ILE 96 HD11 ILE 96 -5.825 1.929 -4.904 759 HD12 ILE 96 HD12 ILE 96 -6.797 0.509 -5.290 760 HD13 ILE 96 HD13 ILE 96 -5.919 1.349 -6.567 761 H TYR 97 H TYR 97 -11.668 1.836 -4.191 762 HA TYR 97 HA TYR 97 -11.832 2.527 -1.481 763 HB2 TYR 97 HB2 TYR 97 -13.761 2.019 -3.681 764 HB3 TYR 97 HB1 TYR 97 -14.401 1.917 -2.039 765 HD1 TYR 97 HD1 TYR 97 -11.735 4.202 -3.249 766 HD2 TYR 97 HD2 TYR 97 -15.755 3.832 -1.906 767 HE1 TYR 97 HE1 TYR 97 -11.921 6.653 -3.147 768 HE2 TYR 97 HE2 TYR 97 -15.952 6.282 -1.802 769 HH TYR 97 HH TYR 97 -13.293 8.384 -2.837 770 H SER 98 H SER 98 -12.289 -0.528 -3.135 771 HA SER 98 HA SER 98 -13.419 -1.879 -0.873 772 HB2 SER 98 HB2 SER 98 -14.057 -2.965 -2.796 773 HB3 SER 98 HB1 SER 98 -12.510 -2.657 -3.604 774 HG SER 98 HG SER 98 -12.967 -4.537 -1.525 775 H VAL 99 H VAL 99 -10.257 -2.079 -2.509 776 HA VAL 99 HA VAL 99 -9.044 -3.791 -0.647 777 HB VAL 99 HB VAL 99 -7.653 -1.701 -2.325 778 HG11 VAL 99 HG11 VAL 99 -5.722 -2.586 -1.653 779 HG12 VAL 99 HG12 VAL 99 -6.642 -3.424 -0.402 780 HG13 VAL 99 HG13 VAL 99 -6.298 -4.228 -1.933 781 HG21 VAL 99 HG21 VAL 99 -8.544 -2.808 -4.058 782 HG22 VAL 99 HG22 VAL 99 -7.381 -4.072 -3.656 783 HG23 VAL 99 HG23 VAL 99 -9.035 -4.174 -3.056 784 H GLU 100 H GLU 100 -8.700 -0.253 -0.979 785 HA GLU 100 HA GLU 100 -7.114 0.228 1.222 786 HB2 GLU 100 HB2 GLU 100 -7.674 2.471 1.026 787 HB3 GLU 100 HB1 GLU 100 -8.029 1.847 -0.593 788 HG2 GLU 100 HG1 GLU 100 -10.417 1.622 0.069 789 HG3 GLU 100 HG2 GLU 100 -10.010 2.416 1.597 790 HE2 GLU 100 HE2 GLU 100 -9.110 5.098 -0.997 791 H ASP 101 H ASP 101 -10.532 -0.465 1.093 792 HA ASP 101 HA ASP 101 -10.880 0.137 3.924 793 HB2 ASP 101 HB2 ASP 101 -12.599 0.702 2.115 794 HB3 ASP 101 HB1 ASP 101 -12.950 -1.031 2.069 795 HD2 ASP 101 HD2 ASP 101 -15.251 -0.298 4.525 796 H GLU 102 H GLU 102 -11.961 -1.485 5.317 797 HA GLU 102 HA GLU 102 -11.824 -3.475 6.421 798 HB2 GLU 102 HB2 GLU 102 -12.110 -4.601 3.625 799 HB3 GLU 102 HB1 GLU 102 -12.461 -5.450 5.138 800 HG2 GLU 102 HG1 GLU 102 -13.885 -2.893 4.557 801 HG3 GLU 102 HG2 GLU 102 -14.377 -4.370 3.717 802 HE2 GLU 102 HE2 GLU 102 -16.387 -4.516 6.599 803 H ASN 103 H ASN 103 -9.577 -3.024 6.941 804 HA ASN 103 HA ASN 103 -7.657 -4.667 5.440 805 HB2 ASN 103 HB2 ASN 103 -7.381 -2.203 7.136 806 HB3 ASN 103 HB1 ASN 103 -5.996 -3.282 6.926 807 HD21 ASN 103 HD21 ASN 103 -8.540 -2.368 4.646 808 HD22 ASN 103 HD22 ASN 103 -7.479 -1.687 3.466 809 H LYS 104 H LYS 104 -9.278 -4.321 8.457 810 HA LYS 104 HA LYS 104 -7.518 -6.312 9.712 811 HB2 LYS 104 HB2 LYS 104 -8.489 -5.647 11.835 812 HB3 LYS 104 HB1 LYS 104 -7.889 -4.223 10.972 813 HG2 LYS 104 HG1 LYS 104 -10.748 -4.963 10.611 814 HG3 LYS 104 HG2 LYS 104 -10.249 -4.248 12.155 815 HD2 LYS 104 HD1 LYS 104 -9.886 -2.209 11.253 816 HD3 LYS 104 HD2 LYS 104 -9.206 -2.888 9.764 817 HE2 LYS 104 HE1 LYS 104 -11.129 -2.093 8.861 818 HE3 LYS 104 HE2 LYS 104 -11.762 -3.636 9.453 819 HZ1 LYS 104 3HZ LYS 104 -13.247 -2.387 10.522 820 HZ2 LYS 104 1HZ LYS 104 -12.351 -0.964 10.331 821 HZ3 LYS 104 2HZ LYS 104 -12.005 -2.018 11.608 822 H GLN 105 H GLN 105 -10.591 -5.889 8.291 823 HA GLN 105 HA GLN 105 -12.343 -7.295 7.939 824 HB2 GLN 105 HB2 GLN 105 -10.574 -9.459 9.092 825 HB3 GLN 105 HB1 GLN 105 -11.964 -9.669 8.015 826 HG2 GLN 105 HG1 GLN 105 -9.422 -8.234 7.251 827 HG3 GLN 105 HG2 GLN 105 -9.768 -9.933 6.896 828 HE21 GLN 105 HE21 GLN 105 -10.339 -6.671 6.018 829 HE22 GLN 105 HE22 GLN 105 -11.318 -6.980 4.630 830 H SER 106 H SER 106 -12.911 -5.861 9.969 831 HA SER 106 HA SER 106 -13.389 -7.500 12.336 832 HB2 SER 106 HB2 SER 106 -12.557 -5.350 12.890 833 HB3 SER 106 HB1 SER 106 -13.671 -4.551 11.766 834 HG SER 106 HG SER 106 -15.032 -4.427 13.346 835 H GLU 107 H GLU 107 -14.919 -8.869 11.137 836 HA GLU 107 HA GLU 107 -17.558 -7.601 10.821 837 HB2 GLU 107 HB2 GLU 107 -16.405 -8.820 8.858 838 HB3 GLU 107 HB1 GLU 107 -16.822 -10.304 9.729 839 HG2 GLU 107 HG1 GLU 107 -18.543 -9.987 8.163 840 HG3 GLU 107 HG2 GLU 107 -19.210 -9.493 9.726 841 HE2 GLU 107 HE2 GLU 107 -18.230 -6.223 7.836 842 H GLY 108 H GLY 108 -18.227 -7.725 12.962 843 HA2 GLY 108 HA2 GLY 108 -18.750 -10.471 13.915 844 HA3 GLY 108 3HA GLY 108 -18.171 -9.220 15.006 845 H SER 109 H SER 109 -20.790 -9.739 12.642 846 HA SER 109 HA SER 109 -22.537 -7.881 13.913 847 HB2 SER 109 HB2 SER 109 -24.256 -8.767 12.376 848 HB3 SER 109 HB1 SER 109 -22.747 -8.395 11.526 849 HG SER 109 HG SER 109 -23.103 -10.374 10.811 Start of MODEL 14 1 H1 MET 1 H MET 1 35.943 27.044 -0.120 2 HA MET 1 HA MET 1 33.727 27.830 -1.530 3 HB2 MET 1 HB2 MET 1 35.642 29.259 -0.663 4 HB3 MET 1 HB1 MET 1 36.496 28.846 -2.158 5 HG2 MET 1 HG1 MET 1 35.509 30.949 -2.544 6 HG3 MET 1 HG2 MET 1 34.524 29.770 -3.414 7 HE1 MET 1 HE1 MET 1 34.016 32.298 0.062 8 HE2 MET 1 HE2 MET 1 34.831 32.548 -1.482 9 HE3 MET 1 HE3 MET 1 33.150 33.044 -1.282 10 H GLY 2 H GLY 2 32.995 27.688 -3.588 11 HA2 GLY 2 HA2 GLY 2 33.322 27.441 -5.950 12 HA3 GLY 2 3HA GLY 2 34.770 26.503 -5.613 13 H SER 3 H SER 3 31.690 26.038 -3.994 14 HA SER 3 HA SER 3 31.680 23.261 -4.432 15 HB2 SER 3 HB2 SER 3 29.579 25.222 -3.511 16 HB3 SER 3 HB1 SER 3 29.204 23.503 -3.724 17 HG SER 3 HG SER 3 30.713 24.750 -1.781 18 H SER 4 H SER 4 30.857 22.004 -5.999 19 HA SER 4 HA SER 4 28.933 23.043 -7.899 20 HB2 SER 4 HB2 SER 4 31.434 21.882 -9.091 21 HB3 SER 4 HB1 SER 4 30.236 22.964 -9.822 22 HG SER 4 HG SER 4 31.148 24.671 -8.869 23 H HIS 5 H HIS 5 28.458 21.289 -9.607 24 HA HIS 5 HA HIS 5 28.795 18.598 -8.486 25 HB2 HIS 5 HB2 HIS 5 26.169 19.836 -9.345 26 HB3 HIS 5 HB1 HIS 5 26.394 18.122 -8.984 27 HD1 HIS 5 HD1 HIS 5 26.158 21.460 -7.315 28 HD2 HIS 5 HD2 HIS 5 26.592 17.461 -6.273 29 HE1 HIS 5 HE1 HIS 5 25.775 21.367 -4.831 30 HE2 HIS 5 HE2 HIS 5 26.040 18.922 -4.194 31 H HIS 6 H HIS 6 29.804 17.474 -10.009 32 HA HIS 6 HA HIS 6 29.526 18.155 -12.807 33 HB2 HIS 6 HB2 HIS 6 31.209 16.174 -11.282 34 HB3 HIS 6 HB1 HIS 6 31.134 16.152 -13.046 35 HD1 HIS 6 HD1 HIS 6 32.497 18.135 -10.197 36 HD2 HIS 6 HD2 HIS 6 32.417 18.287 -14.349 37 HE1 HIS 6 HE1 HIS 6 34.194 19.875 -10.840 38 HE2 HIS 6 HE2 HIS 6 34.147 19.969 -13.377 39 H HIS 7 H HIS 7 28.859 16.685 -14.443 40 HA HIS 7 HA HIS 7 27.431 14.287 -13.614 41 HB2 HIS 7 HB2 HIS 7 25.420 14.988 -14.971 42 HB3 HIS 7 HB1 HIS 7 25.649 15.858 -13.451 43 HD1 HIS 7 HD1 HIS 7 25.287 16.399 -17.048 44 HD2 HIS 7 HD2 HIS 7 26.726 18.535 -13.787 45 HE1 HIS 7 HE1 HIS 7 25.413 18.792 -17.814 46 HE2 HIS 7 HE2 HIS 7 26.293 20.097 -15.821 47 H HIS 8 H HIS 8 27.269 12.739 -15.206 48 HA HIS 8 HA HIS 8 27.978 13.378 -17.942 49 HB2 HIS 8 HB2 HIS 8 29.865 11.887 -18.088 50 HB3 HIS 8 HB1 HIS 8 30.167 13.054 -16.796 51 HD1 HIS 8 HD1 HIS 8 30.923 9.771 -17.326 52 HD2 HIS 8 HD2 HIS 8 28.868 11.650 -14.242 53 HE1 HIS 8 HE1 HIS 8 31.071 8.202 -15.366 54 HE2 HIS 8 HE2 HIS 8 29.816 9.350 -13.481 55 H HIS 9 H HIS 9 27.809 11.447 -19.365 56 HA HIS 9 HA HIS 9 25.437 9.984 -18.726 57 HB2 HIS 9 HB2 HIS 9 27.324 9.567 -21.056 58 HB3 HIS 9 HB1 HIS 9 25.644 9.030 -20.945 59 HD1 HIS 9 HD1 HIS 9 26.687 10.923 -23.209 60 HD2 HIS 9 HD2 HIS 9 24.729 12.158 -19.760 61 HE1 HIS 9 HE1 HIS 9 25.684 13.159 -23.770 62 HE2 HIS 9 HE2 HIS 9 24.487 13.916 -21.662 63 H HIS 10 H HIS 10 25.256 7.633 -18.832 64 HA HIS 10 HA HIS 10 27.681 6.276 -17.847 65 HB2 HIS 10 HB2 HIS 10 24.851 6.191 -16.850 66 HB3 HIS 10 HB1 HIS 10 25.898 4.784 -16.633 67 HD1 HIS 10 HD1 HIS 10 26.404 4.858 -14.191 68 HD2 HIS 10 HD2 HIS 10 26.988 8.535 -16.034 69 HE1 HIS 10 HE1 HIS 10 27.451 6.327 -12.441 70 HE2 HIS 10 HE2 HIS 10 27.808 8.576 -13.565 71 H SER 11 H SER 11 28.331 5.131 -19.578 72 HA SER 11 HA SER 11 26.338 3.645 -21.129 73 HB2 SER 11 HB2 SER 11 28.263 3.250 -22.714 74 HB3 SER 11 HB1 SER 11 27.812 4.951 -22.502 75 HG SER 11 HG SER 11 29.613 5.319 -21.365 76 H SER 12 H SER 12 25.988 2.063 -19.469 77 HA SER 12 HA SER 12 28.025 -0.045 -19.523 78 HB2 SER 12 HB2 SER 12 28.116 1.363 -17.370 79 HB3 SER 12 HB1 SER 12 26.557 0.618 -16.973 80 HG SER 12 HG SER 12 27.701 -0.981 -16.251 81 H GLY 13 H GLY 13 27.160 -1.898 -20.169 82 HA2 GLY 13 HA2 GLY 13 24.364 -2.481 -19.455 83 HA3 GLY 13 3HA GLY 13 24.876 -2.607 -21.131 84 H LEU 14 H LEU 14 24.003 -4.512 -18.812 85 HA LEU 14 HA LEU 14 26.017 -6.558 -19.450 86 HB2 LEU 14 HB2 LEU 14 25.460 -7.458 -17.083 87 HB3 LEU 14 HB1 LEU 14 26.609 -6.121 -17.269 88 HG LEU 14 HG LEU 14 24.746 -4.546 -16.704 89 HD11 LEU 14 HD11 LEU 14 22.768 -5.665 -17.143 90 HD12 LEU 14 HD12 LEU 14 22.870 -5.740 -15.384 91 HD13 LEU 14 HD13 LEU 14 23.310 -7.146 -16.353 92 HD21 LEU 14 HD21 LEU 14 26.164 -4.855 -14.926 93 HD22 LEU 14 HD22 LEU 14 25.845 -6.587 -14.829 94 HD23 LEU 14 HD23 LEU 14 24.647 -5.434 -14.239 95 H VAL 15 H VAL 15 23.338 -5.925 -20.539 96 HA VAL 15 HA VAL 15 21.455 -7.007 -21.226 97 HB VAL 15 HB VAL 15 21.830 -9.072 -22.007 98 HG11 VAL 15 HG11 VAL 15 24.081 -9.636 -22.279 99 HG12 VAL 15 HG12 VAL 15 24.111 -7.896 -21.982 100 HG13 VAL 15 HG13 VAL 15 24.523 -9.021 -20.686 101 HG21 VAL 15 HG21 VAL 15 22.597 -9.811 -19.193 102 HG22 VAL 15 HG22 VAL 15 21.123 -10.229 -20.065 103 HG23 VAL 15 HG23 VAL 15 22.660 -10.953 -20.536 104 HA PRO 16 HA PRO 16 18.770 -7.705 -17.826 105 HB2 PRO 16 HB2 PRO 16 16.885 -9.378 -18.898 106 HB3 PRO 16 HB1 PRO 16 17.025 -7.672 -19.321 107 HG2 PRO 16 HG1 PRO 16 18.089 -10.081 -20.755 108 HG3 PRO 16 HG2 PRO 16 17.229 -8.644 -21.423 109 HD2 PRO 16 HD1 PRO 16 19.922 -8.942 -21.579 110 HD3 PRO 16 HD2 PRO 16 19.144 -7.362 -21.392 111 H ARG 17 H ARG 17 19.617 -8.813 -16.151 112 HA ARG 17 HA ARG 17 19.325 -11.718 -16.160 113 HB2 ARG 17 HB2 ARG 17 21.567 -12.036 -15.182 114 HB3 ARG 17 HB1 ARG 17 21.635 -11.387 -16.826 115 HG2 ARG 17 HG1 ARG 17 23.131 -9.970 -15.924 116 HG3 ARG 17 HG2 ARG 17 21.674 -9.091 -15.433 117 HD2 ARG 17 HD1 ARG 17 23.171 -9.304 -13.537 118 HD3 ARG 17 HD2 ARG 17 21.710 -10.267 -13.270 119 HE ARG 17 HE ARG 17 23.720 -11.873 -14.436 120 HH11 ARG 17 1HH1 ARG 17 22.868 -10.320 -11.439 121 HH12 ARG 17 2HH1 ARG 17 23.712 -11.467 -10.453 122 HH21 ARG 17 1HH2 ARG 17 24.835 -13.390 -13.149 123 HH22 ARG 17 2HH2 ARG 17 24.832 -13.213 -11.427 124 H GLY 18 H GLY 18 19.726 -12.616 -13.907 125 HA2 GLY 18 HA2 GLY 18 19.907 -11.410 -11.540 126 HA3 GLY 18 3HA GLY 18 18.294 -10.913 -12.026 127 H SER 19 H SER 19 20.135 -13.964 -12.192 128 HA SER 19 HA SER 19 18.232 -15.249 -10.424 129 HB2 SER 19 HB2 SER 19 17.073 -15.473 -12.551 130 HB3 SER 19 HB1 SER 19 18.541 -16.113 -13.309 131 HG SER 19 HG SER 19 17.523 -17.924 -12.779 132 H HIS 20 H HIS 20 18.892 -17.421 -9.817 133 HA HIS 20 HA HIS 20 21.599 -18.214 -10.543 134 HB2 HIS 20 HB2 HIS 20 20.777 -17.196 -7.858 135 HB3 HIS 20 HB1 HIS 20 21.915 -18.545 -7.921 136 HD1 HIS 20 HD1 HIS 20 21.914 -14.997 -7.804 137 HD2 HIS 20 HD2 HIS 20 24.208 -17.842 -9.782 138 HE1 HIS 20 HE1 HIS 20 24.042 -13.820 -8.443 139 HE2 HIS 20 HE2 HIS 20 25.444 -15.558 -9.652 140 H MET 21 H MET 21 22.080 -20.391 -10.075 141 HA MET 21 HA MET 21 19.699 -22.019 -9.492 142 HB2 MET 21 HB2 MET 21 22.175 -22.587 -11.128 143 HB3 MET 21 HB1 MET 21 21.022 -23.847 -10.663 144 HG2 MET 21 HG1 MET 21 19.226 -22.448 -11.782 145 HG3 MET 21 HG2 MET 21 20.545 -21.478 -12.443 146 HE1 MET 21 HE1 MET 21 18.431 -22.558 -13.987 147 HE2 MET 21 HE2 MET 21 19.030 -23.547 -15.319 148 HE3 MET 21 HE3 MET 21 18.248 -24.311 -13.935 149 H ILE 22 H ILE 22 21.088 -20.954 -7.338 150 HA ILE 22 HA ILE 22 23.057 -22.730 -6.315 151 HB ILE 22 HB ILE 22 22.783 -20.372 -5.560 152 HG12 ILE 22 HG11 ILE 22 22.543 -22.397 -3.321 153 HG13 ILE 22 HG12 ILE 22 24.025 -22.099 -4.246 154 HG21 ILE 22 HG21 ILE 22 20.158 -20.947 -5.302 155 HG22 ILE 22 HG22 ILE 22 20.687 -21.101 -3.627 156 HG23 ILE 22 HG23 ILE 22 20.954 -19.592 -4.500 157 HD11 ILE 22 HD11 ILE 22 22.731 -20.434 -2.167 158 HD12 ILE 22 HD12 ILE 22 24.439 -20.770 -2.456 159 HD13 ILE 22 HD13 ILE 22 23.583 -19.611 -3.474 160 H SER 23 H SER 23 22.890 -24.437 -4.929 161 HA SER 23 HA SER 23 20.682 -26.092 -5.012 162 HB2 SER 23 HB2 SER 23 22.537 -26.079 -2.632 163 HB3 SER 23 HB1 SER 23 21.776 -27.460 -3.442 164 HG SER 23 HG SER 23 23.130 -27.059 -5.241 165 H LEU 24 H LEU 24 21.622 -23.847 -2.419 166 HA LEU 24 HA LEU 24 20.454 -22.921 -0.703 167 HB2 LEU 24 HB2 LEU 24 19.105 -22.213 -2.762 168 HB3 LEU 24 HB1 LEU 24 17.961 -23.479 -2.282 169 HG LEU 24 HG LEU 24 17.879 -22.241 -0.016 170 HD11 LEU 24 HD11 LEU 24 18.451 -19.957 0.011 171 HD12 LEU 24 HD12 LEU 24 18.750 -19.929 -1.726 172 HD13 LEU 24 HD13 LEU 24 19.855 -20.791 -0.656 173 HD21 LEU 24 HD21 LEU 24 16.161 -20.689 -0.906 174 HD22 LEU 24 HD22 LEU 24 15.990 -22.342 -1.499 175 HD23 LEU 24 HD23 LEU 24 16.687 -21.098 -2.539 176 H SER 25 H SER 25 21.100 -25.491 -0.212 177 HA SER 25 HA SER 25 19.117 -27.333 0.331 178 HB2 SER 25 HB2 SER 25 21.625 -27.655 0.538 179 HB3 SER 25 HB1 SER 25 21.508 -26.868 2.122 180 HG SER 25 HG SER 25 19.756 -28.975 1.609 181 H GLY 26 H GLY 26 17.318 -27.119 1.477 182 HA2 GLY 26 HA2 GLY 26 17.470 -25.786 4.093 183 HA3 GLY 26 3HA GLY 26 16.240 -25.275 2.947 184 H LEU 27 H LEU 27 15.702 -26.288 5.529 185 HA LEU 27 HA LEU 27 14.909 -29.044 5.301 186 HB2 LEU 27 HB2 LEU 27 15.514 -28.395 7.467 187 HB3 LEU 27 HB1 LEU 27 14.551 -26.910 7.374 188 HG LEU 27 HG LEU 27 12.494 -28.229 7.531 189 HD11 LEU 27 HD11 LEU 27 13.507 -30.277 6.465 190 HD12 LEU 27 HD12 LEU 27 12.483 -30.568 7.870 191 HD13 LEU 27 HD13 LEU 27 14.237 -30.628 8.033 192 HD21 LEU 27 HD21 LEU 27 14.406 -28.987 9.732 193 HD22 LEU 27 HD22 LEU 27 12.658 -28.780 9.845 194 HD23 LEU 27 HD23 LEU 27 13.696 -27.382 9.556 195 H THR 28 H THR 28 13.560 -26.045 4.435 196 HA THR 28 HA THR 28 11.026 -27.364 3.787 197 HB THR 28 HB THR 28 10.171 -26.304 5.628 198 HG1 THR 28 HG1 THR 28 9.431 -24.103 4.845 199 HG21 THR 28 HG21 THR 28 10.963 -24.111 6.472 200 HG22 THR 28 HG22 THR 28 12.161 -24.075 5.179 201 HG23 THR 28 HG23 THR 28 12.240 -25.326 6.420 202 H SER 29 H SER 29 9.797 -26.267 2.131 203 HA SER 29 HA SER 29 11.255 -25.509 -0.078 204 HB2 SER 29 HB2 SER 29 9.116 -26.036 -0.695 205 HB3 SER 29 HB1 SER 29 8.406 -25.252 0.727 206 HG SER 29 HG SER 29 7.886 -23.881 -0.854 207 H SER 30 H SER 30 11.493 -23.473 -1.172 208 HA SER 30 HA SER 30 11.309 -21.091 0.528 209 HB2 SER 30 HB2 SER 30 13.649 -22.198 0.568 210 HB3 SER 30 HB1 SER 30 13.794 -21.603 -1.095 211 HG SER 30 HG SER 30 14.629 -20.083 0.362 212 H VAL 31 H VAL 31 9.689 -20.212 -0.703 213 HA VAL 31 HA VAL 31 10.479 -19.343 -3.395 214 HB VAL 31 HB VAL 31 8.213 -19.712 -4.240 215 HG11 VAL 31 HG11 VAL 31 8.262 -22.315 -3.975 216 HG12 VAL 31 HG12 VAL 31 9.552 -21.483 -4.846 217 HG13 VAL 31 HG13 VAL 31 9.805 -22.003 -3.179 218 HG21 VAL 31 HG21 VAL 31 7.672 -21.123 -1.630 219 HG22 VAL 31 HG22 VAL 31 7.064 -19.522 -2.050 220 HG23 VAL 31 HG23 VAL 31 6.557 -20.930 -2.982 221 H GLU 32 H GLU 32 10.538 -17.945 -0.871 222 HA GLU 32 HA GLU 32 8.272 -16.204 -0.717 223 HB2 GLU 32 HB2 GLU 32 9.615 -14.939 0.909 224 HB3 GLU 32 HB1 GLU 32 9.606 -16.673 1.265 225 HG2 GLU 32 HG1 GLU 32 11.822 -16.877 0.171 226 HG3 GLU 32 HG2 GLU 32 11.830 -15.120 -0.036 227 HE2 GLU 32 HE2 GLU 32 13.566 -15.439 3.000 228 H SER 33 H SER 33 11.244 -16.235 -2.481 229 HA SER 33 HA SER 33 10.707 -13.498 -3.434 230 HB2 SER 33 HB2 SER 33 13.182 -13.576 -4.137 231 HB3 SER 33 HB1 SER 33 12.830 -13.424 -2.407 232 HG SER 33 HG SER 33 14.396 -15.153 -3.339 233 H ASP 34 H ASP 34 11.149 -16.813 -4.287 234 HA ASP 34 HA ASP 34 11.793 -16.637 -6.987 235 HB2 ASP 34 HB2 ASP 34 11.803 -18.764 -5.833 236 HB3 ASP 34 HB1 ASP 34 10.061 -18.655 -5.549 237 HD2 ASP 34 HD2 ASP 34 9.515 -20.312 -8.478 238 H LEU 35 H LEU 35 8.822 -15.942 -5.348 239 HA LEU 35 HA LEU 35 7.202 -16.013 -7.735 240 HB2 LEU 35 HB2 LEU 35 6.787 -15.534 -4.853 241 HB3 LEU 35 HB1 LEU 35 5.706 -14.646 -5.939 242 HG LEU 35 HG LEU 35 5.525 -17.168 -6.952 243 HD11 LEU 35 HD11 LEU 35 6.845 -18.183 -5.225 244 HD12 LEU 35 HD12 LEU 35 5.159 -18.642 -4.991 245 HD13 LEU 35 HD13 LEU 35 5.884 -17.401 -3.970 246 HD21 LEU 35 HD21 LEU 35 3.917 -15.583 -5.005 247 HD22 LEU 35 HD22 LEU 35 3.428 -17.236 -5.384 248 HD23 LEU 35 HD23 LEU 35 3.549 -16.034 -6.671 249 H ASP 36 H ASP 36 9.107 -13.697 -6.015 250 HA ASP 36 HA ASP 36 7.963 -11.288 -6.729 251 HB2 ASP 36 HB2 ASP 36 9.932 -11.565 -5.230 252 HB3 ASP 36 HB1 ASP 36 10.928 -11.886 -6.657 253 HD2 ASP 36 HD2 ASP 36 11.475 -8.532 -6.956 254 H MET 37 H MET 37 10.077 -13.383 -8.634 255 HA MET 37 HA MET 37 10.317 -11.591 -10.833 256 HB2 MET 37 HB2 MET 37 11.708 -13.744 -10.112 257 HB3 MET 37 HB1 MET 37 10.589 -14.530 -11.236 258 HG2 MET 37 HG1 MET 37 11.954 -12.058 -12.164 259 HG3 MET 37 HG2 MET 37 12.917 -13.531 -12.010 260 HE1 MET 37 HE1 MET 37 13.387 -12.760 -14.278 261 HE2 MET 37 HE2 MET 37 13.158 -14.315 -15.078 262 HE3 MET 37 HE3 MET 37 12.335 -12.881 -15.690 263 H GLN 38 H GLN 38 7.988 -13.994 -9.888 264 HA GLN 38 HA GLN 38 6.757 -14.256 -12.456 265 HB2 GLN 38 HB2 GLN 38 6.523 -16.072 -10.920 266 HB3 GLN 38 HB1 GLN 38 5.857 -15.003 -9.674 267 HG2 GLN 38 HG1 GLN 38 3.784 -14.921 -10.627 268 HG3 GLN 38 HG2 GLN 38 4.410 -15.206 -12.257 269 HE21 GLN 38 HE21 GLN 38 4.065 -16.820 -9.122 270 HE22 GLN 38 HE22 GLN 38 3.731 -18.385 -9.770 271 H GLN 39 H GLN 39 5.993 -12.453 -9.498 272 HA GLN 39 HA GLN 39 3.599 -11.304 -10.470 273 HB2 GLN 39 HB2 GLN 39 3.891 -9.678 -8.598 274 HB3 GLN 39 HB1 GLN 39 3.993 -11.374 -8.103 275 HG2 GLN 39 HG1 GLN 39 6.386 -11.265 -7.952 276 HG3 GLN 39 HG2 GLN 39 6.387 -9.632 -8.633 277 HE21 GLN 39 HE21 GLN 39 5.657 -11.565 -5.833 278 HE22 GLN 39 HE22 GLN 39 5.554 -10.258 -4.707 279 H ALA 40 H ALA 40 6.965 -10.403 -10.721 280 HA ALA 40 HA ALA 40 6.642 -7.723 -11.508 281 HB1 ALA 40 HB1 ALA 40 8.826 -8.035 -11.068 282 HB2 ALA 40 HB2 ALA 40 8.915 -8.431 -12.786 283 HB3 ALA 40 HB3 ALA 40 8.799 -9.720 -11.588 284 H MET 41 H MET 41 6.142 -10.694 -13.195 285 HA MET 41 HA MET 41 6.286 -9.525 -15.829 286 HB2 MET 41 HB2 MET 41 5.304 -12.225 -14.875 287 HB3 MET 41 HB1 MET 41 5.440 -11.748 -16.574 288 HG2 MET 41 HG1 MET 41 7.859 -11.503 -14.854 289 HG3 MET 41 HG2 MET 41 7.336 -13.113 -15.355 290 HE1 MET 41 HE1 MET 41 7.682 -13.457 -18.895 291 HE2 MET 41 HE2 MET 41 9.007 -13.928 -17.831 292 HE3 MET 41 HE3 MET 41 7.337 -14.082 -17.281 293 H LEU 42 H LEU 42 3.758 -10.559 -13.585 294 HA LEU 42 HA LEU 42 1.597 -10.005 -15.357 295 HB2 LEU 42 HB2 LEU 42 1.815 -10.491 -12.398 296 HB3 LEU 42 HB1 LEU 42 0.277 -10.036 -13.151 297 HG LEU 42 HG LEU 42 0.638 -12.077 -14.669 298 HD11 LEU 42 HD11 LEU 42 2.582 -12.702 -12.453 299 HD12 LEU 42 HD12 LEU 42 2.957 -12.505 -14.165 300 HD13 LEU 42 HD13 LEU 42 1.976 -13.870 -13.628 301 HD21 LEU 42 HD21 LEU 42 0.209 -12.756 -11.780 302 HD22 LEU 42 HD22 LEU 42 -0.583 -13.426 -13.206 303 HD23 LEU 42 HD23 LEU 42 -0.954 -11.783 -12.680 304 H THR 43 H THR 43 3.506 -8.103 -13.191 305 HA THR 43 HA THR 43 1.617 -5.866 -13.352 306 HB THR 43 HB THR 43 2.514 -6.449 -11.114 307 HG1 THR 43 HG1 THR 43 3.469 -4.161 -10.842 308 HG21 THR 43 HG21 THR 43 5.154 -5.278 -11.810 309 HG22 THR 43 HG22 THR 43 4.857 -6.953 -12.275 310 HG23 THR 43 HG23 THR 43 4.734 -6.472 -10.583 311 H ASN 44 H ASN 44 3.053 -6.645 -15.693 312 HA ASN 44 HA ASN 44 5.385 -5.250 -16.217 313 HB2 ASN 44 HB2 ASN 44 4.053 -6.926 -17.687 314 HB3 ASN 44 HB1 ASN 44 3.216 -5.489 -18.284 315 HD21 ASN 44 HD21 ASN 44 6.586 -6.293 -17.503 316 HD22 ASN 44 HD22 ASN 44 7.241 -5.739 -19.002 317 H LYS 45 H LYS 45 5.821 -3.163 -16.040 318 HA LYS 45 HA LYS 45 3.749 -1.183 -15.916 319 HB2 LYS 45 HB2 LYS 45 6.736 -1.175 -15.691 320 HB3 LYS 45 HB1 LYS 45 5.880 0.356 -15.935 321 HG2 LYS 45 HG1 LYS 45 6.001 0.299 -13.651 322 HG3 LYS 45 HG2 LYS 45 4.429 -0.474 -13.925 323 HD2 LYS 45 HD1 LYS 45 5.329 -1.997 -12.479 324 HD3 LYS 45 HD2 LYS 45 5.926 -2.660 -14.010 325 HE2 LYS 45 HE1 LYS 45 8.047 -1.409 -13.698 326 HE3 LYS 45 HE2 LYS 45 7.444 -0.853 -12.131 327 HZ1 LYS 45 3HZ LYS 45 7.195 -3.648 -12.252 328 HZ2 LYS 45 1HZ LYS 45 8.155 -2.719 -11.213 329 HZ3 LYS 45 2HZ LYS 45 8.772 -3.233 -12.701 330 H ASP 46 H ASP 46 3.232 0.388 -17.388 331 HA ASP 46 HA ASP 46 4.666 0.445 -19.937 332 HB2 ASP 46 HB2 ASP 46 1.662 0.104 -19.712 333 HB3 ASP 46 HB1 ASP 46 2.568 0.333 -21.213 334 HD2 ASP 46 HD2 ASP 46 3.831 -2.948 -21.075 335 H GLU 47 H GLU 47 3.823 2.283 -21.340 336 HA GLU 47 HA GLU 47 4.007 4.692 -19.887 337 HB2 GLU 47 HB2 GLU 47 2.915 4.436 -22.689 338 HB3 GLU 47 HB1 GLU 47 3.775 5.808 -21.973 339 HG2 GLU 47 HG1 GLU 47 5.790 4.300 -21.769 340 HG3 GLU 47 HG2 GLU 47 4.904 3.144 -22.775 341 HE2 GLU 47 HE2 GLU 47 6.667 6.158 -24.516 342 H LYS 48 H LYS 48 1.257 3.269 -21.652 343 HA LYS 48 HA LYS 48 -0.653 5.181 -21.029 344 HB2 LYS 48 HB2 LYS 48 -2.325 3.341 -21.353 345 HB3 LYS 48 HB1 LYS 48 -1.145 3.503 -22.663 346 HG2 LYS 48 HG1 LYS 48 -0.392 1.616 -20.529 347 HG3 LYS 48 HG2 LYS 48 -1.808 1.163 -21.495 348 HD2 LYS 48 HD1 LYS 48 0.160 2.125 -23.298 349 HD3 LYS 48 HD2 LYS 48 0.958 0.998 -22.187 350 HE2 LYS 48 HE1 LYS 48 -1.173 -0.486 -22.672 351 HE3 LYS 48 HE2 LYS 48 -1.242 0.504 -24.136 352 HZ1 LYS 48 3HZ LYS 48 1.155 -0.131 -24.481 353 HZ2 LYS 48 1HZ LYS 48 0.029 -1.379 -24.676 354 HZ3 LYS 48 2HZ LYS 48 0.949 -1.284 -23.260 355 H VAL 49 H VAL 49 0.584 2.533 -19.101 356 HA VAL 49 HA VAL 49 -1.394 2.451 -17.116 357 HB VAL 49 HB VAL 49 1.561 1.880 -16.851 358 HG11 VAL 49 HG11 VAL 49 -0.575 1.907 -14.909 359 HG12 VAL 49 HG12 VAL 49 0.134 0.298 -15.061 360 HG13 VAL 49 HG13 VAL 49 1.158 1.681 -14.672 361 HG21 VAL 49 HG21 VAL 49 -0.207 0.593 -18.453 362 HG22 VAL 49 HG22 VAL 49 1.206 -0.166 -17.720 363 HG23 VAL 49 HG23 VAL 49 -0.376 -0.326 -16.958 364 H LEU 50 H LEU 50 1.279 4.635 -17.636 365 HA LEU 50 HA LEU 50 1.340 5.777 -15.042 366 HB2 LEU 50 HB2 LEU 50 2.130 7.078 -17.651 367 HB3 LEU 50 HB1 LEU 50 2.666 7.527 -16.024 368 HG LEU 50 HG LEU 50 3.324 4.898 -17.345 369 HD11 LEU 50 HD11 LEU 50 4.695 6.106 -18.631 370 HD12 LEU 50 HD12 LEU 50 5.658 6.305 -17.168 371 HD13 LEU 50 HD13 LEU 50 4.504 7.553 -17.641 372 HD21 LEU 50 HD21 LEU 50 3.398 4.796 -14.933 373 HD22 LEU 50 HD22 LEU 50 4.367 6.268 -14.868 374 HD23 LEU 50 HD23 LEU 50 5.041 4.797 -15.572 375 H LYS 51 H LYS 51 -0.757 6.165 -17.740 376 HA LYS 51 HA LYS 51 -1.715 8.778 -17.133 377 HB2 LYS 51 HB2 LYS 51 -2.988 6.525 -18.706 378 HB3 LYS 51 HB1 LYS 51 -3.577 8.195 -18.665 379 HG2 LYS 51 HG1 LYS 51 -0.752 7.686 -19.482 380 HG3 LYS 51 HG2 LYS 51 -2.064 7.353 -20.626 381 HD2 LYS 51 HD1 LYS 51 -2.798 9.600 -20.619 382 HD3 LYS 51 HD2 LYS 51 -1.833 9.981 -19.181 383 HE2 LYS 51 HE1 LYS 51 0.230 9.475 -20.557 384 HE3 LYS 51 HE2 LYS 51 -0.839 9.410 -21.966 385 HZ1 LYS 51 3HZ LYS 51 -0.088 11.723 -20.320 386 HZ2 LYS 51 1HZ LYS 51 -1.584 11.731 -21.110 387 HZ3 LYS 51 2HZ LYS 51 -0.156 11.580 -22.004 388 H ALA 52 H ALA 52 -2.727 5.515 -16.257 389 HA ALA 52 HA ALA 52 -5.169 6.207 -15.029 390 HB1 ALA 52 HB1 ALA 52 -5.266 3.986 -15.124 391 HB2 ALA 52 HB2 ALA 52 -4.247 3.961 -13.685 392 HB3 ALA 52 HB3 ALA 52 -3.515 3.847 -15.286 393 H LEU 53 H LEU 53 -1.887 5.848 -13.734 394 HA LEU 53 HA LEU 53 -2.464 6.188 -11.031 395 HB2 LEU 53 HB2 LEU 53 -0.006 7.129 -12.519 396 HB3 LEU 53 HB1 LEU 53 -0.138 6.856 -10.773 397 HG LEU 53 HG LEU 53 -0.456 4.670 -12.824 398 HD11 LEU 53 HD11 LEU 53 1.955 4.480 -11.305 399 HD12 LEU 53 HD12 LEU 53 1.902 6.040 -12.126 400 HD13 LEU 53 HD13 LEU 53 1.744 4.550 -13.056 401 HD21 LEU 53 HD21 LEU 53 0.337 3.474 -10.561 402 HD22 LEU 53 HD22 LEU 53 -1.358 3.735 -10.973 403 HD23 LEU 53 HD23 LEU 53 -0.535 4.844 -9.875 404 H GLU 54 H GLU 54 -2.483 8.467 -13.613 405 HA GLU 54 HA GLU 54 -2.066 10.839 -12.137 406 HB2 GLU 54 HB2 GLU 54 -3.715 10.499 -14.653 407 HB3 GLU 54 HB1 GLU 54 -2.984 11.997 -14.055 408 HG2 GLU 54 HG1 GLU 54 -0.744 10.705 -14.255 409 HG3 GLU 54 HG2 GLU 54 -1.669 9.632 -15.315 410 HE2 GLU 54 HE2 GLU 54 -0.343 12.924 -16.824 411 H ARG 55 H ARG 55 -4.987 9.030 -12.985 412 HA ARG 55 HA ARG 55 -6.750 10.921 -11.738 413 HB2 ARG 55 HB2 ARG 55 -7.661 9.685 -13.545 414 HB3 ARG 55 HB1 ARG 55 -7.134 8.145 -12.847 415 HG2 ARG 55 HG1 ARG 55 -9.548 8.451 -12.630 416 HG3 ARG 55 HG2 ARG 55 -8.749 8.373 -11.050 417 HD2 ARG 55 HD1 ARG 55 -9.410 10.437 -10.491 418 HD3 ARG 55 HD2 ARG 55 -8.908 11.089 -12.057 419 HE ARG 55 HE ARG 55 -11.289 9.625 -12.382 420 HH11 ARG 55 1HH1 ARG 55 -10.111 12.588 -10.984 421 HH12 ARG 55 2HH1 ARG 55 -11.617 13.426 -11.170 422 HH21 ARG 55 1HH2 ARG 55 -13.276 10.718 -12.631 423 HH22 ARG 55 2HH2 ARG 55 -13.416 12.361 -12.107 424 H THR 56 H THR 56 -5.137 7.961 -10.803 425 HA THR 56 HA THR 56 -6.641 7.548 -8.408 426 HB THR 56 HB THR 56 -5.109 5.812 -7.881 427 HG1 THR 56 HG1 THR 56 -3.131 6.800 -8.154 428 HG21 THR 56 HG21 THR 56 -4.716 5.362 -10.710 429 HG22 THR 56 HG22 THR 56 -6.338 5.971 -10.381 430 HG23 THR 56 HG23 THR 56 -5.764 4.513 -9.575 431 H ARG 57 H ARG 57 -3.434 8.910 -9.111 432 HA ARG 57 HA ARG 57 -2.604 9.423 -6.515 433 HB2 ARG 57 HB2 ARG 57 -1.059 11.007 -7.432 434 HB3 ARG 57 HB1 ARG 57 -1.217 9.669 -8.581 435 HG2 ARG 57 HG1 ARG 57 -2.489 10.941 -10.087 436 HG3 ARG 57 HG2 ARG 57 -2.816 12.188 -8.871 437 HD2 ARG 57 HD1 ARG 57 -1.141 12.917 -10.535 438 HD3 ARG 57 HD2 ARG 57 -0.500 12.876 -8.886 439 HE ARG 57 HE ARG 57 0.013 10.434 -10.246 440 HH11 ARG 57 1HH1 ARG 57 1.070 13.739 -9.978 441 HH12 ARG 57 2HH1 ARG 57 2.695 13.397 -10.473 442 HH21 ARG 57 1HH2 ARG 57 2.148 9.970 -10.900 443 HH22 ARG 57 2HH2 ARG 57 3.307 11.252 -10.999 444 H GLN 58 H GLN 58 -4.973 11.053 -8.453 445 HA GLN 58 HA GLN 58 -5.045 13.523 -7.106 446 HB2 GLN 58 HB2 GLN 58 -7.067 11.989 -8.728 447 HB3 GLN 58 HB1 GLN 58 -7.472 13.540 -7.976 448 HG2 GLN 58 HG1 GLN 58 -5.158 13.153 -9.870 449 HG3 GLN 58 HG2 GLN 58 -6.774 13.673 -10.369 450 HE21 GLN 58 HE21 GLN 58 -3.941 14.536 -8.513 451 HE22 GLN 58 HE22 GLN 58 -4.258 16.234 -8.453 452 H LEU 59 H LEU 59 -6.709 10.462 -6.525 453 HA LEU 59 HA LEU 59 -8.065 11.576 -4.197 454 HB2 LEU 59 HB2 LEU 59 -8.178 8.726 -5.173 455 HB3 LEU 59 HB1 LEU 59 -9.330 9.578 -4.130 456 HG LEU 59 HG LEU 59 -9.138 10.906 -6.674 457 HD11 LEU 59 HD11 LEU 59 -8.475 8.806 -7.617 458 HD12 LEU 59 HD12 LEU 59 -10.167 9.090 -8.022 459 HD13 LEU 59 HD13 LEU 59 -9.746 7.955 -6.738 460 HD21 LEU 59 HD21 LEU 59 -10.970 10.862 -4.868 461 HD22 LEU 59 HD22 LEU 59 -11.482 9.354 -5.628 462 HD23 LEU 59 HD23 LEU 59 -11.464 10.851 -6.562 463 H ASP 60 H ASP 60 -5.071 10.905 -4.521 464 HA ASP 60 HA ASP 60 -3.385 10.250 -3.140 465 HB2 ASP 60 HB2 ASP 60 -5.402 9.689 -0.974 466 HB3 ASP 60 HB1 ASP 60 -3.737 10.262 -0.817 467 HD2 ASP 60 HD2 ASP 60 -4.940 13.489 -2.040 468 H ILE 61 H ILE 61 -3.345 8.384 -4.633 469 HA ILE 61 HA ILE 61 -3.769 5.895 -3.131 470 HB ILE 61 HB ILE 61 -4.296 6.068 -6.091 471 HG12 ILE 61 HG11 ILE 61 -6.335 6.111 -3.851 472 HG13 ILE 61 HG12 ILE 61 -5.896 7.510 -4.846 473 HG21 ILE 61 HG21 ILE 61 -5.100 3.895 -5.925 474 HG22 ILE 61 HG22 ILE 61 -3.710 3.888 -4.841 475 HG23 ILE 61 HG23 ILE 61 -5.341 4.011 -4.182 476 HD11 ILE 61 HD11 ILE 61 -6.587 5.418 -6.612 477 HD12 ILE 61 HD12 ILE 61 -7.837 5.513 -5.372 478 HD13 ILE 61 HD13 ILE 61 -7.430 6.940 -6.324 479 HA PRO 62 HA PRO 62 0.529 5.542 -4.288 480 HB2 PRO 62 HB2 PRO 62 0.978 3.203 -2.934 481 HB3 PRO 62 HB1 PRO 62 0.886 4.779 -2.151 482 HG2 PRO 62 HG1 PRO 62 -1.233 2.677 -2.447 483 HG3 PRO 62 HG2 PRO 62 -0.775 3.637 -0.991 484 HD2 PRO 62 HD1 PRO 62 -2.944 4.227 -2.513 485 HD3 PRO 62 HD2 PRO 62 -1.977 5.471 -1.703 486 H ASP 63 H ASP 63 1.477 4.613 -6.006 487 HA ASP 63 HA ASP 63 0.068 3.029 -7.818 488 HB2 ASP 63 HB2 ASP 63 2.462 2.533 -8.725 489 HB3 ASP 63 HB1 ASP 63 1.847 4.191 -8.764 490 HD2 ASP 63 HD2 ASP 63 4.988 3.406 -6.557 491 H GLU 64 H GLU 64 1.751 2.151 -4.968 492 HA GLU 64 HA GLU 64 2.516 -0.478 -5.579 493 HB2 GLU 64 HB2 GLU 64 1.557 0.460 -2.873 494 HB3 GLU 64 HB1 GLU 64 2.724 -0.824 -3.231 495 HG2 GLU 64 HG1 GLU 64 4.249 0.918 -4.177 496 HG3 GLU 64 HG2 GLU 64 3.116 2.137 -3.576 497 HE2 GLU 64 HE2 GLU 64 4.972 2.068 -0.686 498 H LYS 65 H LYS 65 -0.563 0.906 -4.684 499 HA LYS 65 HA LYS 65 -1.769 -1.772 -4.603 500 HB2 LYS 65 HB2 LYS 65 -3.490 -0.925 -3.301 501 HB3 LYS 65 HB1 LYS 65 -2.096 0.014 -2.741 502 HG2 LYS 65 HG1 LYS 65 -2.818 1.778 -4.459 503 HG3 LYS 65 HG2 LYS 65 -4.352 0.891 -4.506 504 HD2 LYS 65 HD1 LYS 65 -3.084 1.973 -1.982 505 HD3 LYS 65 HD2 LYS 65 -4.348 2.799 -2.909 506 HE2 LYS 65 HE1 LYS 65 -5.975 1.222 -2.368 507 HE3 LYS 65 HE2 LYS 65 -4.769 -0.014 -1.980 508 HZ1 LYS 65 3HZ LYS 65 -4.189 1.845 -0.158 509 HZ2 LYS 65 1HZ LYS 65 -5.265 0.569 0.116 510 HZ3 LYS 65 2HZ LYS 65 -5.855 2.095 -0.314 511 H THR 66 H THR 66 -1.716 1.233 -6.353 512 HA THR 66 HA THR 66 -4.086 0.760 -7.881 513 HB THR 66 HB THR 66 -1.761 2.597 -8.494 514 HG1 THR 66 HG1 THR 66 -2.711 3.221 -6.565 515 HG21 THR 66 HG21 THR 66 -3.267 3.753 -9.974 516 HG22 THR 66 HG22 THR 66 -4.601 2.693 -9.516 517 HG23 THR 66 HG23 THR 66 -3.236 2.049 -10.429 518 H MET 67 H MET 67 -0.709 -0.062 -8.220 519 HA MET 67 HA MET 67 -0.479 -0.591 -10.908 520 HB2 MET 67 HB2 MET 67 0.801 -1.582 -8.446 521 HB3 MET 67 HB1 MET 67 0.919 -2.676 -9.834 522 HG2 MET 67 HG1 MET 67 1.609 0.216 -10.170 523 HG3 MET 67 HG2 MET 67 2.759 -0.887 -9.410 524 HE1 MET 67 HE1 MET 67 0.575 -1.069 -13.132 525 HE2 MET 67 HE2 MET 67 0.975 0.393 -12.230 526 HE3 MET 67 HE3 MET 67 1.943 -0.073 -13.629 527 HA PRO 68 HA PRO 68 -2.216 -5.048 -10.247 528 HB2 PRO 68 HB2 PRO 68 -3.354 -5.620 -7.822 529 HB3 PRO 68 HB1 PRO 68 -1.642 -5.846 -8.171 530 HG2 PRO 68 HG1 PRO 68 -3.019 -3.557 -6.809 531 HG3 PRO 68 HG2 PRO 68 -1.512 -4.427 -6.334 532 HD2 PRO 68 HD1 PRO 68 -1.482 -2.010 -7.571 533 HD3 PRO 68 HD2 PRO 68 -0.236 -3.240 -7.843 534 H VAL 69 H VAL 69 -3.749 -2.177 -9.163 535 HA VAL 69 HA VAL 69 -6.451 -3.162 -9.390 536 HB VAL 69 HB VAL 69 -5.303 -0.406 -8.994 537 HG11 VAL 69 HG11 VAL 69 -7.997 -1.203 -9.855 538 HG12 VAL 69 HG12 VAL 69 -7.945 -0.092 -8.485 539 HG13 VAL 69 HG13 VAL 69 -7.168 0.345 -10.006 540 HG21 VAL 69 HG21 VAL 69 -5.722 -0.694 -6.801 541 HG22 VAL 69 HG22 VAL 69 -7.225 -1.568 -7.095 542 HG23 VAL 69 HG23 VAL 69 -5.678 -2.409 -7.210 543 H LEU 70 H LEU 70 -4.543 -0.736 -11.183 544 HA LEU 70 HA LEU 70 -6.366 -0.349 -13.260 545 HB2 LEU 70 HB2 LEU 70 -4.547 0.636 -14.501 546 HB3 LEU 70 HB1 LEU 70 -4.450 1.116 -12.798 547 HG LEU 70 HG LEU 70 -2.784 -0.992 -12.758 548 HD11 LEU 70 HD11 LEU 70 -3.257 -1.062 -15.344 549 HD12 LEU 70 HD12 LEU 70 -1.646 -1.374 -14.702 550 HD13 LEU 70 HD13 LEU 70 -2.035 0.208 -15.375 551 HD21 LEU 70 HD21 LEU 70 -2.167 1.857 -13.524 552 HD22 LEU 70 HD22 LEU 70 -0.948 0.677 -13.042 553 HD23 LEU 70 HD23 LEU 70 -2.204 1.164 -11.902 554 H MET 71 H MET 71 -3.675 -2.636 -12.969 555 HA MET 71 HA MET 71 -3.801 -3.708 -15.552 556 HB2 MET 71 HB2 MET 71 -2.409 -5.428 -14.788 557 HB3 MET 71 HB1 MET 71 -2.019 -4.058 -13.737 558 HG2 MET 71 HG1 MET 71 -3.268 -4.961 -11.926 559 HG3 MET 71 HG2 MET 71 -3.976 -6.200 -12.966 560 HE1 MET 71 HE1 MET 71 -3.404 -8.390 -12.793 561 HE2 MET 71 HE2 MET 71 -1.967 -9.093 -12.049 562 HE3 MET 71 HE3 MET 71 -3.117 -8.189 -11.064 563 H LYS 72 H LYS 72 -5.861 -4.127 -12.823 564 HA LYS 72 HA LYS 72 -6.992 -6.633 -13.590 565 HB2 LYS 72 HB2 LYS 72 -7.004 -5.560 -11.269 566 HB3 LYS 72 HB1 LYS 72 -8.332 -4.554 -11.869 567 HG2 LYS 72 HG1 LYS 72 -9.313 -6.362 -10.695 568 HG3 LYS 72 HG2 LYS 72 -9.562 -6.664 -12.424 569 HD2 LYS 72 HD1 LYS 72 -8.896 -8.730 -11.407 570 HD3 LYS 72 HD2 LYS 72 -7.546 -8.137 -12.391 571 HE2 LYS 72 HE1 LYS 72 -6.384 -7.327 -10.449 572 HE3 LYS 72 HE2 LYS 72 -7.786 -7.666 -9.424 573 HZ1 LYS 72 3HZ LYS 72 -7.113 -10.039 -10.717 574 HZ2 LYS 72 1HZ LYS 72 -6.970 -9.677 -9.070 575 HZ3 LYS 72 2HZ LYS 72 -5.674 -9.384 -10.116 576 H LEU 73 H LEU 73 -7.647 -3.291 -14.344 577 HA LEU 73 HA LEU 73 -10.239 -3.737 -15.463 578 HB2 LEU 73 HB2 LEU 73 -8.490 -1.432 -16.238 579 HB3 LEU 73 HB1 LEU 73 -10.247 -1.489 -16.012 580 HG LEU 73 HG LEU 73 -8.160 -1.485 -13.834 581 HD11 LEU 73 HD11 LEU 73 -8.387 0.690 -14.791 582 HD12 LEU 73 HD12 LEU 73 -9.257 0.679 -13.257 583 HD13 LEU 73 HD13 LEU 73 -10.147 0.572 -14.775 584 HD21 LEU 73 HD21 LEU 73 -9.928 -2.830 -13.039 585 HD22 LEU 73 HD22 LEU 73 -11.153 -1.774 -13.744 586 HD23 LEU 73 HD23 LEU 73 -10.203 -1.225 -12.361 587 H LEU 74 H LEU 74 -7.019 -3.169 -16.872 588 HA LEU 74 HA LEU 74 -7.789 -3.419 -19.558 589 HB2 LEU 74 HB2 LEU 74 -5.167 -3.838 -18.135 590 HB3 LEU 74 HB1 LEU 74 -5.334 -4.029 -19.889 591 HG LEU 74 HG LEU 74 -4.434 -1.862 -19.460 592 HD11 LEU 74 HD11 LEU 74 -6.878 -2.288 -20.797 593 HD12 LEU 74 HD12 LEU 74 -5.680 -1.027 -21.089 594 HD13 LEU 74 HD13 LEU 74 -7.007 -0.738 -19.966 595 HD21 LEU 74 HD21 LEU 74 -5.448 -0.239 -18.023 596 HD22 LEU 74 HD22 LEU 74 -5.230 -1.727 -17.101 597 HD23 LEU 74 HD23 LEU 74 -6.826 -1.297 -17.715 598 H GLU 75 H GLU 75 -7.262 -5.783 -17.098 599 HA GLU 75 HA GLU 75 -6.627 -8.029 -18.630 600 HB2 GLU 75 HB2 GLU 75 -7.660 -7.492 -15.941 601 HB3 GLU 75 HB1 GLU 75 -8.206 -9.036 -16.611 602 HG2 GLU 75 HG1 GLU 75 -5.527 -9.042 -17.217 603 HG3 GLU 75 HG2 GLU 75 -5.580 -8.245 -15.638 604 HE2 GLU 75 HE2 GLU 75 -6.031 -11.246 -14.073 605 H GLU 76 H GLU 76 -9.831 -6.924 -17.523 606 HA GLU 76 HA GLU 76 -11.202 -8.867 -19.131 607 HB2 GLU 76 HB2 GLU 76 -12.375 -6.419 -17.802 608 HB3 GLU 76 HB1 GLU 76 -13.227 -7.891 -18.294 609 HG2 GLU 76 HG1 GLU 76 -12.059 -9.184 -16.609 610 HG3 GLU 76 HG2 GLU 76 -11.124 -7.755 -16.146 611 HE2 GLU 76 HE2 GLU 76 -13.594 -6.718 -14.023 612 H ALA 77 H ALA 77 -10.242 -5.533 -19.470 613 HA ALA 77 HA ALA 77 -11.883 -5.093 -21.814 614 HB1 ALA 77 HB1 ALA 77 -10.651 -2.905 -21.896 615 HB2 ALA 77 HB2 ALA 77 -9.811 -3.405 -20.428 616 HB3 ALA 77 HB3 ALA 77 -11.563 -3.200 -20.416 617 H GLY 78 H GLY 78 -9.262 -6.918 -21.372 618 HA2 GLY 78 HA2 GLY 78 -7.585 -7.715 -22.724 619 HA3 GLY 78 3HA GLY 78 -8.617 -7.218 -24.057 620 H GLY 79 H GLY 79 -7.509 -4.829 -21.806 621 HA2 GLY 79 HA2 GLY 79 -5.686 -3.358 -21.943 622 HA3 GLY 79 3HA GLY 79 -5.242 -4.086 -23.479 623 H ASN 80 H ASN 80 -8.399 -2.791 -22.560 624 HA ASN 80 HA ASN 80 -8.087 -0.777 -24.689 625 HB2 ASN 80 HB2 ASN 80 -9.890 -2.780 -24.706 626 HB3 ASN 80 HB1 ASN 80 -10.813 -1.562 -23.818 627 HD21 ASN 80 HD21 ASN 80 -10.483 0.729 -24.877 628 HD22 ASN 80 HD22 ASN 80 -10.794 0.766 -26.576 629 H TRP 81 H TRP 81 -7.601 1.085 -23.697 630 HA TRP 81 HA TRP 81 -8.700 1.768 -21.120 631 HB2 TRP 81 HB2 TRP 81 -7.008 3.401 -23.035 632 HB3 TRP 81 HB1 TRP 81 -7.395 3.849 -21.374 633 HD1 TRP 81 HD1 TRP 81 -5.388 1.175 -23.301 634 HE1 TRP 81 HE1 TRP 81 -3.539 0.285 -21.749 635 HE3 TRP 81 HE3 TRP 81 -6.682 3.632 -19.008 636 HZ2 TRP 81 2HZ TRP 81 -2.735 0.585 -19.059 637 HZ3 TRP 81 3HZ TRP 81 -5.322 3.274 -16.990 638 HH2 TRP 81 HH TRP 81 -3.390 1.782 -17.016 639 H SER 82 H SER 82 -9.514 2.296 -24.417 640 HA SER 82 HA SER 82 -10.849 4.709 -24.387 641 HB2 SER 82 HB2 SER 82 -10.452 3.086 -26.348 642 HB3 SER 82 HB1 SER 82 -11.953 2.301 -25.826 643 HG SER 82 HG SER 82 -11.711 4.443 -27.341 644 H TYR 83 H TYR 83 -12.209 1.502 -23.645 645 HA TYR 83 HA TYR 83 -14.722 2.605 -22.807 646 HB2 TYR 83 HB2 TYR 83 -14.940 0.462 -23.688 647 HB3 TYR 83 HB1 TYR 83 -13.513 -0.139 -22.839 648 HD1 TYR 83 HD2 TYR 83 -13.627 -0.846 -20.514 649 HD2 TYR 83 HD1 TYR 83 -17.089 0.582 -22.535 650 HE1 TYR 83 HE2 TYR 83 -15.043 -1.764 -18.725 651 HE2 TYR 83 HE1 TYR 83 -18.514 -0.331 -20.749 652 HH TYR 83 HH TYR 83 -17.228 -1.484 -17.780 653 H ILE 84 H ILE 84 -11.875 1.266 -21.187 654 HA ILE 84 HA ILE 84 -12.836 1.299 -18.566 655 HB ILE 84 HB ILE 84 -10.018 1.691 -19.574 656 HG12 ILE 84 HG11 ILE 84 -11.390 -0.743 -18.404 657 HG13 ILE 84 HG12 ILE 84 -11.134 -0.467 -20.136 658 HG21 ILE 84 HG21 ILE 84 -11.124 1.459 -16.809 659 HG22 ILE 84 HG22 ILE 84 -9.523 0.817 -17.174 660 HG23 ILE 84 HG23 ILE 84 -9.866 2.529 -17.428 661 HD11 ILE 84 HD11 ILE 84 -9.343 -1.582 -18.203 662 