NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
592908 | 2mwq | 25350 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLU 1 H1 GLU 1 19.728 14.055 19.539 2 H2 GLU 1 H2 GLU 1 20.314 13.394 18.145 3 H3 GLU 1 H3 GLU 1 19.331 14.713 18.079 4 HA GLU 1 HA GLU 1 18.540 12.011 18.975 5 HB2 GLU 1 HB2 GLU 1 16.969 14.595 18.704 6 HB3 GLU 1 HB3 GLU 1 16.251 13.010 19.003 7 HG2 GLU 1 HG2 GLU 1 17.403 12.861 21.143 8 HG3 GLU 1 HG3 GLU 1 18.177 14.433 20.850 9 H ALA 2 H ALA 2 16.895 11.050 17.520 10 HA ALA 2 HA ALA 2 17.439 11.684 14.696 11 HB1 ALA 2 HB1 ALA 2 16.022 9.692 14.275 12 HB2 ALA 2 HB2 ALA 2 17.313 9.321 15.441 13 HB3 ALA 2 HB3 ALA 2 15.641 9.583 16.007 14 H ARG 3 H ARG 3 16.481 13.941 15.266 15 HA ARG 3 HA ARG 3 13.527 13.901 14.718 16 HB2 ARG 3 HB2 ARG 3 15.094 15.690 16.629 17 HB3 ARG 3 HB3 ARG 3 13.429 16.004 16.130 18 HG2 ARG 3 HG2 ARG 3 12.635 14.010 17.236 19 HG3 ARG 3 HG3 ARG 3 14.292 13.462 17.547 20 HD2 ARG 3 HD2 ARG 3 13.464 14.382 19.591 21 HD3 ARG 3 HD3 ARG 3 14.663 15.506 18.934 22 HE ARG 3 HE ARG 3 12.017 16.239 18.096 23 HH11 ARG 3 HH11 ARG 3 14.180 16.394 20.905 24 HH12 ARG 3 HH12 ARG 3 13.323 17.763 21.576 25 HH21 ARG 3 HH21 ARG 3 11.002 17.991 19.022 26 HH22 ARG 3 HH22 ARG 3 11.582 18.658 20.522 27 HA PRO 4 HA PRO 4 14.957 16.648 11.549 28 HB2 PRO 4 HB2 PRO 4 12.702 17.984 10.815 29 HB3 PRO 4 HB3 PRO 4 12.881 16.222 10.537 30 HG2 PRO 4 HG2 PRO 4 11.465 17.642 12.789 31 HG3 PRO 4 HG3 PRO 4 10.874 16.312 11.750 32 HD2 PRO 4 HD2 PRO 4 11.940 15.898 14.235 33 HD3 PRO 4 HD3 PRO 4 12.113 14.709 12.900 34 H ILE 5 H ILE 5 16.355 17.835 13.053 35 HA ILE 5 HA ILE 5 15.383 20.596 13.563 36 HB ILE 5 HB ILE 5 15.036 19.119 15.631 37 HG12 ILE 5 HG12 ILE 5 17.023 21.368 16.075 38 HG13 ILE 5 HG13 ILE 5 15.343 21.639 15.597 39 HG21 ILE 5 HG21 ILE 5 16.968 18.421 16.958 40 HG22 ILE 5 HG22 ILE 5 17.117 17.729 15.331 41 HG23 ILE 5 HG23 ILE 5 18.093 19.145 15.787 42 HD11 ILE 5 HD11 ILE 5 14.585 20.461 17.671 43 HD12 ILE 5 HD12 ILE 5 16.288 20.303 18.170 44 HD13 ILE 5 HD13 ILE 5 15.556 21.912 18.005 45 H VAL 6 H VAL 6 17.263 22.068 13.939 46 HA VAL 6 HA VAL 6 19.785 20.987 12.781 47 HB VAL 6 HB VAL 6 18.367 22.202 11.043 48 HG11 VAL 6 HG11 VAL 6 18.205 24.667 11.140 49 HG12 VAL 6 HG12 VAL 6 17.343 23.909 12.492 50 HG13 VAL 6 HG13 VAL 6 18.927 24.662 12.763 51 HG21 VAL 6 HG21 VAL 6 20.835 22.009 10.841 52 HG22 VAL 6 HG22 VAL 6 20.187 23.481 10.088 53 HG23 VAL 6 HG23 VAL 6 21.006 23.581 11.655 54 H VAL 7 H VAL 7 21.671 22.122 13.541 55 HA VAL 7 HA VAL 7 21.285 23.188 16.254 56 HB VAL 7 HB VAL 7 23.047 21.443 15.559 57 HG11 VAL 7 HG11 VAL 7 24.546 23.891 14.523 58 HG12 VAL 7 HG12 VAL 7 25.163 22.229 14.630 59 HG13 VAL 7 HG13 VAL 7 23.848 22.609 13.503 60 HG21 VAL 7 HG21 VAL 7 23.081 22.612 17.739 61 HG22 VAL 7 HG22 VAL 7 24.715 22.251 17.145 62 HG23 VAL 7 HG23 VAL 7 24.072 23.905 17.027 63 H GLY 8 H GLY 8 21.440 24.428 13.133 64 HA2 GLY 8 HA2 GLY 8 22.712 26.983 13.886 65 HA3 GLY 8 HA3 GLY 8 22.149 26.503 12.271 66 HA PRO 9 HA PRO 9 18.938 29.143 14.315 67 HB2 PRO 9 HB2 PRO 9 18.469 30.913 12.272 68 HB3 PRO 9 HB3 PRO 9 19.775 31.158 13.477 69 HG2 PRO 9 HG2 PRO 9 19.950 29.940 10.725 70 HG3 PRO 9 HG3 PRO 9 20.948 31.245 11.444 71 HD2 PRO 9 HD2 PRO 9 21.804 28.688 11.410 72 HD3 PRO 9 HD3 PRO 9 22.108 29.744 12.836 73 HA PRO 10 HA PRO 10 15.967 26.744 12.097 74 HB2 PRO 10 HB2 PRO 10 13.598 27.820 12.902 75 HB3 PRO 10 HB3 PRO 10 14.654 26.917 14.036 76 HG2 PRO 10 HG2 PRO 10 14.445 29.885 13.596 77 HG3 PRO 10 HG3 PRO 10 14.350 28.966 15.132 78 HD2 PRO 10 HD2 PRO 10 16.647 30.133 14.318 79 HD3 PRO 10 HD3 PRO 10 16.654 28.541 15.153 80 HA PRO 11 HA PRO 11 14.928 29.133 8.516 81 HB2 PRO 11 HB2 PRO 11 12.727 27.897 7.461 82 HB3 PRO 11 HB3 PRO 11 14.353 27.139 7.421 83 HG2 PRO 11 HG2 PRO 11 12.118 26.719 9.391 84 HG3 PRO 11 HG3 PRO 11 13.051 25.495 8.470 85 HD2 PRO 11 HD2 PRO 11 13.688 26.115 11.018 86 HD3 PRO 11 HD3 PRO 11 14.970 25.791 9.799 87 HA PRO 12 HA PRO 12 11.805 31.864 10.037 88 HB2 PRO 12 HB2 PRO 12 11.184 33.415 7.899 89 HB3 PRO 12 HB3 PRO 12 12.819 33.460 8.636 90 HG2 PRO 12 HG2 PRO 12 11.867 31.902 6.241 91 HG3 PRO 12 HG3 PRO 12 13.281 32.996 6.379 92 HD2 PRO 12 HD2 PRO 12 13.512 30.303 6.640 93 HD3 PRO 12 HD3 PRO 12 14.515 31.434 7.614 94 H LEU 13 H LEU 13 9.583 32.543 9.791 95 HA LEU 13 HA LEU 13 7.363 32.334 9.427 96 HB2 LEU 13 HB2 LEU 13 7.946 30.467 7.117 97 HB3 LEU 13 HB3 LEU 13 6.420 31.249 7.480 98 HG LEU 13 HG LEU 13 8.950 32.729 6.676 99 HD11 LEU 13 HD11 LEU 13 8.122 31.269 4.878 100 HD12 LEU 13 HD12 LEU 13 7.853 32.981 4.487 101 HD13 LEU 13 HD13 LEU 13 6.495 31.973 5.042 102 HD21 LEU 13 HD21 LEU 13 7.415 34.141 7.975 103 HD22 LEU 13 HD22 LEU 13 6.054 33.653 6.937 104 HD23 LEU 13 HD23 LEU 13 7.390 34.620 6.268 105 H SER 14 H SER 14 5.584 30.966 9.851 106 HA SER 14 HA SER 14 6.380 28.817 11.639 107 HB2 SER 14 HB2 SER 14 3.579 29.732 10.921 108 HB3 SER 14 HB3 SER 14 4.128 28.945 12.420 109 HG SER 14 HG SER 14 4.277 30.965 13.084 110 H GLY 15 H GLY 15 5.972 26.662 11.413 111 HA2 GLY 15 HA2 GLY 15 5.025 24.729 10.440 112 HA3 GLY 15 HA3 GLY 15 4.404 25.704 9.096 113 H GLY 16 H GLY 16 5.815 23.218 8.806 114 HA2 GLY 16 HA2 GLY 16 7.385 22.499 7.221 115 HA3 GLY 16 HA3 GLY 16 7.986 24.157 7.064 116 H LEU 17 H LEU 17 7.898 23.778 10.264 117 HA LEU 17 HA LEU 17 10.410 22.242 10.586 118 HB2 LEU 17 HB2 LEU 17 11.548 23.951 11.683 119 HB3 LEU 17 HB3 LEU 17 10.847 24.782 10.309 120 HG LEU 17 HG LEU 17 9.730 24.884 13.135 121 HD11 LEU 17 HD11 LEU 17 10.771 27.062 13.318 122 HD12 LEU 17 HD12 LEU 17 11.432 26.925 11.676 123 HD13 LEU 17 HD13 LEU 17 12.002 25.835 12.968 124 HD21 LEU 17 HD21 LEU 17 8.576 26.945 12.328 125 HD22 LEU 17 HD22 LEU 17 8.003 25.465 11.546 126 HD23 LEU 17 HD23 LEU 17 9.103 26.562 10.676 127 HA PRO 18 HA PRO 18 7.881 21.035 13.960 128 HB2 PRO 18 HB2 PRO 18 9.562 20.319 15.978 129 HB3 PRO 18 HB3 PRO 18 9.458 19.369 14.459 130 HG2 PRO 18 HG2 PRO 18 11.442 21.495 15.231 131 HG3 PRO 18 HG3 PRO 18 11.743 19.847 14.596 132 HD2 PRO 18 HD2 PRO 18 11.747 22.037 12.986 133 HD3 PRO 18 HD3 PRO 18 11.122 20.450 12.416 134 H GLY 19 H GLY 19 6.835 21.923 15.790 135 HA2 GLY 19 HA2 GLY 19 8.035 23.742 17.606 136 HA3 GLY 19 HA3 GLY 19 7.228 24.665 16.315 137 H THR 20 H THR 20 6.060 25.174 18.555 138 HA THR 20 HA THR 20 3.702 23.333 18.774 139 HB THR 20 HB THR 20 3.527 24.134 21.138 140 HG1 THR 20 HG1 THR 20 4.620 26.067 21.023 141 HG21 THR 20 HG21 THR 20 4.794 22.033 20.583 142 HG22 THR 20 HG22 THR 20 5.360 22.847 22.059 143 HG23 THR 20 HG23 THR 20 6.292 22.997 20.555 144 H GLU 21 H GLU 21 4.163 25.544 16.936 145 HA GLU 21 HA GLU 21 2.915 27.975 17.766 146 HB2 GLU 21 HB2 GLU 21 4.281 27.504 15.649 147 HB3 GLU 21 HB3 GLU 21 2.860 26.681 15.012 148 HG2 GLU 21 HG2 GLU 21 2.586 28.733 14.057 149 HG3 GLU 21 HG3 GLU 21 1.659 28.983 15.538 150 H ASN 22 H ASN 22 1.721 24.880 16.599 151 HA ASN 22 HA ASN 22 -1.084 25.744 17.142 152 HB2 ASN 22 HB2 ASN 22 0.020 24.051 14.860 153 HB3 ASN 22 HB3 ASN 22 -1.687 24.046 15.315 154 HD21 ASN 22 HD21 ASN 22 0.462 25.320 13.216 155 HD22 ASN 22 HD22 ASN 22 -0.375 26.801 12.816 156 H SER 23 H SER 23 -2.398 23.577 17.393 157 HA SER 23 HA SER 23 -1.265 22.111 19.574 158 HB2 SER 23 HB2 SER 23 -3.591 21.339 17.774 159 HB3 SER 23 HB3 SER 23 -3.285 20.766 19.429 160 HG SER 23 HG SER 23 -4.821 22.478 19.355 161 H ASP 24 H ASP 24 -1.135 21.719 16.111 162 HA ASP 24 HA ASP 24 0.046 19.006 16.443 163 HB2 ASP 24 HB2 ASP 24 -0.481 18.650 14.097 164 HB3 ASP 24 HB3 ASP 24 -1.947 19.094 14.985 165 H GLN 25 H GLN 25 2.063 18.614 15.748 166 HA GLN 25 HA GLN 25 3.831 20.885 15.369 167 HB2 GLN 25 HB2 GLN 25 4.382 18.801 16.648 168 HB3 GLN 25 HB3 GLN 25 4.389 17.898 15.129 169 HG2 GLN 25 HG2 GLN 25 6.292 19.165 14.324 170 HG3 GLN 25 HG3 GLN 25 6.204 20.251 15.717 171 HE21 GLN 25 HE21 GLN 25 6.795 16.873 14.765 172 HE22 GLN 25 HE22 GLN 25 7.830 16.515 16.130 173 H ALA 26 H ALA 26 2.156 18.650 13.304 174 HA ALA 26 HA ALA 26 2.152 18.203 11.076 175 HB1 ALA 26 HB1 ALA 26 2.966 21.128 10.851 176 HB2 ALA 26 HB2 ALA 26 2.143 20.154 9.610 177 HB3 ALA 26 HB3 ALA 26 1.310 20.542 11.132 178 H ARG 27 H ARG 27 4.803 17.743 12.415 179 HA ARG 27 HA ARG 27 6.341 17.419 9.945 180 HB2 ARG 27 HB2 ARG 27 6.761 19.730 11.331 181 HB3 ARG 27 HB3 ARG 27 7.885 18.674 12.186 182 HG2 ARG 27 HG2 ARG 27 9.046 19.857 10.421 183 HG3 ARG 27 HG3 ARG 27 8.972 18.134 9.996 184 HD2 ARG 27 HD2 ARG 27 7.185 18.506 8.437 185 HD3 ARG 27 HD3 ARG 27 6.933 20.160 9.019 186 HE ARG 27 HE ARG 27 9.493 20.292 8.146 187 HH11 ARG 27 HH11 ARG 27 6.567 19.086 6.569 188 HH12 ARG 27 HH12 ARG 27 7.133 19.536 4.981 189 HH21 ARG 27 HH21 ARG 27 10.133 20.850 6.118 190 HH22 ARG 27 HH22 ARG 27 9.131 20.508 4.729 191 H ASP 28 H ASP 28 7.604 15.675 9.963 192 HA ASP 28 HA ASP 28 8.371 14.403 12.530 193 HB2 ASP 28 HB2 ASP 28 7.601 12.180 11.318 194 HB3 ASP 28 HB3 ASP 28 6.454 13.143 12.258 195 H GLY 29 H GLY 29 8.374 13.991 8.947 196 HA2 GLY 29 HA2 GLY 29 10.402 14.218 7.662 197 HA3 GLY 29 HA3 GLY 29 11.352 13.750 9.083 198 H THR 30 H THR 30 9.665 11.523 9.856 199 HA THR 30 HA THR 30 9.473 9.708 7.589 200 HB THR 30 HB THR 30 11.935 9.597 8.012 201 HG1 THR 30 HG1 THR 30 11.275 7.676 7.357 202 HG21 THR 30 HG21 THR 30 11.159 8.688 10.813 203 HG22 THR 30 HG22 THR 30 11.998 10.197 10.394 204 HG23 THR 30 HG23 THR 30 12.789 8.633 10.114 205 H LEU 31 H LEU 31 8.341 7.783 8.194 206 HA LEU 31 HA LEU 31 7.186 7.850 10.952 207 HB2 LEU 31 HB2 LEU 31 5.746 7.301 8.337 208 HB3 LEU 31 HB3 LEU 31 5.033 7.148 9.940 209 HG LEU 31 HG LEU 31 6.062 9.758 8.769 210 HD11 LEU 31 HD11 LEU 31 3.696 10.311 8.412 211 HD12 LEU 31 HD12 LEU 31 3.220 8.692 8.978 212 HD13 LEU 31 HD13 LEU 31 4.162 8.874 7.478 213 HD21 LEU 31 HD21 LEU 31 4.706 10.784 10.584 214 HD22 LEU 31 HD22 LEU 31 6.033 9.795 11.215 215 HD23 LEU 31 HD23 LEU 31 4.370 9.162 11.232 216 HA PRO 32 HA PRO 32 8.691 3.628 9.841 217 HB2 PRO 32 HB2 PRO 32 10.210 3.054 12.027 218 HB3 PRO 32 HB3 PRO 32 10.837 4.027 10.659 219 HG2 PRO 32 HG2 PRO 32 9.706 4.971 13.289 220 HG3 PRO 32 HG3 PRO 32 11.221 5.464 12.473 221 HD2 PRO 32 HD2 PRO 32 8.919 6.913 12.298 222 HD3 PRO 32 HD3 PRO 32 10.095 6.810 10.943 223 H TYR 33 H TYR 33 7.182 2.066 10.186 224 HA TYR 33 HA TYR 33 5.243 2.369 12.222 225 HB2 TYR 33 HB2 TYR 33 5.255 1.129 9.886 226 HB3 TYR 33 HB3 TYR 33 5.645 -0.284 10.861 227 HD1 TYR 33 HD2 TYR 33 3.613 1.618 13.043 228 HD2 TYR 33 HD1 TYR 33 3.307 -0.663 9.374 229 HE1 TYR 33 HE2 TYR 33 1.182 1.322 13.409 230 HE2 TYR 33 HE1 TYR 33 0.871 -0.912 9.771 231 HH TYR 33 HH TYR 33 -0.785 0.491 12.587 232 H THR 34 H THR 34 7.953 0.018 12.012 233 HA THR 34 HA THR 34 7.493 -0.616 14.909 234 HB THR 34 HB THR 34 8.260 -2.920 14.425 235 HG1 THR 34 HG1 THR 34 8.626 -3.509 12.289 236 HG21 THR 34 HG21 THR 34 6.295 -3.748 13.327 237 HG22 THR 34 HG22 THR 34 6.043 -2.214 12.467 238 HG23 THR 34 HG23 THR 34 5.790 -2.299 14.225 239 H LYS 35 H LYS 35 9.606 0.584 12.611 240 HA LYS 35 HA LYS 35 11.850 0.817 12.374 241 HB2 LYS 35 HB2 LYS 35 11.178 2.469 14.052 242 HB3 LYS 35 HB3 LYS 35 11.592 1.357 15.347 243 HG2 LYS 35 HG2 LYS 35 13.333 3.051 15.056 244 HG3 LYS 35 HG3 LYS 35 13.959 1.452 14.689 245 HD2 LYS 35 HD2 LYS 35 13.819 1.888 12.284 246 HD3 LYS 35 HD3 LYS 35 13.114 3.487 12.612 247 HE2 LYS 35 HE2 LYS 35 15.522 3.684 12.139 248 HE3 LYS 35 HE3 LYS 35 15.165 4.162 13.808 249 HZ1 LYS 35 HZ1 LYS 35 16.255 1.510 13.024 250 HZ2 LYS 35 HZ2 LYS 35 15.979 2.012 14.566 251 HZ3 LYS 35 HZ3 LYS 35 17.142 2.747 13.654 252 H ASP 36 H ASP 36 12.694 -0.270 15.617 253 HA ASP 36 HA ASP 36 14.600 -2.058 14.274 254 HB2 ASP 36 HB2 ASP 36 14.400 -0.978 17.096 255 HB3 ASP 36 HB3 ASP 36 15.671 -2.089 16.557 256 H ARG 37 H ARG 37 11.570 -2.556 15.531 257 HA ARG 37 HA ARG 37 11.959 -4.798 17.236 258 HB2 ARG 37 HB2 ARG 37 9.807 -3.484 16.728 259 HB3 ARG 37 HB3 ARG 37 9.655 -4.507 15.294 260 HG2 ARG 37 HG2 ARG 37 9.804 -6.510 16.900 261 HG3 ARG 37 HG3 ARG 37 9.571 -5.338 18.211 262 HD2 ARG 37 HD2 ARG 37 7.737 -5.760 15.839 263 HD3 ARG 37 HD3 ARG 37 7.457 -6.402 17.464 264 HE ARG 37 HE ARG 37 7.718 -3.692 17.874 265 HH11 ARG 37 HH21 ARG 37 5.654 -5.645 15.807 266 HH12 ARG 37 HH22 ARG 37 4.356 -4.465 15.800 267 HH21 ARG 37 HH11 ARG 37 6.015 -2.236 17.874 268 HH22 ARG 37 HH12 ARG 37 4.560 -2.588 16.984 269 H PHE 38 H PHE 38 12.057 -4.542 13.725 270 HA PHE 38 HA PHE 38 11.779 -7.311 13.104 271 HB2 PHE 38 HB2 PHE 38 13.307 -5.114 11.657 272 HB3 PHE 38 HB3 PHE 38 12.912 -6.695 10.976 273 HD1 PHE 38 HD2 PHE 38 10.029 -6.932 12.077 274 HD2 PHE 38 HD1 PHE 38 12.145 -3.716 10.138 275 HE1 PHE 38 HE2 PHE 38 7.878 -6.047 11.208 276 HE2 PHE 38 HE1 PHE 38 9.993 -2.832 9.256 277 HZ PHE 38 HZ PHE 38 7.857 -3.995 9.787 278 H TYR 39 H TYR 39 14.458 -5.655 14.575 279 HA TYR 39 HA TYR 39 16.289 -7.864 13.729 280 HB2 TYR 39 HB2 TYR 39 17.135 -5.317 15.098 281 HB3 TYR 39 HB3 TYR 39 18.081 -6.382 14.049 282 HD1 TYR 39 HD2 TYR 39 16.874 -6.619 11.542 283 HD2 TYR 39 HD1 TYR 39 16.562 -3.254 14.209 284 HE1 TYR 39 HE2 TYR 39 16.273 -5.139 9.620 285 HE2 TYR 39 HE1 TYR 39 15.958 -1.792 12.289 286 HH TYR 39 HH TYR 39 15.576 -1.662 10.057 287 H LEU 40 H LEU 40 14.283 -6.941 16.194 288 HA LEU 40 HA LEU 40 16.028 -8.051 18.351 289 HB2 LEU 40 HB2 LEU 40 13.787 -6.088 18.220 290 HB3 LEU 40 HB3 LEU 40 13.794 -7.171 19.608 291 HG LEU 40 HG LEU 40 16.047 -6.409 20.229 292 HD11 LEU 40 HD11 LEU 40 15.757 -4.443 17.921 293 HD12 LEU 40 HD12 LEU 40 16.970 -5.737 18.063 294 HD13 LEU 40 HD13 LEU 40 17.003 -4.368 19.187 295 HD21 LEU 40 HD21 LEU 40 15.361 -4.172 20.993 296 HD22 LEU 40 HD22 LEU 40 14.028 -5.334 21.148 297 HD23 LEU 40 HD23 LEU 40 14.036 -4.161 19.807 298 H GLN 41 H GLN 41 12.886 -8.347 16.719 299 HA GLN 41 HA GLN 41 12.539 -11.015 18.020 300 HB2 GLN 41 HB2 GLN 41 10.418 -8.956 17.277 301 HB3 GLN 41 HB3 GLN 41 10.088 -10.592 17.857 302 HG2 GLN 41 HG2 GLN 41 11.293 -10.035 19.976 303 HG3 GLN 41 HG3 GLN 41 11.457 -8.368 19.402 304 HE21 GLN 41 HE21 GLN 41 10.013 -7.042 20.248 305 HE22 GLN 41 HE22 GLN 41 8.372 -7.465 20.677 306 HA PRO 42 HA PRO 42 12.111 -12.301 13.769 307 HB2 PRO 42 HB2 PRO 42 10.369 -14.395 13.904 308 HB3 PRO 42 HB3 PRO 42 12.039 -14.525 14.545 309 HG2 PRO 42 HG2 PRO 42 9.492 -13.892 16.024 310 HG3 PRO 42 HG3 PRO 42 10.728 -15.135 16.398 311 HD2 PRO 42 HD2 PRO 42 10.727 -12.734 17.629 312 HD3 PRO 42 HD3 PRO 42 12.268 -13.536 17.163 313 H LEU 43 H LEU 43 10.304 -12.482 12.070 314 HA LEU 43 HA LEU 43 8.258 -10.432 12.691 315 HB2 LEU 43 HB2 LEU 43 9.323 -11.660 10.138 316 HB3 LEU 43 HB3 LEU 43 7.857 -10.693 10.165 317 HG LEU 43 HG LEU 43 9.131 -8.742 10.968 318 HD11 LEU 43 HD11 LEU 43 11.072 -9.703 12.072 319 HD12 LEU 43 HD12 LEU 43 11.632 -8.747 10.692 320 HD13 LEU 43 HD13 LEU 43 11.577 -10.518 10.571 321 HD21 LEU 43 HD21 LEU 43 10.192 -8.288 8.808 322 HD22 LEU 43 HD22 LEU 43 8.664 -9.164 8.576 323 HD23 LEU 43 HD23 LEU 43 10.212 -10.027 8.429 324 HA PRO 44 HA PRO 44 5.620 -14.117 12.793 325 HB2 PRO 44 HB2 PRO 44 3.587 -13.206 14.345 326 HB3 PRO 44 HB3 PRO 44 5.174 -13.646 15.059 327 HG2 PRO 44 HG2 PRO 44 4.150 -10.956 14.240 328 HG3 PRO 44 HG3 PRO 44 4.847 -11.458 15.809 329 HD2 PRO 44 HD2 PRO 44 6.331 -10.227 13.907 330 HD3 PRO 44 HD3 PRO 44 7.006 -11.516 14.958 331 HA PRO 45 HA PRO 45 2.932 -12.873 9.556 332 HB2 PRO 45 HB2 PRO 45 0.670 -14.385 9.814 333 HB3 PRO 45 HB3 PRO 45 2.246 -15.084 9.333 334 HG2 PRO 45 HG2 PRO 45 1.015 -14.970 12.075 335 HG3 PRO 45 HG3 PRO 45 1.666 -16.388 11.188 336 HD2 PRO 45 HD2 PRO 45 3.172 -15.103 12.989 337 HD3 PRO 45 HD3 PRO 45 3.895 -15.663 11.440 338 H THR 46 H THR 46 1.787 -12.487 12.830 339 HA THR 46 HA THR 46 -0.599 -10.977 12.214 340 HB THR 46 HB THR 46 -0.112 -10.097 14.621 341 HG1 THR 46 HG1 THR 46 1.500 -11.184 15.697 342 HG21 THR 46 HG21 THR 46 -0.341 -13.107 14.172 343 HG22 THR 46 HG22 THR 46 -1.698 -11.952 14.131 344 HG23 THR 46 HG23 THR 46 -0.806 -12.223 15.643 345 H GLU 47 H GLU 47 2.816 -10.123 12.948 346 HA GLU 47 HA GLU 47 2.265 -7.275 12.633 347 HB2 GLU 47 HB2 GLU 47 4.867 -8.806 12.848 348 HB3 GLU 47 HB3 GLU 47 4.708 -7.041 12.829 349 HG2 GLU 47 HG2 GLU 47 3.258 -7.191 14.850 350 HG3 GLU 47 HG3 GLU 47 3.576 -8.931 14.914 351 H ALA 48 H ALA 48 2.890 -9.866 10.476 352 HA ALA 48 HA ALA 48 4.167 -8.370 8.385 353 HB1 ALA 48 HB1 ALA 48 2.242 -10.722 8.168 354 HB2 ALA 48 HB2 ALA 48 3.321 -10.126 6.888 355 HB3 ALA 48 HB3 ALA 48 4.006 -10.845 8.366 356 H ALA 49 H ALA 49 0.894 -8.447 9.698 357 HA ALA 49 HA ALA 49 -0.408 -7.220 7.446 358 HB1 ALA 49 HB1 ALA 49 -1.129 -7.053 10.406 359 HB2 ALA 49 HB2 ALA 49 -2.204 -6.696 9.035 360 HB3 ALA 49 HB3 ALA 49 -1.624 -8.357 9.301 361 H GLN 50 H GLN 50 1.442 -5.933 10.208 362 HA GLN 50 HA GLN 50 0.758 -3.169 9.783 363 HB2 GLN 50 HB2 GLN 50 3.237 -4.463 10.997 364 HB3 GLN 50 HB3 GLN 50 2.961 -2.736 10.947 365 HG2 GLN 50 HG2 GLN 50 0.827 -3.113 12.232 366 HG3 GLN 50 HG3 GLN 50 1.344 -4.793 12.458 367 HE21 GLN 50 HE21 GLN 50 2.290 -1.405 13.000 368 HE22 GLN 50 HE22 GLN 50 3.268 -1.724 14.409 