HD12 ILE 84 HD12 ILE 84 -9.186 -1.491 -19.957 663 HD13 ILE 84 HD13 ILE 84 -8.622 -0.158 -18.950 664 H LYS 85 H LYS 85 -11.798 3.877 -20.625 665 HA LYS 85 HA LYS 85 -11.678 5.758 -18.383 666 HB2 LYS 85 HB2 LYS 85 -10.426 7.151 -19.696 667 HB3 LYS 85 HB1 LYS 85 -10.013 5.598 -20.439 668 HG2 LYS 85 HG1 LYS 85 -12.150 6.205 -21.928 669 HG3 LYS 85 HG2 LYS 85 -11.615 7.842 -21.502 670 HD2 LYS 85 HD1 LYS 85 -10.017 5.687 -22.895 671 HD3 LYS 85 HD2 LYS 85 -10.553 7.241 -23.557 672 HE2 LYS 85 HE1 LYS 85 -9.138 7.989 -21.304 673 HE3 LYS 85 HE2 LYS 85 -8.221 6.609 -21.924 674 HZ1 LYS 85 3HZ LYS 85 -8.423 7.812 -24.168 675 HZ2 LYS 85 1HZ LYS 85 -7.309 8.399 -23.038 676 HZ3 LYS 85 2HZ LYS 85 -8.795 9.180 -23.247 677 H LEU 86 H LEU 86 -14.057 4.456 -20.065 678 HA LEU 86 HA LEU 86 -15.506 6.595 -21.167 679 HB2 LEU 86 HB2 LEU 86 -15.948 4.167 -21.542 680 HB3 LEU 86 HB1 LEU 86 -16.623 4.096 -19.905 681 HG LEU 86 HG LEU 86 -18.095 6.109 -21.013 682 HD11 LEU 86 HD11 LEU 86 -18.824 4.761 -23.193 683 HD12 LEU 86 HD12 LEU 86 -17.110 4.350 -23.179 684 HD13 LEU 86 HD13 LEU 86 -17.611 6.040 -23.224 685 HD21 LEU 86 HD21 LEU 86 -18.834 4.127 -19.686 686 HD22 LEU 86 HD22 LEU 86 -18.784 3.179 -21.173 687 HD23 LEU 86 HD23 LEU 86 -19.897 4.540 -21.030 688 H ASP 87 H ASP 87 -14.842 5.782 -17.929 689 HA ASP 87 HA ASP 87 -16.759 7.817 -17.026 690 HB2 ASP 87 HB2 ASP 87 -16.192 5.233 -15.547 691 HB3 ASP 87 HB1 ASP 87 -17.324 6.504 -15.064 692 HD2 ASP 87 HD2 ASP 87 -18.556 3.775 -17.556 693 H ASN 88 H ASN 88 -13.858 7.832 -17.594 694 HA ASN 88 HA ASN 88 -11.988 8.792 -16.725 695 HB2 ASN 88 HB2 ASN 88 -14.022 10.119 -15.515 696 HB3 ASN 88 HB1 ASN 88 -13.198 9.442 -14.104 697 HD21 ASN 88 HD21 ASN 88 -10.625 9.561 -14.597 698 HD22 ASN 88 HD22 ASN 88 -10.097 11.176 -14.913 699 H TYR 89 H TYR 89 -12.318 6.038 -16.433 700 HA TYR 89 HA TYR 89 -11.403 4.242 -15.380 701 HB2 TYR 89 HB2 TYR 89 -9.832 6.333 -13.850 702 HB3 TYR 89 HB1 TYR 89 -9.440 4.616 -13.964 703 HD1 TYR 89 HD2 TYR 89 -10.220 4.423 -16.977 704 HD2 TYR 89 HD1 TYR 89 -7.705 7.050 -14.770 705 HE1 TYR 89 HE2 TYR 89 -8.883 4.834 -19.001 706 HE2 TYR 89 HE1 TYR 89 -6.362 7.469 -16.787 707 HH TYR 89 HH TYR 89 -5.868 6.506 -18.904 708 H THR 90 H THR 90 -13.851 5.175 -14.401 709 HA THR 90 HA THR 90 -14.093 5.601 -11.688 710 HB THR 90 HB THR 90 -15.894 4.084 -13.573 711 HG1 THR 90 HG1 THR 90 -15.670 6.720 -12.634 712 HG21 THR 90 HG21 THR 90 -16.537 3.170 -11.523 713 HG22 THR 90 HG22 THR 90 -17.624 4.547 -11.710 714 HG23 THR 90 HG23 THR 90 -16.221 4.668 -10.648 715 H ALA 91 H ALA 91 -13.456 2.608 -13.399 716 HA ALA 91 HA ALA 91 -14.025 0.716 -11.477 717 HB1 ALA 91 HB1 ALA 91 -11.622 0.652 -13.295 718 HB2 ALA 91 HB2 ALA 91 -13.266 0.257 -13.801 719 HB3 ALA 91 HB3 ALA 91 -12.459 -0.726 -12.579 720 H LEU 92 H LEU 92 -11.232 2.844 -11.716 721 HA LEU 92 HA LEU 92 -9.688 1.608 -9.691 722 HB2 LEU 92 HB2 LEU 92 -8.217 3.378 -9.901 723 HB3 LEU 92 HB1 LEU 92 -9.001 3.326 -11.490 724 HG LEU 92 HG LEU 92 -10.590 5.123 -10.342 725 HD11 LEU 92 HD11 LEU 92 -9.820 5.499 -8.250 726 HD12 LEU 92 HD12 LEU 92 -8.748 6.610 -9.103 727 HD13 LEU 92 HD13 LEU 92 -8.172 5.007 -8.646 728 HD21 LEU 92 HD21 LEU 92 -9.697 6.444 -11.897 729 HD22 LEU 92 HD22 LEU 92 -8.558 5.137 -12.222 730 HD23 LEU 92 HD23 LEU 92 -8.120 6.434 -11.108 731 H VAL 93 H VAL 93 -12.200 4.054 -9.655 732 HA VAL 93 HA VAL 93 -11.819 4.966 -7.010 733 HB VAL 93 HB VAL 93 -14.246 4.959 -8.796 734 HG11 VAL 93 HG11 VAL 93 -15.025 6.724 -7.045 735 HG12 VAL 93 HG12 VAL 93 -15.290 5.006 -6.738 736 HG13 VAL 93 HG13 VAL 93 -13.949 5.846 -5.959 737 HG21 VAL 93 HG21 VAL 93 -13.373 6.821 -9.634 738 HG22 VAL 93 HG22 VAL 93 -13.287 7.538 -8.026 739 HG23 VAL 93 HG23 VAL 93 -11.940 6.577 -8.637 740 H ASP 94 H ASP 94 -14.018 2.514 -8.355 741 HA ASP 94 HA ASP 94 -15.035 1.757 -5.791 742 HB2 ASP 94 HB2 ASP 94 -16.202 1.520 -8.063 743 HB3 ASP 94 HB1 ASP 94 -15.188 0.089 -8.297 744 HD2 ASP 94 HD2 ASP 94 -17.308 -1.813 -6.420 745 H ALA 95 H ALA 95 -12.410 0.721 -7.834 746 HA ALA 95 HA ALA 95 -11.938 -1.777 -6.547 747 HB1 ALA 95 HB1 ALA 95 -10.385 -0.058 -8.435 748 HB2 ALA 95 HB2 ALA 95 -11.031 -1.682 -8.670 749 HB3 ALA 95 HB3 ALA 95 -9.613 -1.436 -7.651 750 H ILE 96 H ILE 96 -10.172 1.323 -6.405 751 HA ILE 96 HA ILE 96 -8.437 0.587 -4.331 752 HB ILE 96 HB ILE 96 -9.427 3.334 -5.101 753 HG12 ILE 96 HG11 ILE 96 -8.254 2.111 -6.889 754 HG13 ILE 96 HG12 ILE 96 -7.321 3.508 -6.323 755 HG21 ILE 96 HG21 ILE 96 -8.576 3.380 -2.840 756 HG22 ILE 96 HG22 ILE 96 -7.118 2.524 -3.340 757 HG23 ILE 96 HG23 ILE 96 -7.422 4.160 -3.922 758 HD11 ILE 96 HD11 ILE 96 -6.828 0.632 -5.593 759 HD12 ILE 96 HD12 ILE 96 -5.850 1.635 -6.665 760 HD13 ILE 96 HD13 ILE 96 -5.942 2.012 -4.945 761 H TYR 97 H TYR 97 -11.676 1.947 -4.288 762 HA TYR 97 HA TYR 97 -11.799 2.698 -1.594 763 HB2 TYR 97 HB2 TYR 97 -13.751 2.096 -3.741 764 HB3 TYR 97 HB1 TYR 97 -14.361 1.974 -2.088 765 HD1 TYR 97 HD1 TYR 97 -11.821 4.358 -3.385 766 HD2 TYR 97 HD2 TYR 97 -15.774 3.835 -1.900 767 HE1 TYR 97 HE1 TYR 97 -12.102 6.800 -3.286 768 HE2 TYR 97 HE2 TYR 97 -16.066 6.274 -1.798 769 HH TYR 97 HH TYR 97 -14.206 8.341 -1.566 770 H SER 98 H SER 98 -12.230 -0.411 -3.160 771 HA SER 98 HA SER 98 -13.238 -1.731 -0.823 772 HB2 SER 98 HB2 SER 98 -12.454 -2.527 -3.585 773 HB3 SER 98 HB1 SER 98 -12.418 -3.788 -2.340 774 HG SER 98 HG SER 98 -14.560 -2.595 -3.531 775 H VAL 99 H VAL 99 -10.143 -1.909 -2.587 776 HA VAL 99 HA VAL 99 -8.810 -3.556 -0.763 777 HB VAL 99 HB VAL 99 -7.536 -1.423 -2.480 778 HG11 VAL 99 HG11 VAL 99 -5.637 -3.066 -2.488 779 HG12 VAL 99 HG12 VAL 99 -5.960 -2.304 -0.929 780 HG13 VAL 99 HG13 VAL 99 -6.494 -3.958 -1.231 781 HG21 VAL 99 HG21 VAL 99 -8.495 -2.543 -4.177 782 HG22 VAL 99 HG22 VAL 99 -7.248 -3.749 -3.860 783 HG23 VAL 99 HG23 VAL 99 -8.861 -3.948 -3.175 784 H GLU 100 H GLU 100 -8.657 -0.006 -1.084 785 HA GLU 100 HA GLU 100 -6.981 0.550 1.032 786 HB2 GLU 100 HB2 GLU 100 -7.715 2.763 0.925 787 HB3 GLU 100 HB1 GLU 100 -8.030 2.140 -0.702 788 HG2 GLU 100 HG1 GLU 100 -10.391 1.735 -0.047 789 HG3 GLU 100 HG2 GLU 100 -10.040 2.515 1.503 790 HE2 GLU 100 HE2 GLU 100 -9.372 5.266 -1.136 791 H ASP 101 H ASP 101 -10.362 -0.323 1.077 792 HA ASP 101 HA ASP 101 -10.612 0.260 3.917 793 HB2 ASP 101 HB2 ASP 101 -12.445 0.623 2.139 794 HB3 ASP 101 HB1 ASP 101 -12.679 -1.128 2.224 795 HD2 ASP 101 HD2 ASP 101 -13.687 0.990 5.431 796 H GLU 102 H GLU 102 -11.321 -1.373 5.440 797 HA GLU 102 HA GLU 102 -10.931 -3.322 6.557 798 HB2 GLU 102 HB2 GLU 102 -11.419 -4.678 3.905 799 HB3 GLU 102 HB1 GLU 102 -11.759 -5.298 5.528 800 HG2 GLU 102 HG1 GLU 102 -13.426 -3.405 5.768 801 HG3 GLU 102 HG2 GLU 102 -13.215 -3.144 4.031 802 HE2 GLU 102 HE2 GLU 102 -14.773 -6.685 4.924 803 H ASN 103 H ASN 103 -8.675 -2.803 6.810 804 HA ASN 103 HA ASN 103 -6.858 -4.271 5.032 805 HB2 ASN 103 HB2 ASN 103 -6.551 -1.910 6.849 806 HB3 ASN 103 HB1 ASN 103 -5.136 -2.916 6.514 807 HD21 ASN 103 HD21 ASN 103 -7.837 -2.010 4.421 808 HD22 ASN 103 HD22 ASN 103 -6.871 -1.231 3.218 809 H LYS 104 H LYS 104 -8.107 -4.172 8.260 810 HA LYS 104 HA LYS 104 -6.086 -5.861 9.408 811 HB2 LYS 104 HB2 LYS 104 -7.414 -5.840 11.400 812 HB3 LYS 104 HB1 LYS 104 -7.436 -4.207 10.715 813 HG2 LYS 104 HG1 LYS 104 -9.648 -4.291 10.971 814 HG3 LYS 104 HG2 LYS 104 -9.638 -5.364 9.561 815 HD2 LYS 104 HD1 LYS 104 -9.789 -7.299 10.859 816 HD3 LYS 104 HD2 LYS 104 -9.221 -6.467 12.317 817 HE2 LYS 104 HE1 LYS 104 -11.291 -5.290 12.560 818 HE3 LYS 104 HE2 LYS 104 -11.840 -5.838 10.969 819 HZ1 LYS 104 3HZ LYS 104 -12.886 -7.394 12.180 820 HZ2 LYS 104 1HZ LYS 104 -11.850 -7.236 13.508 821 HZ3 LYS 104 2HZ LYS 104 -11.384 -8.171 12.179 822 H GLN 105 H GLN 105 -9.086 -6.316 7.735 823 HA GLN 105 HA GLN 105 -9.364 -9.078 8.570 824 HB2 GLN 105 HB2 GLN 105 -10.894 -7.464 6.513 825 HB3 GLN 105 HB1 GLN 105 -11.316 -9.095 7.059 826 HG2 GLN 105 HG1 GLN 105 -12.140 -8.388 9.053 827 HG3 GLN 105 HG2 GLN 105 -11.033 -7.011 9.138 828 HE21 GLN 105 HE21 GLN 105 -11.572 -5.085 8.131 829 HE22 GLN 105 HE22 GLN 105 -13.173 -4.748 7.575 830 H SER 106 H SER 106 -6.948 -9.006 7.559 831 HA SER 106 HA SER 106 -6.963 -10.860 5.465 832 HB2 SER 106 HB2 SER 106 -7.592 -9.184 3.918 833 HB3 SER 106 HB1 SER 106 -6.493 -7.997 4.643 834 HG SER 106 HG SER 106 -5.080 -8.648 3.247 835 H GLU 107 H GLU 107 -4.776 -11.399 4.706 836 HA GLU 107 HA GLU 107 -2.701 -10.460 6.576 837 HB2 GLU 107 HB2 GLU 107 -3.480 -12.760 7.086 838 HB3 GLU 107 HB1 GLU 107 -2.991 -13.252 5.457 839 HG2 GLU 107 HG1 GLU 107 -0.656 -12.461 6.059 840 HG3 GLU 107 HG2 GLU 107 -1.239 -12.374 7.728 841 HE2 GLU 107 HE2 GLU 107 -0.774 -15.732 8.140 842 H GLY 108 H GLY 108 -0.702 -10.009 5.756 843 HA2 GLY 108 HA2 GLY 108 -0.332 -10.433 2.856 844 HA3 GLY 108 3HA GLY 108 0.030 -8.887 3.610 845 H SER 109 H SER 109 1.893 -10.375 2.125 846 HA SER 109 HA SER 109 3.900 -10.848 4.204 847 HB2 SER 109 HB2 SER 109 3.043 -12.787 2.070 848 HB3 SER 109 HB1 SER 109 4.720 -12.787 2.646 849 HG SER 109 HG SER 109 3.048 -14.172 3.763 Start of MODEL 15 1 H1 MET 1 H MET 1 48.407 55.594 -28.461 2 HA MET 1 HA MET 1 45.856 56.770 -29.244 3 HB2 MET 1 HB2 MET 1 47.946 55.377 -30.935 4 HB3 MET 1 HB1 MET 1 46.551 56.288 -31.533 5 HG2 MET 1 HG1 MET 1 47.506 58.310 -30.346 6 HG3 MET 1 HG2 MET 1 48.969 57.352 -30.111 7 HE1 MET 1 HE1 MET 1 49.985 59.301 -30.940 8 HE2 MET 1 HE2 MET 1 50.950 58.642 -32.262 9 HE3 MET 1 HE3 MET 1 49.866 60.004 -32.555 10 H GLY 2 H GLY 2 45.173 54.868 -27.598 11 HA2 GLY 2 HA2 GLY 2 43.375 53.274 -28.000 12 HA3 GLY 2 3HA GLY 2 44.316 52.649 -29.348 13 H SER 3 H SER 3 43.191 51.382 -26.866 14 HA SER 3 HA SER 3 45.696 50.113 -25.985 15 HB2 SER 3 HB2 SER 3 44.663 51.677 -24.257 16 HB3 SER 3 HB1 SER 3 43.316 50.527 -24.171 17 HG SER 3 HG SER 3 44.501 49.381 -22.889 18 H SER 4 H SER 4 45.719 48.066 -26.600 19 HA SER 4 HA SER 4 43.532 46.671 -27.638 20 HB2 SER 4 HB2 SER 4 45.823 46.044 -28.179 21 HB3 SER 4 HB1 SER 4 46.119 45.597 -26.490 22 HG SER 4 HG SER 4 44.886 44.177 -28.473 23 H HIS 5 H HIS 5 41.954 45.477 -26.765 24 HA HIS 5 HA HIS 5 41.854 45.272 -23.853 25 HB2 HIS 5 HB2 HIS 5 39.943 46.219 -25.239 26 HB3 HIS 5 HB1 HIS 5 39.659 44.570 -25.803 27 HD1 HIS 5 HD1 HIS 5 38.455 46.802 -23.350 28 HD2 HIS 5 HD2 HIS 5 39.371 42.750 -23.361 29 HE1 HIS 5 HE1 HIS 5 37.213 45.827 -21.392 30 HE2 HIS 5 HE2 HIS 5 37.771 43.350 -21.398 31 H HIS 6 H HIS 6 43.301 43.559 -23.523 32 HA HIS 6 HA HIS 6 42.127 40.961 -23.707 33 HB2 HIS 6 HB2 HIS 6 43.249 41.489 -26.008 34 HB3 HIS 6 HB1 HIS 6 44.756 41.178 -25.140 35 HD1 HIS 6 HD1 HIS 6 41.755 39.451 -26.507 36 HD2 HIS 6 HD2 HIS 6 45.182 38.504 -24.357 37 HE1 HIS 6 HE1 HIS 6 41.912 36.942 -26.562 38 HE2 HIS 6 HE2 HIS 6 44.006 36.362 -25.248 39 H HIS 7 H HIS 7 43.082 39.489 -22.318 40 HA HIS 7 HA HIS 7 45.636 39.983 -21.110 41 HB2 HIS 7 HB2 HIS 7 43.846 41.520 -19.969 42 HB3 HIS 7 HB1 HIS 7 43.355 40.026 -19.166 43 HD1 HIS 7 HD1 HIS 7 46.823 41.459 -19.834 44 HD2 HIS 7 HD2 HIS 7 44.464 40.071 -16.709 45 HE1 HIS 7 HE1 HIS 7 48.286 41.561 -17.792 46 HE2 HIS 7 HE2 HIS 7 46.846 40.714 -15.881 47 H HIS 8 H HIS 8 46.432 38.201 -20.015 48 HA HIS 8 HA HIS 8 45.381 35.694 -20.715 49 HB2 HIS 8 HB2 HIS 8 47.287 36.216 -18.427 50 HB3 HIS 8 HB1 HIS 8 47.140 34.744 -19.393 51 HD1 HIS 8 HD1 HIS 8 47.662 35.235 -22.105 52 HD2 HIS 8 HD2 HIS 8 49.360 37.747 -19.264 53 HE1 HIS 8 HE1 HIS 8 49.593 36.353 -23.264 54 HE2 HIS 8 HE2 HIS 8 50.631 37.890 -21.530 55 H HIS 9 H HIS 9 44.223 34.167 -19.596 56 HA HIS 9 HA HIS 9 43.201 34.920 -16.946 57 HB2 HIS 9 HB2 HIS 9 40.960 34.292 -17.525 58 HB3 HIS 9 HB1 HIS 9 41.526 35.457 -18.725 59 HD1 HIS 9 HD1 HIS 9 40.785 31.785 -18.350 60 HD2 HIS 9 HD2 HIS 9 41.616 34.554 -21.333 61 HE1 HIS 9 HE1 HIS 9 40.344 30.590 -20.518 62 HE2 HIS 9 HE2 HIS 9 40.852 32.281 -22.342 63 H HIS 10 H HIS 10 42.825 33.239 -15.531 64 HA HIS 10 HA HIS 10 43.145 30.497 -16.454 65 HB2 HIS 10 HB2 HIS 10 44.909 29.977 -14.847 66 HB3 HIS 10 HB1 HIS 10 45.445 31.219 -15.982 67 HD1 HIS 10 HD1 HIS 10 45.269 30.526 -12.445 68 HD2 HIS 10 HD2 HIS 10 45.262 33.937 -14.818 69 HE1 HIS 10 HE1 HIS 10 45.861 32.420 -10.901 70 HE2 HIS 10 HE2 HIS 10 45.857 34.506 -12.349 71 H SER 11 H SER 11 42.217 28.975 -15.104 72 HA SER 11 HA SER 11 40.321 30.034 -13.190 73 HB2 SER 11 HB2 SER 11 39.401 27.772 -13.131 74 HB3 SER 11 HB1 SER 11 39.648 28.287 -14.810 75 HG SER 11 HG SER 11 40.817 26.238 -13.428 76 H SER 12 H SER 12 40.070 29.138 -11.040 77 HA SER 12 HA SER 12 42.673 28.461 -9.843 78 HB2 SER 12 HB2 SER 12 40.349 30.098 -8.926 79 HB3 SER 12 HB1 SER 12 41.272 29.212 -7.699 80 HG SER 12 HG SER 12 42.446 30.987 -7.830 81 H GLY 13 H GLY 13 42.143 26.217 -10.573 82 HA2 GLY 13 HA2 GLY 13 41.006 24.765 -8.345 83 HA3 GLY 13 3HA GLY 13 40.096 24.612 -9.840 84 H LEU 14 H LEU 14 43.501 24.469 -8.787 85 HA LEU 14 HA LEU 14 43.754 21.961 -10.305 86 HB2 LEU 14 HB2 LEU 14 45.574 24.355 -10.287 87 HB3 LEU 14 HB1 LEU 14 46.173 22.738 -10.697 88 HG LEU 14 HG LEU 14 44.321 22.730 -12.487 89 HD11 LEU 14 HD11 LEU 14 43.030 24.516 -12.698 90 HD12 LEU 14 HD12 LEU 14 44.446 25.543 -12.916 91 HD13 LEU 14 HD13 LEU 14 43.819 25.240 -11.297 92 HD21 LEU 14 HD21 LEU 14 45.843 23.452 -14.059 93 HD22 LEU 14 HD22 LEU 14 46.894 23.103 -12.686 94 HD23 LEU 14 HD23 LEU 14 46.432 24.768 -13.042 95 H VAL 15 H VAL 15 43.162 21.637 -7.788 96 HA VAL 15 HA VAL 15 45.716 21.215 -6.378 97 HB VAL 15 HB VAL 15 44.213 21.059 -4.307 98 HG11 VAL 15 HG11 VAL 15 45.476 22.929 -4.175 99 HG12 VAL 15 HG12 VAL 15 45.056 23.458 -5.806 100 HG13 VAL 15 HG13 VAL 15 43.931 23.725 -4.474 101 HG21 VAL 15 HG21 VAL 15 42.278 22.870 -5.540 102 HG22 VAL 15 HG22 VAL 15 42.190 21.214 -6.140 103 HG23 VAL 15 HG23 VAL 15 42.026 21.536 -4.414 104 HA PRO 16 HA PRO 16 45.080 16.872 -6.399 105 HB2 PRO 16 HB2 PRO 16 46.142 16.151 -3.980 106 HB3 PRO 16 HB1 PRO 16 47.115 16.683 -5.350 107 HG2 PRO 16 HG1 PRO 16 46.146 18.250 -2.984 108 HG3 PRO 16 HG2 PRO 16 47.783 18.223 -3.740 109 HD2 PRO 16 HD1 PRO 16 45.997 20.218 -4.185 110 HD3 PRO 16 HD2 PRO 16 47.137 19.661 -5.422 111 H ARG 17 H ARG 17 43.018 16.183 -6.313 112 HA ARG 17 HA ARG 17 41.133 16.794 -4.351 113 HB2 ARG 17 HB2 ARG 17 41.363 14.678 -6.454 114 HB3 ARG 17 HB1 ARG 17 40.074 14.552 -5.249 115 HG2 ARG 17 HG1 ARG 17 39.352 16.866 -5.875 116 HG3 ARG 17 HG2 ARG 17 40.524 16.793 -7.202 117 HD2 ARG 17 HD1 ARG 17 38.456 16.168 -8.159 118 HD3 ARG 17 HD2 ARG 17 39.360 14.664 -7.936 119 HE ARG 17 HE ARG 17 37.798 15.062 -5.658 120 HH11 ARG 17 1HH1 ARG 17 37.384 14.430 -9.057 121 HH12 ARG 17 2HH1 ARG 17 35.885 13.587 -8.851 122 HH21 ARG 17 1HH2 ARG 17 35.825 13.953 -5.375 123 HH22 ARG 17 2HH2 ARG 17 34.998 13.316 -6.756 124 H GLY 18 H GLY 18 40.328 15.673 -2.571 125 HA2 GLY 18 HA2 GLY 18 41.078 13.150 -1.688 126 HA3 GLY 18 3HA GLY 18 42.255 14.274 -1.027 127 H SER 19 H SER 19 39.050 13.046 -0.820 128 HA SER 19 HA SER 19 38.190 15.057 1.092 129 HB2 SER 19 HB2 SER 19 36.591 12.580 0.666 130 HB3 SER 19 HB1 SER 19 36.062 14.267 0.784 131 HG SER 19 HG SER 19 36.375 14.543 -1.308 132 H HIS 20 H HIS 20 37.306 14.386 3.204 133 HA HIS 20 HA HIS 20 39.106 12.451 4.460 134 HB2 HIS 20 HB2 HIS 20 37.500 14.784 5.441 135 HB3 HIS 20 HB1 HIS 20 37.964 13.518 6.582 136 HD1 HIS 20 HD1 HIS 20 40.403 13.396 7.314 137 HD2 HIS 20 HD2 HIS 20 39.692 16.287 4.414 138 HE1 HIS 20 HE1 HIS 20 42.503 14.775 7.209 139 HE2 HIS 20 HE2 HIS 20 42.070 16.542 5.437 140 H MET 21 H MET 21 38.069 11.277 6.410 141 HA MET 21 HA MET 21 35.325 10.633 6.371 142 HB2 MET 21 HB2 MET 21 35.433 8.343 5.491 143 HB3 MET 21 HB1 MET 21 35.858 9.539 4.257 144 HG2 MET 21 HG1 MET 21 38.267 9.081 4.717 145 HG3 MET 21 HG2 MET 21 37.751 7.782 5.795 146 HE1 MET 21 HE1 MET 21 37.650 8.617 1.607 147 HE2 MET 21 HE2 MET 21 38.952 8.844 2.774 148 HE3 MET 21 HE3 MET 21 38.942 7.423 1.729 149 H ILE 22 H ILE 22 34.741 9.280 8.074 150 HA ILE 22 HA ILE 22 36.956 8.552 9.875 151 HB ILE 22 HB ILE 22 34.828 10.212 10.412 152 HG12 ILE 22 HG11 ILE 22 36.881 10.180 11.668 153 HG13 ILE 22 HG12 ILE 22 35.533 9.941 12.793 154 HG21 ILE 22 HG21 ILE 22 34.236 7.571 11.735 155 HG22 ILE 22 HG22 ILE 22 33.341 9.079 11.915 156 HG23 ILE 22 HG23 ILE 22 33.331 8.227 10.370 157 HD11 ILE 22 HD11 ILE 22 37.605 7.994 11.904 158 HD12 ILE 22 HD12 ILE 22 37.041 8.376 13.530 159 HD13 ILE 22 HD13 ILE 22 36.031 7.416 12.450 160 H SER 23 H SER 23 37.058 6.528 10.732 161 HA SER 23 HA SER 23 36.023 4.365 9.375 162 HB2 SER 23 HB2 SER 23 37.124 4.692 12.157 163 HB3 SER 23 HB1 SER 23 36.483 3.126 11.630 164 HG SER 23 HG SER 23 38.232 2.828 10.520 165 H LEU 24 H LEU 24 34.801 5.819 12.381 166 HA LEU 24 HA LEU 24 32.460 4.103 12.332 167 HB2 LEU 24 HB2 LEU 24 33.409 6.259 14.217 168 HB3 LEU 24 HB1 LEU 24 31.848 5.436 14.390 169 HG LEU 24 HG LEU 24 34.155 3.629 14.208 170 HD11 LEU 24 HD11 LEU 24 33.857 5.001 16.829 171 HD12 LEU 24 HD12 LEU 24 34.831 5.774 15.578 172 HD13 LEU 24 HD13 LEU 24 35.245 4.156 16.144 173 HD21 LEU 24 HD21 LEU 24 32.099 2.652 14.736 174 HD22 LEU 24 HD22 LEU 24 31.686 3.920 15.889 175 HD23 LEU 24 HD23 LEU 24 32.943 2.746 16.282 176 H SER 25 H SER 25 32.527 5.619 10.063 177 HA SER 25 HA SER 25 31.062 8.055 10.315 178 HB2 SER 25 HB2 SER 25 32.196 6.431 8.142 179 HB3 SER 25 HB1 SER 25 30.687 7.253 7.709 180 HG SER 25 HG SER 25 32.071 8.829 7.344 181 H GLY 26 H GLY 26 29.273 7.391 11.625 182 HA2 GLY 26 HA2 GLY 26 27.047 6.883 11.884 183 HA3 GLY 26 3HA GLY 26 26.942 6.812 10.130 184 H LEU 27 H LEU 27 25.610 5.106 12.037 185 HA LEU 27 HA LEU 27 26.750 2.526 11.196 186 HB2 LEU 27 HB2 LEU 27 26.430 1.550 13.264 187 HB3 LEU 27 HB1 LEU 27 26.990 3.179 13.684 188 HG LEU 27 HG LEU 27 24.086 2.368 13.663 189 HD11 LEU 27 HD11 LEU 27 25.272 2.821 16.264 190 HD12 LEU 27 HD12 LEU 27 26.016 1.459 15.428 191 HD13 LEU 27 HD13 LEU 27 24.273 1.484 15.694 192 HD21 LEU 27 HD21 LEU 27 25.593 4.780 14.647 193 HD22 LEU 27 HD22 LEU 27 23.948 4.400 15.160 194 HD23 LEU 27 HD23 LEU 27 24.291 4.715 13.458 195 H THR 28 H THR 28 25.370 1.158 10.236 196 HA THR 28 HA THR 28 22.657 0.855 10.748 197 HB THR 28 HB THR 28 22.153 1.947 8.266 198 HG1 THR 28 HG1 THR 28 23.239 3.791 8.073 199 HG21 THR 28 HG21 THR 28 21.314 3.920 9.927 200 HG22 THR 28 HG22 THR 28 21.547 2.597 11.072 201 HG23 THR 28 HG23 THR 28 20.465 2.392 9.695 202 H SER 29 H SER 29 21.553 -0.492 9.137 203 HA SER 29 HA SER 29 23.253 -2.508 8.134 204 HB2 SER 29 HB2 SER 29 20.324 -1.927 8.019 205 HB3 SER 29 HB1 SER 29 20.983 -3.105 6.871 206 HG SER 29 HG SER 29 20.934 -4.471 8.454 207 H SER 30 H SER 30 22.707 -3.296 5.729 208 HA SER 30 HA SER 30 23.110 -0.994 3.937 209 HB2 SER 30 HB2 SER 30 25.236 -2.284 4.467 210 HB3 SER 30 HB1 SER 30 24.509 -3.652 3.607 211 HG SER 30 HG SER 30 25.727 -1.476 2.593 212 H VAL 31 H VAL 31 22.909 -1.795 1.553 213 HA VAL 31 HA VAL 31 21.249 -2.260 0.016 214 HB VAL 31 HB VAL 31 20.945 -4.686 -0.312 215 HG11 VAL 31 HG11 VAL 31 23.750 -3.763 0.295 216 HG12 VAL 31 HG12 VAL 31 23.360 -5.247 -0.576 217 HG13 VAL 31 HG13 VAL 31 22.907 -3.682 -1.252 218 HG21 VAL 31 HG21 VAL 31 20.868 -5.194 2.157 219 HG22 VAL 31 HG22 VAL 31 21.829 -6.303 1.181 220 HG23 VAL 31 HG23 VAL 31 22.627 -5.069 2.155 221 H GLU 32 H GLU 32 20.032 -1.192 2.250 222 HA GLU 32 HA GLU 32 17.899 -2.884 3.163 223 HB2 GLU 32 HB2 GLU 32 17.045 -0.848 4.262 224 HB3 GLU 32 HB1 GLU 32 18.755 -1.142 4.621 225 HG2 GLU 32 HG1 GLU 32 19.415 0.535 2.979 226 HG3 GLU 32 HG2 GLU 32 17.713 0.820 2.589 227 HE2 GLU 32 HE2 GLU 32 17.984 1.880 6.288 228 H SER 33 H SER 33 18.413 -0.754 0.506 229 HA SER 33 HA SER 33 15.552 -0.908 -0.186 230 HB2 SER 33 HB2 SER 33 16.537 1.403 0.211 231 HB3 SER 33 HB1 SER 33 17.508 1.134 -1.247 232 HG SER 33 HG SER 33 15.194 2.154 -1.268 233 H ASP 34 H ASP 34 18.789 -1.601 -1.153 234 HA ASP 34 HA ASP 34 18.538 -1.869 -3.907 235 HB2 ASP 34 HB2 ASP 34 20.646 -2.064 -2.496 236 HB3 ASP 34 HB1 ASP 34 20.159 -3.733 -2.173 237 HD2 ASP 34 HD2 ASP 34 22.023 -4.424 -4.995 238 H LEU 35 H LEU 35 17.305 -3.857 -1.353 239 HA LEU 35 HA LEU 35 16.698 -6.068 -3.144 240 HB2 LEU 35 HB2 LEU 35 17.462 -6.260 -0.693 241 HB3 LEU 35 HB1 LEU 35 15.793 -5.816 -0.296 242 HG LEU 35 HG LEU 35 14.975 -7.807 -1.453 243 HD11 LEU 35 HD11 LEU 35 17.140 -9.446 -1.799 244 HD12 LEU 35 HD12 LEU 35 17.738 -7.896 -2.389 245 HD13 LEU 35 HD13 LEU 35 16.279 -8.600 -3.085 246 HD21 LEU 35 HD21 LEU 35 15.333 -8.096 0.862 247 HD22 LEU 35 HD22 LEU 35 17.081 -8.204 0.658 248 HD23 LEU 35 HD23 LEU 35 16.044 -9.511 0.084 249 H ASP 36 H ASP 36 15.163 -3.303 -1.738 250 HA ASP 36 HA ASP 36 12.468 -4.156 -2.042 251 HB2 ASP 36 HB2 ASP 36 13.719 -1.412 -1.795 252 HB3 ASP 36 HB1 ASP 36 11.973 -1.681 -1.868 253 HD2 ASP 36 HD2 ASP 36 12.652 -1.651 1.611 254 H MET 37 H MET 37 14.773 -2.540 -4.135 255 HA MET 37 HA MET 37 13.081 -1.574 -6.110 256 HB2 MET 37 HB2 MET 37 15.667 -1.387 -5.813 257 HB3 MET 37 HB1 MET 37 15.704 -2.839 -6.824 258 HG2 MET 37 HG1 MET 37 14.113 -1.377 -8.363 259 HG3 MET 37 HG2 MET 37 14.943 -0.063 -7.526 260 HE1 MET 37 HE1 MET 37 15.770 -0.496 -11.074 261 HE2 MET 37 HE2 MET 37 16.015 -2.243 -11.064 262 HE3 MET 37 HE3 MET 37 14.552 -1.552 -10.359 263 H GLN 38 H GLN 38 14.018 -4.832 -5.382 264 HA GLN 38 HA GLN 38 13.583 -6.123 -7.793 265 HB2 GLN 38 HB2 GLN 38 14.275 -6.964 -5.353 266 HB3 GLN 38 HB1 GLN 38 12.570 -7.437 -5.324 267 HG2 GLN 38 HG1 GLN 38 13.199 -8.460 -7.696 268 HG3 GLN 38 HG2 GLN 38 14.804 -8.498 -6.952 269 HE21 GLN 38 HE21 GLN 38 15.220 -9.898 -5.288 270 HE22 GLN 38 HE22 GLN 38 14.123 -11.141 -4.802 271 H GLN 39 H GLN 39 11.293 -4.740 -5.574 272 HA GLN 39 HA GLN 39 8.973 -6.099 -6.351 273 HB2 GLN 39 HB2 GLN 39 7.743 -4.365 -5.307 274 HB3 GLN 39 HB1 GLN 39 9.249 -4.525 -4.389 275 HG2 GLN 39 HG1 GLN 39 10.151 -2.624 -5.828 276 HG3 GLN 39 HG2 GLN 39 8.472 -2.370 -6.322 277 HE21 GLN 39 HE21 GLN 39 10.031 -3.139 -3.228 278 HE22 GLN 39 HE22 GLN 39 9.321 -1.832 -2.350 279 H ALA 40 H ALA 40 10.699 -3.437 -7.824 280 HA ALA 40 HA ALA 40 8.703 -2.555 -9.596 281 HB1 ALA 40 HB1 ALA 40 10.632 -1.195 -9.211 282 HB2 ALA 40 HB2 ALA 40 10.603 -1.634 -10.919 283 HB3 ALA 40 HB3 ALA 40 11.706 -2.457 -9.815 284 H MET 41 H MET 41 10.718 -5.356 -9.616 285 HA MET 41 HA MET 41 10.419 -5.882 -12.437 286 HB2 MET 41 HB2 MET 41 11.459 -7.595 -10.168 287 HB3 MET 41 HB1 MET 41 11.496 -8.059 -11.876 288 HG2 MET 41 HG1 MET 41 12.774 -5.783 -12.161 289 HG3 MET 41 HG2 MET 41 13.101 -6.005 -10.440 290 HE1 MET 41 HE1 MET 41 14.067 -7.599 -14.132 291 HE2 MET 41 HE2 MET 41 14.482 -6.020 -13.464 292 HE3 MET 41 HE3 MET 41 15.707 -7.285 -13.564 293 H LEU 42 H LEU 42 8.779 -6.717 -9.482 294 HA LEU 42 HA LEU 42 7.186 -8.779 -10.774 295 HB2 LEU 42 HB2 LEU 42 7.641 -7.836 -8.003 296 HB3 LEU 42 HB1 LEU 42 6.033 -8.488 -8.364 297 HG LEU 42 HG LEU 42 7.596 -10.149 -7.389 298 HD11 LEU 42 HD11 LEU 42 5.734 -10.499 -9.310 299 HD12 LEU 42 HD12 LEU 42 6.614 -11.816 -8.535 300 HD13 LEU 42 HD13 LEU 42 7.146 -11.199 -10.099 301 HD21 LEU 42 HD21 LEU 42 9.589 -10.701 -8.298 302 HD22 LEU 42 HD22 LEU 42 9.499 -9.060 -8.937 303 HD23 LEU 42 HD23 LEU 42 9.036 -10.427 -9.951 304 H THR 43 H THR 43 7.137 -5.595 -11.003 305 HA THR 43 HA THR 43 4.226 -5.510 -11.328 306 HB THR 43 HB THR 43 4.635 -4.453 -9.169 307 HG1 THR 43 HG1 THR 43 2.999 -3.452 -10.246 308 HG21 THR 43 HG21 THR 43 6.122 -2.175 -10.315 309 HG22 THR 43 HG22 THR 43 7.031 -3.677 -10.144 310 HG23 THR 43 HG23 THR 43 6.266 -2.944 -8.735 311 H ASN 44 H ASN 44 5.913 -5.903 -13.408 312 HA ASN 44 HA ASN 44 7.041 -3.737 -14.690 313 HB2 ASN 44 HB2 ASN 44 7.427 -5.832 -15.673 314 HB3 ASN 44 HB1 ASN 44 5.703 -6.222 -15.728 315 HD21 ASN 44 HD21 ASN 44 7.948 -3.771 -16.972 316 HD22 ASN 44 HD22 ASN 44 7.245 -3.683 -18.548 317 H LYS 45 H LYS 45 6.168 -1.820 -15.088 318 HA LYS 45 HA LYS 45 3.311 -1.646 -15.731 319 HB2 LYS 45 HB2 LYS 45 3.603 0.794 -15.305 320 HB3 LYS 45 HB1 LYS 45 3.972 -0.226 -13.906 321 HG2 LYS 45 HG1 LYS 45 6.258 0.447 -15.655 322 HG3 LYS 45 HG2 LYS 45 5.543 1.782 -14.735 323 HD2 LYS 45 HD1 LYS 45 6.089 -0.774 -13.297 324 HD3 LYS 45 HD2 LYS 45 7.462 0.264 -13.719 325 HE2 LYS 45 HE1 LYS 45 5.851 2.140 -12.699 326 HE3 LYS 45 HE2 LYS 45 5.238 0.736 -11.813 327 HZ1 LYS 45 3HZ LYS 45 7.954 1.891 -11.766 328 HZ2 LYS 45 1HZ LYS 45 7.683 0.291 -11.287 329 HZ3 LYS 45 2HZ LYS 45 6.921 1.559 -10.468 330 H ASP 46 H ASP 46 2.843 0.309 -17.262 331 HA ASP 46 HA ASP 46 4.725 0.237 -19.524 332 HB2 ASP 46 HB2 ASP 46 1.749 -0.227 -19.526 333 HB3 ASP 46 HB1 ASP 46 2.577 0.378 -20.968 334 HD2 ASP 46 HD2 ASP 46 3.320 -3.359 -19.853 335 H GLU 47 H GLU 47 3.783 1.962 -21.238 336 HA GLU 47 HA GLU 47 4.141 4.484 -19.976 337 HB2 GLU 47 HB2 GLU 47 3.752 5.426 -22.230 338 HB3 GLU 47 HB1 GLU 47 4.953 4.125 -22.227 339 HG2 GLU 47 HG1 GLU 47 3.190 2.550 -22.990 340 HG3 GLU 47 HG2 GLU 47 2.086 3.927 -23.117 341 HE2 GLU 47 HE2 GLU 47 4.733 4.971 -25.631 342 H LYS 48 H LYS 48 1.354 2.817 -21.374 343 HA LYS 48 HA LYS 48 -0.464 4.974 -21.000 344 HB2 LYS 48 HB2 LYS 48 -2.219 3.226 -21.374 345 HB3 LYS 48 HB1 LYS 48 -0.988 3.311 -22.644 346 HG2 LYS 48 HG1 LYS 48 -0.397 1.407 -20.479 347 HG3 LYS 48 HG2 LYS 48 -1.819 1.023 -21.466 348 HD2 LYS 48 HD1 LYS 48 0.207 1.842 -23.260 349 HD3 LYS 48 HD2 LYS 48 0.957 0.722 -22.109 350 HE2 LYS 48 HE1 LYS 48 -1.339 -0.611 -22.613 351 HE3 LYS 48 HE2 LYS 48 -1.118 0.233 -24.152 352 HZ1 LYS 48 3HZ LYS 48 0.882 -0.835 -24.551 353 HZ2 LYS 48 1HZ LYS 48 -0.057 -2.061 -23.860 354 HZ3 LYS 48 2HZ LYS 48 1.110 -1.265 -22.930 355 H VAL 49 H VAL 49 0.580 2.277 -19.029 356 HA VAL 49 HA VAL 49 -1.451 2.277 -17.108 357 HB VAL 49 HB VAL 49 1.479 1.623 -16.769 358 HG11 VAL 49 HG11 VAL 49 0.102 0.135 -14.926 359 HG12 VAL 49 HG12 VAL 49 1.001 1.613 -14.582 360 HG13 VAL 49 HG13 VAL 49 -0.738 1.684 -14.869 361 HG21 VAL 49 HG21 VAL 49 1.046 -0.461 -17.528 362 HG22 VAL 49 HG22 VAL 49 -0.582 -0.489 -16.851 363 HG23 VAL 49 HG23 VAL 49 -0.273 0.353 -18.369 364 H LEU 50 H LEU 50 1.232 4.433 -17.596 365 HA LEU 50 HA LEU 50 1.284 5.582 -15.004 366 HB2 LEU 50 HB2 LEU 50 2.048 7.058 -17.506 367 HB3 LEU 50 HB1 LEU 50 2.747 7.177 -15.882 368 HG LEU 50 HG LEU 50 3.125 4.933 -17.861 369 HD11 LEU 50 HD11 LEU 50 4.383 7.257 -17.913 370 HD12 LEU 50 HD12 LEU 50 5.220 5.740 -18.238 371 HD13 LEU 50 HD13 LEU 50 5.341 6.489 -16.646 372 HD21 LEU 50 HD21 LEU 50 4.166 5.190 -15.042 373 HD22 LEU 50 HD22 LEU 50 4.599 3.928 -16.195 374 HD23 LEU 50 HD23 LEU 50 2.945 4.043 -15.593 375 H LYS 51 H LYS 51 -0.725 6.047 -17.784 376 HA LYS 51 HA LYS 51 -1.693 8.636 -17.191 377 HB2 LYS 51 HB2 LYS 51 -3.049 6.380 -18.690 378 HB3 LYS 51 HB1 LYS 51 -3.531 8.084 -18.727 379 HG2 LYS 51 HG1 LYS 51 -0.736 7.382 -19.495 380 HG3 LYS 51 HG2 LYS 51 -2.053 7.041 -20.631 381 HD2 LYS 51 HD1 LYS 51 -1.712 9.744 -19.337 382 HD3 LYS 51 HD2 LYS 51 -0.895 9.302 -20.847 383 HE2 LYS 51 HE1 LYS 51 -3.887 9.270 -20.377 384 HE3 LYS 51 HE2 LYS 51 -2.986 10.499 -21.276 385 HZ1 LYS 51 3HZ LYS 51 -3.928 8.983 -22.828 386 HZ2 LYS 51 1HZ LYS 51 -3.311 7.641 -22.003 387 HZ3 LYS 51 2HZ LYS 51 -2.261 8.699 -22.802 388 H ALA 52 H ALA 52 -2.775 5.399 -16.282 389 HA ALA 52 HA ALA 52 -5.192 6.144 -15.050 390 HB1 ALA 52 HB1 ALA 52 -5.361 3.934 -14.986 391 HB2 ALA 52 HB2 ALA 52 -4.171 3.900 -13.684 392 HB3 ALA 52 HB3 ALA 52 -3.647 3.762 -15.363 393 H LEU 53 H LEU 53 -1.907 5.800 -13.767 394 HA LEU 53 HA LEU 53 -2.486 6.195 -11.063 395 HB2 LEU 53 HB2 LEU 53 0.004 7.123 -12.499 396 HB3 LEU 53 HB1 LEU 53 -0.165 6.724 -10.780 397 HG LEU 53 HG LEU 53 -0.385 4.741 -13.044 398 HD11 LEU 53 HD11 LEU 53 1.879 5.544 -12.877 399 HD12 LEU 53 HD12 LEU 53 1.787 3.919 -12.200 400 HD13 LEU 53 HD13 LEU 53 1.869 5.317 -11.128 401 HD21 LEU 53 HD21 LEU 53 0.140 3.795 -10.331 402 HD22 LEU 53 HD22 LEU 53 -0.985 3.190 -11.547 403 HD23 LEU 53 HD23 LEU 53 -1.440 4.556 -10.527 404 H GLU 54 H GLU 54 -2.494 8.402 -13.696 405 HA GLU 54 HA GLU 54 -2.023 10.802 -12.264 406 HB2 GLU 54 HB2 GLU 54 -3.649 10.457 -14.793 407 HB3 GLU 54 HB1 GLU 54 -2.869 11.939 -14.220 408 HG2 GLU 54 HG1 GLU 54 -1.613 9.479 -15.387 409 HG3 GLU 54 HG2 GLU 54 -1.459 11.166 -15.897 410 HE2 GLU 54 HE2 GLU 54 1.142 11.748 -13.712 411 H ARG 55 H ARG 55 -4.934 8.965 -13.027 412 HA ARG 55 HA ARG 55 -6.715 10.932 -11.928 413 HB2 ARG 55 HB2 ARG 55 -7.624 9.581 -13.642 414 HB3 ARG 55 HB1 ARG 55 -7.071 8.092 -12.862 415 HG2 ARG 55 HG1 ARG 55 -9.483 8.356 -12.642 416 HG3 ARG 55 HG2 ARG 55 -8.680 8.412 -11.063 417 HD2 ARG 55 HD1 ARG 55 -9.288 10.550 -10.679 418 HD3 ARG 55 HD2 ARG 55 -8.983 11.026 -12.356 419 HE ARG 55 HE ARG 55 -11.265 9.501 -12.446 420 HH11 ARG 55 1HH1 ARG 55 -10.248 12.406 -10.816 421 HH12 ARG 55 2HH1 ARG 55 -11.840 13.090 -10.766 422 HH21 ARG 55 1HH2 ARG 55 -13.364 10.391 -12.386 423 HH22 ARG 55 2HH2 ARG 55 -13.611 11.942 -11.659 424 H THR 56 H THR 56 -5.141 8.010 -10.795 425 HA THR 56 HA THR 56 -6.641 7.820 -8.365 426 HB THR 56 HB THR 56 -5.208 6.044 -7.747 427 HG1 THR 56 HG1 THR 56 -3.372 7.169 -9.609 428 HG21 THR 56 HG21 THR 56 -6.417 6.101 -10.247 429 HG22 THR 56 HG22 THR 56 -5.861 4.667 -9.384 430 HG23 THR 56 HG23 THR 56 -4.808 5.452 -10.559 431 H ARG 57 H ARG 57 -3.421 9.040 -9.224 432 HA ARG 57 HA ARG 57 -2.482 9.660 -6.692 433 HB2 ARG 57 HB2 ARG 57 -0.957 11.187 -7.745 434 HB3 ARG 57 HB1 ARG 57 -1.170 9.788 -8.809 435 HG2 ARG 57 HG1 ARG 57 -2.469 10.986 -10.345 436 HG3 ARG 57 HG2 ARG 57 -2.767 12.295 -9.188 437 HD2 ARG 57 HD1 ARG 57 -1.109 12.838 -11.001 438 HD3 ARG 57 HD2 ARG 57 -0.527 13.069 -9.346 439 HE ARG 57 HE ARG 57 0.129 10.478 -10.311 440 HH11 ARG 57 1HH1 ARG 57 1.047 13.830 -10.507 441 HH12 ARG 57 2HH1 ARG 57 2.701 13.489 -10.897 442 HH21 ARG 57 1HH2 ARG 57 2.303 10.016 -10.824 443 HH22 ARG 57 2HH2 ARG 57 3.414 11.319 -11.078 444 H GLN 58 H GLN 58 -4.902 11.244 -8.606 445 HA GLN 58 HA GLN 58 -4.877 13.767 -7.342 446 HB2 GLN 58 HB2 GLN 58 -6.994 12.241 -8.855 447 HB3 GLN 58 HB1 GLN 58 -7.296 13.850 -8.180 448 HG2 GLN 58 HG1 GLN 58 -5.039 13.257 -10.088 449 HG3 GLN 58 HG2 GLN 58 -6.646 13.790 -10.602 450 HE21 GLN 58 HE21 GLN 58 -3.792 14.689 -8.782 451 HE22 GLN 58 HE22 GLN 58 -4.050 16.396 -8.856 452 H LEU 59 H LEU 59 -6.575 10.757 -6.631 453 HA LEU 59 HA LEU 59 -7.885 11.968 -4.326 454 HB2 LEU 59 HB2 LEU 59 -8.030 9.086 -5.199 455 HB3 LEU 59 HB1 LEU 59 -9.157 9.976 -4.162 456 HG LEU 59 HG LEU 59 -8.996 11.206 -6.765 457 HD11 LEU 59 HD11 LEU 59 -9.685 8.273 -6.676 458 HD12 LEU 59 HD12 LEU 59 -8.410 9.043 -7.620 459 HD13 LEU 59 HD13 LEU 59 -10.102 9.359 -8.002 460 HD21 LEU 59 HD21 LEU 59 -11.382 11.027 -6.653 461 HD22 LEU 59 HD22 LEU 59 -10.784 11.457 -5.050 462 HD23 LEU 59 HD23 LEU 59 -11.281 9.799 -5.391 463 H ASP 60 H ASP 60 -4.894 11.147 -4.735 464 HA ASP 60 HA ASP 60 -3.188 10.515 -3.368 465 HB2 ASP 60 HB2 ASP 60 -5.114 10.205 -1.079 466 HB3 ASP 60 HB1 ASP 60 -3.434 10.757 -1.054 467 HD2 ASP 60 HD2 ASP 60 -4.649 13.895 -2.479 468 H ILE 61 H ILE 61 -3.271 8.541 -4.696 469 HA ILE 61 HA ILE 61 -3.863 6.199 -3.017 470 HB ILE 61 HB ILE 61 -4.257 6.263 -6.008 471 HG12 ILE 61 HG11 ILE 61 -6.370 6.286 -3.838 472 HG13 ILE 61 HG12 ILE 61 -5.890 7.707 -4.779 473 HG21 ILE 61 HG21 ILE 61 -5.311 4.221 -4.083 474 HG22 ILE 61 HG22 ILE 61 -5.085 4.090 -5.827 475 HG23 ILE 61 HG23 ILE 61 -3.685 4.097 -4.753 476 HD11 ILE 61 HD11 ILE 61 -7.922 5.987 -5.414 477 HD12 ILE 61 HD12 ILE 61 -7.146 7.123 -6.518 478 HD13 ILE 61 HD13 ILE 61 -6.607 5.445 -6.457 479 HA PRO 62 HA PRO 62 0.394 5.287 -3.824 480 HB2 PRO 62 HB2 PRO 62 0.406 2.760 -2.769 481 HB3 PRO 62 HB1 PRO 62 0.384 4.224 -1.788 482 HG2 PRO 62 HG1 PRO 62 -1.892 2.456 -2.618 483 HG3 PRO 62 HG2 PRO 62 -1.529 3.161 -0.999 484 HD2 PRO 62 HD1 PRO 62 -3.403 4.203 -2.665 485 HD3 PRO 62 HD2 PRO 62 -2.422 5.205 -1.581 486 H ASP 63 H ASP 63 1.451 4.474 -5.537 487 HA ASP 63 HA ASP 63 0.045 3.171 -7.624 488 HB2 ASP 63 HB2 ASP 63 3.052 3.306 -7.354 489 HB3 ASP 63 HB1 ASP 63 2.093 3.222 -8.837 490 HD2 ASP 63 HD2 ASP 63 1.072 6.677 -7.908 491 H GLU 64 H GLU 64 1.358 1.986 -4.783 492 HA GLU 64 HA GLU 64 2.276 -0.555 -5.738 493 HB2 GLU 64 HB2 GLU 64 1.442 0.117 -2.913 494 HB3 GLU 64 HB1 GLU 64 2.573 -1.137 -3.445 495 HG2 GLU 64 HG1 GLU 64 2.983 1.847 -3.458 496 HG3 GLU 64 HG2 GLU 64 3.858 0.625 -2.523 497 HE2 GLU 64 HE2 GLU 64 5.000 1.359 -6.210 498 H LYS 65 H LYS 65 -0.771 0.790 -4.839 499 HA LYS 65 HA LYS 65 -1.997 -1.885 -4.837 500 HB2 LYS 65 HB2 LYS 65 -3.743 -1.068 -3.517 501 HB3 LYS 65 HB1 LYS 65 -2.307 -0.272 -2.856 502 HG2 LYS 65 HG1 LYS 65 -2.839 1.742 -4.197 503 HG3 LYS 65 HG2 LYS 65 -4.331 0.943 -4.726 504 HD2 LYS 65 HD1 LYS 65 -3.589 1.565 -1.857 505 HD3 LYS 65 HD2 LYS 65 -4.737 2.478 -2.854 506 HE2 LYS 65 HE1 LYS 65 -6.366 1.108 -2.198 507 HE3 LYS 65 HE2 LYS 65 -5.523 -0.220 -3.010 508 HZ1 LYS 65 3HZ LYS 65 -5.842 -0.853 -0.768 509 HZ2 LYS 65 1HZ LYS 65 -5.246 0.617 -0.179 510 HZ3 LYS 65 2HZ LYS 65 -4.199 -0.481 -0.925 511 H THR 66 H THR 66 -1.846 1.157 -6.473 512 HA THR 66 HA THR 66 -4.259 0.830 -7.985 513 HB THR 66 HB THR 66 -1.926 2.612 -8.688 514 HG1 THR 66 HG1 THR 66 -2.975 2.768 -6.448 515 HG21 THR 66 HG21 THR 66 -4.879 2.937 -9.222 516 HG22 THR 66 HG22 THR 66 -3.725 2.286 -10.386 517 HG23 THR 66 HG23 THR 66 -3.569 3.951 -9.826 518 H MET 67 H MET 67 -0.844 0.140 -8.498 519 HA MET 67 HA MET 67 -0.759 -0.352 -11.197 520 HB2 MET 67 HB2 MET 67 0.687 -1.432 -8.835 521 HB3 MET 67 HB1 MET 67 0.854 -2.321 -10.356 522 HG2 MET 67 HG1 MET 67 1.539 0.578 -9.871 523 HG3 MET 67 HG2 MET 67 2.663 -0.758 -10.135 524 HE1 MET 67 HE1 MET 67 0.023 -1.779 -12.615 525 HE2 MET 67 HE2 MET 67 1.324 -1.777 -13.805 526 HE3 MET 67 HE3 MET 67 1.596 -2.457 -12.199 527 HA PRO 68 HA PRO 68 -2.246 -4.894 -10.457 528 HB2 PRO 68 HB2 PRO 68 -3.301 -5.484 -8.000 529 HB3 PRO 68 HB1 PRO 68 -1.588 -5.642 -8.386 530 HG2 PRO 68 HG1 PRO 68 -3.030 -3.396 -7.016 531 HG3 PRO 68 HG2 PRO 68 -1.476 -4.195 -6.569 532 HD2 PRO 68 HD1 PRO 68 -1.579 -1.794 -7.833 533 HD3 PRO 68 HD2 PRO 68 -0.289 -2.974 -8.121 534 H VAL 69 H VAL 69 -3.882 -2.088 -9.333 535 HA VAL 69 HA VAL 69 -6.540 -3.197 -9.519 536 HB VAL 69 HB VAL 69 -5.468 -0.434 -9.033 537 HG11 VAL 69 HG11 VAL 69 -7.267 0.295 -10.209 538 HG12 VAL 69 HG12 VAL 69 -8.163 -1.208 -9.984 539 HG13 VAL 69 HG13 VAL 69 -8.080 -0.027 -8.677 540 HG21 VAL 69 HG21 VAL 69 -6.052 -0.773 -6.878 541 HG22 VAL 69 HG22 VAL 69 -7.502 -1.683 -7.300 542 HG23 VAL 69 HG23 VAL 69 -5.925 -2.472 -7.333 543 H LEU 70 H LEU 70 -4.756 -0.689 -11.326 544 HA LEU 70 HA LEU 70 -6.651 -0.386 -13.370 545 HB2 LEU 70 HB2 LEU 70 -4.870 0.694 -14.642 546 HB3 LEU 70 HB1 LEU 70 -4.898 1.242 -12.956 547 HG LEU 70 HG LEU 70 -3.054 -0.724 -12.787 548 HD11 LEU 70 HD11 LEU 70 -2.319 0.542 -15.383 549 HD12 LEU 70 HD12 LEU 70 -3.362 -0.879 -15.376 550 HD13 LEU 70 HD13 LEU 70 -1.752 -0.964 -14.663 551 HD21 LEU 70 HD21 LEU 70 -1.370 1.143 -13.051 552 HD22 LEU 70 HD22 LEU 70 -2.667 1.428 -11.889 553 HD23 LEU 70 HD23 LEU 70 -2.726 2.185 -13.482 554 H MET 71 H MET 71 -3.769 -2.443 -13.163 555 HA MET 71 HA MET 71 -3.878 -3.499 -15.755 556 HB2 MET 71 HB2 MET 71 -2.324 -5.108 -15.044 557 HB3 MET 71 HB1 MET 71 -2.008 -3.701 -14.017 558 HG2 MET 71 HG1 MET 71 -2.022 -5.232 -12.369 559 HG3 MET 71 HG2 MET 71 -3.768 -4.987 -12.465 560 HE1 MET 71 HE1 MET 71 -1.080 -8.205 -12.941 561 HE2 MET 71 HE2 MET 71 -1.413 -8.127 -14.671 562 HE3 MET 71 HE3 MET 71 -0.821 -6.698 -13.820 563 H LYS 72 H LYS 72 -5.801 -4.128 -12.966 564 HA LYS 72 HA LYS 72 -6.726 -6.719 -13.724 565 HB2 LYS 72 HB2 LYS 72 -6.767 -5.672 -11.394 566 HB3 LYS 72 HB1 LYS 72 -8.191 -4.775 -11.946 567 HG2 LYS 72 HG1 LYS 72 -9.293 -6.524 -11.051 568 HG3 LYS 72 HG2 LYS 72 -8.946 -7.253 -12.630 569 HD2 LYS 72 HD1 LYS 72 -6.654 -7.827 -11.254 570 HD3 LYS 72 HD2 LYS 72 -7.880 -7.913 -9.976 571 HE2 LYS 72 HE1 LYS 72 -8.630 -9.234 -12.505 572 HE3 LYS 72 HE2 LYS 72 -7.260 -9.958 -11.651 573 HZ1 LYS 72 3HZ LYS 72 -8.928 -11.036 -10.604 574 HZ2 LYS 72 1HZ LYS 72 -10.061 -9.808 -10.865 575 HZ3 LYS 72 2HZ LYS 72 -8.919 -9.655 -9.626 576 H LEU 73 H LEU 73 -7.695 -3.446 -14.440 577 HA LEU 73 HA LEU 73 -10.268 -4.131 -15.495 578 HB2 LEU 73 HB2 LEU 73 -8.758 -1.649 -16.242 579 HB3 LEU 73 HB1 LEU 73 -10.501 -1.883 -16.031 580 HG LEU 73 HG LEU 73 -8.474 -1.807 -13.798 581 HD11 LEU 73 HD11 LEU 73 -10.460 0.251 -14.749 582 HD12 LEU 73 HD12 LEU 73 -8.701 0.374 -14.800 583 HD13 LEU 73 HD13 LEU 73 -9.538 0.350 -13.247 584 HD21 LEU 73 HD21 LEU 73 -10.512 -1.641 -12.377 585 HD22 LEU 73 HD22 LEU 73 -10.327 -3.196 -13.187 586 HD23 LEU 73 HD23 LEU 73 -11.481 -2.012 -13.802 587 H LEU 74 H LEU 74 -7.167 -3.192 -16.974 588 HA LEU 74 HA LEU 74 -7.939 -3.441 -19.641 589 HB2 LEU 74 HB2 LEU 74 -5.290 -3.722 -18.244 590 HB3 LEU 74 HB1 LEU 74 -5.443 -3.936 -19.996 591 HG LEU 74 HG LEU 74 -4.669 -1.711 -19.538 592 HD11 LEU 74 HD11 LEU 74 -5.888 -1.020 -21.252 593 HD12 LEU 74 HD12 LEU 74 -7.255 -0.730 -20.177 594 HD13 LEU 74 HD13 LEU 74 -7.056 -2.307 -20.944 595 HD21 LEU 74 HD21 LEU 74 -5.897 -0.134 -18.188 596 HD22 LEU 74 HD22 LEU 74 -5.535 -1.568 -17.226 597 HD23 LEU 74 HD23 LEU 74 -7.157 -1.329 -17.878 598 H GLU 75 H GLU 75 -7.243 -5.854 -17.272 599 HA GLU 75 HA GLU 75 -6.492 -8.012 -18.864 600 HB2 GLU 75 HB2 GLU 75 -7.571 -7.614 -16.174 601 HB3 GLU 75 HB1 GLU 75 -8.064 -9.151 -16.899 602 HG2 GLU 75 HG1 GLU 75 -5.206 -8.205 -16.699 603 HG3 GLU 75 HG2 GLU 75 -5.994 -9.287 -15.541 604 HE2 GLU 75 HE2 GLU 75 -5.476 -12.009 -17.553 605 H GLU 76 H GLU 76 -9.768 -7.115 -17.780 606 HA GLU 76 HA GLU 76 -11.005 -9.074 -19.476 607 HB2 GLU 76 HB2 GLU 76 -12.276 -6.746 -18.017 608 HB3 GLU 76 HB1 GLU 76 -13.109 -8.162 -18.677 609 HG2 GLU 76 HG1 GLU 76 -11.770 -9.584 -17.103 610 HG3 GLU 76 HG2 GLU 76 -11.198 -8.084 -16.359 611 HE2 GLU 76 HE2 GLU 76 -14.674 -7.464 -15.408 612 H ALA 77 H ALA 77 -10.200 -5.693 -19.695 613 HA ALA 77 HA ALA 77 -11.843 -5.238 -22.031 614 HB1 ALA 77 HB1 ALA 77 -11.327 -3.021 -21.819 615 HB2 ALA 77 HB2 ALA 77 -9.695 -3.342 -21.228 616 HB3 ALA 77 HB3 ALA 77 -11.079 -3.552 -20.155 617 H GLY 78 H GLY 78 -9.154 -6.979 -21.635 618 HA2 GLY 78 HA2 GLY 78 -7.484 -7.708 -23.030 619 HA3 GLY 78 3HA GLY 78 -8.498 -7.132 -24.344 620 H GLY 79 H GLY 79 -7.529 -4.817 -21.991 621 HA2 GLY 79 HA2 GLY 79 -5.693 -3.342 -21.985 622 HA3 GLY 79 3HA GLY 79 -5.197 -3.989 -23.542 623 H ASN 80 H ASN 80 -8.378 -2.745 -22.616 624 HA ASN 80 HA ASN 80 -8.045 -0.650 -24.662 625 HB2 ASN 80 HB2 ASN 80 -9.881 -2.669 -24.694 626 HB3 ASN 80 HB1 ASN 80 -10.792 -1.387 -23.886 627 HD21 ASN 80 HD21 ASN 80 -10.168 0.867 -25.036 628 HD22 ASN 80 HD22 ASN 80 -10.477 0.848 -26.736 629 H TRP 81 H TRP 81 -7.535 1.151 -23.561 630 HA TRP 81 HA TRP 81 -8.704 1.739 -20.990 631 HB2 TRP 81 HB2 TRP 81 -6.922 3.433 -22.763 632 HB3 TRP 81 HB1 TRP 81 -7.339 3.786 -21.086 633 HD1 TRP 81 HD1 TRP 81 -5.352 1.178 -23.127 634 HE1 TRP 81 HE1 TRP 81 -3.557 0.158 -21.592 635 HE3 TRP 81 HE3 TRP 81 -6.674 3.426 -18.729 636 HZ2 TRP 81 2HZ TRP 81 -2.801 0.287 -18.875 637 HZ3 TRP 81 3HZ TRP 81 -5.363 2.923 -16.709 638 HH2 TRP 81 HH TRP 81 -3.468 1.386 -16.781 639 H SER 82 H SER 82 -9.391 2.432 -24.284 640 HA SER 82 HA SER 82 -10.666 4.873 -24.201 641 HB2 SER 82 HB2 SER 82 -10.268 3.512 -26.257 642 HB3 SER 82 HB1 SER 82 -11.608 2.461 -25.769 643 HG SER 82 HG SER 82 -11.673 4.940 -26.922 644 H TYR 83 H TYR 83 -12.107 1.678 -23.583 645 HA TYR 83 HA TYR 83 -14.621 2.823 -22.782 646 HB2 TYR 83 HB2 TYR 83 -14.872 0.725 -23.769 647 HB3 TYR 83 HB1 TYR 83 -13.497 0.043 -22.895 648 HD1 TYR 83 HD2 TYR 83 -13.715 -0.755 -20.609 649 HD2 TYR 83 HD1 TYR 83 -17.056 0.870 -22.685 650 HE1 TYR 83 HE2 TYR 83 -15.223 -1.696 -18.909 651 HE2 TYR 83 HE1 TYR 83 -18.573 -0.066 -20.989 652 HH TYR 83 HH TYR 83 -18.499 -2.007 -19.325 653 H ILE 84 H ILE 84 -11.870 1.305 -21.150 654 HA ILE 84 HA ILE 84 -12.898 1.262 -18.556 655 HB ILE 84 HB ILE 84 -10.040 1.601 -19.467 656 HG12 ILE 84 HG11 ILE 84 -11.544 -0.834 -18.475 657 HG13 ILE 84 HG12 ILE 84 -11.190 -0.486 -20.176 658 HG21 ILE 84 HG21 ILE 84 -9.530 0.707 -17.151 659 HG22 ILE 84 HG22 ILE 84 -10.080 2.378 -17.243 660 HG23 ILE 84 HG23 ILE 84 -11.196 1.111 -16.737 661 HD11 ILE 84 HD11 ILE 84 -9.193 -1.413 -20.010 662 HD12 ILE 84 HD12 ILE 84 -8.771 -0.373 -18.649 663 HD13 ILE 84 HD13 ILE 84 -9.601 -1.903 -18.366 664 H LYS 85 H LYS 85 -11.748 3.893 -20.475 665 HA LYS 85 HA LYS 85 -11.604 5.666 -18.149 666 HB2 LYS 85 HB2 LYS 85 -10.296 7.086 -19.383 667 HB3 LYS 85 HB1 LYS 85 -9.902 5.549 -20.169 668 HG2 LYS 85 HG1 LYS 85 -11.977 6.248 -21.694 669 HG3 LYS 85 HG2 LYS 85 -11.441 7.859 -21.188 670 HD2 LYS 85 HD1 LYS 85 -9.836 5.746 -22.633 671 HD3 LYS 85 HD2 LYS 85 -10.316 7.346 -23.225 672 HE2 LYS 85 HE1 LYS 85 -8.960 7.977 -20.922 673 HE3 LYS 85 HE2 LYS 85 -8.068 6.569 -21.518 674 HZ1 LYS 85 3HZ LYS 85 -7.337 8.842 -22.334 675 HZ2 LYS 85 1HZ LYS 85 -8.731 8.839 -23.294 676 HZ3 LYS 85 2HZ LYS 85 -7.553 7.644 -23.508 677 H LEU 86 H LEU 86 -13.896 4.572 -20.226 678 HA LEU 86 HA LEU 86 -15.278 6.776 -21.159 679 HB2 LEU 86 HB2 LEU 86 -15.815 4.415 -21.675 680 HB3 LEU 86 HB1 LEU 86 -16.477 4.247 -20.040 681 HG LEU 86 HG LEU 86 -17.609 6.341 -21.837 682 HD11 LEU 86 HD11 LEU 86 -18.812 4.925 -23.142 683 HD12 LEU 86 HD12 LEU 86 -18.812 3.635 -21.941 684 HD13 LEU 86 HD13 LEU 86 -17.374 3.927 -22.919 685 HD21 LEU 86 HD21 LEU 86 -18.180 5.256 -19.292 686 HD22 LEU 86 HD22 LEU 86 -19.496 4.789 -20.368 687 HD23 LEU 86 HD23 LEU 86 -19.072 6.491 -20.178 688 H ASP 87 H ASP 87 -14.992 5.566 -17.918 689 HA ASP 87 HA ASP 87 -16.840 7.671 -17.001 690 HB2 ASP 87 HB2 ASP 87 -16.195 5.133 -15.488 691 HB3 ASP 87 HB1 ASP 87 -17.471 6.308 -15.140 692 HD2 ASP 87 HD2 ASP 87 -19.617 4.907 -17.453 693 H ASN 88 H ASN 88 -13.894 7.695 -17.523 694 HA ASN 88 HA ASN 88 -12.055 8.679 -16.612 695 HB2 ASN 88 HB2 ASN 88 -14.130 10.010 -15.479 696 HB3 ASN 88 HB1 ASN 88 -13.348 9.353 -14.037 697 HD21 ASN 88 HD21 ASN 88 -10.713 9.415 -14.722 698 HD22 ASN 88 HD22 ASN 88 -10.200 11.051 -14.931 699 H TYR 89 H TYR 89 -12.390 5.925 -16.295 700 HA TYR 89 HA TYR 89 -11.494 4.147 -15.197 701 HB2 TYR 89 HB2 TYR 89 -9.980 6.257 -13.636 702 HB3 TYR 89 HB1 TYR 89 -9.571 4.543 -13.736 703 HD1 TYR 89 HD2 TYR 89 -10.223 4.282 -16.749 704 HD2 TYR 89 HD1 TYR 89 -7.876 7.043 -14.519 705 HE1 TYR 89 HE2 TYR 89 -8.834 4.698 -18.736 706 HE2 TYR 89 HE1 TYR 89 -6.481 7.466 -16.499 707 HH TYR 89 HH TYR 89 -7.051 5.741 -19.550 708 H THR 90 H THR 90 -13.973 5.077 -14.300 709 HA THR 90 HA THR 90 -14.297 5.533 -11.600 710 HB THR 90 HB THR 90 -16.039 3.977 -13.512 711 HG1 THR 90 HG1 THR 90 -17.308 6.000 -13.130 712 HG21 THR 90 HG21 THR 90 -17.818 4.502 -11.702 713 HG22 THR 90 HG22 THR 90 -16.438 4.613 -10.610 714 HG23 THR 90 HG23 THR 90 -16.759 3.111 -11.476 715 H ALA 91 H ALA 91 -13.507 2.556 -13.246 716 HA ALA 91 HA ALA 91 -14.148 0.681 -11.299 717 HB1 ALA 91 HB1 ALA 91 -12.460 -0.750 -12.337 718 HB2 ALA 91 HB2 ALA 91 -11.804 0.643 -13.198 719 HB3 ALA 91 HB3 ALA 91 -13.437 0.075 -13.552 720 H LEU 92 H LEU 92 -11.346 2.795 -11.571 721 HA LEU 92 HA LEU 92 -9.797 1.599 -9.535 722 HB2 LEU 92 HB2 LEU 92 -8.342 3.368 -9.772 723 HB3 LEU 92 HB1 LEU 92 -9.156 3.340 -11.345 724 HG LEU 92 HG LEU 92 -10.727 5.115 -10.160 725 HD11 LEU 92 HD11 LEU 92 -9.950 5.409 -8.049 726 HD12 LEU 92 HD12 LEU 92 -8.927 6.585 -8.874 727 HD13 LEU 92 HD13 LEU 92 -8.292 4.989 -8.478 728 HD21 LEU 92 HD21 LEU 92 -9.832 6.467 -11.686 729 HD22 LEU 92 HD22 LEU 92 -8.685 5.172 -12.031 730 HD23 LEU 92 HD23 LEU 92 -8.259 6.447 -10.889 731 H VAL 93 H VAL 93 -12.346 4.004 -9.501 732 HA VAL 93 HA VAL 93 -11.975 4.942 -6.867 733 HB VAL 93 HB VAL 93 -14.389 4.875 -8.665 734 HG11 VAL 93 HG11 VAL 93 -14.178 5.685 -5.803 735 HG12 VAL 93 HG12 VAL 93 -15.239 6.594 -6.882 736 HG13 VAL 93 HG13 VAL 93 -15.491 4.864 -6.647 737 HG21 VAL 93 HG21 VAL 93 -13.398 7.443 -7.746 738 HG22 VAL 93 HG22 VAL 93 -12.159 6.509 -8.586 739 HG23 VAL 93 HG23 VAL 93 -13.690 6.867 -9.387 740 H ASP 94 H ASP 94 -14.138 2.435 -8.174 741 HA ASP 94 HA ASP 94 -15.098 1.671 -5.588 742 HB2 ASP 94 HB2 ASP 94 -16.310 1.414 -7.833 743 HB3 ASP 94 HB1 ASP 94 -15.276 0.002 -8.092 744 HD2 ASP 94 HD2 ASP 94 -17.737 -1.762 -6.472 745 H ALA 95 H ALA 95 -12.496 0.674 -7.679 746 HA ALA 95 HA ALA 95 -11.964 -1.811 -6.383 747 HB1 ALA 95 HB1 ALA 95 -10.382 -0.089 -8.269 748 HB2 ALA 95 HB2 ALA 95 -11.180 -1.631 -8.588 749 HB3 ALA 95 HB3 ALA 95 -9.731 -1.578 -7.583 750 H ILE 96 H ILE 96 -10.220 1.305 -6.346 751 HA ILE 96 HA ILE 96 -8.400 0.635 -4.336 752 HB ILE 96 HB ILE 96 -9.510 3.344 -5.074 753 HG12 ILE 96 HG11 ILE 96 -8.331 2.142 -6.880 754 HG13 ILE 96 HG12 ILE 96 -7.455 3.591 -6.357 755 HG21 ILE 96 HG21 ILE 96 -7.491 4.241 -3.956 756 HG22 ILE 96 HG22 ILE 96 -8.612 3.457 -2.844 757 HG23 ILE 96 HG23 ILE 96 -7.144 2.621 -3.353 758 HD11 ILE 96 HD11 ILE 96 -6.804 0.771 -5.534 759 HD12 ILE 96 HD12 ILE 96 -5.937 1.730 -6.734 760 HD13 ILE 96 HD13 ILE 96 -5.935 2.224 -5.042 761 H TYR 97 H TYR 97 -11.645 2.003 -4.141 762 HA TYR 97 HA TYR 97 -11.651 2.662 -1.419 763 HB2 TYR 97 HB2 TYR 97 -13.727 2.112 -3.484 764 HB3 TYR 97 HB1 TYR 97 -14.237 2.066 -1.794 765 HD1 TYR 97 HD1 TYR 97 -11.691 4.300 -3.331 766 HD2 TYR 97 HD2 TYR 97 -15.553 3.991 -1.572 767 HE1 TYR 97 HE1 TYR 97 -11.865 6.753 -3.295 768 HE2 TYR 97 HE2 TYR 97 -15.739 6.442 -1.532 769 HH TYR 97 HH TYR 97 -14.465 8.410 -3.119 770 H SER 98 H SER 98 -12.163 -0.382 -3.074 771 HA SER 98 HA SER 98 -13.140 -1.770 -0.762 772 HB2 SER 98 HB2 SER 98 -13.857 -2.678 -2.818 773 HB3 SER 98 HB1 SER 98 -12.219 -2.645 -3.495 774 HG SER 98 HG SER 98 -13.428 -4.592 -2.064 775 H VAL 99 H VAL 99 -10.087 -1.926 -2.600 776 HA VAL 99 HA VAL 99 -8.738 -3.643 -0.848 777 HB VAL 99 HB VAL 99 -7.451 -1.494 -2.534 778 HG11 VAL 99 HG11 VAL 99 -6.137 -4.081 -2.309 779 HG12 VAL 99 HG12 VAL 99 -5.489 -2.456 -2.073 780 HG13 VAL 99 HG13 VAL 99 -6.329 -3.273 -0.754 781 HG21 VAL 99 HG21 VAL 99 -8.351 -2.505 -4.305 782 HG22 VAL 99 HG22 VAL 99 -7.331 -3.893 -3.926 783 HG23 VAL 99 HG23 VAL 99 -8.986 -3.823 -3.318 784 H GLU 100 H GLU 100 -8.555 -0.089 -1.093 785 HA GLU 100 HA GLU 100 -6.805 0.405 0.977 786 HB2 GLU 100 HB2 GLU 100 -7.538 2.625 0.960 787 HB3 GLU 100 HB1 GLU 100 -7.894 2.046 -0.675 788 HG2 GLU 100 HG1 GLU 100 -10.239 1.639 0.009 789 HG3 GLU 100 HG2 GLU 100 -9.856 2.345 1.586 790 HE2 GLU 100 HE2 GLU 100 -11.125 5.124 -0.178 791 H ASP 101 H ASP 101 -10.184 -0.461 1.121 792 HA ASP 101 HA ASP 101 -10.672 0.263 3.806 793 HB2 ASP 101 HB2 ASP 101 -12.371 -0.343 1.982 794 HB3 ASP 101 HB1 ASP 101 -12.015 -2.029 2.383 795 HD2 ASP 101 HD2 ASP 101 -13.691 -1.813 5.426 796 H GLU 102 H GLU 102 -10.045 -2.959 2.403 797 HA GLU 102 HA GLU 102 -9.133 -3.838 5.058 798 HB2 GLU 102 HB2 GLU 102 -10.011 -5.520 2.700 799 HB3 GLU 102 HB1 GLU 102 -9.584 -6.116 4.311 800 HG2 GLU 102 HG1 GLU 102 -11.790 -4.120 4.003 801 HG3 GLU 102 HG2 GLU 102 -12.078 -5.830 3.649 802 HE2 GLU 102 HE2 GLU 102 -11.646 -4.723 7.413 803 H ASN 103 H ASN 103 -7.015 -3.985 5.326 804 HA ASN 103 HA ASN 103 -5.327 -4.491 2.966 805 HB2 ASN 103 HB2 ASN 103 -4.922 -2.820 5.427 806 HB3 ASN 103 HB1 ASN 103 -3.519 -3.483 4.579 807 HD21 ASN 103 HD21 ASN 103 -6.598 -2.114 3.471 808 HD22 ASN 103 HD22 ASN 103 -5.892 -0.927 2.435 809 H LYS 104 H LYS 104 -6.198 -5.539 6.142 810 HA LYS 104 HA LYS 104 -3.971 -7.142 6.756 811 HB2 LYS 104 HB2 LYS 104 -5.425 -8.276 8.346 812 HB3 LYS 104 HB1 LYS 104 -5.695 -6.527 8.402 813 HG2 LYS 104 HG1 LYS 104 -7.453 -8.048 6.576 814 HG3 LYS 104 HG2 LYS 104 -7.676 -8.330 8.311 815 HD2 LYS 104 HD1 LYS 104 -7.564 -5.672 8.382 816 HD3 LYS 104 HD2 LYS 104 -8.129 -5.866 6.714 817 HE2 LYS 104 HE1 LYS 104 -10.059 -5.641 8.125 818 HE3 LYS 104 HE2 LYS 104 -9.966 -7.318 7.568 819 HZ1 LYS 104 3HZ LYS 104 -8.585 -6.869 10.048 820 HZ2 LYS 104 1HZ LYS 104 -9.712 -8.062 9.640 821 HZ3 LYS 104 2HZ LYS 104 -10.241 -6.537 10.144 822 H GLN 105 H GLN 105 -6.483 -7.538 4.462 823 HA GLN 105 HA GLN 105 -6.783 -10.271 4.255 824 HB2 GLN 105 HB2 GLN 105 -6.557 -8.385 1.903 825 HB3 GLN 105 HB1 GLN 105 -7.437 -9.920 1.966 826 HG2 GLN 105 HG1 GLN 105 -8.116 -7.366 3.417 827 HG3 GLN 105 HG2 GLN 105 -9.012 -8.130 2.097 828 HE21 GLN 105 HE21 GLN 105 -8.973 -7.672 5.331 829 HE22 GLN 105 HE22 GLN 105 -9.907 -9.035 5.837 830 H SER 106 H SER 106 -5.891 -11.725 2.549 831 HA SER 106 HA SER 106 -2.998 -11.663 2.687 832 HB2 SER 106 HB2 SER 106 -3.293 -13.910 1.426 833 HB3 SER 106 HB1 SER 106 -3.845 -13.808 3.108 834 HG SER 106 HG SER 106 -5.437 -14.769 1.812 835 H GLU 107 H GLU 107 -1.831 -10.655 1.203 836 HA GLU 107 HA GLU 107 -2.867 -10.519 -1.552 837 HB2 GLU 107 HB2 GLU 107 -0.998 -8.620 -0.114 838 HB3 GLU 107 HB1 GLU 107 -1.489 -8.480 -1.808 839 HG2 GLU 107 HG1 GLU 107 -3.747 -8.033 -1.222 840 HG3 GLU 107 HG2 GLU 107 -3.446 -8.454 0.471 841 HE2 GLU 107 HE2 GLU 107 -1.342 -5.290 0.120 842 H GLY 108 H GLY 108 -0.727 -9.834 -2.986 843 HA2 GLY 108 HA2 GLY 108 1.682 -11.181 -2.378 844 HA3 GLY 108 3HA GLY 108 0.664 -12.225 -3.359 845 H SER 109 H SER 109 0.204 -11.648 -5.503 846 HA SER 109 HA SER 109 2.175 -9.814 -6.649 847 HB2 SER 109 HB2 SER 109 2.367 -11.817 -7.798 848 HB3 SER 109 HB1 SER 109 0.630 -12.156 -7.694 849 HG SER 109 HG SER 109 1.468 -11.477 -9.814 Start of MODEL 16 1 H1 MET 1 H MET 1 51.012 11.081 -0.929 2 HA MET 1 HA MET 1 51.583 13.401 -1.263 3 HB2 MET 1 HB2 MET 1 53.313 11.717 -0.219 4 HB3 MET 1 HB1 MET 1 54.220 12.056 -1.702 5 HG2 MET 1 HG1 MET 1 54.113 14.481 -1.171 6 HG3 MET 1 HG2 MET 1 53.337 14.061 0.358 7 HE1 MET 1 HE1 MET 1 54.523 11.722 1.508 8 HE2 MET 1 HE2 MET 1 56.095 12.069 2.226 9 HE3 MET 1 HE3 MET 1 54.729 13.142 2.535 10 H GLY 2 H GLY 2 50.707 12.350 -3.825 11 HA2 GLY 2 HA2 GLY 2 52.685 13.611 -5.620 12 HA3 GLY 2 3HA GLY 2 51.552 12.363 -6.115 13 H SER 3 H SER 3 51.956 14.972 -7.300 14 HA SER 3 HA SER 3 49.543 16.449 -6.586 15 HB2 SER 3 HB2 SER 3 50.404 18.119 -8.265 16 HB3 SER 3 HB1 SER 3 51.494 17.819 -6.901 17 HG SER 3 HG SER 3 51.908 17.404 -9.545 18 H SER 4 H SER 4 48.219 14.608 -7.368 19 HA SER 4 HA SER 4 47.216 15.163 -9.978 20 HB2 SER 4 HB2 SER 4 49.259 13.703 -10.427 21 HB3 SER 4 HB1 SER 4 48.368 12.393 -9.630 22 HG SER 4 HG SER 4 47.219 12.149 -11.367 23 H HIS 5 H HIS 5 45.292 13.912 -10.482 24 HA HIS 5 HA HIS 5 43.903 13.117 -8.040 25 HB2 HIS 5 HB2 HIS 5 43.051 14.002 -10.771 26 HB3 HIS 5 HB1 HIS 5 41.932 13.045 -9.795 27 HD1 HIS 5 HD1 HIS 5 41.821 14.128 -7.147 28 HD2 HIS 5 HD2 HIS 5 42.579 16.634 -10.373 29 HE1 HIS 5 HE1 HIS 5 41.225 16.439 -6.357 30 HE2 HIS 5 HE2 HIS 5 41.687 17.972 -8.327 31 H HIS 6 H HIS 6 44.058 11.040 -7.509 32 HA HIS 6 HA HIS 6 44.383 9.006 -9.560 33 HB2 HIS 6 HB2 HIS 6 44.830 7.473 -7.753 34 HB3 HIS 6 HB1 HIS 6 45.748 8.958 -7.479 35 HD1 HIS 6 HD1 HIS 6 43.105 6.847 -5.987 36 HD2 HIS 6 HD2 HIS 6 44.797 10.586 -5.339 37 HE1 HIS 6 HE1 HIS 6 42.351 7.537 -3.689 38 HE2 HIS 6 HE2 HIS 6 43.385 9.822 -3.293 39 H HIS 7 H HIS 7 41.931 10.265 -7.461 40 HA HIS 7 HA HIS 7 40.163 8.151 -7.256 41 HB2 HIS 7 HB2 HIS 7 39.490 11.076 -7.672 42 HB3 HIS 7 HB1 HIS 7 38.388 9.849 -7.038 43 HD1 HIS 7 HD1 HIS 7 39.149 8.734 -4.690 44 HD2 HIS 7 HD2 HIS 7 41.001 12.299 -5.747 45 HE1 HIS 7 HE1 HIS 7 40.164 9.619 -2.566 46 HE2 HIS 7 HE2 HIS 7 41.298 11.798 -3.212 47 H HIS 8 H HIS 8 40.532 10.475 -9.907 48 HA HIS 8 HA HIS 8 38.380 9.504 -11.464 49 HB2 HIS 8 HB2 HIS 8 40.798 11.197 -12.019 50 HB3 HIS 8 HB1 HIS 8 39.798 10.629 -13.360 51 HD1 HIS 8 HD1 HIS 8 37.197 11.352 -13.238 52 HD2 HIS 8 HD2 HIS 8 39.819 13.433 -10.778 53 HE1 HIS 8 HE1 HIS 8 35.975 13.447 -12.571 54 HE2 HIS 8 HE2 HIS 8 37.578 14.719 -11.067 55 H HIS 9 H HIS 9 38.323 8.078 -13.181 56 HA HIS 9 HA HIS 9 40.746 6.575 -13.821 57 HB2 HIS 9 HB2 HIS 9 39.388 4.431 -13.674 58 HB3 HIS 9 HB1 HIS 9 39.851 5.170 -12.138 59 HD1 HIS 9 HD1 HIS 9 37.949 6.412 -10.793 60 HD2 HIS 9 HD2 HIS 9 36.655 4.223 -14.079 61 HE1 HIS 9 HE1 HIS 9 35.462 6.171 -10.504 62 HE2 HIS 9 HE2 HIS 9 34.671 4.833 -12.513 63 H HIS 10 H HIS 10 39.905 4.739 -15.519 64 HA HIS 10 HA HIS 10 38.820 6.315 -17.707 65 HB2 HIS 10 HB2 HIS 10 40.833 5.004 -18.120 66 HB3 HIS 10 HB1 HIS 10 39.991 3.526 -17.646 67 HD1 HIS 10 HD1 HIS 10 39.250 6.267 -20.194 68 HD2 HIS 10 HD2 HIS 10 39.294 2.128 -19.838 69 HE1 HIS 10 HE1 HIS 10 38.536 5.391 -22.442 70 HE2 HIS 10 HE2 HIS 10 38.562 2.860 -22.224 71 H SER 11 H SER 11 36.940 5.888 -18.799 72 HA SER 11 HA SER 11 35.170 3.870 -17.583 73 HB2 SER 11 HB2 SER 11 34.184 6.345 -19.002 74 HB3 SER 11 HB1 SER 11 33.316 5.301 -17.862 75 HG SER 11 HG SER 11 34.365 6.201 -16.195 76 H SER 12 H SER 12 35.376 2.182 -18.960 77 HA SER 12 HA SER 12 35.519 2.517 -21.804 78 HB2 SER 12 HB2 SER 12 34.895 -0.078 -20.393 79 HB3 SER 12 HB1 SER 12 35.751 0.170 -21.925 80 HG SER 12 HG SER 12 37.526 0.859 -20.844 81 H GLY 13 H GLY 13 33.984 1.676 -23.339 82 HA2 GLY 13 HA2 GLY 13 31.331 2.502 -22.813 83 HA3 GLY 13 3HA GLY 13 31.872 1.628 -24.238 84 H LEU 14 H LEU 14 29.421 1.338 -22.620 85 HA LEU 14 HA LEU 14 29.475 -0.932 -20.999 86 HB2 LEU 14 HB2 LEU 14 27.275 0.143 -22.769 87 HB3 LEU 14 HB1 LEU 14 27.057 -1.134 -21.559 88 HG LEU 14 HG LEU 14 28.017 1.632 -20.858 89 HD11 LEU 14 HD11 LEU 14 25.871 1.956 -21.830 90 HD12 LEU 14 HD12 LEU 14 25.664 1.992 -20.080 91 HD13 LEU 14 HD13 LEU 14 25.211 0.552 -20.990 92 HD21 LEU 14 HD21 LEU 14 28.481 0.466 -18.984 93 HD22 LEU 14 HD22 LEU 14 27.368 -0.841 -19.391 94 HD23 LEU 14 HD23 LEU 14 26.752 0.657 -18.690 95 H VAL 15 H VAL 15 28.108 -2.966 -21.680 96 HA VAL 15 HA VAL 15 28.813 -3.863 -24.373 97 HB VAL 15 HB VAL 15 29.564 -6.083 -23.332 98 HG11 VAL 15 HG11 VAL 15 31.835 -5.397 -23.299 99 HG12 VAL 15 HG12 VAL 15 31.012 -4.356 -24.462 100 HG13 VAL 15 HG13 VAL 15 31.401 -3.747 -22.854 101 HG21 VAL 15 HG21 VAL 15 30.471 -4.540 -20.973 102 HG22 VAL 15 HG22 VAL 15 28.779 -5.041 -21.001 103 HG23 VAL 15 HG23 VAL 15 30.059 -6.249 -21.123 104 HA PRO 16 HA PRO 16 24.905 -5.861 -24.285 105 HB2 PRO 16 HB2 PRO 16 25.369 -8.040 -25.879 106 HB3 PRO 16 HB1 PRO 16 25.255 -6.392 -26.494 107 HG2 PRO 16 HG1 PRO 16 27.692 -8.004 -25.818 108 HG3 PRO 16 HG2 PRO 16 27.368 -6.980 -27.266 109 HD2 PRO 16 HD1 PRO 16 28.910 -6.141 -25.196 110 HD3 PRO 16 HD2 PRO 16 27.886 -5.041 -26.133 111 H ARG 17 H ARG 17 23.786 -7.895 -23.729 112 HA ARG 17 HA ARG 17 25.292 -9.385 -21.686 113 HB2 ARG 17 HB2 ARG 17 23.075 -9.888 -20.687 114 HB3 ARG 17 HB1 ARG 17 23.448 -8.159 -20.733 115 HG2 ARG 17 HG1 ARG 17 21.691 -7.687 -22.027 116 HG3 ARG 17 HG2 ARG 17 22.006 -9.068 -23.093 117 HD2 ARG 17 HD1 ARG 17 21.141 -10.393 -20.918 118 HD3 ARG 17 HD2 ARG 17 20.267 -8.868 -20.708 119 HE ARG 17 HE ARG 17 20.054 -9.993 -23.353 120 HH11 ARG 17 1HH1 ARG 17 18.716 -9.904 -20.140 121 HH12 ARG 17 2HH1 ARG 17 17.142 -10.427 -20.640 122 HH21 ARG 17 1HH2 ARG 17 17.986 -10.682 -24.024 123 HH22 ARG 17 2HH2 ARG 17 16.727 -10.869 -22.849 124 H GLY 18 H GLY 18 23.391 -9.653 -24.579 125 HA2 GLY 18 HA2 GLY 18 22.912 -11.436 -25.942 126 HA3 GLY 18 3HA GLY 18 24.297 -12.225 -25.202 127 H SER 19 H SER 19 23.296 -14.248 -25.215 128 HA SER 19 HA SER 19 21.224 -14.562 -23.152 129 HB2 SER 19 HB2 SER 19 19.919 -14.868 -25.064 130 HB3 SER 19 HB1 SER 19 21.241 -15.642 -25.954 131 HG SER 19 HG SER 19 19.570 -16.730 -23.968 132 H HIS 20 H HIS 20 21.633 -16.101 -21.688 133 HA HIS 20 HA HIS 20 24.078 -17.657 -21.987 134 HB2 HIS 20 HB2 HIS 20 22.297 -16.930 -19.685 135 HB3 HIS 20 HB1 HIS 20 23.401 -18.301 -19.537 136 HD1 HIS 20 HD1 HIS 20 25.829 -17.812 -19.090 137 HD2 HIS 20 HD2 HIS 20 23.658 -14.408 -20.070 138 HE1 HIS 20 HE1 HIS 20 27.377 -15.878 -18.653 139 HE2 HIS 20 HE2 HIS 20 26.049 -13.797 -19.251 140 H MET 21 H MET 21 24.182 -19.871 -21.994 141 HA MET 21 HA MET 21 21.631 -21.251 -22.454 142 HB2 MET 21 HB2 MET 21 24.450 -22.078 -23.190 143 HB3 MET 21 HB1 MET 21 22.977 -22.980 -23.578 144 HG2 MET 21 HG1 MET 21 22.232 -20.802 -24.770 145 HG3 MET 21 HG2 MET 21 23.946 -20.391 -24.706 146 HE1 MET 21 HE1 MET 21 21.955 -23.988 -26.196 147 HE2 MET 21 HE2 MET 21 21.206 -22.441 -25.799 148 HE3 MET 21 HE3 MET 21 21.635 -22.811 -27.470 149 H ILE 22 H ILE 22 20.874 -22.546 -20.924 150 HA ILE 22 HA ILE 22 22.689 -24.131 -19.301 151 HB ILE 22 HB ILE 22 22.466 -22.054 -18.008 152 HG12 ILE 22 HG11 ILE 22 20.819 -24.153 -16.613 153 HG13 ILE 22 HG12 ILE 22 22.527 -24.435 -16.991 154 HG21 ILE 22 HG21 ILE 22 20.471 -21.104 -17.376 155 HG22 ILE 22 HG22 ILE 22 20.059 -21.721 -18.975 156 HG23 ILE 22 HG23 ILE 22 19.577 -22.616 -17.535 157 HD11 ILE 22 HD11 ILE 22 21.379 -22.320 -15.197 158 HD12 ILE 22 HD12 ILE 22 22.440 -23.660 -14.761 159 HD13 ILE 22 HD13 ILE 22 23.057 -22.328 -15.739 160 H SER 23 H SER 23 21.788 -26.011 -18.548 161 HA SER 23 HA SER 23 19.322 -26.822 -19.776 162 HB2 SER 23 HB2 SER 23 20.829 -28.433 -17.719 163 HB3 SER 23 HB1 SER 23 19.860 -29.007 -19.088 164 HG SER 23 HG SER 23 22.424 -27.814 -19.139 165 H LEU 24 H LEU 24 18.322 -24.925 -18.427 166 HA LEU 24 HA LEU 24 17.801 -25.125 -15.716 167 HB2 LEU 24 HB2 LEU 24 17.166 -23.326 -17.535 168 HB3 LEU 24 HB1 LEU 24 15.636 -24.222 -17.554 169 HG LEU 24 HG LEU 24 15.784 -23.832 -14.939 170 HD11 LEU 24 HD11 LEU 24 16.800 -21.184 -15.508 171 HD12 LEU 24 HD12 LEU 24 18.020 -22.427 -15.778 172 HD13 LEU 24 HD13 LEU 24 17.222 -22.301 -14.211 173 HD21 LEU 24 HD21 LEU 24 14.304 -21.987 -15.200 174 HD22 LEU 24 HD22 LEU 24 14.032 -23.070 -16.566 175 HD23 LEU 24 HD23 LEU 24 14.973 -21.593 -16.783 176 H SER 25 H SER 25 16.046 -26.577 -18.430 177 HA SER 25 HA SER 25 13.911 -27.677 -17.027 178 HB2 SER 25 HB2 SER 25 15.345 -28.787 -19.462 179 HB3 SER 25 HB1 SER 25 13.744 -29.296 -18.896 180 HG SER 25 HG SER 25 13.364 -26.837 -19.062 181 H GLY 26 H GLY 26 13.519 -29.772 -16.199 182 HA2 GLY 26 HA2 GLY 26 15.593 -31.717 -15.944 183 HA3 GLY 26 3HA GLY 26 15.394 -30.797 -14.461 184 H LEU 27 H LEU 27 14.943 -33.619 -14.848 185 HA LEU 27 HA LEU 27 12.120 -34.085 -14.970 186 HB2 LEU 27 HB2 LEU 27 13.436 -35.885 -15.676 187 HB3 LEU 27 HB1 LEU 27 14.504 -35.758 -14.268 188 HG LEU 27 HG LEU 27 12.725 -36.645 -12.835 189 HD11 LEU 27 HD11 LEU 27 11.145 -37.146 -15.344 190 HD12 LEU 27 HD12 LEU 27 10.864 -35.761 -14.291 191 HD13 LEU 27 HD13 LEU 27 10.647 -37.396 -13.671 192 HD21 LEU 27 HD21 LEU 27 13.145 -38.417 -15.235 193 HD22 LEU 27 HD22 LEU 27 12.842 -38.913 -13.570 194 HD23 LEU 27 HD23 LEU 27 14.366 -38.132 -13.995 195 H THR 28 H THR 28 14.273 -33.046 -12.550 196 HA THR 28 HA THR 28 12.468 -33.877 -10.392 197 HB THR 28 HB THR 28 14.211 -33.397 -8.843 198 HG1 THR 28 HG1 THR 28 16.153 -32.376 -9.532 199 HG21 THR 28 HG21 THR 28 16.029 -34.819 -9.612 200 HG22 THR 28 HG22 THR 28 15.489 -34.638 -11.282 201 HG23 THR 28 HG23 THR 28 14.479 -35.490 -10.116 202 H SER 29 H SER 29 12.699 -32.042 -8.513 203 HA SER 29 HA SER 29 11.184 -29.836 -9.547 204 HB2 SER 29 HB2 SER 29 10.826 -29.201 -7.282 205 HB3 SER 29 HB1 SER 29 10.828 -30.973 -7.295 206 HG SER 29 HG SER 29 12.297 -30.757 -5.807 207 H SER 30 H SER 30 11.757 -27.699 -9.693 208 HA SER 30 HA SER 30 14.362 -26.795 -8.824 209 HB2 SER 30 HB2 SER 30 13.664 -26.880 -11.776 210 HB3 SER 30 HB1 SER 30 15.076 -26.066 -11.080 211 HG SER 30 HG SER 30 15.996 -27.966 -10.646 212 H VAL 31 H VAL 31 14.690 -24.439 -9.656 213 HA VAL 31 HA VAL 31 13.930 -22.312 -9.178 214 HB VAL 31 HB VAL 31 12.322 -21.503 -10.868 215 HG11 VAL 31 HG11 VAL 31 14.843 -22.110 -11.270 216 HG12 VAL 31 HG12 VAL 31 14.156 -23.327 -12.348 217 HG13 VAL 31 HG13 VAL 31 13.809 -21.618 -12.611 218 HG21 VAL 31 HG21 VAL 31 11.280 -22.945 -12.436 219 HG22 VAL 31 HG22 VAL 31 12.192 -24.342 -11.862 220 HG23 VAL 31 HG23 VAL 31 10.950 -23.619 -10.841 221 H GLU 32 H GLU 32 12.899 -24.000 -7.259 222 HA GLU 32 HA GLU 32 10.080 -23.872 -7.016 223 HB2 GLU 32 HB2 GLU 32 10.407 -24.586 -4.722 224 HB3 GLU 32 HB1 GLU 32 11.478 -25.501 -5.795 225 HG2 GLU 32 HG1 GLU 32 13.358 -24.069 -5.170 226 HG3 GLU 32 HG2 GLU 32 12.291 -23.153 -4.096 227 HE2 GLU 32 HE2 GLU 32 14.038 -25.870 -2.294 228 H SER 33 H SER 33 12.665 -21.691 -6.182 229 HA SER 33 HA SER 33 10.667 -19.707 -5.361 230 HB2 SER 33 HB2 SER 33 13.214 -20.380 -3.859 231 HB3 SER 33 HB1 SER 33 12.240 -18.931 -3.562 232 HG SER 33 HG SER 33 10.445 -20.506 -3.253 233 H ASP 34 H ASP 34 12.519 -20.332 -7.717 234 HA ASP 34 HA ASP 34 14.232 -17.984 -7.767 235 HB2 ASP 34 HB2 ASP 34 14.995 -20.182 -8.680 236 HB3 ASP 34 HB1 ASP 34 13.760 -20.035 -9.938 237 HD2 ASP 34 HD2 ASP 34 16.357 -18.580 -11.705 238 H LEU 35 H LEU 35 11.201 -19.097 -9.090 239 HA LEU 35 HA LEU 35 10.866 -17.292 -11.185 240 HB2 LEU 35 HB2 LEU 35 9.062 -18.879 -9.438 241 HB3 LEU 35 HB1 LEU 35 8.339 -17.550 -10.361 242 HG LEU 35 HG LEU 35 8.102 -19.692 -11.514 243 HD11 LEU 35 HD11 LEU 35 8.591 -18.896 -13.622 244 HD12 LEU 35 HD12 LEU 35 10.099 -18.141 -13.105 245 HD13 LEU 35 HD13 LEU 35 8.553 -17.411 -12.671 246 HD21 LEU 35 HD21 LEU 35 10.404 -20.467 -10.533 247 HD22 LEU 35 HD22 LEU 35 11.039 -19.780 -12.029 248 HD23 LEU 35 HD23 LEU 35 9.842 -21.076 -12.090 249 H ASP 36 H ASP 36 10.730 -16.809 -7.767 250 HA ASP 36 HA ASP 36 9.113 -14.586 -7.509 251 HB2 ASP 36 HB2 ASP 36 10.136 -14.196 -5.448 252 HB3 ASP 36 HB1 ASP 36 10.419 -15.921 -5.714 253 HD2 ASP 36 HD2 ASP 36 13.845 -15.174 -6.534 254 H MET 37 H MET 37 12.315 -14.834 -8.866 255 HA MET 37 HA MET 37 12.762 -11.986 -8.912 256 HB2 MET 37 HB2 MET 37 14.712 -13.320 -8.715 257 HB3 MET 37 HB1 MET 37 14.237 -14.338 -10.084 258 HG2 MET 37 HG1 MET 37 15.112 -12.943 -11.605 259 HG3 MET 37 HG2 MET 37 14.518 -11.512 -10.759 260 HE1 MET 37 HE1 MET 37 17.042 -9.905 -9.209 261 HE2 MET 37 HE2 MET 37 17.486 -10.053 -10.910 262 HE3 MET 37 HE3 MET 37 15.786 -9.961 -10.447 263 H GLN 38 H GLN 38 11.629 -14.461 -11.130 264 HA GLN 38 HA GLN 38 11.719 -12.880 -13.479 265 HB2 GLN 38 HB2 GLN 38 10.443 -15.448 -12.667 266 HB3 GLN 38 HB1 GLN 38 9.825 -14.642 -14.118 267 HG2 GLN 38 HG1 GLN 38 11.573 -16.363 -14.555 268 HG3 GLN 38 HG2 GLN 38 11.939 -14.753 -15.189 269 HE21 GLN 38 HE21 GLN 38 12.810 -17.193 -12.906 270 HE22 GLN 38 HE22 GLN 38 14.289 -16.472 -12.379 271 H GLN 39 H GLN 39 9.481 -13.114 -10.847 272 HA GLN 39 HA GLN 39 7.128 -12.209 -12.000 273 HB2 GLN 39 HB2 GLN 39 8.259 -11.660 -9.248 274 HB3 GLN 39 HB1 GLN 39 6.594 -11.301 -9.731 275 HG2 GLN 39 HG1 GLN 39 7.781 -14.065 -9.886 276 HG3 GLN 39 HG2 GLN 39 6.946 -13.443 -8.455 277 HE21 GLN 39 HE21 GLN 39 6.585 -14.347 -11.808 278 HE22 GLN 39 HE22 GLN 39 4.866 -14.521 -11.780 279 H ALA 40 H ALA 40 9.993 -10.427 -11.047 280 HA ALA 40 HA ALA 40 8.922 -7.828 -11.181 281 HB1 ALA 40 HB1 ALA 40 11.109 -8.453 -10.155 282 HB2 ALA 40 HB2 ALA 40 11.181 -7.051 -11.222 283 HB3 ALA 40 HB3 ALA 40 11.765 -8.618 -11.783 284 H MET 41 H MET 41 9.889 -10.070 -13.635 285 HA MET 41 HA MET 41 10.119 -8.085 -15.716 286 HB2 MET 41 HB2 MET 41 9.933 -11.100 -15.931 287 HB3 MET 41 HB1 MET 41 10.425 -9.986 -17.216 288 HG2 MET 41 HG1 MET 41 12.365 -9.296 -15.828 289 HG3 MET 41 HG2 MET 41 11.897 -10.524 -14.649 290 HE1 MET 41 HE1 MET 41 13.376 -11.206 -18.907 291 HE2 MET 41 HE2 MET 41 12.613 -9.768 -18.228 292 HE3 MET 41 HE3 MET 41 14.298 -10.131 -17.856 293 H LEU 42 H LEU 42 7.767 -10.555 -14.752 294 HA LEU 42 HA LEU 42 5.955 -10.051 -16.877 295 HB2 LEU 42 HB2 LEU 42 5.712 -11.413 -14.204 296 HB3 LEU 42 HB1 LEU 42 4.316 -11.209 -15.277 297 HG LEU 42 HG LEU 42 5.642 -12.455 -17.036 298 HD11 LEU 42 HD11 LEU 42 7.406 -12.948 -14.647 299 HD12 LEU 42 HD12 LEU 42 7.859 -12.255 -16.203 300 HD13 LEU 42 HD13 LEU 42 7.414 -13.957 -16.093 301 HD21 LEU 42 HD21 LEU 42 4.830 -13.809 -14.470 302 HD22 LEU 42 HD22 LEU 42 5.202 -14.669 -15.965 303 HD23 LEU 42 HD23 LEU 42 3.842 -13.546 -15.906 304 H THR 43 H THR 43 6.522 -8.557 -13.803 305 HA THR 43 HA THR 43 4.015 -7.058 -13.944 306 HB THR 43 HB THR 43 4.742 -8.033 -11.763 307 HG1 THR 43 HG1 THR 43 3.352 -6.299 -11.636 308 HG21 THR 43 HG21 THR 43 6.756 -5.840 -11.528 309 HG22 THR 43 HG22 THR 43 7.217 -7.355 -12.304 310 HG23 THR 43 HG23 THR 43 6.639 -7.357 -10.638 311 H ASN 44 H ASN 44 6.356 -6.674 -15.781 312 HA ASN 44 HA ASN 44 7.654 -4.248 -15.143 313 HB2 ASN 44 HB2 ASN 44 8.494 -5.847 -16.831 314 HB3 ASN 44 HB1 ASN 44 7.122 -5.445 -17.871 315 HD21 ASN 44 HD21 ASN 44 9.521 -3.628 -15.984 316 HD22 ASN 44 HD22 ASN 44 9.950 -2.544 -17.258 317 H LYS 45 H LYS 45 6.414 -2.533 -14.625 318 HA LYS 45 HA LYS 45 3.911 -1.871 -15.593 319 HB2 LYS 45 HB2 LYS 45 4.142 0.149 -14.509 320 HB3 LYS 45 HB1 LYS 45 5.378 -0.821 -13.692 321 HG2 LYS 45 HG1 LYS 45 5.845 1.160 -15.924 322 HG3 LYS 45 HG2 LYS 45 6.238 1.379 -14.208 323 HD2 LYS 45 HD1 LYS 45 7.396 -0.795 -15.966 324 HD3 LYS 45 HD2 LYS 45 8.196 0.746 -15.604 325 HE2 LYS 45 HE1 LYS 45 7.308 -1.235 -13.496 326 HE3 LYS 45 HE2 LYS 45 8.939 -1.166 -14.176 327 HZ1 LYS 45 3HZ LYS 45 7.569 0.882 -12.538 328 HZ2 LYS 45 1HZ LYS 45 8.958 1.232 -13.437 329 HZ3 LYS 45 2HZ LYS 45 9.017 0.074 -12.206 330 H ASP 46 H ASP 46 3.441 0.200 -16.881 331 HA ASP 46 HA ASP 46 5.271 0.540 -19.140 332 HB2 ASP 46 HB2 ASP 46 2.445 -0.466 -19.272 333 HB3 ASP 46 HB1 ASP 46 3.094 0.505 -20.601 334 HD2 ASP 46 HD2 ASP 46 4.488 -3.167 -20.108 335 H GLU 47 H GLU 47 4.525 2.378 -20.578 336 HA GLU 47 HA GLU 47 4.176 4.694 -19.000 337 HB2 GLU 47 HB2 GLU 47 3.787 4.446 -21.990 338 HB3 GLU 47 HB1 GLU 47 4.168 5.917 -21.081 339 HG2 GLU 47 HG1 GLU 47 6.321 4.794 -20.383 340 HG3 GLU 47 HG2 GLU 47 5.944 3.548 -21.582 341 HE2 GLU 47 HE2 GLU 47 7.281 5.484 -24.055 342 H LYS 48 H LYS 48 2.009 3.157 -21.378 343 HA LYS 48 HA LYS 48 -0.171 4.828 -21.127 344 HB2 LYS 48 HB2 LYS 48 -1.537 2.736 -21.696 345 HB3 LYS 48 HB1 LYS 48 -0.272 3.219 -22.836 346 HG2 LYS 48 HG1 LYS 48 0.060 0.946 -22.707 347 HG3 LYS 48 HG2 LYS 48 1.209 1.556 -21.504 348 HD2 LYS 48 HD1 LYS 48 0.124 0.593 -19.787 349 HD3 LYS 48 HD2 LYS 48 -1.464 1.057 -20.423 350 HE2 LYS 48 HE1 LYS 48 0.221 -1.278 -21.362 351 HE3 LYS 48 HE2 LYS 48 -1.231 -1.367 -20.356 352 HZ1 LYS 48 3HZ LYS 48 -1.885 0.095 -22.638 353 HZ2 LYS 48 1HZ LYS 48 -2.438 -1.442 -22.192 354 HZ3 LYS 48 2HZ LYS 48 -1.056 -1.285 -23.156 355 H VAL 49 H VAL 49 0.946 2.332 -18.961 356 HA VAL 49 HA VAL 49 -1.422 2.081 -17.421 357 HB VAL 49 HB VAL 49 1.458 1.411 -16.878 358 HG11 VAL 49 HG11 VAL 49 0.961 1.735 -14.696 359 HG12 VAL 49 HG12 VAL 49 -0.779 1.607 -14.960 360 HG13 VAL 49 HG13 VAL 49 0.210 0.149 -14.867 361 HG21 VAL 49 HG21 VAL 49 -0.941 0.010 -17.820 362 HG22 VAL 49 HG22 VAL 49 0.764 -0.343 -18.101 363 HG23 VAL 49 HG23 VAL 49 -0.008 -0.862 -16.604 364 H LEU 50 H LEU 50 1.401 4.178 -17.213 365 HA LEU 50 HA LEU 50 0.965 5.261 -14.677 366 HB2 LEU 50 HB2 LEU 50 2.085 6.716 -17.076 367 HB3 LEU 50 HB1 LEU 50 2.367 7.090 -15.367 368 HG LEU 50 HG LEU 50 3.382 4.690 -16.885 369 HD11 LEU 50 HD11 LEU 50 4.521 6.885 -17.251 370 HD12 LEU 50 HD12 LEU 50 5.548 5.629 -16.558 371 HD13 LEU 50 HD13 LEU 50 4.902 6.908 -15.529 372 HD21 LEU 50 HD21 LEU 50 3.229 5.291 -13.975 373 HD22 LEU 50 HD22 LEU 50 4.670 4.485 -14.595 374 HD23 LEU 50 HD23 LEU 50 3.081 3.751 -14.822 375 H LYS 51 H LYS 51 -0.476 6.021 -17.781 376 HA LYS 51 HA LYS 51 -1.623 8.477 -17.300 377 HB2 LYS 51 HB2 LYS 51 -2.716 6.106 -18.827 378 HB3 LYS 51 HB1 LYS 51 -3.445 7.719 -18.868 379 HG2 LYS 51 HG1 LYS 51 -0.550 7.384 -19.546 380 HG3 LYS 51 HG2 LYS 51 -1.801 6.991 -20.740 381 HD2 LYS 51 HD1 LYS 51 -2.753 9.262 -20.456 382 HD3 LYS 51 HD2 LYS 51 -1.428 9.642 -19.342 383 HE2 LYS 51 HE1 LYS 51 0.147 8.972 -21.257 384 HE3 LYS 51 HE2 LYS 51 -1.287 9.073 -22.289 385 HZ1 LYS 51 3HZ LYS 51 0.344 11.164 -21.352 386 HZ2 LYS 51 1HZ LYS 51 -1.223 11.392 -20.755 387 HZ3 LYS 51 2HZ LYS 51 -0.966 11.244 -22.421 388 H ALA 52 H ALA 52 -2.641 5.317 -16.164 389 HA ALA 52 HA ALA 52 -5.167 6.168 -15.147 390 HB1 ALA 52 HB1 ALA 52 -4.301 3.884 -13.732 391 HB2 ALA 52 HB2 ALA 52 -3.737 3.714 -15.395 392 HB3 ALA 52 HB3 ALA 52 -5.451 3.971 -15.066 393 H LEU 53 H LEU 53 -1.929 5.843 -13.796 394 HA LEU 53 HA LEU 53 -2.582 6.198 -11.091 395 HB2 LEU 53 HB2 LEU 53 -0.051 7.134 -12.443 396 HB3 LEU 53 HB1 LEU 53 -0.271 6.695 -10.741 397 HG LEU 53 HG LEU 53 -0.351 4.800 -13.087 398 HD11 LEU 53 HD11 LEU 53 1.668 5.075 -10.866 399 HD12 LEU 53 HD12 LEU 53 1.892 5.656 -12.516 400 HD13 LEU 53 HD13 LEU 53 1.718 3.928 -12.205 401 HD21 LEU 53 HD21 LEU 53 -1.404 3.364 -11.768 402 HD22 LEU 53 HD22 LEU 53 -1.476 4.573 -10.486 403 HD23 LEU 53 HD23 LEU 53 -0.095 3.481 -10.593 404 H GLU 54 H GLU 54 -2.520 8.411 -13.715 405 HA GLU 54 HA GLU 54 -2.061 10.808 -12.285 406 HB2 GLU 54 HB2 GLU 54 -3.572 10.340 -14.867 407 HB3 GLU 54 HB1 GLU 54 -3.059 11.922 -14.256 408 HG2 GLU 54 HG1 GLU 54 -1.027 9.768 -14.665 409 HG3 GLU 54 HG2 GLU 54 -1.639 10.684 -16.050 410 HE2 GLU 54 HE2 GLU 54 0.731 13.048 -15.330 411 H ARG 55 H ARG 55 -4.990 9.012 -13.100 412 HA ARG 55 HA ARG 55 -6.747 10.982 -11.966 413 HB2 ARG 55 HB2 ARG 55 -7.675 9.706 -13.721 414 HB3 ARG 55 HB1 ARG 55 -7.138 8.182 -12.999 415 HG2 ARG 55 HG1 ARG 55 -9.547 8.461 -12.774 416 HG3 ARG 55 HG2 ARG 55 -8.748 8.445 -11.193 417 HD2 ARG 55 HD1 ARG 55 -9.320 10.580 -10.726 418 HD3 ARG 55 HD2 ARG 55 -9.032 11.110 -12.390 419 HE ARG 55 HE ARG 55 -11.341 9.563 -12.412 420 HH11 ARG 55 1HH1 ARG 55 -10.227 12.559 -11.034 421 HH12 ARG 55 2HH1 ARG 55 -11.798 13.290 -11.021 422 HH21 ARG 55 1HH2 ARG 55 -13.416 10.513 -12.399 423 HH22 ARG 55 2HH2 ARG 55 -13.611 12.124 -11.797 424 H THR 56 H THR 56 -5.202 8.031 -10.890 425 HA THR 56 HA THR 56 -6.743 7.761 -8.494 426 HB THR 56 HB THR 56 -5.338 5.967 -7.917 427 HG1 THR 56 HG1 THR 56 -3.414 7.190 -9.623 428 HG21 THR 56 HG21 THR 56 -5.865 4.652 -9.649 429 HG22 THR 56 HG22 THR 56 -4.783 5.523 -10.736 430 HG23 THR 56 HG23 THR 56 -6.421 6.114 -10.460 431 H ARG 57 H ARG 57 -3.535 9.061 -9.268 432 HA ARG 57 HA ARG 57 -2.633 9.607 -6.707 433 HB2 ARG 57 HB2 ARG 57 -1.146 11.233 -7.696 434 HB3 ARG 57 HB1 ARG 57 -1.280 9.835 -8.774 435 HG2 ARG 57 HG1 ARG 57 -2.488 10.987 -10.369 436 HG3 ARG 57 HG2 ARG 57 -3.043 12.202 -9.205 437 HD2 ARG 57 HD1 ARG 57 -1.312 13.012 -10.847 438 HD3 ARG 57 HD2 ARG 57 -0.914 13.250 -9.141 439 HE ARG 57 HE ARG 57 0.136 10.798 -10.171 440 HH11 ARG 57 1HH1 ARG 57 0.672 14.231 -9.955 441 HH12 ARG 57 2HH1 ARG 57 2.389 14.106 -10.141 442 HH21 ARG 57 1HH2 ARG 57 2.397 10.621 -10.417 443 HH22 ARG 57 2HH2 ARG 57 3.369 12.053 -10.404 444 H GLN 58 H GLN 58 -5.080 11.195 -8.573 445 HA GLN 58 HA GLN 58 -5.115 13.684 -7.253 446 HB2 GLN 58 HB2 GLN 58 -7.252 12.137 -8.724 447 HB3 GLN 58 HB1 GLN 58 -7.516 13.763 -8.075 448 HG2 GLN 58 HG1 GLN 58 -5.318 13.096 -10.027 449 HG3 GLN 58 HG2 GLN 58 -6.928 13.651 -10.508 450 HE21 GLN 58 HE21 GLN 58 -4.018 14.528 -8.763 451 HE22 GLN 58 HE22 GLN 58 -4.242 16.238 -8.866 452 H LEU 59 H LEU 59 -6.656 10.598 -6.548 453 HA LEU 59 HA LEU 59 -7.956 11.739 -4.190 454 HB2 LEU 59 HB2 LEU 59 -8.135 8.888 -5.150 455 HB3 LEU 59 HB1 LEU 59 -9.242 9.761 -4.074 456 HG LEU 59 HG LEU 59 -9.123 11.067 -6.633 457 HD11 LEU 59 HD11 LEU 59 -10.208 9.259 -7.937 458 HD12 LEU 59 HD12 LEU 59 -9.777 8.126 -6.657 459 HD13 LEU 59 HD13 LEU 59 -8.511 8.945 -7.572 460 HD21 LEU 59 HD21 LEU 59 -10.894 11.145 -4.826 461 HD22 LEU 59 HD22 LEU 59 -11.412 9.558 -5.396 462 HD23 LEU 59 HD23 LEU 59 -11.476 10.949 -6.479 463 H ASP 60 H ASP 60 -4.981 11.000 -4.665 464 HA ASP 60 HA ASP 60 -3.245 10.331 -3.354 465 HB2 ASP 60 HB2 ASP 60 -4.710 11.500 -1.596 466 HB3 ASP 60 HB1 ASP 60 -5.204 9.871 -1.111 467 HD2 ASP 60 HD2 ASP 60 -2.429 9.657 0.861 468 H ILE 61 H ILE 61 -3.274 8.454 -4.814 469 HA ILE 61 HA ILE 61 -3.705 5.984 -3.285 470 HB ILE 61 HB ILE 61 -4.309 6.155 -6.231 471 HG12 ILE 61 HG11 ILE 61 -6.275 6.242 -3.928 472 HG13 ILE 61 HG12 ILE 61 -5.855 7.621 -4.959 473 HG21 ILE 61 HG21 