369 H ARG 51 H ARG 51 3.425 -5.259 8.636 370 HA ARG 51 HA ARG 51 4.761 -3.231 7.092 371 HB2 ARG 51 HB2 ARG 51 4.615 -6.253 6.794 372 HB3 ARG 51 HB3 ARG 51 5.717 -5.217 5.884 373 HG2 ARG 51 HG2 ARG 51 6.985 -4.677 7.779 374 HG3 ARG 51 HG3 ARG 51 5.739 -5.248 8.907 375 HD2 ARG 51 HD2 ARG 51 7.720 -6.811 8.622 376 HD3 ARG 51 HD3 ARG 51 6.126 -7.529 8.349 377 HE ARG 51 HE ARG 51 6.551 -7.750 6.058 378 HH11 ARG 51 HH11 ARG 51 9.295 -6.072 7.571 379 HH12 ARG 51 HH12 ARG 51 10.277 -6.251 6.141 380 HH21 ARG 51 HH21 ARG 51 7.817 -7.930 4.350 381 HH22 ARG 51 HH22 ARG 51 9.457 -7.307 4.335 382 H ALA 52 H ALA 52 2.146 -5.486 6.399 383 HA ALA 52 HA ALA 52 2.147 -5.173 3.577 384 HB1 ALA 52 HB1 ALA 52 1.016 -7.041 4.704 385 HB2 ALA 52 HB2 ALA 52 -0.143 -5.919 5.444 386 HB3 ALA 52 HB3 ALA 52 -0.126 -6.145 3.683 387 H LYS 53 H LYS 53 0.214 -3.432 6.110 388 HA LYS 53 HA LYS 53 -1.158 -1.942 4.056 389 HB2 LYS 53 HB2 LYS 53 -2.018 -0.537 5.864 390 HB3 LYS 53 HB3 LYS 53 -2.239 -2.263 6.121 391 HG2 LYS 53 HG2 LYS 53 -0.254 -2.208 7.683 392 HG3 LYS 53 HG3 LYS 53 -0.258 -0.446 7.522 393 HD2 LYS 53 HD2 LYS 53 -1.490 -0.961 9.524 394 HD3 LYS 53 HD3 LYS 53 -2.690 -0.497 8.309 395 HE2 LYS 53 HE2 LYS 53 -3.120 -2.936 7.855 396 HE3 LYS 53 HE3 LYS 53 -1.964 -3.356 9.124 397 HZ1 LYS 53 HZ1 LYS 53 -4.494 -1.855 9.529 398 HZ2 LYS 53 HZ2 LYS 53 -3.424 -2.250 10.721 399 HZ3 LYS 53 HZ3 LYS 53 -4.244 -3.440 9.919 400 H VAL 54 H VAL 54 1.977 -1.481 5.525 401 HA VAL 54 HA VAL 54 2.179 1.307 4.668 402 HB VAL 54 HB VAL 54 4.343 -0.734 5.386 403 HG11 VAL 54 HG11 VAL 54 5.316 0.967 3.912 404 HG12 VAL 54 HG12 VAL 54 4.559 2.270 4.859 405 HG13 VAL 54 HG13 VAL 54 5.845 1.269 5.578 406 HG21 VAL 54 HG21 VAL 54 4.491 0.517 7.492 407 HG22 VAL 54 HG22 VAL 54 3.219 1.634 6.946 408 HG23 VAL 54 HG23 VAL 54 2.834 -0.070 7.256 409 H SER 55 H SER 55 3.272 -1.881 3.332 410 HA SER 55 HA SER 55 4.380 -0.657 0.959 411 HB2 SER 55 HB2 SER 55 4.310 -3.003 0.053 412 HB3 SER 55 HB3 SER 55 5.166 -2.819 1.598 413 HG SER 55 HG SER 55 3.699 -3.968 2.581 414 H ALA 56 H ALA 56 1.145 -1.625 1.895 415 HA ALA 56 HA ALA 56 0.015 -1.548 -0.756 416 HB1 ALA 56 HB1 ALA 56 -1.348 -0.947 1.904 417 HB2 ALA 56 HB2 ALA 56 -2.112 -1.478 0.395 418 HB3 ALA 56 HB3 ALA 56 -1.058 -2.588 1.280 419 H SER 57 H SER 57 0.708 0.903 1.745 420 HA SER 57 HA SER 57 -0.845 2.970 0.497 421 HB2 SER 57 HB2 SER 57 -0.085 2.949 2.892 422 HB3 SER 57 HB3 SER 57 1.567 3.283 2.329 423 HG SER 57 HG SER 57 0.673 5.186 1.303 424 H GLU 58 H GLU 58 2.335 1.668 -0.183 425 HA GLU 58 HA GLU 58 3.417 3.942 -1.579 426 HB2 GLU 58 HB2 GLU 58 3.830 0.954 -1.786 427 HB3 GLU 58 HB3 GLU 58 4.664 2.081 -2.843 428 HG2 GLU 58 HG2 GLU 58 4.817 2.172 0.179 429 HG3 GLU 58 HG3 GLU 58 5.992 1.349 -0.864 430 H ILE 59 H ILE 59 1.051 1.472 -2.413 431 HA ILE 59 HA ILE 59 1.162 2.022 -5.271 432 HB ILE 59 HB ILE 59 -0.851 0.482 -3.580 433 HG12 ILE 59 HG12 ILE 59 1.315 -0.522 -5.472 434 HG13 ILE 59 HG13 ILE 59 1.586 -0.318 -3.745 435 HG21 ILE 59 HG21 ILE 59 -0.568 0.636 -6.627 436 HG22 ILE 59 HG22 ILE 59 -1.629 -0.496 -5.759 437 HG23 ILE 59 HG23 ILE 59 -1.937 1.245 -5.674 438 HD11 ILE 59 HD11 ILE 59 -0.126 -1.974 -3.231 439 HD12 ILE 59 HD12 ILE 59 -0.453 -2.196 -4.964 440 HD13 ILE 59 HD13 ILE 59 1.129 -2.645 -4.293 441 H LEU 60 H LEU 60 -0.436 3.414 -2.478 442 HA LEU 60 HA LEU 60 -2.422 4.894 -4.027 443 HB2 LEU 60 HB2 LEU 60 -1.253 5.545 -1.302 444 HB3 LEU 60 HB3 LEU 60 -2.725 6.204 -1.991 445 HG LEU 60 HG LEU 60 -2.322 3.291 -1.211 446 HD11 LEU 60 HD11 LEU 60 -3.751 3.817 0.709 447 HD12 LEU 60 HD12 LEU 60 -3.848 5.518 0.197 448 HD13 LEU 60 HD13 LEU 60 -2.295 4.834 0.728 449 HD21 LEU 60 HD21 LEU 60 -4.795 4.825 -2.065 450 HD22 LEU 60 HD22 LEU 60 -4.790 3.173 -1.411 451 HD23 LEU 60 HD23 LEU 60 -3.994 3.510 -2.960 452 H ASN 61 H ASN 61 0.979 5.164 -3.385 453 HA ASN 61 HA ASN 61 1.125 8.051 -3.864 454 HB2 ASN 61 HB2 ASN 61 2.628 6.582 -2.353 455 HB3 ASN 61 HB3 ASN 61 3.421 6.069 -3.849 456 HD21 ASN 61 HD21 ASN 61 5.318 6.989 -2.836 457 HD22 ASN 61 HD22 ASN 61 5.593 8.710 -2.968 458 H VAL 62 H VAL 62 0.551 5.504 -5.909 459 HA VAL 62 HA VAL 62 2.419 5.943 -8.029 460 HB VAL 62 HB VAL 62 -0.354 4.681 -7.974 461 HG11 VAL 62 HG11 VAL 62 0.304 3.626 -10.181 462 HG12 VAL 62 HG12 VAL 62 -0.058 5.357 -10.279 463 HG13 VAL 62 HG13 VAL 62 1.632 4.802 -10.283 464 HG21 VAL 62 HG21 VAL 62 1.548 3.589 -6.716 465 HG22 VAL 62 HG22 VAL 62 0.880 2.590 -8.018 466 HG23 VAL 62 HG23 VAL 62 2.424 3.447 -8.252 467 H LYS 63 H LYS 63 -0.362 7.849 -7.069 468 HA LYS 63 HA LYS 63 -0.963 9.039 -9.581 469 HB2 LYS 63 HB2 LYS 63 -1.825 9.392 -7.007 470 HB3 LYS 63 HB3 LYS 63 -0.917 10.885 -7.253 471 HG2 LYS 63 HG2 LYS 63 -2.973 9.948 -9.280 472 HG3 LYS 63 HG3 LYS 63 -3.471 10.824 -7.828 473 HD2 LYS 63 HD2 LYS 63 -2.246 12.789 -8.459 474 HD3 LYS 63 HD3 LYS 63 -1.376 11.924 -9.727 475 HE2 LYS 63 HE2 LYS 63 -3.045 13.284 -10.782 476 HE3 LYS 63 HE3 LYS 63 -3.488 11.582 -10.967 477 HZ1 LYS 63 HZ1 LYS 63 -5.010 11.913 -9.056 478 HZ2 LYS 63 HZ2 LYS 63 -5.415 12.777 -10.403 479 HZ3 LYS 63 HZ3 LYS 63 -4.698 13.533 -9.114 480 H GLN 64 H GLN 64 1.806 9.521 -7.417 481 HA GLN 64 HA GLN 64 2.647 11.974 -8.674 482 HB2 GLN 64 HB2 GLN 64 4.284 9.956 -7.107 483 HB3 GLN 64 HB3 GLN 64 4.733 11.627 -7.466 484 HG2 GLN 64 HG2 GLN 64 2.419 10.716 -5.710 485 HG3 GLN 64 HG3 GLN 64 3.934 11.443 -5.168 486 HE21 GLN 64 HE21 GLN 64 4.197 13.654 -5.253 487 HE22 GLN 64 HE22 GLN 64 2.915 14.744 -5.726 488 H PHE 65 H PHE 65 2.804 8.695 -9.805 489 HA PHE 65 HA PHE 65 5.148 9.167 -11.514 490 HB2 PHE 65 HB2 PHE 65 5.014 6.943 -11.773 491 HB3 PHE 65 HB3 PHE 65 3.518 6.905 -10.838 492 HD1 PHE 65 HD1 PHE 65 4.948 7.080 -14.268 493 HD2 PHE 65 HD2 PHE 65 1.351 6.699 -11.954 494 HE1 PHE 65 HE1 PHE 65 3.683 6.538 -16.337 495 HE2 PHE 65 HE2 PHE 65 0.084 6.149 -14.009 496 HZ PHE 65 HZ PHE 65 1.234 6.096 -16.213 497 H ILE 66 H ILE 66 1.651 9.640 -11.615 498 HA ILE 66 HA ILE 66 1.423 9.851 -14.469 499 HB ILE 66 HB ILE 66 -0.398 11.094 -12.330 500 HG12 ILE 66 HG12 ILE 66 -0.601 8.390 -13.704 501 HG13 ILE 66 HG13 ILE 66 -0.048 8.629 -12.048 502 HG21 ILE 66 HG21 ILE 66 -2.143 11.052 -14.095 503 HG22 ILE 66 HG22 ILE 66 -0.750 11.990 -14.651 504 HG23 ILE 66 HG23 ILE 66 -0.990 10.331 -15.242 505 HD11 ILE 66 HD11 ILE 66 -2.831 9.053 -13.145 506 HD12 ILE 66 HD12 ILE 66 -2.296 7.903 -11.906 507 HD13 ILE 66 HD13 ILE 66 -2.321 9.643 -11.545 508 H ASP 67 H ASP 67 1.909 12.184 -11.829 509 HA ASP 67 HA ASP 67 1.904 14.572 -13.391 510 HB2 ASP 67 HB2 ASP 67 1.839 14.643 -10.967 511 HB3 ASP 67 HB3 ASP 67 3.380 13.779 -10.858 512 H ARG 68 H ARG 68 4.594 12.428 -12.392 513 HA ARG 68 HA ARG 68 6.545 13.936 -13.920 514 HB2 ARG 68 HB2 ARG 68 6.654 11.202 -12.598 515 HB3 ARG 68 HB3 ARG 68 8.038 11.996 -13.365 516 HG2 ARG 68 HG2 ARG 68 7.732 13.934 -11.809 517 HG3 ARG 68 HG3 ARG 68 6.492 13.004 -10.950 518 HD2 ARG 68 HD2 ARG 68 9.348 12.060 -11.396 519 HD3 ARG 68 HD3 ARG 68 8.809 12.901 -9.938 520 HE ARG 68 HE ARG 68 8.178 10.134 -10.742 521 HH11 ARG 68 HH21 ARG 68 7.559 12.729 -8.433 522 HH12 ARG 68 HH22 ARG 68 6.920 11.636 -7.236 523 HH21 ARG 68 HH11 ARG 68 7.329 8.801 -9.171 524 HH22 ARG 68 HH12 ARG 68 6.785 9.456 -7.654 525 H LYS 69 H LYS 69 4.180 11.770 -14.896 526 HA LYS 69 HA LYS 69 3.790 10.558 -16.807 527 HB2 LYS 69 HB2 LYS 69 5.686 12.649 -17.926 528 HB3 LYS 69 HB3 LYS 69 4.618 11.628 -18.900 529 HG2 LYS 69 HG2 LYS 69 2.648 12.622 -17.972 530 HG3 LYS 69 HG3 LYS 69 3.568 13.393 -16.679 531 HD2 LYS 69 HD2 LYS 69 4.740 14.776 -18.383 532 HD3 LYS 69 HD3 LYS 69 3.585 14.151 -19.591 533 HE2 LYS 69 HE2 LYS 69 1.704 14.982 -18.225 534 HE3 LYS 69 HE3 LYS 69 2.832 15.510 -16.962 535 HZ1 LYS 69 HZ1 LYS 69 2.710 16.615 -19.705 536 HZ2 LYS 69 HZ2 LYS 69 3.761 17.092 -18.524 537 HZ3 LYS 69 HZ3 LYS 69 2.144 17.347 -18.340 538 H ALA 70 H ALA 70 5.625 9.397 -15.132 539 HA ALA 70 HA ALA 70 8.012 8.630 -16.623 540 HB1 ALA 70 HB1 ALA 70 8.628 7.429 -14.602 541 HB2 ALA 70 HB2 ALA 70 7.996 9.025 -14.157 542 HB3 ALA 70 HB3 ALA 70 6.981 7.577 -13.952 543 H TRP 71 H TRP 71 6.200 7.816 -18.323 544 HA TRP 71 HA TRP 71 4.860 5.396 -18.096 545 HB2 TRP 71 HB2 TRP 71 6.375 6.032 -20.609 546 HB3 TRP 71 HB3 TRP 71 4.776 5.348 -20.410 547 HD1 TRP 71 HD1 TRP 71 6.422 8.492 -21.284 548 HE1 TRP 71 HE1 TRP 71 4.876 10.504 -21.206 549 HE3 TRP 71 HE3 TRP 71 2.612 6.355 -18.638 550 HZ2 TRP 71 HZ2 TRP 71 2.275 11.105 -20.196 551 HZ3 TRP 71 HZ3 TRP 71 0.574 7.721 -18.141 552 HH2 TRP 71 HH2 TRP 71 0.425 10.080 -18.926 553 HA PRO 72 HA PRO 72 8.300 2.623 -19.388 554 HB2 PRO 72 HB2 PRO 72 10.926 3.253 -19.512 555 HB3 PRO 72 HB3 PRO 72 9.799 3.705 -20.832 556 HG2 PRO 72 HG2 PRO 72 10.758 5.371 -18.517 557 HG3 PRO 72 HG3 PRO 72 10.794 5.752 -20.268 558 HD2 PRO 72 HD2 PRO 72 8.806 6.636 -18.650 559 HD3 PRO 72 HD3 PRO 72 8.494 6.149 -20.351 560 H SER 73 H SER 73 8.633 4.670 -16.647 561 HA SER 73 HA SER 73 10.496 2.842 -15.260 562 HB2 SER 73 HB2 SER 73 10.696 5.310 -15.002 563 HB3 SER 73 HB3 SER 73 9.085 5.336 -14.253 564 HG SER 73 HG SER 73 10.841 5.233 -12.731 565 H LEU 74 H LEU 74 7.066 3.876 -15.122 566 HA LEU 74 HA LEU 74 6.465 2.676 -12.647 567 HB2 LEU 74 HB2 LEU 74 5.006 4.257 -13.957 568 HB3 LEU 74 HB3 LEU 74 4.583 2.904 -15.013 569 HG LEU 74 HG LEU 74 3.789 1.681 -12.911 570 HD11 LEU 74 HD11 LEU 74 3.168 3.127 -10.981 571 HD12 LEU 74 HD12 LEU 74 4.029 4.479 -11.739 572 HD13 LEU 74 HD13 LEU 74 4.921 3.038 -11.205 573 HD21 LEU 74 HD21 LEU 74 2.168 2.448 -14.374 574 HD22 LEU 74 HD22 LEU 74 2.455 4.140 -13.938 575 HD23 LEU 74 HD23 LEU 74 1.681 3.049 -12.781 576 H GLN 75 H GLN 75 6.432 1.220 -15.889 577 HA GLN 75 HA GLN 75 5.126 -1.184 -15.278 578 HB2 GLN 75 HB2 GLN 75 6.379 -2.138 -17.184 579 HB3 GLN 75 HB3 GLN 75 5.690 -0.552 -17.545 580 HG2 GLN 75 HG2 GLN 75 7.891 0.491 -17.216 581 HG3 GLN 75 HG3 GLN 75 8.593 -1.087 -16.843 582 HE21 GLN 75 HE21 GLN 75 9.651 -1.978 -18.463 583 HE22 GLN 75 HE22 GLN 75 9.288 -1.758 -20.158 584 H ASN 76 H ASN 76 8.383 -0.180 -14.357 585 HA ASN 76 HA ASN 76 8.913 -2.904 -13.257 586 HB2 ASN 76 HB2 ASN 76 10.783 -1.801 -14.415 587 HB3 ASN 76 HB3 ASN 76 10.624 -0.388 -13.363 588 HD21 ASN 76 HD21 ASN 76 12.278 -0.330 -12.017 589 HD22 ASN 76 HD22 ASN 76 12.914 -1.701 -11.140 590 H ASP 77 H ASP 77 8.716 0.536 -12.291 591 HA ASP 77 HA ASP 77 9.331 0.159 -9.595 592 HB2 ASP 77 HB2 ASP 77 9.225 2.282 -11.015 593 HB3 ASP 77 HB3 ASP 77 7.494 2.323 -10.648 594 H LEU 78 H LEU 78 6.041 0.201 -11.067 595 HA LEU 78 HA LEU 78 4.702 0.175 -8.506 596 HB2 LEU 78 HB2 LEU 78 3.923 0.408 -11.143 597 HB3 LEU 78 HB3 LEU 78 3.357 -1.207 -10.755 598 HG LEU 78 HG LEU 78 2.624 1.344 -9.287 599 HD11 LEU 78 HD11 LEU 78 0.380 0.963 -10.276 600 HD12 LEU 78 HD12 LEU 78 1.034 -0.408 -11.200 601 HD13 LEU 78 HD13 LEU 78 1.625 1.231 -11.505 602 HD21 LEU 78 HD21 LEU 78 2.508 -0.434 -7.683 603 HD22 LEU 78 HD22 LEU 78 1.716 -1.517 -8.845 604 HD23 LEU 78 HD23 LEU 78 0.853 -0.100 -8.215 605 H ARG 79 H ARG 79 5.987 -2.293 -10.684 606 HA ARG 79 HA ARG 79 4.666 -4.482 -9.349 607 HB2 ARG 79 HB2 ARG 79 7.116 -4.544 -11.141 608 HB3 ARG 79 HB3 ARG 79 6.079 -5.916 -10.712 609 HG2 ARG 79 HG2 ARG 79 4.147 -4.577 -11.751 610 HG3 ARG 79 HG3 ARG 79 5.387 -3.499 -12.402 611 HD2 ARG 79 HD2 ARG 79 5.155 -4.942 -14.176 612 HD3 ARG 79 HD3 ARG 79 6.442 -5.772 -13.284 613 HE ARG 79 HE ARG 79 4.949 -7.480 -12.739 614 HH11 ARG 79 HH11 ARG 79 3.108 -4.832 -14.212 615 HH12 ARG 79 HH12 ARG 79 1.646 -5.804 -14.292 616 HH21 ARG 79 HH21 ARG 79 3.028 -8.621 -12.931 617 HH22 ARG 79 HH22 ARG 79 1.603 -7.839 -13.600 618 H LEU 80 H LEU 80 7.639 -2.706 -8.756 619 HA LEU 80 HA LEU 80 8.792 -4.699 -7.002 620 HB2 LEU 80 HB2 LEU 80 9.086 -1.676 -7.054 621 HB3 LEU 80 HB3 LEU 80 10.037 -2.748 -6.035 622 HG LEU 80 HG LEU 80 10.064 -2.807 -9.067 623 HD11 LEU 80 HD11 LEU 80 12.041 -1.591 -7.103 624 HD12 LEU 80 HD12 LEU 80 10.956 -0.690 -8.193 625 HD13 LEU 80 HD13 LEU 80 12.250 -1.701 -8.864 626 HD21 LEU 80 HD21 LEU 80 12.125 -4.146 -8.767 627 HD22 LEU 80 HD22 LEU 80 10.702 -4.962 -8.102 628 HD23 LEU 80 HD23 LEU 80 11.853 -4.157 -7.008 629 H ARG 81 H ARG 81 6.573 -1.907 -6.487 630 HA ARG 81 HA ARG 81 6.417 -2.274 -3.619 631 HB2 ARG 81 HB2 ARG 81 4.223 -1.173 -5.421 632 HB3 ARG 81 HB3 ARG 81 4.428 -0.882 -3.696 633 HG2 ARG 81 HG2 ARG 81 6.177 0.147 -5.948 634 HG3 ARG 81 HG3 ARG 81 5.042 1.078 -4.973 635 HD2 ARG 81 HD2 ARG 81 6.755 1.596 -3.621 636 HD3 ARG 81 HD3 ARG 81 6.774 -0.091 -3.083 637 HE ARG 81 HE ARG 81 8.704 -0.429 -4.316 638 HH11 ARG 81 HH21 ARG 81 7.246 2.590 -5.429 639 HH12 ARG 81 HH22 ARG 81 8.560 2.919 -6.539 640 HH21 ARG 81 HH11 ARG 81 10.378 0.121 -5.691 641 HH22 ARG 81 HH12 ARG 81 10.273 1.571 -6.671 642 H ALA 82 H ALA 82 4.515 -3.407 -6.385 643 HA ALA 82 HA ALA 82 2.510 -4.773 -4.944 644 HB1 ALA 82 HB1 ALA 82 2.001 -5.834 -7.030 645 HB2 ALA 82 HB2 ALA 82 2.620 -4.228 -7.448 646 HB3 ALA 82 HB3 ALA 82 3.668 -5.655 -7.620 647 H SER 83 H SER 83 5.757 -5.899 -6.022 648 HA SER 83 HA SER 83 5.339 -8.616 -5.242 649 HB2 SER 83 HB2 SER 83 7.921 -7.011 -5.363 650 HB3 SER 83 HB3 SER 83 7.805 -8.782 -5.258 651 HG SER 83 HG SER 83 6.942 -7.077 -7.368 652 H TYR 84 H TYR 84 6.703 -5.810 -3.469 653 HA TYR 84 HA TYR 84 7.426 -7.234 -1.117 654 HB2 TYR 84 HB2 TYR 84 7.951 -4.816 -1.831 655 HB3 TYR 84 HB3 TYR 84 6.356 -4.392 -1.211 656 HD1 TYR 84 HD1 TYR 84 5.880 -5.071 1.321 657 HD2 TYR 84 HD2 TYR 84 9.818 -4.765 -0.396 658 HE1 TYR 84 HE1 TYR 84 6.846 -4.754 3.585 659 HE2 TYR 84 HE2 TYR 84 10.777 -4.457 1.891 660 HH TYR 84 HH TYR 84 8.702 -4.307 4.798 661 H LEU 85 H LEU 85 4.389 -5.579 -2.048 662 HA LEU 85 HA LEU 85 2.978 -6.120 0.366 663 HB2 LEU 85 HB2 LEU 85 2.259 -4.469 -1.320 664 HB3 LEU 85 HB3 LEU 85 1.980 -5.765 -2.479 665 HG LEU 85 HG LEU 85 0.153 -6.655 -1.073 666 HD11 LEU 85 HD11 LEU 85 0.733 -4.215 0.642 667 HD12 LEU 85 HD12 LEU 85 0.832 -5.919 1.134 668 HD13 LEU 85 HD13 LEU 85 -0.743 -5.199 0.754 669 HD21 LEU 85 HD21 LEU 85 -0.287 -5.038 -2.892 670 HD22 LEU 85 HD22 LEU 85 -0.127 -3.702 -1.728 671 HD23 LEU 85 HD23 LEU 85 -1.450 -4.875 -1.559 672 H ARG 86 H ARG 86 3.348 -7.967 -2.636 673 HA ARG 86 HA ARG 86 1.374 -9.940 -2.073 674 HB2 ARG 86 HB2 ARG 86 2.693 -9.490 -4.256 675 HB3 ARG 86 HB3 ARG 86 3.962 -10.492 -3.560 676 HG2 ARG 86 HG2 ARG 86 2.726 -11.932 -4.960 677 HG3 ARG 86 HG3 ARG 86 2.152 -12.326 -3.326 678 HD2 ARG 86 HD2 ARG 86 0.144 -11.012 -3.647 679 HD3 ARG 86 HD3 ARG 86 0.784 -10.328 -5.145 680 HE ARG 86 HE ARG 86 0.609 -13.164 -5.382 681 HH11 ARG 86 HH11 ARG 86 -1.407 -10.265 -5.446 682 HH12 ARG 86 HH12 ARG 86 -2.627 -11.018 -6.433 683 HH21 ARG 86 HH21 ARG 86 -0.994 -14.055 -6.671 684 HH22 ARG 86 HH22 ARG 86 -2.394 -13.117 -7.113 685 H TYR 87 H TYR 87 4.859 -9.793 -1.243 686 HA TYR 87 HA TYR 87 4.947 -12.444 -0.158 687 HB2 TYR 87 HB2 TYR 87 6.638 -10.043 0.634 688 HB3 TYR 87 HB3 TYR 87 7.030 -11.743 0.909 689 HD1 TYR 87 HD2 TYR 87 6.267 -12.886 -1.829 690 HD2 TYR 87 HD1 TYR 87 8.439 -9.327 -0.737 691 HE1 TYR 87 HE2 TYR 87 7.440 -12.916 -4.027 692 HE2 TYR 87 HE1 TYR 87 9.615 -9.384 -2.937 693 HH TYR 87 HH TYR 87 9.865 -10.475 -4.939 694 H ASP 88 H ASP 88 4.390 -9.238 1.391 695 HA ASP 88 HA ASP 88 4.219 -10.352 4.030 696 HB2 ASP 88 HB2 ASP 88 3.192 -7.780 2.800 697 HB3 ASP 88 HB3 ASP 88 2.891 -8.205 4.493 698 H LEU 89 H LEU 89 1.678 -9.654 1.557 699 HA LEU 89 HA LEU 89 -0.472 -10.400 3.302 700 HB2 LEU 89 HB2 LEU 89 -0.143 -9.667 0.536 701 HB3 LEU 89 HB3 LEU 89 -1.107 -11.129 0.598 702 HG LEU 89 HG LEU 89 -2.518 -9.162 0.502 703 HD11 LEU 89 HD11 LEU 89 -2.665 -10.466 3.250 704 HD12 LEU 89 HD12 LEU 89 -3.353 -11.117 1.742 705 HD13 LEU 89 HD13 LEU 89 -3.970 -9.597 2.420 706 HD21 LEU 89 HD21 LEU 89 -0.940 -7.596 1.612 707 HD22 LEU 89 HD22 LEU 89 -1.347 -8.333 3.176 708 HD23 LEU 89 HD23 LEU 89 -2.598 -7.493 2.233 709 H LYS 90 H LYS 90 1.542 -12.335 1.068 710 HA LYS 90 HA LYS 90 0.110 -14.746 1.249 711 HB2 LYS 90 HB2 LYS 90 2.003 -14.184 -0.293 712 HB3 LYS 90 HB3 LYS 90 3.108 -14.224 1.077 713 HG2 LYS 90 HG2 LYS 90 3.376 -16.231 -0.080 714 HG3 LYS 90 HG3 LYS 90 2.496 -16.619 1.405 715 HD2 LYS 90 HD2 LYS 90 0.373 -16.632 0.127 716 HD3 LYS 90 HD3 LYS 90 1.294 -16.259 -1.360 717 HE2 LYS 90 HE2 LYS 90 2.682 -18.239 -0.927 718 HE3 LYS 90 HE3 LYS 90 1.661 -18.619 0.468 719 HZ1 LYS 90 HZ1 LYS 90 1.020 -19.895 -1.487 720 HZ2 LYS 90 HZ2 LYS 90 0.745 -18.518 -2.351 721 HZ3 LYS 90 HZ3 LYS 90 -0.208 -18.881 -1.053 722 H THR 91 H THR 91 2.367 -13.155 3.451 723 HA THR 91 HA THR 91 2.634 -15.461 5.201 724 HB THR 91 HB THR 91 3.290 -12.534 5.783 725 HG1 THR 91 HG1 THR 91 4.436 -13.055 3.966 726 HG21 THR 91 HG21 THR 91 3.370 -14.022 7.740 727 HG22 THR 91 HG22 THR 91 4.997 -13.516 7.257 728 HG23 THR 91 HG23 THR 91 4.420 -15.146 6.852 729 H VAL 92 H VAL 92 0.740 -12.364 5.287 730 HA VAL 92 HA VAL 92 -0.353 -12.745 7.888 731 HB VAL 92 HB VAL 92 -1.604 -11.366 5.446 732 HG11 VAL 92 HG11 VAL 92 -2.957 -10.096 7.164 733 HG12 VAL 92 HG12 VAL 92 -3.385 -11.810 7.053 734 HG13 VAL 92 HG13 VAL 92 -2.377 -11.233 8.401 735 HG21 