ILE 61 -3.726 3.974 -4.927 474 HG22 ILE 61 HG22 ILE 61 -5.379 4.117 -4.330 475 HG23 ILE 61 HG23 ILE 61 -5.076 3.988 -6.062 476 HD11 ILE 61 HD11 ILE 61 -6.678 5.381 -6.563 477 HD12 ILE 61 HD12 ILE 61 -7.908 5.797 -5.370 478 HD13 ILE 61 HD13 ILE 61 -7.324 7.020 -6.497 479 HA PRO 62 HA PRO 62 0.554 5.539 -4.547 480 HB2 PRO 62 HB2 PRO 62 0.989 3.198 -3.194 481 HB3 PRO 62 HB1 PRO 62 0.948 4.778 -2.415 482 HG2 PRO 62 HG1 PRO 62 -1.218 2.717 -2.650 483 HG3 PRO 62 HG2 PRO 62 -0.706 3.674 -1.210 484 HD2 PRO 62 HD1 PRO 62 -2.900 4.302 -2.682 485 HD3 PRO 62 HD2 PRO 62 -1.888 5.528 -1.900 486 H ASP 63 H ASP 63 1.412 4.610 -6.307 487 HA ASP 63 HA ASP 63 -0.072 3.024 -8.054 488 HB2 ASP 63 HB2 ASP 63 2.281 2.517 -9.053 489 HB3 ASP 63 HB1 ASP 63 1.670 4.176 -9.077 490 HD2 ASP 63 HD2 ASP 63 4.691 3.350 -6.640 491 H GLU 64 H GLU 64 1.718 2.152 -5.269 492 HA GLU 64 HA GLU 64 2.458 -0.478 -5.895 493 HB2 GLU 64 HB2 GLU 64 1.587 0.468 -3.162 494 HB3 GLU 64 HB1 GLU 64 2.741 -0.817 -3.553 495 HG2 GLU 64 HG1 GLU 64 4.226 0.933 -4.563 496 HG3 GLU 64 HG2 GLU 64 3.119 2.144 -3.903 497 HE2 GLU 64 HE2 GLU 64 4.650 0.076 -0.935 498 H LYS 65 H LYS 65 -0.601 0.916 -5.018 499 HA LYS 65 HA LYS 65 -1.801 -1.768 -4.887 500 HB2 LYS 65 HB2 LYS 65 -3.465 -0.958 -3.490 501 HB3 LYS 65 HB1 LYS 65 -2.048 -0.036 -2.963 502 HG2 LYS 65 HG1 LYS 65 -2.829 1.785 -4.576 503 HG3 LYS 65 HG2 LYS 65 -4.360 0.894 -4.628 504 HD2 LYS 65 HD1 LYS 65 -3.047 1.868 -2.083 505 HD3 LYS 65 HD2 LYS 65 -4.319 2.741 -2.955 506 HE2 LYS 65 HE1 LYS 65 -5.950 1.161 -2.451 507 HE3 LYS 65 HE2 LYS 65 -4.752 -0.107 -2.154 508 HZ1 LYS 65 3HZ LYS 65 -5.753 1.946 -0.359 509 HZ2 LYS 65 1HZ LYS 65 -4.098 1.617 -0.245 510 HZ3 LYS 65 2HZ LYS 65 -5.224 0.375 -0.022 511 H THR 66 H THR 66 -1.757 1.242 -6.597 512 HA THR 66 HA THR 66 -4.207 0.826 -8.027 513 HB THR 66 HB THR 66 -1.948 2.650 -8.849 514 HG1 THR 66 HG1 THR 66 -2.531 3.088 -6.677 515 HG21 THR 66 HG21 THR 66 -3.639 3.911 -9.969 516 HG22 THR 66 HG22 THR 66 -4.925 2.953 -9.235 517 HG23 THR 66 HG23 THR 66 -3.857 2.224 -10.434 518 H MET 67 H MET 67 -0.810 0.136 -8.581 519 HA MET 67 HA MET 67 -0.745 -0.366 -11.280 520 HB2 MET 67 HB2 MET 67 0.704 -1.461 -8.923 521 HB3 MET 67 HB1 MET 67 0.863 -2.340 -10.450 522 HG2 MET 67 HG1 MET 67 1.568 0.550 -9.941 523 HG3 MET 67 HG2 MET 67 2.679 -0.791 -10.231 524 HE1 MET 67 HE1 MET 67 1.584 -2.456 -12.301 525 HE2 MET 67 HE2 MET 67 0.017 -1.761 -12.713 526 HE3 MET 67 HE3 MET 67 1.321 -1.760 -13.901 527 HA PRO 68 HA PRO 68 -2.260 -4.895 -10.515 528 HB2 PRO 68 HB2 PRO 68 -3.294 -5.473 -8.046 529 HB3 PRO 68 HB1 PRO 68 -1.586 -5.643 -8.450 530 HG2 PRO 68 HG1 PRO 68 -2.998 -3.386 -7.069 531 HG3 PRO 68 HG2 PRO 68 -1.445 -4.194 -6.636 532 HD2 PRO 68 HD1 PRO 68 -1.545 -1.795 -7.905 533 HD3 PRO 68 HD2 PRO 68 -0.266 -2.984 -8.204 534 H VAL 69 H VAL 69 -3.866 -2.077 -9.375 535 HA VAL 69 HA VAL 69 -6.532 -3.168 -9.535 536 HB VAL 69 HB VAL 69 -5.469 -0.386 -9.110 537 HG11 VAL 69 HG11 VAL 69 -8.162 -1.237 -9.947 538 HG12 VAL 69 HG12 VAL 69 -8.100 -0.112 -8.589 539 HG13 VAL 69 HG13 VAL 69 -7.355 0.319 -10.128 540 HG21 VAL 69 HG21 VAL 69 -7.350 -1.692 -7.245 541 HG22 VAL 69 HG22 VAL 69 -5.738 -2.398 -7.354 542 HG23 VAL 69 HG23 VAL 69 -5.930 -0.700 -6.916 543 H LEU 70 H LEU 70 -4.748 -0.674 -11.360 544 HA LEU 70 HA LEU 70 -6.661 -0.356 -13.384 545 HB2 LEU 70 HB2 LEU 70 -4.885 0.715 -14.673 546 HB3 LEU 70 HB1 LEU 70 -4.899 1.263 -12.987 547 HG LEU 70 HG LEU 70 -3.062 -0.711 -12.830 548 HD11 LEU 70 HD11 LEU 70 -2.399 0.554 -15.458 549 HD12 LEU 70 HD12 LEU 70 -3.368 -0.918 -15.391 550 HD13 LEU 70 HD13 LEU 70 -1.738 -0.904 -14.717 551 HD21 LEU 70 HD21 LEU 70 -2.710 2.192 -13.544 552 HD22 LEU 70 HD22 LEU 70 -1.371 1.139 -13.086 553 HD23 LEU 70 HD23 LEU 70 -2.677 1.454 -11.942 554 H MET 71 H MET 71 -3.788 -2.427 -13.206 555 HA MET 71 HA MET 71 -3.926 -3.480 -15.798 556 HB2 MET 71 HB2 MET 71 -2.381 -5.111 -15.098 557 HB3 MET 71 HB1 MET 71 -2.035 -3.694 -14.097 558 HG2 MET 71 HG1 MET 71 -2.034 -5.203 -12.428 559 HG3 MET 71 HG2 MET 71 -3.778 -4.937 -12.495 560 HE1 MET 71 HE1 MET 71 -0.998 -7.591 -14.179 561 HE2 MET 71 HE2 MET 71 -0.994 -7.119 -12.479 562 HE3 MET 71 HE3 MET 71 -1.554 -8.726 -12.948 563 H LYS 72 H LYS 72 -5.825 -4.104 -12.990 564 HA LYS 72 HA LYS 72 -6.767 -6.691 -13.733 565 HB2 LYS 72 HB2 LYS 72 -6.793 -5.614 -11.410 566 HB3 LYS 72 HB1 LYS 72 -8.231 -4.739 -11.965 567 HG2 LYS 72 HG1 LYS 72 -9.017 -6.619 -10.772 568 HG3 LYS 72 HG2 LYS 72 -9.260 -6.973 -12.491 569 HD2 LYS 72 HD1 LYS 72 -8.375 -8.948 -11.487 570 HD3 LYS 72 HD2 LYS 72 -7.080 -8.218 -12.453 571 HE2 LYS 72 HE1 LYS 72 -5.978 -7.365 -10.533 572 HE3 LYS 72 HE2 LYS 72 -7.385 -7.685 -9.510 573 HZ1 LYS 72 3HZ LYS 72 -5.995 -9.427 -8.999 574 HZ2 LYS 72 1HZ LYS 72 -5.409 -9.586 -10.578 575 HZ3 LYS 72 2HZ LYS 72 -6.965 -10.127 -10.194 576 H LEU 73 H LEU 73 -7.727 -3.418 -14.464 577 HA LEU 73 HA LEU 73 -10.303 -4.112 -15.513 578 HB2 LEU 73 HB2 LEU 73 -8.812 -1.617 -16.252 579 HB3 LEU 73 HB1 LEU 73 -10.553 -1.863 -16.033 580 HG LEU 73 HG LEU 73 -8.509 -1.774 -13.815 581 HD11 LEU 73 HD11 LEU 73 -10.507 0.258 -14.791 582 HD12 LEU 73 HD12 LEU 73 -8.750 0.411 -14.751 583 HD13 LEU 73 HD13 LEU 73 -9.665 0.358 -13.244 584 HD21 LEU 73 HD21 LEU 73 -10.482 -1.703 -12.348 585 HD22 LEU 73 HD22 LEU 73 -10.380 -3.211 -13.257 586 HD23 LEU 73 HD23 LEU 73 -11.519 -1.958 -13.752 587 H LEU 74 H LEU 74 -7.209 -3.144 -16.989 588 HA LEU 74 HA LEU 74 -7.981 -3.389 -19.656 589 HB2 LEU 74 HB2 LEU 74 -5.331 -3.649 -18.260 590 HB3 LEU 74 HB1 LEU 74 -5.481 -3.863 -20.012 591 HG LEU 74 HG LEU 74 -4.726 -1.630 -19.549 592 HD11 LEU 74 HD11 LEU 74 -7.109 -2.247 -20.958 593 HD12 LEU 74 HD12 LEU 74 -5.943 -0.963 -21.273 594 HD13 LEU 74 HD13 LEU 74 -7.312 -0.667 -20.202 595 HD21 LEU 74 HD21 LEU 74 -7.227 -1.275 -17.900 596 HD22 LEU 74 HD22 LEU 74 -5.979 -0.066 -18.206 597 HD23 LEU 74 HD23 LEU 74 -5.605 -1.495 -17.242 598 H GLU 75 H GLU 75 -7.261 -5.805 -17.297 599 HA GLU 75 HA GLU 75 -6.493 -7.949 -18.900 600 HB2 GLU 75 HB2 GLU 75 -7.682 -7.608 -16.218 601 HB3 GLU 75 HB1 GLU 75 -7.954 -9.187 -16.971 602 HG2 GLU 75 HG1 GLU 75 -5.206 -7.990 -16.840 603 HG3 GLU 75 HG2 GLU 75 -5.895 -8.874 -15.471 604 HE2 GLU 75 HE2 GLU 75 -4.411 -10.926 -18.414 605 H GLU 76 H GLU 76 -9.773 -7.087 -17.797 606 HA GLU 76 HA GLU 76 -11.001 -9.052 -19.491 607 HB2 GLU 76 HB2 GLU 76 -12.362 -6.732 -18.114 608 HB3 GLU 76 HB1 GLU 76 -13.086 -8.262 -18.633 609 HG2 GLU 76 HG1 GLU 76 -10.983 -8.015 -16.483 610 HG3 GLU 76 HG2 GLU 76 -12.727 -8.095 -16.188 611 HE2 GLU 76 HE2 GLU 76 -12.768 -11.507 -16.547 612 H ALA 77 H ALA 77 -10.224 -5.665 -19.710 613 HA ALA 77 HA ALA 77 -11.880 -5.223 -22.040 614 HB1 ALA 77 HB1 ALA 77 -11.132 -3.530 -20.164 615 HB2 ALA 77 HB2 ALA 77 -11.385 -3.000 -21.827 616 HB3 ALA 77 HB3 ALA 77 -9.751 -3.306 -21.238 617 H GLY 78 H GLY 78 -9.172 -6.936 -21.654 618 HA2 GLY 78 HA2 GLY 78 -7.495 -7.642 -23.052 619 HA3 GLY 78 3HA GLY 78 -8.523 -7.083 -24.363 620 H GLY 79 H GLY 79 -7.557 -4.763 -22.006 621 HA2 GLY 79 HA2 GLY 79 -5.746 -3.261 -22.015 622 HA3 GLY 79 3HA GLY 79 -5.251 -3.902 -23.575 623 H ASN 80 H ASN 80 -8.440 -2.695 -22.628 624 HA ASN 80 HA ASN 80 -8.145 -0.600 -24.679 625 HB2 ASN 80 HB2 ASN 80 -9.954 -2.635 -24.707 626 HB3 ASN 80 HB1 ASN 80 -10.877 -1.380 -23.873 627 HD21 ASN 80 HD21 ASN 80 -10.702 0.836 -24.946 628 HD22 ASN 80 HD22 ASN 80 -10.880 0.855 -26.665 629 H TRP 81 H TRP 81 -7.648 1.210 -23.587 630 HA TRP 81 HA TRP 81 -8.806 1.789 -21.007 631 HB2 TRP 81 HB2 TRP 81 -7.064 3.517 -22.788 632 HB3 TRP 81 HB1 TRP 81 -7.455 3.834 -21.097 633 HD1 TRP 81 HD1 TRP 81 -5.477 1.287 -23.221 634 HE1 TRP 81 HE1 TRP 81 -3.641 0.261 -21.737 635 HE3 TRP 81 HE3 TRP 81 -6.740 3.440 -18.760 636 HZ2 TRP 81 2HZ TRP 81 -2.835 0.352 -19.033 637 HZ3 TRP 81 3HZ TRP 81 -5.387 2.919 -16.773 638 HH2 TRP 81 HH TRP 81 -3.475 1.405 -16.909 639 H SER 82 H SER 82 -9.542 2.445 -24.291 640 HA SER 82 HA SER 82 -10.830 4.882 -24.216 641 HB2 SER 82 HB2 SER 82 -10.448 3.135 -26.164 642 HB3 SER 82 HB1 SER 82 -12.100 2.646 -25.745 643 HG SER 82 HG SER 82 -12.607 4.244 -27.027 644 H TYR 83 H TYR 83 -12.240 1.682 -23.549 645 HA TYR 83 HA TYR 83 -14.749 2.822 -22.721 646 HB2 TYR 83 HB2 TYR 83 -15.012 0.724 -23.699 647 HB3 TYR 83 HB1 TYR 83 -13.620 0.046 -22.851 648 HD1 TYR 83 HD2 TYR 83 -13.796 -0.747 -20.558 649 HD2 TYR 83 HD1 TYR 83 -17.178 0.859 -22.579 650 HE1 TYR 83 HE2 TYR 83 -15.270 -1.693 -18.831 651 HE2 TYR 83 HE1 TYR 83 -18.662 -0.081 -20.857 652 HH TYR 83 HH TYR 83 -17.459 -1.396 -17.916 653 H ILE 84 H ILE 84 -11.967 1.321 -21.128 654 HA ILE 84 HA ILE 84 -12.955 1.272 -18.519 655 HB ILE 84 HB ILE 84 -10.114 1.633 -19.474 656 HG12 ILE 84 HG11 ILE 84 -11.585 -0.812 -18.458 657 HG13 ILE 84 HG12 ILE 84 -11.257 -0.463 -20.165 658 HG21 ILE 84 HG21 ILE 84 -11.229 1.145 -16.727 659 HG22 ILE 84 HG22 ILE 84 -9.570 0.735 -17.162 660 HG23 ILE 84 HG23 ILE 84 -10.117 2.409 -17.251 661 HD11 ILE 84 HD11 ILE 84 -9.250 -1.375 -20.026 662 HD12 ILE 84 HD12 ILE 84 -8.819 -0.332 -18.670 663 HD13 ILE 84 HD13 ILE 84 -9.634 -1.868 -18.377 664 H LYS 85 H LYS 85 -11.843 3.910 -20.455 665 HA LYS 85 HA LYS 85 -11.699 5.686 -18.129 666 HB2 LYS 85 HB2 LYS 85 -10.388 7.103 -19.358 667 HB3 LYS 85 HB1 LYS 85 -9.999 5.570 -20.155 668 HG2 LYS 85 HG1 LYS 85 -12.063 6.266 -21.678 669 HG3 LYS 85 HG2 LYS 85 -11.559 7.882 -21.151 670 HD2 LYS 85 HD1 LYS 85 -9.910 5.818 -22.618 671 HD3 LYS 85 HD2 LYS 85 -10.412 7.419 -23.187 672 HE2 LYS 85 HE1 LYS 85 -8.445 6.794 -20.976 673 HE3 LYS 85 HE2 LYS 85 -8.104 7.534 -22.548 674 HZ1 LYS 85 3HZ LYS 85 -9.969 9.190 -21.522 675 HZ2 LYS 85 1HZ LYS 85 -8.299 9.447 -21.440 676 HZ3 LYS 85 2HZ LYS 85 -9.110 8.742 -20.135 677 H LEU 86 H LEU 86 -14.008 4.565 -20.142 678 HA LEU 86 HA LEU 86 -15.392 6.767 -21.104 679 HB2 LEU 86 HB2 LEU 86 -15.952 4.444 -21.647 680 HB3 LEU 86 HB1 LEU 86 -16.527 4.205 -19.988 681 HG LEU 86 HG LEU 86 -18.099 6.263 -20.718 682 HD11 LEU 86 HD11 LEU 86 -18.840 5.255 -23.105 683 HD12 LEU 86 HD12 LEU 86 -17.093 5.045 -23.201 684 HD13 LEU 86 HD13 LEU 86 -17.774 6.645 -22.911 685 HD21 LEU 86 HD21 LEU 86 -18.862 4.181 -19.740 686 HD22 LEU 86 HD22 LEU 86 -18.587 3.336 -21.263 687 HD23 LEU 86 HD23 LEU 86 -19.836 4.577 -21.156 688 H ASP 87 H ASP 87 -15.043 5.617 -17.858 689 HA ASP 87 HA ASP 87 -16.904 7.712 -16.944 690 HB2 ASP 87 HB2 ASP 87 -16.268 5.294 -15.276 691 HB3 ASP 87 HB1 ASP 87 -17.674 6.365 -15.199 692 HD2 ASP 87 HD2 ASP 87 -18.200 3.143 -17.112 693 H ASN 88 H ASN 88 -13.963 7.729 -17.476 694 HA ASN 88 HA ASN 88 -12.120 8.715 -16.575 695 HB2 ASN 88 HB2 ASN 88 -14.197 10.029 -15.410 696 HB3 ASN 88 HB1 ASN 88 -13.375 9.383 -13.985 697 HD21 ASN 88 HD21 ASN 88 -10.754 9.470 -14.758 698 HD22 ASN 88 HD22 ASN 88 -10.266 11.112 -14.973 699 H TYR 89 H TYR 89 -12.452 5.959 -16.264 700 HA TYR 89 HA TYR 89 -11.549 4.178 -15.177 701 HB2 TYR 89 HB2 TYR 89 -10.021 6.284 -13.624 702 HB3 TYR 89 HB1 TYR 89 -9.615 4.569 -13.731 703 HD1 TYR 89 HD2 TYR 89 -10.284 4.309 -16.738 704 HD2 TYR 89 HD1 TYR 89 -7.931 7.078 -14.524 705 HE1 TYR 89 HE2 TYR 89 -8.912 4.729 -18.735 706 HE2 TYR 89 HE1 TYR 89 -6.553 7.507 -16.515 707 HH TYR 89 HH TYR 89 -6.045 6.775 -18.596 708 H THR 90 H THR 90 -14.021 5.111 -14.258 709 HA THR 90 HA THR 90 -14.323 5.559 -11.555 710 HB THR 90 HB THR 90 -16.080 4.006 -13.454 711 HG1 THR 90 HG1 THR 90 -15.883 6.664 -12.568 712 HG21 THR 90 HG21 THR 90 -17.848 4.519 -11.637 713 HG22 THR 90 HG22 THR 90 -16.465 4.654 -10.551 714 HG23 THR 90 HG23 THR 90 -16.774 3.141 -11.403 715 H ALA 91 H ALA 91 -13.542 2.589 -13.213 716 HA ALA 91 HA ALA 91 -14.169 0.707 -11.266 717 HB1 ALA 91 HB1 ALA 91 -12.430 -0.699 -12.307 718 HB2 ALA 91 HB2 ALA 91 -11.872 0.703 -13.220 719 HB3 ALA 91 HB3 ALA 91 -13.491 0.059 -13.495 720 H LEU 92 H LEU 92 -11.375 2.828 -11.546 721 HA LEU 92 HA LEU 92 -9.811 1.628 -9.524 722 HB2 LEU 92 HB2 LEU 92 -8.361 3.401 -9.762 723 HB3 LEU 92 HB1 LEU 92 -9.182 3.374 -11.332 724 HG LEU 92 HG LEU 92 -10.752 5.143 -10.133 725 HD11 LEU 92 HD11 LEU 92 -9.933 5.380 -8.014 726 HD12 LEU 92 HD12 LEU 92 -9.005 6.630 -8.843 727 HD13 LEU 92 HD13 LEU 92 -8.267 5.066 -8.500 728 HD21 LEU 92 HD21 LEU 92 -8.313 6.504 -10.874 729 HD22 LEU 92 HD22 LEU 92 -9.880 6.479 -11.682 730 HD23 LEU 92 HD23 LEU 92 -8.699 5.208 -12.005 731 H VAL 93 H VAL 93 -12.360 4.035 -9.469 732 HA VAL 93 HA VAL 93 -11.977 4.966 -6.836 733 HB VAL 93 HB VAL 93 -14.404 4.892 -8.617 734 HG11 VAL 93 HG11 VAL 93 -14.171 5.749 -5.762 735 HG12 VAL 93 HG12 VAL 93 -15.287 6.578 -6.849 736 HG13 VAL 93 HG13 VAL 93 -15.460 4.847 -6.559 737 HG21 VAL 93 HG21 VAL 93 -13.750 6.910 -9.317 738 HG22 VAL 93 HG22 VAL 93 -13.378 7.454 -7.682 739 HG23 VAL 93 HG23 VAL 93 -12.190 6.521 -8.592 740 H ASP 94 H ASP 94 -14.149 2.459 -8.128 741 HA ASP 94 HA ASP 94 -15.081 1.685 -5.534 742 HB2 ASP 94 HB2 ASP 94 -16.322 1.432 -7.756 743 HB3 ASP 94 HB1 ASP 94 -15.281 0.034 -8.049 744 HD2 ASP 94 HD2 ASP 94 -17.937 -0.299 -5.110 745 H ALA 95 H ALA 95 -12.501 0.694 -7.658 746 HA ALA 95 HA ALA 95 -11.950 -1.798 -6.399 747 HB1 ALA 95 HB1 ALA 95 -9.788 -1.654 -7.615 748 HB2 ALA 95 HB2 ALA 95 -10.241 -0.033 -8.145 749 HB3 ALA 95 HB3 ALA 95 -11.199 -1.426 -8.647 750 H ILE 96 H ILE 96 -10.227 1.328 -6.280 751 HA ILE 96 HA ILE 96 -8.437 0.604 -4.248 752 HB ILE 96 HB ILE 96 -9.477 3.346 -4.972 753 HG12 ILE 96 HG11 ILE 96 -8.355 2.138 -6.808 754 HG13 ILE 96 HG12 ILE 96 -7.426 3.549 -6.272 755 HG21 ILE 96 HG21 ILE 96 -8.542 3.363 -2.737 756 HG22 ILE 96 HG22 ILE 96 -7.089 2.547 -3.313 757 HG23 ILE 96 HG23 ILE 96 -7.451 4.186 -3.851 758 HD11 ILE 96 HD11 ILE 96 -5.969 1.652 -6.695 759 HD12 ILE 96 HD12 ILE 96 -5.941 2.109 -4.990 760 HD13 ILE 96 HD13 ILE 96 -6.859 0.695 -5.510 761 H TYR 97 H TYR 97 -11.694 1.910 -4.129 762 HA TYR 97 HA TYR 97 -11.770 2.663 -1.435 763 HB2 TYR 97 HB2 TYR 97 -13.757 2.027 -3.538 764 HB3 TYR 97 HB1 TYR 97 -14.329 1.889 -1.874 765 HD1 TYR 97 HD1 TYR 97 -11.853 4.326 -3.186 766 HD2 TYR 97 HD2 TYR 97 -15.785 3.721 -1.679 767 HE1 TYR 97 HE1 TYR 97 -12.177 6.761 -3.074 768 HE2 TYR 97 HE2 TYR 97 -16.121 6.155 -1.564 769 HH TYR 97 HH TYR 97 -13.859 8.390 -2.953 770 H SER 98 H SER 98 -12.179 -0.455 -2.989 771 HA SER 98 HA SER 98 -13.111 -1.790 -0.630 772 HB2 SER 98 HB2 SER 98 -12.354 -2.587 -3.404 773 HB3 SER 98 HB1 SER 98 -12.305 -3.839 -2.150 774 HG SER 98 HG SER 98 -14.474 -2.548 -3.269 775 H VAL 99 H VAL 99 -10.052 -1.908 -2.458 776 HA VAL 99 HA VAL 99 -8.651 -3.529 -0.659 777 HB VAL 99 HB VAL 99 -7.438 -1.382 -2.399 778 HG11 VAL 99 HG11 VAL 99 -5.488 -2.157 -1.680 779 HG12 VAL 99 HG12 VAL 99 -6.326 -3.291 -0.618 780 HG13 VAL 99 HG13 VAL 99 -5.906 -3.768 -2.263 781 HG21 VAL 99 HG21 VAL 99 -8.574 -2.517 -4.012 782 HG22 VAL 99 HG22 VAL 99 -7.158 -3.562 -3.896 783 HG23 VAL 99 HG23 VAL 99 -8.652 -4.005 -3.068 784 H GLU 100 H GLU 100 -8.527 0.021 -1.013 785 HA GLU 100 HA GLU 100 -6.830 0.606 1.074 786 HB2 GLU 100 HB2 GLU 100 -7.558 2.811 0.940 787 HB3 GLU 100 HB1 GLU 100 -7.939 2.166 -0.664 788 HG2 GLU 100 HG1 GLU 100 -10.274 1.769 0.104 789 HG3 GLU 100 HG2 GLU 100 -9.856 2.592 1.613 790 HE2 GLU 100 HE2 GLU 100 -9.290 5.286 -1.093 791 H ASP 101 H ASP 101 -10.199 -0.297 1.179 792 HA ASP 101 HA ASP 101 -10.439 0.335 4.004 793 HB2 ASP 101 HB2 ASP 101 -12.324 0.673 2.378 794 HB3 ASP 101 HB1 ASP 101 -12.428 -1.086 2.226 795 HD2 ASP 101 HD2 ASP 101 -14.596 -1.038 4.868 796 H GLU 102 H GLU 102 -11.069 -1.274 5.582 797 HA GLU 102 HA GLU 102 -10.602 -3.175 6.750 798 HB2 GLU 102 HB2 GLU 102 -11.070 -4.637 4.151 799 HB3 GLU 102 HB1 GLU 102 -11.389 -5.200 5.798 800 HG2 GLU 102 HG1 GLU 102 -13.091 -3.307 5.952 801 HG3 GLU 102 HG2 GLU 102 -12.916 -3.179 4.196 802 HE2 GLU 102 HE2 GLU 102 -15.616 -5.500 4.897 803 H ASN 103 H ASN 103 -8.377 -2.655 7.021 804 HA ASN 103 HA ASN 103 -6.539 -4.138 5.267 805 HB2 ASN 103 HB2 ASN 103 -6.264 -1.632 6.886 806 HB3 ASN 103 HB1 ASN 103 -4.827 -2.616 6.581 807 HD21 ASN 103 HD21 ASN 103 -7.620 -1.959 4.516 808 HD22 ASN 103 HD22 ASN 103 -6.719 -1.242 3.227 809 H LYS 104 H LYS 104 -7.736 -3.836 8.496 810 HA LYS 104 HA LYS 104 -5.711 -5.052 9.967 811 HB2 LYS 104 HB2 LYS 104 -7.458 -5.652 11.588 812 HB3 LYS 104 HB1 LYS 104 -7.633 -3.984 11.019 813 HG2 LYS 104 HG1 LYS 104 -9.775 -4.476 10.665 814 HG3 LYS 104 HG2 LYS 104 -9.205 -5.397 9.262 815 HD2 LYS 104 HD1 LYS 104 -9.214 -7.441 10.453 816 HD3 LYS 104 HD2 LYS 104 -9.370 -6.608 12.011 817 HE2 LYS 104 HE1 LYS 104 -11.582 -5.712 10.629 818 HE3 LYS 104 HE2 LYS 104 -11.426 -7.392 10.091 819 HZ1 LYS 104 3HZ LYS 104 -11.664 -6.436 12.890 820 HZ2 LYS 104 1HZ LYS 104 -11.313 -8.036 12.468 821 HZ3 LYS 104 2HZ LYS 104 -12.793 -7.349 12.021 822 H GLN 105 H GLN 105 -8.221 -6.460 7.953 823 HA GLN 105 HA GLN 105 -7.082 -9.125 8.484 824 HB2 GLN 105 HB2 GLN 105 -9.317 -9.963 7.589 825 HB3 GLN 105 HB1 GLN 105 -9.332 -9.194 9.184 826 HG2 GLN 105 HG1 GLN 105 -11.231 -8.412 7.983 827 HG3 GLN 105 HG2 GLN 105 -10.067 -7.085 8.096 828 HE21 GLN 105 HE21 GLN 105 -9.132 -6.279 6.268 829 HE22 GLN 105 HE22 GLN 105 -9.599 -6.749 4.673 830 H SER 106 H SER 106 -6.206 -7.060 6.537 831 HA SER 106 HA SER 106 -6.956 -8.104 3.948 832 HB2 SER 106 HB2 SER 106 -6.580 -5.841 3.745 833 HB3 SER 106 HB1 SER 106 -5.269 -5.849 4.939 834 HG SER 106 HG SER 106 -5.167 -6.735 2.250 835 H GLU 107 H GLU 107 -3.970 -7.936 5.878 836 HA GLU 107 HA GLU 107 -2.922 -10.175 4.274 837 HB2 GLU 107 HB2 GLU 107 -1.769 -7.848 4.186 838 HB3 GLU 107 HB1 GLU 107 -1.158 -8.279 5.791 839 HG2 GLU 107 HG1 GLU 107 0.567 -8.999 4.475 840 HG3 GLU 107 HG2 GLU 107 -0.402 -10.474 4.602 841 HE2 GLU 107 HE2 GLU 107 -1.506 -10.072 1.241 842 H GLY 108 H GLY 108 -4.403 -11.165 6.104 843 HA2 GLY 108 HA2 GLY 108 -3.081 -12.883 7.646 844 HA3 GLY 108 3HA GLY 108 -2.993 -11.435 8.639 845 H SER 109 H SER 109 -4.574 -14.210 8.422 846 HA SER 109 HA SER 109 -7.030 -13.068 9.563 847 HB2 SER 109 HB2 SER 109 -8.305 -14.960 8.482 848 HB3 SER 109 HB1 SER 109 -7.669 -13.752 7.352 849 HG SER 109 HG SER 109 -7.232 -16.348 7.329 Start of MODEL 17 1 H1 MET 1 H MET 1 6.212 -30.895 -64.433 2 HA MET 1 HA MET 1 7.199 -33.626 -64.058 3 HB2 MET 1 HB2 MET 1 8.485 -30.907 -63.851 4 HB3 MET 1 HB1 MET 1 9.269 -32.359 -63.211 5 HG2 MET 1 HG1 MET 1 9.447 -33.345 -65.354 6 HG3 MET 1 HG2 MET 1 8.349 -32.157 -66.059 7 HE1 MET 1 HE1 MET 1 11.574 -33.387 -65.973 8 HE2 MET 1 HE2 MET 1 12.729 -32.072 -66.182 9 HE3 MET 1 HE3 MET 1 12.168 -32.503 -64.566 10 H GLY 2 H GLY 2 5.219 -33.651 -62.492 11 HA2 GLY 2 HA2 GLY 2 4.621 -34.031 -60.301 12 HA3 GLY 2 3HA GLY 2 6.283 -33.684 -59.848 13 H SER 3 H SER 3 3.869 -31.636 -61.458 14 HA SER 3 HA SER 3 3.977 -29.826 -59.138 15 HB2 SER 3 HB2 SER 3 4.285 -29.165 -62.068 16 HB3 SER 3 HB1 SER 3 3.745 -27.951 -60.895 17 HG SER 3 HG SER 3 6.228 -28.747 -61.399 18 H SER 4 H SER 4 2.012 -29.909 -58.266 19 HA SER 4 HA SER 4 -0.272 -29.033 -59.728 20 HB2 SER 4 HB2 SER 4 -1.635 -31.021 -59.619 21 HB3 SER 4 HB1 SER 4 -0.121 -31.435 -60.443 22 HG SER 4 HG SER 4 -0.148 -32.991 -58.999 23 H HIS 5 H HIS 5 -2.124 -28.700 -58.377 24 HA HIS 5 HA HIS 5 -1.470 -27.892 -55.752 25 HB2 HIS 5 HB2 HIS 5 -4.160 -28.279 -57.084 26 HB3 HIS 5 HB1 HIS 5 -3.929 -27.500 -55.516 27 HD1 HIS 5 HD1 HIS 5 -2.489 -25.233 -55.546 28 HD2 HIS 5 HD2 HIS 5 -3.839 -26.596 -59.231 29 HE1 HIS 5 HE1 HIS 5 -2.288 -23.269 -57.104 30 HE2 HIS 5 HE2 HIS 5 -3.114 -24.102 -59.357 31 H HIS 6 H HIS 6 -1.103 -29.195 -54.090 32 HA HIS 6 HA HIS 6 -2.836 -31.549 -53.744 33 HB2 HIS 6 HB2 HIS 6 -0.370 -31.948 -54.501 34 HB3 HIS 6 HB1 HIS 6 0.021 -31.562 -52.823 35 HD1 HIS 6 HD1 HIS 6 0.887 -34.155 -52.937 36 HD2 HIS 6 HD2 HIS 6 -3.219 -33.522 -52.916 37 HE1 HIS 6 HE1 HIS 6 -0.129 -36.356 -52.270 38 HE2 HIS 6 HE2 HIS 6 -2.638 -35.972 -52.258 39 H HIS 7 H HIS 7 -3.952 -29.753 -52.481 40 HA HIS 7 HA HIS 7 -2.846 -29.659 -49.750 41 HB2 HIS 7 HB2 HIS 7 -2.988 -27.460 -51.053 42 HB3 HIS 7 HB1 HIS 7 -4.741 -27.609 -50.889 43 HD1 HIS 7 HD1 HIS 7 -3.492 -25.211 -49.599 44 HD2 HIS 7 HD2 HIS 7 -3.934 -28.838 -47.620 45 HE1 HIS 7 HE1 HIS 7 -3.454 -24.649 -47.147 46 HE2 HIS 7 HE2 HIS 7 -3.725 -26.865 -45.938 47 H HIS 8 H HIS 8 -3.912 -31.160 -48.618 48 HA HIS 8 HA HIS 8 -6.475 -32.137 -49.168 49 HB2 HIS 8 HB2 HIS 8 -4.739 -33.264 -47.759 50 HB3 HIS 8 HB1 HIS 8 -5.101 -32.109 -46.474 51 HD1 HIS 8 HD1 HIS 8 -5.605 -34.655 -45.377 52 HD2 HIS 8 HD2 HIS 8 -8.418 -32.977 -47.933 53 HE1 HIS 8 HE1 HIS 8 -7.757 -35.865 -44.895 54 HE2 HIS 8 HE2 HIS 8 -9.478 -34.839 -46.457 55 H HIS 9 H HIS 9 -5.568 -30.128 -46.360 56 HA HIS 9 HA HIS 9 -7.734 -28.315 -46.737 57 HB2 HIS 9 HB2 HIS 9 -9.148 -28.903 -44.918 58 HB3 HIS 9 HB1 HIS 9 -8.901 -30.376 -45.862 59 HD1 HIS 9 HD1 HIS 9 -9.653 -30.248 -42.767 60 HD2 HIS 9 HD2 HIS 9 -5.897 -31.011 -44.369 61 HE1 HIS 9 HE1 HIS 9 -8.407 -31.514 -40.987 62 HE2 HIS 9 HE2 HIS 9 -6.111 -31.981 -41.964 63 H HIS 10 H HIS 10 -7.776 -26.627 -45.139 64 HA HIS 10 HA HIS 10 -5.180 -25.982 -44.162 65 HB2 HIS 10 HB2 HIS 10 -7.847 -24.645 -43.638 66 HB3 HIS 10 HB1 HIS 10 -6.267 -23.955 -43.257 67 HD1 HIS 10 HD1 HIS 10 -5.110 -22.662 -45.058 68 HD2 HIS 10 HD2 HIS 10 -8.270 -24.932 -46.517 69 HE1 HIS 10 HE1 HIS 10 -5.374 -21.979 -47.463 70 HE2 HIS 10 HE2 HIS 10 -7.306 -23.365 -48.356 71 H SER 11 H SER 11 -4.586 -25.542 -41.966 72 HA SER 11 HA SER 11 -6.138 -27.077 -39.987 73 HB2 SER 11 HB2 SER 11 -3.819 -27.501 -38.911 74 HB3 SER 11 HB1 SER 11 -4.264 -28.444 -40.344 75 HG SER 11 HG SER 11 -2.496 -26.252 -40.161 76 H SER 12 H SER 12 -6.138 -26.303 -37.859 77 HA SER 12 HA SER 12 -5.408 -23.465 -37.633 78 HB2 SER 12 HB2 SER 12 -7.712 -23.640 -37.225 79 HB3 SER 12 HB1 SER 12 -7.524 -25.151 -36.317 80 HG SER 12 HG SER 12 -7.901 -23.134 -35.075 81 H GLY 13 H GLY 13 -5.204 -26.577 -35.969 82 HA2 GLY 13 HA2 GLY 13 -3.407 -27.307 -34.655 83 HA3 GLY 13 3HA GLY 13 -2.804 -25.656 -34.601 84 H LEU 14 H LEU 14 -3.050 -27.490 -32.397 85 HA LEU 14 HA LEU 14 -4.461 -25.758 -30.578 86 HB2 LEU 14 HB2 LEU 14 -6.063 -27.582 -31.618 87 HB3 LEU 14 HB1 LEU 14 -5.277 -28.617 -30.413 88 HG LEU 14 HG LEU 14 -7.355 -27.803 -29.523 89 HD11 LEU 14 HD11 LEU 14 -6.589 -27.207 -27.457 90 HD12 LEU 14 HD12 LEU 14 -5.397 -26.076 -28.099 91 HD13 LEU 14 HD13 LEU 14 -5.094 -27.812 -28.172 92 HD21 LEU 14 HD21 LEU 14 -6.753 -25.481 -30.965 93 HD22 LEU 14 HD22 LEU 14 -6.745 -25.004 -29.267 94 HD23 LEU 14 HD23 LEU 14 -8.169 -25.782 -29.958 95 H VAL 15 H VAL 15 -3.209 -25.568 -28.851 96 HA VAL 15 HA VAL 15 -1.519 -27.858 -28.077 97 HB VAL 15 HB VAL 15 -0.005 -26.058 -27.059 98 HG11 VAL 15 HG11 VAL 15 1.201 -26.832 -28.762 99 HG12 VAL 15 HG12 VAL 15 -0.234 -27.055 -29.764 100 HG13 VAL 15 HG13 VAL 15 0.576 -25.488 -29.716 101 HG21 VAL 15 HG21 VAL 15 -0.176 -23.853 -27.735 102 HG22 VAL 15 HG22 VAL 15 -1.179 -24.248 -29.131 103 HG23 VAL 15 HG23 VAL 15 -1.866 -24.300 -27.507 104 HA PRO 16 HA PRO 16 -3.287 -27.762 -24.060 105 HB2 PRO 16 HB2 PRO 16 -1.149 -28.480 -22.506 106 HB3 PRO 16 HB1 PRO 16 -1.997 -29.599 -23.573 107 HG2 PRO 16 HG1 PRO 16 0.536 -28.064 -24.050 108 HG3 PRO 16 HG2 PRO 16 0.170 -29.796 -24.394 109 HD2 PRO 16 HD1 PRO 16 0.151 -27.884 -26.321 110 HD3 PRO 16 HD2 PRO 16 -0.946 -29.275 -26.342 111 H ARG 17 H ARG 17 -3.872 -25.755 -23.405 112 HA ARG 17 HA ARG 17 -2.118 -23.589 -23.007 113 HB2 ARG 17 HB2 ARG 17 -4.921 -24.151 -22.036 114 HB3 ARG 17 HB1 ARG 17 -4.077 -22.637 -21.681 115 HG2 ARG 17 HG1 ARG 17 -3.726 -22.588 -24.292 116 HG3 ARG 17 HG2 ARG 17 -5.148 -23.645 -24.263 117 HD2 ARG 17 HD1 ARG 17 -4.965 -20.908 -22.980 118 HD3 ARG 17 HD2 ARG 17 -5.765 -21.282 -24.513 119 HE ARG 17 HE ARG 17 -6.843 -22.926 -22.513 120 HH11 ARG 17 1HH1 ARG 17 -6.758 -19.580 -23.465 121 HH12 ARG 17 2HH1 ARG 17 -8.302 -19.208 -22.774 122 HH21 ARG 17 1HH2 ARG 17 -8.878 -22.450 -21.598 123 HH22 ARG 17 2HH2 ARG 17 -9.507 -20.841 -21.711 124 H GLY 18 H GLY 18 -0.470 -23.745 -21.602 125 HA2 GLY 18 HA2 GLY 18 0.181 -23.353 -19.314 126 HA3 GLY 18 3HA GLY 18 -1.153 -24.379 -18.807 127 H SER 19 H SER 19 0.785 -25.216 -17.519 128 HA SER 19 HA SER 19 1.514 -27.743 -18.580 129 HB2 SER 19 HB2 SER 19 3.518 -25.517 -18.697 130 HB3 SER 19 HB1 SER 19 4.077 -27.149 -18.296 131 HG SER 19 HG SER 19 3.128 -27.881 -20.242 132 H HIS 20 H HIS 20 1.695 -29.088 -16.913 133 HA HIS 20 HA HIS 20 2.127 -27.944 -14.245 134 HB2 HIS 20 HB2 HIS 20 0.808 -30.473 -15.218 135 HB3 HIS 20 HB1 HIS 20 1.267 -30.266 -13.525 136 HD1 HIS 20 HD1 HIS 20 -1.711 -30.507 -14.582 137 HD2 HIS 20 HD2 HIS 20 0.242 -26.990 -13.542 138 HE1 HIS 20 HE1 HIS 20 -3.532 -28.870 -14.011 139 HE2 HIS 20 HE2 HIS 20 -2.340 -26.720 -13.376 140 H MET 21 H MET 21 3.557 -28.935 -12.761 141 HA MET 21 HA MET 21 5.293 -31.066 -13.603 142 HB2 MET 21 HB2 MET 21 6.141 -28.844 -14.658 143 HB3 MET 21 HB1 MET 21 6.681 -28.471 -13.014 144 HG2 MET 21 HG1 MET 21 8.581 -29.425 -13.831 145 HG3 MET 21 HG2 MET 21 7.773 -30.849 -13.172 146 HE1 MET 21 HE1 MET 21 9.649 -31.799 -14.447 147 HE2 MET 21 HE2 MET 21 8.627 -33.046 -15.161 148 HE3 MET 21 HE3 MET 21 9.698 -32.090 -16.186 149 H ILE 22 H ILE 22 6.411 -31.993 -11.901 150 HA ILE 22 HA ILE 22 5.814 -30.863 -9.245 151 HB ILE 22 HB ILE 22 4.678 -33.017 -9.715 152 HG12 ILE 22 HG11 ILE 22 6.786 -33.562 -7.648 153 HG13 ILE 22 HG12 ILE 22 5.648 -32.224 -7.415 154 HG21 ILE 22 HG21 ILE 22 7.119 -34.608 -9.442 155 HG22 ILE 22 HG22 ILE 22 5.719 -34.845 -10.486 156 HG23 ILE 22 HG23 ILE 22 6.994 -33.725 -10.963 157 HD11 ILE 22 HD11 ILE 22 4.558 -33.899 -6.314 158 HD12 ILE 22 HD12 ILE 22 3.854 -34.060 -7.924 159 HD13 ILE 22 HD13 ILE 22 5.142 -35.151 -7.410 160 H SER 23 H SER 23 7.436 -30.602 -7.799 161 HA SER 23 HA SER 23 10.138 -30.767 -8.794 162 HB2 SER 23 HB2 SER 23 8.951 -29.794 -6.183 163 HB3 SER 23 HB1 SER 23 10.693 -29.801 -6.512 164 HG SER 23 HG SER 23 10.439 -28.279 -8.040 165 H LEU 24 H LEU 24 9.528 -33.264 -8.886 166 HA LEU 24 HA LEU 24 9.591 -34.856 -6.613 167 HB2 LEU 24 HB2 LEU 24 9.110 -35.587 -8.963 168 HB3 LEU 24 HB1 LEU 24 10.856 -35.532 -9.262 169 HG LEU 24 HG LEU 24 11.133 -37.254 -7.461 170 HD11 LEU 24 HD11 LEU 24 9.328 -37.363 -6.106 171 HD12 LEU 24 HD12 LEU 24 8.802 -38.562 -7.287 172 HD13 LEU 24 HD13 LEU 24 8.201 -36.907 -7.384 173 HD21 LEU 24 HD21 LEU 24 11.287 -38.027 -9.673 174 HD22 LEU 24 HD22 LEU 24 9.557 -37.826 -9.955 175 HD23 LEU 24 HD23 LEU 24 10.136 -39.110 -8.892 176 H SER 25 H SER 25 12.215 -33.339 -8.382 177 HA SER 25 HA SER 25 14.039 -34.113 -6.213 178 HB2 SER 25 HB2 SER 25 14.721 -35.622 -7.881 179 HB3 SER 25 HB1 SER 25 14.480 -34.433 -9.173 180 HG SER 25 HG SER 25 16.580 -34.237 -8.932 181 H GLY 26 H GLY 26 15.642 -32.613 -5.708 182 HA2 GLY 26 HA2 GLY 26 15.731 -30.125 -7.247 183 HA3 GLY 26 3HA GLY 26 15.222 -30.018 -5.568 184 H LEU 27 H LEU 27 16.765 -29.553 -4.160 185 HA LEU 27 HA LEU 27 18.865 -29.017 -3.404 186 HB2 LEU 27 HB2 LEU 27 20.193 -30.914 -2.896 187 HB3 LEU 27 HB1 LEU 27 18.497 -31.421 -2.815 188 HG LEU 27 HG LEU 27 19.887 -31.886 -5.386 189 HD11 LEU 27 HD11 LEU 27 20.543 -34.159 -4.047 190 HD12 LEU 27 HD12 LEU 27 20.869 -32.926 -2.830 191 HD13 LEU 27 HD13 LEU 27 21.659 -32.840 -4.404 192 HD21 LEU 27 HD21 LEU 27 18.402 -33.989 -3.948 193 HD22 LEU 27 HD22 LEU 27 18.321 -33.492 -5.638 194 HD23 LEU 27 HD23 LEU 27 17.476 -32.559 -4.402 195 H THR 28 H THR 28 18.484 -28.275 -6.125 196 HA THR 28 HA THR 28 21.243 -28.557 -7.121 197 HB THR 28 HB THR 28 20.306 -28.281 -9.434 198 HG1 THR 28 HG1 THR 28 18.267 -27.687 -9.427 199 HG21 THR 28 HG21 THR 28 18.960 -30.726 -8.676 200 HG22 THR 28 HG22 THR 28 20.511 -30.568 -7.851 201 HG23 THR 28 HG23 THR 28 20.438 -30.502 -9.612 202 H SER 29 H SER 29 18.396 -26.515 -6.810 203 HA SER 29 HA SER 29 19.913 -24.156 -6.500 204 HB2 SER 29 HB2 SER 29 19.949 -24.752 -9.087 205 HB3 SER 29 HB1 SER 29 18.349 -23.993 -9.041 206 HG SER 29 HG SER 29 20.304 -22.611 -9.432 207 H SER 30 H SER 30 18.388 -22.155 -6.728 208 HA SER 30 HA SER 30 15.756 -22.934 -5.654 209 HB2 SER 30 HB2 SER 30 16.940 -20.249 -5.059 210 HB3 SER 30 HB1 SER 30 15.865 -21.255 -4.072 211 HG SER 30 HG SER 30 18.209 -21.067 -3.467 212 H VAL 31 H VAL 31 14.271 -20.809 -5.753 213 HA VAL 31 HA VAL 31 12.827 -19.832 -7.267 214 HB VAL 31 HB VAL 31 13.831 -17.864 -8.365 215 HG11 VAL 31 HG11 VAL 31 13.662 -16.835 -6.403 216 HG12 VAL 31 HG12 VAL 31 13.677 -18.415 -5.619 217 HG13 VAL 31 HG13 VAL 31 15.185 -17.533 -5.856 218 HG21 VAL 31 HG21 VAL 31 16.157 -17.406 -8.296 219 HG22 VAL 31 HG22 VAL 31 16.468 -18.783 -7.239 220 HG23 VAL 31 HG23 VAL 31 15.991 -19.049 -8.916 221 H GLU 32 H GLU 32 13.560 -22.282 -8.296 222 HA GLU 32 HA GLU 32 14.725 -22.346 -10.807 223 HB2 GLU 32 HB2 GLU 32 13.182 -24.338 -11.211 224 HB3 GLU 32 HB1 GLU 32 14.247 -24.420 -9.800 225 HG2 GLU 32 HG1 GLU 32 11.619 -23.245 -9.247 226 HG3 GLU 32 HG2 GLU 32 11.575 -24.931 -9.782 227 HE2 GLU 32 HE2 GLU 32 13.697 -25.718 -6.924 228 H SER 33 H SER 33 11.473 -21.414 -9.870 229 HA SER 33 HA SER 33 10.927 -20.701 -12.678 230 HB2 SER 33 HB2 SER 33 9.415 -22.459 -11.956 231 HB3 SER 33 HB1 SER 33 8.985 -21.530 -10.510 232 HG SER 33 HG SER 33 8.439 -20.833 -13.206 233 H ASP 34 H ASP 34 10.950 -19.675 -9.360 234 HA ASP 34 HA ASP 34 9.444 -17.331 -9.529 235 HB2 ASP 34 HB2 ASP 34 10.410 -18.456 -7.447 236 HB3 ASP 34 HB1 ASP 34 11.920 -17.619 -7.831 237 HD2 ASP 34 HD2 ASP 34 9.128 -14.926 -7.264 238 H LEU 35 H LEU 35 12.623 -18.064 -10.689 239 HA LEU 35 HA LEU 35 13.792 -15.559 -10.849 240 HB2 LEU 35 HB2 LEU 35 14.553 -18.011 -11.582 241 HB3 LEU 35 HB1 LEU 35 14.103 -17.376 -13.173 242 HG LEU 35 HG LEU 35 16.495 -17.143 -12.766 243 HD11 LEU 35 HD11 LEU 35 15.549 -14.342 -12.588 244 HD12 LEU 35 HD12 LEU 35 14.916 -15.333 -13.902 245 HD13 LEU 35 HD13 LEU 35 16.656 -15.098 -13.735 246 HD21 LEU 35 HD21 LEU 35 17.290 -16.589 -10.772 247 HD22 LEU 35 HD22 LEU 35 15.644 -16.379 -10.175 248 HD23 LEU 35 HD23 LEU 35 16.507 -15.012 -10.883 249 H ASP 36 H ASP 36 11.261 -16.966 -12.799 250 HA ASP 36 HA ASP 36 11.322 -15.306 -15.026 251 HB2 ASP 36 HB2 ASP 36 9.170 -16.058 -15.515 252 HB3 ASP 36 HB1 ASP 36 9.816 -17.353 -14.498 253 HD2 ASP 36 HD2 ASP 36 6.525 -15.861 -13.354 254 H MET 37 H MET 37 10.338 -14.636 -11.774 255 HA MET 37 HA MET 37 8.653 -12.447 -12.161 256 HB2 MET 37 HB2 MET 37 9.426 -13.754 -9.993 257 HB3 MET 37 HB1 MET 37 10.593 -12.427 -9.891 258 HG2 MET 37 HG1 MET 37 8.631 -10.838 -10.073 259 HG3 MET 37 HG2 MET 37 7.597 -12.250 -9.842 260 HE1 MET 37 HE1 MET 37 6.980 -12.102 -6.335 261 HE2 MET 37 HE2 MET 37 6.716 -10.638 -7.281 262 HE3 MET 37 HE3 MET 37 6.457 -12.222 -8.015 263 H GLN 38 H GLN 38 12.136 -12.705 -12.308 264 HA GLN 38 HA GLN 38 12.769 -9.968 -12.147 265 HB2 GLN 38 HB2 GLN 38 14.138 -12.408 -13.196 266 HB3 GLN 38 HB1 GLN 38 14.800 -10.820 -13.613 267 HG2 GLN 38 HG1 GLN 38 15.822 -11.911 -11.603 268 HG3 GLN 38 HG2 GLN 38 15.194 -10.277 -11.349 269 HE21 GLN 38 HE21 GLN 38 14.203 -13.668 -11.089 270 HE22 GLN 38 HE22 GLN 38 13.262 -13.464 -9.655 271 H GLN 39 H GLN 39 12.648 -12.029 -15.060 272 HA GLN 39 HA GLN 39 12.848 -9.972 -16.923 273 HB2 GLN 39 HB2 GLN 39 11.294 -12.535 -17.313 274 HB3 GLN 39 HB1 GLN 39 12.074 -11.550 -18.560 275 HG2 GLN 39 HG1 GLN 39 14.276 -12.068 -17.521 276 HG3 GLN 39 HG2 GLN 39 13.436 -13.175 -16.428 277 HE21 GLN 39 HE21 GLN 39 12.257 -14.958 -17.392 278 HE22 GLN 39 HE22 GLN 39 12.830 -15.648 -18.869 279 H ALA 40 H ALA 40 10.152 -11.023 -15.029 280 HA ALA 40 HA ALA 40 8.108 -9.857 -16.650 281 HB1 ALA 40 HB1 ALA 40 7.890 -11.700 -14.862 282 HB2 ALA 40 HB2 ALA 40 6.609 -10.494 -14.992 283 HB3 ALA 40 HB3 ALA 40 7.817 -10.364 -13.712 284 H MET 41 H MET 41 10.119 -8.747 -13.998 285 HA MET 41 HA MET 41 8.735 -6.473 -13.217 286 HB2 MET 41 HB2 MET 41 11.699 -7.043 -13.350 287 HB3 MET 41 HB1 MET 41 11.035 -5.570 -12.627 288 HG2 MET 41 HG1 MET 41 9.964 -8.179 -11.679 289 HG3 MET 41 HG2 MET 41 11.596 -7.719 -11.192 290 HE1 MET 41 HE1 MET 41 11.915 -5.072 -10.869 291 HE2 MET 41 HE2 MET 41 10.954 -4.184 -9.688 292 HE3 MET 41 HE3 MET 41 11.958 -5.538 -9.168 293 H LEU 42 H LEU 42 11.273 -6.742 -15.706 294 HA LEU 42 HA LEU 42 11.214 -4.077 -16.545 295 HB2 LEU 42 HB2 LEU 42 12.131 -6.655 -17.707 296 HB3 LEU 42 HB1 LEU 42 11.942 -5.280 -18.808 297 HG LEU 42 HG LEU 42 13.450 -4.012 -17.142 298 HD11 LEU 42 HD11 LEU 42 14.798 -5.220 -15.689 299 HD12 LEU 42 HD12 LEU 42 14.435 -6.758 -16.471 300 HD13 LEU 42 HD13 LEU 42 13.214 -5.966 -15.476 301 HD21 LEU 42 HD21 LEU 42 14.878 -6.218 -18.566 302 HD22 LEU 42 HD22 LEU 42 15.292 -4.507 -18.442 303 HD23 LEU 42 HD23 LEU 42 13.963 -5.020 -19.482 304 H THR 43 H THR 43 9.077 -6.721 -17.209 305 HA THR 43 HA THR 43 7.545 -4.986 -19.035 306 HB THR 43 HB THR 43 8.390 -6.772 -20.377 307 HG1 THR 43 HG1 THR 43 6.406 -6.721 -21.128 308 HG21 THR 43 HG21 THR 43 7.258 -9.107 -19.261 309 HG22 THR 43 HG22 THR 43 8.132 -8.290 -17.965 310 HG23 THR 43 HG23 THR 43 8.966 -8.717 -19.460 311 H ASN 44 H ASN 44 6.725 -4.394 -16.762 312 HA ASN 44 HA ASN 44 4.393 -6.093 -16.188 313 HB2 ASN 44 HB2 ASN 44 6.136 -6.398 -14.444 314 HB3 ASN 44 HB1 ASN 44 6.065 -4.663 -14.110 315 HD21 ASN 44 HD21 ASN 44 3.512 -7.036 -14.734 316 HD22 ASN 44 HD22 ASN 44 2.660 -6.763 -13.255 317 H LYS 45 H LYS 45 5.307 -3.280 -17.421 318 HA LYS 45 HA LYS 45 2.787 -2.005 -16.791 319 HB2 LYS 45 HB2 LYS 45 3.970 0.186 -16.267 320 HB3 LYS 45 HB1 LYS 45 4.002 -1.053 -15.003 321 HG2 LYS 45 HG1 LYS 45 6.277 -1.024 -16.904 322 HG3 LYS 45 HG2 LYS 45 6.166 0.310 -15.741 323 HD2 LYS 45 HD1 LYS 45 5.977 -2.590 -14.922 324 HD3 LYS 45 HD2 LYS 45 7.513 -1.710 -15.008 325 HE2 LYS 45 HE1 LYS 45 5.811 -0.020 -13.570 326 HE3 LYS 45 HE2 LYS 45 5.467 -1.647 -12.965 327 HZ1 LYS 45 3HZ LYS 45 7.782 -1.964 -12.473 328 HZ2 LYS 45 1HZ LYS 45 7.259 -0.530 -11.742 329 HZ3 LYS 45 2HZ LYS 45 8.185 -0.469 -13.156 330 H ASP 46 H ASP 46 2.937 0.351 -17.930 331 HA ASP 46 HA ASP 46 4.411 0.218 -20.430 332 HB2 ASP 46 HB2 ASP 46 1.437 -0.095 -20.220 333 HB3 ASP 46 HB1 ASP 46 2.116 0.780 -21.599 334 HD2 ASP 46 HD2 ASP 46 2.150 -3.063 -21.758 335 H GLU 47 H GLU 47 3.536 2.220 -21.843 336 HA GLU 47 HA GLU 47 4.243 4.523 -20.356 337 HB2 GLU 47 HB2 GLU 47 3.687 5.769 -22.426 338 HB3 GLU 47 HB1 GLU 47 4.759 4.390 -22.713 339 HG2 GLU 47 HG1 GLU 47 2.754 3.062 -23.399 340 HG3 GLU 47 HG2 GLU 47 1.814 4.556 -23.294 341 HE2 GLU 47 HE2 GLU 47 3.457 5.874 -26.135 342 H LYS 48 H LYS 48 1.160 3.323 -21.616 343 HA LYS 48 HA LYS 48 -0.374 5.556 -20.759 344 HB2 LYS 48 HB2 LYS 48 -2.329 4.032 -21.118 345 HB3 LYS 48 HB1 LYS 48 -1.243 4.169 -22.510 346 HG2 LYS 48 HG1 LYS 48 -0.628 1.958 -20.664 347 HG3 LYS 48 HG2 LYS 48 -2.172 1.833 -21.526 348 HD2 LYS 48 HD1 LYS 48 -0.507 2.617 -23.540 349 HD3 LYS 48 HD2 LYS 48 0.576 1.630 -22.542 350 HE2 LYS 48 HE1 LYS 48 -1.380 -0.090 -22.549 351 HE3 LYS 48 HE2 LYS 48 -1.942 0.833 -23.951 352 HZ1 LYS 48 3HZ LYS 48 0.121 -1.094 -23.812 353 HZ2 LYS 48 1HZ LYS 48 0.756 0.376 -24.356 354 HZ3 LYS 48 2HZ LYS 48 -0.540 -0.340 -25.175 355 H VAL 49 H VAL 49 0.595 2.544 -19.261 356 HA VAL 49 HA VAL 49 -1.191 2.427 -17.133 357 HB VAL 49 HB VAL 49 1.725 1.634 -17.142 358 HG11 VAL 49 HG11 VAL 49 -0.240 1.630 -15.048 359 HG12 VAL 49 HG12 VAL 49 0.243 -0.023 -15.437 360 HG13 VAL 49 HG13 VAL 49 1.462 1.170 -14.986 361 HG21 VAL 49 HG21 VAL 49 -0.606 -0.215 -17.490 362 HG22 VAL 49 HG22 VAL 49 0.085 0.639 -18.870 363 HG23 VAL 49 HG23 VAL 49 1.086 -0.463 -17.923 364 H LEU 50 H LEU 50 1.665 4.406 -17.585 365 HA LEU 50 HA LEU 50 1.895 5.290 -14.897 366 HB2 LEU 50 HB2 LEU 50 2.788 6.783 -17.362 367 HB3 LEU 50 HB1 LEU 50 3.439 6.906 -15.718 368 HG LEU 50 HG LEU 50 3.659 4.420 -17.407 369 HD11 LEU 50 HD11 LEU 50 5.628 6.674 -17.050 370 HD12 LEU 50 HD12 LEU 50 4.825 6.200 -18.545 371 HD13 LEU 50 HD13 LEU 50 5.993 5.115 -17.790 372 HD21 LEU 50 HD21 LEU 50 