VAL 92 HG21 VAL 92 -0.781 -9.303 6.438 736 HG22 VAL 92 HG22 VAL 92 -0.114 -10.204 7.821 737 HG23 VAL 92 HG23 VAL 92 0.567 -10.418 6.202 738 H ILE 93 H ILE 93 -1.607 -13.833 4.698 739 HA ILE 93 HA ILE 93 -4.059 -14.797 5.834 740 HB ILE 93 HB ILE 93 -4.405 -15.956 3.708 741 HG12 ILE 93 HG12 ILE 93 -2.371 -15.096 2.031 742 HG13 ILE 93 HG13 ILE 93 -1.510 -15.638 3.464 743 HG21 ILE 93 HG21 ILE 93 -4.497 -13.948 2.299 744 HG22 ILE 93 HG22 ILE 93 -4.900 -13.513 3.964 745 HG23 ILE 93 HG23 ILE 93 -3.292 -13.139 3.314 746 HD11 ILE 93 HD11 ILE 93 -2.625 -17.848 3.316 747 HD12 ILE 93 HD12 ILE 93 -3.492 -17.300 1.861 748 HD13 ILE 93 HD13 ILE 93 -1.719 -17.458 1.837 749 H SER 94 H SER 94 -0.929 -16.174 5.879 750 HA SER 94 HA SER 94 -1.809 -18.935 6.008 751 HB2 SER 94 HB2 SER 94 0.497 -18.129 5.333 752 HB3 SER 94 HB3 SER 94 0.798 -17.779 7.050 753 HG SER 94 HG SER 94 0.316 -20.001 7.471 754 H ALA 95 H ALA 95 -1.990 -16.350 8.243 755 HA ALA 95 HA ALA 95 -1.621 -17.991 10.637 756 HB1 ALA 95 HB1 ALA 95 -2.179 -15.936 11.836 757 HB2 ALA 95 HB2 ALA 95 -1.022 -15.581 10.538 758 HB3 ALA 95 HB3 ALA 95 -2.736 -15.172 10.326 759 H LYS 96 H LYS 96 -4.098 -18.047 8.467 760 HA LYS 96 HA LYS 96 -6.123 -18.640 10.585 761 HB2 LYS 96 HB2 LYS 96 -6.387 -16.763 8.212 762 HB3 LYS 96 HB3 LYS 96 -7.798 -17.482 8.979 763 HG2 LYS 96 HG2 LYS 96 -5.774 -15.708 10.406 764 HG3 LYS 96 HG3 LYS 96 -7.346 -15.177 9.787 765 HD2 LYS 96 HD2 LYS 96 -8.481 -16.815 11.295 766 HD3 LYS 96 HD3 LYS 96 -6.899 -17.284 11.951 767 HE2 LYS 96 HE2 LYS 96 -6.527 -14.955 12.712 768 HE3 LYS 96 HE3 LYS 96 -8.143 -14.514 12.109 769 HZ1 LYS 96 HZ1 LYS 96 -9.085 -16.136 13.656 770 HZ2 LYS 96 HZ2 LYS 96 -8.189 -15.021 14.476 771 HZ3 LYS 96 HZ3 LYS 96 -7.586 -16.534 14.216 772 HA PRO 97 HA PRO 97 -6.925 -22.124 8.100 773 HB2 PRO 97 HB2 PRO 97 -9.665 -22.306 7.821 774 HB3 PRO 97 HB3 PRO 97 -8.803 -22.719 9.340 775 HG2 PRO 97 HG2 PRO 97 -10.127 -20.136 8.569 776 HG3 PRO 97 HG3 PRO 97 -10.347 -21.121 10.054 777 HD2 PRO 97 HD2 PRO 97 -8.719 -19.021 10.077 778 HD3 PRO 97 HD3 PRO 97 -8.205 -20.548 10.873 779 H LYS 98 H LYS 98 -7.148 -22.694 5.978 780 HA LYS 98 HA LYS 98 -6.707 -20.543 4.198 781 HB2 LYS 98 HB2 LYS 98 -7.397 -23.410 3.465 782 HB3 LYS 98 HB3 LYS 98 -6.500 -22.252 2.478 783 HG2 LYS 98 HG2 LYS 98 -5.549 -23.416 5.141 784 HG3 LYS 98 HG3 LYS 98 -5.044 -23.975 3.544 785 HD2 LYS 98 HD2 LYS 98 -3.968 -21.834 3.070 786 HD3 LYS 98 HD3 LYS 98 -4.586 -21.144 4.582 787 HE2 LYS 98 HE2 LYS 98 -2.240 -21.779 4.856 788 HE3 LYS 98 HE3 LYS 98 -3.283 -22.757 5.900 789 HZ1 LYS 98 HZ1 LYS 98 -1.603 -24.103 4.805 790 HZ2 LYS 98 HZ2 LYS 98 -2.142 -23.656 3.311 791 HZ3 LYS 98 HZ3 LYS 98 -3.103 -24.565 4.297 792 H ASP 99 H ASP 99 -9.649 -22.328 4.896 793 HA ASP 99 HA ASP 99 -11.027 -21.720 2.491 794 HB2 ASP 99 HB2 ASP 99 -11.625 -23.489 4.150 795 HB3 ASP 99 HB3 ASP 99 -12.208 -22.220 5.239 796 H GLU 100 H GLU 100 -11.604 -20.203 5.745 797 HA GLU 100 HA GLU 100 -13.305 -18.170 4.729 798 HB2 GLU 100 HB2 GLU 100 -11.379 -18.038 7.086 799 HB3 GLU 100 HB3 GLU 100 -12.738 -16.947 6.815 800 HG2 GLU 100 HG2 GLU 100 -14.307 -18.783 7.156 801 HG3 GLU 100 HG3 GLU 100 -12.956 -19.924 7.323 802 H LYS 101 H LYS 101 -9.801 -18.302 5.181 803 HA LYS 101 HA LYS 101 -9.419 -15.512 4.663 804 HB2 LYS 101 HB2 LYS 101 -7.983 -17.301 5.931 805 HB3 LYS 101 HB3 LYS 101 -7.225 -17.525 4.349 806 HG2 LYS 101 HG2 LYS 101 -5.961 -15.963 5.589 807 HG3 LYS 101 HG3 LYS 101 -6.794 -15.092 4.293 808 HD2 LYS 101 HD2 LYS 101 -8.386 -14.143 5.854 809 HD3 LYS 101 HD3 LYS 101 -7.865 -15.237 7.148 810 HE2 LYS 101 HE2 LYS 101 -5.680 -14.138 7.253 811 HE3 LYS 101 HE3 LYS 101 -6.109 -13.104 5.880 812 HZ1 LYS 101 HZ1 LYS 101 -7.852 -12.100 7.248 813 HZ2 LYS 101 HZ2 LYS 101 -6.387 -11.933 7.984 814 HZ3 LYS 101 HZ3 LYS 101 -7.461 -13.062 8.527 815 H LYS 102 H LYS 102 -9.978 -18.091 2.579 816 HA LYS 102 HA LYS 102 -8.668 -17.399 0.164 817 HB2 LYS 102 HB2 LYS 102 -10.159 -19.374 0.414 818 HB3 LYS 102 HB3 LYS 102 -11.533 -18.292 0.632 819 HG2 LYS 102 HG2 LYS 102 -11.817 -18.968 -1.528 820 HG3 LYS 102 HG3 LYS 102 -11.015 -17.412 -1.739 821 HD2 LYS 102 HD2 LYS 102 -8.832 -18.658 -1.973 822 HD3 LYS 102 HD3 LYS 102 -9.764 -20.169 -1.929 823 HE2 LYS 102 HE2 LYS 102 -9.936 -17.934 -3.992 824 HE3 LYS 102 HE3 LYS 102 -9.366 -19.595 -4.252 825 HZ1 LYS 102 HZ1 LYS 102 -12.130 -18.638 -3.808 826 HZ2 LYS 102 HZ2 LYS 102 -11.741 -20.234 -3.588 827 HZ3 LYS 102 HZ3 LYS 102 -11.551 -19.529 -5.068 828 H SER 103 H SER 103 -11.591 -15.995 1.707 829 HA SER 103 HA SER 103 -12.390 -14.282 -0.372 830 HB2 SER 103 HB2 SER 103 -13.671 -14.598 1.698 831 HB3 SER 103 HB3 SER 103 -12.403 -13.778 2.630 832 HG SER 103 HG SER 103 -13.961 -12.624 0.546 833 H LEU 104 H LEU 104 -9.815 -13.743 2.069 834 HA LEU 104 HA LEU 104 -9.316 -11.028 1.229 835 HB2 LEU 104 HB2 LEU 104 -8.495 -12.585 3.334 836 HB3 LEU 104 HB3 LEU 104 -7.043 -12.592 2.328 837 HG LEU 104 HG LEU 104 -8.507 -10.158 3.362 838 HD11 LEU 104 HD11 LEU 104 -7.314 -11.359 5.105 839 HD12 LEU 104 HD12 LEU 104 -6.512 -9.818 4.763 840 HD13 LEU 104 HD13 LEU 104 -5.819 -11.331 4.133 841 HD21 LEU 104 HD21 LEU 104 -6.010 -10.331 1.667 842 HD22 LEU 104 HD22 LEU 104 -6.463 -8.890 2.610 843 HD23 LEU 104 HD23 LEU 104 -7.519 -9.466 1.311 844 H GLN 105 H GLN 105 -7.943 -14.213 0.362 845 HA GLN 105 HA GLN 105 -5.835 -13.110 -1.241 846 HB2 GLN 105 HB2 GLN 105 -7.149 -15.833 -1.174 847 HB3 GLN 105 HB3 GLN 105 -5.804 -15.442 -2.253 848 HG2 GLN 105 HG2 GLN 105 -5.690 -15.171 0.767 849 HG3 GLN 105 HG3 GLN 105 -5.116 -16.576 -0.140 850 HE21 GLN 105 HE21 GLN 105 -3.169 -16.515 -1.156 851 HE22 GLN 105 HE22 GLN 105 -2.087 -15.141 -1.097 852 H GLU 106 H GLU 106 -9.231 -13.734 -1.932 853 HA GLU 106 HA GLU 106 -8.876 -13.508 -4.805 854 HB2 GLU 106 HB2 GLU 106 -11.288 -13.191 -3.001 855 HB3 GLU 106 HB3 GLU 106 -11.349 -13.054 -4.771 856 HG2 GLU 106 HG2 GLU 106 -10.420 -15.340 -4.976 857 HG3 GLU 106 HG3 GLU 106 -10.397 -15.488 -3.218 858 H LEU 107 H LEU 107 -9.485 -11.179 -2.132 859 HA LEU 107 HA LEU 107 -9.723 -8.900 -3.916 860 HB2 LEU 107 HB2 LEU 107 -8.722 -8.989 -1.051 861 HB3 LEU 107 HB3 LEU 107 -9.113 -7.545 -1.960 862 HG LEU 107 HG LEU 107 -11.055 -9.603 -0.928 863 HD11 LEU 107 HD11 LEU 107 -10.099 -8.073 0.730 864 HD12 LEU 107 HD12 LEU 107 -11.815 -7.707 0.444 865 HD13 LEU 107 HD13 LEU 107 -10.557 -6.681 -0.275 866 HD21 LEU 107 HD21 LEU 107 -12.827 -8.051 -1.757 867 HD22 LEU 107 HD22 LEU 107 -11.904 -8.787 -3.079 868 HD23 LEU 107 HD23 LEU 107 -11.580 -7.102 -2.594 869 H THR 108 H THR 108 -7.017 -10.483 -2.188 870 HA THR 108 HA THR 108 -4.959 -8.685 -2.931 871 HB THR 108 HB THR 108 -4.687 -11.732 -2.688 872 HG1 THR 108 HG1 THR 108 -4.470 -11.377 -0.495 873 HG21 THR 108 HG21 THR 108 -2.631 -10.589 -3.454 874 HG22 THR 108 HG22 THR 108 -2.441 -11.213 -1.799 875 HG23 THR 108 HG23 THR 108 -2.733 -9.476 -2.071 876 H SER 109 H SER 109 -6.517 -11.337 -4.739 877 HA SER 109 HA SER 109 -4.643 -11.137 -6.959 878 HB2 SER 109 HB2 SER 109 -7.403 -12.400 -6.825 879 HB3 SER 109 HB3 SER 109 -6.187 -12.656 -8.098 880 HG SER 109 HG SER 109 -6.074 -13.389 -5.348 881 H LYS 110 H LYS 110 -7.955 -9.912 -6.309 882 HA LYS 110 HA LYS 110 -8.444 -8.791 -8.885 883 HB2 LYS 110 HB2 LYS 110 -10.055 -9.135 -6.921 884 HB3 LYS 110 HB3 LYS 110 -9.357 -7.689 -6.198 885 HG2 LYS 110 HG2 LYS 110 -11.202 -6.776 -7.220 886 HG3 LYS 110 HG3 LYS 110 -10.000 -6.563 -8.499 887 HD2 LYS 110 HD2 LYS 110 -11.906 -7.421 -9.594 888 HD3 LYS 110 HD3 LYS 110 -10.826 -8.820 -9.432 889 HE2 LYS 110 HE2 LYS 110 -12.090 -9.550 -7.414 890 HE3 LYS 110 HE3 LYS 110 -13.148 -8.133 -7.569 891 HZ1 LYS 110 HZ1 LYS 110 -13.884 -8.992 -9.705 892 HZ2 LYS 110 HZ2 LYS 110 -14.150 -10.112 -8.524 893 HZ3 LYS 110 HZ3 LYS 110 -12.891 -10.304 -9.573 894 H LEU 111 H LEU 111 -6.880 -7.485 -5.993 895 HA LEU 111 HA LEU 111 -6.538 -4.813 -6.824 896 HB2 LEU 111 HB2 LEU 111 -6.207 -5.853 -4.578 897 HB3 LEU 111 HB3 LEU 111 -4.713 -6.567 -5.139 898 HG LEU 111 HG LEU 111 -5.140 -3.572 -4.961 899 HD11 LEU 111 HD11 LEU 111 -3.937 -3.850 -2.767 900 HD12 LEU 111 HD12 LEU 111 -4.165 -5.596 -2.914 901 HD13 LEU 111 HD13 LEU 111 -5.574 -4.510 -2.796 902 HD21 LEU 111 HD21 LEU 111 -2.690 -3.509 -4.759 903 HD22 LEU 111 HD22 LEU 111 -3.197 -4.209 -6.298 904 HD23 LEU 111 HD23 LEU 111 -2.623 -5.268 -4.993 905 H PHE 112 H PHE 112 -4.445 -7.681 -7.350 906 HA PHE 112 HA PHE 112 -2.415 -6.102 -8.653 907 HB2 PHE 112 HB2 PHE 112 -2.926 -9.052 -8.364 908 HB3 PHE 112 HB3 PHE 112 -1.650 -8.443 -9.429 909 HD1 PHE 112 HD1 PHE 112 -2.826 -7.512 -5.943 910 HD2 PHE 112 HD2 PHE 112 0.468 -8.588 -8.490 911 HE1 PHE 112 HE1 PHE 112 -1.297 -7.263 -4.028 912 HE2 PHE 112 HE2 PHE 112 2.021 -8.334 -6.553 913 HZ PHE 112 HZ PHE 112 1.119 -7.667 -4.317 914 H SER 113 H SER 113 -5.353 -7.698 -9.820 915 HA SER 113 HA SER 113 -4.631 -7.571 -12.603 916 HB2 SER 113 HB2 SER 113 -7.392 -7.298 -11.350 917 HB3 SER 113 HB3 SER 113 -7.028 -7.743 -13.029 918 HG SER 113 HG SER 113 -5.866 -9.572 -12.104 919 H SER 114 H SER 114 -6.014 -5.188 -10.305 920 HA SER 114 HA SER 114 -6.435 -3.235 -12.420 921 HB2 SER 114 HB2 SER 114 -6.950 -1.657 -10.658 922 HB3 SER 114 HB3 SER 114 -7.769 -3.197 -10.358 923 HG SER 114 HG SER 114 -5.703 -3.574 -9.005 924 H ILE 115 H ILE 115 -3.707 -4.165 -10.417 925 HA ILE 115 HA ILE 115 -2.100 -1.802 -10.931 926 HB ILE 115 HB ILE 115 -1.393 -4.675 -10.163 927 HG12 ILE 115 HG12 ILE 115 -1.110 -2.033 -8.688 928 HG13 ILE 115 HG13 ILE 115 -2.439 -3.171 -8.468 929 HG21 ILE 115 HG21 ILE 115 0.558 -2.381 -10.650 930 HG22 ILE 115 HG22 ILE 115 0.984 -3.921 -9.875 931 HG23 ILE 115 HG23 ILE 115 0.471 -3.898 -11.564 932 HD11 ILE 115 HD11 ILE 115 -0.911 -3.509 -6.660 933 HD12 ILE 115 HD12 ILE 115 -0.716 -4.902 -7.743 934 HD13 ILE 115 HD13 ILE 115 0.481 -3.583 -7.744 935 H ASP 116 H ASP 116 -2.539 -4.981 -12.554 936 HA ASP 116 HA ASP 116 -0.584 -4.524 -14.583 937 HB2 ASP 116 HB2 ASP 116 -3.107 -6.218 -14.531 938 HB3 ASP 116 HB3 ASP 116 -1.983 -6.200 -15.898 939 H ASN 117 H ASN 117 -4.020 -3.617 -14.345 940 HA ASN 117 HA ASN 117 -4.220 -2.651 -17.042 941 HB2 ASN 117 HB2 ASN 117 -5.740 -1.892 -14.518 942 HB3 ASN 117 HB3 ASN 117 -6.139 -1.307 -16.135 943 HD21 ASN 117 HD21 ASN 117 -7.869 -2.785 -14.463 944 HD22 ASN 117 HD22 ASN 117 -8.202 -4.291 -15.283 945 H LEU 118 H LEU 118 -3.220 -1.081 -13.978 946 HA LEU 118 HA LEU 118 -3.024 1.562 -15.124 947 HB2 LEU 118 HB2 LEU 118 -2.935 0.513 -12.612 948 HB3 LEU 118 HB3 LEU 118 -1.231 0.844 -12.874 949 HG LEU 118 HG LEU 118 -3.445 2.907 -13.110 950 HD11 LEU 118 HD11 LEU 118 -1.545 2.285 -10.827 951 HD12 LEU 118 HD12 LEU 118 -3.309 2.066 -10.840 952 HD13 LEU 118 HD13 LEU 118 -2.620 3.697 -10.910 953 HD21 LEU 118 HD21 LEU 118 -1.459 3.551 -14.383 954 HD22 LEU 118 HD22 LEU 118 -0.443 3.253 -12.958 955 HD23 LEU 118 HD23 LEU 118 -1.644 4.561 -12.939 956 H ASP 119 H ASP 119 -0.772 -1.182 -14.782 957 HA ASP 119 HA ASP 119 1.580 0.195 -15.696 958 HB2 ASP 119 HB2 ASP 119 2.175 -1.825 -14.807 959 HB3 ASP 119 HB3 ASP 119 0.687 -2.625 -15.341 960 H HIS 120 H HIS 120 -0.993 -1.623 -17.464 961 HA HIS 120 HA HIS 120 0.217 -1.171 -20.036 962 HB2 HIS 120 HB2 HIS 120 -2.579 -1.869 -19.137 963 HB3 HIS 120 HB3 HIS 120 -2.209 -1.541 -20.834 964 HD1 HIS 120 HD1 HIS 120 -1.289 -4.012 -18.071 965 HD2 HIS 120 HD2 HIS 120 -0.981 -3.543 -22.208 966 HE1 HIS 120 HE1 HIS 120 -0.446 -6.209 -19.007 967 H ALA 121 H ALA 121 -2.126 0.723 -18.102 968 HA ALA 121 HA ALA 121 -2.684 2.639 -20.148 969 HB1 ALA 121 HB1 ALA 121 -3.379 4.088 -18.286 970 HB2 ALA 121 HB2 ALA 121 -4.024 2.440 -18.119 971 HB3 ALA 121 HB3 ALA 121 -2.639 2.960 -17.129 972 H ALA 122 H ALA 122 -0.063 2.360 -17.757 973 HA ALA 122 HA ALA 122 1.080 4.935 -18.313 974 HB1 ALA 122 HB1 ALA 122 1.599 3.579 -16.296 975 HB2 ALA 122 HB2 ALA 122 2.430 2.388 -17.320 976 HB3 ALA 122 HB3 ALA 122 3.069 4.040 -17.186 977 H LYS 123 H LYS 123 1.740 1.626 -19.553 978 HA LYS 123 HA LYS 123 3.895 2.453 -21.250 979 HB2 LYS 123 HB2 LYS 123 2.068 0.066 -21.068 980 HB3 LYS 123 HB3 LYS 123 3.075 0.248 -22.510 981 HG2 LYS 123 HG2 LYS 123 4.970 -0.311 -21.439 982 HG3 LYS 123 HG3 LYS 123 4.564 0.641 -20.002 983 HD2 LYS 123 HD2 LYS 123 4.727 -1.715 -19.421 984 HD3 LYS 123 HD3 LYS 123 3.070 -1.152 -19.222 985 HE2 LYS 123 HE2 LYS 123 2.460 -2.173 -21.398 986 HE3 LYS 123 HE3 LYS 123 4.128 -2.777 -21.559 987 HZ1 LYS 123 HZ1 LYS 123 2.327 -3.419 -19.281 988 HZ2 LYS 123 HZ2 LYS 123 3.814 -4.065 -19.566 989 HZ3 LYS 123 HZ3 LYS 123 2.557 -4.411 -20.584 990 H ILE 124 H ILE 124 0.380 2.381 -21.761 991 HA ILE 124 HA ILE 124 0.714 2.962 -24.616 992 HB ILE 124 HB ILE 124 -1.223 1.606 -23.422 993 HG12 ILE 124 HG12 ILE 124 -2.805 2.345 -25.296 994 HG13 ILE 124 HG13 ILE 124 -1.545 3.484 -25.774 995 HG21 ILE 124 HG21 ILE 124 -1.940 3.540 -21.983 996 HG22 ILE 124 HG22 ILE 124 -2.495 4.374 -23.447 997 HG23 ILE 124 HG23 ILE 124 -3.242 2.839 -22.953 998 HD11 ILE 124 HD11 ILE 124 0.029 1.616 -26.160 999 HD12 ILE 124 HD12 ILE 124 -1.194 0.454 -25.588 1000 HD13 ILE 124 HD13 ILE 124 -1.467 1.372 -27.088 1001 H LYS 125 H LYS 125 1.322 4.727 -22.004 1002 HA LYS 125 HA LYS 125 1.784 6.925 -21.690 1003 HB2 LYS 125 HB2 LYS 125 2.433 6.485 -24.199 1004 HB3 LYS 125 HB3 LYS 125 1.061 7.533 -24.550 1005 HG2 LYS 125 HG2 LYS 125 2.150 9.318 -23.173 1006 HG3 LYS 125 HG3 LYS 125 3.554 8.242 -22.989 1007 HD2 LYS 125 HD2 LYS 125 3.763 8.114 -25.450 1008 HD3 LYS 125 HD3 LYS 125 2.373 9.205 -25.617 1009 HE2 LYS 125 HE2 LYS 125 3.618 10.962 -24.394 1010 HE3 LYS 125 HE3 LYS 125 5.022 9.871 -24.282 1011 HZ1 LYS 125 HZ1 LYS 125 3.787 10.832 -26.807 1012 HZ2 LYS 125 HZ2 LYS 125 5.084 9.818 -26.708 1013 HZ3 LYS 125 HZ3 LYS 125 5.212 11.374 -26.176 1014 H SER 126 H SER 126 -1.019 5.969 -21.346 1015 HA SER 126 HA SER 126 -2.520 8.463 -21.967 1016 HB2 SER 126 HB2 SER 126 -3.602 6.449 -22.710 1017 HB3 SER 126 HB3 SER 126 -3.491 5.753 -21.072 1018 HG SER 126 HG SER 126 -5.542 6.896 -21.711 1019 HA PRO 127 HA PRO 127 -2.036 9.151 -17.554 1020 HB2 PRO 127 HB2 PRO 127 -2.831 11.754 -17.425 1021 HB3 PRO 127 HB3 PRO 127 -1.203 11.282 -18.010 1022 HG2 PRO 127 HG2 PRO 127 -3.669 11.927 -19.609 1023 HG3 PRO 127 HG3 PRO 127 -2.003 12.561 -19.799 1024 HD2 PRO 127 HD2 PRO 127 -2.956 10.518 -21.317 1025 HD3 PRO 127 HD3 PRO 127 -1.239 10.581 -20.784 1026 H THR 128 H THR 128 -4.869 9.749 -19.626 1027 HA THR 128 HA THR 128 -6.749 10.206 -17.496 1028 HB THR 128 HB THR 128 -8.372 9.313 -19.374 1029 HG1 THR 128 HG1 THR 128 -7.282 8.500 -20.995 1030 HG21 THR 128 HG21 THR 128 -8.049 11.718 -18.830 1031 HG22 THR 128 HG22 THR 128 -8.217 11.453 -20.580 1032 HG23 THR 128 HG23 THR 128 -6.611 11.750 -19.880 1033 H GLU 129 H GLU 129 -5.740 7.319 -19.346 1034 HA GLU 129 HA GLU 129 -7.561 5.602 -17.876 1035 HB2 GLU 129 HB2 GLU 129 -5.372 5.237 -19.882 1036 HB3 GLU 129 HB3 GLU 129 -5.917 3.835 -18.944 1037 HG2 GLU 129 HG2 GLU 129 -7.170 3.883 -21.002 1038 HG3 GLU 129 HG3 GLU 129 -8.256 4.293 -19.664 1039 H ALA 130 H ALA 130 -4.220 6.701 -17.483 1040 HA ALA 130 HA ALA 130 -3.493 4.788 -15.464 1041 HB1 ALA 130 HB1 ALA 130 -1.811 6.472 -14.807 1042 HB2 ALA 130 HB2 ALA 130 -1.840 6.257 -16.571 1043 HB3 ALA 130 HB3 ALA 130 -2.600 7.686 -15.827 1044 H GLU 131 H GLU 131 -5.127 8.020 -15.315 1045 HA GLU 131 HA GLU 131 -5.442 7.917 -12.445 1046 HB2 GLU 131 HB2 GLU 131 -6.830 9.486 -14.627 1047 HB3 GLU 131 HB3 GLU 131 -7.326 9.579 -12.932 1048 HG2 GLU 131 HG2 GLU 131 -4.909 10.129 -12.382 1049 HG3 GLU 131 HG3 GLU 131 -4.671 10.385 -14.118 1050 H LYS 132 H LYS 132 -7.385 6.727 -15.172 1051 HA LYS 132 HA LYS 132 -9.758 6.148 -13.705 1052 HB2 LYS 132 HB2 LYS 132 -9.260 6.032 -16.262 1053 HB3 LYS 132 HB3 LYS 132 -8.671 4.408 -15.941 1054 HG2 LYS 132 HG2 LYS 132 -10.874 4.047 -16.614 1055 HG3 LYS 132 HG3 LYS 132 -10.974 3.976 -14.848 1056 HD2 LYS 132 HD2 LYS 132 -12.826 5.299 -15.576 1057 HD3 LYS 132 HD3 LYS 132 -11.650 6.442 -14.903 1058 HE2 LYS 132 HE2 LYS 132 -10.840 6.936 -17.222 1059 HE3 LYS 132 HE3 LYS 132 -12.052 5.813 -17.867 1060 HZ1 LYS 132 HZ1 LYS 132 -13.771 7.237 -16.929 1061 HZ2 LYS 132 HZ2 LYS 132 -12.811 8.097 -17.960 1062 HZ3 LYS 132 HZ3 LYS 132 -12.638 8.277 -16.329 1063 H TYR 133 H TYR 133 -6.869 4.126 -14.377 1064 HA TYR 133 HA TYR 133 -7.945 1.977 -12.709 1065 HB2 TYR 133 HB2 TYR 133 -5.245 2.348 -14.020 1066 HB3 TYR 133 HB3 TYR 133 -5.788 0.873 -13.205 1067 HD1 TYR 133 HD1 TYR 133 -8.472 0.370 -14.102 1068 HD2 TYR 133 HD2 TYR 133 -5.218 2.074 -16.334 1069 HE1 TYR 133 HE1 TYR 133 -9.547 -0.357 -16.230 1070 HE2 TYR 133 HE2 TYR 133 -6.293 1.336 -18.458 1071 HH TYR 133 HH TYR 133 -8.069 0.260 -19.417 1072 H TYR 134 H TYR 134 -5.936 4.796 -12.197 1073 HA TYR 134 HA TYR 134 -4.742 3.951 -9.723 1074 HB2 TYR 134 HB2 TYR 134 -3.969 5.971 -10.793 1075 HB3 TYR 134 HB3 TYR 134 -5.587 6.669 -10.748 1076 HD1 TYR 134 HD1 TYR 134 -2.872 5.438 -8.457 1077 HD2 TYR 134 HD2 TYR 134 -6.265 8.038 -8.972 1078 HE1 TYR 134 HE1 TYR 134 -2.419 6.485 -6.246 1079 HE2 TYR 134 HE2 TYR 134 -5.799 9.078 -6.757 1080 HH TYR 134 HH TYR 134 -4.483 9.085 -4.907 1081 H GLY 135 H GLY 135 -7.905 5.475 -10.554 1082 HA2 GLY 135 HA2 GLY 135 -8.841 5.643 -7.873 1083 HA3 GLY 135 HA3 GLY 135 -9.863 5.497 -9.314 1084 H GLN 136 H GLN 136 -8.878 2.922 -10.190 1085 HA GLN 136 HA GLN 136 -10.500 1.254 -8.470 1086 HB2 GLN 136 HB2 GLN 136 -8.640 0.530 -10.764 1087 HB3 GLN 136 HB3 GLN 136 -9.731 -0.595 -9.944 1088 HG2 GLN 136 HG2 GLN 136 -11.640 0.931 -10.589 1089 HG3 GLN 136 HG3 GLN 136 -10.496 1.813 -11.612 1090 HE21 GLN 136 HE21 GLN 136 -12.887 0.307 -12.367 1091 HE22 GLN 136 HE22 GLN 136 -12.341 -0.940 -13.464 1092 H THR 137 H THR 137 -6.943 1.606 -8.932 1093 HA THR 137 HA THR 137 -6.324 -0.627 -7.218 1094 HB THR 137 HB THR 137 -4.057 0.549 -6.929 1095 HG1 THR 137 HG1 THR 137 -5.079 2.224 -8.986 1096 HG21 THR 137 HG21 THR 137 -4.326 -1.151 -8.637 1097 HG22 THR 137 HG22 THR 137 -3.369 0.192 -9.287 1098 HG23 THR 137 HG23 THR 137 -5.078 0.020 -9.745 1099 H VAL 138 H VAL 138 -6.782 2.894 -6.595 1100 HA VAL 138 HA VAL 138 -6.096 2.809 -3.834 1101 HB VAL 138 HB VAL 138 -8.104 4.552 -5.343 1102 HG11 VAL 138 HG11 VAL 138 -7.138 4.803 -2.458 1103 HG12 VAL 138 HG12 VAL 138 -7.952 6.106 -3.357 1104 HG13 VAL 138 HG13 VAL 138 -8.812 4.593 -3.019 1105 HG21 VAL 138 HG21 VAL 138 -6.378 6.238 -5.318 1106 HG22 VAL 138 HG22 VAL 138 -5.359 5.278 -4.230 1107 HG23 VAL 138 HG23 VAL 138 -5.618 4.746 -5.896 1108 H SER 139 H SER 139 -9.260 2.183 -5.448 1109 HA SER 139 HA SER 139 -10.696 1.735 -3.019 1110 HB2 SER 139 HB2 SER 139 -11.729 2.053 -5.276 1111 HB3 SER 139 HB3 SER 139 -11.178 0.428 -5.726 1112 HG SER 139 HG SER 139 -12.500 -0.432 -4.095 1113 H ASN 140 H ASN 140 -8.965 -0.540 -5.191 1114 HA ASN 140 HA ASN 140 -9.640 -2.886 -3.695 1115 HB2 ASN 140 HB2 ASN 140 -7.533 -2.164 -5.719 1116 HB3 ASN 140 HB3 ASN 140 -7.378 -3.666 -4.803 1117 HD21 ASN 140 HD21 ASN 140 -9.366 -1.913 -7.099 1118 HD22 ASN 140 HD22 ASN 140 -10.235 -3.325 -7.664 1119 H ILE 141 H ILE 141 -6.920 -0.568 -3.393 1120 HA ILE 141 HA ILE 141 -5.463 -2.113 -1.452 1121 HB ILE 141 HB ILE 141 -5.557 0.907 -1.996 1122 HG12 ILE 141 HG12 ILE 141 -4.498 -0.660 -3.680 1123 HG13 ILE 141 HG13 ILE 141 -3.466 0.630 -3.076 1124 HG21 ILE 141 HG21 ILE 141 -3.408 0.947 -0.535 1125 HG22 ILE 141 HG22 ILE 141 -4.976 0.890 0.294 1126 HG23 ILE 141 HG23 ILE 141 -4.007 -0.588 0.143 1127 HD11 ILE 141 HD11 ILE 141 -3.340 -2.099 -1.799 1128 HD12 ILE 141 HD12 ILE 141 -2.518 -1.776 -3.339 1129 HD13 ILE 141 HD13 ILE 141 -2.106 -0.837 -1.902 1130 H ASN 142 H ASN 142 -7.970 0.447 -1.152 1131 HA ASN 142 HA ASN 142 -8.020 0.495 1.678 1132 HB2 ASN 142 HB2 ASN 142 -9.151 2.117 0.147 1133 HB3 ASN 142 HB3 ASN 142 -10.359 0.876 -0.222 1134 HD21 ASN 142 HD21 ASN 142 -12.188 1.318 0.769 1135 HD22 ASN 142 HD22 ASN 142 -12.334 1.870 2.422 1136 H GLU 143 H GLU 143 -9.871 -1.586 -0.601 1137 HA GLU 143 HA GLU 143 -11.445 -2.804 1.448 1138 HB2 GLU 143 HB2 GLU 143 -10.597 -3.768 -1.301 1139 HB3 GLU 143 HB3 GLU 143 -11.735 -4.647 -0.273 1140 HG2 GLU 143 HG2 GLU 143 -13.298 -2.790 -0.322 1141 HG3 GLU 143 HG3 GLU 143 -12.147 -1.804 -1.235 1142 H VAL 144 H VAL 144 -8.305 -3.741 0.018 1143 HA VAL 144 HA VAL 144 -8.123 -6.199 1.542 1144 HB VAL 144 HB VAL 144 -6.043 -4.440 0.147 1145 HG11 VAL 144 HG11 VAL 144 -4.431 -6.335 0.463 1146 HG12 VAL 144 HG12 VAL 144 -4.847 -5.520 1.980 1147 HG13 VAL 144 HG13 VAL 144 -5.583 -7.089 1.588 1148 HG21 VAL 144 HG21 VAL 144 -7.577 -5.691 -1.316 1149 HG22 VAL 144 HG22 VAL 144 -5.947 -6.382 -1.409 1150 HG23 VAL 144 HG23 VAL 144 -7.195 -7.198 -0.449 1151 H LEU 145 H LEU 145 -7.273 -2.779 2.140 1152 HA LEU 145 HA LEU 145 -5.648 -3.283 4.450 1153 HB2 LEU 145 HB2 LEU 145 -6.282 -1.089 2.949 1154 HB3 LEU 145 HB3 LEU 145 -7.183 -0.752 4.416 1155 HG LEU 145 HG LEU 145 -4.220 -1.426 4.368 1156 HD11 LEU 145 HD11 LEU 145 -5.553 1.309 4.386 1157 HD12 LEU 145 HD12 LEU 145 -4.651 0.591 3.030 1158 HD13 LEU 145 HD13 LEU 145 -3.807 0.989 4.538 1159 HD21 LEU 145 HD21 LEU 145 -5.168 -1.745 6.567 1160 HD22 LEU 145 HD22 LEU 145 -6.038 -0.196 6.479 1161 HD23 LEU 145 HD23 LEU 145 -4.263 -0.219 6.581 1162 H ALA 146 H ALA 146 -9.149 -2.792 4.040 1163 HA ALA 146 HA ALA 146 -9.735 -2.653 6.851 1164 HB1 ALA 146 HB1 ALA 146 -12.049 -3.173 6.144 1165 HB2 ALA 146 HB2 ALA 146 -11.321 -1.949 5.074 1166 HB3 ALA 146 HB3 ALA 146 -11.461 -3.639 4.528 1167 H LYS 147 H LYS 147 -8.990 -5.333 4.716 1168 HA LYS 147 HA LYS 147 -9.963 -7.347 6.649 1169 HB2 LYS 147 HB2 LYS 147 -8.230 -7.633 4.186 1170 HB3 LYS 147 HB3 LYS 147 -8.990 -8.947 5.081 1171 HG2 LYS 147 HG2 LYS 147 -10.546 -6.783 3.639 1172 HG3 LYS 147 HG3 LYS 147 -10.100 -8.331 2.923 1173 HD2 LYS 147 HD2 LYS 147 -11.351 -9.502 4.718 1174 HD3 LYS 147 HD3 LYS 147 -11.875 -7.921 5.348 1175 HE2 LYS 147 HE2 LYS 147 -12.907 -7.401 3.152 1176 HE3 LYS 147 HE3 LYS 147 -12.393 -8.982 2.535 1177 HZ1 LYS 147 HZ1 LYS 147 -14.698 -9.006 3.252 1178 HZ2 LYS 147 HZ2 LYS 147 -14.276 -8.559 4.783 1179 HZ3 LYS 147 HZ3 LYS 147 -13.807 -10.028 4.193 1180 H LEU 148 H LEU 148 -7.276 -5.362 6.338 1181 HA LEU 148 HA LEU 148 -5.480 -7.224 7.837 1182 HB2 LEU 148 HB2 LEU 148 -4.937 -4.529 6.540 1183 HB3 LEU 148 HB3 LEU 148 -3.753 -5.476 7.426 1184 HG LEU 148 HG LEU 148 -5.061 -6.388 4.856 1185 HD11 LEU 148 HD11 LEU 148 -3.721 -4.370 4.492 1186 HD12 LEU 148 HD12 LEU 148 -2.883 -5.780 3.826 1187 HD13 LEU 148 HD13 LEU 148 -2.356 -5.089 5.378 1188 HD21 LEU 148 HD21 LEU 148 -2.664 -7.441 6.399 1189 HD22 LEU 148 HD22 LEU 148 -3.209 -8.019 4.807 1190 HD23 LEU 148 HD23 LEU 148 -4.243 -8.244 6.230 1191 H GLY 149 H GLY 149 -7.967 -5.263 8.536 1192 HA2 GLY 149 HA2 GLY 149 -6.742 -3.674 10.674 1193 HA3 GLY 149 HA3 GLY 149 -8.474 -3.862 10.329 Start of MODEL 2 1 H1 GLU 1 H1 GLU 1 0.602 7.177 19.965 2 H2 GLU 1 H2 GLU 1 0.190 6.048 18.835 3 H3 GLU 1 H3 GLU 1 0.744 5.567 20.312 4 HA GLU 1 HA GLU 1 2.913 6.530 19.863 5 HB2 GLU 1 HB2 GLU 1 1.979 4.710 17.610 6 HB3 GLU 1 HB3 GLU 1 3.647 4.957 18.128 7 HG2 GLU 1 HG2 GLU 1 2.938 2.851 19.004 8 HG3 GLU 1 HG3 GLU 1 3.016 3.986 20.367 9 H ALA 2 H ALA 2 4.246 7.747 18.517 10 HA ALA 2 HA ALA 2 4.638 9.542 17.153 11 HB1 ALA 2 HB1 ALA 2 5.249 7.490 15.928 12 HB2 ALA 2 HB2 ALA 2 3.651 7.501 15.138 13 HB3 ALA 2 HB3 ALA 2 4.801 8.828 14.855 14 H ARG 3 H ARG 3 2.385 10.466 18.191 15 HA ARG 3 HA ARG 3 1.345 11.992 15.918 16 HB2 ARG 3 HB2 ARG 3 -1.038 11.710 16.547 17 HB3 ARG 3 HB3 ARG 3 -0.278 10.274 15.874 18 HG2 ARG 3 HG2 ARG 3 -0.016 9.425 18.291 19 HG3 ARG 3 HG3 ARG 3 -1.103 10.744 18.756 20 HD2 ARG 3 HD2 ARG 3 -2.461 8.797 18.431 21 HD3 ARG 3 HD3 ARG 3 -2.754 9.864 17.047 22 HE ARG 3 HE ARG 3 -1.179 8.441 15.746 23 HH11 ARG 3 HH11 ARG 3 -2.635 6.973 18.624 24 HH12 ARG 3 HH12 ARG 3 -2.331 5.352 18.051 25 HH21 ARG 3 HH21 ARG 3 -0.858 6.356 15.092 26 HH22 ARG 3 HH22 ARG 3 -1.366 5.016 16.089 27 HA PRO 4 HA PRO 4 2.078 14.112 19.967 28 HB2 PRO 4 HB2 PRO 4 3.931 15.950 19.204 29 HB3 PRO 4 HB3 PRO 4 4.366 14.255 19.588 30 HG2 PRO 4 HG2 PRO 4 3.847 15.505 16.909 31 HG3 PRO 4 HG3 PRO 4 5.260 14.541 17.446 32 HD2 PRO 4 HD2 PRO 4 3.224 13.419 16.084 33 HD3 PRO 4 HD3 PRO 4 4.054 12.539 17.415 34 H ILE 5 H ILE 5 1.326 16.112 20.698 35 HA ILE 5 HA ILE 5 0.428 18.075 18.669 36 HB ILE 5 HB ILE 5 -1.736 18.407 19.900 37 HG12 ILE 5 HG12 ILE 5 -1.066 15.781 21.302 38 HG13 ILE 5 HG13 ILE 5 -1.016 17.369 22.068 39 HG21 ILE 5 HG21 ILE 5 -1.543 16.968 17.815 40 HG22 ILE 5 HG22 ILE 5 -1.482 15.540 18.872 41 HG23 ILE 5 HG23 ILE 5 -2.931 16.574 18.847 42 HD11 ILE 5 HD11 ILE 5 -3.077 16.320 22.707 43 HD12 ILE 5 HD12 ILE 5 -3.484 17.622 21.569 44 HD13 ILE 5 HD13 ILE 5 -3.481 15.926 21.023 45 H VAL 6 H VAL 6 0.795 20.165 19.340 46 HA VAL 6 HA VAL 6 2.373 20.403 21.819 47 HB VAL 6 HB VAL 6 1.855 22.600 19.762 48 HG11 VAL 6 HG11 VAL 6 2.871 23.299 21.931 49 HG12 VAL 6 HG12 VAL 6 4.168 22.100 21.702 50 HG13 VAL 6 HG13 VAL 6 4.015 23.477 20.589 51 HG21 VAL 6 HG21 VAL 6 3.995 20.418 19.731 52 HG22 VAL 6 HG22 VAL 6 2.753 20.722 18.488 53 HG23 VAL 6 HG23 VAL 6 4.056 21.895 18.739 54 H VAL 7 H VAL 7 0.166 19.832 22.808 55 HA VAL 7 HA VAL 7 -1.402 22.341 23.324 56 HB VAL 7 HB VAL 7 -2.342 19.428 23.395 57 HG11 VAL 7 HG11 VAL 7 -3.548 20.748 25.079 58 HG12 VAL 7 HG12 VAL 7 -3.876 22.026 23.883 59 HG13 VAL 7 HG13 VAL 7 -4.622 20.417 23.705 60 HG21 VAL 7 HG21 VAL 7 -3.753 20.093 21.454 61 HG22 VAL 7 HG22 VAL 7 -2.997 21.704 21.465 62 HG23 VAL 7 HG23 VAL 7 -2.026 20.266 21.093 63 H GLY 8 H GLY 8 0.206 19.501 24.719 64 HA2 GLY 8 HA2 GLY 8 0.241 20.898 27.313 65 HA3 GLY 8 HA3 GLY 8 -0.512 19.290 27.268 66 HA PRO 9 HA PRO 9 4.148 18.901 27.746 67 HB2 PRO 9 HB2 PRO 9 4.171 17.417 30.048 68 HB3 PRO 9 HB3 PRO 9 4.045 19.206 30.072 69 HG2 PRO 9 HG2 PRO 9 1.846 17.155 30.215 70 HG3 PRO 9 HG3 PRO 9 2.174 18.534 31.315 71 HD2 PRO 9 HD2 PRO 9 0.360 18.734 29.339 72 HD3 PRO 9 HD3 PRO 9 1.443 20.115 29.736 73 HA PRO 10 HA PRO 10 4.014 14.921 25.921 74 HB2 PRO 10 HB2 PRO 10 6.245 13.574 26.789 75 HB3 PRO 10 HB3 PRO 10 6.330 14.960 25.654 76 HG2 PRO 10 HG2 PRO 10 6.672 14.950 28.632 77 HG3 PRO 10 HG3 PRO 10 7.753 15.624 27.369 78 HD2 PRO 10 HD2 PRO 10 6.025 17.197 28.674 79 HD3 PRO 10 HD3 PRO 10 6.278 17.401 26.907 80 HA PRO 11 HA PRO 11 1.983 12.427 28.859 81 HB2 PRO 11 HB2 PRO 11 1.781 9.990 27.671 82 HB3 PRO 11 HB3 PRO 11 0.924 11.424 27.033 83 HG2 PRO 11 HG2 PRO 11 3.565 10.264 26.168 84 HG3 PRO 11 HG3 PRO 11 2.135 10.674 25.165 85 HD2 PRO 11 HD2 PRO 11 4.218 12.373 25.422 86 HD3 PRO 11 HD3 PRO 11 2.527 12.982 25.351 87 HA PRO 12 HA PRO 12 5.081 10.396 31.233 88 HB2 PRO 12 HB2 PRO 12 3.659 8.895 33.010 89 HB3 PRO 12 HB3 PRO 12 3.620 10.687 33.021 90 HG2 PRO 12 HG2 PRO 12 1.668 8.776 31.743 91 HG3 PRO 12 HG3 PRO 12 1.343 10.139 32.861 92 HD2 PRO 12 HD2 PRO 12 1.117 10.406 30.177 93 HD3 PRO 12 HD3 PRO 12 1.741 11.744 31.203 94 H LEU 13 H LEU 13 5.971 9.234 29.485 95 HA LEU 13 HA LEU 13 6.832 7.403 28.456 96 HB2 LEU 13 HB2 LEU 13 5.849 5.863 30.871 97 HB3 LEU 13 HB3 LEU 13 7.041 5.310 29.703 98 HG LEU 13 HG LEU 13 7.417 7.693 31.548 99 HD11 LEU 13 HD11 LEU 13 8.520 4.860 31.702 100 HD12 LEU 13 HD12 LEU 13 7.284 5.564 32.774 101 HD13 LEU 13 HD13 LEU 13 8.939 6.208 32.786 102 HD21 LEU 13 HD21 LEU 13 9.354 6.241 29.689 103 HD22 LEU 13 HD22 LEU 13 9.814 7.479 30.881 104 HD23 LEU 13 HD23 LEU 13 8.772 7.914 29.518 105 H SER 14 H SER 14 3.732 7.939 28.357 106 HA SER 14 HA SER 14 2.685 5.344 27.561 107 HB2 SER 14 HB2 SER 14 1.362 7.890 26.736 108 HB3 SER 14 HB3 SER 14 0.666 6.428 27.468 109 HG SER 14 HG SER 14 1.841 7.095 29.430 110 H GLY 15 H GLY 15 4.819 7.440 26.128 111 HA2 GLY 15 HA2 GLY 15 5.207 6.090 23.808 112 HA3 GLY 15 HA3 GLY 15 3.899 7.213 23.372 113 H GLY 16 H GLY 16 6.608 7.262 22.318 114 HA2 GLY 16 HA2 GLY 16 7.981 9.472 23.647 115 HA3 GLY 16 HA3 GLY 16 8.450 8.674 22.134 116 H LEU 17 H LEU 17 5.700 10.632 23.374 117 HA LEU 17 HA LEU 17 5.612 12.023 20.723 118 HB2 LEU 17 HB2 LEU 17 3.594 11.555 22.925 119 HB3 LEU 17 HB3 LEU 17 3.398 12.877 21.788 120 HG LEU 17 HG LEU 17 3.274 11.267 19.917 121 HD11 LEU 17 HD11 LEU 17 2.787 8.875 20.465 122 HD12 LEU 17 HD12 LEU 17 3.328 9.180 22.129 123 HD13 LEU 17 HD13 LEU 17 4.473 9.338 20.772 124 HD21 LEU 17 HD21 LEU 17 1.005 10.506 20.473 125 HD22 LEU 17 HD22 LEU 17 1.276 12.153 21.064 126 HD23 LEU 17 HD23 LEU 17 1.318 10.787 22.202 127 HA PRO 18 HA PRO 18 7.225 15.335 23.362 128 HB2 PRO 18 HB2 PRO 18 7.732 17.179 21.409 129 HB3 PRO 18 HB3 PRO 18 8.831 15.794 21.710 130 HG2 PRO 18 HG2 PRO 18 6.629 16.043 19.672 131 HG3 PRO 18 HG3 PRO 18 8.343 15.577 19.427 132 HD2 PRO 18 HD2 PRO 18 6.430 13.709 19.661 133 HD3 PRO 18 HD3 PRO 18 8.037 13.473 20.428 134 H GLY 19 H GLY 19 6.400 17.560 23.809 135 HA2 GLY 19 HA2 GLY 19 3.777 18.166 22.523 136 HA3 GLY 19 HA3 GLY 19 3.855 17.987 24.289 137 H THR 20 H THR 20 3.747 19.986 25.151 138 HA THR 20 HA THR 20 4.954 22.324 23.883 139 HB THR 20 HB THR 20 4.417 23.419 26.087 140 HG1 THR 20 HG1 THR 20 4.621 21.797 27.548 141 HG21 THR 20 HG21 THR 20 2.170 21.713 24.931 142 HG22 THR 20 HG22 THR 20 2.673 23.316 24.352 143 HG23 THR 20 HG23 THR 20 1.963 23.136 25.969 144 H GLU 21 H GLU 21 6.188 19.683 25.545 145 HA GLU 21 HA GLU 21 8.761 21.062 26.010 146 HB2 GLU 21 HB2 GLU 21 7.513 20.959 28.189 147 HB3 GLU 21 HB3 GLU 21 7.402 19.213 28.024 148 HG2 GLU 21 HG2 GLU 21 10.156 20.331 27.844 149 HG3 GLU 21 HG3 GLU 21 9.347 20.558 29.402 150 H ASN 22 H ASN 22 10.522 19.477 25.874 151 HA ASN 22 HA ASN 22 9.916 16.733 25.165 152 HB2 ASN 22 HB2 ASN 22 10.802 16.736 22.936 153 HB3 ASN 22 HB3 ASN 22 9.537 17.974 22.971 154 HD21 ASN 22 HD21 ASN 22 10.393 20.245 23.470 155 HD22 ASN 22 HD22 ASN 22 11.889 20.670 22.675 156 H SER 23 H SER 23 12.111 15.612 24.810 157 HA SER 23 HA SER 23 13.772 16.322 26.987 158 HB2 SER 23 HB2 SER 23 15.252 14.495 25.975 159 HB3 SER 23 HB3 SER 23 13.574 14.046 26.356 160 HG SER 23 HG SER 23 14.786 14.499 23.836 161 H ASP 24 H ASP 24 14.243 16.889 23.508 162 HA ASP 24 HA ASP 24 16.405 18.765 23.961 163 HB2 ASP 24 HB2 ASP 24 18.198 17.490 22.869 164 HB3 ASP 24 HB3 ASP 24 17.670 16.651 24.330 165 H GLN 25 H GLN 25 15.057 16.402 21.629 166 HA GLN 25 HA GLN 25 14.429 18.637 19.782 167 HB2 GLN 25 HB2 GLN 25 16.698 17.599 19.176 168 HB3 GLN 25 HB3 GLN 25 15.833 16.084 18.899 169 HG2 GLN 25 HG2 GLN 25 14.367 17.520 17.271 170 HG3 GLN 25 HG3 GLN 25 15.718 18.654 17.326 171 HE21 GLN 25 HE21 GLN 25 14.444 15.772 16.022 172 HE22 GLN 25 HE22 GLN 25 15.855 15.310 15.087 173 H ALA 26 H ALA 26 12.520 18.195 18.648 174 HA ALA 26 HA ALA 26 10.797 16.088 19.540 175 HB1 ALA 26 HB1 ALA 26 10.763 17.708 16.941 176 HB2 ALA 26 HB2 ALA 26 9.421 16.714 17.550 177 HB3 ALA 26 HB3 ALA 26 9.936 18.155 18.456 178 H ARG 27 H ARG 27 10.633 13.980 18.836 179 HA ARG 27 HA ARG 27 12.878 12.926 17.417 180 HB2 ARG 27 HB2 ARG 27 11.494 11.747 19.204 181 HB3 ARG 27 HB3 ARG 27 10.259 11.497 17.968 182 HG2 ARG 27 HG2 ARG 27 11.355 9.496 17.781 183 HG3 ARG 27 HG3 ARG 27 12.307 10.426 16.625 184 HD2 ARG 27 HD2 ARG 27 13.028 9.664 19.477 185 HD3 ARG 27 HD3 ARG 27 13.867 9.214 17.990 186 HE ARG 27 HE ARG 27 14.220 11.627 19.570 187 HH11 ARG 27 HH11 ARG 27 14.573 10.390 16.271 188 HH12 ARG 27 HH12 ARG 27 15.796 11.565 15.875 189 HH21 ARG 27 HH21 ARG 27 15.774 13.085 18.986 190 HH22 ARG 27 HH22 ARG 27 16.459 13.063 17.383 191 H ASP 28 H ASP 28 9.602 13.644 16.477 192 HA ASP 28 HA ASP 28 8.515 13.783 14.511 193 HB2 ASP 28 HB2 ASP 28 10.592 15.186 14.005 194 HB3 ASP 28 HB3 ASP 28 11.188 13.791 13.091 195 H GLY 29 H GLY 29 8.194 12.826 12.268 196 HA2 GLY 29 HA2 GLY 29 8.064 10.993 10.861 197 HA3 GLY 29 HA3 GLY 29 9.249 10.142 11.852 198 H THR 30 H THR 30 6.861 9.098 10.597 199 HA THR 30 HA THR 30 4.988 8.516 12.785 200 HB THR 30 HB THR 30 4.042 6.898 11.072 201 HG1 THR 30 HG1 THR 30 4.929 7.046 8.986 202 HG21 THR 30 HG21 THR 30 3.235 9.260 11.255 203 HG22 THR 30 HG22 THR 30 3.147 8.624 9.597 204 HG23 THR 30 HG23 THR 30 4.454 9.741 10.048 205 H LEU 31 H LEU 31 7.923 7.401 11.524 206 HA LEU 31 HA LEU 31 9.395 5.792 12.019 207 HB2 LEU 31 HB2 LEU 31 7.639 5.016 14.351 208 HB3 LEU 31 HB3 LEU 31 9.325 4.585 14.112 209 HG LEU 31 HG LEU 31 8.296 7.414 14.546 210 HD11 LEU 31 HD11 LEU 31 9.744 5.537 16.449 211 HD12 LEU 31 HD12 LEU 31 8.014 5.959 16.520 212 HD13 LEU 31 HD13 LEU 31 9.245 7.213 16.785 213 HD21 LEU 31 HD21 LEU 31 10.396 7.415 13.273 214 HD22 LEU 31 HD22 LEU 31 11.148 6.332 14.469 215 HD23 LEU 31 HD23 LEU 31 10.672 7.989 14.921 216 HA PRO 32 HA PRO 32 7.500 2.439 9.910 217 HB2 PRO 32 HB2 PRO 32 9.644 0.929 9.230 218 HB3 PRO 32 HB3 PRO 32 9.367 2.538 8.491 219 HG2 PRO 32 HG2 PRO 32 11.142 1.807 10.816 220 HG3 PRO 32 HG3 PRO 32 11.552 2.738 9.340 221 HD2 PRO 32 HD2 PRO 32 10.887 3.956 11.681 222 HD3 PRO 32 HD3 PRO 32 10.415 4.645 10.087 223 H TYR 33 H TYR 33 7.022 0.149 10.204 224 HA TYR 33 HA TYR 33 7.113 -0.717 12.944 225 HB2 TYR 33 HB2 TYR 33 6.507 -2.330 10.439 226 HB3 TYR 33 HB3 TYR 33 6.114 -2.793 12.098 227 HD1 TYR 33 HD2 TYR 33 5.153 0.057 13.022 228 HD2 TYR 33 HD1 TYR 33 4.244 -2.353 9.556 229 HE1 TYR 33 HE2 TYR 33 2.962 1.200 12.789 230 HE2 TYR 33 HE1 TYR 33 2.036 -1.204 9.370 231 HH TYR 33 HH TYR 33 1.022 1.375 11.602 232 H THR 34 H THR 34 9.371 -0.945 10.369 233 HA THR 34 HA THR 34 10.730 -3.342 11.343 234 HB THR 34 HB THR 34 12.416 -2.712 9.586 235 HG1 THR 34 HG1 THR 34 12.114 -0.851 8.440 236 HG21 THR 34 HG21 THR 34 10.983 -3.009 7.643 237 HG22 THR 34 HG22 THR 34 9.551 -2.505 8.565 238 HG23 THR 34 HG23 THR 34 10.381 -4.025 8.965 239 H LYS 35 H LYS 35 10.549 -0.258 12.551 240 HA LYS 35 HA LYS 35 13.229 0.585 12.889 241 HB2 LYS 35 HB2 LYS 35 11.210 1.943 13.351 242 HB3 LYS 35 HB3 LYS 35 10.807 0.893 14.699 243 HG2 LYS 35 HG2 LYS 35 13.213 1.680 15.587 244 HG3 LYS 35 HG3 LYS 35 12.900 3.039 14.496 245 HD2 LYS 35 HD2 LYS 35 12.038 3.723 16.612 246 HD3 LYS 35 HD3 LYS 35 10.604 3.230 15.678 247 HE2 LYS 35 HE2 LYS 35 10.767 0.969 16.735 248 HE3 LYS 35 HE3 LYS 35 12.113 1.543 17.718 249 HZ1 LYS 35 HZ1 LYS 35 10.026 1.502 18.898 250 HZ2 LYS 35 HZ2 LYS 35 9.349 2.576 