5.639 4.170 -15.731 373 HD22 LEU 50 HD22 LEU 50 4.002 3.750 -15.228 374 HD23 LEU 50 HD23 LEU 50 4.704 5.297 -14.750 375 H LYS 51 H LYS 51 -0.160 6.162 -17.519 376 HA LYS 51 HA LYS 51 -0.833 8.779 -16.553 377 HB2 LYS 51 HB2 LYS 51 -1.944 9.011 -18.493 378 HB3 LYS 51 HB1 LYS 51 -1.136 7.502 -18.948 379 HG2 LYS 51 HG1 LYS 51 -3.092 6.228 -18.151 380 HG3 LYS 51 HG2 LYS 51 -3.904 7.762 -17.790 381 HD2 LYS 51 HD1 LYS 51 -2.812 7.554 -20.520 382 HD3 LYS 51 HD2 LYS 51 -4.124 6.423 -20.144 383 HE2 LYS 51 HE1 LYS 51 -5.455 8.383 -19.286 384 HE3 LYS 51 HE2 LYS 51 -4.181 9.429 -19.931 385 HZ1 LYS 51 3HZ LYS 51 -5.964 9.246 -21.511 386 HZ2 LYS 51 1HZ LYS 51 -5.868 7.557 -21.501 387 HZ3 LYS 51 2HZ LYS 51 -4.596 8.472 -22.137 388 H ALA 52 H ALA 52 -2.124 5.537 -16.196 389 HA ALA 52 HA ALA 52 -4.638 6.106 -15.153 390 HB1 ALA 52 HB1 ALA 52 -2.829 3.819 -15.181 391 HB2 ALA 52 HB2 ALA 52 -4.580 3.884 -15.378 392 HB3 ALA 52 HB3 ALA 52 -3.874 3.869 -13.761 393 H LEU 53 H LEU 53 -1.484 6.270 -13.661 394 HA LEU 53 HA LEU 53 -2.396 6.402 -10.967 395 HB2 LEU 53 HB2 LEU 53 0.185 7.231 -12.292 396 HB3 LEU 53 HB1 LEU 53 -0.099 7.346 -10.547 397 HG LEU 53 HG LEU 53 -0.290 4.745 -12.049 398 HD11 LEU 53 HD11 LEU 53 1.949 4.277 -11.622 399 HD12 LEU 53 HD12 LEU 53 2.106 5.599 -10.465 400 HD13 LEU 53 HD13 LEU 53 1.979 5.948 -12.189 401 HD21 LEU 53 HD21 LEU 53 0.364 5.138 -9.154 402 HD22 LEU 53 HD22 LEU 53 -0.312 3.726 -9.965 403 HD23 LEU 53 HD23 LEU 53 -1.310 5.157 -9.709 404 H GLU 54 H GLU 54 -2.316 8.643 -13.548 405 HA GLU 54 HA GLU 54 -2.053 11.061 -12.128 406 HB2 GLU 54 HB2 GLU 54 -3.631 10.582 -14.666 407 HB3 GLU 54 HB1 GLU 54 -2.984 12.129 -14.094 408 HG2 GLU 54 HG1 GLU 54 -0.920 10.096 -14.333 409 HG3 GLU 54 HG2 GLU 54 -1.768 10.394 -15.857 410 HE2 GLU 54 HE2 GLU 54 -0.331 13.507 -16.221 411 H ARG 55 H ARG 55 -4.881 9.114 -12.982 412 HA ARG 55 HA ARG 55 -6.740 10.965 -11.811 413 HB2 ARG 55 HB2 ARG 55 -7.574 9.669 -13.607 414 HB3 ARG 55 HB1 ARG 55 -6.995 8.162 -12.883 415 HG2 ARG 55 HG1 ARG 55 -9.442 8.424 -12.729 416 HG3 ARG 55 HG2 ARG 55 -8.654 8.288 -11.148 417 HD2 ARG 55 HD1 ARG 55 -9.302 10.343 -10.510 418 HD3 ARG 55 HD2 ARG 55 -8.880 11.042 -12.080 419 HE ARG 55 HE ARG 55 -11.172 9.631 -12.554 420 HH11 ARG 55 1HH1 ARG 55 -10.238 12.169 -10.362 421 HH12 ARG 55 2HH1 ARG 55 -11.823 12.866 -10.287 422 HH21 ARG 55 1HH2 ARG 55 -13.263 10.539 -12.464 423 HH22 ARG 55 2HH2 ARG 55 -13.543 11.937 -11.481 424 H THR 56 H THR 56 -5.051 8.072 -10.793 425 HA THR 56 HA THR 56 -6.582 7.640 -8.425 426 HB THR 56 HB THR 56 -4.963 6.000 -7.820 427 HG1 THR 56 HG1 THR 56 -2.925 6.407 -8.175 428 HG21 THR 56 HG21 THR 56 -5.614 4.643 -9.463 429 HG22 THR 56 HG22 THR 56 -4.519 5.431 -10.598 430 HG23 THR 56 HG23 THR 56 -6.151 6.057 -10.368 431 H ARG 57 H ARG 57 -3.422 9.134 -9.069 432 HA ARG 57 HA ARG 57 -2.698 9.734 -6.457 433 HB2 ARG 57 HB2 ARG 57 -1.182 11.354 -7.362 434 HB3 ARG 57 HB1 ARG 57 -1.254 9.987 -8.485 435 HG2 ARG 57 HG1 ARG 57 -2.548 11.182 -10.048 436 HG3 ARG 57 HG2 ARG 57 -2.916 12.455 -8.871 437 HD2 ARG 57 HD1 ARG 57 -1.198 13.084 -10.593 438 HD3 ARG 57 HD2 ARG 57 -0.678 13.263 -8.911 439 HE ARG 57 HE ARG 57 0.064 10.715 -9.866 440 HH11 ARG 57 1HH1 ARG 57 0.878 14.083 -10.199 441 HH12 ARG 57 2HH1 ARG 57 2.533 13.777 -10.610 442 HH21 ARG 57 1HH2 ARG 57 2.241 10.298 -10.405 443 HH22 ARG 57 2HH2 ARG 57 3.307 11.624 -10.727 444 H GLN 58 H GLN 58 -5.050 11.235 -8.521 445 HA GLN 58 HA GLN 58 -5.268 13.726 -7.229 446 HB2 GLN 58 HB2 GLN 58 -7.152 12.084 -8.906 447 HB3 GLN 58 HB1 GLN 58 -7.665 13.618 -8.188 448 HG2 GLN 58 HG1 GLN 58 -5.265 13.324 -9.990 449 HG3 GLN 58 HG2 GLN 58 -6.882 13.780 -10.546 450 HE21 GLN 58 HE21 GLN 58 -4.142 14.762 -8.617 451 HE22 GLN 58 HE22 GLN 58 -4.530 16.444 -8.568 452 H LEU 59 H LEU 59 -6.841 10.616 -6.649 453 HA LEU 59 HA LEU 59 -8.335 11.722 -4.405 454 HB2 LEU 59 HB2 LEU 59 -8.273 8.848 -5.317 455 HB3 LEU 59 HB1 LEU 59 -9.503 9.660 -4.333 456 HG LEU 59 HG LEU 59 -9.279 10.945 -6.900 457 HD11 LEU 59 HD11 LEU 59 -9.798 7.976 -6.922 458 HD12 LEU 59 HD12 LEU 59 -8.488 8.828 -7.737 459 HD13 LEU 59 HD13 LEU 59 -10.155 9.075 -8.254 460 HD21 LEU 59 HD21 LEU 59 -11.171 10.964 -5.229 461 HD22 LEU 59 HD22 LEU 59 -11.559 9.333 -5.775 462 HD23 LEU 59 HD23 LEU 59 -11.631 10.683 -6.908 463 H ASP 60 H ASP 60 -5.294 11.133 -4.617 464 HA ASP 60 HA ASP 60 -3.636 10.577 -3.162 465 HB2 ASP 60 HB2 ASP 60 -5.661 10.051 -1.005 466 HB3 ASP 60 HB1 ASP 60 -4.042 10.753 -0.871 467 HD2 ASP 60 HD2 ASP 60 -5.257 13.901 -1.969 468 H ILE 61 H ILE 61 -3.529 8.639 -4.563 469 HA ILE 61 HA ILE 61 -3.978 6.218 -2.957 470 HB ILE 61 HB ILE 61 -4.340 6.274 -5.948 471 HG12 ILE 61 HG11 ILE 61 -6.489 6.285 -3.813 472 HG13 ILE 61 HG12 ILE 61 -6.054 7.679 -4.818 473 HG21 ILE 61 HG21 ILE 61 -3.733 4.150 -4.611 474 HG22 ILE 61 HG22 ILE 61 -5.399 4.222 -4.042 475 HG23 ILE 61 HG23 ILE 61 -5.062 4.074 -5.766 476 HD11 ILE 61 HD11 ILE 61 -7.784 5.445 -5.423 477 HD12 ILE 61 HD12 ILE 61 -7.623 7.005 -6.230 478 HD13 ILE 61 HD13 ILE 61 -6.545 5.677 -6.656 479 HA PRO 62 HA PRO 62 0.338 5.649 -3.778 480 HB2 PRO 62 HB2 PRO 62 0.540 3.112 -2.769 481 HB3 PRO 62 HB1 PRO 62 0.409 4.553 -1.761 482 HG2 PRO 62 HG1 PRO 62 -1.728 2.634 -2.624 483 HG3 PRO 62 HG2 PRO 62 -1.416 3.335 -0.991 484 HD2 PRO 62 HD1 PRO 62 -3.366 4.262 -2.637 485 HD3 PRO 62 HD2 PRO 62 -2.462 5.316 -1.537 486 H ASP 63 H ASP 63 1.516 4.855 -5.438 487 HA ASP 63 HA ASP 63 0.214 3.576 -7.606 488 HB2 ASP 63 HB2 ASP 63 2.050 5.075 -8.040 489 HB3 ASP 63 HB1 ASP 63 3.140 4.093 -7.052 490 HD2 ASP 63 HD2 ASP 63 4.064 2.571 -9.982 491 H GLU 64 H GLU 64 1.473 2.351 -4.746 492 HA GLU 64 HA GLU 64 2.435 -0.161 -5.733 493 HB2 GLU 64 HB2 GLU 64 1.541 0.424 -2.910 494 HB3 GLU 64 HB1 GLU 64 2.720 -0.779 -3.455 495 HG2 GLU 64 HG1 GLU 64 3.036 2.215 -3.363 496 HG3 GLU 64 HG2 GLU 64 3.941 0.986 -2.468 497 HE2 GLU 64 HE2 GLU 64 6.041 0.358 -5.157 498 H LYS 65 H LYS 65 -0.594 1.035 -4.397 499 HA LYS 65 HA LYS 65 -1.803 -1.611 -4.547 500 HB2 LYS 65 HB2 LYS 65 -3.476 -0.827 -3.194 501 HB3 LYS 65 HB1 LYS 65 -2.166 0.266 -2.719 502 HG2 LYS 65 HG1 LYS 65 -3.040 1.937 -4.351 503 HG3 LYS 65 HG2 LYS 65 -4.421 0.859 -4.621 504 HD2 LYS 65 HD1 LYS 65 -3.624 2.152 -2.004 505 HD3 LYS 65 HD2 LYS 65 -5.022 2.563 -3.012 506 HE2 LYS 65 HE1 LYS 65 -4.539 0.031 -1.440 507 HE3 LYS 65 HE2 LYS 65 -5.844 1.212 -1.250 508 HZ1 LYS 65 3HZ LYS 65 -6.133 0.428 -3.817 509 HZ2 LYS 65 1HZ LYS 65 -7.008 -0.195 -2.509 510 HZ3 LYS 65 2HZ LYS 65 -5.634 -1.007 -3.071 511 H THR 66 H THR 66 -1.755 1.417 -6.263 512 HA THR 66 HA THR 66 -4.086 0.945 -7.839 513 HB THR 66 HB THR 66 -1.749 2.800 -8.336 514 HG1 THR 66 HG1 THR 66 -2.721 3.982 -6.887 515 HG21 THR 66 HG21 THR 66 -3.242 3.958 -9.894 516 HG22 THR 66 HG22 THR 66 -4.481 2.733 -9.625 517 HG23 THR 66 HG23 THR 66 -2.961 2.295 -10.405 518 H MET 67 H MET 67 -0.704 0.123 -8.127 519 HA MET 67 HA MET 67 -0.430 -0.394 -10.813 520 HB2 MET 67 HB2 MET 67 0.867 -1.248 -8.356 521 HB3 MET 67 HB1 MET 67 0.879 -2.526 -9.580 522 HG2 MET 67 HG1 MET 67 1.727 0.264 -10.283 523 HG3 MET 67 HG2 MET 67 2.838 -0.856 -9.489 524 HE1 MET 67 HE1 MET 67 0.422 -1.249 -13.076 525 HE2 MET 67 HE2 MET 67 0.902 0.253 -12.287 526 HE3 MET 67 HE3 MET 67 1.799 -0.334 -13.688 527 HA PRO 68 HA PRO 68 -2.182 -4.853 -10.213 528 HB2 PRO 68 HB2 PRO 68 -3.346 -5.449 -7.807 529 HB3 PRO 68 HB1 PRO 68 -1.629 -5.672 -8.138 530 HG2 PRO 68 HG1 PRO 68 -3.021 -3.395 -6.769 531 HG3 PRO 68 HG2 PRO 68 -1.520 -4.270 -6.286 532 HD2 PRO 68 HD1 PRO 68 -1.475 -1.841 -7.499 533 HD3 PRO 68 HD2 PRO 68 -0.227 -3.069 -7.770 534 H VAL 69 H VAL 69 -3.727 -1.994 -9.114 535 HA VAL 69 HA VAL 69 -6.425 -2.974 -9.378 536 HB VAL 69 HB VAL 69 -5.277 -0.224 -8.951 537 HG11 VAL 69 HG11 VAL 69 -7.978 -1.013 -9.823 538 HG12 VAL 69 HG12 VAL 69 -7.908 0.128 -8.479 539 HG13 VAL 69 HG13 VAL 69 -7.125 0.520 -10.011 540 HG21 VAL 69 HG21 VAL 69 -5.676 -0.555 -6.769 541 HG22 VAL 69 HG22 VAL 69 -7.229 -1.333 -7.072 542 HG23 VAL 69 HG23 VAL 69 -5.737 -2.265 -7.197 543 H LEU 70 H LEU 70 -4.488 -0.552 -11.143 544 HA LEU 70 HA LEU 70 -6.295 -0.150 -13.235 545 HB2 LEU 70 HB2 LEU 70 -4.520 0.909 -14.413 546 HB3 LEU 70 HB1 LEU 70 -4.321 1.270 -12.689 547 HG LEU 70 HG LEU 70 -2.691 -0.831 -12.835 548 HD11 LEU 70 HD11 LEU 70 -1.978 0.344 -15.444 549 HD12 LEU 70 HD12 LEU 70 -3.374 -0.733 -15.429 550 HD13 LEU 70 HD13 LEU 70 -1.811 -1.311 -14.855 551 HD21 LEU 70 HD21 LEU 70 -0.847 0.817 -13.268 552 HD22 LEU 70 HD22 LEU 70 -1.978 1.277 -11.996 553 HD23 LEU 70 HD23 LEU 70 -2.093 2.023 -13.591 554 H MET 71 H MET 71 -3.652 -2.474 -12.889 555 HA MET 71 HA MET 71 -3.711 -3.522 -15.486 556 HB2 MET 71 HB2 MET 71 -2.348 -5.241 -14.703 557 HB3 MET 71 HB1 MET 71 -2.009 -3.913 -13.582 558 HG2 MET 71 HG1 MET 71 -2.297 -5.516 -12.026 559 HG3 MET 71 HG2 MET 71 -3.998 -5.095 -12.248 560 HE1 MET 71 HE1 MET 71 -1.847 -8.514 -14.353 561 HE2 MET 71 HE2 MET 71 -1.169 -7.005 -13.741 562 HE3 MET 71 HE3 MET 71 -1.485 -8.343 -12.635 563 H LYS 72 H LYS 72 -5.829 -3.972 -12.790 564 HA LYS 72 HA LYS 72 -6.986 -6.437 -13.622 565 HB2 LYS 72 HB2 LYS 72 -7.099 -5.590 -11.300 566 HB3 LYS 72 HB1 LYS 72 -8.158 -4.283 -11.852 567 HG2 LYS 72 HG1 LYS 72 -9.971 -5.632 -12.067 568 HG3 LYS 72 HG2 LYS 72 -8.994 -7.050 -12.488 569 HD2 LYS 72 HD1 LYS 72 -8.965 -5.864 -9.717 570 HD3 LYS 72 HD2 LYS 72 -10.166 -7.066 -10.216 571 HE2 LYS 72 HE1 LYS 72 -8.399 -8.657 -10.764 572 HE3 LYS 72 HE2 LYS 72 -7.176 -7.448 -10.347 573 HZ1 LYS 72 3HZ LYS 72 -8.489 -7.462 -8.085 574 HZ2 LYS 72 1HZ LYS 72 -7.271 -8.593 -8.405 575 HZ3 LYS 72 2HZ LYS 72 -8.895 -9.026 -8.587 576 H LEU 73 H LEU 73 -7.573 -3.080 -14.373 577 HA LEU 73 HA LEU 73 -10.145 -3.428 -15.532 578 HB2 LEU 73 HB2 LEU 73 -8.263 -1.261 -16.388 579 HB3 LEU 73 HB1 LEU 73 -10.020 -1.205 -16.161 580 HG LEU 73 HG LEU 73 -7.898 -1.171 -14.021 581 HD11 LEU 73 HD11 LEU 73 -8.322 0.953 -15.182 582 HD12 LEU 73 HD12 LEU 73 -8.824 1.002 -13.493 583 HD13 LEU 73 HD13 LEU 73 -10.031 0.825 -14.766 584 HD21 LEU 73 HD21 LEU 73 -10.799 -1.789 -13.896 585 HD22 LEU 73 HD22 LEU 73 -10.117 -0.769 -12.629 586 HD23 LEU 73 HD23 LEU 73 -9.469 -2.387 -12.904 587 H LEU 74 H LEU 74 -6.859 -3.358 -16.845 588 HA LEU 74 HA LEU 74 -7.705 -3.660 -19.562 589 HB2 LEU 74 HB2 LEU 74 -5.021 -4.031 -18.224 590 HB3 LEU 74 HB1 LEU 74 -5.290 -4.136 -19.973 591 HG LEU 74 HG LEU 74 -4.399 -1.991 -19.575 592 HD11 LEU 74 HD11 LEU 74 -7.060 -0.897 -19.620 593 HD12 LEU 74 HD12 LEU 74 -6.958 -2.336 -20.634 594 HD13 LEU 74 HD13 LEU 74 -5.858 -0.985 -20.908 595 HD21 LEU 74 HD21 LEU 74 -4.960 -2.084 -17.092 596 HD22 LEU 74 HD22 LEU 74 -6.528 -1.410 -17.536 597 HD23 LEU 74 HD23 LEU 74 -5.051 -0.507 -17.876 598 H GLU 75 H GLU 75 -7.114 -5.804 -16.931 599 HA GLU 75 HA GLU 75 -6.549 -8.150 -18.429 600 HB2 GLU 75 HB2 GLU 75 -6.074 -8.883 -16.383 601 HB3 GLU 75 HB1 GLU 75 -6.811 -7.434 -15.681 602 HG2 GLU 75 HG1 GLU 75 -8.970 -8.491 -15.594 603 HG3 GLU 75 HG2 GLU 75 -8.341 -9.907 -16.449 604 HE2 GLU 75 HE2 GLU 75 -6.446 -9.869 -13.069 605 H GLU 76 H GLU 76 -9.522 -6.752 -17.112 606 HA GLU 76 HA GLU 76 -11.159 -8.927 -18.049 607 HB2 GLU 76 HB2 GLU 76 -11.761 -6.235 -16.824 608 HB3 GLU 76 HB1 GLU 76 -13.039 -7.317 -17.401 609 HG2 GLU 76 HG1 GLU 76 -11.972 -9.088 -15.879 610 HG3 GLU 76 HG2 GLU 76 -11.128 -7.724 -15.133 611 HE2 GLU 76 HE2 GLU 76 -14.875 -8.332 -14.212 612 H ALA 77 H ALA 77 -10.609 -5.554 -19.011 613 HA ALA 77 HA ALA 77 -12.377 -5.697 -21.257 614 HB1 ALA 77 HB1 ALA 77 -12.032 -3.566 -20.238 615 HB2 ALA 77 HB2 ALA 77 -11.347 -3.503 -21.863 616 HB3 ALA 77 HB3 ALA 77 -10.287 -3.679 -20.464 617 H GLY 78 H GLY 78 -9.143 -6.650 -20.680 618 HA2 GLY 78 HA2 GLY 78 -7.807 -7.916 -22.116 619 HA3 GLY 78 3HA GLY 78 -8.881 -7.501 -23.444 620 H GLY 79 H GLY 79 -7.948 -4.799 -21.630 621 HA2 GLY 79 HA2 GLY 79 -5.986 -3.444 -21.869 622 HA3 GLY 79 3HA GLY 79 -5.649 -4.265 -23.386 623 H ASN 80 H ASN 80 -8.707 -2.849 -22.306 624 HA ASN 80 HA ASN 80 -8.542 -0.996 -24.592 625 HB2 ASN 80 HB2 ASN 80 -10.424 -2.958 -24.169 626 HB3 ASN 80 HB1 ASN 80 -11.221 -1.523 -23.513 627 HD21 ASN 80 HD21 ASN 80 -10.936 0.471 -24.976 628 HD22 ASN 80 HD22 ASN 80 -11.254 0.206 -26.653 629 H TRP 81 H TRP 81 -7.908 0.904 -23.757 630 HA TRP 81 HA TRP 81 -8.802 1.795 -21.162 631 HB2 TRP 81 HB2 TRP 81 -7.170 3.209 -23.292 632 HB3 TRP 81 HB1 TRP 81 -7.449 3.811 -21.657 633 HD1 TRP 81 HD1 TRP 81 -5.563 1.011 -23.496 634 HE1 TRP 81 HE1 TRP 81 -3.699 0.137 -21.951 635 HE3 TRP 81 HE3 TRP 81 -6.738 3.614 -19.256 636 HZ2 TRP 81 2HZ TRP 81 -2.842 0.501 -19.287 637 HZ3 TRP 81 3HZ TRP 81 -5.346 3.293 -17.252 638 HH2 TRP 81 HH TRP 81 -3.440 1.768 -17.268 639 H SER 82 H SER 82 -9.827 2.127 -24.422 640 HA SER 82 HA SER 82 -11.064 4.596 -24.467 641 HB2 SER 82 HB2 SER 82 -10.864 3.026 -26.404 642 HB3 SER 82 HB1 SER 82 -12.171 2.061 -25.696 643 HG SER 82 HG SER 82 -12.453 4.816 -26.288 644 H TYR 83 H TYR 83 -12.537 1.492 -23.514 645 HA TYR 83 HA TYR 83 -14.927 2.751 -22.564 646 HB2 TYR 83 HB2 TYR 83 -15.307 0.585 -23.316 647 HB3 TYR 83 HB1 TYR 83 -13.847 -0.043 -22.548 648 HD1 TYR 83 HD2 TYR 83 -13.814 -0.648 -20.192 649 HD2 TYR 83 HD1 TYR 83 -17.356 0.849 -22.014 650 HE1 TYR 83 HE2 TYR 83 -15.127 -1.425 -18.264 651 HE2 TYR 83 HE1 TYR 83 -18.679 0.077 -20.090 652 HH TYR 83 HH TYR 83 -18.460 -0.558 -17.841 653 H ILE 84 H ILE 84 -12.067 1.319 -21.043 654 HA ILE 84 HA ILE 84 -12.852 1.522 -18.379 655 HB ILE 84 HB ILE 84 -10.096 1.734 -19.589 656 HG12 ILE 84 HG11 ILE 84 -11.420 -0.553 -18.116 657 HG13 ILE 84 HG12 ILE 84 -11.398 -0.403 -19.881 658 HG21 ILE 84 HG21 ILE 84 -11.016 1.964 -16.797 659 HG22 ILE 84 HG22 ILE 84 -9.635 0.904 -17.074 660 HG23 ILE 84 HG23 ILE 84 -9.563 2.595 -17.571 661 HD11 ILE 84 HD11 ILE 84 -8.947 -0.596 -18.148 662 HD12 ILE 84 HD12 ILE 84 -9.667 -1.927 -19.052 663 HD13 ILE 84 HD13 ILE 84 -8.989 -0.543 -19.909 664 H LYS 85 H LYS 85 -11.658 3.950 -20.583 665 HA LYS 85 HA LYS 85 -11.437 5.921 -18.435 666 HB2 LYS 85 HB2 LYS 85 -10.119 7.173 -19.818 667 HB3 LYS 85 HB1 LYS 85 -9.822 5.572 -20.514 668 HG2 LYS 85 HG1 LYS 85 -11.910 6.228 -22.011 669 HG3 LYS 85 HG2 LYS 85 -11.355 7.862 -21.609 670 HD2 LYS 85 HD1 LYS 85 -9.808 5.670 -22.996 671 HD3 LYS 85 HD2 LYS 85 -10.286 7.249 -23.644 672 HE2 LYS 85 HE1 LYS 85 -8.252 6.693 -21.476 673 HE3 LYS 85 HE2 LYS 85 -7.960 7.348 -23.094 674 HZ1 LYS 85 3HZ LYS 85 -9.781 9.062 -22.003 675 HZ2 LYS 85 1HZ LYS 85 -8.118 9.336 -22.146 676 HZ3 LYS 85 2HZ LYS 85 -8.751 8.707 -20.709 677 H LEU 86 H LEU 86 -13.864 4.691 -20.200 678 HA LEU 86 HA LEU 86 -15.202 6.929 -21.256 679 HB2 LEU 86 HB2 LEU 86 -15.711 4.526 -21.738 680 HB3 LEU 86 HB1 LEU 86 -16.459 4.431 -20.135 681 HG LEU 86 HG LEU 86 -17.782 6.550 -21.260 682 HD11 LEU 86 HD11 LEU 86 -16.498 5.435 -23.406 683 HD12 LEU 86 HD12 LEU 86 -17.970 6.402 -23.480 684 HD13 LEU 86 HD13 LEU 86 -18.073 4.642 -23.448 685 HD21 LEU 86 HD21 LEU 86 -18.619 3.662 -21.468 686 HD22 LEU 86 HD22 LEU 86 -19.663 5.079 -21.354 687 HD23 LEU 86 HD23 LEU 86 -18.671 4.602 -19.976 688 H ASP 87 H ASP 87 -14.644 5.976 -18.043 689 HA ASP 87 HA ASP 87 -16.535 8.019 -17.105 690 HB2 ASP 87 HB2 ASP 87 -16.057 5.375 -15.705 691 HB3 ASP 87 HB1 ASP 87 -17.181 6.650 -15.213 692 HD2 ASP 87 HD2 ASP 87 -19.541 5.693 -17.573 693 H ASN 88 H ASN 88 -13.616 7.971 -17.607 694 HA ASN 88 HA ASN 88 -11.743 8.855 -16.662 695 HB2 ASN 88 HB2 ASN 88 -13.751 10.216 -15.480 696 HB3 ASN 88 HB1 ASN 88 -13.036 9.445 -14.058 697 HD21 ASN 88 HD21 ASN 88 -10.380 9.408 -14.725 698 HD22 ASN 88 HD22 ASN 88 -9.785 11.028 -14.818 699 H TYR 89 H TYR 89 -12.142 6.105 -16.477 700 HA TYR 89 HA TYR 89 -11.308 4.249 -15.461 701 HB2 TYR 89 HB2 TYR 89 -9.710 6.247 -13.837 702 HB3 TYR 89 HB1 TYR 89 -9.365 4.524 -13.992 703 HD1 TYR 89 HD2 TYR 89 -10.099 4.453 -17.029 704 HD2 TYR 89 HD1 TYR 89 -7.533 6.910 -14.688 705 HE1 TYR 89 HE2 TYR 89 -8.707 4.881 -19.012 706 HE2 TYR 89 HE1 TYR 89 -6.135 7.346 -16.665 707 HH TYR 89 HH TYR 89 -6.262 5.547 -19.437 708 H THR 90 H THR 90 -13.749 5.206 -14.504 709 HA THR 90 HA THR 90 -14.042 5.563 -11.786 710 HB THR 90 HB THR 90 -15.834 4.128 -13.743 711 HG1 THR 90 HG1 THR 90 -17.050 6.182 -13.197 712 HG21 THR 90 HG21 THR 90 -16.566 3.192 -11.744 713 HG22 THR 90 HG22 THR 90 -17.586 4.623 -11.895 714 HG23 THR 90 HG23 THR 90 -16.192 4.643 -10.814 715 H ALA 91 H ALA 91 -13.316 2.640 -13.547 716 HA ALA 91 HA ALA 91 -14.000 0.692 -11.694 717 HB1 ALA 91 HB1 ALA 91 -13.225 0.241 -13.994 718 HB2 ALA 91 HB2 ALA 91 -12.388 -0.735 -12.786 719 HB3 ALA 91 HB3 ALA 91 -11.585 0.665 -13.499 720 H LEU 92 H LEU 92 -11.217 2.830 -11.788 721 HA LEU 92 HA LEU 92 -9.719 1.503 -9.771 722 HB2 LEU 92 HB2 LEU 92 -8.223 3.268 -9.892 723 HB3 LEU 92 HB1 LEU 92 -8.943 3.229 -11.510 724 HG LEU 92 HG LEU 92 -10.559 5.036 -10.427 725 HD11 LEU 92 HD11 LEU 92 -8.710 6.479 -9.104 726 HD12 LEU 92 HD12 LEU 92 -8.264 4.852 -8.593 727 HD13 LEU 92 HD13 LEU 92 -9.901 5.445 -8.314 728 HD21 LEU 92 HD21 LEU 92 -7.991 6.262 -11.082 729 HD22 LEU 92 HD22 LEU 92 -9.559 6.418 -11.874 730 HD23 LEU 92 HD23 LEU 92 -8.515 5.046 -12.248 731 H VAL 93 H VAL 93 -12.161 4.027 -9.742 732 HA VAL 93 HA VAL 93 -11.848 4.923 -7.108 733 HB VAL 93 HB VAL 93 -14.250 4.830 -8.919 734 HG11 VAL 93 HG11 VAL 93 -15.247 4.715 -6.792 735 HG12 VAL 93 HG12 VAL 93 -14.065 5.818 -6.086 736 HG13 VAL 93 HG13 VAL 93 -15.272 6.425 -7.221 737 HG21 VAL 93 HG21 VAL 93 -13.435 7.431 -8.063 738 HG22 VAL 93 HG22 VAL 93 -12.029 6.550 -8.662 739 HG23 VAL 93 HG23 VAL 93 -13.447 6.752 -9.691 740 H ASP 94 H ASP 94 -14.028 2.422 -8.404 741 HA ASP 94 HA ASP 94 -14.951 1.645 -5.807 742 HB2 ASP 94 HB2 ASP 94 -16.082 1.388 -8.172 743 HB3 ASP 94 HB1 ASP 94 -15.191 -0.139 -8.200 744 HD2 ASP 94 HD2 ASP 94 -17.192 -1.516 -5.699 745 H ALA 95 H ALA 95 -12.387 0.648 -7.945 746 HA ALA 95 HA ALA 95 -11.845 -1.863 -6.739 747 HB1 ALA 95 HB1 ALA 95 -10.952 -1.653 -8.865 748 HB2 ALA 95 HB2 ALA 95 -9.534 -1.448 -7.835 749 HB3 ALA 95 HB3 ALA 95 -10.316 -0.038 -8.550 750 H ILE 96 H ILE 96 -10.124 1.255 -6.483 751 HA ILE 96 HA ILE 96 -8.349 0.496 -4.470 752 HB ILE 96 HB ILE 96 -9.495 3.233 -5.034 753 HG12 ILE 96 HG11 ILE 96 -8.301 2.160 -6.921 754 HG13 ILE 96 HG12 ILE 96 -7.467 3.600 -6.315 755 HG21 ILE 96 HG21 ILE 96 -7.195 2.358 -3.304 756 HG22 ILE 96 HG22 ILE 96 -7.380 4.008 -3.895 757 HG23 ILE 96 HG23 ILE 96 -8.607 3.308 -2.841 758 HD11 ILE 96 HD11 ILE 96 -5.903 2.199 -5.082 759 HD12 ILE 96 HD12 ILE 96 -6.725 0.755 -5.678 760 HD13 ILE 96 HD13 ILE 96 -5.889 1.824 -6.805 761 H TYR 97 H TYR 97 -11.543 2.027 -4.220 762 HA TYR 97 HA TYR 97 -11.583 2.333 -1.437 763 HB2 TYR 97 HB2 TYR 97 -13.599 2.291 -3.614 764 HB3 TYR 97 HB1 TYR 97 -14.206 1.994 -1.983 765 HD1 TYR 97 HD1 TYR 97 -11.846 4.373 -3.653 766 HD2 TYR 97 HD2 TYR 97 -14.967 3.824 -0.815 767 HE1 TYR 97 HE1 TYR 97 -11.844 6.789 -3.194 768 HE2 TYR 97 HE2 TYR 97 -14.976 6.239 -0.349 769 HH TYR 97 HH TYR 97 -12.984 8.175 -0.640 770 H SER 98 H SER 98 -12.207 -0.430 -3.471 771 HA SER 98 HA SER 98 -13.446 -2.006 -1.420 772 HB2 SER 98 HB2 SER 98 -12.528 -2.460 -4.228 773 HB3 SER 98 HB1 SER 98 -12.738 -3.876 -3.184 774 HG SER 98 HG SER 98 -14.617 -2.425 -4.417 775 H VAL 99 H VAL 99 -10.276 -2.160 -3.047 776 HA VAL 99 HA VAL 99 -9.196 -4.158 -1.384 777 HB VAL 99 HB VAL 99 -7.612 -2.018 -2.803 778 HG11 VAL 99 HG11 VAL 99 -6.568 -4.721 -2.809 779 HG12 VAL 99 HG12 VAL 99 -5.800 -3.216 -2.301 780 HG13 VAL 99 HG13 VAL 99 -6.817 -4.114 -1.173 781 HG21 VAL 99 HG21 VAL 99 -9.290 -4.151 -3.878 782 HG22 VAL 99 HG22 VAL 99 -8.595 -2.742 -4.680 783 HG23 VAL 99 HG23 VAL 99 -7.627 -4.201 -4.465 784 H GLU 100 H GLU 100 -8.709 -0.624 -1.338 785 HA GLU 100 HA GLU 100 -7.043 -0.433 0.846 786 HB2 GLU 100 HB2 GLU 100 -7.582 1.832 0.955 787 HB3 GLU 100 HB1 GLU 100 -7.936 1.409 -0.726 788 HG2 GLU 100 HG1 GLU 100 -10.322 1.174 -0.154 789 HG3 GLU 100 HG2 GLU 100 -9.944 1.680 1.498 790 HE2 GLU 100 HE2 GLU 100 -10.892 4.730 0.008 791 H ASP 101 H ASP 101 -10.479 -1.034 0.761 792 HA ASP 101 HA ASP 101 -11.088 -0.462 3.447 793 HB2 ASP 101 HB2 ASP 101 -12.759 -0.809 1.615 794 HB3 ASP 101 HB1 ASP 101 -12.405 -2.540 1.690 795 HD2 ASP 101 HD2 ASP 101 -15.058 -1.221 4.110 796 H GLU 102 H GLU 102 -10.024 -3.444 1.859 797 HA GLU 102 HA GLU 102 -9.196 -4.465 4.476 798 HB2 GLU 102 HB2 GLU 102 -10.007 -6.765 3.706 799 HB3 GLU 102 HB1 GLU 102 -11.236 -5.610 4.245 800 HG2 GLU 102 HG1 GLU 102 -10.637 -5.564 1.359 801 HG3 GLU 102 HG2 GLU 102 -11.395 -7.042 1.969 802 HE2 GLU 102 HE2 GLU 102 -14.111 -4.851 3.137 803 H ASN 103 H ASN 103 -7.130 -5.015 4.397 804 HA ASN 103 HA ASN 103 -6.006 -5.899 1.820 805 HB2 ASN 103 HB2 ASN 103 -4.718 -4.289 4.038 806 HB3 ASN 103 HB1 ASN 103 -3.828 -4.973 2.671 807 HD21 ASN 103 HD21 ASN 103 -6.670 -2.959 3.328 808 HD22 ASN 103 HD22 ASN 103 -6.415 -1.871 2.009 809 H LYS 104 H LYS 104 -6.227 -6.443 5.252 810 HA LYS 104 HA LYS 104 -4.193 -8.293 5.647 811 HB2 LYS 104 HB2 LYS 104 -5.502 -9.122 7.539 812 HB3 LYS 104 HB1 LYS 104 -5.525 -7.352 7.474 813 HG2 LYS 104 HG1 LYS 104 -7.750 -7.271 6.779 814 HG3 LYS 104 HG2 LYS 104 -7.736 -8.966 6.261 815 HD2 LYS 104 HD1 LYS 104 -7.989 -9.781 8.395 816 HD3 LYS 104 HD2 LYS 104 -7.228 -8.361 9.133 817 HE2 LYS 104 HE1 LYS 104 -9.871 -8.119 7.719 818 HE3 LYS 104 HE2 LYS 104 -9.781 -8.689 9.392 819 HZ1 LYS 104 3HZ LYS 104 -8.297 -6.262 8.801 820 HZ2 LYS 104 1HZ LYS 104 -9.230 -6.660 10.156 821 HZ3 LYS 104 2HZ LYS 104 -9.982 -6.129 8.737 822 H GLN 105 H GLN 105 -7.210 -8.624 3.979 823 HA GLN 105 HA GLN 105 -6.725 -11.513 3.671 824 HB2 GLN 105 HB2 GLN 105 -9.108 -11.727 3.114 825 HB3 GLN 105 HB1 GLN 105 -8.868 -11.033 4.725 826 HG2 GLN 105 HG1 GLN 105 -9.000 -8.796 3.142 827 HG3 GLN 105 HG2 GLN 105 -10.152 -9.896 2.370 828 HE21 GLN 105 HE21 GLN 105 -9.337 -8.238 5.338 829 HE22 GLN 105 HE22 GLN 105 -10.907 -8.334 6.051 830 H SER 106 H SER 106 -5.167 -9.980 2.118 831 HA SER 106 HA SER 106 -5.737 -10.837 -0.479 832 HB2 SER 106 HB2 SER 106 -7.424 -9.266 -0.812 833 HB3 SER 106 HB1 SER 106 -6.607 -8.041 0.176 834 HG SER 106 HG SER 106 -6.524 -8.280 -2.435 835 H GLU 107 H GLU 107 -4.075 -10.323 -1.972 836 HA GLU 107 HA GLU 107 -1.596 -9.554 -0.670 837 HB2 GLU 107 HB2 GLU 107 -0.492 -10.374 -2.676 838 HB3 GLU 107 HB1 GLU 107 -1.660 -11.567 -2.086 839 HG2 GLU 107 HG1 GLU 107 -2.055 -11.611 -4.349 840 HG3 GLU 107 HG2 GLU 107 -3.273 -10.459 -3.785 841 HE2 GLU 107 HE2 GLU 107 -0.145 -8.728 -5.512 842 H GLY 108 H GLY 108 -0.043 -8.394 -2.439 843 HA2 GLY 108 HA2 GLY 108 -1.279 -6.333 -3.981 844 HA3 GLY 108 3HA GLY 108 -0.705 -5.720 -2.437 845 H SER 109 H SER 109 0.247 -4.858 -4.950 846 HA SER 109 HA SER 109 3.003 -5.902 -4.897 847 HB2 SER 109 HB2 SER 109 2.245 -6.483 -7.027 848 HB3 SER 109 HB1 SER 109 1.274 -5.007 -7.184 849 HG SER 109 HG SER 109 3.032 -3.871 -7.708 Start of MODEL 18 1 H1 MET 1 H MET 1 -1.190 -17.164 51.163 2 HA MET 1 HA MET 1 -3.810 -18.119 51.826 3 HB2 MET 1 HB2 MET 1 -3.285 -18.900 54.087 4 HB3 MET 1 HB1 MET 1 -2.472 -19.885 52.861 5 HG2 MET 1 HG1 MET 1 -0.983 -17.588 54.040 6 HG3 MET 1 HG2 MET 1 -1.216 -19.043 55.013 7 HE1 MET 1 HE1 MET 1 2.015 -18.184 54.018 8 HE2 MET 1 HE2 MET 1 2.037 -18.235 52.255 9 HE3 MET 1 HE3 MET 1 0.894 -17.184 53.091 10 H GLY 2 H GLY 2 -4.807 -16.879 53.548 11 HA2 GLY 2 HA2 GLY 2 -4.002 -14.999 55.202 12 HA3 GLY 2 3HA GLY 2 -3.667 -14.188 53.680 13 H SER 3 H SER 3 -5.682 -13.889 56.012 14 HA SER 3 HA SER 3 -8.268 -14.276 54.971 15 HB2 SER 3 HB2 SER 3 -7.287 -12.271 57.029 16 HB3 SER 3 HB1 SER 3 -8.987 -12.673 56.726 17 HG SER 3 HG SER 3 -8.761 -14.436 57.846 18 H SER 4 H SER 4 -9.749 -12.794 54.079 19 HA SER 4 HA SER 4 -8.469 -10.735 52.442 20 HB2 SER 4 HB2 SER 4 -11.092 -12.213 52.270 21 HB3 SER 4 HB1 SER 4 -10.817 -10.729 51.343 22 HG SER 4 HG SER 4 -9.345 -11.720 50.132 23 H HIS 5 H HIS 5 -8.628 -10.016 55.078 24 HA HIS 5 HA HIS 5 -10.824 -8.051 55.108 25 HB2 HIS 5 HB2 HIS 5 -10.623 -9.945 56.926 26 HB3 HIS 5 HB1 HIS 5 -9.399 -8.870 57.610 27 HD1 HIS 5 HD1 HIS 5 -12.846 -8.112 56.169 28 HD2 HIS 5 HD2 HIS 5 -10.598 -7.516 59.612 29 HE1 HIS 5 HE1 HIS 5 -14.291 -6.718 57.683 30 HE2 HIS 5 HE2 HIS 5 -12.919 -6.353 59.787 31 H HIS 6 H HIS 6 -8.435 -7.549 53.736 32 HA HIS 6 HA HIS 6 -7.202 -5.496 55.454 33 HB2 HIS 6 HB2 HIS 6 -5.991 -7.392 53.474 34 HB3 HIS 6 HB1 HIS 6 -5.244 -5.810 53.720 35 HD1 HIS 6 HD1 HIS 6 -3.507 -8.061 54.496 36 HD2 HIS 6 HD2 HIS 6 -6.286 -6.452 57.132 37 HE1 HIS 6 HE1 HIS 6 -2.696 -8.686 56.793 38 HE2 HIS 6 HE2 HIS 6 -4.394 -7.703 58.405 39 H HIS 7 H HIS 7 -8.133 -6.366 52.150 40 HA HIS 7 HA HIS 7 -8.653 -5.111 50.322 41 HB2 HIS 7 HB2 HIS 7 -9.474 -3.131 52.464 42 HB3 HIS 7 HB1 HIS 7 -9.937 -3.037 50.763 43 HD1 HIS 7 HD1 HIS 7 -11.423 -5.120 49.869 44 HD2 HIS 7 HD2 HIS 7 -11.181 -4.630 53.987 45 HE1 HIS 7 HE1 HIS 7 -13.331 -6.456 50.818 46 HE2 HIS 7 HE2 HIS 7 -13.185 -6.156 53.335 47 H HIS 8 H HIS 8 -5.944 -4.946 51.297 48 HA HIS 8 HA HIS 8 -5.145 -2.546 49.881 49 HB2 HIS 8 HB2 HIS 8 -5.334 -1.712 52.159 50 HB3 HIS 8 HB1 HIS 8 -4.328 -3.037 52.753 51 HD1 HIS 8 HD1 HIS 8 -4.042 0.032 50.552 52 HD2 HIS 8 HD2 HIS 8 -1.639 -2.561 52.733 53 HE1 HIS 8 HE1 HIS 8 -1.740 1.042 50.497 54 HE2 HIS 8 HE2 HIS 8 -0.270 -0.542 51.830 55 H HIS 9 H HIS 9 -3.723 -3.257 48.447 56 HA HIS 9 HA HIS 9 -2.069 -5.585 49.090 57 HB2 HIS 9 HB2 HIS 9 -2.596 -4.188 46.454 58 HB3 HIS 9 HB1 HIS 9 -1.584 -5.622 46.653 59 HD1 HIS 9 HD1 HIS 9 -3.812 -6.040 44.783 60 HD2 HIS 9 HD2 HIS 9 -4.305 -6.535 48.878 61 HE1 HIS 9 HE1 HIS 9 -5.815 -7.537 45.043 62 HE2 HIS 9 HE2 HIS 9 -6.117 -7.841 47.546 63 H HIS 10 H HIS 10 0.176 -5.484 47.947 64 HA HIS 10 HA HIS 10 1.711 -3.541 49.271 65 HB2 HIS 10 HB2 HIS 10 2.368 -5.414 46.992 66 HB3 HIS 10 HB1 HIS 10 3.574 -4.377 47.759 67 HD1 HIS 10 HD1 HIS 10 0.898 -6.529 49.397 68 HD2 HIS 10 HD2 HIS 10 5.026 -6.067 49.297 69 HE1 HIS 10 HE1 HIS 10 1.796 -8.141 51.106 70 HE2 HIS 10 HE2 HIS 10 4.320 -7.860 51.045 71 H SER 11 H SER 11 0.482 -3.716 45.977 72 HA SER 11 HA SER 11 1.945 -1.540 44.931 73 HB2 SER 11 HB2 SER 11 0.912 -3.082 43.406 74 HB3 SER 11 HB1 SER 11 -0.689 -2.772 44.101 75 HG SER 11 HG SER 11 0.911 -0.991 42.584 76 H SER 12 H SER 12 1.905 0.339 46.030 77 HA SER 12 HA SER 12 -0.682 1.700 46.241 78 HB2 SER 12 HB2 SER 12 -0.419 0.932 48.472 79 HB3 SER 12 HB1 SER 12 1.311 1.321 48.475 80 HG SER 12 HG SER 12 -0.727 2.873 49.201 81 H GLY 13 H GLY 13 -0.555 3.558 45.182 82 HA2 GLY 13 HA2 GLY 13 0.329 5.761 44.935 83 HA3 GLY 13 3HA GLY 13 1.910 5.143 45.389 84 H LEU 14 H LEU 14 2.741 6.249 43.524 85 HA LEU 14 HA LEU 14 2.072 4.963 40.965 86 HB2 LEU 14 HB2 LEU 14 1.977 7.550 41.411 87 HB3 LEU 14 HB1 LEU 14 3.729 7.436 41.162 88 HG LEU 14 HG LEU 14 1.758 6.422 39.128 89 HD11 LEU 14 HD11 LEU 14 2.562 8.710 38.032 90 HD12 LEU 14 HD12 LEU 14 2.602 9.196 39.728 91 HD13 LEU 14 HD13 LEU 14 1.105 8.591 39.019 92 HD21 LEU 14 HD21 LEU 14 3.784 7.001 37.659 93 HD22 LEU 14 HD22 LEU 14 3.877 5.561 38.673 94 HD23 LEU 14 HD23 LEU 14 4.691 7.044 39.171 95 H VAL 15 H VAL 15 3.515 3.687 40.001 96 HA VAL 15 HA VAL 15 5.806 2.741 41.210 97 HB VAL 15 HB VAL 15 6.511 2.051 38.851 98 HG11 VAL 15 HG11 VAL 15 4.514 0.476 38.662 99 HG12 VAL 15 HG12 VAL 15 5.424 0.444 40.173 100 HG13 VAL 15 HG13 VAL 15 3.881 1.295 40.089 101 HG21 VAL 15 HG21 VAL 15 4.977 2.350 37.062 102 HG22 VAL 15 HG22 VAL 15 3.763 3.052 38.132 103 HG23 VAL 15 HG23 VAL 15 5.243 3.943 37.773 104 HA PRO 16 HA PRO 16 8.995 5.703 40.643 105 HB2 PRO 16 HB2 PRO 16 11.179 4.089 40.278 106 HB3 PRO 16 HB1 PRO 16 10.364 4.287 41.828 107 HG2 PRO 16 HG1 PRO 16 10.051 2.120 39.777 108 HG3 PRO 16 HG2 PRO 16 10.216 1.981 41.568 109 HD2 PRO 16 HD1 PRO 16 7.826 1.772 40.296 110 HD3 PRO 16 HD2 PRO 16 7.993 2.484 41.910 111 H ARG 17 H ARG 17 10.733 6.415 39.140 112 HA ARG 17 HA ARG 17 10.329 5.458 36.390 113 HB2 ARG 17 HB2 ARG 17 10.602 8.381 37.104 114 HB3 ARG 17 HB1 ARG 17 10.188 7.681 35.533 115 HG2 ARG 17 HG1 ARG 17 8.040 6.960 36.340 116 HG3 ARG 17 HG2 ARG 17 8.455 7.470 37.984 117 HD2 ARG 17 HD1 ARG 17 8.784 9.815 36.988 118 HD3 ARG 17 HD2 ARG 17 7.934 9.181 35.572 119 HE ARG 17 HE ARG 17 6.346 8.569 37.744 120 HH11 ARG 17 1HH1 ARG 17 7.621 11.445 36.252 121 HH12 ARG 17 2HH1 ARG 17 6.289 12.442 36.735 122 HH21 ARG 17 1HH2 ARG 17 4.589 9.872 38.386 123 HH22 ARG 17 2HH2 ARG 17 4.566 11.547 37.950 124 H GLY 18 H GLY 18 12.050 6.866 34.975 125 HA2 GLY 18 HA2 GLY 18 14.531 7.485 36.149 126 HA3 GLY 18 3HA GLY 18 14.561 5.806 35.633 127 H SER 19 H SER 19 15.753 5.724 33.843 128 HA SER 19 HA SER 19 15.263 7.745 31.756 129 HB2 SER 19 HB2 SER 19 17.574 6.835 30.913 130 HB3 SER 19 HB1 SER 19 17.520 7.982 32.262 131 HG SER 19 HG SER 19 18.807 6.361 32.964 132 H HIS 20 H HIS 20 15.203 7.056 29.565 133 HA HIS 20 HA HIS 20 14.213 4.313 29.274 134 HB2 HIS 20 HB2 HIS 20 13.903 6.786 27.563 135 HB3 HIS 20 HB1 HIS 20 13.371 5.184 27.042 136 HD1 HIS 20 HD1 HIS 20 11.097 4.450 27.759 137 HD2 HIS 20 HD2 HIS 20 12.471 7.697 29.956 138 HE1 HIS 20 HE1 HIS 20 9.152 5.170 29.182 139 HE2 HIS 20 HE2 HIS 20 9.992 7.154 30.526 140 H MET 21 H MET 21 15.629 2.858 28.589 141 HA MET 21 HA MET 21 17.595 3.669 26.551 142 HB2 MET 21 HB2 MET 21 19.158 2.002 27.540 143 HB3 MET 21 HB1 MET 21 18.789 3.358 28.618 144 HG2 MET 21 HG1 MET 21 17.614 2.069 30.097 145 HG3 MET 21 HG2 MET 21 17.141 0.903 28.857 146 HE1 MET 21 HE1 MET 21 19.517 -1.783 28.836 147 HE2 MET 21 HE2 MET 21 18.149 -1.669 29.943 148 HE3 MET 21 HE3 MET 21 18.021 -1.007 28.313 149 H ILE 22 H ILE 22 15.107 2.671 25.869 150 HA ILE 22 HA ILE 22 15.131 -0.155 25.501 151 HB ILE 22 HB ILE 22 13.088 1.385 25.509 152 HG12 ILE 22 HG11 ILE 22 13.438 -0.674 23.314 153 HG13 ILE 22 HG12 ILE 22 12.946 -0.993 24.986 154 HG21 ILE 22 HG21 ILE 22 13.197 1.613 22.596 155 HG22 ILE 22 HG22 ILE 22 12.661 2.777 23.807 156 HG23 ILE 22 HG23 ILE 22 14.378 2.616 23.440 157 HD11 ILE 22 HD11 ILE 22 11.365 -0.006 22.720 158 HD12 ILE 22 HD12 ILE 22 10.881 -0.966 24.119 159 HD13 ILE 22 HD13 ILE 22 11.052 0.782 24.266 160 H SER 23 H SER 23 15.368 -1.320 23.546 161 HA SER 23 HA SER 23 17.428 -0.229 21.822 162 HB2 SER 23 HB2 SER 23 17.421 -2.603 22.778 163 HB3 SER 23 HB1 SER 23 16.152 -2.956 21.592 164 HG SER 23 HG SER 23 18.821 -2.155 21.099 165 H LEU 24 H LEU 24 14.255 0.191 21.838 166 HA LEU 24 HA LEU 24 12.567 0.313 20.255 167 HB2 LEU 24 HB2 LEU 24 13.336 1.887 18.381 168 HB3 LEU 24 HB1 LEU 24 13.419 2.464 20.054 169 HG LEU 24 HG LEU 24 15.849 1.268 18.792 170 HD11 LEU 24 HD11 LEU 24 14.471 3.570 17.792 171 HD12 LEU 24 HD12 LEU 24 15.970 2.834 17.228 172 HD13 LEU 24 HD13 LEU 24 16.012 4.055 18.499 173 HD21 LEU 24 HD21 LEU 24 16.896 2.108 20.578 174 HD22 LEU 24 HD22 LEU 24 15.286 2.298 21.274 175 HD23 LEU 24 HD23 LEU 24 16.057 3.656 20.453 176 H SER 25 H SER 25 13.357 -2.169 19.938 177 HA SER 25 HA SER 25 13.784 -2.497 17.039 178 HB2 SER 25 HB2 SER 25 14.846 -4.001 19.393 179 HB3 SER 25 HB1 SER 25 14.482 -4.916 17.919 180 HG SER 25 HG SER 25 15.976 -3.774 16.813 181 H GLY 26 H GLY 26 12.749 -4.411 16.082 182 HA2 GLY 26 HA2 GLY 26 10.151 -4.934 17.385 183 HA3 GLY 26 3HA GLY 26 10.399 -4.890 15.645 184 H LEU 27 H LEU 27 9.203 -7.009 15.990 185 HA LEU 27 HA LEU 27 11.129 -9.162 16.569 186 HB2 LEU 27 HB2 LEU 27 9.302 -10.585 17.156 187 HB3 LEU 27 HB1 LEU 27 9.139 -9.061 18.045 188 HG LEU 27 HG LEU 27 7.637 -9.382 15.492 189 HD11 LEU 27 HD11 LEU 27 6.089 -10.228 17.780 190 HD12 LEU 27 HD12 LEU 27 7.443 -11.315 17.475 191 HD13 LEU 27 HD13 LEU 27 6.272 -10.986 16.198 192 HD21 LEU 27 HD21 LEU 27 7.144 -7.325 16.279 193 HD22 LEU 27 HD22 LEU 27 7.542 -7.747 17.945 194 HD23 LEU 27 HD23 LEU 27 5.984 -8.218 17.263 195 H THR 28 H THR 28 10.210 -7.544 14.042 196 HA THR 28 HA THR 28 9.143 -9.522 12.281 197 HB THR 28 HB THR 28 9.556 -7.933 10.493 198 HG1 THR 28 HG1 THR 28 11.369 -6.845 10.758 199 HG21 THR 28 HG21 THR 28 8.038 -7.386 12.824 200 HG22 THR 28 HG22 THR 28 7.750 -6.826 11.177 201 HG23 THR 28 HG23 THR 28 8.738 -5.864 12.276 202 H SER 29 H SER 29 10.399 -9.888 10.119 203 HA SER 29 HA SER 29 13.065 -10.891 10.857 204 HB2 SER 29 HB2 SER 29 12.800 -12.627 9.240 205 HB3 SER 29 HB1 SER 29 11.276 -12.546 10.143 206 HG SER 29 HG SER 29 11.300 -12.584 7.676 207 H SER 30 H SER 30 14.170 -11.360 8.432 208 HA SER 30 HA SER 30 14.627 -8.643 7.454 209 HB2 SER 30 HB2 SER 30 16.666 -9.579 6.412 210 HB3 SER 30 HB1 SER 30 16.603 -9.902 8.154 211 HG SER 30 HG SER 30 17.106 -11.695 6.521 212 H VAL 31 H VAL 31 15.530 -8.948 4.962 213 HA VAL 31 HA VAL 31 14.607 -8.803 2.850 214 HB VAL 31 HB VAL 31 14.208 -11.028 1.862 215 HG11 VAL 31 HG11 VAL 31 16.540 -11.737 3.411 216 HG12 VAL 31 HG12 VAL 31 16.414 -11.276 1.712 217 HG13 VAL 31 HG13 VAL 31 16.566 -10.035 2.956 218 HG21 VAL 31 HG21 VAL 31 14.682 -12.156 4.612 219 HG22 VAL 31 HG22 VAL 31 13.073 -11.941 3.924 220 HG23 VAL 31 HG23 VAL 31 14.227 -13.024 3.146 221 H GLU 32 H GLU 32 12.703 -7.930 4.643 222 HA GLU 32 HA GLU 32 10.216 -9.313 4.226 223 HB2 GLU 32 HB2 GLU 32 9.201 -7.547 5.509 224 HB3 GLU 32 HB1 GLU 32 10.715 -8.025 6.294 225 HG2 GLU 32 HG1 GLU 32 11.853 -6.090 5.405 226 HG3 GLU 32 HG2 GLU 32 10.406 -5.634 4.493 227 HE2 GLU 32 HE2 GLU 32 8.786 -4.733 7.564 228 H SER 33 H SER 33 12.013 -6.879 2.600 229 HA SER 33 HA SER 33 9.685 -6.262 0.901 230 HB2 SER 33 HB2 SER 33 12.186 -4.575 1.163 231 HB3 SER 33 HB1 SER 33 10.640 -4.123 0.425 232 HG SER 33 HG SER 33 9.975 -3.524 2.315 233 H ASP 34 H ASP 34 12.872 -7.549 1.024 234 HA ASP 34 HA ASP 34 13.742 -7.251 -1.597 235 HB2 ASP 34 HB2 ASP 34 15.115 -8.163 0.258 236 HB3 ASP 34 HB1 ASP 34 14.167 -9.654 0.190 237 HD2 ASP 34 HD2 ASP 34 16.721 -10.661 -1.920 238 H LEU 35 H LEU 35 11.257 -9.276 -0.290 239 HA LEU 35 HA LEU 35 11.125 -11.044 -2.558 240 HB2 LEU 35 HB2 LEU 35 10.361 -11.359 -0.036 241 HB3 LEU 35 HB1 LEU 35 8.840 -10.721 -0.685 242 HG LEU 35 HG LEU 35 8.843 -13.165 -0.606 243 HD11 LEU 35 HD11 LEU 35 7.826 -13.471 -2.646 244 HD12 LEU 35 HD12 LEU 35 9.003 -12.479 -3.505 245 HD13 LEU 35 HD13 LEU 35 7.779 -11.715 -2.492 246 HD21 LEU 35 HD21 LEU 35 10.537 -13.802 -2.775 247 HD22 LEU 35 HD22 LEU 35 10.678 -14.312 -1.092 248 HD23 LEU 35 HD23 LEU 35 11.481 -12.839 -1.638 249 H ASP 36 H ASP 36 9.542 -8.105 -1.503 250 HA ASP 36 HA ASP 36 7.347 -8.116 -3.239 251 HB2 ASP 36 HB2 ASP 36 7.906 -6.525 -1.274 252 HB3 ASP 36 HB1 ASP 36 8.804 -5.594 -2.482 253 HD2 ASP 36 HD2 ASP 36 5.869 -4.564 -4.069 254 H MET 37 H MET 37 10.701 -7.552 -3.826 255 HA MET 37 HA MET 37 10.431 -6.072 -6.241 256 HB2 MET 37 HB2 MET 37 12.510 -5.907 -5.119 257 HB3 MET 37 HB1 MET 37 12.687 -7.666 -5.039 258 HG2 MET 37 HG1 MET 37 13.516 -7.833 -7.131 259 HG3 MET 37 HG2 MET 37 12.489 -6.536 -7.746 260 HE1 MET 37 HE1 MET 37 13.817 -4.441 -8.768 261 HE2 MET 37 HE2 MET 37 12.837 -4.087 -7.345 262 HE3 MET 37 HE3 MET 37 14.452 -3.392 -7.499 263 H GLN 38 H GLN 38 10.791 -9.508 -5.491 264 HA GLN 38 HA GLN 38 11.128 -10.476 -8.086 265 HB2 GLN 38 HB2 GLN 38 11.512 -11.936 -6.236 266 HB3 GLN 38 HB1 GLN 38 9.854 -11.723 -5.652 267 HG2 GLN 38 HG1 GLN 38 8.949 -13.109 -7.254 268 HG3 GLN 38 HG2 GLN 38 10.310 -12.879 -8.360 269 HE21 GLN 38 HE21 GLN 38 9.927 -13.975 -5.002 270 HE22 GLN 38 HE22 GLN 38 10.862 -15.416 -5.187 271 H GLN 39 H GLN 39 8.318 -9.256 -6.486 272 HA GLN 39 HA GLN 39 6.438 -10.438 -8.324 273 HB2 GLN 39 HB2 GLN 39 6.025 -8.194 -6.334 274 HB3 GLN 39 HB1 GLN 39 4.758 -9.129 -7.145 275 HG2 GLN 39 HG1 GLN 39 6.804 -10.357 -5.303 276 HG3 GLN 39 HG2 GLN 39 5.222 -9.771 -4.770 277 HE21 GLN 39 HE21 GLN 39 6.876 -12.129 -6.748 278 HE22 GLN 39 HE22 GLN 39 5.563 -13.247 -6.858 279 H ALA 40 H ALA 40 8.342 -7.568 -8.154 280 HA ALA 40 HA ALA 40 6.821 -5.849 -9.770 281 HB1 ALA 40 HB1 ALA 40 8.566 -4.435 -9.603 282 HB2 ALA 40 HB2 ALA 40 9.746 -5.669 -10.047 283 HB3 ALA 40 HB3 ALA 40 9.129 -5.592 -8.396 284 H MET 41 H MET 41 8.726 -8.625 -10.538 285 HA MET 41 HA MET 41 9.144 -7.987 -13.299 286 HB2 MET 41 HB2 MET 41 9.225 -10.719 -12.003 287 HB3 MET 41 HB1 MET 41 10.008 -10.220 -13.510 288 HG2 MET 41 HG1 MET 41 11.244 -8.497 -11.983 289 HG3 MET 41 HG2 MET 41 10.774 -9.612 -10.696 290 HE1 MET 41 HE1 MET 41 12.946 -10.591 -14.470 291 HE2 MET 41 HE2 MET 41 12.273 -9.044 -13.960 292 HE3 MET 41 HE3 MET 41 13.937 -9.460 -13.548 293 H LEU 42 H LEU 42 6.824 -9.954 -11.492 294 HA LEU 42 HA LEU 42 5.475 -10.922 -13.815 295 HB2 LEU 42 HB2 LEU 42 5.048 -11.010 -10.873 296 HB3 LEU 42 HB1 LEU 42 3.641 -11.282 -11.916 297 HG LEU 42 HG LEU 42 4.752 -13.367 -11.153 298 HD11 LEU 42 HD11 LEU 42 5.034 -13.099 -14.126 299 HD12 LEU 42 HD12 LEU 42 3.458 -13.070 -13.337 300 HD13 LEU 42 HD13 LEU 42 4.495 -14.489 -13.184 301 HD21 LEU 42 HD21 LEU 42 6.913 -13.908 -11.632 302 HD22 LEU 42 HD22 LEU 42 7.084 -12.158 -11.490 303 HD23 LEU 42 HD23 LEU 42 6.961 -12.906 -13.083 304 H THR 43 H THR 43 5.487 -7.954 -12.205 305 HA THR 43 HA THR 43 2.957 -7.190 -13.514 306 HB THR 43 HB THR 43 2.628 -7.163 -11.104 307 HG1 THR 43 HG1 THR 43 1.529 -5.386 -11.397 308 HG21 THR 43 HG21 THR 43 4.161 -6.475 -9.628 309 HG22 THR 43 HG22 THR 43 4.405 -4.951 -10.481 310 HG23 THR 43 HG23 THR 43 5.287 -6.393 -10.982 311 H ASN 44 H ASN 44 5.184 -7.010 -14.999 312 HA ASN 44 HA ASN 44 6.804 -4.784 -14.820 313 HB2 ASN 44 HB2 ASN 44 6.895 -6.699 -16.511 314 HB3 ASN 44 HB1 ASN 44 5.694 -5.792 -17.439 315 HD21 ASN 44 HD21 ASN 44 8.874 -5.438 -15.934 316 HD22 ASN 44 HD22 ASN 44 9.510 -4.358 -17.124 317 H LYS 45 H LYS 45 6.309 -2.710 -14.645 318 HA LYS 45 HA LYS 45 3.726 -1.681 -15.279 319 HB2 LYS 45 HB2 LYS 45 6.307 -0.283 -14.538 320 HB3 LYS 45 HB1 LYS 45 4.736 0.518 -14.676 321 HG2 LYS 45 HG1 LYS 45 4.762 0.165 -12.432 322 HG3 LYS 45 HG2 LYS 45 4.026 -1.359 -12.956 323 HD2 LYS 45 HD1 LYS 45 6.046 -2.556 -12.717 324 HD3 LYS 45 HD2 LYS 45 6.999 -1.064 -12.616 325 HE2 LYS 45 HE1 LYS 45 4.893 -1.394 -10.560 326 HE3 LYS 45 HE2 LYS 45 6.259 -2.515 -10.469 327 HZ1 LYS 45 3HZ LYS 45 7.767 -0.623 -10.439 328 HZ2 LYS 45 1HZ LYS 45 6.664 -0.532 -9.158 329 HZ3 LYS 45 2HZ LYS 45 6.461 0.448 -10.521 330 H ASP 46 H ASP 46 3.454 0.296 -16.661 331 HA ASP 46 HA ASP 46 5.249 0.407 -18.959 332 HB2 ASP 46 HB2 ASP 46 2.451 -0.599 -18.992 333 HB3 ASP 46 HB1 ASP 46 2.923 0.485 -20.307 334 HD2 ASP 46 HD2 ASP 46 4.053 -3.198 -20.533 335 H GLU 47 H GLU 47 4.679 2.242 -20.429 336 HA GLU 47 HA GLU 47 4.376 4.618 -18.918 337 HB2 GLU 47 HB2 GLU 47 4.388 5.760 -21.131 338 HB3 GLU 47 HB1 GLU 47 5.738 4.637 -20.902 339 HG2 GLU 47 HG1 GLU 47 3.969 2.987 -22.084 340 HG3 GLU 47 HG2 GLU 47 3.493 4.533 -22.800 341 HE2 GLU 47 HE2 GLU 47 6.116 4.356 -24.977 342 H LYS 48 H LYS 48 2.241 2.934 -21.195 343 HA LYS 48 HA LYS 48 0.148 4.787 -21.203 344 HB2 LYS 48 HB2 LYS 48 -1.284 2.780 -21.816 345 HB3 LYS 48 HB1 LYS 48 0.113 3.098 -22.857 346 HG2 LYS 48 HG1 LYS 48 0.279 0.828 -22.595 347 HG3 LYS 48 HG2 LYS 48 1.313 1.401 -21.274 348 HD2 LYS 48 HD1 LYS 48 -0.053 0.592 -19.683 349 HD3 LYS 48 HD2 LYS 48 -1.506 1.151 -20.531 350 HE2 LYS 48 HE1 LYS 48 0.087 -1.342 -21.181 351 HE3 LYS 48 HE2 LYS 48 -1.479 -1.281 -20.359 352 HZ1 LYS 48 3HZ LYS 48 -0.885 -1.116 -23.163 353 HZ2 LYS 48 1HZ LYS 48 -1.929 0.109 -22.642 354 HZ3 LYS 48 2HZ LYS 48 -2.335 -1.513 -22.388 355 H VAL 49 H VAL 49 1.021 2.310 -18.904 356 HA VAL 49 HA VAL 49 -1.421 2.178 -17.493 357 HB VAL 49 HB VAL 49 1.414 1.528 -16.731 358 HG11 VAL 49 HG11 VAL 49 0.771 1.969 -14.606 359 HG12 VAL 49 HG12 VAL 49 -0.948 1.813 -14.976 360 HG13 VAL 49 HG13 VAL 49 0.041 0.370 -14.745 361 HG21 VAL 49 HG21 VAL 49 0.866 -0.367 -17.763 362 HG22 VAL 49 HG22 VAL 49 -0.260 -0.680 -16.442 363 HG23 VAL 49 HG23 VAL 49 -0.821 0.126 -17.905 364 H LEU 50 H LEU 50 1.356 4.317 -17.268 365 HA LEU 50 HA LEU 50 0.905 5.507 -14.809 366 HB2 LEU 50 HB2 LEU 50 1.863 6.879 -17.327 367 HB3 LEU 50 HB1 LEU 50 2.119 7.430 -15.662 368 HG LEU 50 HG LEU 50 3.282 4.922 -16.877 369 HD11 LEU 50 HD11 LEU 50 4.870 7.284 -15.987 370 HD12 LEU 50 HD12 LEU 50 4.113 7.294 -17.579 371 HD13 LEU 50 HD13 LEU 50 5.273 6.033 -17.162 372 HD21 LEU 50 HD21 LEU 50 4.648 4.922 -14.791 373 HD22 LEU 50 HD22 LEU 50 2.934 4.591 -14.535 374 HD23 LEU 50 HD23 LEU 50 3.592 6.185 -14.159 375 H LYS 51 H LYS 51 -0.691 6.049 -17.883 376 HA LYS 51 HA LYS 51 -1.983 8.442 -17.444 377 HB2 LYS 51 HB2 LYS 51 -2.897 5.947 -18.879 378 HB3 LYS 51 HB1 LYS 51 -3.832 7.450 -18.892 379 HG2 LYS 51 HG1 LYS 51 -0.956 7.519 -19.699 380 HG3 LYS 51 HG2 LYS 51 -2.172 6.899 -20.830 381 HD2 LYS 51 HD1 LYS 51 -2.173 9.123 -21.407 382 HD3 LYS 51 HD2 LYS 51 -3.448 9.104 -20.175 383 HE2 LYS 51 HE1 LYS 51 -2.188 10.230 -18.636 384 HE3 LYS 51 HE2 LYS 51 -0.670 9.549 -19.240 385 HZ1 LYS 51 3HZ LYS 51 -2.228 11.799 -20.364 386 HZ2 LYS 51 1HZ LYS 51 -1.032 11.003 -21.258 387 HZ3 LYS 51 2HZ LYS 51 -0.626 11.800 -19.822 388 H ALA 52 H ALA 52 -2.757 5.261 -16.176 389 HA ALA 52 HA ALA 52 -5.294 5.990 -15.093 390 HB1 ALA 52 HB1 ALA 52 -5.428 3.778 -14.983 391 HB2 ALA 52 HB2 ALA 52 -4.285 3.809 -13.639 392 HB3 ALA 52 HB3 ALA 52 -3.699 3.619 -15.291 393 H LEU 53 H LEU 53 -2.009 5.788 -13.799 394 HA LEU 53 HA LEU 53 -2.616 6.245 -11.104 395 HB2 LEU 53 HB2 LEU 53 -0.131 7.188 -12.535 396 HB3 LEU 53 HB1 LEU 53 -0.312 6.798 -10.816 397 HG LEU 53 HG LEU 53 -0.448 4.806 -13.079 398 HD11 LEU 53 HD11 LEU 53 1.798 5.751 -12.745 399 HD12 LEU 53 HD12 LEU 53 1.713 4.045 -12.308 400 HD13 LEU 53 HD13 LEU 53 1.728 5.279 -11.047 401 HD21 LEU 53 HD21 LEU 53 -0.707 4.569 -10.100 402 HD22 LEU 53 HD22 LEU 53 -0.173 3.212 -11.091 403 HD23 LEU 53 HD23 LEU 53 -1.763 3.928 -11.359 404 H GLU 54 H GLU 54 -2.681 8.351 -13.808 405 HA GLU 54 HA GLU 54 -2.220 10.817 -12.509 406 HB2 GLU 54 HB2 GLU 54 -3.871 10.216 -14.975 407 HB3 GLU 54 HB1 GLU 54 -3.330 11.823 -14.470 408 HG2 GLU 54 HG1 GLU 54 -1.461 9.548 -15.124 409 HG3 GLU 54 HG2 GLU 54 -1.971 10.785 -16.281 410 HE2 GLU 54 HE2 GLU 54 1.022 11.621 -14.018 411 H ARG 55 H ARG 55 -5.167 8.962 -13.139 412 HA ARG 55 HA ARG 55 -6.889 10.934 -11.962 413 HB2 ARG 55 HB2 ARG 55 -7.861 9.586 -13.650 414 HB3 ARG 55 HB1 ARG 55 -7.307 8.094 -12.875 415 HG2 ARG 55 HG1 ARG 55 -9.719 8.433 -12.602 416 HG3 ARG 55 HG2 ARG 55 -8.864 8.418 -11.051 417 HD2 ARG 55 HD1 ARG 55 -9.485 10.514 -10.563 418 HD3 ARG 55 HD2 ARG 55 -9.040 11.087 -12.177 419 HE ARG 55 HE ARG 55 -11.400 9.692 -12.490 420 HH11 ARG 55 1HH1 ARG 55 -10.303 12.484 -10.724 421 HH12 ARG 55 2HH1 ARG 55 -11.844 13.273 -10.758 422 HH21 ARG 55 1HH2 ARG 55 -13.435 10.720 -12.542 423 HH22 ARG 55 2HH2 ARG 55 -13.626 12.269 -11.792 424 H THR 56 H THR 56 -5.241 8.044 -10.885 425 HA THR 56 HA THR 56 -6.665 7.793 -8.420 426 HB THR 56 HB THR 56 -5.098 6.101 -7.824 427 HG1 THR 56 HG1 THR 56 -3.120 6.953 -8.250 428 HG21 THR 56 HG21 THR 56 -5.907 4.704 -9.358 429 HG22 THR 56 HG22 THR 56 -4.841 5.379 -10.590 430 HG23 THR 56 HG23 THR 56 -6.424 6.099 -10.303 431 H ARG 57 H ARG 57 -3.510 9.136 -9.340 432 HA ARG 57 HA ARG 57 -2.548 9.792 -6.828 433 HB2 ARG 57 HB2 ARG 57 -1.123 11.408 -7.915 434 HB3 ARG 57 HB1 ARG 57 -1.263 9.975 -8.944 435 HG2 ARG 57 HG1 ARG 57 -2.524 11.056 -10.542 436 HG3 ARG 57 HG2 ARG 57 -3.094 12.283 -9.399 437 HD2 ARG 57 HD1 ARG 57 -1.401 13.062 -11.125 438 HD3 ARG 57 HD2 ARG 57 -1.034 13.429 -9.434 439 HE ARG 57 HE ARG 57 0.133 10.970 -10.372 440 HH11 ARG 57 1HH1 ARG 57 0.530 14.416 -10.079 441 HH12 ARG 57 2HH1 ARG 57 2.259 14.356 -10.170 442 HH21 ARG 57 1HH2 ARG 57 2.409 10.878 -10.494 443 HH22 ARG 57 2HH2 ARG 57 3.327 12.344 -10.407 444 H GLN 58 H GLN 58 -5.083 11.263 -8.671 445 HA GLN 58 HA GLN 58 -5.128 13.790 -7.407 446 HB2 GLN 58 HB2 GLN 58 -7.240 12.189 -8.851 447 HB3 GLN 58 HB1 GLN 58 -7.543 13.810 -8.208 448 HG2 GLN 58 HG1 GLN 58 -5.337 13.192 -10.165 449 HG3 GLN 58 HG2 GLN 58 -6.961 13.702 -10.643 450 HE21 GLN 58 HE21 GLN 58 -4.064 14.664 -8.926 451 HE22 GLN 58 HE22 GLN 58 -4.338 16.367 -9.031 452 H LEU 59 H LEU 59 -6.628 10.698 -6.644 453 HA LEU 59 HA LEU 59 -7.956 11.853 -4.314 454 HB2 LEU 59 HB2 LEU 59 -8.011 8.973 -5.207 455 HB3 LEU 59 HB1 LEU 59 -9.143 9.808 -4.129 456 HG LEU 59 HG LEU 59 -9.105 11.066 -6.722 457 HD11 LEU 59 HD11 LEU 59 -9.692 8.111 -6.648 458 HD12 LEU 59 HD12 LEU 59 -8.451 8.925 -7.601 459 HD13 LEU 59 HD13 LEU 59 -10.157 9.198 -7.957 460 HD21 LEU 59 HD21 LEU 59 -11.300 9.550 -5.321 461 HD22 LEU 59 HD22 LEU 59 -11.472 10.815 -6.540 462 HD23 LEU 59 HD23 LEU 59 -10.849 11.212 -4.938 463 H ASP 60 H ASP 60 -4.947 11.156 -4.796 464 HA ASP 60 HA ASP 60 -3.182 10.553 -3.494 465 HB2 ASP 60 HB2 ASP 60 -5.345 11.131 -1.568 466 HB3 ASP 60 HB1 ASP 60 -4.041 10.114 -0.944 467 HD2 ASP 60 HD2 ASP 60 -1.958 12.801 -0.626 468 H ILE 61 H ILE 61 -3.283 8.554 -4.787 469 HA ILE 61 HA ILE 61 -3.766 6.233 -3.044 470 HB ILE 61 HB ILE 61 -4.277 6.241 -6.018 471 HG12 ILE 61 HG11 ILE 61 -6.304 6.242 -3.769 472 HG13 ILE 61 HG12 ILE 61 -5.890 7.666 -4.739 473 HG21 ILE 61 HG21 ILE 61 -3.604 4.105 -4.779 474 HG22 ILE 61 HG22 ILE 61 -5.190 4.204 -4.014 475 HG23 ILE 61 HG23 ILE 61 -5.064 4.053 -5.767 476 HD11 ILE 61 HD11 ILE 61 -6.533 5.586 -6.539 477 HD12 ILE 61 HD12 ILE 61 -7.790 5.641 -5.303 478 HD13 ILE 61 HD13 ILE 61 -7.405 7.089 -6.234 479 HA PRO 62 HA PRO 62 0.473 5.378 -3.995 480 HB2 PRO 62 HB2 PRO 62 0.567 2.867 -2.906 481 HB3 PRO 62 HB1 PRO 62 0.553 4.344 -1.945 482 HG2 PRO 62 HG1 PRO 62 -1.719 2.526 -2.669 483 HG3 PRO 62 HG2 PRO 62 -1.310 3.261 -1.074 484 HD2 PRO 62 HD1 PRO 62 -3.261 4.247 -2.685 485 HD3 PRO 62 HD2 PRO 62 -2.259 5.281 -1.650 486 H ASP 63 H ASP 63 1.483 4.554 -5.730 487 HA ASP 63 HA ASP 63 0.026 3.202 -7.750 488 HB2 ASP 63 HB2 ASP 63 3.032 3.498 -7.519 489 HB3 ASP 63 HB1 ASP 63 2.109 3.170 -8.990 490 HD2 ASP 63 HD2 ASP 63 0.817 6.640 -8.291 491 H GLU 64 H GLU 64 1.453 2.075 -4.940 492 HA GLU 64 HA GLU 64 2.388 -0.460 -5.882 493 HB2 GLU 64 HB2 GLU 64 1.593 0.220 -3.049 494 HB3 GLU 64 HB1 GLU 64 2.746 -1.008 -3.592 495 HG2 GLU 64 HG1 GLU 64 4.101 0.950 -4.549 496 HG3 GLU 64 HG2 GLU 64 3.076 1.967 -3.527 497 HE2 GLU 64 HE2 GLU 64 6.029 0.054 -1.861 498 H LYS 65 H LYS 65 -0.668 0.838 -4.965 499 HA LYS 65 HA LYS 65 -1.841 -1.863 -4.914 500 HB2 LYS 65 HB2 LYS 65 -3.565 -1.083 -3.547 501 HB3 LYS 65 HB1 LYS 65 -2.135 -0.237 -2.932 502 HG2 LYS 65 HG1 LYS 65 -2.778 1.730 -4.340 503 HG3 LYS 65 HG2 LYS 65 -4.290 0.881 -4.709 504 HD2 LYS 65 HD1 LYS 65 -3.331 1.585 -1.926 505 HD3 LYS 65 HD2 LYS 65 -4.529 2.501 -2.857 506 HE2 LYS 65 HE1 LYS 65 -6.167 1.119 -2.235 507 HE3 LYS 65 HE2 LYS 65 -5.247 -0.279 -2.809 508 HZ1 LYS 65 3HZ LYS 65 -3.981 -0.090 -0.638 509 HZ2 LYS 65 1HZ LYS 65 -5.575 -0.647 -0.540 510 HZ3 LYS 65 2HZ LYS 65 -5.211 0.949 -0.119 511 H THR 66 H THR 66 -1.793 1.185 -6.550 512 HA THR 66 HA THR 66 -4.228 0.801 -8.012 513 HB THR 66 HB THR 66 -1.959 2.641 -8.768 514 HG1 THR 66 HG1 THR 66 -2.446 3.784 -7.065 515 HG21 THR 66 HG21 THR 66 -3.616 3.914 -9.906 516 HG22 THR 66 HG22 THR 66 -4.925 2.973 -9.189 517 HG23 THR 66 HG23 THR 66 -3.858 2.234 -10.382 518 H MET 67 H MET 67 -0.807 0.197 -8.597 519 HA MET 67 HA MET 67 -0.764 -0.285 -11.297 520 HB2 MET 67 HB2 MET 67 0.752 -1.339 -8.967 521 HB3 MET 67 HB1 MET 67 0.911 -2.221 -10.495 522 HG2 MET 67 HG1 MET 67 1.540 0.692 -10.012 523 HG3 MET 67 HG2 MET 67 2.687 -0.617 -10.304 524 HE1 MET 67 HE1 MET 67 1.619 -2.332 -12.353 525 HE2 MET 67 HE2 MET 67 0.024 -1.689 -12.739 526 HE3 MET 67 HE3 MET 67 1.306 -1.654 -13.951 527 HA PRO 68 HA PRO 68 -2.131 -4.863 -10.546 528 HB2 PRO 68 HB2 PRO 68 -3.123 -5.486 -8.071 529 HB3 PRO 68 HB1 PRO 68 -1.415 -5.603 -8.491 530 HG2 PRO 68 HG1 PRO 68 -2.881 -3.396 -7.084 531 HG3 PRO 68 HG2 PRO 68 -1.301 -4.160 -6.671 532 HD2 PRO 68 HD1 PRO 68 -1.484 -1.758 -7.923 533 HD3 PRO 68 HD2 PRO 68 -0.173 -2.906 -8.243 534 H VAL 69 H VAL 69 -3.813 -2.106 -9.359 535 HA VAL 69 HA VAL 69 -6.445 -3.278 -9.515 536 HB VAL 69 HB VAL 69 -5.435 -0.496 -9.007 537 HG11 VAL 69 HG11 VAL 69 -8.128 -1.330 -9.914 538 HG12 VAL 69 HG12 VAL 69 -8.050 -0.164 -8.592 539 HG13 VAL 69 HG13 VAL 69 -7.278 0.199 -10.136 540 HG21 VAL 69 HG21 VAL 69 -5.772 -2.550 -7.322 541 HG22 VAL 69 HG22 VAL 69 -5.995 -0.868 -6.843 542 HG23 VAL 69 HG23 VAL 69 -7.393 -1.858 -7.260 543 H LEU 70 H LEU 70 -4.774 -0.683 -11.306 544 HA LEU 70 HA LEU 70 -6.701 -0.384 -13.308 545 HB2 LEU 70 HB2 LEU 70 -4.959 0.729 -14.606 546 HB3 LEU 70 HB1 LEU 70 -4.954 1.252 -12.913 547 HG LEU 70 HG LEU 70 -3.089 -0.698 -12.812 548 HD11 LEU 70 HD11 LEU 70 -2.476 0.613 -15.427 549 HD12 LEU 70 HD12 LEU 70 -3.433 -0.866 -15.374 550 HD13 LEU 70 HD13 LEU 70 -1.796 -0.853 -14.721 551 HD21 LEU 70 HD21 LEU 70 -2.791 1.516 -11.925 552 HD22 LEU 70 HD22 LEU 70 -2.715 2.202 -13.548 553 HD23 LEU 70 HD23 LEU 70 -1.428 1.138 -12.979 554 H MET 71 H MET 71 -3.798 -2.419 -13.198 555 HA MET 71 HA MET 71 -3.933 -3.434 -15.797 556 HB2 MET 71 HB2 MET 71 -2.379 -5.056 -15.129 557 HB3 MET 71 HB1 MET 71 -2.062 -3.681 -14.060 558 HG2 MET 71 HG1 MET 71 -2.080 -5.260 -12.458 559 HG3 MET 71 HG2 MET 71 -3.826 -5.008 -12.548 560 HE1 MET 71 HE1 MET 71 -1.730 -8.636 -12.487 561 HE2 MET 71 HE2 MET 71 -1.057 -8.025 -13.999 562 HE3 MET 71 HE3 MET 71 -1.027 -7.018 -12.550 563 H LYS 72 H LYS 72 -5.848 -4.111 -13.011 564 HA LYS 72 HA LYS 72 -6.789 -6.680 -13.813 565 HB2 LYS 72 HB2 LYS 72 -6.826 -5.748 -11.467 566 HB3 LYS 72 HB1 LYS 72 -8.178 -4.726 -11.978 567 HG2 LYS 72 HG1 LYS 72 -9.338 -6.463 -11.070 568 HG3 LYS 72 HG2 LYS 72 -9.196 -7.032 -12.742 569 HD2 LYS 72 HD1 LYS 72 -7.026 -7.739 -10.815 570 HD3 LYS 72 HD2 LYS 72 -8.577 -8.592 -10.703 571 HE2 LYS 72 HE1 LYS 72 -8.291 -8.891 -13.290 572 HE3 LYS 72 HE2 LYS 72 -6.587 -8.568 -12.935 573 HZ1 LYS 72 3HZ LYS 72 -7.104 -10.943 -12.918 574 HZ2 LYS 72 1HZ LYS 72 -8.209 -10.704 -11.658 575 HZ3 LYS 72 2HZ LYS 72 -6.561 -10.416 -11.404 576 H LEU 73 H LEU 73 -7.737 -3.394 -14.482 577 HA LEU 73 HA LEU 73 -10.319 -4.038 -15.532 578 HB2 LEU 73 HB2 LEU 73 -8.788 -1.570 -16.281 579 HB3 LEU 73 HB1 LEU 73 -10.530 -1.783 -16.042 580 HG LEU 73 HG LEU 73 -8.455 -1.725 -13.852 581 HD11 LEU 73 HD11 LEU 73 -9.525 0.419 -13.261 582 HD12 LEU 73 HD12 LEU 73 -10.487 0.319 -14.736 583 HD13 LEU 73 HD13 LEU 73 -8.732 0.460 -14.835 584 HD21 LEU 73 HD21 LEU 73 -10.333 -3.153 -13.278 585 HD22 LEU 73 HD22 LEU 73 -11.466 -1.881 -13.736 586 HD23 LEU 73 HD23 LEU 73 -10.398 -1.653 -12.351 587 H LEU 74 H LEU 74 -7.178 -3.231 -16.990 588 HA LEU 74 HA LEU 74 -7.975 -3.418 -19.669 589 HB2 LEU 74 HB2 LEU 74 -5.324 -3.774 -18.287 590 HB3 LEU 74 HB1 LEU 74 -5.497 -3.947 -20.042 591 HG LEU 74 HG LEU 74 -4.668 -1.749 -19.541 592 HD11 LEU 74 HD11 LEU 74 -5.881 -1.004 -21.237 593 HD12 LEU 74 HD12 LEU 74 -7.231 -0.693 -20.145 594 HD13 LEU 74 HD13 LEU 74 -7.083 -2.261 -20.939 595 HD21 LEU 74 HD21 LEU 74 -7.145 -1.314 -17.879 596 HD22 LEU 74 HD22 LEU 74 -5.817 -0.181 -18.136 597 HD23 LEU 74 HD23 LEU 74 -5.549 -1.664 -17.216 598 H GLU 75 H GLU 75 -7.318 -5.853 -17.310 599 HA GLU 75 HA GLU 75 -6.620 -8.018 -18.918 600 HB2 GLU 75 HB2 GLU 75 -8.137 -7.844 -16.315 601 HB3 GLU 75 HB1 GLU 75 -7.745 -9.393 -17.076 602 HG2 GLU 75 HG1 GLU 75 -5.412 -7.685 -16.898 603 HG3 GLU 75 HG2 GLU 75 -6.159 -7.955 -15.317 604 HE2 GLU 75 HE2 GLU 75 -5.191 -11.267 -15.251 605 H GLU 76 H GLU 76 -9.866 -7.063 -17.792 606 HA GLU 76 HA GLU 76 -11.159 -8.991 -19.482 607 HB2 GLU 76 HB2 GLU 76 -12.454 -6.638 -18.099 608 HB3 GLU 76 HB1 GLU 76 -13.213 -8.156 -18.602 609 HG2 GLU 76 HG1 GLU 76 -11.261 -7.731 -16.348 610 HG3 GLU 76 HG2 GLU 76 -12.954 -8.239 -16.249 611 HE2 GLU 76 HE2 GLU 76 -10.203 -10.962 -16.877 612 H ALA 77 H ALA 77 -10.291 -5.627 -19.698 613 HA ALA 77 HA ALA 77 -11.947 -5.141 -22.024 614 HB1 ALA 77 HB1 ALA 77 -9.881 -3.435 -20.643 615 HB2 ALA 77 HB2 ALA 77 -11.634 -3.318 -20.492 616 HB3 ALA 77 HB3 ALA 77 -10.852 -2.914 -22.020 617 H GLY 78 H GLY 78 -9.299 -6.930 -21.663 618 HA2 GLY 78 HA2 GLY 78 -7.611 -7.641 -23.048 619 HA3 GLY 78 3HA GLY 78 -8.643 -7.089 -24.359 620 H GLY 79 H GLY 79 -7.575 -4.803 -21.984 621 HA2 GLY 79 HA2 GLY 79 -5.777 -3.298 -22.036 622 HA3 GLY 79 3HA GLY 79 -5.302 -3.955 -23.595 623 H ASN 80 H ASN 80 -8.471 -2.711 -22.631 624 HA ASN 80 HA ASN 80 -8.174 -0.630 -24.696 625 HB2 ASN 80 HB2 ASN 80 -9.965 -2.629 -24.792 626 HB3 ASN 80 HB1 ASN 80 -10.889 -1.470 -23.828 627 HD21 ASN 80 HD21 ASN 80 -10.911 0.796 -24.724 628 HD22 ASN 80 HD22 ASN 80 -11.126 0.950 -26.432 629 H TRP 81 H TRP 81 -7.653 1.182 -23.618 630 HA TRP 81 HA TRP 81 -8.777 1.785 -21.032 631 HB2 TRP 81 HB2 TRP 81 -7.043 3.478 -22.856 632 HB3 TRP 81 HB1 TRP 81 -7.428 3.838 -21.172 633 HD1 TRP 81 HD1 TRP 81 -5.460 1.240 -23.241 634 HE1 TRP 81 HE1 TRP 81 -3.628 0.238 -21.737 635 HE3 TRP 81 HE3 TRP 81 -6.718 3.487 -18.824 636 HZ2 TRP 81 2HZ TRP 81 -2.822 0.382 -19.035 637 HZ3 TRP 81 3HZ TRP 81 -5.365 3.001 -16.827 638 HH2 TRP 81 HH TRP 81 -3.459 1.480 -16.932 639 H SER 82 H SER 82 -9.554 2.425 -24.312 640 HA SER 82 HA SER 82 -10.838 4.866 -24.225 641 HB2 SER 82 HB2 SER 82 -10.482 3.076 -26.165 642 HB3 SER 82 HB1 SER 82 -12.154 2.660 -25.745 643 HG SER 82 HG SER 82 -11.984 4.295 -27.383 644 H TYR 83 H TYR 83 -12.271 1.666 -23.593 645 HA TYR 83 HA TYR 83 -14.764 2.801 -22.732 646 HB2 TYR 83 HB2 TYR 83 -15.030 0.698 -23.699 647 HB3 TYR 83 HB1 TYR 83 -13.627 0.029 -22.863 648 HD1 TYR 83 HD2 TYR 83 -13.778 -0.761 -20.567 649 HD2 TYR 83 HD1 TYR 83 -17.185 0.829 -22.558 650 HE1 TYR 83 HE2 TYR 83 -15.231 -1.708 -18.824 651 HE2 TYR 83 HE1 TYR 83 -18.648 -0.113 -20.820 652 HH TYR 83 HH TYR 83 -17.436 -1.370 -17.882 653 H ILE 84 H ILE 84 -11.964 1.325 -21.150 654 HA ILE 84 HA ILE 84 -12.939 1.278 -18.535 655 HB ILE 84 HB ILE 84 -10.106 1.648 -19.509 656 HG12 ILE 84 HG11 ILE 84 -11.550 -0.800 -18.463 657 HG13 ILE 84 HG12 ILE 84 -11.252 -0.458 -20.175 658 HG21 ILE 84 HG21 ILE 84 -11.204 1.184 -16.752 659 HG22 ILE 84 HG22 ILE 84 -9.550 0.757 -17.191 660 HG23 ILE 84 HG23 ILE 84 -10.084 2.434 -17.295 661 HD11 ILE 84 HD11 ILE 84 -8.759 -0.264 -18.915 662 HD12 ILE 84 HD12 ILE 84 -9.534 -1.712 -18.271 663 HD13 ILE 84 HD13 ILE 84 -9.326 -1.523 -20.012 664 H LYS 85 H LYS 85 -11.832 3.913 -20.484 665 HA LYS 85 HA LYS 85 -11.693 5.698 -18.166 666 HB2 LYS 85 HB2 LYS 85 -10.386 7.111 -19.402 667 HB3 LYS 85 HB1 LYS 85 -10.000 5.578 -20.200 668 HG2 LYS 85 HG1 LYS 85 -12.076 6.278 -21.712 669 HG3 LYS 85 HG2 LYS 85 -11.560 7.891 -21.191 670 HD2 LYS 85 HD1 LYS 85 -9.926 5.814 -22.657 671 HD3 LYS 85 HD2 LYS 85 -10.433 7.411 -23.237 672 HE2 LYS 85 HE1 LYS 85 -8.450 6.807 -21.033 673 HE3 LYS 85 HE2 LYS 85 -8.120 7.529 -22.614 674 HZ1 LYS 85 3HZ LYS 85 -8.385 9.487 -21.635 675 HZ2 LYS 85 1HZ LYS 85 -8.973 8.788 -20.211 676 HZ3 LYS 85 2HZ LYS 85 -10.033 9.139 -21.482 677 H LEU 86 H LEU 86 -14.035 4.542 -20.073 678 HA LEU 86 HA LEU 86 -15.423 6.737 -21.078 679 HB2 LEU 86 HB2 LEU 86 -15.938 4.346 -21.529 680 HB3 LEU 86 HB1 LEU 86 -16.618 4.235 -19.895 681 HG LEU 86 HG LEU 86 -18.005 6.345 -21.002 682 HD11 LEU 86 HD11 LEU 86 -17.431 6.127 -23.217 683 HD12 LEU 86 HD12 LEU 86 -18.866 5.107 -23.130 684 HD13 LEU 86 HD13 LEU 86 -17.263 4.374 -23.115 685 HD21 LEU 86 HD21 LEU 86 -19.884 4.833 -20.989 686 HD22 LEU 86 HD22 LEU 86 -18.859 4.504 -19.592 687 HD23 LEU 86 HD23 LEU 86 -18.805 3.437 -20.998 688 H ASP 87 H ASP 87 -14.967 5.693 -17.830 689 HA ASP 87 HA ASP 87 -16.830 7.784 -16.917 690 HB2 ASP 87 HB2 ASP 87 -16.234 5.358 -15.243 691 HB3 ASP 87 HB1 ASP 87 -17.616 6.459 -15.160 692 HD2 ASP 87 HD2 ASP 87 -17.760 3.445 -17.709 693 H ASN 88 H ASN 88 -13.902 7.772 -17.463 694 HA ASN 88 HA ASN 88 -12.041 8.730 -16.571 695 HB2 ASN 88 HB2 ASN 88 -14.101 10.054 -15.373 696 HB3 ASN 88 HB1 ASN 88 -13.254 9.403 -13.965 697 HD21 ASN 88 HD21 ASN 88 -10.646 9.474 -14.826 698 HD22 ASN 88 HD22 ASN 88 -10.155 11.118 -15.033 699 H TYR 89 H TYR 89 -12.395 5.978 -16.275 700 HA TYR 89 HA TYR 89 -11.507 4.181 -15.203 701 HB2 TYR 89 HB2 TYR 89 -9.939 6.270 -13.668 702 HB3 TYR 89 HB1 TYR 89 -9.558 4.548 -13.761 703 HD1 TYR 89 HD2 TYR 89 -10.296 4.327 -16.780 704 HD2 TYR 89 HD1 TYR 89 -7.798 6.968 -14.569 705 HE1 TYR 89 HE2 TYR 89 -8.930 4.708 -18.789 706 HE2 TYR 89 HE1 TYR 89 -6.426 7.357 -16.573 707 HH TYR 89 HH TYR 89 -7.179 7.023 -19.410 708 H THR 90 H THR 90 -13.958 5.137 -14.257 709 HA THR 90 HA THR 90 -14.234 5.579 -11.551 710 HB THR 90 HB THR 90 -16.017 4.043 -13.439 711 HG1 THR 90 HG1 THR 90 -15.880 6.694 -12.463 712 HG21 THR 90 HG21 THR 90 -17.783 4.459 -11.657 713 HG22 THR 90 HG22 THR 90 -16.447 4.769 -10.548 714 HG23 THR 90 HG23 THR 90 -16.609 3.189 -11.313 715 H ALA 91 H ALA 91 -13.521 2.594 -13.224 716 HA ALA 91 HA ALA 91 -14.136 0.716 -11.279 717 HB1 ALA 91 HB1 ALA 91 -13.458 0.098 -13.530 718 HB2 ALA 91 HB2 ALA 91 -12.442 -0.710 -12.335 719 HB3 ALA 91 HB3 ALA 91 -11.825 0.688 -13.218 720 H LEU 92 H LEU 92 -11.332 2.824 -11.561 721 HA LEU 92 HA LEU 92 -9.767 1.605 -9.549 722 HB2 LEU 92 HB2 LEU 92 -8.310 3.376 -9.778 723 HB3 LEU 92 HB1 LEU 92 -9.127 3.348 -11.350 724 HG LEU 92 HG LEU 92 -10.696 5.122 -10.150 725 HD11 LEU 92 HD11 LEU 92 -8.223 5.023 -8.514 726 HD12 LEU 92 HD12 LEU 92 -9.880 5.402 -8.045 727 HD13 LEU 92 HD13 LEU 92 -8.905 6.605 -8.889 728 HD21 LEU 92 HD21 LEU 92 -9.833 6.440 -11.720 729 HD22 LEU 92 HD22 LEU 92 -8.645 5.176 -12.031 730 HD23 LEU 92 HD23 LEU 92 -8.267 6.484 -10.911 731 H VAL 93 H VAL 93 -12.302 4.025 -9.474 732 HA VAL 93 HA VAL 93 -11.903 4.938 -6.836 733 HB VAL 93 HB VAL 93 -14.334 4.903 -8.611 734 HG11 VAL 93 HG11 VAL 93 -15.109 6.644 -6.788 735 HG12 VAL 93 HG12 VAL 93 -15.442 4.920 -6.609 736 HG13 VAL 93 HG13 VAL 93 -14.091 5.654 -5.743 737 HG21 VAL 93 HG21 VAL 93 -13.673 6.931 -9.295 738 HG22 VAL 93 HG22 VAL 93 -13.244 7.442 -7.662 739 HG23 VAL 93 HG23 VAL 93 -12.104 6.495 -8.618 740 H ASP 94 H ASP 94 -14.093 2.459 -8.149 741 HA ASP 94 HA ASP 94 -15.045 1.680 -5.564 742 HB2 ASP 94 HB2 ASP 94 -16.221 1.443 -7.860 743 HB3 ASP 94 HB1 ASP 94 -15.248 -0.023 -8.034 744 HD2 ASP 94 HD2 ASP 94 -17.356 -1.798 -6.015 745 H ALA 95 H ALA 95 -12.459 0.682 -7.675 746 HA ALA 95 HA ALA 95 -11.935 -1.816 -6.402 747 HB1 ALA 95 HB1 ALA 95 -11.109 -1.705 -8.565 748 HB2 ALA 95 HB2 ALA 95 -9.658 -1.487 -7.586 749 HB3 ALA 95 HB3 ALA 95 -10.437 -0.092 -8.334 750 H ILE 96 H ILE 96 -10.179 1.292 -6.335 751 HA ILE 96 HA ILE 96 -8.361 0.588 -4.332 752 HB ILE 96 HB ILE 96 -9.442 3.314 -5.049 753 HG12 ILE 96 HG11 ILE 96 -8.284 2.110 -6.869 754 HG13 ILE 96 HG12 ILE 96 -7.394 3.547 -6.341 755 HG21 ILE 96 HG21 ILE 96 -7.077 2.550 -3.345 756 HG22 ILE 96 HG22 ILE 96 -7.408 4.178 -3.934 757 HG23 ILE 96 HG23 ILE 96 -8.532 3.398 -2.822 758 HD11 ILE 96 HD11 ILE 96 -5.902 1.660 -6.742 759 HD12 ILE 96 HD12 ILE 96 -5.870 2.168 -5.052 760 HD13 ILE 96 HD13 ILE 96 -6.763 0.722 -5.521 761 H TYR 97 H TYR 97 -11.600 1.963 -4.134 762 HA TYR 97 HA TYR 97 -11.607 2.625 -1.413 763 HB2 TYR 97 HB2 TYR 97 -13.676 2.080 -3.482 764 HB3 TYR 97 HB1 TYR 97 -14.193 2.016 -1.795 765 HD1 TYR 97 HD1 TYR 97 -11.641 4.276 -3.274 766 HD2 TYR 97 HD2 TYR 97 -15.531 3.932 -1.585 767 HE1 TYR 97 HE1 TYR 97 -11.826 6.728 -3.216 768 HE2 TYR 97 HE2 TYR 97 -15.727 6.382 -1.523 769 HH TYR 97 HH TYR 97 -14.806 8.320 -2.156 770 H SER 98 H SER 98 -12.123 -0.421 -3.065 771 HA SER 98 HA SER 98 -13.091 -1.805 -0.747 772 HB2 SER 98 HB2 SER 98 -12.175 -2.680 -3.489 773 HB3 SER 98 HB1 SER 98 -12.577 -3.856 -2.224 774 HG SER 98 HG SER 98 -14.407 -3.436 -3.468 775 H VAL 99 H VAL 99 -10.046 -1.963 -2.598 776 HA VAL 99 HA VAL 99 -8.690 -3.683 -0.856 777 HB VAL 99 HB VAL 99 -7.402 -1.527 -2.530 778 HG11 VAL 99 HG11 VAL 99 -5.697 -3.516 -2.702 779 HG12 VAL 99 HG12 VAL 99 -5.683 -2.433 -1.309 780 HG13 VAL 99 HG13 VAL 99 -6.456 -4.015 -1.191 781 HG21 VAL 99 HG21 VAL 99 -7.255 -3.773 -4.043 782 HG22 VAL 99 HG22 VAL 99 -8.844 -3.968 -3.306 783 HG23 VAL 99 HG23 VAL 99 -8.480 -2.519 -4.241 784 H GLU 100 H GLU 100 -8.507 -0.128 -1.090 785 HA GLU 100 HA GLU 100 -6.753 0.360 0.977 786 HB2 GLU 100 HB2 GLU 100 -7.489 2.579 0.971 787 HB3 GLU 100 HB1 GLU 100 -7.846 2.007 -0.666 788 HG2 GLU 100 HG1 GLU 100 -10.190 1.593 0.024 789 HG3 GLU 100 HG2 GLU 100 -9.803 2.299 1.600 790 HE2 GLU 100 HE2 GLU 100 -9.213 5.134 -0.993 791 H ASP 101 H ASP 101 -10.131 -0.506 1.128 792 HA ASP 101 HA ASP 101 -10.548 0.184 3.853 793 HB2 ASP 101 HB2 ASP 101 -12.026 -1.204 1.725 794 HB3 ASP 101 HB1 ASP 101 -12.361 -1.819 3.349 795 HD2 ASP 101 HD2 ASP 101 -14.685 0.769 3.285 796 H GLU 102 H GLU 102 -10.096 -2.990 2.283 797 HA GLU 102 HA GLU 102 -9.104 -4.008 4.865 798 HB2 GLU 102 HB2 GLU 102 -9.745 -6.285 3.890 799 HB3 GLU 102 HB1 GLU 102 -11.064 -5.218 4.397 800 HG2 GLU 102 HG1 GLU 102 -11.779 -4.827 2.261 801 HG3 GLU 102 HG2 GLU 102 -10.177 -5.108 1.565 802 HE2 GLU 102 HE2 GLU 102 -12.563 -8.221 2.114 803 H ASN 103 H ASN 103 -6.961 -4.133 4.842 804 HA ASN 103 HA ASN 103 -5.583 -4.757 2.332 805 HB2 ASN 103 HB2 ASN 103 -4.713 -3.501 4.930 806 HB3 ASN 103 HB1 ASN 103 -3.525 -4.132 3.782 807 HD21 ASN 103 HD21 ASN 103 -6.551 -2.308 3.443 808 HD22 ASN 103 HD22 ASN 103 -5.876 -1.041 2.480 809 H LYS 104 H LYS 104 -5.811 -5.811 5.703 810 HA LYS 104 HA LYS 104 -4.465 -8.318 4.938 811 HB2 LYS 104 HB2 LYS 104 -3.837 -8.569 7.300 812 HB3 LYS 104 HB1 LYS 104 -3.201 -7.068 6.609 813 HG2 LYS 104 HG1 LYS 104 -3.989 -6.167 8.513 814 HG3 LYS 104 HG2 LYS 104 -5.519 -6.159 7.620 815 HD2 LYS 104 HD1 LYS 104 -5.653 -8.640 8.609 816 HD3 LYS 104 HD2 LYS 104 -4.634 -7.899 9.854 817 HE2 LYS 104 HE1 LYS 104 -7.094 -6.445 8.977 818 HE3 LYS 104 HE2 LYS 104 -7.265 -7.856 10.030 819 HZ1 LYS 104 3HZ LYS 104 -5.225 -6.316 11.103 820 HZ2 LYS 104 1HZ LYS 104 -6.778 -6.550 11.732 821 HZ3 LYS 104 2HZ LYS 104 -6.469 -5.237 10.712 822 H GLN 105 H GLN 105 -7.187 -6.874 6.619 823 HA GLN 105 HA GLN 105 -8.282 -9.247 7.678 824 HB2 GLN 105 HB2 GLN 105 -10.392 -7.955 7.844 825 HB3 GLN 105 HB1 GLN 105 -8.995 -7.095 8.508 826 HG2 GLN 105 HG1 GLN 105 -8.884 -6.059 6.091 827 HG3 GLN 105 HG2 GLN 105 -10.594 -6.511 6.074 828 HE21 GLN 105 HE21 GLN 105 -8.169 -4.572 7.678 829 HE22 GLN 105 HE22 GLN 105 -9.267 -3.464 8.422 830 H SER 106 H SER 106 -9.092 -10.931 6.636 831 HA SER 106 HA SER 106 -10.845 -10.587 4.374 832 HB2 SER 106 HB2 SER 106 -8.788 -10.542 3.146 833 HB3 SER 106 HB1 SER 106 -8.151 -11.921 4.059 834 HG SER 106 HG SER 106 -9.125 -13.211 2.728 835 H GLU 107 H GLU 107 -11.768 -12.680 3.651 836 HA GLU 107 HA GLU 107 -11.617 -14.755 5.730 837 HB2 GLU 107 HB2 GLU 107 -14.156 -13.737 4.432 838 HB3 GLU 107 HB1 GLU 107 -14.044 -15.052 5.610 839 HG2 GLU 107 HG1 GLU 107 -13.052 -12.305 6.286 840 HG3 GLU 107 HG2 GLU 107 -14.769 -12.717 6.411 841 HE2 GLU 107 HE2 GLU 107 -14.110 -14.954 9.072 842 H GLY 108 H GLY 108 -10.666 -16.394 4.679 843 HA2 GLY 108 HA2 GLY 108 -11.176 -18.341 3.301 844 HA3 GLY 108 3HA GLY 108 -11.885 -17.243 2.126 845 H SER 109 H SER 109 -8.782 -17.837 3.775 846 HA SER 109 HA SER 109 -7.292 -16.667 1.608 847 HB2 SER 109 HB2 SER 109 -5.328 -17.736 2.975 848 HB3 SER 109 HB1 SER 109 -6.209 -16.351 3.642 849 HG SER 109 HG SER 109 -6.182 -17.807 5.266 Start of MODEL 19 1 H1 MET 1 H MET 1 41.951 18.095 59.457 2 HA MET 1 HA MET 1 39.903 16.797 58.117 3 HB2 MET 1 HB2 MET 1 39.798 19.466 59.545 4 HB3 MET 1 HB1 MET 1 38.395 18.468 59.132 5 HG2 MET 1 HG1 MET 1 38.868 16.870 60.730 6 HG3 MET 1 HG2 MET 1 40.580 17.300 60.785 7 HE1 MET 1 HE1 MET 1 37.097 19.451 62.805 8 HE2 MET 1 HE2 MET 1 37.051 18.440 61.360 9 HE3 MET 1 HE3 MET 1 37.291 17.703 62.945 10 H GLY 2 H GLY 2 39.271 16.946 56.073 11 HA2 GLY 2 HA2 GLY 2 38.219 19.009 54.729 12 HA3 GLY 2 3HA GLY 2 39.938 19.297 54.501 13 H SER 3 H SER 3 37.419 18.214 52.902 14 HA SER 3 HA SER 3 38.911 16.052 51.563 15 HB2 SER 3 HB2 SER 3 36.771 15.087 50.886 16 HB3 SER 3 HB1 SER 3 36.826 15.272 52.648 17 HG SER 3 HG SER 3 35.116 16.381 50.869 18 H SER 4 H SER 4 37.757 15.780 49.226 19 HA SER 4 HA SER 4 37.347 18.375 47.975 20 HB2 SER 4 HB2 SER 4 39.769 16.669 47.590 21 HB3 SER 4 HB1 SER 4 39.091 17.481 46.167 22 HG SER 4 HG SER 4 39.167 19.446 47.513 23 H HIS 5 H HIS 5 36.958 18.046 45.538 24 HA HIS 5 HA HIS 5 35.854 15.444 44.860 25 HB2 HIS 5 HB2 HIS 5 34.136 17.939 44.833 26 HB3 HIS 5 HB1 HIS 5 33.646 16.333 44.286 27 HD1 HIS 5 HD1 HIS 5 33.255 14.506 46.124 28 HD2 HIS 5 HD2 HIS 5 33.982 18.326 47.585 29 HE1 HIS 5 HE1 HIS 5 32.571 14.442 48.543 30 HE2 HIS 5 HE2 HIS 5 33.014 16.776 49.437 31 H HIS 6 H HIS 6 35.520 15.145 42.628 32 HA HIS 6 HA HIS 6 36.500 17.314 40.899 33 HB2 HIS 6 HB2 HIS 6 37.353 14.422 40.948 34 HB3 HIS 6 HB1 HIS 6 37.556 15.422 39.507 35 HD1 HIS 6 HD1 HIS 6 39.092 17.617 39.838 36 HD2 HIS 6 HD2 HIS 6 39.361 14.706 42.790 37 HE1 HIS 6 HE1 HIS 6 41.218 18.118 41.085 38 HE2 HIS 6 HE2 HIS 6 41.384 16.338 42.889 39 H HIS 7 H HIS 7 35.777 17.215 38.695 40 HA HIS 7 HA HIS 7 33.402 15.525 38.282 41 HB2 HIS 7 HB2 HIS 7 33.714 18.486 37.979 42 HB3 HIS 7 HB1 HIS 7 32.632 17.629 36.877 43 HD1 HIS 7 HD1 HIS 7 30.332 18.061 37.678 44 HD2 HIS 7 HD2 HIS 7 32.924 17.198 40.808 45 HE1 HIS 7 HE1 HIS 7 28.896 17.990 39.741 46 HE2 HIS 7 HE2 HIS 7 30.479 17.461 41.654 47 H HIS 8 H HIS 8 32.749 15.515 35.903 48 HA HIS 8 HA HIS 8 34.935 15.898 34.035 49 HB2 HIS 8 HB2 HIS 8 33.751 13.156 34.544 50 HB3 HIS 8 HB1 HIS 8 34.869 13.558 33.238 51 HD1 HIS 8 HD1 HIS 8 37.349 13.743 33.793 52 HD2 HIS 8 HD2 HIS 8 34.957 13.084 37.126 53 HE1 HIS 8 HE1 HIS 8 38.938 13.196 35.664 54 HE2 HIS 8 HE2 HIS 8 37.477 12.793 37.702 55 H HIS 9 H HIS 9 34.190 15.056 31.779 56 HA HIS 9 HA HIS 9 31.313 15.228 31.391 57 HB2 HIS 9 HB2 HIS 9 32.331 17.584 31.387 58 HB3 HIS 9 HB1 HIS 9 33.095 17.118 29.864 59 HD1 HIS 9 HD1 HIS 9 31.679 18.975 28.669 60 HD2 HIS 9 HD2 HIS 9 29.464 15.878 30.331 61 HE1 HIS 9 HE1 HIS 9 29.383 19.175 27.661 62 HE2 HIS 9 HE2 HIS 9 28.029 17.281 28.675 63 H HIS 10 H HIS 10 30.647 13.994 29.735 64 HA HIS 10 HA HIS 10 32.421 13.368 27.530 65 HB2 HIS 10 HB2 HIS 10 31.555 11.339 29.577 66 HB3 HIS 10 HB1 HIS 10 31.892 10.855 27.912 67 HD1 HIS 10 HD1 HIS 10 33.537 11.279 31.074 68 HD2 HIS 10 HD2 HIS 10 34.643 11.675 27.089 69 HE1 HIS 10 HE1 HIS 10 36.051 11.196 31.062 70 HE2 HIS 10 HE2 HIS 10 36.728 11.438 28.627 71 H SER 11 H SER 11 31.316 12.105 25.834 72 HA SER 11 HA SER 11 28.402 12.083 25.995 73 HB2 SER 11 HB2 SER 11 28.971 14.318 25.116 74 HB3 SER 11 HB1 SER 11 29.903 13.556 23.815 75 HG SER 11 HG SER 11 28.110 13.372 22.760 76 H SER 12 H SER 12 27.440 11.064 24.000 77 HA SER 12 HA SER 12 29.274 9.111 22.786 78 HB2 SER 12 HB2 SER 12 28.101 7.974 24.608 79 HB3 SER 12 HB1 SER 12 26.544 8.505 23.948 80 HG SER 12 HG SER 12 26.968 6.398 23.274 81 H GLY 13 H GLY 13 25.766 9.697 22.593 82 HA2 GLY 13 HA2 GLY 13 24.502 10.524 20.830 83 HA3 GLY 13 3HA GLY 13 25.990 10.827 19.944 84 H LEU 14 H LEU 14 24.226 9.955 18.330 85 HA LEU 14 HA LEU 14 23.978 7.084 18.272 86 HB2 LEU 14 HB2 LEU 14 23.229 9.238 16.292 87 HB3 LEU 14 HB1 LEU 14 22.913 7.512 16.048 88 HG LEU 14 HG LEU 14 21.831 8.969 18.439 89 HD11 LEU 14 HD11 LEU 14 19.955 9.684 17.308 90 HD12 LEU 14 HD12 LEU 14 20.212 8.576 15.961 91 HD13 LEU 14 HD13 LEU 14 21.229 10.006 16.132 92 HD21 LEU 14 HD21 LEU 14 20.676 7.087 18.838 93 HD22 LEU 14 HD22 LEU 14 21.891 6.327 17.810 94 HD23 LEU 14 HD23 LEU 14 20.337 6.811 17.129 95 H VAL 15 H VAL 15 24.405 6.124 15.916 96 HA VAL 15 HA VAL 15 27.128 6.903 15.108 97 HB VAL 15 HB VAL 15 27.473 4.409 14.631 98 HG11 VAL 15 HG11 VAL 15 28.117 3.970 17.010 99 HG12 VAL 15 HG12 VAL 15 28.719 5.493 16.354 100 HG13 VAL 15 HG13 VAL 15 27.329 5.487 17.440 101 HG21 VAL 15 HG21 VAL 15 26.192 2.871 16.036 102 HG22 VAL 15 HG22 VAL 15 25.187 4.209 16.592 103 HG23 VAL 15 HG23 VAL 15 25.145 3.720 14.899 104 HA PRO 16 HA PRO 16 25.708 6.865 10.955 105 HB2 PRO 16 HB2 PRO 16 27.942 6.018 9.620 106 HB3 PRO 16 HB1 PRO 16 27.795 7.613 10.355 107 HG2 PRO 16 HG1 PRO 16 29.094 5.136 11.435 108 HG3 PRO 16 HG2 PRO 16 29.704 6.833 11.429 109 HD2 PRO 16 HD1 PRO 16 28.605 5.680 13.627 110 HD3 PRO 16 HD2 PRO 16 28.423 7.403 13.258 111 H ARG 17 H ARG 17 26.079 5.332 8.859 112 HA ARG 17 HA ARG 17 25.600 2.554 9.688 113 HB2 ARG 17 HB2 ARG 17 23.846 2.442 7.870 114 HB3 ARG 17 HB1 ARG 17 23.413 3.390 9.300 115 HG2 ARG 17 HG1 ARG 17 24.647 4.818 6.997 116 HG3 ARG 17 HG2 ARG 17 22.963 4.281 6.862 117 HD2 ARG 17 HD1 ARG 17 22.624 5.400 9.161 118 HD3 ARG 17 HD2 ARG 17 24.165 6.202 8.827 119 HE ARG 17 HE ARG 17 22.546 6.574 6.598 120 HH11 ARG 17 1HH1 ARG 17 22.587 7.450 9.967 121 HH12 ARG 17 2HH1 ARG 17 21.714 8.927 9.728 122 HH21 ARG 17 1HH2 ARG 17 21.395 8.517 6.271 123 HH22 ARG 17 2HH2 ARG 17 21.035 9.533 7.626 124 H GLY 18 H GLY 18 25.503 1.125 7.593 125 HA2 GLY 18 HA2 GLY 18 26.989 1.946 5.323 126 HA3 GLY 18 3HA GLY 18 28.040 1.106 6.453 127 H SER 19 H SER 19 28.297 -0.436 4.689 128 HA SER 19 HA SER 19 26.107 -1.994 3.766 129 HB2 SER 19 HB2 SER 19 27.721 -3.346 2.649 130 HB3 SER 19 HB1 SER 19 28.346 -1.688 2.604 131 HG SER 19 HG SER 19 30.035 -2.394 3.612 132 H HIS 20 H HIS 20 26.648 -4.580 3.971 133 HA HIS 20 HA HIS 20 26.543 -5.105 6.868 134 HB2 HIS 20 HB2 HIS 20 24.530 -5.559 5.208 135 HB3 HIS 20 HB1 HIS 20 25.436 -7.039 4.877 136 HD1 HIS 20 HD1 HIS 20 26.428 -7.258 7.958 137 HD2 HIS 20 HD2 HIS 20 22.525 -7.002 6.557 138 HE1 HIS 20 HE1 HIS 20 24.998 -8.269 9.763 139 HE2 HIS 20 HE2 HIS 20 22.612 -8.113 8.909 140 H MET 21 H MET 21 29.011 -4.944 5.519 141 HA MET 21 HA MET 21 29.862 -7.696 5.075 142 HB2 MET 21 HB2 MET 21 31.107 -4.999 4.633 143 HB3 MET 21 HB1 MET 21 32.119 -6.451 4.672 144 HG2 MET 21 HG1 MET 21 30.694 -7.429 2.873 145 HG3 MET 21 HG2 MET 21 29.856 -5.878 2.777 146 HE1 MET 21 HE1 MET 21 31.910 -8.027 1.269 147 HE2 MET 21 HE2 MET 21 31.613 -6.958 -0.102 148 HE3 MET 21 HE3 MET 21 33.261 -7.221 0.471 149 H ILE 22 H ILE 22 29.720 -8.540 7.172 150 HA ILE 22 HA ILE 22 32.051 -8.182 8.768 151 HB ILE 22 HB ILE 22 30.699 -6.211 9.491 152 HG12 ILE 22 HG11 ILE 22 32.278 -7.802 10.946 153 HG13 ILE 22 HG12 ILE 22 31.457 -6.394 11.641 154 HG21 ILE 22 HG21 ILE 22 28.744 -6.692 10.976 155 HG22 ILE 22 HG22 ILE 22 28.476 -7.048 9.270 156 HG23 ILE 22 HG23 ILE 22 28.796 -8.360 10.405 157 HD11 ILE 22 HD11 ILE 22 30.134 -9.068 11.698 158 HD12 ILE 22 HD12 ILE 22 31.359 -8.644 12.895 159 HD13 ILE 22 HD13 ILE 22 29.893 -7.674 12.751 160 H SER 23 H SER 23 32.324 -9.821 10.286 161 HA SER 23 HA SER 23 30.798 -12.192 9.796 162 HB2 SER 23 HB2 SER 23 33.193 -11.478 11.440 163 HB3 SER 23 HB1 SER 23 32.319 -12.969 11.831 164 HG SER 23 HG SER 23 32.573 -13.564 9.600 165 H LEU 24 H LEU 24 28.761 -11.008 10.515 166 HA LEU 24 HA LEU 24 28.409 -10.876 13.400 167 HB2 LEU 24 HB2 LEU 24 27.418 -9.352 11.412 168 HB3 LEU 24 HB1 LEU 24 26.100 -10.522 11.591 169 HG LEU 24 HG LEU 24 25.550 -8.619 12.904 170 HD11 LEU 24 HD11 LEU 24 25.394 -9.567 15.138 171 HD12 LEU 24 HD12 LEU 24 26.614 -10.772 14.727 172 HD13 LEU 24 HD13 LEU 24 25.048 -10.789 13.914 173 HD21 LEU 24 HD21 LEU 24 27.533 -7.444 13.208 174 HD22 LEU 24 HD22 LEU 24 28.374 -8.841 13.880 175 HD23 LEU 24 HD23 LEU 24 27.144 -8.009 14.832 176 H SER 25 H SER 25 28.981 -13.437 12.615 177 HA SER 25 HA SER 25 26.895 -15.115 11.928 178 HB2 SER 25 HB2 SER 25 28.147 -16.869 13.285 179 HB3 SER 25 HB1 SER 25 29.090 -16.032 12.038 180 HG SER 25 HG SER 25 29.656 -16.207 14.591 181 H GLY 26 H GLY 26 24.976 -15.427 12.829 182 HA2 GLY 26 HA2 GLY 26 23.722 -16.283 14.717 183 HA3 GLY 26 3HA GLY 26 24.784 -15.362 15.771 184 H LEU 27 H LEU 27 22.623 -14.743 12.998 185 HA LEU 27 HA LEU 27 21.255 -12.704 14.580 186 HB2 LEU 27 HB2 LEU 27 23.105 -11.611 13.290 187 HB3 LEU 27 HB1 LEU 27 22.293 -12.144 11.808 188 HG LEU 27 HG LEU 27 20.656 -10.552 13.686 189 HD11 LEU 27 HD11 LEU 27 23.125 -9.600 13.438 190 HD12 LEU 27 HD12 LEU 27 21.707 -8.552 13.464 191 HD13 