17.842 251 HZ3 LYS 35 HZ3 LYS 35 10.606 3.049 18.807 252 H ASP 36 H ASP 36 11.244 -1.496 15.022 253 HA ASP 36 HA ASP 36 13.762 -2.354 16.369 254 HB2 ASP 36 HB2 ASP 36 12.604 -2.222 18.562 255 HB3 ASP 36 HB3 ASP 36 12.836 -0.649 17.796 256 H ARG 37 H ARG 37 10.292 -3.054 15.897 257 HA ARG 37 HA ARG 37 10.332 -5.507 17.274 258 HB2 ARG 37 HB2 ARG 37 8.456 -3.935 16.227 259 HB3 ARG 37 HB3 ARG 37 8.475 -5.166 14.960 260 HG2 ARG 37 HG2 ARG 37 7.909 -6.898 16.522 261 HG3 ARG 37 HG3 ARG 37 8.220 -5.840 17.912 262 HD2 ARG 37 HD2 ARG 37 6.032 -5.420 15.861 263 HD3 ARG 37 HD3 ARG 37 5.810 -6.149 17.462 264 HE ARG 37 HE ARG 37 7.062 -3.652 17.844 265 HH11 ARG 37 HH21 ARG 37 3.933 -4.857 16.707 266 HH12 ARG 37 HH22 ARG 37 3.114 -3.382 17.176 267 HH21 ARG 37 HH11 ARG 37 5.941 -1.835 18.427 268 HH22 ARG 37 HH12 ARG 37 4.223 -1.719 18.154 269 H PHE 38 H PHE 38 11.403 -4.836 14.034 270 HA PHE 38 HA PHE 38 11.261 -7.584 13.105 271 HB2 PHE 38 HB2 PHE 38 12.372 -4.984 12.149 272 HB3 PHE 38 HB3 PHE 38 13.120 -6.447 11.511 273 HD1 PHE 38 HD2 PHE 38 9.554 -5.374 12.238 274 HD2 PHE 38 HD1 PHE 38 12.360 -7.054 9.433 275 HE1 PHE 38 HE2 PHE 38 7.731 -5.617 10.564 276 HE2 PHE 38 HE1 PHE 38 10.544 -7.291 7.751 277 HZ PHE 38 HZ PHE 38 8.231 -6.572 8.306 278 H TYR 39 H TYR 39 13.326 -5.989 15.308 279 HA TYR 39 HA TYR 39 15.503 -7.982 14.822 280 HB2 TYR 39 HB2 TYR 39 15.523 -5.430 16.478 281 HB3 TYR 39 HB3 TYR 39 16.898 -6.501 16.190 282 HD1 TYR 39 HD2 TYR 39 17.865 -6.682 13.850 283 HD2 TYR 39 HD1 TYR 39 14.873 -3.757 14.859 284 HE1 TYR 39 HE2 TYR 39 18.435 -5.375 11.799 285 HE2 TYR 39 HE1 TYR 39 15.441 -2.468 12.808 286 HH TYR 39 HH TYR 39 16.757 -2.337 10.959 287 H LEU 40 H LEU 40 13.312 -6.553 17.226 288 HA LEU 40 HA LEU 40 14.218 -8.174 19.432 289 HB2 LEU 40 HB2 LEU 40 11.917 -6.361 18.830 290 HB3 LEU 40 HB3 LEU 40 11.693 -7.537 20.118 291 HG LEU 40 HG LEU 40 13.643 -6.638 21.320 292 HD11 LEU 40 HD11 LEU 40 13.700 -4.504 19.143 293 HD12 LEU 40 HD12 LEU 40 14.971 -5.705 19.474 294 HD13 LEU 40 HD13 LEU 40 14.609 -4.451 20.673 295 HD21 LEU 40 HD21 LEU 40 11.360 -5.831 21.772 296 HD22 LEU 40 HD22 LEU 40 11.560 -4.556 20.544 297 HD23 LEU 40 HD23 LEU 40 12.555 -4.544 22.019 298 H GLN 41 H GLN 41 11.705 -8.565 16.937 299 HA GLN 41 HA GLN 41 11.165 -11.298 18.027 300 HB2 GLN 41 HB2 GLN 41 9.262 -9.402 16.606 301 HB3 GLN 41 HB3 GLN 41 8.872 -11.043 17.132 302 HG2 GLN 41 HG2 GLN 41 9.124 -10.373 19.481 303 HG3 GLN 41 HG3 GLN 41 9.602 -8.744 18.983 304 HE21 GLN 41 HE21 GLN 41 7.305 -9.716 16.790 305 HE22 GLN 41 HE22 GLN 41 5.901 -9.009 17.545 306 HA PRO 42 HA PRO 42 11.938 -12.262 13.698 307 HB2 PRO 42 HB2 PRO 42 10.606 -14.640 13.426 308 HB3 PRO 42 HB3 PRO 42 12.218 -14.540 14.208 309 HG2 PRO 42 HG2 PRO 42 9.489 -14.639 15.481 310 HG3 PRO 42 HG3 PRO 42 10.959 -15.580 15.886 311 HD2 PRO 42 HD2 PRO 42 10.207 -13.358 17.274 312 HD3 PRO 42 HD3 PRO 42 11.934 -13.788 17.017 313 H LEU 43 H LEU 43 10.612 -11.680 11.928 314 HA LEU 43 HA LEU 43 8.289 -10.239 12.556 315 HB2 LEU 43 HB2 LEU 43 8.110 -9.715 10.284 316 HB3 LEU 43 HB3 LEU 43 9.803 -9.782 10.694 317 HG LEU 43 HG LEU 43 8.299 -11.795 8.998 318 HD11 LEU 43 HD11 LEU 43 10.435 -9.756 8.282 319 HD12 LEU 43 HD12 LEU 43 8.696 -9.554 7.987 320 HD13 LEU 43 HD13 LEU 43 9.589 -10.847 7.163 321 HD21 LEU 43 HD21 LEU 43 10.105 -12.990 10.114 322 HD22 LEU 43 HD22 LEU 43 11.262 -11.695 9.705 323 HD23 LEU 43 HD23 LEU 43 10.551 -12.703 8.424 324 HA PRO 44 HA PRO 44 5.674 -13.828 12.574 325 HB2 PRO 44 HB2 PRO 44 3.615 -12.958 14.083 326 HB3 PRO 44 HB3 PRO 44 5.255 -13.165 14.782 327 HG2 PRO 44 HG2 PRO 44 3.919 -10.692 13.773 328 HG3 PRO 44 HG3 PRO 44 4.760 -10.962 15.326 329 HD2 PRO 44 HD2 PRO 44 5.940 -9.791 13.130 330 HD3 PRO 44 HD3 PRO 44 6.851 -10.730 14.360 331 HA PRO 45 HA PRO 45 2.685 -13.115 9.387 332 HB2 PRO 45 HB2 PRO 45 0.750 -14.978 9.803 333 HB3 PRO 45 HB3 PRO 45 2.406 -15.429 9.302 334 HG2 PRO 45 HG2 PRO 45 1.228 -15.376 12.069 335 HG3 PRO 45 HG3 PRO 45 2.094 -16.708 11.238 336 HD2 PRO 45 HD2 PRO 45 3.375 -15.053 12.943 337 HD3 PRO 45 HD3 PRO 45 4.180 -15.638 11.448 338 H THR 46 H THR 46 1.580 -12.940 12.734 339 HA THR 46 HA THR 46 -1.024 -11.893 12.191 340 HB THR 46 HB THR 46 0.704 -11.191 14.599 341 HG1 THR 46 HG1 THR 46 -0.202 -13.212 15.433 342 HG21 THR 46 HG21 THR 46 -2.273 -11.761 14.293 343 HG22 THR 46 HG22 THR 46 -1.548 -10.143 14.451 344 HG23 THR 46 HG23 THR 46 -1.441 -11.300 15.796 345 H GLU 47 H GLU 47 2.145 -10.342 12.813 346 HA GLU 47 HA GLU 47 1.015 -7.677 12.442 347 HB2 GLU 47 HB2 GLU 47 3.877 -8.605 12.785 348 HB3 GLU 47 HB3 GLU 47 3.332 -6.920 12.767 349 HG2 GLU 47 HG2 GLU 47 1.821 -7.451 14.694 350 HG3 GLU 47 HG3 GLU 47 2.569 -9.056 14.779 351 H ALA 48 H ALA 48 2.053 -10.142 10.369 352 HA ALA 48 HA ALA 48 3.175 -8.581 8.249 353 HB1 ALA 48 HB1 ALA 48 1.461 -11.075 7.998 354 HB2 ALA 48 HB2 ALA 48 2.602 -10.433 6.798 355 HB3 ALA 48 HB3 ALA 48 3.204 -11.090 8.339 356 H ALA 49 H ALA 49 -0.089 -8.991 9.502 357 HA ALA 49 HA ALA 49 -1.466 -7.963 7.222 358 HB1 ALA 49 HB1 ALA 49 -2.610 -9.119 9.086 359 HB2 ALA 49 HB2 ALA 49 -2.191 -7.780 10.179 360 HB3 ALA 49 HB3 ALA 49 -3.300 -7.503 8.817 361 H GLN 50 H GLN 50 0.053 -6.388 10.036 362 HA GLN 50 HA GLN 50 -0.820 -3.728 9.319 363 HB2 GLN 50 HB2 GLN 50 1.520 -4.631 11.043 364 HB3 GLN 50 HB3 GLN 50 0.859 -2.993 10.973 365 HG2 GLN 50 HG2 GLN 50 -1.291 -3.820 11.865 366 HG3 GLN 50 HG3 GLN 50 -0.638 -5.464 11.930 367 HE21 GLN 50 HE21 GLN 50 -1.403 -5.066 14.231 368 HE22 GLN 50 HE22 GLN 50 -0.200 -4.435 15.330 369 H ARG 51 H ARG 51 2.136 -5.657 8.751 370 HA ARG 51 HA ARG 51 3.675 -3.622 7.437 371 HB2 ARG 51 HB2 ARG 51 3.544 -6.636 7.157 372 HB3 ARG 51 HB3 ARG 51 4.672 -5.667 6.210 373 HG2 ARG 51 HG2 ARG 51 6.047 -5.260 7.972 374 HG3 ARG 51 HG3 ARG 51 4.730 -5.231 9.159 375 HD2 ARG 51 HD2 ARG 51 6.346 -7.203 9.326 376 HD3 ARG 51 HD3 ARG 51 4.623 -7.591 9.278 377 HE ARG 51 HE ARG 51 5.659 -7.646 6.608 378 HH11 ARG 51 HH11 ARG 51 5.745 -9.566 9.585 379 HH12 ARG 51 HH12 ARG 51 6.025 -11.049 8.719 380 HH21 ARG 51 HH21 ARG 51 5.971 -9.542 5.586 381 HH22 ARG 51 HH22 ARG 51 6.171 -11.039 6.483 382 H ALA 52 H ALA 52 1.303 -5.985 6.221 383 HA ALA 52 HA ALA 52 1.593 -5.364 3.483 384 HB1 ALA 52 HB1 ALA 52 -0.668 -6.373 3.271 385 HB2 ALA 52 HB2 ALA 52 0.450 -7.359 4.240 386 HB3 ALA 52 HB3 ALA 52 -0.800 -6.389 5.044 387 H LYS 53 H LYS 53 -0.332 -3.708 6.016 388 HA LYS 53 HA LYS 53 -1.876 -2.146 4.162 389 HB2 LYS 53 HB2 LYS 53 -0.996 -1.475 6.996 390 HB3 LYS 53 HB3 LYS 53 -2.155 -0.540 6.040 391 HG2 LYS 53 HG2 LYS 53 -3.511 -2.685 5.832 392 HG3 LYS 53 HG3 LYS 53 -2.458 -3.359 7.075 393 HD2 LYS 53 HD2 LYS 53 -3.114 -1.530 8.619 394 HD3 LYS 53 HD3 LYS 53 -4.192 -0.884 7.352 395 HE2 LYS 53 HE2 LYS 53 -5.308 -3.139 7.282 396 HE3 LYS 53 HE3 LYS 53 -4.358 -3.599 8.696 397 HZ1 LYS 53 HZ1 LYS 53 -6.346 -1.417 8.584 398 HZ2 LYS 53 HZ2 LYS 53 -5.460 -1.830 9.917 399 HZ3 LYS 53 HZ3 LYS 53 -6.557 -2.891 9.293 400 H VAL 54 H VAL 54 1.353 -1.678 5.607 401 HA VAL 54 HA VAL 54 1.699 0.966 4.477 402 HB VAL 54 HB VAL 54 3.815 -1.054 5.379 403 HG11 VAL 54 HG11 VAL 54 4.798 0.699 3.961 404 HG12 VAL 54 HG12 VAL 54 3.987 1.961 4.916 405 HG13 VAL 54 HG13 VAL 54 5.264 0.962 5.652 406 HG21 VAL 54 HG21 VAL 54 2.451 1.213 6.894 407 HG22 VAL 54 HG22 VAL 54 2.272 -0.529 7.209 408 HG23 VAL 54 HG23 VAL 54 3.830 0.265 7.493 409 H SER 55 H SER 55 2.710 -2.345 3.492 410 HA SER 55 HA SER 55 4.092 -1.538 1.143 411 HB2 SER 55 HB2 SER 55 2.592 -4.122 1.708 412 HB3 SER 55 HB3 SER 55 3.852 -3.894 0.473 413 HG SER 55 HG SER 55 4.396 -4.753 2.749 414 H ALA 56 H ALA 56 0.635 -2.020 1.743 415 HA ALA 56 HA ALA 56 -0.103 -1.837 -1.075 416 HB1 ALA 56 HB1 ALA 56 -2.331 -1.879 -0.297 417 HB2 ALA 56 HB2 ALA 56 -1.429 -2.981 0.755 418 HB3 ALA 56 HB3 ALA 56 -1.858 -1.354 1.336 419 H SER 57 H SER 57 0.404 0.421 1.598 420 HA SER 57 HA SER 57 -0.929 2.642 0.327 421 HB2 SER 57 HB2 SER 57 1.206 2.602 2.494 422 HB3 SER 57 HB3 SER 57 0.219 4.006 2.035 423 HG SER 57 HG SER 57 -0.690 1.528 3.121 424 H GLU 58 H GLU 58 2.284 1.241 0.051 425 HA GLU 58 HA GLU 58 3.652 3.471 -1.101 426 HB2 GLU 58 HB2 GLU 58 3.884 0.468 -1.420 427 HB3 GLU 58 HB3 GLU 58 4.926 1.570 -2.310 428 HG2 GLU 58 HG2 GLU 58 4.700 1.465 0.709 429 HG3 GLU 58 HG3 GLU 58 5.973 0.692 -0.252 430 H ILE 59 H ILE 59 1.290 1.209 -2.404 431 HA ILE 59 HA ILE 59 1.812 1.812 -5.185 432 HB ILE 59 HB ILE 59 -0.663 0.623 -3.856 433 HG12 ILE 59 HG12 ILE 59 1.617 -0.824 -5.253 434 HG13 ILE 59 HG13 ILE 59 1.563 -0.587 -3.505 435 HG21 ILE 59 HG21 ILE 59 -1.164 1.453 -6.146 436 HG22 ILE 59 HG22 ILE 59 0.236 0.567 -6.781 437 HG23 ILE 59 HG23 ILE 59 -1.160 -0.315 -6.127 438 HD11 ILE 59 HD11 ILE 59 -0.554 -1.844 -3.379 439 HD12 ILE 59 HD12 ILE 59 -0.467 -2.136 -5.132 440 HD13 ILE 59 HD13 ILE 59 0.780 -2.802 -4.059 441 H LEU 60 H LEU 60 -0.129 3.301 -2.624 442 HA LEU 60 HA LEU 60 -1.871 4.818 -4.347 443 HB2 LEU 60 HB2 LEU 60 -0.857 5.469 -1.564 444 HB3 LEU 60 HB3 LEU 60 -2.199 6.262 -2.365 445 HG LEU 60 HG LEU 60 -2.209 3.308 -1.662 446 HD11 LEU 60 HD11 LEU 60 -3.393 5.654 -0.120 447 HD12 LEU 60 HD12 LEU 60 -1.959 4.722 0.367 448 HD13 LEU 60 HD13 LEU 60 -3.546 3.930 0.295 449 HD21 LEU 60 HD21 LEU 60 -4.629 3.534 -1.908 450 HD22 LEU 60 HD22 LEU 60 -3.799 3.976 -3.411 451 HD23 LEU 60 HD23 LEU 60 -4.436 5.249 -2.343 452 H ASN 61 H ASN 61 1.494 5.143 -3.532 453 HA ASN 61 HA ASN 61 1.715 7.983 -3.889 454 HB2 ASN 61 HB2 ASN 61 3.342 6.423 -2.736 455 HB3 ASN 61 HB3 ASN 61 3.851 5.874 -4.340 456 HD21 ASN 61 HD21 ASN 61 5.945 6.609 -4.041 457 HD22 ASN 61 HD22 ASN 61 6.337 8.312 -4.065 458 H VAL 62 H VAL 62 1.249 5.454 -6.265 459 HA VAL 62 HA VAL 62 2.887 6.656 -8.289 460 HB VAL 62 HB VAL 62 1.903 5.182 -9.883 461 HG11 VAL 62 HG11 VAL 62 2.086 3.672 -7.253 462 HG12 VAL 62 HG12 VAL 62 2.473 3.100 -8.885 463 HG13 VAL 62 HG13 VAL 62 3.495 4.323 -8.124 464 HG21 VAL 62 HG21 VAL 62 -0.290 4.737 -7.835 465 HG22 VAL 62 HG22 VAL 62 -0.438 5.344 -9.496 466 HG23 VAL 62 HG23 VAL 62 0.002 3.651 -9.207 467 H LYS 63 H LYS 63 -0.002 7.958 -7.087 468 HA LYS 63 HA LYS 63 -1.046 9.027 -9.560 469 HB2 LYS 63 HB2 LYS 63 -2.223 9.242 -7.372 470 HB3 LYS 63 HB3 LYS 63 -0.974 10.375 -6.835 471 HG2 LYS 63 HG2 LYS 63 -1.558 11.898 -8.679 472 HG3 LYS 63 HG3 LYS 63 -2.789 10.754 -9.244 473 HD2 LYS 63 HD2 LYS 63 -4.053 11.052 -7.206 474 HD3 LYS 63 HD3 LYS 63 -2.759 12.059 -6.518 475 HE2 LYS 63 HE2 LYS 63 -4.614 13.465 -7.399 476 HE3 LYS 63 HE3 LYS 63 -3.094 13.763 -8.259 477 HZ1 LYS 63 HZ1 LYS 63 -4.966 13.606 -9.795 478 HZ2 LYS 63 HZ2 LYS 63 -5.318 12.078 -9.291 479 HZ3 LYS 63 HZ3 LYS 63 -3.905 12.382 -10.083 480 H GLN 64 H GLN 64 1.674 9.858 -7.464 481 HA GLN 64 HA GLN 64 2.352 12.367 -8.632 482 HB2 GLN 64 HB2 GLN 64 4.170 10.230 -7.455 483 HB3 GLN 64 HB3 GLN 64 4.612 11.916 -7.727 484 HG2 GLN 64 HG2 GLN 64 2.454 10.942 -5.813 485 HG3 GLN 64 HG3 GLN 64 4.082 11.457 -5.359 486 HE21 GLN 64 HE21 GLN 64 1.056 12.449 -5.174 487 HE22 GLN 64 HE22 GLN 64 1.258 14.170 -5.396 488 H PHE 65 H PHE 65 2.667 9.124 -9.966 489 HA PHE 65 HA PHE 65 4.888 9.774 -11.710 490 HB2 PHE 65 HB2 PHE 65 4.871 7.566 -11.940 491 HB3 PHE 65 HB3 PHE 65 3.323 7.446 -11.113 492 HD1 PHE 65 HD2 PHE 65 1.189 7.418 -12.429 493 HD2 PHE 65 HD1 PHE 65 5.037 7.475 -14.356 494 HE1 PHE 65 HE2 PHE 65 0.120 6.789 -14.582 495 HE2 PHE 65 HE1 PHE 65 3.970 6.856 -16.513 496 HZ PHE 65 HZ PHE 65 1.500 6.533 -16.632 497 H ILE 66 H ILE 66 1.439 10.370 -11.791 498 HA ILE 66 HA ILE 66 1.091 10.584 -14.620 499 HB ILE 66 HB ILE 66 -0.307 12.153 -12.375 500 HG12 ILE 66 HG12 ILE 66 -0.469 9.658 -12.141 501 HG13 ILE 66 HG13 ILE 66 -2.011 10.476 -12.342 502 HG21 ILE 66 HG21 ILE 66 -2.238 12.253 -14.065 503 HG22 ILE 66 HG22 ILE 66 -0.824 13.271 -14.438 504 HG23 ILE 66 HG23 ILE 66 -1.064 11.737 -15.304 505 HD11 ILE 66 HD11 ILE 66 -0.573 9.076 -14.633 506 HD12 ILE 66 HD12 ILE 66 -1.795 8.307 -13.600 507 HD13 ILE 66 HD13 ILE 66 -2.242 9.690 -14.615 508 H ASP 67 H ASP 67 2.027 12.957 -12.103 509 HA ASP 67 HA ASP 67 2.461 15.139 -13.909 510 HB2 ASP 67 HB2 ASP 67 3.700 14.552 -11.189 511 HB3 ASP 67 HB3 ASP 67 3.683 16.127 -12.000 512 H ARG 68 H ARG 68 4.516 12.502 -12.738 513 HA ARG 68 HA ARG 68 7.003 13.646 -13.716 514 HB2 ARG 68 HB2 ARG 68 6.264 10.782 -13.021 515 HB3 ARG 68 HB3 ARG 68 7.903 11.341 -13.347 516 HG2 ARG 68 HG2 ARG 68 6.457 12.837 -11.228 517 HG3 ARG 68 HG3 ARG 68 6.812 11.139 -10.869 518 HD2 ARG 68 HD2 ARG 68 9.183 11.517 -11.396 519 HD3 ARG 68 HD3 ARG 68 8.833 13.226 -11.743 520 HE ARG 68 HE ARG 68 7.822 12.790 -9.195 521 HH11 ARG 68 HH21 ARG 68 11.025 12.504 -10.653 522 HH12 ARG 68 HH22 ARG 68 11.840 12.849 -9.155 523 HH21 ARG 68 HH11 ARG 68 8.930 13.244 -7.324 524 HH22 ARG 68 HH12 ARG 68 10.672 13.263 -7.303 525 H LYS 69 H LYS 69 4.421 11.894 -15.192 526 HA LYS 69 HA LYS 69 4.085 11.029 -17.278 527 HB2 LYS 69 HB2 LYS 69 5.262 13.508 -17.527 528 HB3 LYS 69 HB3 LYS 69 6.264 12.530 -18.600 529 HG2 LYS 69 HG2 LYS 69 4.341 11.891 -19.897 530 HG3 LYS 69 HG3 LYS 69 3.238 12.613 -18.708 531 HD2 LYS 69 HD2 LYS 69 4.262 14.834 -19.161 532 HD3 LYS 69 HD3 LYS 69 5.253 14.091 -20.436 533 HE2 LYS 69 HE2 LYS 69 3.213 13.419 -21.642 534 HE3 LYS 69 HE3 LYS 69 2.208 14.092 -20.340 535 HZ1 LYS 69 HZ1 LYS 69 4.071 15.660 -22.035 536 HZ2 LYS 69 HZ2 LYS 69 3.118 16.273 -20.837 537 HZ3 LYS 69 HZ3 LYS 69 2.427 15.637 -22.193 538 H ALA 70 H ALA 70 6.015 9.691 -15.544 539 HA ALA 70 HA ALA 70 8.202 8.751 -17.226 540 HB1 ALA 70 HB1 ALA 70 8.842 7.446 -15.244 541 HB2 ALA 70 HB2 ALA 70 8.477 9.124 -14.792 542 HB3 ALA 70 HB3 ALA 70 7.295 7.833 -14.459 543 H TRP 71 H TRP 71 6.410 8.035 -18.851 544 HA TRP 71 HA TRP 71 4.680 5.947 -18.453 545 HB2 TRP 71 HB2 TRP 71 6.320 6.328 -20.966 546 HB3 TRP 71 HB3 TRP 71 4.756 5.551 -20.835 547 HD1 TRP 71 HD1 TRP 71 6.077 8.572 -22.100 548 HE1 TRP 71 HE1 TRP 71 4.449 10.518 -22.134 549 HE3 TRP 71 HE3 TRP 71 2.679 6.712 -18.759 550 HZ2 TRP 71 HZ2 TRP 71 1.946 11.167 -20.932 551 HZ3 TRP 71 HZ3 TRP 71 0.649 8.076 -18.230 552 HH2 TRP 71 HH2 TRP 71 0.308 10.285 -19.320 553 HA PRO 72 HA PRO 72 7.315 2.423 -19.532 554 HB2 PRO 72 HB2 PRO 72 10.001 2.354 -19.828 555 HB3 PRO 72 HB3 PRO 72 8.928 2.938 -21.143 556 HG2 PRO 72 HG2 PRO 72 10.461 4.536 -19.099 557 HG3 PRO 72 HG3 PRO 72 10.407 4.740 -20.880 558 HD2 PRO 72 HD2 PRO 72 8.860 6.213 -19.174 559 HD3 PRO 72 HD3 PRO 72 8.311 5.741 -20.820 560 H SER 73 H SER 73 8.842 4.597 -17.218 561 HA SER 73 HA SER 73 10.303 2.618 -15.773 562 HB2 SER 73 HB2 SER 73 9.278 5.267 -14.715 563 HB3 SER 73 HB3 SER 73 10.736 4.381 -14.213 564 HG SER 73 HG SER 73 11.396 5.959 -15.618 565 H LEU 74 H LEU 74 6.985 3.774 -15.561 566 HA LEU 74 HA LEU 74 6.529 3.148 -12.868 567 HB2 LEU 74 HB2 LEU 74 5.012 4.446 -14.412 568 HB3 LEU 74 HB3 LEU 74 4.498 2.902 -15.105 569 HG LEU 74 HG LEU 74 3.741 2.195 -12.817 570 HD11 LEU 74 HD11 LEU 74 3.387 4.012 -11.123 571 HD12 LEU 74 HD12 LEU 74 4.407 5.076 -12.116 572 HD13 LEU 74 HD13 LEU 74 5.087 3.606 -11.382 573 HD21 LEU 74 HD21 LEU 74 2.091 2.960 -14.305 574 HD22 LEU 74 HD22 LEU 74 2.543 4.657 -14.043 575 HD23 LEU 74 HD23 LEU 74 1.771 3.732 -12.743 576 H GLN 75 H GLN 75 6.527 0.966 -15.668 577 HA GLN 75 HA GLN 75 5.225 -1.228 -14.479 578 HB2 GLN 75 HB2 GLN 75 6.049 -1.105 -16.838 579 HB3 GLN 75 HB3 GLN 75 7.697 -1.349 -16.257 580 HG2 GLN 75 HG2 GLN 75 7.221 -3.551 -15.502 581 HG3 GLN 75 HG3 GLN 75 5.480 -3.281 -15.589 582 HE21 GLN 75 HE21 GLN 75 4.382 -3.745 -17.390 583 HE22 GLN 75 HE22 GLN 75 5.141 -4.348 -18.856 584 H ASN 76 H ASN 76 8.598 -0.120 -14.148 585 HA ASN 76 HA ASN 76 9.398 -2.434 -12.576 586 HB2 ASN 76 HB2 ASN 76 10.981 -1.023 -13.905 587 HB3 ASN 76 HB3 ASN 76 10.668 0.324 -12.800 588 HD21 ASN 76 HD21 ASN 76 12.342 0.610 -11.522 589 HD22 ASN 76 HD22 ASN 76 13.243 -0.662 -10.737 590 H ASP 77 H ASP 77 8.570 0.979 -11.882 591 HA ASP 77 HA ASP 77 9.016 0.911 -9.097 592 HB2 ASP 77 HB2 ASP 77 7.165 2.513 -10.877 593 HB3 ASP 77 HB3 ASP 77 7.204 2.771 -9.133 594 H LEU 78 H LEU 78 5.988 0.250 -10.912 595 HA LEU 78 HA LEU 78 4.442 -0.192 -8.526 596 HB2 LEU 78 HB2 LEU 78 4.102 -0.702 -11.462 597 HB3 LEU 78 HB3 LEU 78 3.083 -1.608 -10.360 598 HG LEU 78 HG LEU 78 3.205 1.416 -10.459 599 HD11 LEU 78 HD11 LEU 78 1.029 1.265 -11.588 600 HD12 LEU 78 HD12 LEU 78 1.119 -0.509 -11.570 601 HD13 LEU 78 HD13 LEU 78 2.277 0.434 -12.532 602 HD21 LEU 78 HD21 LEU 78 1.381 -0.523 -8.973 603 HD22 LEU 78 HD22 LEU 78 1.055 1.209 -9.153 604 HD23 LEU 78 HD23 LEU 78 2.489 0.666 -8.263 605 H ARG 79 H ARG 79 5.984 -2.475 -10.863 606 HA ARG 79 HA ARG 79 4.860 -4.715 -9.457 607 HB2 ARG 79 HB2 ARG 79 7.079 -4.600 -11.512 608 HB3 ARG 79 HB3 ARG 79 6.358 -6.091 -10.886 609 HG2 ARG 79 HG2 ARG 79 4.111 -5.317 -11.700 610 HG3 ARG 79 HG3 ARG 79 4.884 -3.900 -12.417 611 HD2 ARG 79 HD2 ARG 79 6.312 -5.447 -13.789 612 HD3 ARG 79 HD3 ARG 79 5.374 -6.804 -13.134 613 HE ARG 79 HE ARG 79 3.822 -4.654 -14.446 614 HH11 ARG 79 HH11 ARG 79 5.282 -7.851 -14.854 615 HH12 ARG 79 HH12 ARG 79 4.286 -8.212 -16.239 616 