LEU 27 HD13 LEU 27 22.455 -8.986 11.926 192 HD21 LEU 27 HD21 LEU 27 19.415 -10.645 11.842 193 HD22 LEU 27 HD22 LEU 27 20.762 -11.251 10.878 194 HD23 LEU 27 HD23 LEU 27 20.558 -9.515 11.116 195 H THR 28 H THR 28 19.195 -12.067 13.682 196 HA THR 28 HA THR 28 17.626 -14.182 12.817 197 HB THR 28 HB THR 28 15.858 -12.600 12.419 198 HG1 THR 28 HG1 THR 28 16.596 -10.913 11.312 199 HG21 THR 28 HG21 THR 28 15.757 -11.513 14.522 200 HG22 THR 28 HG22 THR 28 17.514 -11.417 14.639 201 HG23 THR 28 HG23 THR 28 16.705 -12.977 14.779 202 H SER 29 H SER 29 16.243 -14.095 10.758 203 HA SER 29 HA SER 29 17.929 -14.502 8.540 204 HB2 SER 29 HB2 SER 29 15.639 -15.539 8.962 205 HB3 SER 29 HB1 SER 29 14.952 -14.009 8.388 206 HG SER 29 HG SER 29 15.228 -14.760 6.456 207 H SER 30 H SER 30 17.042 -13.407 6.332 208 HA SER 30 HA SER 30 17.029 -10.495 6.735 209 HB2 SER 30 HB2 SER 30 19.326 -11.528 6.111 210 HB3 SER 30 HB1 SER 30 18.610 -11.754 4.505 211 HG SER 30 HG SER 30 19.516 -9.474 5.688 212 H VAL 31 H VAL 31 16.905 -9.603 4.205 213 HA VAL 31 HA VAL 31 15.201 -9.060 2.747 214 HB VAL 31 HB VAL 31 14.843 -10.816 1.048 215 HG11 VAL 31 HG11 VAL 31 16.915 -9.364 1.169 216 HG12 VAL 31 HG12 VAL 31 17.742 -10.767 1.850 217 HG13 VAL 31 HG13 VAL 31 17.055 -10.848 0.226 218 HG21 VAL 31 HG21 VAL 31 14.824 -12.694 2.731 219 HG22 VAL 31 HG22 VAL 31 15.741 -13.003 1.257 220 HG23 VAL 31 HG23 VAL 31 16.584 -12.588 2.749 221 H GLU 32 H GLU 32 14.055 -9.529 5.209 222 HA GLU 32 HA GLU 32 12.000 -11.472 5.181 223 HB2 GLU 32 HB2 GLU 32 11.022 -10.145 7.045 224 HB3 GLU 32 HB1 GLU 32 12.733 -10.536 7.275 225 HG2 GLU 32 HG1 GLU 32 12.762 -8.078 5.975 226 HG3 GLU 32 HG2 GLU 32 11.431 -7.963 7.134 227 HE2 GLU 32 HE2 GLU 32 15.049 -7.692 8.491 228 H SER 33 H SER 33 12.228 -8.212 3.959 229 HA SER 33 HA SER 33 9.609 -8.542 2.697 230 HB2 SER 33 HB2 SER 33 10.446 -6.093 4.280 231 HB3 SER 33 HB1 SER 33 9.000 -6.198 3.261 232 HG SER 33 HG SER 33 9.420 -7.159 5.781 233 H ASP 34 H ASP 34 12.563 -8.483 1.970 234 HA ASP 34 HA ASP 34 12.715 -6.172 0.215 235 HB2 ASP 34 HB2 ASP 34 14.758 -6.715 1.321 236 HB3 ASP 34 HB1 ASP 34 14.637 -8.413 0.841 237 HD2 ASP 34 HD2 ASP 34 16.398 -7.786 -2.010 238 H LEU 35 H LEU 35 12.155 -9.618 0.042 239 HA LEU 35 HA LEU 35 12.537 -10.024 -2.697 240 HB2 LEU 35 HB2 LEU 35 11.185 -11.406 -0.486 241 HB3 LEU 35 HB1 LEU 35 10.490 -11.727 -2.085 242 HG LEU 35 HG LEU 35 12.091 -13.444 -1.520 243 HD11 LEU 35 HD11 LEU 35 11.949 -12.213 -3.878 244 HD12 LEU 35 HD12 LEU 35 13.053 -13.552 -3.569 245 HD13 LEU 35 HD13 LEU 35 13.642 -11.890 -3.506 246 HD21 LEU 35 HD21 LEU 35 14.386 -11.567 -1.582 247 HD22 LEU 35 HD22 LEU 35 14.195 -13.100 -0.730 248 HD23 LEU 35 HD23 LEU 35 13.430 -11.639 -0.102 249 H ASP 36 H ASP 36 9.964 -8.489 -0.959 250 HA ASP 36 HA ASP 36 7.834 -8.702 -2.705 251 HB2 ASP 36 HB2 ASP 36 8.711 -6.409 -0.938 252 HB3 ASP 36 HB1 ASP 36 7.184 -6.401 -1.831 253 HD2 ASP 36 HD2 ASP 36 5.965 -7.829 1.074 254 H MET 37 H MET 37 10.698 -6.695 -2.932 255 HA MET 37 HA MET 37 9.912 -4.887 -4.884 256 HB2 MET 37 HB2 MET 37 12.519 -6.085 -4.062 257 HB3 MET 37 HB1 MET 37 12.460 -5.170 -5.576 258 HG2 MET 37 HG1 MET 37 13.041 -3.506 -4.122 259 HG3 MET 37 HG2 MET 37 11.281 -3.368 -4.097 260 HE1 MET 37 HE1 MET 37 13.538 -2.511 -1.284 261 HE2 MET 37 HE2 MET 37 12.188 -1.885 -2.230 262 HE3 MET 37 HE3 MET 37 11.930 -2.408 -0.565 263 H GLN 38 H GLN 38 10.740 -8.262 -5.161 264 HA GLN 38 HA GLN 38 11.236 -8.393 -7.918 265 HB2 GLN 38 HB2 GLN 38 11.438 -10.175 -5.965 266 HB3 GLN 38 HB1 GLN 38 9.838 -10.648 -6.559 267 HG2 GLN 38 HG1 GLN 38 11.277 -12.043 -7.727 268 HG3 GLN 38 HG2 GLN 38 10.929 -10.740 -8.873 269 HE21 GLN 38 HE21 GLN 38 13.210 -11.286 -6.203 270 HE22 GLN 38 HE22 GLN 38 14.612 -10.773 -7.072 271 H GLN 39 H GLN 39 8.286 -8.112 -6.117 272 HA GLN 39 HA GLN 39 6.460 -9.081 -8.008 273 HB2 GLN 39 HB2 GLN 39 6.101 -6.869 -5.972 274 HB3 GLN 39 HB1 GLN 39 4.790 -7.700 -6.824 275 HG2 GLN 39 HG1 GLN 39 6.767 -9.214 -5.145 276 HG3 GLN 39 HG2 GLN 39 5.342 -8.439 -4.439 277 HE21 GLN 39 HE21 GLN 39 6.461 -10.914 -6.628 278 HE22 GLN 39 HE22 GLN 39 4.987 -11.815 -6.674 279 H ALA 40 H ALA 40 8.289 -6.154 -7.894 280 HA ALA 40 HA ALA 40 6.694 -4.504 -9.515 281 HB1 ALA 40 HB1 ALA 40 9.671 -4.563 -9.067 282 HB2 ALA 40 HB2 ALA 40 8.479 -3.528 -8.282 283 HB3 ALA 40 HB3 ALA 40 8.845 -3.309 -9.993 284 H MET 41 H MET 41 8.777 -7.175 -10.270 285 HA MET 41 HA MET 41 9.113 -6.562 -13.039 286 HB2 MET 41 HB2 MET 41 9.353 -9.260 -11.690 287 HB3 MET 41 HB1 MET 41 10.069 -8.769 -13.233 288 HG2 MET 41 HG1 MET 41 10.790 -7.672 -10.513 289 HG3 MET 41 HG2 MET 41 11.735 -8.815 -11.471 290 HE1 MET 41 HE1 MET 41 13.863 -7.880 -12.682 291 HE2 MET 41 HE2 MET 41 12.616 -8.305 -13.855 292 HE3 MET 41 HE3 MET 41 13.538 -6.814 -14.049 293 H LEU 42 H LEU 42 7.054 -8.860 -11.264 294 HA LEU 42 HA LEU 42 5.708 -9.880 -13.510 295 HB2 LEU 42 HB2 LEU 42 5.182 -9.798 -10.573 296 HB3 LEU 42 HB1 LEU 42 3.871 -10.283 -11.663 297 HG LEU 42 HG LEU 42 5.145 -12.177 -10.662 298 HD11 LEU 42 HD11 LEU 42 5.071 -13.488 -12.597 299 HD12 LEU 42 HD12 LEU 42 5.499 -12.133 -13.641 300 HD13 LEU 42 HD13 LEU 42 3.903 -12.200 -12.894 301 HD21 LEU 42 HD21 LEU 42 7.363 -11.252 -12.482 302 HD22 LEU 42 HD22 LEU 42 7.364 -12.677 -11.442 303 HD23 LEU 42 HD23 LEU 42 7.361 -11.063 -10.729 304 H THR 43 H THR 43 5.383 -6.912 -11.797 305 HA THR 43 HA THR 43 2.868 -6.331 -13.218 306 HB THR 43 HB THR 43 2.679 -6.151 -10.774 307 HG1 THR 43 HG1 THR 43 1.552 -4.302 -10.902 308 HG21 THR 43 HG21 THR 43 4.133 -5.051 -9.451 309 HG22 THR 43 HG22 THR 43 4.307 -3.715 -10.589 310 HG23 THR 43 HG23 THR 43 5.231 -5.199 -10.823 311 H ASN 44 H ASN 44 5.250 -6.183 -14.640 312 HA ASN 44 HA ASN 44 6.598 -3.776 -14.690 313 HB2 ASN 44 HB2 ASN 44 7.000 -5.890 -16.088 314 HB3 ASN 44 HB1 ASN 44 5.801 -5.231 -17.207 315 HD21 ASN 44 HD21 ASN 44 8.527 -3.892 -15.366 316 HD22 ASN 44 HD22 ASN 44 9.265 -3.100 -16.714 317 H LYS 45 H LYS 45 5.732 -1.810 -14.675 318 HA LYS 45 HA LYS 45 3.151 -1.186 -15.647 319 HB2 LYS 45 HB2 LYS 45 3.519 0.951 -14.874 320 HB3 LYS 45 HB1 LYS 45 4.685 0.037 -13.903 321 HG2 LYS 45 HG1 LYS 45 5.289 1.622 -16.402 322 HG3 LYS 45 HG2 LYS 45 5.696 2.068 -14.736 323 HD2 LYS 45 HD1 LYS 45 6.698 -0.425 -16.126 324 HD3 LYS 45 HD2 LYS 45 7.601 1.095 -16.011 325 HE2 LYS 45 HE1 LYS 45 6.584 -0.433 -13.606 326 HE3 LYS 45 HE2 LYS 45 8.204 -0.633 -14.292 327 HZ1 LYS 45 3HZ LYS 45 8.027 2.041 -14.004 328 HZ2 LYS 45 1HZ LYS 45 8.756 0.997 -12.891 329 HZ3 LYS 45 2HZ LYS 45 7.158 1.497 -12.659 330 H ASP 46 H ASP 46 2.977 0.842 -17.189 331 HA ASP 46 HA ASP 46 4.777 0.569 -19.478 332 HB2 ASP 46 HB2 ASP 46 1.800 0.094 -19.512 333 HB3 ASP 46 HB1 ASP 46 2.669 0.609 -20.964 334 HD2 ASP 46 HD2 ASP 46 4.404 -2.480 -21.090 335 H GLU 47 H GLU 47 3.807 2.212 -21.268 336 HA GLU 47 HA GLU 47 4.127 4.787 -20.099 337 HB2 GLU 47 HB2 GLU 47 3.747 5.638 -22.389 338 HB3 GLU 47 HB1 GLU 47 4.961 4.351 -22.330 339 HG2 GLU 47 HG1 GLU 47 3.221 2.731 -23.046 340 HG3 GLU 47 HG2 GLU 47 2.103 4.090 -23.232 341 HE2 GLU 47 HE2 GLU 47 4.332 3.278 -26.232 342 H LYS 48 H LYS 48 1.375 3.025 -21.450 343 HA LYS 48 HA LYS 48 -0.475 5.172 -21.166 344 HB2 LYS 48 HB2 LYS 48 -2.202 3.391 -21.504 345 HB3 LYS 48 HB1 LYS 48 -0.960 3.453 -22.764 346 HG2 LYS 48 HG1 LYS 48 -0.372 1.623 -20.534 347 HG3 LYS 48 HG2 LYS 48 -1.773 1.190 -21.531 348 HD2 LYS 48 HD1 LYS 48 0.296 1.995 -23.299 349 HD3 LYS 48 HD2 LYS 48 1.003 0.879 -22.117 350 HE2 LYS 48 HE1 LYS 48 -1.224 -0.492 -22.639 351 HE3 LYS 48 HE2 LYS 48 -1.097 0.402 -24.162 352 HZ1 LYS 48 3HZ LYS 48 0.081 -1.556 -24.527 353 HZ2 LYS 48 1HZ LYS 48 0.823 -1.524 -23.007 354 HZ3 LYS 48 2HZ LYS 48 1.295 -0.423 -24.202 355 H VAL 49 H VAL 49 0.584 2.547 -19.107 356 HA VAL 49 HA VAL 49 -1.454 2.542 -17.208 357 HB VAL 49 HB VAL 49 1.497 2.052 -16.787 358 HG11 VAL 49 HG11 VAL 49 -0.745 2.094 -14.939 359 HG12 VAL 49 HG12 VAL 49 0.098 0.543 -14.948 360 HG13 VAL 49 HG13 VAL 49 0.988 2.029 -14.615 361 HG21 VAL 49 HG21 VAL 49 -0.227 0.638 -18.356 362 HG22 VAL 49 HG22 VAL 49 1.211 -0.028 -17.583 363 HG23 VAL 49 HG23 VAL 49 -0.366 -0.209 -16.816 364 H LEU 50 H LEU 50 1.140 4.800 -17.730 365 HA LEU 50 HA LEU 50 1.164 6.041 -15.202 366 HB2 LEU 50 HB2 LEU 50 1.712 7.417 -17.829 367 HB3 LEU 50 HB1 LEU 50 2.370 7.806 -16.230 368 HG LEU 50 HG LEU 50 3.034 5.356 -17.862 369 HD11 LEU 50 HD11 LEU 50 5.148 7.247 -17.159 370 HD12 LEU 50 HD12 LEU 50 3.930 7.906 -18.251 371 HD13 LEU 50 HD13 LEU 50 4.806 6.440 -18.690 372 HD21 LEU 50 HD21 LEU 50 4.206 6.313 -15.254 373 HD22 LEU 50 HD22 LEU 50 4.672 4.871 -16.156 374 HD23 LEU 50 HD23 LEU 50 3.071 4.976 -15.421 375 H LYS 51 H LYS 51 -1.080 6.165 -17.797 376 HA LYS 51 HA LYS 51 -2.222 8.713 -17.175 377 HB2 LYS 51 HB2 LYS 51 -3.215 6.369 -18.805 378 HB3 LYS 51 HB1 LYS 51 -4.105 7.891 -18.642 379 HG2 LYS 51 HG1 LYS 51 -1.270 7.846 -19.632 380 HG3 LYS 51 HG2 LYS 51 -2.643 7.563 -20.716 381 HD2 LYS 51 HD1 LYS 51 -3.562 9.770 -19.579 382 HD3 LYS 51 HD2 LYS 51 -1.837 10.045 -19.281 383 HE2 LYS 51 HE1 LYS 51 -2.204 11.091 -21.339 384 HE3 LYS 51 HE2 LYS 51 -1.523 9.516 -21.776 385 HZ1 LYS 51 3HZ LYS 51 -4.336 10.401 -21.959 386 HZ2 LYS 51 1HZ LYS 51 -3.921 8.761 -21.984 387 HZ3 LYS 51 2HZ LYS 51 -3.341 9.799 -23.186 388 H ALA 52 H ALA 52 -2.771 5.413 -16.161 389 HA ALA 52 HA ALA 52 -5.289 5.913 -14.899 390 HB1 ALA 52 HB1 ALA 52 -5.285 3.696 -15.117 391 HB2 ALA 52 HB2 ALA 52 -4.238 3.653 -13.699 392 HB3 ALA 52 HB3 ALA 52 -3.534 3.643 -15.316 393 H LEU 53 H LEU 53 -1.950 6.148 -13.952 394 HA LEU 53 HA LEU 53 -2.454 6.231 -11.131 395 HB2 LEU 53 HB2 LEU 53 -0.037 7.131 -12.708 396 HB3 LEU 53 HB1 LEU 53 -0.115 6.923 -10.950 397 HG LEU 53 HG LEU 53 -0.489 4.673 -12.922 398 HD11 LEU 53 HD11 LEU 53 1.883 4.198 -11.696 399 HD12 LEU 53 HD12 LEU 53 1.934 5.951 -11.877 400 HD13 LEU 53 HD13 LEU 53 1.707 4.924 -13.293 401 HD21 LEU 53 HD21 LEU 53 -0.962 3.397 -11.165 402 HD22 LEU 53 HD22 LEU 53 -1.094 4.873 -10.210 403 HD23 LEU 53 HD23 LEU 53 0.436 3.999 -10.274 404 H GLU 54 H GLU 54 -2.507 8.510 -13.719 405 HA GLU 54 HA GLU 54 -2.064 10.877 -12.235 406 HB2 GLU 54 HB2 GLU 54 -2.567 12.025 -14.160 407 HB3 GLU 54 HB1 GLU 54 -2.144 10.441 -14.827 408 HG2 GLU 54 HG1 GLU 54 -4.071 10.885 -15.975 409 HG3 GLU 54 HG2 GLU 54 -4.698 9.973 -14.594 410 HE2 GLU 54 HE2 GLU 54 -6.853 12.611 -14.146 411 H ARG 55 H ARG 55 -4.930 8.965 -12.919 412 HA ARG 55 HA ARG 55 -6.747 10.893 -11.799 413 HB2 ARG 55 HB2 ARG 55 -7.671 9.522 -13.481 414 HB3 ARG 55 HB1 ARG 55 -7.034 8.048 -12.736 415 HG2 ARG 55 HG1 ARG 55 -9.471 8.275 -12.461 416 HG3 ARG 55 HG2 ARG 55 -8.604 8.227 -10.917 417 HD2 ARG 55 HD1 ARG 55 -9.408 10.221 -10.323 418 HD3 ARG 55 HD2 ARG 55 -8.827 10.940 -11.832 419 HE ARG 55 HE ARG 55 -11.177 9.482 -12.347 420 HH11 ARG 55 1HH1 ARG 55 -10.099 12.383 -10.753 421 HH12 ARG 55 2HH1 ARG 55 -11.597 13.222 -10.981 422 HH21 ARG 55 1HH2 ARG 55 -13.155 10.575 -12.653 423 HH22 ARG 55 2HH2 ARG 55 -13.336 12.193 -12.060 424 H THR 56 H THR 56 -5.113 7.980 -10.704 425 HA THR 56 HA THR 56 -6.537 7.794 -8.230 426 HB THR 56 HB THR 56 -5.007 6.060 -7.624 427 HG1 THR 56 HG1 THR 56 -3.031 6.955 -8.166 428 HG21 THR 56 HG21 THR 56 -5.956 4.688 -9.100 429 HG22 THR 56 HG22 THR 56 -4.849 5.241 -10.357 430 HG23 THR 56 HG23 THR 56 -6.378 6.080 -10.097 431 H ARG 57 H ARG 57 -3.340 9.011 -9.179 432 HA ARG 57 HA ARG 57 -2.334 9.647 -6.679 433 HB2 ARG 57 HB2 ARG 57 -0.836 11.159 -7.776 434 HB3 ARG 57 HB1 ARG 57 -1.095 9.775 -8.848 435 HG2 ARG 57 HG1 ARG 57 -2.505 11.012 -10.291 436 HG3 ARG 57 HG2 ARG 57 -2.628 12.341 -9.126 437 HD2 ARG 57 HD1 ARG 57 -1.115 12.981 -10.901 438 HD3 ARG 57 HD2 ARG 57 -0.211 12.768 -9.396 439 HE ARG 57 HE ARG 57 -0.054 10.342 -10.661 440 HH11 ARG 57 1HH1 ARG 57 0.785 13.627 -11.450 441 HH12 ARG 57 2HH1 ARG 57 2.104 13.181 -12.481 442 HH21 ARG 57 1HH2 ARG 57 1.680 9.741 -12.016 443 HH22 ARG 57 2HH2 ARG 57 2.612 10.970 -12.803 444 H GLN 58 H GLN 58 -4.791 11.241 -8.548 445 HA GLN 58 HA GLN 58 -4.748 13.765 -7.314 446 HB2 GLN 58 HB2 GLN 58 -6.878 12.184 -8.737 447 HB3 GLN 58 HB1 GLN 58 -7.242 13.757 -8.009 448 HG2 GLN 58 HG1 GLN 58 -5.062 13.308 -10.044 449 HG3 GLN 58 HG2 GLN 58 -6.704 13.832 -10.438 450 HE21 GLN 58 HE21 GLN 58 -3.731 14.714 -8.834 451 HE22 GLN 58 HE22 GLN 58 -4.031 16.415 -8.787 452 H LEU 59 H LEU 59 -6.413 10.763 -6.474 453 HA LEU 59 HA LEU 59 -7.602 12.007 -4.123 454 HB2 LEU 59 HB2 LEU 59 -7.779 9.109 -4.931 455 HB3 LEU 59 HB1 LEU 59 -8.861 10.020 -3.865 456 HG LEU 59 HG LEU 59 -8.827 11.197 -6.493 457 HD11 LEU 59 HD11 LEU 59 -9.949 9.328 -7.663 458 HD12 LEU 59 HD12 LEU 59 -9.496 8.264 -6.332 459 HD13 LEU 59 HD13 LEU 59 -8.246 9.016 -7.322 460 HD21 LEU 59 HD21 LEU 59 -10.535 11.397 -4.647 461 HD22 LEU 59 HD22 LEU 59 -11.066 9.771 -5.077 462 HD23 LEU 59 HD23 LEU 59 -11.179 11.076 -6.258 463 H ASP 60 H ASP 60 -4.633 11.241 -4.638 464 HA ASP 60 HA ASP 60 -2.858 10.631 -3.350 465 HB2 ASP 60 HB2 ASP 60 -4.160 11.982 -1.641 466 HB3 ASP 60 HB1 ASP 60 -4.790 10.444 -1.037 467 HD2 ASP 60 HD2 ASP 60 -0.919 11.138 -0.457 468 H ILE 61 H ILE 61 -3.059 8.641 -4.689 469 HA ILE 61 HA ILE 61 -3.530 6.308 -2.952 470 HB ILE 61 HB ILE 61 -3.999 6.307 -5.931 471 HG12 ILE 61 HG11 ILE 61 -6.055 6.483 -3.714 472 HG13 ILE 61 HG12 ILE 61 -5.589 7.827 -4.770 473 HG21 ILE 61 HG21 ILE 61 -4.826 4.154 -5.673 474 HG22 ILE 61 HG22 ILE 61 -3.453 4.183 -4.568 475 HG23 ILE 61 HG23 ILE 61 -5.092 4.357 -3.942 476 HD11 ILE 61 HD11 ILE 61 -6.950 7.158 -6.385 477 HD12 ILE 61 HD12 ILE 61 -6.372 5.494 -6.291 478 HD13 ILE 61 HD13 ILE 61 -7.648 6.048 -5.206 479 HA PRO 62 HA PRO 62 0.707 5.426 -3.893 480 HB2 PRO 62 HB2 PRO 62 0.775 2.907 -2.821 481 HB3 PRO 62 HB1 PRO 62 0.771 4.377 -1.849 482 HG2 PRO 62 HG1 PRO 62 -1.515 2.584 -2.594 483 HG3 PRO 62 HG2 PRO 62 -1.105 3.305 -0.993 484 HD2 PRO 62 HD1 PRO 62 -3.042 4.318 -2.603 485 HD3 PRO 62 HD2 PRO 62 -2.035 5.337 -1.559 486 H ASP 63 H ASP 63 1.764 4.533 -5.579 487 HA ASP 63 HA ASP 63 0.307 3.269 -7.657 488 HB2 ASP 63 HB2 ASP 63 3.279 3.654 -7.226 489 HB3 ASP 63 HB1 ASP 63 2.581 2.972 -8.701 490 HD2 ASP 63 HD2 ASP 63 1.196 6.609 -8.319 491 H GLU 64 H GLU 64 1.597 2.054 -4.813 492 HA GLU 64 HA GLU 64 2.425 -0.520 -5.747 493 HB2 GLU 64 HB2 GLU 64 1.584 0.184 -2.933 494 HB3 GLU 64 HB1 GLU 64 2.685 -1.102 -3.451 495 HG2 GLU 64 HG1 GLU 64 3.173 1.866 -3.410 496 HG3 GLU 64 HG2 GLU 64 4.040 0.591 -2.545 497 HE2 GLU 64 HE2 GLU 64 5.082 1.411 -6.252 498 H LYS 65 H LYS 65 -0.553 0.859 -4.507 499 HA LYS 65 HA LYS 65 -1.872 -1.748 -4.582 500 HB2 LYS 65 HB2 LYS 65 -3.560 -0.852 -3.276 501 HB3 LYS 65 HB1 LYS 65 -2.141 0.046 -2.713 502 HG2 LYS 65 HG1 LYS 65 -2.768 1.887 -4.292 503 HG3 LYS 65 HG2 LYS 65 -4.276 1.007 -4.602 504 HD2 LYS 65 HD1 LYS 65 -3.326 2.066 -1.930 505 HD3 LYS 65 HD2 LYS 65 -4.645 2.714 -2.920 506 HE2 LYS 65 HE1 LYS 65 -4.530 0.080 -1.449 507 HE3 LYS 65 HE2 LYS 65 -5.674 1.414 -1.238 508 HZ1 LYS 65 3HZ LYS 65 -6.716 -0.362 -2.448 509 HZ2 LYS 65 1HZ LYS 65 -5.480 -0.371 -3.603 510 HZ3 LYS 65 2HZ LYS 65 -6.518 0.960 -3.486 511 H THR 66 H THR 66 -1.746 1.297 -6.278 512 HA THR 66 HA THR 66 -4.102 0.885 -7.839 513 HB THR 66 HB THR 66 -1.751 2.706 -8.390 514 HG1 THR 66 HG1 THR 66 -3.266 4.284 -7.481 515 HG21 THR 66 HG21 THR 66 -3.228 3.910 -9.861 516 HG22 THR 66 HG22 THR 66 -4.576 2.854 -9.441 517 HG23 THR 66 HG23 THR 66 -3.208 2.218 -10.352 518 H MET 67 H MET 67 -0.731 0.033 -8.167 519 HA MET 67 HA MET 67 -0.501 -0.448 -10.870 520 HB2 MET 67 HB2 MET 67 0.789 -1.460 -8.424 521 HB3 MET 67 HB1 MET 67 0.902 -2.545 -9.818 522 HG2 MET 67 HG1 MET 67 1.593 0.350 -10.133 523 HG3 MET 67 HG2 MET 67 2.745 -0.764 -9.394 524 HE1 MET 67 HE1 MET 67 2.002 0.232 -13.522 525 HE2 MET 67 HE2 MET 67 0.634 -0.837 -13.212 526 HE3 MET 67 HE3 MET 67 0.929 0.546 -12.158 527 HA PRO 68 HA PRO 68 -2.224 -4.918 -10.267 528 HB2 PRO 68 HB2 PRO 68 -3.348 -5.530 -7.846 529 HB3 PRO 68 HB1 PRO 68 -1.636 -5.746 -8.206 530 HG2 PRO 68 HG1 PRO 68 -3.013 -3.482 -6.801 531 HG3 PRO 68 HG2 PRO 68 -1.500 -4.354 -6.349 532 HD2 PRO 68 HD1 PRO 68 -1.484 -1.918 -7.548 533 HD3 PRO 68 HD2 PRO 68 -0.236 -3.141 -7.846 534 H VAL 69 H VAL 69 -3.762 -2.071 -9.122 535 HA VAL 69 HA VAL 69 -6.461 -3.062 -9.357 536 HB VAL 69 HB VAL 69 -5.302 -0.327 -8.880 537 HG11 VAL 69 HG11 VAL 69 -8.013 -1.063 -9.786 538 HG12 VAL 69 HG12 VAL 69 -7.919 0.079 -8.443 539 HG13 VAL 69 HG13 VAL 69 -7.123 0.448 -9.974 540 HG21 VAL 69 HG21 VAL 69 -7.299 -1.475 -7.064 541 HG22 VAL 69 HG22 VAL 69 -5.791 -2.384 -7.170 542 HG23 VAL 69 HG23 VAL 69 -5.763 -0.682 -6.710 543 H LEU 70 H LEU 70 -4.569 -0.596 -11.112 544 HA LEU 70 HA LEU 70 -6.402 -0.175 -13.172 545 HB2 LEU 70 HB2 LEU 70 -4.602 0.848 -14.398 546 HB3 LEU 70 HB1 LEU 70 -4.473 1.275 -12.683 547 HG LEU 70 HG LEU 70 -2.813 -0.830 -12.728 548 HD11 LEU 70 HD11 LEU 70 -3.338 -0.864 -15.298 549 HD12 LEU 70 HD12 LEU 70 -1.706 -1.169 -14.703 550 HD13 LEU 70 HD13 LEU 70 -2.129 0.420 -15.342 551 HD21 LEU 70 HD21 LEU 70 -2.175 2.019 -13.477 552 HD22 LEU 70 HD22 LEU 70 -0.977 0.822 -12.985 553 HD23 LEU 70 HD23 LEU 70 -2.232 1.331 -11.854 554 H MET 71 H MET 71 -3.712 -2.468 -12.936 555 HA MET 71 HA MET 71 -3.847 -3.491 -15.538 556 HB2 MET 71 HB2 MET 71 -2.461 -5.234 -14.805 557 HB3 MET 71 HB1 MET 71 -2.057 -3.877 -13.742 558 HG2 MET 71 HG1 MET 71 -3.289 -4.794 -11.929 559 HG3 MET 71 HG2 MET 71 -4.024 -6.013 -12.977 560 HE1 MET 71 HE1 MET 71 -0.180 -5.290 -13.586 561 HE2 MET 71 HE2 MET 71 -0.556 -4.591 -12.011 562 HE3 MET 71 HE3 MET 71 0.502 -5.999 -12.123 563 H LYS 72 H LYS 72 -5.895 -3.966 -12.805 564 HA LYS 72 HA LYS 72 -7.029 -6.456 -13.599 565 HB2 LYS 72 HB2 LYS 72 -7.069 -5.468 -11.273 566 HB3 LYS 72 HB1 LYS 72 -8.315 -4.353 -11.856 567 HG2 LYS 72 HG1 LYS 72 -9.671 -5.951 -10.993 568 HG3 LYS 72 HG2 LYS 72 -9.457 -6.622 -12.619 569 HD2 LYS 72 HD1 LYS 72 -7.449 -7.375 -10.557 570 HD3 LYS 72 HD2 LYS 72 -9.073 -8.070 -10.415 571 HE2 LYS 72 HE1 LYS 72 -8.786 -8.622 -12.949 572 HE3 LYS 72 HE2 LYS 72 -7.065 -8.396 -12.610 573 HZ1 LYS 72 3HZ LYS 72 -8.831 -10.277 -11.142 574 HZ2 LYS 72 1HZ LYS 72 -7.159 -10.108 -10.947 575 HZ3 LYS 72 2HZ LYS 72 -7.784 -10.718 -12.396 576 H LEU 73 H LEU 73 -7.672 -3.113 -14.356 577 HA LEU 73 HA LEU 73 -10.265 -3.519 -15.465 578 HB2 LEU 73 HB2 LEU 73 -8.459 -1.287 -16.321 579 HB3 LEU 73 HB1 LEU 73 -10.213 -1.285 -16.071 580 HG LEU 73 HG LEU 73 -8.065 -1.212 -13.959 581 HD11 LEU 73 HD11 LEU 73 -10.168 0.728 -14.889 582 HD12 LEU 73 HD12 LEU 73 -8.417 0.937 -14.886 583 HD13 LEU 73 HD13 LEU 73 -9.302 0.898 -13.361 584 HD21 LEU 73 HD21 LEU 73 -10.093 -0.995 -12.418 585 HD22 LEU 73 HD22 LEU 73 -9.691 -2.606 -13.013 586 HD23 LEU 73 HD23 LEU 73 -11.019 -1.702 -13.741 587 H LEU 74 H LEU 74 -6.998 -3.387 -16.806 588 HA LEU 74 HA LEU 74 -7.792 -3.571 -19.524 589 HB2 LEU 74 HB2 LEU 74 -5.192 -4.167 -18.112 590 HB3 LEU 74 HB1 LEU 74 -5.397 -4.283 -19.869 591 HG LEU 74 HG LEU 74 -4.350 -2.201 -19.414 592 HD11 LEU 74 HD11 LEU 74 -6.888 -0.906 -19.734 593 HD12 LEU 74 HD12 LEU 74 -6.846 -2.398 -20.672 594 HD13 LEU 74 HD13 LEU 74 -5.608 -1.168 -20.918 595 HD21 LEU 74 HD21 LEU 74 -5.103 -0.602 -17.837 596 HD22 LEU 74 HD22 LEU 74 -5.085 -2.155 -17.000 597 HD23 LEU 74 HD23 LEU 74 -6.612 -1.474 -17.565 598 H GLU 75 H GLU 75 -7.421 -5.880 -16.988 599 HA GLU 75 HA GLU 75 -6.925 -8.210 -18.453 600 HB2 GLU 75 HB2 GLU 75 -7.901 -7.527 -15.775 601 HB3 GLU 75 HB1 GLU 75 -8.550 -9.054 -16.395 602 HG2 GLU 75 HG1 GLU 75 -5.607 -8.457 -16.469 603 HG3 GLU 75 HG2 GLU 75 -6.390 -9.125 -15.030 604 HE2 GLU 75 HE2 GLU 75 -5.573 -11.530 -17.986 605 H GLU 76 H GLU 76 -10.049 -6.882 -17.360 606 HA GLU 76 HA GLU 76 -11.542 -8.783 -18.912 607 HB2 GLU 76 HB2 GLU 76 -12.610 -6.245 -17.675 608 HB3 GLU 76 HB1 GLU 76 -13.491 -7.735 -18.046 609 HG2 GLU 76 HG1 GLU 76 -11.532 -7.218 -15.829 610 HG3 GLU 76 HG2 GLU 76 -13.217 -7.749 -15.725 611 HE2 GLU 76 HE2 GLU 76 -12.177 -11.024 -16.818 612 H ALA 77 H ALA 77 -10.426 -5.499 -19.315 613 HA ALA 77 HA ALA 77 -12.047 -5.037 -21.667 614 HB1 ALA 77 HB1 ALA 77 -9.777 -3.244 -21.037 615 HB2 ALA 77 HB2 ALA 77 -11.082 -3.338 -19.854 616 HB3 ALA 77 HB3 ALA 77 -11.430 -2.860 -21.515 617 H GLY 78 H GLY 78 -9.517 -6.969 -21.198 618 HA2 GLY 78 HA2 GLY 78 -7.862 -7.848 -22.526 619 HA3 GLY 78 3HA GLY 78 -8.881 -7.351 -23.869 620 H GLY 79 H GLY 79 -7.662 -4.961 -21.669 621 HA2 GLY 79 HA2 GLY 79 -5.795 -3.555 -21.853 622 HA3 GLY 79 3HA GLY 79 -5.383 -4.336 -23.372 623 H ASN 80 H ASN 80 -8.496 -2.918 -22.489 624 HA ASN 80 HA ASN 80 -8.112 -0.959 -24.656 625 HB2 ASN 80 HB2 ASN 80 -9.968 -2.902 -24.666 626 HB3 ASN 80 HB1 ASN 80 -10.861 -1.663 -23.778 627 HD21 ASN 80 HD21 ASN 80 -10.444 0.625 -24.846 628 HD22 ASN 80 HD22 ASN 80 -10.773 0.664 -26.542 629 H TRP 81 H TRP 81 -7.552 0.894 -23.674 630 HA TRP 81 HA TRP 81 -8.633 1.663 -21.122 631 HB2 TRP 81 HB2 TRP 81 -6.928 3.224 -23.085 632 HB3 TRP 81 HB1 TRP 81 -7.289 3.711 -21.429 633 HD1 TRP 81 HD1 TRP 81 -5.316 1.009 -23.340 634 HE1 TRP 81 HE1 TRP 81 -3.485 0.093 -21.782 635 HE3 TRP 81 HE3 TRP 81 -6.609 3.459 -19.044 636 HZ2 TRP 81 2HZ TRP 81 -2.693 0.372 -19.087 637 HZ3 TRP 81 3HZ TRP 81 -5.263 3.078 -17.019 638 HH2 TRP 81 HH TRP 81 -3.346 1.566 -17.042 639 H SER 82 H SER 82 -9.434 2.177 -24.433 640 HA SER 82 HA SER 82 -10.740 4.607 -24.409 641 HB2 SER 82 HB2 SER 82 -10.347 2.956 -26.362 642 HB3 SER 82 HB1 SER 82 -11.884 2.229 -25.862 643 HG SER 82 HG SER 82 -11.406 4.838 -26.828 644 H TYR 83 H TYR 83 -12.144 1.414 -23.690 645 HA TYR 83 HA TYR 83 -14.652 2.539 -22.870 646 HB2 TYR 83 HB2 TYR 83 -14.895 0.398 -23.740 647 HB3 TYR 83 HB1 TYR 83 -13.465 -0.212 -22.905 648 HD1 TYR 83 HD1 TYR 83 -17.034 0.536 -22.562 649 HD2 TYR 83 HD2 TYR 83 -13.565 -0.938 -20.588 650 HE1 TYR 83 HE1 TYR 83 -18.449 -0.375 -20.769 651 HE2 TYR 83 HE2 TYR 83 -14.970 -1.854 -18.790 652 HH TYR 83 HH TYR 83 -18.022 -2.476 -18.976 653 H ILE 84 H ILE 84 -11.829 1.179 -21.223 654 HA ILE 84 HA ILE 84 -12.815 1.227 -18.610 655 HB ILE 84 HB ILE 84 -9.985 1.579 -19.600 656 HG12 ILE 84 HG11 ILE 84 -11.315 -0.835 -18.354 657 HG13 ILE 84 HG12 ILE 84 -11.213 -0.576 -20.104 658 HG21 ILE 84 HG21 ILE 84 -9.618 0.652 -17.140 659 HG22 ILE 84 HG22 ILE 84 -9.712 2.378 -17.488 660 HG23 ILE 84 HG23 ILE 84 -11.125 1.527 -16.862 661 HD11 ILE 84 HD11 ILE 84 -9.470 -2.092 -19.172 662 HD12 ILE 84 HD12 ILE 84 -8.842 -0.715 -20.077 663 HD13 ILE 84 HD13 ILE 84 -8.804 -0.703 -18.314 664 H LYS 85 H LYS 85 -11.698 3.788 -20.660 665 HA LYS 85 HA LYS 85 -11.588 5.672 -18.423 666 HB2 LYS 85 HB2 LYS 85 -10.308 7.047 -19.729 667 HB3 LYS 85 HB1 LYS 85 -9.909 5.486 -20.465 668 HG2 LYS 85 HG1 LYS 85 -12.025 6.115 -21.973 669 HG3 LYS 85 HG2 LYS 85 -11.477 7.746 -21.546 670 HD2 LYS 85 HD1 LYS 85 -9.890 5.573 -22.922 671 HD3 LYS 85 HD2 LYS 85 -10.403 7.133 -23.590 672 HE2 LYS 85 HE1 LYS 85 -9.000 7.867 -21.326 673 HE3 LYS 85 HE2 LYS 85 -8.093 6.475 -21.935 674 HZ1 LYS 85 3HZ LYS 85 -7.430 7.585 -23.762 675 HZ2 LYS 85 1HZ LYS 85 -7.720 8.952 -22.807 676 HZ3 LYS 85 2HZ LYS 85 -8.881 8.439 -23.925 677 H LEU 86 H LEU 86 -13.974 4.392 -20.103 678 HA LEU 86 HA LEU 86 -15.389 6.541 -21.233 679 HB2 LEU 86 HB2 LEU 86 -15.837 4.079 -21.540 680 HB3 LEU 86 HB1 LEU 86 -16.598 4.106 -19.940 681 HG LEU 86 HG LEU 86 -17.632 6.070 -21.889 682 HD11 LEU 86 HD11 LEU 86 -18.436 3.192 -22.169 683 HD12 LEU 86 HD12 LEU 86 -17.188 3.919 -23.181 684 HD13 LEU 86 HD13 LEU 86 -18.831 4.557 -23.215 685 HD21 LEU 86 HD21 LEU 86 -19.182 6.119 -20.303 686 HD22 LEU 86 HD22 LEU 86 -18.436 4.751 -19.476 687 HD23 LEU 86 HD23 LEU 86 -19.636 4.471 -20.738 688 H ASP 87 H ASP 87 -14.749 5.749 -17.984 689 HA ASP 87 HA ASP 87 -16.630 7.827 -17.109 690 HB2 ASP 87 HB2 ASP 87 -16.131 5.350 -15.461 691 HB3 ASP 87 HB1 ASP 87 -17.402 6.564 -15.266 692 HD2 ASP 87 HD2 ASP 87 -19.473 4.988 -17.514 693 H ASN 88 H ASN 88 -13.722 7.761 -17.642 694 HA ASN 88 HA ASN 88 -11.841 8.681 -16.754 695 HB2 ASN 88 HB2 ASN 88 -13.810 10.095 -15.605 696 HB3 ASN 88 HB1 ASN 88 -13.135 9.338 -14.158 697 HD21 ASN 88 HD21 ASN 88 -10.501 9.269 -14.590 698 HD22 ASN 88 HD22 ASN 88 -9.862 10.863 -14.778 699 H TYR 89 H TYR 89 -12.252 5.932 -16.471 700 HA TYR 89 HA TYR 89 -11.389 4.111 -15.417 701 HB2 TYR 89 HB2 TYR 89 -9.770 6.154 -13.871 702 HB3 TYR 89 HB1 TYR 89 -9.420 4.428 -13.995 703 HD1 TYR 89 HD2 TYR 89 -10.178 4.255 -17.006 704 HD2 TYR 89 HD1 TYR 89 -7.636 6.843 -14.783 705 HE1 TYR 89 HE2 TYR 89 -8.823 4.646 -19.022 706 HE2 TYR 89 HE1 TYR 89 -6.275 7.242 -16.793 707 HH TYR 89 HH TYR 89 -7.142 5.796 -19.915 708 H THR 90 H THR 90 -13.815 5.111 -14.447 709 HA THR 90 HA THR 90 -14.059 5.537 -11.734 710 HB THR 90 HB THR 90 -15.894 4.063 -13.621 711 HG1 THR 90 HG1 THR 90 -16.029 6.655 -12.437 712 HG21 THR 90 HG21 THR 90 -16.109 4.523 -10.695 713 HG22 THR 90 HG22 THR 90 -16.740 3.205 -11.682 714 HG23 THR 90 HG23 THR 90 -17.559 4.767 -11.667 715 H ALA 91 H ALA 91 -13.446 2.547 -13.444 716 HA ALA 91 HA ALA 91 -14.091 0.660 -11.531 717 HB1 ALA 91 HB1 ALA 91 -13.370 0.127 -13.820 718 HB2 ALA 91 HB2 ALA 91 -12.487 -0.803 -12.607 719 HB3 ALA 91 HB3 ALA 91 -11.719 0.578 -13.390 720 H LEU 92 H LEU 92 -11.276 2.751 -11.730 721 HA LEU 92 HA LEU 92 -9.758 1.463 -9.711 722 HB2 LEU 92 HB2 LEU 92 -8.253 3.216 -9.893 723 HB3 LEU 92 HB1 LEU 92 -9.009 3.159 -11.495 724 HG LEU 92 HG LEU 92 -10.592 4.991 -10.396 725 HD11 LEU 92 HD11 LEU 92 -9.866 5.403 -8.301 726 HD12 LEU 92 HD12 LEU 92 -8.725 6.453 -9.141 727 HD13 LEU 92 HD13 LEU 92 -8.229 4.837 -8.636 728 HD21 LEU 92 HD21 LEU 92 -8.057 6.219 -11.133 729 HD22 LEU 92 HD22 LEU 92 -9.635 6.319 -11.913 730 HD23 LEU 92 HD23 LEU 92 -8.567 4.958 -12.257 731 H VAL 93 H VAL 93 -12.190 3.996 -9.680 732 HA VAL 93 HA VAL 93 -11.819 4.919 -7.057 733 HB VAL 93 HB VAL 93 -14.251 4.854 -8.831 734 HG11 VAL 93 HG11 VAL 93 -15.197 6.507 -7.144 735 HG12 VAL 93 HG12 VAL 93 -15.209 4.803 -6.683 736 HG13 VAL 93 HG13 VAL 93 -13.985 5.888 -6.022 737 HG21 VAL 93 HG21 VAL 93 -13.410 6.734 -9.660 738 HG22 VAL 93 HG22 VAL 93 -13.368 7.454 -8.051 739 HG23 VAL 93 HG23 VAL 93 -11.986 6.530 -8.641 740 H ASP 94 H ASP 94 -14.046 2.441 -8.312 741 HA ASP 94 HA ASP 94 -14.970 1.707 -5.705 742 HB2 ASP 94 HB2 ASP 94 -16.130 1.443 -8.043 743 HB3 ASP 94 HB1 ASP 94 -15.238 -0.084 -8.094 744 HD2 ASP 94 HD2 ASP 94 -18.101 0.254 -5.358 745 H ALA 95 H ALA 95 -12.426 0.651 -7.838 746 HA ALA 95 HA ALA 95 -11.914 -1.849 -6.587 747 HB1 ALA 95 HB1 ALA 95 -9.601 -1.467 -7.720 748 HB2 ALA 95 HB2 ALA 95 -10.409 -0.096 -8.480 749 HB3 ALA 95 HB3 ALA 95 -11.034 -1.728 -8.715 750 H ILE 96 H ILE 96 -10.140 1.247 -6.429 751 HA ILE 96 HA ILE 96 -8.357 0.499 -4.416 752 HB ILE 96 HB ILE 96 -9.439 3.245 -5.053 753 HG12 ILE 96 HG11 ILE 96 -8.291 2.094 -6.918 754 HG13 ILE 96 HG12 ILE 96 -7.404 3.521 -6.353 755 HG21 ILE 96 HG21 ILE 96 -7.754 2.346 -2.912 756 HG22 ILE 96 HG22 ILE 96 -6.855 3.425 -3.979 757 HG23 ILE 96 HG23 ILE 96 -8.366 3.965 -3.248 758 HD11 ILE 96 HD11 ILE 96 -5.847 2.134 -5.142 759 HD12 ILE 96 HD12 ILE 96 -6.751 0.687 -5.589 760 HD13 ILE 96 HD13 ILE 96 -5.922 1.628 -6.829 761 H TYR 97 H TYR 97 -11.509 2.117 -4.182 762 HA TYR 97 HA TYR 97 -11.510 2.504 -1.406 763 HB2 TYR 97 HB2 TYR 97 -13.615 2.359 -3.526 764 HB3 TYR 97 HB1 TYR 97 -14.122 2.314 -1.835 765 HD1 TYR 97 HD1 TYR 97 -11.633 4.292 -3.816 766 HD2 TYR 97 HD2 TYR 97 -14.832 4.337 -1.010 767 HE1 TYR 97 HE1 TYR 97 -11.472 6.743 -3.681 768 HE2 TYR 97 HE2 TYR 97 -14.681 6.788 -0.869 769 HH TYR 97 HH TYR 97 -13.850 8.651 -2.010 770 H SER 98 H SER 98 -12.250 -0.293 -3.359 771 HA SER 98 HA SER 98 -13.499 -1.774 -1.243 772 HB2 SER 98 HB2 SER 98 -14.229 -2.550 -3.293 773 HB3 SER 98 HB1 SER 98 -12.634 -2.359 -4.045 774 HG SER 98 HG SER 98 -13.018 -4.542 -3.742 775 H VAL 99 H VAL 99 -10.374 -2.083 -2.934 776 HA VAL 99 HA VAL 99 -9.320 -4.073 -1.255 777 HB VAL 99 HB VAL 99 -7.702 -2.002 -2.737 778 HG11 VAL 99 HG11 VAL 99 -6.387 -4.363 -2.958 779 HG12 VAL 99 HG12 VAL 99 -6.069 -3.158 -1.710 780 HG13 VAL 99 HG13 VAL 99 -7.119 -4.532 -1.364 781 HG21 VAL 99 HG21 VAL 99 -8.711 -2.737 -4.590 782 HG22 VAL 99 HG22 VAL 99 -7.810 -4.233 -4.345 783 HG23 VAL 99 HG23 VAL 99 -9.464 -4.091 -3.747 784 H GLU 100 H GLU 100 -8.701 -0.560 -1.280 785 HA GLU 100 HA GLU 100 -7.007 -0.396 0.886 786 HB2 GLU 100 HB2 GLU 100 -7.441 1.890 0.948 787 HB3 GLU 100 HB1 GLU 100 -7.840 1.449 -0.719 788 HG2 GLU 100 HG1 GLU 100 -10.232 1.306 -0.069 789 HG3 GLU 100 HG2 GLU 100 -9.779 1.899 1.537 790 HE2 GLU 100 HE2 GLU 100 -8.805 4.716 -0.969 791 H ASP 101 H ASP 101 -10.471 -0.836 0.840 792 HA ASP 101 HA ASP 101 -10.678 -0.482 3.724 793 HB2 ASP 101 HB2 ASP 101 -12.415 0.284 1.947 794 HB3 ASP 101 HB1 ASP 101 -12.915 -1.412 1.946 795 HD2 ASP 101 HD2 ASP 101 -13.517 0.601 5.323 796 H GLU 102 H GLU 102 -11.572 -2.130 5.100 797 HA GLU 102 HA GLU 102 -11.469 -4.213 6.019 798 HB2 GLU 102 HB2 GLU 102 -12.191 -5.227 3.268 799 HB3 GLU 102 HB1 GLU 102 -12.606 -5.933 4.838 800 HG2 GLU 102 HG1 GLU 102 -14.002 -3.916 5.308 801 HG3 GLU 102 HG2 GLU 102 -13.698 -3.400 3.643 802 HE2 GLU 102 HE2 GLU 102 -15.866 -6.716 3.994 803 H ASN 103 H ASN 103 -9.159 -4.066 6.257 804 HA ASN 103 HA ASN 103 -7.584 -5.549 4.282 805 HB2 ASN 103 HB2 ASN 103 -6.937 -3.580 6.444 806 HB3 ASN 103 HB1 ASN 103 -5.692 -4.730 5.940 807 HD21 ASN 103 HD21 ASN 103 -8.189 -3.099 4.042 808 HD22 ASN 103 HD22 ASN 103 -7.096 -2.301 2.967 809 H LYS 104 H LYS 104 -8.837 -5.756 7.506 810 HA LYS 104 HA LYS 104 -7.123 -7.789 8.484 811 HB2 LYS 104 HB2 LYS 104 -8.965 -8.182 10.150 812 HB3 LYS 104 HB1 LYS 104 -8.379 -6.513 10.064 813 HG2 LYS 104 HG1 LYS 104 -10.308 -5.731 9.053 814 HG3 LYS 104 HG2 LYS 104 -10.764 -7.340 8.465 815 HD2 LYS 104 HD1 LYS 104 -11.640 -7.998 10.489 816 HD3 LYS 104 HD2 LYS 104 -10.603 -6.893 11.408 817 HE2 LYS 104 HE1 LYS 104 -12.585 -5.774 11.618 818 HE3 LYS 104 HE2 LYS 104 -12.008 -5.066 10.102 819 HZ1 LYS 104 3HZ LYS 104 -13.991 -7.247 10.415 820 HZ2 LYS 104 1HZ LYS 104 -13.320 -6.806 8.926 821 HZ3 LYS 104 2HZ LYS 104 -14.257 -5.697 9.793 822 H GLN 105 H GLN 105 -9.928 -7.806 6.439 823 HA GLN 105 HA GLN 105 -10.199 -10.708 6.658 824 HB2 GLN 105 HB2 GLN 105 -11.847 -8.662 5.152 825 HB3 GLN 105 HB1 GLN 105 -12.198 -10.397 5.224 826 HG2 GLN 105 HG1 GLN 105 -13.077 -10.285 7.286 827 HG3 GLN 105 HG2 GLN 105 -11.893 -9.088 7.832 828 HE21 GLN 105 HE21 GLN 105 -12.208 -6.867 7.142 829 HE22 GLN 105 HE22 GLN 105 -13.815 -6.279 6.905 830 H SER 106 H SER 106 -7.804 -9.771 5.516 831 HA SER 106 HA SER 106 -7.663 -11.314 3.183 832 HB2 SER 106 HB2 SER 106 -8.864 -9.654 1.986 833 HB3 SER 106 HB1 SER 106 -7.953 -8.341 2.754 834 HG SER 106 HG SER 106 -7.167 -10.084 0.702 835 H GLU 107 H GLU 107 -5.528 -11.243 2.172 836 HA GLU 107 HA GLU 107 -3.480 -10.874 4.122 837 HB2 GLU 107 HB2 GLU 107 -3.569 -12.653 2.301 838 HB3 GLU 107 HB1 GLU 107 -3.054 -11.382 1.182 839 HG2 GLU 107 HG1 GLU 107 -1.502 -12.073 3.666 840 HG3 GLU 107 HG2 GLU 107 -1.246 -12.884 2.114 841 HE2 GLU 107 HE2 GLU 107 0.841 -9.813 2.547 842 H GLY 108 H GLY 108 -3.780 -9.499 0.839 843 HA2 GLY 108 HA2 GLY 108 -3.552 -6.832 1.434 844 HA3 GLY 108 3HA GLY 108 -1.896 -7.418 1.418 845 H SER 109 H SER 109 -1.434 -6.068 -0.369 846 HA SER 109 HA SER 109 -2.859 -6.500 -2.854 847 HB2 SER 109 HB2 SER 109 -1.782 -4.625 -3.668 848 HB3 SER 109 HB1 SER 109 -1.755 -4.285 -1.929 849 HG SER 109 HG SER 109 0.333 -4.321 -2.020 Start of MODEL 20 1 H1 MET 1 H MET 1 1.640 18.221 27.975 2 HA MET 1 HA MET 1 0.053 15.820 27.500 3 HB2 MET 1 HB2 MET 1 -0.974 18.385 28.631 4 HB3 MET 1 HB1 MET 1 -1.984 17.529 27.456 5 HG2 MET 1 HG1 MET 1 -2.779 16.625 29.396 6 HG3 MET 1 HG2 MET 1 -1.506 15.470 28.996 7 HE1 MET 1 HE1 MET 1 -2.303 16.301 32.738 8 HE2 MET 1 HE2 MET 1 -2.631 15.238 31.370 9 HE3 MET 1 HE3 MET 1 -1.201 14.975 32.368 10 H GLY 2 H GLY 2 0.219 15.487 25.385 11 HA2 GLY 2 HA2 GLY 2 -0.795 17.074 23.395 12 HA3 GLY 2 3HA GLY 2 0.875 17.595 23.554 13 H SER 3 H SER 3 -1.041 15.727 21.752 14 HA SER 3 HA SER 3 0.330 13.270 21.565 15 HB2 SER 3 HB2 SER 3 -1.190 14.642 19.331 16 HB3 SER 3 HB1 SER 3 -0.912 12.904 19.541 17 HG SER 3 HG SER 3 -2.691 12.884 20.638 18 H SER 4 H SER 4 2.414 13.085 21.087 19 HA SER 4 HA SER 4 3.462 14.627 18.808 20 HB2 SER 4 HB2 SER 4 4.880 14.012 21.419 21 HB3 SER 4 HB1 SER 4 5.655 14.726 19.993 22 HG SER 4 HG SER 4 4.182 16.480 20.174 23 H HIS 5 H HIS 5 2.811 12.627 17.675 24 HA HIS 5 HA HIS 5 4.297 10.217 18.219 25 HB2 HIS 5 HB2 HIS 5 2.503 10.974 15.897 26 HB3 HIS 5 HB1 HIS 5 3.176 9.363 16.170 27 HD1 HIS 5 HD1 HIS 5 0.290 9.234 16.074 28 HD2 HIS 5 HD2 HIS 5 2.229 10.332 19.581 29 HE1 HIS 5 HE1 HIS 5 -1.360 8.794 17.920 30 HE2 HIS 5 HE2 HIS 5 -0.175 9.463 20.064 31 H HIS 6 H HIS 6 4.018 12.084 15.195 32 HA HIS 6 HA HIS 6 5.534 12.597 13.578 33 HB2 HIS 6 HB2 HIS 6 6.630 13.549 15.778 34 HB3 HIS 6 HB1 HIS 6 7.799 12.254 15.502 35 HD1 HIS 6 HD1 HIS 6 6.485 15.382 13.851 36 HD2 HIS 6 HD2 HIS 6 9.660 12.722 13.533 37 HE1 HIS 6 HE1 HIS 6 8.078 16.430 12.210 38 HE2 HIS 6 HE2 HIS 6 10.019 14.805 12.015 39 H HIS 7 H HIS 7 4.742 10.043 13.463 40 HA HIS 7 HA HIS 7 6.879 8.156 13.546 41 HB2 HIS 7 HB2 HIS 7 5.344 6.600 12.563 42 HB3 HIS 7 HB1 HIS 7 4.453 7.567 13.743 43 HD1 HIS 7 HD1 HIS 7 4.825 7.111 10.028 44 HD2 HIS 7 HD2 HIS 7 2.372 9.085 12.738 45 HE1 HIS 7 HE1 HIS 7 2.881 7.964 8.678 46 HE2 HIS 7 HE2 HIS 7 1.382 9.171 10.335 47 H HIS 8 H HIS 8 7.610 6.935 11.613 48 HA HIS 8 HA HIS 8 8.339 8.814 9.506 49 HB2 HIS 8 HB2 HIS 8 9.351 6.091 10.318 50 HB3 HIS 8 HB1 HIS 8 9.833 6.844 8.795 51 HD1 HIS 8 HD1 HIS 8 11.201 9.113 8.979 52 HD2 HIS 8 HD2 HIS 8 10.702 7.027 12.536 53 HE1 HIS 8 HE1 HIS 8 12.885 10.088 10.571 54 HE2 HIS 8 HE2 HIS 8 12.580 8.814 12.747 55 H HIS 9 H HIS 9 8.311 8.099 7.242 56 HA HIS 9 HA HIS 9 6.164 6.174 6.661 57 HB2 HIS 9 HB2 HIS 9 5.477 7.723 4.771 58 HB3 HIS 9 HB1 HIS 9 5.077 8.266 6.403 59 HD1 HIS 9 HD1 HIS 9 6.432 10.277 7.368 60 HD2 HIS 9 HD2 HIS 9 7.282 9.358 3.407 61 HE1 HIS 9 HE1 HIS 9 7.700 12.256 6.476 62 HE2 HIS 9 HE2 HIS 9 8.221 11.696 4.056 63 H HIS 10 H HIS 10 8.937 5.674 6.586 64 HA HIS 10 HA HIS 10 9.436 5.482 3.688 65 HB2 HIS 10 HB2 HIS 10 11.234 5.972 6.015 66 HB3 HIS 10 HB1 HIS 10 11.875 5.016 4.676 67 HD1 HIS 10 HD1 HIS 10 12.705 8.014 5.543 68 HD2 HIS 10 HD2 HIS 10 10.388 6.879 2.287 69 HE1 HIS 10 HE1 HIS 10 12.900 9.898 3.890 70 HE2 HIS 10 HE2 HIS 10 11.484 9.207 1.899 71 H SER 11 H SER 11 9.833 3.520 2.796 72 HA SER 11 HA SER 11 10.143 1.204 4.565 73 HB2 SER 11 HB2 SER 11 8.499 -0.033 3.031 74 HB3 SER 11 HB1 SER 11 7.810 1.124 4.183 75 HG SER 11 HG SER 11 6.951 2.039 2.508 76 H SER 12 H SER 12 10.261 -0.834 2.894 77 HA SER 12 HA SER 12 11.871 -0.173 0.568 78 HB2 SER 12 HB2 SER 12 13.482 -0.223 2.476 79 HB3 SER 12 HB1 SER 12 13.007 -1.904 2.777 80 HG SER 12 HG SER 12 14.813 -1.954 1.491 81 H GLY 13 H GLY 13 11.640 -1.637 -1.029 82 HA2 GLY 13 HA2 GLY 13 11.301 -4.376 -0.807 83 HA3 GLY 13 3HA GLY 13 9.684 -3.687 -0.754 84 H LEU 14 H LEU 14 12.683 -3.450 -2.666 85 HA LEU 14 HA LEU 14 11.071 -3.680 -5.097 86 HB2 LEU 14 HB2 LEU 14 11.737 -1.229 -4.347 87 HB3 LEU 14 HB1 LEU 14 13.279 -1.685 -5.091 88 HG LEU 14 HG LEU 14 10.596 -1.622 -6.469 89 HD11 LEU 14 HD11 LEU 14 13.011 0.118 -6.913 90 HD12 LEU 14 HD12 LEU 14 11.630 0.585 -5.922 91 HD13 LEU 14 HD13 LEU 14 11.415 0.281 -7.646 92 HD21 LEU 14 HD21 LEU 14 11.658 -3.258 -7.657 93 HD22 LEU 14 HD22 LEU 14 13.269 -2.656 -7.263 94 HD23 LEU 14 HD23 LEU 14 12.292 -1.832 -8.479 95 H VAL 15 H VAL 15 11.943 -5.049 -6.516 96 HA VAL 15 HA VAL 15 14.837 -5.516 -6.476 97 HB VAL 15 HB VAL 15 14.310 -8.003 -6.801 98 HG11 VAL 15 HG11 VAL 15 13.567 -7.407 -4.031 99 HG12 VAL 15 HG12 VAL 15 14.949 -8.298 -4.671 100 HG13 VAL 15 HG13 VAL 15 14.987 -6.536 -4.607 101 HG21 VAL 15 