HH21 ARG 79 HH21 ARG 79 2.637 -5.174 -16.211 617 HH22 ARG 79 HH22 ARG 79 2.795 -6.737 -16.971 618 H LEU 80 H LEU 80 7.879 -2.940 -8.969 619 HA LEU 80 HA LEU 80 9.153 -4.981 -7.380 620 HB2 LEU 80 HB2 LEU 80 9.318 -1.965 -7.465 621 HB3 LEU 80 HB3 LEU 80 10.173 -2.875 -6.223 622 HG LEU 80 HG LEU 80 10.601 -3.298 -9.196 623 HD11 LEU 80 HD11 LEU 80 11.210 -1.009 -8.555 624 HD12 LEU 80 HD12 LEU 80 12.663 -1.977 -8.872 625 HD13 LEU 80 HD13 LEU 80 12.182 -1.630 -7.197 626 HD21 LEU 80 HD21 LEU 80 12.205 -4.168 -6.750 627 HD22 LEU 80 HD22 LEU 80 12.701 -4.384 -8.446 628 HD23 LEU 80 HD23 LEU 80 11.268 -5.228 -7.834 629 H ARG 81 H ARG 81 7.044 -2.206 -6.457 630 HA ARG 81 HA ARG 81 7.040 -2.974 -3.653 631 HB2 ARG 81 HB2 ARG 81 5.367 -1.080 -5.323 632 HB3 ARG 81 HB3 ARG 81 5.022 -1.365 -3.608 633 HG2 ARG 81 HG2 ARG 81 6.866 -0.221 -2.886 634 HG3 ARG 81 HG3 ARG 81 7.857 -0.757 -4.249 635 HD2 ARG 81 HD2 ARG 81 6.014 0.891 -5.482 636 HD3 ARG 81 HD3 ARG 81 6.305 1.712 -3.930 637 HE ARG 81 HE ARG 81 8.822 1.004 -4.800 638 HH11 ARG 81 HH21 ARG 81 6.236 2.915 -6.234 639 HH12 ARG 81 HH22 ARG 81 7.347 3.836 -7.220 640 HH21 ARG 81 HH11 ARG 81 10.165 2.218 -6.065 641 HH22 ARG 81 HH12 ARG 81 9.532 3.415 -7.164 642 H ALA 82 H ALA 82 4.950 -3.648 -6.435 643 HA ALA 82 HA ALA 82 2.851 -4.922 -5.012 644 HB1 ALA 82 HB1 ALA 82 2.874 -4.321 -7.472 645 HB2 ALA 82 HB2 ALA 82 3.942 -5.716 -7.746 646 HB3 ALA 82 HB3 ALA 82 2.298 -5.961 -7.125 647 H SER 83 H SER 83 6.002 -6.190 -6.228 648 HA SER 83 HA SER 83 5.467 -8.901 -5.561 649 HB2 SER 83 HB2 SER 83 8.122 -7.418 -5.585 650 HB3 SER 83 HB3 SER 83 7.926 -9.182 -5.546 651 HG SER 83 HG SER 83 7.176 -7.364 -7.603 652 H TYR 84 H TYR 84 6.908 -6.251 -3.607 653 HA TYR 84 HA TYR 84 7.466 -7.878 -1.331 654 HB2 TYR 84 HB2 TYR 84 8.228 -5.474 -1.833 655 HB3 TYR 84 HB3 TYR 84 6.653 -4.962 -1.208 656 HD1 TYR 84 HD1 TYR 84 6.059 -5.457 1.219 657 HD2 TYR 84 HD2 TYR 84 9.994 -6.212 -0.358 658 HE1 TYR 84 HE1 TYR 84 6.961 -5.611 3.534 659 HE2 TYR 84 HE2 TYR 84 10.891 -6.344 1.966 660 HH TYR 84 HH TYR 84 10.425 -6.220 4.191 661 H LEU 85 H LEU 85 4.574 -5.945 -2.233 662 HA LEU 85 HA LEU 85 3.077 -6.520 0.125 663 HB2 LEU 85 HB2 LEU 85 2.476 -4.759 -1.488 664 HB3 LEU 85 HB3 LEU 85 2.156 -5.980 -2.713 665 HG LEU 85 HG LEU 85 0.259 -6.843 -1.381 666 HD11 LEU 85 HD11 LEU 85 0.978 -6.182 0.877 667 HD12 LEU 85 HD12 LEU 85 -0.617 -5.507 0.499 668 HD13 LEU 85 HD13 LEU 85 0.818 -4.469 0.432 669 HD21 LEU 85 HD21 LEU 85 -0.069 -5.145 -3.132 670 HD22 LEU 85 HD22 LEU 85 0.154 -3.862 -1.923 671 HD23 LEU 85 HD23 LEU 85 -1.242 -4.960 -1.809 672 H ARG 86 H ARG 86 3.499 -8.318 -2.901 673 HA ARG 86 HA ARG 86 1.446 -10.257 -2.303 674 HB2 ARG 86 HB2 ARG 86 3.150 -9.682 -4.448 675 HB3 ARG 86 HB3 ARG 86 3.626 -11.293 -3.948 676 HG2 ARG 86 HG2 ARG 86 0.709 -10.582 -4.361 677 HG3 ARG 86 HG3 ARG 86 1.736 -10.976 -5.742 678 HD2 ARG 86 HD2 ARG 86 1.403 -12.846 -3.374 679 HD3 ARG 86 HD3 ARG 86 0.330 -12.862 -4.789 680 HE ARG 86 HE ARG 86 2.098 -13.620 -6.159 681 HH11 ARG 86 HH21 ARG 86 3.225 -13.328 -2.805 682 HH12 ARG 86 HH22 ARG 86 4.670 -14.248 -3.137 683 HH21 ARG 86 HH11 ARG 86 3.952 -14.783 -6.471 684 HH22 ARG 86 HH12 ARG 86 5.061 -15.067 -5.158 685 H TYR 87 H TYR 87 4.887 -10.011 -1.429 686 HA TYR 87 HA TYR 87 4.970 -12.732 -0.366 687 HB2 TYR 87 HB2 TYR 87 6.743 -10.310 0.120 688 HB3 TYR 87 HB3 TYR 87 7.036 -11.913 0.802 689 HD1 TYR 87 HD2 TYR 87 6.662 -13.833 -1.288 690 HD2 TYR 87 HD1 TYR 87 8.262 -9.849 -1.609 691 HE1 TYR 87 HE2 TYR 87 7.894 -14.482 -3.364 692 HE2 TYR 87 HE1 TYR 87 9.486 -10.513 -3.678 693 HH TYR 87 HH TYR 87 9.967 -12.204 -5.147 694 H ASP 88 H ASP 88 4.390 -9.445 0.948 695 HA ASP 88 HA ASP 88 4.143 -10.200 3.684 696 HB2 ASP 88 HB2 ASP 88 3.129 -7.952 1.971 697 HB3 ASP 88 HB3 ASP 88 2.306 -8.227 3.509 698 H LEU 89 H LEU 89 1.609 -9.898 1.130 699 HA LEU 89 HA LEU 89 -0.516 -10.792 2.798 700 HB2 LEU 89 HB2 LEU 89 -0.074 -10.324 -0.063 701 HB3 LEU 89 HB3 LEU 89 -1.185 -11.648 0.241 702 HG LEU 89 HG LEU 89 -2.360 -9.536 -0.100 703 HD11 LEU 89 HD11 LEU 89 -3.855 -9.650 1.784 704 HD12 LEU 89 HD12 LEU 89 -2.626 -10.444 2.790 705 HD13 LEU 89 HD13 LEU 89 -3.317 -11.290 1.386 706 HD21 LEU 89 HD21 LEU 89 -1.091 -8.575 2.470 707 HD22 LEU 89 HD22 LEU 89 -2.244 -7.705 1.432 708 HD23 LEU 89 HD23 LEU 89 -0.609 -8.056 0.840 709 H LYS 90 H LYS 90 1.811 -12.637 0.864 710 HA LYS 90 HA LYS 90 0.420 -15.141 1.091 711 HB2 LYS 90 HB2 LYS 90 3.148 -14.219 0.358 712 HB3 LYS 90 HB3 LYS 90 3.083 -15.845 1.018 713 HG2 LYS 90 HG2 LYS 90 1.415 -14.880 -1.340 714 HG3 LYS 90 HG3 LYS 90 2.959 -15.733 -1.488 715 HD2 LYS 90 HD2 LYS 90 0.473 -16.884 -0.145 716 HD3 LYS 90 HD3 LYS 90 0.981 -17.223 -1.804 717 HE2 LYS 90 HE2 LYS 90 3.131 -18.157 -0.940 718 HE3 LYS 90 HE3 LYS 90 2.565 -17.878 0.720 719 HZ1 LYS 90 HZ1 LYS 90 0.744 -19.398 0.303 720 HZ2 LYS 90 HZ2 LYS 90 2.179 -20.152 0.009 721 HZ3 LYS 90 HZ3 LYS 90 1.239 -19.650 -1.250 722 H THR 91 H THR 91 2.351 -13.249 3.294 723 HA THR 91 HA THR 91 2.757 -15.493 5.152 724 HB THR 91 HB THR 91 3.273 -12.524 5.641 725 HG1 THR 91 HG1 THR 91 4.429 -13.122 3.803 726 HG21 THR 91 HG21 THR 91 3.367 -14.031 7.616 727 HG22 THR 91 HG22 THR 91 4.956 -13.359 7.204 728 HG23 THR 91 HG23 THR 91 4.563 -15.035 6.768 729 H VAL 92 H VAL 92 0.709 -12.538 4.857 730 HA VAL 92 HA VAL 92 -0.479 -12.600 7.417 731 HB VAL 92 HB VAL 92 -1.887 -11.879 4.775 732 HG11 VAL 92 HG11 VAL 92 -2.542 -11.167 7.675 733 HG12 VAL 92 HG12 VAL 92 -3.316 -10.429 6.259 734 HG13 VAL 92 HG13 VAL 92 -3.530 -12.154 6.573 735 HG21 VAL 92 HG21 VAL 92 0.086 -10.522 5.023 736 HG22 VAL 92 HG22 VAL 92 -1.319 -9.537 5.405 737 HG23 VAL 92 HG23 VAL 92 -0.307 -10.186 6.706 738 H ILE 93 H ILE 93 -1.474 -14.340 4.438 739 HA ILE 93 HA ILE 93 -3.890 -15.367 5.557 740 HB ILE 93 HB ILE 93 -3.780 -17.060 3.764 741 HG12 ILE 93 HG12 ILE 93 -1.180 -15.776 2.922 742 HG13 ILE 93 HG13 ILE 93 -1.268 -17.290 3.815 743 HG21 ILE 93 HG21 ILE 93 -3.974 -15.445 1.889 744 HG22 ILE 93 HG22 ILE 93 -4.760 -14.834 3.346 745 HG23 ILE 93 HG23 ILE 93 -3.169 -14.203 2.862 746 HD11 ILE 93 HD11 ILE 93 -0.971 -17.834 1.505 747 HD12 ILE 93 HD12 ILE 93 -2.646 -18.249 1.931 748 HD13 ILE 93 HD13 ILE 93 -2.299 -16.764 1.010 749 H SER 94 H SER 94 -0.673 -16.231 6.289 750 HA SER 94 HA SER 94 -1.340 -19.005 6.972 751 HB2 SER 94 HB2 SER 94 1.152 -17.373 7.519 752 HB3 SER 94 HB3 SER 94 0.980 -19.134 7.680 753 HG SER 94 HG SER 94 1.076 -17.532 5.362 754 H ALA 95 H ALA 95 -1.682 -15.917 8.456 755 HA ALA 95 HA ALA 95 -1.264 -16.754 11.201 756 HB1 ALA 95 HB1 ALA 95 -2.494 -14.683 11.773 757 HB2 ALA 95 HB2 ALA 95 -1.295 -14.347 10.505 758 HB3 ALA 95 HB3 ALA 95 -3.013 -14.499 10.081 759 H LYS 96 H LYS 96 -4.046 -16.572 8.987 760 HA LYS 96 HA LYS 96 -5.418 -18.628 10.639 761 HB2 LYS 96 HB2 LYS 96 -6.640 -16.041 9.697 762 HB3 LYS 96 HB3 LYS 96 -7.609 -17.472 10.054 763 HG2 LYS 96 HG2 LYS 96 -7.711 -16.761 12.172 764 HG3 LYS 96 HG3 LYS 96 -6.007 -17.228 12.314 765 HD2 LYS 96 HD2 LYS 96 -5.879 -15.030 12.982 766 HD3 LYS 96 HD3 LYS 96 -5.603 -14.853 11.238 767 HE2 LYS 96 HE2 LYS 96 -8.171 -14.568 11.060 768 HE3 LYS 96 HE3 LYS 96 -8.162 -14.355 12.810 769 HZ1 LYS 96 HZ1 LYS 96 -6.681 -12.447 12.467 770 HZ2 LYS 96 HZ2 LYS 96 -8.106 -12.250 11.659 771 HZ3 LYS 96 HZ3 LYS 96 -6.749 -12.668 10.829 772 HA PRO 97 HA PRO 97 -5.274 -19.537 6.116 773 HB2 PRO 97 HB2 PRO 97 -4.352 -22.087 6.195 774 HB3 PRO 97 HB3 PRO 97 -3.271 -20.694 6.495 775 HG2 PRO 97 HG2 PRO 97 -4.693 -22.430 8.502 776 HG3 PRO 97 HG3 PRO 97 -2.952 -22.014 8.408 777 HD2 PRO 97 HD2 PRO 97 -4.687 -20.669 10.016 778 HD3 PRO 97 HD3 PRO 97 -3.306 -19.853 9.210 779 H LYS 98 H LYS 98 -7.690 -19.342 7.325 780 HA LYS 98 HA LYS 98 -9.015 -21.979 6.866 781 HB2 LYS 98 HB2 LYS 98 -9.993 -19.775 8.703 782 HB3 LYS 98 HB3 LYS 98 -10.634 -21.417 8.574 783 HG2 LYS 98 HG2 LYS 98 -7.903 -20.613 9.695 784 HG3 LYS 98 HG3 LYS 98 -9.305 -21.110 10.638 785 HD2 LYS 98 HD2 LYS 98 -7.850 -22.924 8.657 786 HD3 LYS 98 HD3 LYS 98 -7.542 -22.879 10.395 787 HE2 LYS 98 HE2 LYS 98 -9.918 -23.511 10.817 788 HE3 LYS 98 HE3 LYS 98 -10.172 -23.641 9.062 789 HZ1 LYS 98 HZ1 LYS 98 -9.670 -25.795 10.039 790 HZ2 LYS 98 HZ2 LYS 98 -8.236 -25.247 10.639 791 HZ3 LYS 98 HZ3 LYS 98 -8.456 -25.360 9.009 792 H ASP 99 H ASP 99 -11.637 -20.320 7.259 793 HA ASP 99 HA ASP 99 -12.295 -20.261 4.514 794 HB2 ASP 99 HB2 ASP 99 -13.947 -20.345 6.343 795 HB3 ASP 99 HB3 ASP 99 -13.509 -18.696 6.815 796 H GLU 100 H GLU 100 -11.294 -17.589 6.677 797 HA GLU 100 HA GLU 100 -11.639 -15.515 4.804 798 HB2 GLU 100 HB2 GLU 100 -10.303 -14.171 6.253 799 HB3 GLU 100 HB3 GLU 100 -11.251 -15.272 7.262 800 HG2 GLU 100 HG2 GLU 100 -9.211 -16.765 7.382 801 HG3 GLU 100 HG3 GLU 100 -8.303 -15.472 6.575 802 H LYS 101 H LYS 101 -9.158 -17.996 4.907 803 HA LYS 101 HA LYS 101 -7.062 -16.560 3.587 804 HB2 LYS 101 HB2 LYS 101 -6.951 -18.861 4.638 805 HB3 LYS 101 HB3 LYS 101 -7.821 -19.477 3.237 806 HG2 LYS 101 HG2 LYS 101 -5.684 -18.121 2.087 807 HG3 LYS 101 HG3 LYS 101 -4.989 -18.807 3.564 808 HD2 LYS 101 HD2 LYS 101 -4.671 -20.460 1.903 809 HD3 LYS 101 HD3 LYS 101 -6.042 -21.031 2.875 810 HE2 LYS 101 HE2 LYS 101 -7.606 -20.089 1.156 811 HE3 LYS 101 HE3 LYS 101 -6.208 -19.594 0.182 812 HZ1 LYS 101 HZ1 LYS 101 -6.872 -22.385 0.941 813 HZ2 LYS 101 HZ2 LYS 101 -5.575 -21.933 0.032 814 HZ3 LYS 101 HZ3 LYS 101 -7.103 -21.721 -0.551 815 H LYS 102 H LYS 102 -10.036 -18.117 2.365 816 HA LYS 102 HA LYS 102 -9.235 -17.844 -0.435 817 HB2 LYS 102 HB2 LYS 102 -10.814 -19.567 0.066 818 HB3 LYS 102 HB3 LYS 102 -11.800 -18.491 1.049 819 HG2 LYS 102 HG2 LYS 102 -12.986 -19.018 -0.973 820 HG3 LYS 102 HG3 LYS 102 -12.575 -17.301 -0.983 821 HD2 LYS 102 HD2 LYS 102 -10.810 -17.660 -2.594 822 HD3 LYS 102 HD3 LYS 102 -10.968 -19.426 -2.447 823 HE2 LYS 102 HE2 LYS 102 -12.710 -19.499 -3.885 824 HE3 LYS 102 HE3 LYS 102 -13.533 -18.157 -3.071 825 HZ1 LYS 102 HZ1 LYS 102 -11.337 -17.767 -5.008 826 HZ2 LYS 102 HZ2 LYS 102 -12.306 -16.602 -4.337 827 HZ3 LYS 102 HZ3 LYS 102 -12.940 -17.696 -5.394 828 H SER 103 H SER 103 -11.493 -16.078 1.718 829 HA SER 103 HA SER 103 -12.295 -14.183 -0.230 830 HB2 SER 103 HB2 SER 103 -13.452 -14.554 1.918 831 HB3 SER 103 HB3 SER 103 -12.067 -13.864 2.788 832 HG SER 103 HG SER 103 -13.712 -12.528 0.882 833 H LEU 104 H LEU 104 -9.513 -14.140 2.048 834 HA LEU 104 HA LEU 104 -8.768 -11.456 1.291 835 HB2 LEU 104 HB2 LEU 104 -8.159 -12.562 3.427 836 HB3 LEU 104 HB3 LEU 104 -7.101 -13.659 2.546 837 HG LEU 104 HG LEU 104 -5.602 -11.857 1.961 838 HD11 LEU 104 HD11 LEU 104 -7.101 -9.981 1.596 839 HD12 LEU 104 HD12 LEU 104 -5.958 -9.540 2.877 840 HD13 LEU 104 HD13 LEU 104 -7.612 -10.010 3.302 841 HD21 LEU 104 HD21 LEU 104 -5.410 -12.916 4.215 842 HD22 LEU 104 HD22 LEU 104 -6.414 -11.617 4.892 843 HD23 LEU 104 HD23 LEU 104 -4.822 -11.243 4.195 844 H GLN 105 H GLN 105 -7.753 -14.728 0.110 845 HA GLN 105 HA GLN 105 -5.620 -13.605 -1.479 846 HB2 GLN 105 HB2 GLN 105 -7.046 -16.258 -1.526 847 HB3 GLN 105 HB3 GLN 105 -5.815 -15.838 -2.725 848 HG2 GLN 105 HG2 GLN 105 -5.311 -15.725 0.254 849 HG3 GLN 105 HG3 GLN 105 -4.996 -17.160 -0.725 850 HE21 GLN 105 HE21 GLN 105 -3.943 -13.915 0.069 851 HE22 GLN 105 HE22 GLN 105 -2.423 -14.003 -0.786 852 H GLU 106 H GLU 106 -9.085 -14.152 -2.218 853 HA GLU 106 HA GLU 106 -8.605 -13.703 -5.041 854 HB2 GLU 106 HB2 GLU 106 -10.989 -13.522 -5.287 855 HB3 GLU 106 HB3 GLU 106 -10.571 -14.895 -4.260 856 HG2 GLU 106 HG2 GLU 106 -11.152 -13.569 -2.275 857 HG3 GLU 106 HG3 GLU 106 -11.628 -12.221 -3.320 858 H LEU 107 H LEU 107 -9.252 -11.528 -2.269 859 HA LEU 107 HA LEU 107 -9.489 -9.198 -4.011 860 HB2 LEU 107 HB2 LEU 107 -8.771 -9.392 -1.069 861 HB3 LEU 107 HB3 LEU 107 -9.017 -7.905 -1.961 862 HG LEU 107 HG LEU 107 -11.062 -9.849 -0.987 863 HD11 LEU 107 HD11 LEU 107 -10.802 -6.817 -0.978 864 HD12 LEU 107 HD12 LEU 107 -10.314 -7.889 0.349 865 HD13 LEU 107 HD13 LEU 107 -12.026 -7.770 -0.112 866 HD21 LEU 107 HD21 LEU 107 -11.476 -7.819 -3.225 867 HD22 LEU 107 HD22 LEU 107 -12.787 -8.585 -2.296 868 HD23 LEU 107 HD23 LEU 107 -11.734 -9.583 -3.318 869 H THR 108 H THR 108 -6.863 -10.892 -2.329 870 HA THR 108 HA THR 108 -4.779 -9.007 -2.803 871 HB THR 108 HB THR 108 -4.597 -12.082 -2.822 872 HG1 THR 108 HG1 THR 108 -5.489 -11.120 -0.890 873 HG21 THR 108 HG21 THR 108 -2.254 -11.699 -2.044 874 HG22 THR 108 HG22 THR 108 -2.466 -9.959 -2.365 875 HG23 THR 108 HG23 THR 108 -2.536 -11.127 -3.707 876 H SER 109 H SER 109 -6.121 -11.646 -4.835 877 HA SER 109 HA SER 109 -4.294 -11.168 -7.005 878 HB2 SER 109 HB2 SER 109 -7.080 -12.411 -7.074 879 HB3 SER 109 HB3 SER 109 -5.791 -12.622 -8.279 880 HG SER 109 HG SER 109 -5.827 -13.489 -5.563 881 H LYS 110 H LYS 110 -7.596 -9.973 -6.247 882 HA LYS 110 HA LYS 110 -8.090 -8.729 -8.775 883 HB2 LYS 110 HB2 LYS 110 -9.743 -9.317 -6.961 884 HB3 LYS 110 HB3 LYS 110 -9.175 -7.910 -6.058 885 HG2 LYS 110 HG2 LYS 110 -9.849 -6.474 -8.015 886 HG3 LYS 110 HG3 LYS 110 -10.562 -7.914 -8.764 887 HD2 LYS 110 HD2 LYS 110 -11.336 -6.800 -6.031 888 HD3 LYS 110 HD3 LYS 110 -12.217 -6.480 -7.533 889 HE2 LYS 110 HE2 LYS 110 -12.642 -8.930 -7.781 890 HE3 LYS 110 HE3 LYS 110 -11.823 -9.208 -6.229 891 HZ1 LYS 110 HZ1 LYS 110 -14.266 -7.568 -6.610 892 HZ2 LYS 110 HZ2 LYS 110 -13.492 -7.793 -5.172 893 HZ3 LYS 110 HZ3 LYS 110 -14.209 -9.071 -5.927 894 H LEU 111 H LEU 111 -6.639 -7.478 -5.769 895 HA LEU 111 HA LEU 111 -6.451 -4.750 -6.592 896 HB2 LEU 111 HB2 LEU 111 -6.107 -5.759 -4.295 897 HB3 LEU 111 HB3 LEU 111 -4.527 -6.305 -4.819 898 HG LEU 111 HG LEU 111 -5.354 -3.382 -4.674 899 HD11 LEU 111 HD11 LEU 111 -5.515 -4.344 -2.477 900 HD12 LEU 111 HD12 LEU 111 -4.016 -3.406 -2.547 901 HD13 LEU 111 HD13 LEU 111 -3.950 -5.178 -2.661 902 HD21 LEU 111 HD21 LEU 111 -3.416 -3.617 -6.085 903 HD22 LEU 111 HD22 LEU 111 -2.633 -4.712 -4.922 904 HD23 LEU 111 HD23 LEU 111 -2.885 -2.996 -4.519 905 H PHE 112 H PHE 112 -4.264 -7.556 -6.996 906 HA PHE 112 HA PHE 112 -2.208 -6.028 -8.281 907 HB2 PHE 112 HB2 PHE 112 -2.813 -8.951 -7.986 908 HB3 PHE 112 HB3 PHE 112 -1.519 -8.405 -9.059 909 HD1 PHE 112 HD1 PHE 112 -2.675 -7.468 -5.568 910 HD2 PHE 112 HD2 PHE 112 0.590 -8.519 -8.159 911 HE1 PHE 112 HE1 PHE 112 -1.127 -7.255 -3.669 912 HE2 PHE 112 HE2 PHE 112 2.157 -8.287 -6.249 913 HZ PHE 112 HZ PHE 112 1.291 -7.645 -3.997 914 H SER 113 H SER 113 -5.142 -7.520 -9.548 915 HA SER 113 HA SER 113 -4.319 -7.442 -12.313 916 HB2 SER 113 HB2 SER 113 -6.314 -8.679 -11.556 917 HB3 SER 113 HB3 SER 113 -7.086 -7.155 -11.071 918 HG SER 113 HG SER 113 -6.179 -7.623 -13.716 919 H SER 114 H SER 114 -5.563 -5.049 -10.010 920 HA SER 114 HA SER 114 -5.989 -2.999 -12.025 921 HB2 SER 114 HB2 SER 114 -5.623 -2.670 -9.030 922 HB3 SER 114 HB3 SER 114 -6.356 -1.511 -10.154 923 HG SER 114 HG SER 114 -7.329 -4.125 -9.553 924 H ILE 115 H ILE 115 -3.278 -4.066 -10.026 925 HA ILE 115 HA ILE 115 -1.611 -1.750 -10.474 926 HB ILE 115 HB ILE 115 -0.906 -4.684 -9.922 927 HG12 ILE 115 HG12 ILE 115 -0.817 -2.236 -8.118 928 HG13 ILE 115 HG13 ILE 115 -2.120 -3.423 -8.134 929 HG21 ILE 115 HG21 ILE 115 0.991 -3.687 -11.094 930 HG22 ILE 115 HG22 ILE 115 0.939 -2.267 -10.038 931 HG23 ILE 115 HG23 ILE 115 1.407 -3.849 -9.382 932 HD11 ILE 115 HD11 ILE 115 -0.259 -5.179 -7.598 933 HD12 ILE 115 HD12 ILE 115 0.712 -3.753 -7.152 934 HD13 ILE 115 HD13 ILE 115 -0.805 -4.089 -6.308 935 H ASP 116 H ASP 116 -2.155 -4.840 -12.186 936 HA ASP 116 HA ASP 116 -0.143 -4.425 -14.152 937 HB2 ASP 116 HB2 ASP 116 -1.278 -6.587 -13.558 938 HB3 ASP 116 HB3 ASP 116 -2.697 -6.026 -14.452 939 H ASN 117 H ASN 117 -3.682 -3.615 -14.264 940 HA ASN 117 HA ASN 117 -3.328 -2.707 -17.005 941 HB2 ASN 117 HB2 ASN 117 -5.639 -1.857 -16.877 942 HB3 ASN 117 HB3 ASN 117 -5.470 -3.565 -16.458 943 HD21 ASN 117 HD21 ASN 117 -7.142 -3.895 -15.171 944 HD22 ASN 117 HD22 ASN 117 -7.443 -3.020 -13.690 945 H LEU 118 H LEU 118 -2.987 -1.107 -13.888 946 HA LEU 118 HA LEU 118 -3.061 1.580 -14.949 947 HB2 LEU 118 HB2 LEU 118 -3.029 0.583 -12.496 948 HB3 LEU 118 HB3 LEU 118 -1.295 0.771 -12.651 949 HG LEU 118 HG LEU 118 -3.343 3.007 -12.874 950 HD11 LEU 118 HD11 LEU 118 -1.519 2.160 -10.587 951 HD12 LEU 118 HD12 LEU 118 -3.290 1.987 -10.646 952 HD13 LEU 118 HD13 LEU 118 -2.560 3.605 -10.604 953 HD21 LEU 118 HD21 LEU 118 -1.307 3.617 -14.052 954 HD22 LEU 118 HD22 LEU 118 -0.320 3.102 -12.667 955 HD23 LEU 118 HD23 LEU 118 -1.401 4.508 -12.524 956 H ASP 119 H ASP 119 -0.563 -0.918 -14.546 957 HA ASP 119 HA ASP 119 1.676 0.626 -15.481 958 HB2 ASP 119 HB2 ASP 119 2.171 -1.338 -14.280 959 HB3 ASP 119 HB3 ASP 119 0.997 -2.297 -15.179 960 H HIS 120 H HIS 120 -0.651 -1.554 -17.188 961 HA HIS 120 HA HIS 120 0.556 -1.179 -19.762 962 HB2 HIS 120 HB2 HIS 120 -2.222 -1.958 -18.872 963 HB3 HIS 120 HB3 HIS 120 -1.832 -1.716 -20.577 964 HD1 HIS 120 HD1 HIS 120 -1.038 -4.063 -17.687 965 HD2 HIS 120 HD2 HIS 120 -0.312 -3.665 -21.778 966 HE1 HIS 120 HE1 HIS 120 -0.055 -6.247 -18.474 967 H ALA 121 H ALA 121 -1.942 0.724 -18.017 968 HA ALA 121 HA ALA 121 -2.527 2.461 -20.217 969 HB1 ALA 121 HB1 ALA 121 -3.417 3.970 -18.486 970 HB2 ALA 121 HB2 ALA 121 -3.958 2.294 -18.260 971 HB3 ALA 121 HB3 ALA 121 -2.673 2.959 -17.224 972 H ALA 122 H ALA 122 0.046 2.466 -17.766 973 HA ALA 122 HA ALA 122 1.005 5.108 -18.355 974 HB1 ALA 122 HB1 ALA 122 3.058 4.382 -17.246 975 HB2 ALA 122 HB2 ALA 122 1.648 3.781 -16.346 976 HB3 ALA 122 HB3 ALA 122 2.573 2.680 -17.389 977 H LYS 123 H LYS 123 1.765 1.855 -19.690 978 HA LYS 123 HA LYS 123 3.775 2.976 -21.472 979 HB2 LYS 123 HB2 LYS 123 2.421 0.266 -21.424 980 HB3 LYS 123 HB3 LYS 123 3.730 0.729 -22.526 981 HG2 LYS 123 HG2 LYS 123 5.039 1.386 -20.415 982 HG3 LYS 123 HG3 LYS 123 3.835 0.430 -19.526 983 HD2 LYS 123 HD2 LYS 123 4.372 -1.522 -20.938 984 HD3 LYS 123 HD3 LYS 123 5.559 -0.537 -21.829 985 HE2 LYS 123 HE2 LYS 123 6.709 -0.099 -19.623 986 HE3 LYS 123 HE3 LYS 123 5.622 -1.304 -18.900 987 HZ1 LYS 123 HZ1 LYS 123 6.473 -2.861 -20.643 988 HZ2 LYS 123 HZ2 LYS 123 7.598 -2.421 -19.524 989 HZ3 LYS 123 HZ3 LYS 123 7.625 -1.748 -21.035 990 H ILE 124 H ILE 124 0.307 2.510 -21.749 991 HA ILE 124 HA ILE 124 0.414 2.950 -24.654 992 HB ILE 124 HB ILE 124 -1.460 1.687 -23.185 993 HG12 ILE 124 HG12 ILE 124 -3.102 2.247 -25.086 994 HG13 ILE 124 HG13 ILE 124 -1.827 3.288 -25.729 995 HG21 ILE 124 HG21 ILE 124 -2.697 4.455 -23.524 996 HG22 ILE 124 HG22 ILE 124 -3.468 3.005 -22.846 997 HG23 ILE 124 HG23 ILE 124 -2.144 3.785 -21.976 998 HD11 ILE 124 HD11 ILE 124 -1.840 1.051 -26.805 999 HD12 ILE 124 HD12 ILE 124 -0.316 1.335 -25.935 1000 HD13 ILE 124 HD13 ILE 124 -1.568 0.287 -25.222 1001 H LYS 125 H LYS 125 0.854 4.750 -21.912 1002 HA LYS 125 HA LYS 125 1.326 6.919 -21.525 1003 HB2 LYS 125 HB2 LYS 125 1.030 7.393 -24.498 1004 HB3 LYS 125 HB3 LYS 125 1.871 8.424 -23.344 1005 HG2 LYS 125 HG2 LYS 125 3.603 6.797 -23.005 1006 HG3 LYS 125 HG3 LYS 125 2.722 5.564 -23.906 1007 HD2 LYS 125 HD2 LYS 125 3.652 8.151 -25.162 1008 HD3 LYS 125 HD3 LYS 125 4.617 6.660 -25.150 1009 HE2 LYS 125 HE2 LYS 125 2.738 5.453 -26.273 1010 HE3 LYS 125 HE3 LYS 125 1.838 6.978 -26.367 1011 HZ1 LYS 125 HZ1 LYS 125 2.997 6.527 -28.418 1012 HZ2 LYS 125 HZ2 LYS 125 4.453 6.454 -27.649 1013 HZ3 LYS 125 HZ3 LYS 125 3.630 7.882 -27.723 1014 H SER 126 H SER 126 -1.426 5.998 -21.464 1015 HA SER 126 HA SER 126 -2.892 8.507 -22.136 1016 HB2 SER 126 HB2 SER 126 -3.856 6.411 -22.962 1017 HB3 SER 126 HB3 SER 126 -3.894 5.768 -21.310 1018 HG SER 126 HG SER 126 -5.887 6.715 -22.143 1019 HA PRO 127 HA PRO 127 -2.158 8.919 -17.713 1020 HB2 PRO 127 HB2 PRO 127 -2.825 11.558 -17.385 1021 HB3 PRO 127 HB3 PRO 127 -1.243 11.033 -18.041 1022 HG2 PRO 127 HG2 PRO 127 -3.708 11.909 -19.532 1023 HG3 PRO 127 HG3 PRO 127 -2.013 12.458 -19.732 1024 HD2 PRO 127 HD2 PRO 127 -3.090 10.583 -21.353 1025 HD3 PRO 127 HD3 PRO 127 -1.378 10.474 -20.814 1026 H THR 128 H THR 128 -5.052 9.924 -19.534 1027 HA THR 128 HA THR 128 -6.749 10.237 -17.263 1028 HB THR 128 HB THR 128 -7.881 9.229 -19.846 1029 HG1 THR 128 HG1 THR 128 -6.762 11.830 -19.652 1030 HG21 THR 128 HG21 THR 128 -9.390 11.135 -19.516 1031 HG22 THR 128 HG22 THR 128 -8.409 11.704 -18.143 1032 HG23 THR 128 HG23 THR 128 -9.300 10.171 -18.026 1033 H GLU 129 H GLU 129 -5.900 7.411 -19.298 1034 HA GLU 129 HA GLU 129 -7.796 5.629 -18.022 1035 HB2 GLU 129 HB2 GLU 129 -5.267 5.242 -19.625 1036 HB3 GLU 129 HB3 GLU 129 -6.130 3.875 -18.908 1037 HG2 GLU 129 HG2 GLU 129 -8.061 4.264 -20.215 1038 HG3 GLU 129 HG3 GLU 129 -7.490 5.868 -20.713 1039 H ALA 130 H ALA 130 -4.345 6.443 -17.529 1040 HA ALA 130 HA ALA 130 -3.902 4.568 -15.436 1041 HB1 ALA 130 HB1 ALA 130 -2.604 7.278 -15.933 1042 HB2 ALA 130 HB2 ALA 130 -1.972 6.000 -14.872 1043 HB3 ALA 130 HB3 ALA 130 -2.085 5.722 -16.625 1044 H GLU 131 H GLU 131 -5.174 7.933 -15.372 1045 HA GLU 131 HA GLU 131 -5.305 8.123 -12.514 1046 HB2 GLU 131 HB2 GLU 131 -6.765 9.484 -14.776 1047 HB3 GLU 131 HB3 GLU 131 -7.210 9.773 -13.089 1048 HG2 GLU 131 HG2 GLU 131 -4.878 10.438 -12.596 1049 HG3 GLU 131 HG3 GLU 131 -4.487 10.268 -14.313 1050 H LYS 132 H LYS 132 -7.595 6.831 -14.959 1051 HA LYS 132 HA LYS 132 -9.760 6.406 -13.083 1052 HB2 LYS 132 HB2 LYS 132 -9.144 5.695 -15.871 1053 HB3 LYS 132 HB3 LYS 132 -9.961 4.390 -15.015 1054 HG2 LYS 132 HG2 LYS 132 -11.797 5.499 -15.800 1055 HG3 LYS 132 HG3 LYS 132 -11.608 6.303 -14.240 1056 HD2 LYS 132 HD2 LYS 132 -11.984 8.052 -15.796 1057 HD3 LYS 132 HD3 LYS 132 -10.246 8.096 -15.464 1058 HE2 LYS 132 HE2 LYS 132 -10.638 8.376 -17.858 1059 HE3 LYS 132 HE3 LYS 132 -9.818 6.837 -17.567 1060 HZ1 LYS 132 HZ1 LYS 132 -11.604 6.596 -19.159 1061 HZ2 LYS 132 HZ2 LYS 132 -12.716 7.159 -18.075 1062 HZ3 LYS 132 HZ3 LYS 132 -11.950 5.723 -17.803 1063 H TYR 133 H TYR 133 -7.179 4.268 -14.368 1064 HA TYR 133 HA TYR 133 -7.992 2.006 -12.810 1065 HB2 TYR 133 HB2 TYR 133 -5.322 2.756 -14.038 1066 HB3 TYR 133 HB3 TYR 133 -5.652 1.202 -13.260 1067 HD1 TYR 133 HD1 TYR 133 -8.310 0.428 -14.203 1068 HD2 TYR 133 HD2 TYR 133 -5.145 2.386 -16.352 1069 HE1 TYR 133 HE1 TYR 133 -9.210 -0.464 -16.345 1070 HE2 TYR 133 HE2 TYR 133 -6.053 1.478 -18.499 1071 HH TYR 133 HH TYR 133 -8.948 -0.598 -18.607 1072 H TYR 134 H TYR 134 -5.864 4.781 -12.128 1073 HA TYR 134 HA TYR 134 -4.806 3.780 -9.677 1074 HB2 TYR 134 HB2 TYR 134 -3.916 5.789 -10.709 1075 HB3 TYR 134 HB3 TYR 134 -5.471 6.606 -10.555 1076 HD1 TYR 134 HD1 TYR 134 -2.724 5.079 -8.514 1077 HD2 TYR 134 HD2 TYR 134 -6.015 7.848 -8.609 1078 HE1 TYR 134 HE1 TYR 134 -2.071 5.934 -6.275 1079 HE2 TYR 134 HE2 TYR 134 -5.358 8.692 -6.351 1080 HH TYR 134 HH TYR 134 -2.455 7.529 -4.652 1081 H GLY 135 H GLY 135 -7.840 5.637 -10.351 1082 HA2 GLY 135 HA2 GLY 135 -8.659 5.748 -7.624 1083 HA3 GLY 135 HA3 GLY 135 -9.736 5.824 -9.033 1084 H GLN 136 H GLN 136 -9.169 3.255 -10.126 1085 HA GLN 136 HA GLN 136 -10.894 1.601 -8.511 1086 HB2 GLN 136 HB2 GLN 136 -9.023 0.932 -10.814 1087 HB3 GLN 136 HB3 GLN 136 -10.198 -0.195 -10.125 1088 HG2 GLN 136 HG2 GLN 136 -12.046 1.094 -10.901 1089 HG3 GLN 136 HG3 GLN 136 -11.027 2.493 -11.259 1090 HE21 GLN 136 HE21 GLN 136 -10.761 -0.983 -12.079 1091 HE22 GLN 136 HE22 GLN 136 -10.627 -0.713 -13.800 1092 H THR 137 H THR 137 -7.357 1.816 -8.918 1093 HA THR 137 HA THR 137 -6.766 -0.533 -7.374 1094 HB THR 137 HB THR 137 -4.968 1.905 -7.797 1095 HG1 THR 137 HG1 THR 137 -5.685 1.107 -9.802 1096 HG21 THR 137 HG21 THR 137 -3.169 0.224 -7.654 1097 HG22 THR 137 HG22 THR 137 -4.372 -1.041 -7.321 1098 HG23 THR 137 HG23 THR 137 -4.119 0.277 -6.156 1099 H VAL 138 H VAL 138 -7.064 2.959 -6.531 1100 HA VAL 138 HA VAL 138 -6.287 2.754 -3.795 1101 HB VAL 138 HB VAL 138 -8.390 4.564 -5.111 1102 HG11 VAL 138 HG11 VAL 138 -8.056 6.059 -3.115 1103 HG12 VAL 138 HG12 VAL 138 -8.854 4.525 -2.723 1104 HG13 VAL 138 HG13 VAL 138 -7.130 4.752 -2.341 1105 HG21 VAL 138 HG21 VAL 138 -5.847 4.692 -5.787 1106 HG22 VAL 138 HG22 VAL 138 -6.731 6.181 -5.418 1107 HG23 VAL 138 HG23 VAL 138 -5.648 5.466 -4.214 1108 H SER 139 H SER 139 -9.487 2.273 -5.375 1109 HA SER 139 HA SER 139 -10.910 1.767 -2.954 1110 HB2 SER 139 HB2 SER 139 -11.937 2.253 -5.186 1111 HB3 SER 139 HB3 SER 139 -11.475 0.622 -5.716 1112 HG SER 139 HG SER 139 -12.708 -0.090 -3.779 1113 H ASN 140 H ASN 140 -9.197 -0.461 -5.199 1114 HA ASN 140 HA ASN 140 -9.954 -2.849 -3.770 1115 HB2 ASN 140 HB2 ASN 140 -7.812 -2.142 -5.768 1116 HB3 ASN 140 HB3 ASN 140 -7.744 -3.686 -4.910 1117 HD21 ASN 140 HD21 ASN 140 -8.939 -2.128 -7.603 1118 HD22 ASN 140 HD22 ASN 140 -10.138 -3.314 -8.053 1119 H ILE 141 H ILE 141 -7.234 -0.558 -3.419 1120 HA ILE 141 HA ILE 141 -5.772 -2.164 -1.524 1121 HB ILE 141 HB ILE 141 -5.807 0.858 -2.032 1122 HG12 ILE 141 HG12 ILE 141 -3.561 -1.117 -2.529 1123 HG13 ILE 141 HG13 ILE 141 -4.835 -0.876 -3.719 1124 HG21 ILE 141 HG21 ILE 141 -4.073 -0.760 -0.107 1125 HG22 ILE 141 HG22 ILE 141 -3.642 0.870 -0.656 1126 HG23 ILE 141 HG23 ILE 141 -5.124 0.617 0.288 1127 HD11 ILE 141 HD11 ILE 141 -2.908 0.474 -4.287 1128 HD12 ILE 141 HD12 ILE 141 -4.260 1.531 -3.842 1129 HD13 ILE 141 HD13 ILE 141 -2.926 1.252 -2.695 1130 H ASN 142 H ASN 142 -8.280 0.393 -1.178 1131 HA ASN 142 HA ASN 142 -8.340 0.396 1.655 1132 HB2 ASN 142 HB2 ASN 142 -9.524 2.004 0.129 1133 HB3 ASN 142 HB3 ASN 142 -10.710 0.734 -0.205 1134 HD21 ASN 142 HD21 ASN 142 -12.509 0.912 0.926 1135 HD22 ASN 142 HD22 ASN 142 -12.626 1.556 2.544 1136 H GLU 143 H GLU 143 -10.119 -1.691 -0.664 1137 HA GLU 143 HA GLU 143 -11.696 -2.998 1.324 1138 HB2 GLU 143 HB2 GLU 143 -10.746 -3.788 -1.443 1139 HB3 GLU 143 HB3 GLU 143 -11.760 -4.857 -0.470 1140 HG2 GLU 143 HG2 GLU 143 -12.671 -2.041 -0.943 1141 HG3 GLU 143 HG3 GLU 143 -12.812 -3.240 -2.241 1142 H VAL 144 H VAL 144 -8.506 -3.820 -0.073 1143 HA VAL 144 HA VAL 144 -8.294 -6.282 1.435 1144 HB VAL 144 HB VAL 144 -6.182 -4.505 0.111 1145 HG11 VAL 144 HG11 VAL 144 -5.855 -7.234 1.439 1146 HG12 VAL 144 HG12 VAL 144 -4.653 -6.483 0.359 1147 HG13 VAL 144 HG13 VAL 144 -5.062 -5.712 1.899 1148 HG21 VAL 144 HG21 VAL 144 -6.120 -6.345 -1.552 1149 HG22 VAL 144 HG22 VAL 144 -7.371 -7.208 -0.641 1150 HG23 VAL 144 HG23 VAL 144 -7.751 -5.660 -1.425 1151 H LEU 145 H LEU 145 -7.522 -2.853 2.057 1152 HA LEU 145 HA LEU 145 -5.945 -3.295 4.411 1153 HB2 LEU 145 HB2 LEU 145 -7.183 -1.053 3.036 1154 HB3 LEU 145 HB3 LEU 145 -7.357 -0.889 4.772 1155 HG LEU 145 HG LEU 145 -4.931 -1.023 5.064 1156 HD11 LEU 145 HD11 LEU 145 -4.845 -1.269 2.043 1157 HD12 LEU 145 HD12 LEU 145 -4.228 -2.430 3.232 1158 HD13 LEU 145 HD13 LEU 145 -3.445 -0.849 3.051 1159 HD21 LEU 145 HD21 LEU 145 -6.029 1.157 4.700 1160 HD22 LEU 145 HD22 LEU 145 -5.771 0.992 2.947 1161 HD23 LEU 145 HD23 LEU 145 -4.379 1.142 4.044 1162 H ALA 146 H ALA 146 -9.455 -3.029 3.920 1163 HA ALA 146 HA ALA 146 -10.082 -2.972 6.734 1164 HB1 ALA 146 HB1 ALA 146 -11.681 -2.265 4.963 1165 HB2 ALA 146 HB2 ALA 146 -11.748 -3.933 4.351 1166 HB3 ALA 146 HB3 ALA 146 -12.369 -3.555 5.976 1167 H LYS 147 H LYS 147 -9.552 -5.594 4.377 1168 HA LYS 147 HA LYS 147 -10.303 -7.668 6.301 1169 HB2 LYS 147 HB2 LYS 147 -8.791 -7.771 3.674 1170 HB3 LYS 147 HB3 LYS 147 -9.242 -9.179 4.637 1171 HG2 LYS 147 HG2 LYS 147 -11.669 -8.237 4.466 1172 HG3 LYS 147 HG3 LYS 147 -11.023 -7.285 3.120 1173 HD2 LYS 147 HD2 LYS 147 -11.883 -9.246 2.116 1174 HD3 LYS 147 HD3 LYS 147 -10.128 -9.491 2.177 1175 HE2 LYS 147 HE2 LYS 147 -11.181 -11.544 2.874 1176 HE3 LYS 147 HE3 LYS 147 -10.461 -10.812 4.316 1177 HZ1 LYS 147 HZ1 LYS 147 -12.686 -9.917 4.841 1178 HZ2 LYS 147 HZ2 LYS 147 -12.677 -11.567 4.801 1179 HZ3 LYS 147 HZ3 LYS 147 -13.322 -10.718 3.544 1180 H LEU 148 H LEU 148 -7.567 -5.715 5.927 1181 HA LEU 148 HA LEU 148 -5.794 -7.675 7.309 1182 HB2 LEU 148 HB2 LEU 148 -5.287 -4.917 6.153 1183 HB3 LEU 148 HB3 LEU 148 -4.076 -5.868 6.992 1184 HG LEU 148 HG LEU 148 -5.378 -6.722 4.401 1185 HD11 LEU 148 HD11 LEU 148 -2.781 -5.255 4.968 1186 HD12 LEU 148 HD12 LEU 148 -4.178 -4.655 4.048 1187 HD13 LEU 148 HD13 LEU 148 -3.201 -5.984 3.399 1188 HD21 LEU 148 HD21 LEU 148 -3.500 -8.252 4.224 1189 HD22 LEU 148 HD22 LEU 148 -4.459 -8.573 5.683 1190 HD23 LEU 148 HD23 LEU 148 -2.908 -7.713 5.807 1191 H GLY 149 H GLY 149 -8.237 -5.679 8.183 1192 HA2 GLY 149 HA2 GLY 149 -6.880 -4.316 10.413 1193 HA3 GLY 149 HA3 GLY 149 -8.602 -4.243 9.997 Start of MODEL 3 1 H1 GLU 1 H1 GLU 1 -3.626 0.815 23.737 2 H2 GLU 1 H2 GLU 1 -2.787 -0.092 24.840 3 H3 GLU 1 H3 GLU 1 -4.149 -0.699 24.131 4 HA GLU 1 HA GLU 1 -4.560 -0.009 26.406 5 HB2 GLU 1 HB2 GLU 1 -3.940 2.763 25.303 6 HB3 GLU 1 HB3 GLU 1 -4.510 2.378 26.934 7 HG2 GLU 1 HG2 GLU 1 -1.830 1.810 25.684 8 HG3 GLU 1 HG3 GLU 1 -2.191 2.685 27.183 9 H ALA 2 H ALA 2 -6.571 1.129 27.051 10 HA ALA 2 HA ALA 2 -8.625 0.694 25.079 11 HB1 ALA 2 HB1 ALA 2 -8.723 2.134 27.775 12 HB2 ALA 2 HB2 ALA 2 -10.130 1.576 26.839 13 HB3 ALA 2 HB3 ALA 2 -8.994 0.391 27.523 14 H ARG 3 H ARG 3 -10.016 2.259 24.138 15 HA ARG 3 HA ARG 3 -9.352 5.112 24.227 16 HB2 ARG 3 HB2 ARG 3 -8.817 5.273 21.829 17 HB3 ARG 3 HB3 ARG 3 -7.649 4.216 22.631 18 HG2 ARG 3 HG2 ARG 3 -9.056 2.249 21.833 19 HG3 ARG 3 HG3 ARG 3 -9.951 3.403 20.831 20 HD2 ARG 3 HD2 ARG 3 -7.865 4.047 19.701 21 HD3 ARG 3 HD3 ARG 3 -6.948 2.937 20.737 22 HE ARG 3 HE ARG 3 -8.639 2.252 18.449 23 HH11 ARG 3 HH11 ARG 3 -7.064 0.955 21.346 24 HH12 ARG 3 HH12 ARG 3 -7.108 -0.679 20.737 25 HH21 ARG 3 HH21 ARG 3 -8.656 0.142 17.757 26 HH22 ARG 3 HH22 ARG 3 -7.992 -1.127 18.747 27 HA PRO 4 HA PRO 4 -13.629 4.776 23.273 28 HB2 PRO 4 HB2 PRO 4 -14.270 6.950 21.739 29 HB3 PRO 4 HB3 PRO 4 -13.867 7.094 23.480 30 HG2 PRO 4 HG2 PRO 4 -12.081 7.500 21.086 31 HG3 PRO 4 HG3 PRO 4 -12.341 8.581 22.494 32 HD2 PRO 4 HD2 PRO 4 -10.228 6.906 22.370 33 HD3 PRO 4 HD3 PRO 4 -11.083 7.207 23.923 34 H ILE 5 H ILE 5 -14.963 3.851 21.727 35 HA ILE 5 HA ILE 5 -14.096 3.773 18.903 36 HB ILE 5 HB ILE 5 -14.457 1.347 18.718 37 HG12 ILE 5 HG12 ILE 5 -16.043 1.118 20.661 38 HG13 ILE 5 HG13 ILE 5 -14.873 -0.170 20.454 39 HG21 ILE 5 HG21 ILE 5 -12.336 1.973 20.823 40 HG22 ILE 5 HG22 ILE 5 -12.399 0.507 19.815 41 HG23 ILE 5 HG23 ILE 5 -12.152 2.099 19.062 42 HD11 ILE 5 HD11 ILE 5 -15.178 0.313 22.837 43 HD12 ILE 5 HD12 ILE 5 -13.517 0.719 22.364 44 HD13 ILE 5 HD13 ILE 5 -14.722 2.006 22.600 45 H VAL 6 H VAL 6 -15.997 2.792 17.619 46 HA VAL 6 HA VAL 6 -18.585 3.091 19.040 47 HB VAL 6 HB VAL 6 -18.125 5.251 17.804 48 HG11 VAL 6 HG11 VAL 6 -18.173 3.519 15.291 49 HG12 VAL 6 HG12 VAL 6 -18.112 5.295 15.347 50 HG13 VAL 6 HG13 VAL 6 -16.745 4.345 15.959 51 HG21 VAL 6 HG21 VAL 6 -20.454 4.428 18.144 52 HG22 VAL 6 HG22 VAL 6 -20.277 5.402 16.671 53 HG23 VAL 6 HG23 VAL 6 -20.389 3.633 16.551 54 H VAL 7 H VAL 7 -20.173 1.668 18.128 55 HA VAL 7 HA VAL 7 -19.329 -0.134 15.966 56 HB VAL 7 HB VAL 7 -18.343 -1.183 18.033 57 HG11 VAL 7 HG11 VAL 7 -21.218 -1.339 19.046 58 HG12 VAL 7 HG12 VAL 7 -19.791 -2.069 19.813 59 HG13 VAL 7 HG13 VAL 7 -19.934 -0.304 19.712 60 HG21 VAL 7 HG21 VAL 7 -19.148 -2.603 16.161 61 HG22 VAL 7 HG22 VAL 7 -19.265 -3.417 17.733 62 HG23 VAL 7 HG23 VAL 7 -20.727 -2.755 16.973 63 H GLY 8 H GLY 8 -21.213 -1.046 14.987 64 HA2 GLY 8 HA2 GLY 8 -23.513 -1.278 14.627 65 HA3 GLY 8 HA3 GLY 8 -23.814 -0.574 16.229 66 HA PRO 9 HA PRO 9 -24.753 2.624 13.023 67 HB2 PRO 9 HB2 PRO 9 -27.138 3.509 14.006 68 HB3 PRO 9 HB3 PRO 9 -27.019 2.004 13.037 69 HG2 PRO 9 HG2 PRO 9 -27.057 2.327 16.030 70 HG3 PRO 9 HG3 PRO 9 -28.080 1.274 14.998 71 HD2 PRO 9 HD2 PRO 9 -25.871 0.332 16.245 72 HD3 PRO 9 HD3 PRO 9 -26.324 -0.230 14.598 73 HA PRO 10 HA PRO 10 -23.279 5.890 15.591 74 HB2 PRO 10 HB2 PRO 10 -24.199 8.188 14.422 75 HB3 PRO 10 HB3 PRO 10 -22.958 7.153 13.642 76 HG2 PRO 10 HG2 PRO 10 -25.933 7.186 13.203 77 HG3 PRO 10 HG3 PRO 10 -24.615 7.306 11.992 78 HD2 PRO 10 HD2 PRO 10 -25.825 4.959 12.504 79 HD3 PRO 10 HD3 PRO 10 -24.052 5.035 12.215 80 HA PRO 11 HA PRO 11 -26.476 6.842 18.467 81 HB2 PRO 11 HB2 PRO 11 -25.635 9.154 19.680 82 HB3 PRO 11 HB3 PRO 11 -24.815 7.581 19.928 83 HG2 PRO 11 HG2 PRO 11 -24.118 9.787 18.007 84 HG3 PRO 11 HG3 PRO 11 -23.069 8.965 19.203 85 HD2 PRO 11 HD2 PRO 11 -23.082 8.231 16.626 86 HD3 PRO 11 HD3 PRO 11 -22.983 6.995 17.929 87 HA PRO 12 HA PRO 12 -29.251 9.655 16.495 88 HB2 PRO 12 HB2 PRO 12 -31.162 10.084 18.363 89 HB3 PRO 12 HB3 PRO 12 -30.841 8.441 17.723 90 HG2 PRO 12 HG2 PRO 12 -29.790 9.723 20.234 91 HG3 PRO 12 HG3 PRO 12 -30.647 8.159 20.046 92 HD2 PRO 12 HD2 PRO 12 -27.939 8.310 20.145 93 HD3 PRO 12 HD3 PRO 12 -28.779 7.116 19.095 94 H LEU 13 H LEU 13 -26.989 10.929 18.356 95 HA LEU 13 HA LEU 13 -27.885 13.676 17.924 96 HB2 LEU 13 HB2 LEU 13 -27.522 14.477 20.114 97 HB3 LEU 13 HB3 LEU 13 -28.670 13.165 20.266 98 HG LEU 13 HG LEU 13 -25.714 12.875 20.914 99 HD11 LEU 13 HD11 LEU 13 -26.374 13.219 23.264 100 HD12 LEU 13 HD12 LEU 13 -28.042 13.571 22.749 101 HD13 LEU 13 HD13 LEU 13 -26.709 14.656 22.278 102 HD21 LEU 13 HD21 LEU 13 -26.499 10.985 22.330 103 HD22 LEU 13 HD22 LEU 13 -26.842 10.722 20.613 104 HD23 LEU 13 HD23 LEU 13 -28.149 11.220 21.707 105 H SER 14 H SER 14 -25.883 15.105 18.205 106 HA SER 14 HA SER 14 -23.372 13.551 17.997 107 HB2 SER 14 HB2 SER 14 -24.489 13.803 15.710 108 HB3 SER 14 HB3 SER 14 -24.197 15.548 15.867 109 HG SER 14 HG SER 14 -22.490 14.626 14.760 110 H GLY 15 H GLY 15 -21.550 15.217 17.459 111 HA2 GLY 15 HA2 GLY 15 -20.635 17.393 17.921 112 HA3 GLY 15 HA3 GLY 15 -21.927 17.684 19.100 113 H GLY 16 H GLY 16 -18.815 17.563 19.172 114 HA2 GLY 16 HA2 GLY 16 -17.395 17.175 20.971 115 HA3 GLY 16 HA3 GLY 16 -18.712 16.359 21.820 116 H LEU 17 H LEU 17 -18.384 15.030 18.737 117 HA LEU 17 HA LEU 17 -16.338 13.054 19.542 118 HB2 LEU 17 HB2 LEU 17 -17.691 11.200 19.417 119 HB3 LEU 17 HB3 LEU 17 -18.740 12.334 20.238 120 HG LEU 17 HG LEU 17 -18.927 11.592 17.298 121 HD11 LEU 17 HD11 LEU 17 -20.591 10.698 19.683 122 HD12 LEU 17 HD12 LEU 17 -19.414 9.702 18.791 123 HD13 LEU 17 HD13 LEU 17 -20.883 10.272 17.978 124 HD21 LEU 17 HD21 LEU 17 -21.200 12.590 17.445 125 HD22 LEU 17 HD22 LEU 17 -19.900 13.776 17.636 126 HD23 LEU 17 HD23 LEU 