HG21 VAL 15 11.828 -7.445 -5.236 102 HG22 VAL 15 HG22 VAL 15 11.785 -7.379 -6.998 103 HG23 VAL 15 HG23 VAL 15 12.262 -8.868 -6.183 104 HA PRO 16 HA PRO 16 14.539 -5.518 -10.856 105 HB2 PRO 16 HB2 PRO 16 16.532 -7.268 -11.539 106 HB3 PRO 16 HB1 PRO 16 16.832 -5.653 -10.898 107 HG2 PRO 16 HG1 PRO 16 16.796 -8.289 -9.469 108 HG3 PRO 16 HG2 PRO 16 17.987 -6.941 -9.344 109 HD2 PRO 16 HD1 PRO 16 16.044 -7.355 -7.495 110 HD3 PRO 16 HD2 PRO 16 16.624 -5.738 -7.927 111 H ARG 17 H ARG 17 14.809 -7.331 -12.746 112 HA ARG 17 HA ARG 17 12.450 -8.841 -12.660 113 HB2 ARG 17 HB2 ARG 17 14.804 -8.675 -14.485 114 HB3 ARG 17 HB1 ARG 17 13.718 -10.062 -14.657 115 HG2 ARG 17 HG1 ARG 17 12.843 -8.549 -16.171 116 HG3 ARG 17 HG2 ARG 17 11.837 -8.297 -14.735 117 HD2 ARG 17 HD1 ARG 17 13.163 -6.357 -14.096 118 HD3 ARG 17 HD2 ARG 17 14.244 -6.634 -15.468 119 HE ARG 17 HE ARG 17 11.481 -6.280 -16.202 120 HH11 ARG 17 1HH1 ARG 17 14.516 -4.704 -15.557 121 HH12 ARG 17 2HH1 ARG 17 14.131 -3.293 -16.486 122 HH21 ARG 17 1HH2 ARG 17 10.962 -4.429 -17.429 123 HH22 ARG 17 2HH2 ARG 17 12.109 -3.138 -17.551 124 H GLY 18 H GLY 18 12.150 -11.138 -12.687 125 HA2 GLY 18 HA2 GLY 18 14.343 -12.684 -11.472 126 HA3 GLY 18 3HA GLY 18 12.750 -12.693 -10.730 127 H SER 19 H SER 19 13.128 -15.067 -11.099 128 HA SER 19 HA SER 19 12.939 -16.051 -13.787 129 HB2 SER 19 HB2 SER 19 12.358 -18.243 -12.402 130 HB3 SER 19 HB1 SER 19 14.011 -17.605 -12.466 131 HG SER 19 HG SER 19 13.878 -16.973 -10.433 132 H HIS 20 H HIS 20 11.161 -17.748 -14.245 133 HA HIS 20 HA HIS 20 8.558 -16.640 -13.415 134 HB2 HIS 20 HB2 HIS 20 9.132 -17.880 -16.111 135 HB3 HIS 20 HB1 HIS 20 7.693 -16.981 -15.619 136 HD1 HIS 20 HD1 HIS 20 9.615 -16.247 -18.054 137 HD2 HIS 20 HD2 HIS 20 9.544 -14.422 -14.323 138 HE1 HIS 20 HE1 HIS 20 10.585 -13.954 -18.409 139 HE2 HIS 20 HE2 HIS 20 10.543 -12.838 -16.129 140 H MET 21 H MET 21 7.257 -18.040 -12.438 141 HA MET 21 HA MET 21 6.457 -19.984 -11.562 142 HB2 MET 21 HB2 MET 21 5.864 -20.078 -14.085 143 HB3 MET 21 HB1 MET 21 7.130 -21.313 -14.170 144 HG2 MET 21 HG1 MET 21 5.939 -22.636 -12.461 145 HG3 MET 21 HG2 MET 21 4.661 -21.418 -12.451 146 HE1 MET 21 HE1 MET 21 6.205 -24.317 -13.681 147 HE2 MET 21 HE2 MET 21 4.625 -25.056 -13.939 148 HE3 MET 21 HE3 MET 21 5.654 -24.672 -15.320 149 H ILE 22 H ILE 22 8.911 -19.613 -10.636 150 HA ILE 22 HA ILE 22 10.819 -21.602 -11.217 151 HB ILE 22 HB ILE 22 11.252 -19.471 -9.953 152 HG12 ILE 22 HG11 ILE 22 12.273 -21.608 -8.177 153 HG13 ILE 22 HG12 ILE 22 12.579 -21.834 -9.907 154 HG21 ILE 22 HG21 ILE 22 10.877 -19.461 -7.544 155 HG22 ILE 22 HG22 ILE 22 9.356 -19.607 -8.420 156 HG23 ILE 22 HG23 ILE 22 10.071 -21.026 -7.655 157 HD11 ILE 22 HD11 ILE 22 13.727 -19.726 -10.038 158 HD12 ILE 22 HD12 ILE 22 13.341 -19.374 -8.354 159 HD13 ILE 22 HD13 ILE 22 14.430 -20.702 -8.749 160 H SER 23 H SER 23 11.447 -23.435 -9.961 161 HA SER 23 HA SER 23 9.396 -25.210 -9.367 162 HB2 SER 23 HB2 SER 23 11.075 -26.690 -8.501 163 HB3 SER 23 HB1 SER 23 11.807 -25.788 -9.840 164 HG SER 23 HG SER 23 13.176 -25.858 -8.005 165 H LEU 24 H LEU 24 10.871 -22.776 -7.394 166 HA LEU 24 HA LEU 24 10.336 -23.691 -4.833 167 HB2 LEU 24 HB2 LEU 24 11.446 -21.473 -5.806 168 HB3 LEU 24 HB1 LEU 24 9.843 -20.823 -5.421 169 HG LEU 24 HG LEU 24 11.444 -20.404 -3.624 170 HD11 LEU 24 HD11 LEU 24 9.687 -22.446 -2.409 171 HD12 LEU 24 HD12 LEU 24 8.901 -21.175 -3.345 172 HD13 LEU 24 HD13 LEU 24 9.934 -20.754 -1.978 173 HD21 LEU 24 HD21 LEU 24 12.973 -21.930 -3.116 174 HD22 LEU 24 HD22 LEU 24 12.167 -23.127 -4.130 175 HD23 LEU 24 HD23 LEU 24 11.698 -22.944 -2.439 176 H SER 25 H SER 25 8.184 -22.275 -7.207 177 HA SER 25 HA SER 25 6.012 -21.638 -5.583 178 HB2 SER 25 HB2 SER 25 6.326 -22.383 -8.471 179 HB3 SER 25 HB1 SER 25 4.696 -22.279 -7.783 180 HG SER 25 HG SER 25 4.879 -20.213 -8.072 181 H GLY 26 H GLY 26 4.966 -22.907 -4.208 182 HA2 GLY 26 HA2 GLY 26 4.331 -25.659 -5.064 183 HA3 GLY 26 3HA GLY 26 4.955 -25.340 -3.452 184 H LEU 27 H LEU 27 2.716 -26.637 -3.371 185 HA LEU 27 HA LEU 27 0.546 -24.672 -3.093 186 HB2 LEU 27 HB2 LEU 27 -1.006 -26.481 -3.245 187 HB3 LEU 27 HB1 LEU 27 0.159 -26.626 -4.572 188 HG LEU 27 HG LEU 27 0.620 -28.190 -2.075 189 HD11 LEU 27 HD11 LEU 27 -1.690 -28.462 -3.831 190 HD12 LEU 27 HD12 LEU 27 -1.378 -29.169 -2.246 191 HD13 LEU 27 HD13 LEU 27 -0.734 -29.938 -3.695 192 HD21 LEU 27 HD21 LEU 27 1.445 -28.232 -4.912 193 HD22 LEU 27 HD22 LEU 27 1.218 -29.798 -4.132 194 HD23 LEU 27 HD23 LEU 27 2.356 -28.632 -3.457 195 H THR 28 H THR 28 2.869 -25.642 -1.227 196 HA THR 28 HA THR 28 1.509 -26.731 1.046 197 HB THR 28 HB THR 28 3.579 -26.572 2.211 198 HG1 THR 28 HG1 THR 28 5.246 -25.246 1.536 199 HG21 THR 28 HG21 THR 28 3.374 -27.801 -0.292 200 HG22 THR 28 HG22 THR 28 4.532 -28.174 0.984 201 HG23 THR 28 HG23 THR 28 4.956 -27.025 -0.285 202 H SER 29 H SER 29 2.204 -25.430 3.230 203 HA SER 29 HA SER 29 0.763 -22.890 2.993 204 HB2 SER 29 HB2 SER 29 0.356 -23.061 5.380 205 HB3 SER 29 HB1 SER 29 -0.062 -24.600 4.609 206 HG SER 29 HG SER 29 1.155 -25.193 6.308 207 H SER 30 H SER 30 2.901 -22.135 2.001 208 HA SER 30 HA SER 30 4.237 -20.519 3.939 209 HB2 SER 30 HB2 SER 30 5.340 -22.934 3.924 210 HB3 SER 30 HB1 SER 30 6.152 -22.294 2.484 211 HG SER 30 HG SER 30 7.125 -21.957 4.708 212 H VAL 31 H VAL 31 5.689 -18.975 2.970 213 HA VAL 31 HA VAL 31 5.877 -17.306 1.386 214 HB VAL 31 HB VAL 31 7.153 -18.047 -0.592 215 HG11 VAL 31 HG11 VAL 31 9.070 -18.415 0.587 216 HG12 VAL 31 HG12 VAL 31 8.021 -17.899 1.909 217 HG13 VAL 31 HG13 VAL 31 8.325 -19.616 1.642 218 HG21 VAL 31 HG21 VAL 31 7.614 -20.332 -1.035 219 HG22 VAL 31 HG22 VAL 31 6.854 -20.850 0.469 220 HG23 VAL 31 HG23 VAL 31 5.866 -20.203 -0.841 221 H GLU 32 H GLU 32 3.230 -18.075 1.458 222 HA GLU 32 HA GLU 32 2.250 -18.757 -1.140 223 HB2 GLU 32 HB2 GLU 32 0.025 -18.129 -0.186 224 HB3 GLU 32 HB1 GLU 32 0.909 -19.336 0.761 225 HG2 GLU 32 HG1 GLU 32 1.542 -17.709 2.398 226 HG3 GLU 32 HG2 GLU 32 0.881 -16.400 1.407 227 HE2 GLU 32 HE2 GLU 32 -1.587 -18.516 3.639 228 H SER 33 H SER 33 3.121 -15.825 0.465 229 HA SER 33 HA SER 33 2.011 -14.268 -1.778 230 HB2 SER 33 HB2 SER 33 0.934 -13.546 0.230 231 HB3 SER 33 HB1 SER 33 2.474 -13.489 1.105 232 HG SER 33 HG SER 33 1.512 -11.435 0.211 233 H ASP 34 H ASP 34 4.827 -15.123 0.017 234 HA ASP 34 HA ASP 34 6.547 -13.016 -0.610 235 HB2 ASP 34 HB2 ASP 34 6.980 -14.920 0.998 236 HB3 ASP 34 HB1 ASP 34 7.357 -15.919 -0.411 237 HD2 ASP 34 HD2 ASP 34 9.879 -12.895 -0.053 238 H LEU 35 H LEU 35 5.260 -15.522 -2.590 239 HA LEU 35 HA LEU 35 7.260 -15.124 -4.675 240 HB2 LEU 35 HB2 LEU 35 5.096 -17.095 -4.134 241 HB3 LEU 35 HB1 LEU 35 5.540 -16.798 -5.825 242 HG LEU 35 HG LEU 35 7.984 -17.230 -4.794 243 HD11 LEU 35 HD11 LEU 35 6.830 -17.657 -2.550 244 HD12 LEU 35 HD12 LEU 35 8.017 -18.838 -3.102 245 HD13 LEU 35 HD13 LEU 35 6.295 -19.179 -3.264 246 HD21 LEU 35 HD21 LEU 35 5.945 -18.898 -6.111 247 HD22 LEU 35 HD22 LEU 35 7.282 -19.773 -5.362 248 HD23 LEU 35 HD23 LEU 35 7.606 -18.543 -6.586 249 H ASP 36 H ASP 36 5.023 -13.196 -3.747 250 HA ASP 36 HA ASP 36 3.321 -12.898 -6.026 251 HB2 ASP 36 HB2 ASP 36 2.412 -12.079 -4.019 252 HB3 ASP 36 HB1 ASP 36 3.897 -11.211 -3.603 253 HD2 ASP 36 HD2 ASP 36 2.849 -8.387 -5.222 254 H MET 37 H MET 37 6.463 -11.738 -5.124 255 HA MET 37 HA MET 37 6.583 -9.518 -6.885 256 HB2 MET 37 HB2 MET 37 8.889 -11.190 -5.860 257 HB3 MET 37 HB1 MET 37 8.963 -9.527 -6.460 258 HG2 MET 37 HG1 MET 37 7.364 -10.324 -4.033 259 HG3 MET 37 HG2 MET 37 9.050 -9.805 -3.964 260 HE1 MET 37 HE1 MET 37 9.304 -7.551 -2.893 261 HE2 MET 37 HE2 MET 37 9.911 -7.423 -4.545 262 HE3 MET 37 HE3 MET 37 8.932 -6.124 -3.862 263 H GLN 38 H GLN 38 6.963 -12.930 -7.314 264 HA GLN 38 HA GLN 38 8.505 -12.909 -9.679 265 HB2 GLN 38 HB2 GLN 38 7.738 -14.856 -8.029 266 HB3 GLN 38 HB1 GLN 38 6.477 -15.046 -9.257 267 HG2 GLN 38 HG1 GLN 38 8.046 -16.492 -10.062 268 HG3 GLN 38 HG2 GLN 38 8.504 -15.008 -10.910 269 HE21 GLN 38 HE21 GLN 38 9.233 -16.992 -8.094 270 HE22 GLN 38 HE22 GLN 38 10.892 -16.528 -7.969 271 H GLN 39 H GLN 39 4.989 -13.271 -9.213 272 HA GLN 39 HA GLN 39 4.317 -13.253 -11.935 273 HB2 GLN 39 HB2 GLN 39 2.029 -12.560 -11.108 274 HB3 GLN 39 HB1 GLN 39 2.691 -14.043 -10.401 275 HG2 GLN 39 HG1 GLN 39 3.234 -12.947 -8.362 276 HG3 GLN 39 HG2 GLN 39 2.889 -11.360 -9.065 277 HE21 GLN 39 HE21 GLN 39 1.678 -13.846 -7.219 278 HE22 GLN 39 HE22 GLN 39 0.002 -13.428 -7.267 279 H ALA 40 H ALA 40 4.973 -10.672 -9.688 280 HA ALA 40 HA ALA 40 3.798 -8.532 -11.064 281 HB1 ALA 40 HB1 ALA 40 4.769 -7.213 -9.508 282 HB2 ALA 40 HB2 ALA 40 6.343 -7.996 -9.666 283 HB3 ALA 40 HB3 ALA 40 5.070 -8.757 -8.711 284 H MET 41 H MET 41 6.682 -10.343 -11.686 285 HA MET 41 HA MET 41 7.996 -8.408 -13.310 286 HB2 MET 41 HB2 MET 41 8.326 -11.406 -13.483 287 HB3 MET 41 HB1 MET 41 9.507 -10.156 -13.902 288 HG2 MET 41 HG1 MET 41 8.524 -10.831 -11.127 289 HG3 MET 41 HG2 MET 41 10.104 -11.215 -11.816 290 HE1 MET 41 HE1 MET 41 10.748 -8.505 -9.047 291 HE2 MET 41 HE2 MET 41 10.021 -10.106 -9.193 292 HE3 MET 41 HE3 MET 41 11.635 -9.807 -9.841 293 H LEU 42 H LEU 42 5.768 -11.068 -13.959 294 HA LEU 42 HA LEU 42 5.922 -10.827 -16.802 295 HB2 LEU 42 HB2 LEU 42 4.158 -12.289 -14.874 296 HB3 LEU 42 HB1 LEU 42 3.684 -12.158 -16.576 297 HG LEU 42 HG LEU 42 5.915 -13.199 -17.153 298 HD11 LEU 42 HD11 LEU 42 6.869 -14.595 -15.276 299 HD12 LEU 42 HD12 LEU 42 5.933 -13.588 -14.171 300 HD13 LEU 42 HD13 LEU 42 7.178 -12.861 -15.186 301 HD21 LEU 42 HD21 LEU 42 5.024 -15.320 -17.067 302 HD22 LEU 42 HD22 LEU 42 3.577 -14.329 -16.876 303 HD23 LEU 42 HD23 LEU 42 4.326 -15.080 -15.465 304 H THR 43 H THR 43 4.530 -8.910 -14.456 305 HA THR 43 HA THR 43 2.741 -7.683 -16.443 306 HB THR 43 HB THR 43 1.251 -8.802 -14.949 307 HG1 THR 43 HG1 THR 43 0.216 -6.956 -15.122 308 HG21 THR 43 HG21 THR 43 3.263 -8.165 -12.986 309 HG22 THR 43 HG22 THR 43 1.943 -9.332 -12.896 310 HG23 THR 43 HG23 THR 43 1.672 -7.653 -12.428 311 H ASN 44 H ASN 44 4.921 -6.493 -16.591 312 HA ASN 44 HA ASN 44 5.613 -4.681 -14.504 313 HB2 ASN 44 HB2 ASN 44 6.922 -5.609 -16.681 314 HB3 ASN 44 HB1 ASN 44 6.412 -4.027 -17.280 315 HD21 ASN 44 HD21 ASN 44 8.209 -2.852 -17.244 316 HD22 ASN 44 HD22 ASN 44 9.205 -2.596 -15.856 317 H LYS 45 H LYS 45 5.971 -2.249 -15.652 318 HA LYS 45 HA LYS 45 3.208 -1.321 -15.969 319 HB2 LYS 45 HB2 LYS 45 5.713 0.247 -15.312 320 HB3 LYS 45 HB1 LYS 45 4.062 0.884 -15.332 321 HG2 LYS 45 HG1 LYS 45 4.223 0.517 -13.109 322 HG3 LYS 45 HG2 LYS 45 3.707 -1.107 -13.595 323 HD2 LYS 45 HD1 LYS 45 6.033 -1.858 -13.653 324 HD3 LYS 45 HD2 LYS 45 6.569 -0.229 -13.204 325 HE2 LYS 45 HE1 LYS 45 4.559 -1.479 -11.418 326 HE3 LYS 45 HE2 LYS 45 6.171 -2.208 -11.425 327 HZ1 LYS 45 3HZ LYS 45 6.747 0.411 -11.270 328 HZ2 LYS 45 1HZ LYS 45 6.631 -0.623 -9.937 329 HZ3 LYS 45 2HZ LYS 45 5.312 0.339 -10.378 330 H ASP 46 H ASP 46 3.082 0.791 -17.323 331 HA ASP 46 HA ASP 46 4.820 0.708 -19.667 332 HB2 ASP 46 HB2 ASP 46 1.804 0.448 -19.805 333 HB3 ASP 46 HB1 ASP 46 2.858 0.737 -21.196 334 HD2 ASP 46 HD2 ASP 46 2.269 -2.909 -20.264 335 H GLU 47 H GLU 47 4.027 2.533 -21.252 336 HA GLU 47 HA GLU 47 4.272 4.974 -19.840 337 HB2 GLU 47 HB2 GLU 47 3.929 6.043 -22.051 338 HB3 GLU 47 HB1 GLU 47 5.158 4.769 -22.078 339 HG2 GLU 47 HG1 GLU 47 2.982 3.328 -22.757 340 HG3 GLU 47 HG2 GLU 47 2.547 4.908 -23.426 341 HE2 GLU 47 HE2 GLU 47 4.464 4.155 -26.155 342 H LYS 48 H LYS 48 1.546 3.373 -21.427 343 HA LYS 48 HA LYS 48 -0.306 5.486 -20.981 344 HB2 LYS 48 HB2 LYS 48 -2.029 3.750 -21.513 345 HB3 LYS 48 HB1 LYS 48 -0.758 3.914 -22.734 346 HG2 LYS 48 HG1 LYS 48 -0.222 1.897 -20.661 347 HG3 LYS 48 HG2 LYS 48 -1.609 1.559 -21.712 348 HD2 LYS 48 HD1 LYS 48 0.431 2.476 -23.417 349 HD3 LYS 48 HD2 LYS 48 1.203 1.351 -22.285 350 HE2 LYS 48 HE1 LYS 48 0.457 -0.293 -23.609 351 HE3 LYS 48 HE2 LYS 48 -1.145 0.065 -22.947 352 HZ1 LYS 48 3HZ LYS 48 -0.224 0.394 -25.588 353 HZ2 LYS 48 1HZ LYS 48 -0.683 1.904 -24.977 354 HZ3 LYS 48 2HZ LYS 48 -1.785 0.620 -24.977 355 H VAL 49 H VAL 49 0.711 2.691 -19.137 356 HA VAL 49 HA VAL 49 -1.376 2.554 -17.283 357 HB VAL 49 HB VAL 49 1.552 1.925 -16.883 358 HG11 VAL 49 HG11 VAL 49 1.009 1.757 -14.722 359 HG12 VAL 49 HG12 VAL 49 -0.721 1.854 -15.058 360 HG13 VAL 49 HG13 VAL 49 0.120 0.308 -15.187 361 HG21 VAL 49 HG21 VAL 49 -0.298 -0.301 -17.081 362 HG22 VAL 49 HG22 VAL 49 -0.308 0.704 -18.531 363 HG23 VAL 49 HG23 VAL 49 1.203 0.000 -17.956 364 H LEU 50 H LEU 50 1.279 4.777 -17.567 365 HA LEU 50 HA LEU 50 1.253 5.773 -14.915 366 HB2 LEU 50 HB2 LEU 50 2.078 7.220 -17.437 367 HB3 LEU 50 HB1 LEU 50 2.551 7.617 -15.776 368 HG LEU 50 HG LEU 50 3.348 5.111 -17.255 369 HD11 LEU 50 HD11 LEU 50 5.549 6.754 -16.575 370 HD12 LEU 50 HD12 LEU 50 4.368 7.757 -17.415 371 HD13 LEU 50 HD13 LEU 50 4.979 6.290 -18.178 372 HD21 LEU 50 HD21 LEU 50 4.965 4.916 -15.351 373 HD22 LEU 50 HD22 LEU 50 3.274 4.666 -14.915 374 HD23 LEU 50 HD23 LEU 50 4.066 6.198 -14.540 375 H LYS 51 H LYS 51 -0.652 6.444 -17.752 376 HA LYS 51 HA LYS 51 -1.713 8.938 -17.010 377 HB2 LYS 51 HB2 LYS 51 -2.943 6.727 -18.675 378 HB3 LYS 51 HB1 LYS 51 -3.554 8.387 -18.581 379 HG2 LYS 51 HG1 LYS 51 -0.710 7.957 -19.373 380 HG3 LYS 51 HG2 LYS 51 -1.995 7.621 -20.548 381 HD2 LYS 51 HD1 LYS 51 -2.745 9.838 -20.565 382 HD3 LYS 51 HD2 LYS 51 -1.933 10.210 -19.034 383 HE2 LYS 51 HE1 LYS 51 0.266 9.806 -20.245 384 HE3 LYS 51 HE2 LYS 51 -0.681 9.792 -21.740 385 HZ1 LYS 51 3HZ LYS 51 -0.969 12.004 -21.681 386 HZ2 LYS 51 1HZ LYS 51 0.388 11.990 -20.672 387 HZ3 LYS 51 2HZ LYS 51 -1.163 12.059 -20.001 388 H ALA 52 H ALA 52 -2.771 5.635 -16.319 389 HA ALA 52 HA ALA 52 -5.206 6.283 -15.070 390 HB1 ALA 52 HB1 ALA 52 -3.792 3.950 -15.659 391 HB2 ALA 52 HB2 ALA 52 -5.407 4.074 -14.959 392 HB3 ALA 52 HB3 ALA 52 -3.997 3.943 -13.907 393 H LEU 53 H LEU 53 -1.909 6.106 -13.862 394 HA LEU 53 HA LEU 53 -2.532 6.250 -11.108 395 HB2 LEU 53 HB2 LEU 53 -0.032 7.213 -12.507 396 HB3 LEU 53 HB1 LEU 53 -0.205 6.826 -10.786 397 HG LEU 53 HG LEU 53 -0.447 4.819 -13.026 398 HD11 LEU 53 HD11 LEU 53 1.743 4.066 -12.441 399 HD12 LEU 53 HD12 LEU 53 1.838 5.212 -11.104 400 HD13 LEU 53 HD13 LEU 53 1.831 5.797 -12.768 401 HD21 LEU 53 HD21 LEU 53 0.151 3.537 -10.649 402 HD22 LEU 53 HD22 LEU 53 -1.418 3.578 -11.453 403 HD23 LEU 53 HD23 LEU 53 -1.042 4.752 -10.190 404 H GLU 54 H GLU 54 -2.567 8.582 -13.614 405 HA GLU 54 HA GLU 54 -2.077 10.916 -12.090 406 HB2 GLU 54 HB2 GLU 54 -3.732 10.620 -14.609 407 HB3 GLU 54 HB1 GLU 54 -3.057 12.127 -13.969 408 HG2 GLU 54 HG1 GLU 54 -1.498 9.763 -15.015 409 HG3 GLU 54 HG2 GLU 54 -1.720 11.328 -15.812 410 HE2 GLU 54 HE2 GLU 54 0.418 12.838 -13.351 411 H ARG 55 H ARG 55 -5.015 9.127 -12.887 412 HA ARG 55 HA ARG 55 -6.759 11.024 -11.623 413 HB2 ARG 55 HB2 ARG 55 -7.725 9.787 -13.386 414 HB3 ARG 55 HB1 ARG 55 -7.143 8.250 -12.727 415 HG2 ARG 55 HG1 ARG 55 -9.544 8.476 -12.410 416 HG3 ARG 55 HG2 ARG 55 -8.693 8.446 -10.856 417 HD2 ARG 55 HD1 ARG 55 -9.602 10.399 -10.293 418 HD3 ARG 55 HD2 ARG 55 -8.857 11.149 -11.711 419 HE ARG 55 HE ARG 55 -11.190 9.758 -12.479 420 HH11 ARG 55 1HH1 ARG 55 -10.156 12.625 -10.797 421 HH12 ARG 55 2HH1 ARG 55 -11.592 13.520 -11.170 422 HH21 ARG 55 1HH2 ARG 55 -13.085 10.926 -12.978 423 HH22 ARG 55 2HH2 ARG 55 -13.258 12.552 -12.410 424 H THR 56 H THR 56 -5.158 8.044 -10.703 425 HA THR 56 HA THR 56 -6.600 7.701 -8.256 426 HB THR 56 HB THR 56 -5.017 5.958 -7.732 427 HG1 THR 56 HG1 THR 56 -3.019 6.198 -8.363 428 HG21 THR 56 HG21 THR 56 -4.961 5.133 -10.422 429 HG22 THR 56 HG22 THR 56 -6.421 6.105 -10.231 430 HG23 THR 56 HG23 THR 56 -6.147 4.709 -9.189 431 H ARG 57 H ARG 57 -3.371 8.932 -9.086 432 HA ARG 57 HA ARG 57 -2.416 9.433 -6.536 433 HB2 ARG 57 HB2 ARG 57 -0.863 10.957 -7.522 434 HB3 ARG 57 HB1 ARG 57 -1.133 9.647 -8.681 435 HG2 ARG 57 HG1 ARG 57 -2.472 11.000 -10.078 436 HG3 ARG 57 HG2 ARG 57 -2.615 12.253 -8.833 437 HD2 ARG 57 HD1 ARG 57 -1.040 12.939 -10.570 438 HD3 ARG 57 HD2 ARG 57 -0.224 12.725 -9.016 439 HE ARG 57 HE ARG 57 -0.006 10.316 -10.373 440 HH11 ARG 57 1HH1 ARG 57 1.023 13.617 -10.776 441 HH12 ARG 57 2HH1 ARG 57 2.454 13.200 -11.658 442 HH21 ARG 57 1HH2 ARG 57 1.876 9.754 -11.534 443 HH22 ARG 57 2HH2 ARG 57 2.939 11.002 -12.089 444 H GLN 58 H GLN 58 -4.817 11.140 -8.371 445 HA GLN 58 HA GLN 58 -4.762 13.603 -7.009 446 HB2 GLN 58 HB2 GLN 58 -6.873 12.140 -8.577 447 HB3 GLN 58 HB1 GLN 58 -7.230 13.679 -7.779 448 HG2 GLN 58 HG1 GLN 58 -4.993 13.300 -9.765 449 HG3 GLN 58 HG2 GLN 58 -6.614 13.865 -10.186 450 HE21 GLN 58 HE21 GLN 58 -3.692 14.624 -8.431 451 HE22 GLN 58 HE22 GLN 58 -3.972 16.325 -8.313 452 H LEU 59 H LEU 59 -6.485 10.586 -6.377 453 HA LEU 59 HA LEU 59 -7.740 11.720 -4.007 454 HB2 LEU 59 HB2 LEU 59 -7.910 8.869 -4.972 455 HB3 LEU 59 HB1 LEU 59 -9.016 9.728 -3.886 456 HG LEU 59 HG LEU 59 -8.898 11.044 -6.447 457 HD11 LEU 59 HD11 LEU 59 -9.620 8.117 -6.456 458 HD12 LEU 59 HD12 LEU 59 -8.319 8.891 -7.362 459 HD13 LEU 59 HD13 LEU 59 -10.000 9.258 -7.747 460 HD21 LEU 59 HD21 LEU 59 -11.253 10.953 -6.274 461 HD22 LEU 59 HD22 LEU 59 -10.652 11.160 -4.628 462 HD23 LEU 59 HD23 LEU 59 -11.195 9.574 -5.177 463 H ASP 60 H ASP 60 -4.759 10.903 -4.496 464 HA ASP 60 HA ASP 60 -3.031 10.215 -3.185 465 HB2 ASP 60 HB2 ASP 60 -4.913 9.861 -0.865 466 HB3 ASP 60 HB1 ASP 60 -3.228 10.399 -0.862 467 HD2 ASP 60 HD2 ASP 60 -4.175 13.670 -1.780 468 H ILE 61 H ILE 61 -3.182 8.277 -4.572 469 HA ILE 61 HA ILE 61 -3.762 5.897 -2.940 470 HB ILE 61 HB ILE 61 -4.186 6.037 -5.924 471 HG12 ILE 61 HG11 ILE 61 -6.288 6.033 -3.745 472 HG13 ILE 61 HG12 ILE 61 -5.781 7.481 -4.634 473 HG21 ILE 61 HG21 ILE 61 -5.261 3.972 -4.036 474 HG22 ILE 61 HG22 ILE 61 -5.043 3.874 -5.783 475 HG23 ILE 61 HG23 ILE 61 -3.640 3.837 -4.716 476 HD11 ILE 61 HD11 ILE 61 -6.479 5.413 -6.485 477 HD12 ILE 61 HD12 ILE 61 -7.792 5.676 -5.338 478 HD13 ILE 61 HD13 ILE 61 -7.169 7.024 -6.289 479 HA PRO 62 HA PRO 62 0.475 4.962 -3.823 480 HB2 PRO 62 HB2 PRO 62 0.471 2.406 -2.841 481 HB3 PRO 62 HB1 PRO 62 0.475 3.841 -1.817 482 HG2 PRO 62 HG1 PRO 62 -1.830 2.122 -2.674 483 HG3 PRO 62 HG2 PRO 62 -1.440 2.777 -1.039 484 HD2 PRO 62 HD1 PRO 62 -3.321 3.886 -2.652 485 HD3 PRO 62 HD2 PRO 62 -2.317 4.846 -1.552 486 H ASP 63 H ASP 63 1.526 4.152 -5.547 487 HA ASP 63 HA ASP 63 0.086 2.956 -7.675 488 HB2 ASP 63 HB2 ASP 63 3.090 3.120 -7.309 489 HB3 ASP 63 HB1 ASP 63 2.225 2.858 -8.829 490 HD2 ASP 63 HD2 ASP 63 3.036 6.448 -8.169 491 H GLU 64 H GLU 64 1.359 1.646 -4.868 492 HA GLU 64 HA GLU 64 2.191 -0.895 -5.897 493 HB2 GLU 64 HB2 GLU 64 1.373 -0.301 -3.052 494 HB3 GLU 64 HB1 GLU 64 2.491 -1.547 -3.631 495 HG2 GLU 64 HG1 GLU 64 2.983 1.427 -3.784 496 HG3 GLU 64 HG2 GLU 64 3.633 0.342 -2.547 497 HE2 GLU 64 HE2 GLU 64 5.365 -1.207 -5.484 498 H LYS 65 H LYS 65 -0.809 0.522 -4.948 499 HA LYS 65 HA LYS 65 -2.121 -2.111 -5.069 500 HB2 LYS 65 HB2 LYS 65 -3.810 -1.335 -3.657 501 HB3 LYS 65 HB1 LYS 65 -2.340 -0.614 -2.981 502 HG2 LYS 65 HG1 LYS 65 -2.859 1.484 -4.222 503 HG3 LYS 65 HG2 LYS 65 -4.399 0.748 -4.702 504 HD2 LYS 65 HD1 LYS 65 -3.483 1.226 -1.855 505 HD3 LYS 65 HD2 LYS 65 -4.665 2.203 -2.746 506 HE2 LYS 65 HE1 LYS 65 -6.293 0.832 -2.091 507 HE3 LYS 65 HE2 LYS 65 -5.493 -0.492 -2.949 508 HZ1 LYS 65 3HZ LYS 65 -4.439 0.216 -0.321 509 HZ2 LYS 65 1HZ LYS 65 -4.578 -1.300 -1.058 510 HZ3 LYS 65 2HZ LYS 65 -5.936 -0.569 -0.364 511 H THR 66 H THR 66 -1.851 0.992 -6.540 512 HA THR 66 HA THR 66 -4.318 0.886 -8.000 513 HB THR 66 HB THR 66 -1.880 2.571 -8.598 514 HG1 THR 66 HG1 THR 66 -2.427 3.699 -6.903 515 HG21 THR 66 HG21 THR 66 -3.345 3.988 -9.821 516 HG22 THR 66 HG22 THR 66 -4.772 3.132 -9.235 517 HG23 THR 66 HG23 THR 66 -3.672 2.344 -10.367 518 H MET 67 H MET 67 -0.957 0.042 -8.648 519 HA MET 67 HA MET 67 -1.006 -0.330 -11.375 520 HB2 MET 67 HB2 MET 67 0.501 -1.584 -9.129 521 HB3 MET 67 HB1 MET 67 0.602 -2.350 -10.722 522 HG2 MET 67 HG1 MET 67 1.372 0.482 -10.017 523 HG3 MET 67 HG2 MET 67 2.446 -0.848 -10.456 524 HE1 MET 67 HE1 MET 67 -0.318 -1.578 -12.915 525 HE2 MET 67 HE2 MET 67 0.953 -1.501 -14.136 526 HE3 MET 67 HE3 MET 67 1.250 -2.324 -12.603 527 HA PRO 68 HA PRO 68 -2.599 -4.850 -10.712 528 HB2 PRO 68 HB2 PRO 68 -3.590 -5.476 -8.236 529 HB3 PRO 68 HB1 PRO 68 -1.898 -5.675 -8.686 530 HG2 PRO 68 HG1 PRO 68 -3.218 -3.425 -7.208 531 HG3 PRO 68 HG2 PRO 68 -1.677 -4.284 -6.836 532 HD2 PRO 68 HD1 PRO 68 -1.746 -1.847 -8.031 533 HD3 PRO 68 HD2 PRO 68 -0.504 -3.058 -8.395 534 H VAL 69 H VAL 69 -4.117 -2.045 -9.398 535 HA VAL 69 HA VAL 69 -6.809 -3.071 -9.573 536 HB VAL 69 HB VAL 69 -5.635 -0.385 -8.936 537 HG11 VAL 69 HG11 VAL 69 -7.424 0.405 -10.150 538 HG12 VAL 69 HG12 VAL 69 -8.427 -1.001 -9.790 539 HG13 VAL 69 HG13 VAL 69 -8.148 0.224 -8.552 540 HG21 VAL 69 HG21 VAL 69 -7.711 -1.617 -7.258 541 HG22 VAL 69 HG22 VAL 69 -6.204 -2.525 -7.377 542 HG23 VAL 69 HG23 VAL 69 -6.186 -0.858 -6.804 543 H LEU 70 H LEU 70 -4.841 -0.725 -11.379 544 HA LEU 70 HA LEU 70 -6.842 -0.203 -13.334 545 HB2 LEU 70 HB2 LEU 70 -5.195 1.059 -14.485 546 HB3 LEU 70 HB1 LEU 70 -4.948 1.316 -12.749 547 HG LEU 70 HG LEU 70 -3.205 -0.697 -13.171 548 HD11 LEU 70 HD11 LEU 70 -2.671 -1.008 -15.298 549 HD12 LEU 70 HD12 LEU 70 -2.302 0.706 -15.480 550 HD13 LEU 70 HD13 LEU 70 -3.940 0.121 -15.772 551 HD21 LEU 70 HD21 LEU 70 -1.474 1.096 -13.353 552 HD22 LEU 70 HD22 LEU 70 -2.628 1.324 -12.039 553 HD23 LEU 70 HD23 LEU 70 -2.782 2.265 -13.524 554 H MET 71 H MET 71 -4.085 -2.395 -13.155 555 HA MET 71 HA MET 71 -4.185 -3.282 -15.837 556 HB2 MET 71 HB2 MET 71 -2.561 -4.816 -15.258 557 HB3 MET 71 HB1 MET 71 -2.346 -3.587 -14.002 558 HG2 MET 71 HG1 MET 71 -3.610 -4.916 -12.416 559 HG3 MET 71 HG2 MET 71 -3.942 -6.115 -13.669 560 HE1 MET 71 HE1 MET 71 0.387 -5.255 -12.333 561 HE2 MET 71 HE2 MET 71 -0.535 -4.264 -13.464 562 HE3 MET 71 HE3 MET 71 -0.979 -4.298 -11.757 563 H LYS 72 H LYS 72 -6.049 -4.051 -13.031 564 HA LYS 72 HA LYS 72 -6.988 -6.602 -13.775 565 HB2 LYS 72 HB2 LYS 72 -7.298 -5.933 -11.523 566 HB3 LYS 72 HB1 LYS 72 -8.125 -4.443 -12.006 567 HG2 LYS 72 HG1 LYS 72 -9.739 -5.993 -11.130 568 HG3 LYS 72 HG2 LYS 72 -9.998 -5.796 -12.872 569 HD2 LYS 72 HD1 LYS 72 -8.227 -7.904 -12.768 570 HD3 LYS 72 HD2 LYS 72 -9.252 -8.175 -11.348 571 HE2 LYS 72 HE1 LYS 72 -11.221 -7.706 -12.995 572 HE3 LYS 72 HE2 LYS 72 -10.017 -8.071 -14.240 573 HZ1 LYS 72 3HZ LYS 72 -11.428 -9.856 -12.533 574 HZ2 LYS 72 1HZ LYS 72 -9.757 -10.082 -12.391 575 HZ3 LYS 72 2HZ LYS 72 -10.499 -10.195 -13.906 576 H LEU 73 H LEU 73 -8.055 -3.351 -14.577 577 HA LEU 73 HA LEU 73 -10.488 -4.164 -15.832 578 HB2 LEU 73 HB2 LEU 73 -9.069 -1.616 -16.515 579 HB3 LEU 73 HB1 LEU 73 -10.805 -1.936 -16.367 580 HG LEU 73 HG LEU 73 -8.860 -1.710 -14.072 581 HD11 LEU 73 HD11 LEU 73 -9.376 0.410 -15.292 582 HD12 LEU 73 HD12 LEU 73 -9.871 0.394 -13.600 583 HD13 LEU 73 HD13 LEU 73 -11.071 0.169 -14.872 584 HD21 LEU 73 HD21 LEU 73 -10.691 -3.267 -13.613 585 HD22 LEU 73 HD22 LEU 73 -11.859 -2.031 -14.080 586 HD23 LEU 73 HD23 LEU 73 -10.843 -1.791 -12.658 587 H LEU 74 H LEU 74 -7.236 -3.374 -16.981 588 HA LEU 74 HA LEU 74 -7.894 -3.692 -19.746 589 HB2 LEU 74 HB2 LEU 74 -5.213 -3.682 -18.347 590 HB3 LEU 74 HB1 LEU 74 -5.460 -3.599 -20.099 591 HG LEU 74 HG LEU 74 -6.848 -1.499 -18.595 592 HD11 LEU 74 HD11 LEU 74 -3.950 -0.998 -18.850 593 HD12 LEU 74 HD12 LEU 74 -4.455 -2.043 -17.522 594 HD13 LEU 74 HD13 LEU 74 -5.107 -0.410 -17.655 595 HD21 LEU 74 HD21 LEU 74 -4.907 -1.386 -20.898 596 HD22 LEU 74 HD22 LEU 74 -6.036 -0.128 -20.390 597 HD23 LEU 74 HD23 LEU 74 -6.644 -1.640 -21.068 598 H GLU 75 H GLU 75 -6.990 -5.817 -17.186 599 HA GLU 75 HA GLU 75 -5.904 -7.926 -18.732 600 HB2 GLU 75 HB2 GLU 75 -5.372 -8.179 -16.515 601 HB3 GLU 75 HB1 GLU 75 -6.964 -7.637 -15.964 602 HG2 GLU 75 HG1 GLU 75 -6.608 -9.996 -15.469 603 HG3 GLU 75 HG2 GLU 75 -7.942 -9.761 -16.608 604 HE2 GLU 75 HE2 GLU 75 -6.391 -12.162 -18.515 605 H GLU 76 H GLU 76 -9.160 -7.401 -17.393 606 HA GLU 76 HA GLU 76 -10.229 -9.707 -18.738 607 HB2 GLU 76 HB2 GLU 76 -11.448 -7.476 -17.118 608 HB3 GLU 76 HB1 GLU 76 -12.443 -8.692 -17.933 609 HG2 GLU 76 HG1 GLU 76 -11.289 -10.467 -16.677 610 HG3 GLU 76 HG2 GLU 76 -10.358 -9.224 -15.829 611 HE2 GLU 76 HE2 GLU 76 -13.487 -10.170 -14.040 612 H ALA 77 H ALA 77 -10.250 -6.219 -19.233 613 HA ALA 77 HA ALA 77 -12.070 -6.285 -21.437 614 HB1 ALA 77 HB1 ALA 77 -11.545 -4.312 -19.894 615 HB2 ALA 77 HB2 ALA 77 -11.734 -3.981 -21.616 616 HB3 ALA 77 HB3 ALA 77 -10.122 -4.068 -20.905 617 H GLY 78 H GLY 78 -8.764 -7.008 -21.078 618 HA2 GLY 78 HA2 GLY 78 -7.454 -8.010 -22.761 619 HA3 GLY 78 3HA GLY 78 -8.511 -7.304 -23.974 620 H GLY 79 H GLY 79 -8.095 -4.752 -22.142 621 HA2 GLY 79 HA2 GLY 79 -6.113 -3.342 -21.839 622 HA3 GLY 79 3HA GLY 79 -5.501 -4.011 -23.344 623 H ASN 80 H ASN 80 -8.698 -2.708 -22.495 624 HA ASN 80 HA ASN 80 -8.400 -0.817 -24.734 625 HB2 ASN 80 HB2 ASN 80 -10.358 -2.733 -24.331 626 HB3 ASN 80 HB1 ASN 80 -11.126 -1.243 -23.768 627 HD21 ASN 80 HD21 ASN 80 -10.669 0.683 -25.293 628 HD22 ASN 80 HD22 ASN 80 -10.929 0.364 -26.971 629 H TRP 81 H TRP 81 -7.696 1.034 -23.825 630 HA TRP 81 HA TRP 81 -8.537 1.942 -21.254 631 HB2 TRP 81 HB2 TRP 81 -7.087 3.366 -23.503 632 HB3 TRP 81 HB1 TRP 81 -7.337 4.043 -21.892 633 HD1 TRP 81 HD1 TRP 81 -5.177 1.541 -23.755 634 HE1 TRP 81 HE1 TRP 81 -3.300 0.724 -22.194 635 HE3 TRP 81 HE3 TRP 81 -6.818 3.591 -19.367 636 HZ2 TRP 81 2HZ TRP 81 -2.608 0.921 -19.464 637 HZ3 TRP 81 3HZ TRP 81 -5.491 3.229 -17.328 638 HH2 TRP 81 HH TRP 81 -3.430 1.920 -17.377 639 H SER 82 H SER 82 -9.692 2.364 -24.495 640 HA SER 82 HA SER 82 -11.097 4.742 -24.321 641 HB2 SER 82 HB2 SER 82 -10.856 3.499 -26.417 642 HB3 SER 82 HB1 SER 82 -11.895 2.212 -25.782 643 HG SER 82 HG SER 82 -12.688 4.911 -26.171 644 H TYR 83 H TYR 83 -12.333 1.468 -23.636 645 HA TYR 83 HA TYR 83 -14.788 2.474 -22.550 646 HB2 TYR 83 HB2 TYR 83 -15.062 0.375 -23.498 647 HB3 TYR 83 HB1 TYR 83 -13.539 -0.231 -22.843 648 HD1 TYR 83 HD2 TYR 83 -13.382 -1.067 -20.564 649 HD2 TYR 83 HD1 TYR 83 -17.077 0.357 -22.119 650 HE1 TYR 83 HE2 TYR 83 -14.572 -2.128 -18.690 651 HE2 TYR 83 HE1 TYR 83 -18.278 -0.699 -20.250 652 HH TYR 83 HH TYR 83 -17.462 -2.943 -18.574 653 H ILE 84 H ILE 84 -11.763 1.225 -21.236 654 HA ILE 84 HA ILE 84 -12.544 1.088 -18.538 655 HB ILE 84 HB ILE 84 -9.824 1.516 -19.772 656 HG12 ILE 84 HG11 ILE 84 -10.948 -0.933 -18.406 657 HG13 ILE 84 HG12 ILE 84 -11.104 -0.655 -20.148 658 HG21 ILE 84 HG21 ILE 84 -8.936 0.854 -17.543 659 HG22 ILE 84 HG22 ILE 84 -9.736 2.425 -17.556 660 HG23 ILE 84 HG23 ILE 84 -10.567 1.017 -16.895 661 HD11 ILE 84 HD11 ILE 84 -8.415 -0.281 -19.692 662 HD12 ILE 84 HD12 ILE 84 -8.837 -1.626 -18.632 663 HD13 ILE 84 HD13 ILE 84 -9.174 -1.726 -20.360 664 H LYS 85 H LYS 85 -11.684 3.758 -20.562 665 HA LYS 85 HA LYS 85 -11.500 5.544 -18.239 666 HB2 LYS 85 HB2 LYS 85 -10.193 6.955 -19.463 667 HB3 LYS 85 HB1 LYS 85 -9.819 5.438 -20.299 668 HG2 LYS 85 HG1 LYS 85 -11.897 6.155 -21.780 669 HG3 LYS 85 HG2 LYS 85 -11.413 7.764 -21.215 670 HD2 LYS 85 HD1 LYS 85 -9.752 5.767 -22.758 671 HD3 LYS 85 HD2 LYS 85 -10.278 7.380 -23.271 672 HE2 LYS 85 HE1 LYS 85 -8.271 6.701 -21.113 673 HE3 LYS 85 HE2 LYS 85 -7.971 7.516 -22.656 674 HZ1 LYS 85 3HZ LYS 85 -9.876 9.057 -21.468 675 HZ2 LYS 85 1HZ LYS 85 -8.218 9.394 -21.517 676 HZ3 LYS 85 2HZ LYS 85 -8.883 8.610 -20.173 677 H LEU 86 H LEU 86 -13.820 4.357 -20.162 678 HA LEU 86 HA LEU 86 -15.255 6.450 -21.229 679 HB2 LEU 86 HB2 LEU 86 -15.885 4.133 -21.554 680 HB3 LEU 86 HB1 LEU 86 -16.288 3.986 -19.835 681 HG LEU 86 HG LEU 86 -17.974 5.956 -20.479 682 HD11 LEU 86 HD11 LEU 86 -18.916 4.954 -22.771 683 HD12 LEU 86 HD12 LEU 86 -17.192 4.681 -23.029 684 HD13 LEU 86 HD13 LEU 86 -17.789 6.309 -22.706 685 HD21 LEU 86 HD21 LEU 86 -18.732 3.154 -21.213 686 HD22 LEU 86 HD22 LEU 86 -19.668 4.378 -20.354 687 HD23 LEU 86 HD23 LEU 86 -18.325 3.569 -19.548 688 H ASP 87 H ASP 87 -14.879 5.538 -17.886 689 HA ASP 87 HA ASP 87 -16.606 7.800 -17.120 690 HB2 ASP 87 HB2 ASP 87 -16.083 5.306 -15.481 691 HB3 ASP 87 HB1 ASP 87 -17.200 6.622 -15.090 692 HD2 ASP 87 HD2 ASP 87 -19.603 5.447 -17.314 693 H ASN 88 H ASN 88 -13.706 7.705 -17.704 694 HA ASN 88 HA ASN 88 -11.807 8.671 -16.905 695 HB2 ASN 88 HB2 ASN 88 -13.740 10.176 -15.838 696 HB3 ASN 88 HB1 ASN 88 -13.089 9.492 -14.343 697 HD21 ASN 88 HD21 ASN 88 -10.484 9.390 -14.626 698 HD22 ASN 88 HD22 ASN 88 -9.804 10.946 -14.945 699 H TYR 89 H TYR 89 -12.175 5.955 -16.460 700 HA TYR 89 HA TYR 89 -11.272 4.208 -15.317 701 HB2 TYR 89 HB2 TYR 89 -9.727 6.340 -13.817 702 HB3 TYR 89 HB1 TYR 89 -9.325 4.623 -13.910 703 HD1 TYR 89 HD2 TYR 89 -9.954 4.268 -16.883 704 HD2 TYR 89 HD1 TYR 89 -7.702 7.190 -14.765 705 HE1 TYR 89 HE2 TYR 89 -8.593 4.666 -18.892 706 HE2 TYR 89 HE1 TYR 89 -6.335 7.597 -16.768 707 HH TYR 89 HH TYR 89 -5.695 6.216 -18.873 708 H THR 90 H THR 90 -13.730 5.270 -14.417 709 HA THR 90 HA THR 90 -13.994 5.769 -11.717 710 HB THR 90 HB THR 90 -15.817 4.324 -13.630 711 HG1 THR 90 HG1 THR 90 -16.092 6.837 -12.316 712 HG21 THR 90 HG21 THR 90 -16.469 3.373 -11.580 713 HG22 THR 90 HG22 THR 90 -17.572 4.729 -11.810 714 HG23 THR 90 HG23 THR 90 -16.209 4.877 -10.701 715 H ALA 91 H ALA 91 -13.475 2.709 -13.354 716 HA ALA 91 HA ALA 91 -14.138 0.892 -11.392 717 HB1 ALA 91 HB1 ALA 91 -11.718 0.007 -12.586 718 HB2 ALA 91 HB2 ALA 91 -12.656 0.864 -13.809 719 HB3 ALA 91 HB3 ALA 91 -13.370 -0.496 -12.941 720 H LEU 92 H LEU 92 -11.270 2.909 -11.647 721 HA LEU 92 HA LEU 92 -9.765 1.654 -9.611 722 HB2 LEU 92 HB2 LEU 92 -8.259 3.392 -9.820 723 HB3 LEU 92 HB1 LEU 92 -9.042 3.359 -11.409 724 HG LEU 92 HG LEU 92 -10.595 5.186 -10.250 725 HD11 LEU 92 HD11 LEU 92 -8.801 6.659 -9.001 726 HD12 LEU 92 HD12 LEU 92 -8.115 5.081 -8.616 727 HD13 LEU 92 HD13 LEU 92 -9.769 5.462 -8.141 728 HD21 LEU 92 HD21 LEU 92 -8.173 6.522 -11.017 729 HD22 LEU 92 HD22 LEU 92 -9.710 6.413 -11.875 730 HD23 LEU 92 HD23 LEU 92 -8.485 5.162 -12.096 731 H VAL 93 H VAL 93 -12.227 4.149 -9.579 732 HA VAL 93 HA VAL 93 -11.834 5.049 -6.933 733 HB VAL 93 HB VAL 93 -14.233 5.114 -8.752 734 HG11 VAL 93 HG11 VAL 93 -15.317 5.114 -6.709 735 HG12 VAL 93 HG12 VAL 93 -13.994 5.947 -5.890 736 HG13 VAL 93 HG13 VAL 93 -15.051 6.835 -6.988 737 HG21 VAL 93 HG21 VAL 93 -13.268 7.660 -7.899 738 HG22 VAL 93 HG22 VAL 93 -11.909 6.700 -8.482 739 HG23 VAL 93 HG23 VAL 93 -13.303 6.978 -9.524 740 H ASP 94 H ASP 94 -14.085 2.652 -8.291 741 HA ASP 94 HA ASP 94 -15.123 1.912 -5.728 742 HB2 ASP 94 HB2 ASP 94 -16.315 1.718 -7.979 743 HB3 ASP 94 HB1 ASP 94 -15.320 0.284 -8.260 744 HD2 ASP 94 HD2 ASP 94 -17.826 -0.068 -5.201 745 H ALA 95 H ALA 95 -12.524 0.821 -7.776 746 HA ALA 95 HA ALA 95 -12.119 -1.687 -6.473 747 HB1 ALA 95 HB1 ALA 95 -10.036 -1.783 -7.727 748 HB2 ALA 95 HB2 ALA 95 -10.209 -0.084 -8.171 749 HB3 ALA 95 HB3 ALA 95 -11.367 -1.274 -8.767 750 H ILE 96 H ILE 96 -10.241 1.349 -6.426 751 HA ILE 96 HA ILE 96 -8.476 0.605 -4.391 752 HB ILE 96 HB ILE 96 -9.448 3.359 -5.157 753 HG12 ILE 96 HG11 ILE 96 -8.310 2.100 -6.945 754 HG13 ILE 96 HG12 ILE 96 -7.365 3.501 -6.414 755 HG21 ILE 96 HG21 ILE 96 -7.403 4.167 -4.021 756 HG22 ILE 96 HG22 ILE 96 -8.568 3.439 -2.917 757 HG23 ILE 96 HG23 ILE 96 -7.136 2.536 -3.407 758 HD11 ILE 96 HD11 ILE 96 -5.919 1.596 -6.759 759 HD12 ILE 96 HD12 ILE 96 -5.959 2.031 -5.051 760 HD13 ILE 96 HD13 ILE 96 -6.874 0.638 -5.627 761 H TYR 97 H TYR 97 -11.690 2.019 -4.254 762 HA TYR 97 HA TYR 97 -11.720 2.775 -1.559 763 HB2 TYR 97 HB2 TYR 97 -13.748 2.200 -3.645 764 HB3 TYR 97 HB1 TYR 97 -14.308 2.095 -1.974 765 HD1 TYR 97 HD1 TYR 97 -11.767 4.430 -3.353 766 HD2 TYR 97 HD2 TYR 97 -15.683 3.981 -1.754 767 HE1 TYR 97 HE1 TYR 97 -12.001 6.876 -3.256 768 HE2 TYR 97 HE2 TYR 97 -15.929 6.426 -1.654 769 HH TYR 97 HH TYR 97 -14.907 8.430 -2.866 770 H SER 98 H SER 98 -12.250 -0.328 -3.107 771 HA SER 98 HA SER 98 -13.210 -1.627 -0.738 772 HB2 SER 98 HB2 SER 98 -13.960 -2.628 -2.726 773 HB3 SER 98 HB1 SER 98 -12.347 -2.582 -3.458 774 HG SER 98 HG SER 98 -11.879 -4.416 -2.540 775 H VAL 99 H VAL 99 -10.176 -1.863 -2.597 776 HA VAL 99 HA VAL 99 -8.814 -3.532 -0.817 777 HB VAL 99 HB VAL 99 -7.534 -1.413 -2.545 778 HG11 VAL 99 HG11 VAL 99 -6.419 -4.116 -1.889 779 HG12 VAL 99 HG12 VAL 99 -5.575 -2.664 -2.431 780 HG13 VAL 99 HG13 VAL 99 -6.209 -2.755 -0.787 781 HG21 VAL 99 HG21 VAL 99 -8.761 -2.486 -4.147 782 HG22 VAL 99 HG22 VAL 99 -7.355 -3.550 -4.094 783 HG23 VAL 99 HG23 VAL 99 -8.832 -3.997 -3.241 784 H GLU 100 H GLU 100 -8.636 0.017 -1.127 785 HA GLU 100 HA GLU 100 -6.877 0.553 0.924 786 HB2 GLU 100 HB2 GLU 100 -7.626 2.770 0.880 787 HB3 GLU 100 HB1 GLU 100 -7.970 2.165 -0.748 788 HG2 GLU 100 HG1 GLU 100 -10.315 1.750 -0.062 789 HG3 GLU 100 HG2 GLU 100 -9.943 2.489 1.501 790 HE2 GLU 100 HE2 GLU 100 -9.351 5.278 -1.141 791 H ASP 101 H ASP 101 -10.254 -0.316 1.103 792 HA ASP 101 HA ASP 101 -10.832 0.480 3.715 793 HB2 ASP 101 HB2 ASP 101 -12.408 -0.458 1.914 794 HB3 ASP 101 HB1 ASP 101 -11.903 -2.054 2.487 795 HD2 ASP 101 HD2 ASP 101 -14.757 -1.399 4.464 796 H GLU 102 H GLU 102 -9.599 -2.645 2.535 797 HA GLU 102 HA GLU 102 -8.522 -3.129 5.230 798 HB2 GLU 102 HB2 GLU 102 -8.974 -5.601 4.767 799 HB3 GLU 102 HB1 GLU 102 -10.369 -4.587 5.164 800 HG2 GLU 102 HG1 GLU 102 -11.145 -4.564 2.952 801 HG3 GLU 102 HG2 GLU 102 -9.596 -5.146 2.324 802 HE2 GLU 102 HE2 GLU 102 -10.958 -8.287 2.336 803 H ASN 103 H ASN 103 -6.409 -3.501 5.236 804 HA ASN 103 HA ASN 103 -5.143 -4.418 2.737 805 HB2 ASN 103 HB2 ASN 103 -4.271 -2.369 4.762 806 HB3 ASN 103 HB1 ASN 103 -3.080 -3.198 3.752 807 HD21 ASN 103 HD21 ASN 103 -6.273 -1.717 3.279 808 HD22 ASN 103 HD22 ASN 103 -5.828 -0.804 1.881 809 H LYS 104 H LYS 104 -5.058 -4.521 6.266 810 HA LYS 104 HA LYS 104 -3.396 -6.948 6.094 811 HB2 LYS 104 HB2 LYS 104 -2.530 -6.469 8.275 812 HB3 LYS 104 HB1 LYS 104 -2.371 -5.005 7.291 813 HG2 LYS 104 HG1 LYS 104 -3.230 -4.002 9.109 814 HG3 LYS 104 HG2 LYS 104 -4.768 -4.544 8.416 815 HD2 LYS 104 HD1 LYS 104 -5.155 -5.952 10.109 816 HD3 LYS 104 HD2 LYS 104 -3.514 -6.613 10.017 817 HE2 LYS 104 HE1 LYS 104 -4.053 -5.525 12.204 818 HE3 LYS 104 HE2 LYS 104 -2.644 -4.849 11.375 819 HZ1 LYS 104 3HZ LYS 104 -5.023 -3.492 10.612 820 HZ2 LYS 104 1HZ LYS 104 -3.605 -2.868 11.290 821 HZ3 LYS 104 2HZ LYS 104 -4.830 -3.463 12.293 822 H GLN 105 H GLN 105 -6.392 -5.608 7.099 823 HA GLN 105 HA GLN 105 -7.213 -7.275 9.136 824 HB2 GLN 105 HB2 GLN 105 -8.923 -6.304 6.834 825 HB3 GLN 105 HB1 GLN 105 -9.497 -6.815 8.431 826 HG2 GLN 105 HG1 GLN 105 -7.726 -4.431 7.885 827 HG3 GLN 105 HG2 GLN 105 -9.468 -4.382 8.193 828 HE21 GLN 105 HE21 GLN 105 -6.432 -4.226 9.570 829 HE22 GLN 105 HE22 GLN 105 -6.884 -4.400 11.229 830 H SER 106 H SER 106 -6.892 -9.413 9.144 831 HA SER 106 HA SER 106 -8.434 -11.124 7.522 832 HB2 SER 106 HB2 SER 106 -6.505 -12.290 6.363 833 HB3 SER 106 HB1 SER 106 -6.905 -10.681 5.736 834 HG SER 106 HG SER 106 -4.945 -10.116 6.187 835 H GLU 107 H GLU 107 -7.275 -13.496 7.677 836 HA GLU 107 HA GLU 107 -6.623 -13.795 10.534 837 HB2 GLU 107 HB2 GLU 107 -8.791 -14.776 9.811 838 HB3 GLU 107 HB1 GLU 107 -7.901 -15.829 8.700 839 HG2 GLU 107 HG1 GLU 107 -6.616 -16.602 10.801 840 HG3 GLU 107 HG2 GLU 107 -7.965 -15.879 11.688 841 HE2 GLU 107 HE2 GLU 107 -8.617 -19.417 10.778 842 H GLY 108 H GLY 108 -5.748 -14.674 7.264 843 HA2 GLY 108 HA2 GLY 108 -3.430 -16.168 8.318 844 HA3 GLY 108 3HA GLY 108 -4.142 -16.426 6.732 845 H SER 109 H SER 109 -2.002 -16.160 5.868 846 HA SER 109 HA SER 109 -0.845 -13.488 6.040 847 HB2 SER 109 HB2 SER 109 0.469 -15.733 6.144 848 HB3 SER 109 HB1 SER 109 0.276 -15.732 4.382 849 HG SER 109 HG SER 109 1.673 -13.906 6.009
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