17 -20.795 13.205 19.070 127 HA PRO 18 HA PRO 18 -15.480 13.662 15.318 128 HB2 PRO 18 HB2 PRO 18 -14.519 11.303 14.343 129 HB3 PRO 18 HB3 PRO 18 -13.619 12.269 15.558 130 HG2 PRO 18 HG2 PRO 18 -15.453 9.918 16.000 131 HG3 PRO 18 HG3 PRO 18 -13.780 10.168 16.596 132 HD2 PRO 18 HD2 PRO 18 -15.925 10.709 18.143 133 HD3 PRO 18 HD3 PRO 18 -14.464 11.756 18.187 134 H GLY 19 H GLY 19 -16.282 13.449 13.185 135 HA2 GLY 19 HA2 GLY 19 -18.048 11.415 12.284 136 HA3 GLY 19 HA3 GLY 19 -19.005 12.770 12.944 137 H THR 20 H THR 20 -19.636 13.011 10.540 138 HA THR 20 HA THR 20 -17.578 13.945 8.701 139 HB THR 20 HB THR 20 -19.631 14.714 7.365 140 HG1 THR 20 HG1 THR 20 -20.998 14.856 9.280 141 HG21 THR 20 HG21 THR 20 -19.606 11.816 8.304 142 HG22 THR 20 HG22 THR 20 -18.566 12.491 7.027 143 HG23 THR 20 HG23 THR 20 -20.329 12.433 6.804 144 H GLU 21 H GLU 21 -19.602 15.359 11.158 145 HA GLU 21 HA GLU 21 -19.138 18.134 10.272 146 HB2 GLU 21 HB2 GLU 21 -20.281 18.707 12.381 147 HB3 GLU 21 HB3 GLU 21 -21.227 17.587 11.402 148 HG2 GLU 21 HG2 GLU 21 -19.471 16.444 13.565 149 HG3 GLU 21 HG3 GLU 21 -20.966 17.268 14.024 150 H ASN 22 H ASN 22 -17.448 15.715 11.867 151 HA ASN 22 HA ASN 22 -15.520 15.581 13.028 152 HB2 ASN 22 HB2 ASN 22 -15.052 17.286 11.008 153 HB3 ASN 22 HB3 ASN 22 -14.670 18.361 12.358 154 HD21 ASN 22 HD21 ASN 22 -12.887 17.294 10.346 155 HD22 ASN 22 HD22 ASN 22 -11.687 16.347 11.196 156 H SER 23 H SER 23 -13.934 17.488 14.392 157 HA SER 23 HA SER 23 -15.669 18.734 16.430 158 HB2 SER 23 HB2 SER 23 -15.371 16.338 17.140 159 HB3 SER 23 HB3 SER 23 -13.616 16.581 17.089 160 HG SER 23 HG SER 23 -14.835 16.858 19.183 161 H ASP 24 H ASP 24 -14.058 19.867 18.039 162 HA ASP 24 HA ASP 24 -12.199 21.373 16.365 163 HB2 ASP 24 HB2 ASP 24 -11.911 22.773 18.324 164 HB3 ASP 24 HB3 ASP 24 -13.635 22.422 18.125 165 H GLN 25 H GLN 25 -12.020 18.892 18.833 166 HA GLN 25 HA GLN 25 -9.077 18.636 18.360 167 HB2 GLN 25 HB2 GLN 25 -10.483 18.764 21.058 168 HB3 GLN 25 HB3 GLN 25 -8.815 18.227 20.835 169 HG2 GLN 25 HG2 GLN 25 -8.152 20.426 20.054 170 HG3 GLN 25 HG3 GLN 25 -9.831 20.980 20.084 171 HE21 GLN 25 HE21 GLN 25 -10.700 21.765 21.898 172 HE22 GLN 25 HE22 GLN 25 -9.856 21.810 23.438 173 H ALA 26 H ALA 26 -12.069 17.261 19.686 174 HA ALA 26 HA ALA 26 -12.767 15.123 20.091 175 HB1 ALA 26 HB1 ALA 26 -12.339 13.433 18.400 176 HB2 ALA 26 HB2 ALA 26 -12.391 14.988 17.553 177 HB3 ALA 26 HB3 ALA 26 -10.824 14.233 17.892 178 H ARG 27 H ARG 27 -11.090 12.688 19.726 179 HA ARG 27 HA ARG 27 -9.235 13.075 22.041 180 HB2 ARG 27 HB2 ARG 27 -11.110 11.589 22.596 181 HB3 ARG 27 HB3 ARG 27 -10.781 10.599 21.171 182 HG2 ARG 27 HG2 ARG 27 -9.944 9.477 23.163 183 HG3 ARG 27 HG3 ARG 27 -8.591 9.940 22.125 184 HD2 ARG 27 HD2 ARG 27 -8.247 11.969 23.552 185 HD3 ARG 27 HD3 ARG 27 -9.518 11.373 24.641 186 HE ARG 27 HE ARG 27 -7.617 9.308 24.277 187 HH11 ARG 27 HH11 ARG 27 -7.712 12.515 25.738 188 HH12 ARG 27 HH12 ARG 27 -6.460 12.135 26.888 189 HH21 ARG 27 HH21 ARG 27 -6.028 8.885 25.774 190 HH22 ARG 27 HH22 ARG 27 -5.524 10.112 26.905 191 H ASP 28 H ASP 28 -9.724 11.719 18.858 192 HA ASP 28 HA ASP 28 -8.352 10.862 17.280 193 HB2 ASP 28 HB2 ASP 28 -7.438 13.254 17.810 194 HB3 ASP 28 HB3 ASP 28 -6.039 12.381 18.451 195 H GLY 29 H GLY 29 -5.521 10.325 17.314 196 HA2 GLY 29 HA2 GLY 29 -4.151 8.937 18.991 197 HA3 GLY 29 HA3 GLY 29 -5.565 7.870 19.031 198 H THR 30 H THR 30 -2.723 7.472 18.103 199 HA THR 30 HA THR 30 -3.288 6.716 15.269 200 HB THR 30 HB THR 30 -0.555 7.086 16.569 201 HG1 THR 30 HG1 THR 30 -2.279 8.934 15.282 202 HG21 THR 30 HG21 THR 30 -0.525 5.772 14.495 203 HG22 THR 30 HG22 THR 30 0.165 7.383 14.206 204 HG23 THR 30 HG23 THR 30 -1.490 7.023 13.665 205 H LEU 31 H LEU 31 -3.151 4.586 14.726 206 HA LEU 31 HA LEU 31 -2.762 2.646 16.882 207 HB2 LEU 31 HB2 LEU 31 -3.364 2.419 13.918 208 HB3 LEU 31 HB3 LEU 31 -2.987 1.017 14.899 209 HG LEU 31 HG LEU 31 -5.342 1.122 14.558 210 HD11 LEU 31 HD11 LEU 31 -6.152 0.983 16.829 211 HD12 LEU 31 HD12 LEU 31 -4.801 1.972 17.430 212 HD13 LEU 31 HD13 LEU 31 -4.498 0.342 16.777 213 HD21 LEU 31 HD21 LEU 31 -5.422 3.840 15.922 214 HD22 LEU 31 HD22 LEU 31 -6.794 2.913 15.275 215 HD23 LEU 31 HD23 LEU 31 -5.576 3.571 14.169 216 HA PRO 32 HA PRO 32 1.528 2.651 15.741 217 HB2 PRO 32 HB2 PRO 32 2.578 0.982 17.598 218 HB3 PRO 32 HB3 PRO 32 1.936 2.597 18.048 219 HG2 PRO 32 HG2 PRO 32 0.581 -0.091 18.203 220 HG3 PRO 32 HG3 PRO 32 0.743 1.163 19.475 221 HD2 PRO 32 HD2 PRO 32 -1.488 0.926 17.924 222 HD3 PRO 32 HD3 PRO 32 -0.894 2.519 18.508 223 H TYR 33 H TYR 33 3.099 1.306 14.778 224 HA TYR 33 HA TYR 33 2.156 -1.399 13.901 225 HB2 TYR 33 HB2 TYR 33 4.267 0.481 12.744 226 HB3 TYR 33 HB3 TYR 33 3.912 -1.140 12.135 227 HD1 TYR 33 HD2 TYR 33 2.472 2.301 12.560 228 HD2 TYR 33 HD1 TYR 33 2.091 -1.510 10.582 229 HE1 TYR 33 HE2 TYR 33 0.712 3.240 11.068 230 HE2 TYR 33 HE1 TYR 33 0.330 -0.553 9.115 231 HH TYR 33 HH TYR 33 -0.856 1.290 8.523 232 H THR 34 H THR 34 3.734 -3.135 14.291 233 HA THR 34 HA THR 34 5.380 -2.592 16.627 234 HB THR 34 HB THR 34 6.113 -4.976 16.366 235 HG1 THR 34 HG1 THR 34 5.323 -6.181 14.722 236 HG21 THR 34 HG21 THR 34 3.096 -4.662 16.139 237 HG22 THR 34 HG22 THR 34 4.023 -4.324 17.622 238 HG23 THR 34 HG23 THR 34 3.992 -5.966 16.947 239 H LYS 35 H LYS 35 7.610 -2.657 16.772 240 HA LYS 35 HA LYS 35 9.179 -2.561 14.247 241 HB2 LYS 35 HB2 LYS 35 8.450 -0.208 14.927 242 HB3 LYS 35 HB3 LYS 35 9.294 -0.466 16.456 243 HG2 LYS 35 HG2 LYS 35 11.315 -1.028 14.768 244 HG3 LYS 35 HG3 LYS 35 10.395 0.071 13.732 245 HD2 LYS 35 HD2 LYS 35 10.493 1.815 15.431 246 HD3 LYS 35 HD3 LYS 35 11.199 0.680 16.601 247 HE2 LYS 35 HE2 LYS 35 12.944 0.482 14.463 248 HE3 LYS 35 HE3 LYS 35 12.512 2.211 14.455 249 HZ1 LYS 35 HZ1 LYS 35 13.522 0.659 16.780 250 HZ2 LYS 35 HZ2 LYS 35 13.107 2.258 16.827 251 HZ3 LYS 35 HZ3 LYS 35 14.392 1.762 15.914 252 H ASP 36 H ASP 36 11.257 -3.308 14.625 253 HA ASP 36 HA ASP 36 12.952 -4.438 15.575 254 HB2 ASP 36 HB2 ASP 36 12.167 -3.049 18.141 255 HB3 ASP 36 HB3 ASP 36 13.726 -3.800 17.779 256 H ARG 37 H ARG 37 9.837 -5.091 16.814 257 HA ARG 37 HA ARG 37 10.385 -7.168 18.663 258 HB2 ARG 37 HB2 ARG 37 8.146 -6.076 18.114 259 HB3 ARG 37 HB3 ARG 37 8.102 -7.060 16.649 260 HG2 ARG 37 HG2 ARG 37 6.756 -8.201 18.223 261 HG3 ARG 37 HG3 ARG 37 8.275 -9.110 18.180 262 HD2 ARG 37 HD2 ARG 37 9.033 -7.861 20.205 263 HD3 ARG 37 HD3 ARG 37 7.462 -7.035 20.243 264 HE ARG 37 HE ARG 37 7.143 -9.907 20.210 265 HH11 ARG 37 HH11 ARG 37 7.920 -7.236 22.394 266 HH12 ARG 37 HH12 ARG 37 7.394 -8.117 23.802 267 HH21 ARG 37 HH21 ARG 37 6.512 -10.961 22.027 268 HH22 ARG 37 HH22 ARG 37 6.582 -10.184 23.596 269 H PHE 38 H PHE 38 10.496 -7.057 15.190 270 HA PHE 38 HA PHE 38 10.425 -9.829 14.619 271 HB2 PHE 38 HB2 PHE 38 12.005 -7.846 12.997 272 HB3 PHE 38 HB3 PHE 38 11.007 -9.196 12.443 273 HD1 PHE 38 HD2 PHE 38 8.391 -8.919 13.289 274 HD2 PHE 38 HD1 PHE 38 11.184 -5.712 12.618 275 HE1 PHE 38 HE2 PHE 38 6.500 -7.342 12.981 276 HE2 PHE 38 HE1 PHE 38 9.283 -4.126 12.300 277 HZ PHE 38 HZ PHE 38 6.937 -4.943 12.493 278 H TYR 39 H TYR 39 12.908 -8.061 16.202 279 HA TYR 39 HA TYR 39 15.011 -9.968 15.303 280 HB2 TYR 39 HB2 TYR 39 15.217 -7.658 17.260 281 HB3 TYR 39 HB3 TYR 39 16.549 -8.548 16.517 282 HD1 TYR 39 HD2 TYR 39 15.939 -8.617 13.661 283 HD2 TYR 39 HD1 TYR 39 15.226 -5.457 16.500 284 HE1 TYR 39 HE2 TYR 39 15.983 -6.934 11.816 285 HE2 TYR 39 HE1 TYR 39 15.290 -3.787 14.652 286 HH TYR 39 HH TYR 39 15.560 -3.438 12.431 287 H LEU 40 H LEU 40 12.811 -9.281 17.910 288 HA LEU 40 HA LEU 40 14.309 -10.894 19.873 289 HB2 LEU 40 HB2 LEU 40 11.628 -9.456 19.903 290 HB3 LEU 40 HB3 LEU 40 12.130 -10.525 21.196 291 HG LEU 40 HG LEU 40 12.395 -8.249 21.870 292 HD11 LEU 40 HD11 LEU 40 14.691 -8.297 22.647 293 HD12 LEU 40 HD12 LEU 40 15.142 -9.454 21.375 294 HD13 LEU 40 HD13 LEU 40 14.027 -9.943 22.673 295 HD21 LEU 40 HD21 LEU 40 12.745 -7.178 19.656 296 HD22 LEU 40 HD22 LEU 40 14.395 -7.836 19.618 297 HD23 LEU 40 HD23 LEU 40 13.932 -6.665 20.869 298 H GLN 41 H GLN 41 11.309 -11.018 17.956 299 HA GLN 41 HA GLN 41 11.263 -13.982 18.363 300 HB2 GLN 41 HB2 GLN 41 8.911 -12.051 18.179 301 HB3 GLN 41 HB3 GLN 41 8.775 -13.814 18.119 302 HG2 GLN 41 HG2 GLN 41 9.811 -13.927 20.386 303 HG3 GLN 41 HG3 GLN 41 9.771 -12.157 20.457 304 HE21 GLN 41 HE21 GLN 41 8.050 -15.051 20.954 305 HE22 GLN 41 HE22 GLN 41 6.496 -14.338 21.314 306 HA PRO 42 HA PRO 42 11.184 -13.747 13.912 307 HB2 PRO 42 HB2 PRO 42 9.705 -15.945 13.186 308 HB3 PRO 42 HB3 PRO 42 11.402 -16.080 13.750 309 HG2 PRO 42 HG2 PRO 42 8.852 -16.444 15.319 310 HG3 PRO 42 HG3 PRO 42 10.285 -17.519 15.234 311 HD2 PRO 42 HD2 PRO 42 9.941 -15.781 17.273 312 HD3 PRO 42 HD3 PRO 42 11.572 -16.093 16.584 313 H LEU 43 H LEU 43 9.688 -12.819 12.418 314 HA LEU 43 HA LEU 43 7.549 -11.492 13.684 315 HB2 LEU 43 HB2 LEU 43 7.116 -10.397 11.693 316 HB3 LEU 43 HB3 LEU 43 8.846 -10.640 11.760 317 HG LEU 43 HG LEU 43 6.934 -12.154 9.954 318 HD11 LEU 43 HD11 LEU 43 8.880 -9.892 9.376 319 HD12 LEU 43 HD12 LEU 43 7.103 -9.757 9.435 320 HD13 LEU 43 HD13 LEU 43 7.875 -10.746 8.182 321 HD21 LEU 43 HD21 LEU 43 9.985 -12.128 10.055 322 HD22 LEU 43 HD22 LEU 43 9.009 -12.834 8.744 323 HD23 LEU 43 HD23 LEU 43 8.914 -13.518 10.374 324 HA PRO 44 HA PRO 44 4.511 -14.688 13.054 325 HB2 PRO 44 HB2 PRO 44 2.432 -13.639 14.459 326 HB3 PRO 44 HB3 PRO 44 3.883 -14.290 15.290 327 HG2 PRO 44 HG2 PRO 44 3.216 -11.455 14.582 328 HG3 PRO 44 HG3 PRO 44 3.742 -12.128 16.155 329 HD2 PRO 44 HD2 PRO 44 5.463 -10.932 14.414 330 HD3 PRO 44 HD3 PRO 44 5.959 -12.301 15.468 331 HA PRO 45 HA PRO 45 2.357 -12.970 9.632 332 HB2 PRO 45 HB2 PRO 45 -0.057 -14.259 9.526 333 HB3 PRO 45 HB3 PRO 45 1.499 -15.068 9.154 334 HG2 PRO 45 HG2 PRO 45 -0.025 -15.046 11.746 335 HG3 PRO 45 HG3 PRO 45 0.602 -16.448 10.817 336 HD2 PRO 45 HD2 PRO 45 1.989 -15.443 12.884 337 HD3 PRO 45 HD3 PRO 45 2.839 -15.962 11.385 338 H THR 46 H THR 46 0.851 -12.729 12.780 339 HA THR 46 HA THR 46 -1.286 -10.932 12.060 340 HB THR 46 HB THR 46 -0.987 -10.315 14.577 341 HG1 THR 46 HG1 THR 46 0.340 -11.728 15.702 342 HG21 THR 46 HG21 THR 46 -2.687 -11.930 13.734 343 HG22 THR 46 HG22 THR 46 -2.012 -12.432 15.298 344 HG23 THR 46 HG23 THR 46 -1.468 -13.227 13.804 345 H GLU 47 H GLU 47 2.095 -10.455 13.198 346 HA GLU 47 HA GLU 47 1.835 -7.550 13.129 347 HB2 GLU 47 HB2 GLU 47 4.230 -9.401 13.289 348 HB3 GLU 47 HB3 GLU 47 4.345 -7.636 13.288 349 HG2 GLU 47 HG2 GLU 47 2.942 -7.536 15.310 350 HG3 GLU 47 HG3 GLU 47 2.848 -9.303 15.335 351 H ALA 48 H ALA 48 2.750 -10.112 10.886 352 HA ALA 48 HA ALA 48 3.936 -8.425 8.899 353 HB1 ALA 48 HB1 ALA 48 2.348 -10.988 8.465 354 HB2 ALA 48 HB2 ALA 48 3.536 -10.266 7.360 355 HB3 ALA 48 HB3 ALA 48 4.068 -10.936 8.922 356 H ALA 49 H ALA 49 0.566 -9.088 9.822 357 HA ALA 49 HA ALA 49 -0.638 -8.014 7.460 358 HB1 ALA 49 HB1 ALA 49 -1.829 -9.367 9.230 359 HB2 ALA 49 HB2 ALA 49 -1.760 -7.944 10.295 360 HB3 ALA 49 HB3 ALA 49 -2.674 -7.869 8.776 361 H GLN 50 H GLN 50 0.504 -6.519 10.486 362 HA GLN 50 HA GLN 50 -0.529 -3.926 9.857 363 HB2 GLN 50 HB2 GLN 50 1.681 -4.813 11.699 364 HB3 GLN 50 HB3 GLN 50 1.149 -3.133 11.548 365 HG2 GLN 50 HG2 GLN 50 -0.669 -5.431 12.236 366 HG3 GLN 50 HG3 GLN 50 0.083 -4.369 13.439 367 HE21 GLN 50 HE21 GLN 50 -2.748 -4.859 12.909 368 HE22 GLN 50 HE22 GLN 50 -3.442 -3.316 12.485 369 H ARG 51 H ARG 51 2.591 -5.556 9.246 370 HA ARG 51 HA ARG 51 3.872 -3.268 8.041 371 HB2 ARG 51 HB2 ARG 51 4.299 -6.254 7.645 372 HB3 ARG 51 HB3 ARG 51 5.336 -4.998 6.959 373 HG2 ARG 51 HG2 ARG 51 5.887 -4.201 9.232 374 HG3 ARG 51 HG3 ARG 51 4.841 -5.450 9.929 375 HD2 ARG 51 HD2 ARG 51 7.171 -6.155 10.013 376 HD3 ARG 51 HD3 ARG 51 6.251 -7.204 8.914 377 HE ARG 51 HE ARG 51 7.239 -5.354 7.195 378 HH11 ARG 51 HH11 ARG 51 8.867 -7.261 9.679 379 HH12 ARG 51 HH12 ARG 51 10.371 -7.293 8.796 380 HH21 ARG 51 HH21 ARG 51 9.183 -5.420 6.139 381 HH22 ARG 51 HH22 ARG 51 10.550 -6.249 6.834 382 H ALA 52 H ALA 52 1.770 -5.820 6.767 383 HA ALA 52 HA ALA 52 2.149 -5.256 4.006 384 HB1 ALA 52 HB1 ALA 52 1.053 -7.300 4.928 385 HB2 ALA 52 HB2 ALA 52 -0.349 -6.320 5.389 386 HB3 ALA 52 HB3 ALA 52 0.077 -6.503 3.674 387 H LYS 53 H LYS 53 0.094 -3.710 6.457 388 HA LYS 53 HA LYS 53 -1.561 -2.223 4.631 389 HB2 LYS 53 HB2 LYS 53 -0.621 -1.556 7.439 390 HB3 LYS 53 HB3 LYS 53 -1.884 -0.676 6.577 391 HG2 LYS 53 HG2 LYS 53 -3.390 -2.507 6.682 392 HG3 LYS 53 HG3 LYS 53 -2.102 -3.648 7.057 393 HD2 LYS 53 HD2 LYS 53 -2.843 -3.440 9.178 394 HD3 LYS 53 HD3 LYS 53 -1.818 -1.999 9.173 395 HE2 LYS 53 HE2 LYS 53 -3.867 -1.278 10.071 396 HE3 LYS 53 HE3 LYS 53 -3.905 -0.712 8.387 397 HZ1 LYS 53 HZ1 LYS 53 -5.978 -1.824 9.155 398 HZ2 LYS 53 HZ2 LYS 53 -5.150 -3.244 9.314 399 HZ3 LYS 53 HZ3 LYS 53 -5.327 -2.550 7.829 400 H VAL 54 H VAL 54 1.693 -1.684 5.965 401 HA VAL 54 HA VAL 54 1.903 1.026 4.955 402 HB VAL 54 HB VAL 54 4.141 -0.923 5.705 403 HG11 VAL 54 HG11 VAL 54 4.962 0.981 4.385 404 HG12 VAL 54 HG12 VAL 54 4.113 2.120 5.459 405 HG13 VAL 54 HG13 VAL 54 5.471 1.149 6.076 406 HG21 VAL 54 HG21 VAL 54 4.131 0.280 7.906 407 HG22 VAL 54 HG22 VAL 54 2.646 1.121 7.406 408 HG23 VAL 54 HG23 VAL 54 2.649 -0.647 7.617 409 H SER 55 H SER 55 3.012 -2.210 3.824 410 HA SER 55 HA SER 55 4.341 -1.313 1.489 411 HB2 SER 55 HB2 SER 55 2.773 -3.900 1.825 412 HB3 SER 55 HB3 SER 55 4.147 -3.613 0.736 413 HG SER 55 HG SER 55 4.666 -4.703 2.769 414 H ALA 56 H ALA 56 0.901 -2.057 2.072 415 HA ALA 56 HA ALA 56 0.084 -1.747 -0.679 416 HB1 ALA 56 HB1 ALA 56 -1.172 -2.936 1.185 417 HB2 ALA 56 HB2 ALA 56 -1.611 -1.327 1.798 418 HB3 ALA 56 HB3 ALA 56 -2.134 -1.841 0.177 419 H SER 57 H SER 57 0.578 0.488 2.015 420 HA SER 57 HA SER 57 -0.880 2.684 0.881 421 HB2 SER 57 HB2 SER 57 -0.228 2.419 3.294 422 HB3 SER 57 HB3 SER 57 1.444 2.793 2.831 423 HG SER 57 HG SER 57 0.399 4.670 3.496 424 H GLU 58 H GLU 58 2.421 1.471 0.399 425 HA GLU 58 HA GLU 58 3.533 3.846 -0.748 426 HB2 GLU 58 HB2 GLU 58 4.069 0.926 -1.407 427 HB3 GLU 58 HB3 GLU 58 5.043 2.285 -1.967 428 HG2 GLU 58 HG2 GLU 58 5.480 2.847 0.454 429 HG3 GLU 58 HG3 GLU 58 4.715 1.298 0.868 430 H ILE 59 H ILE 59 1.369 1.389 -2.033 431 HA ILE 59 HA ILE 59 1.770 2.007 -4.810 432 HB ILE 59 HB ILE 59 -0.634 0.711 -3.447 433 HG12 ILE 59 HG12 ILE 59 1.741 -0.644 -4.766 434 HG13 ILE 59 HG13 ILE 59 1.644 -0.366 -3.028 435 HG21 ILE 59 HG21 ILE 59 0.312 0.550 -6.364 436 HG22 ILE 59 HG22 ILE 59 -1.081 -0.315 -5.676 437 HG23 ILE 59 HG23 ILE 59 -1.113 1.446 -5.799 438 HD11 ILE 59 HD11 ILE 59 0.994 -2.623 -3.419 439 HD12 ILE 59 HD12 ILE 59 -0.474 -1.720 -2.977 440 HD13 ILE 59 HD13 ILE 59 -0.166 -2.147 -4.675 441 H LEU 60 H LEU 60 -0.101 3.531 -2.245 442 HA LEU 60 HA LEU 60 -1.949 4.933 -3.977 443 HB2 LEU 60 HB2 LEU 60 -0.877 5.692 -1.243 444 HB3 LEU 60 HB3 LEU 60 -2.270 6.417 -2.027 445 HG LEU 60 HG LEU 60 -2.153 3.480 -1.263 446 HD11 LEU 60 HD11 LEU 60 -3.339 5.814 0.287 447 HD12 LEU 60 HD12 LEU 60 -1.879 4.899 0.738 448 HD13 LEU 60 HD13 LEU 60 -3.461 4.091 0.719 449 HD21 LEU 60 HD21 LEU 60 -4.470 5.334 -1.914 450 HD22 LEU 60 HD22 LEU 60 -4.597 3.626 -1.430 451 HD23 LEU 60 HD23 LEU 60 -3.825 4.055 -2.968 452 H ASN 61 H ASN 61 1.439 5.367 -3.236 453 HA ASN 61 HA ASN 61 1.417 8.229 -3.870 454 HB2 ASN 61 HB2 ASN 61 2.963 7.104 -2.220 455 HB3 ASN 61 HB3 ASN 61 3.786 6.353 -3.595 456 HD21 ASN 61 HD21 ASN 61 5.716 7.343 -3.579 457 HD22 ASN 61 HD22 ASN 61 5.940 9.071 -3.690 458 H VAL 62 H VAL 62 1.326 5.452 -5.857 459 HA VAL 62 HA VAL 62 3.379 6.183 -7.698 460 HB VAL 62 HB VAL 62 2.491 4.537 -9.204 461 HG11 VAL 62 HG11 VAL 62 2.210 3.598 -6.323 462 HG12 VAL 62 HG12 VAL 62 2.567 2.589 -7.731 463 HG13 VAL 62 HG13 VAL 62 3.742 3.799 -7.197 464 HG21 VAL 62 HG21 VAL 62 0.160 4.885 -9.305 465 HG22 VAL 62 HG22 VAL 62 0.310 3.316 -8.497 466 HG23 VAL 62 HG23 VAL 62 -0.040 4.766 -7.545 467 H LYS 63 H LYS 63 0.357 7.738 -7.310 468 HA LYS 63 HA LYS 63 -0.169 8.402 -10.046 469 HB2 LYS 63 HB2 LYS 63 -1.633 8.866 -7.977 470 HB3 LYS 63 HB3 LYS 63 -0.627 10.310 -7.747 471 HG2 LYS 63 HG2 LYS 63 -1.166 10.856 -10.194 472 HG3 LYS 63 HG3 LYS 63 -2.402 9.600 -10.094 473 HD2 LYS 63 HD2 LYS 63 -3.466 10.816 -8.256 474 HD3 LYS 63 HD3 LYS 63 -2.191 12.067 -8.371 475 HE2 LYS 63 HE2 LYS 63 -2.790 12.478 -10.728 476 HE3 LYS 63 HE3 LYS 63 -3.985 11.186 -10.675 477 HZ1 LYS 63 HZ1 LYS 63 -5.076 13.239 -10.586 478 HZ2 LYS 63 HZ2 LYS 63 -4.175 13.788 -9.311 479 HZ3 LYS 63 HZ3 LYS 63 -5.249 12.551 -9.097 480 H GLN 64 H GLN 64 2.188 9.540 -7.747 481 HA GLN 64 HA GLN 64 3.062 11.946 -8.935 482 HB2 GLN 64 HB2 GLN 64 4.657 9.716 -7.618 483 HB3 GLN 64 HB3 GLN 64 5.315 11.304 -7.993 484 HG2 GLN 64 HG2 GLN 64 2.997 10.789 -6.087 485 HG3 GLN 64 HG3 GLN 64 4.677 11.050 -5.608 486 HE21 GLN 64 HE21 GLN 64 2.016 12.544 -5.253 487 HE22 GLN 64 HE22 GLN 64 2.437 14.193 -5.655 488 H PHE 65 H PHE 65 3.641 8.580 -10.033 489 HA PHE 65 HA PHE 65 5.683 9.418 -11.958 490 HB2 PHE 65 HB2 PHE 65 4.074 6.861 -11.684 491 HB3 PHE 65 HB3 PHE 65 5.371 7.108 -12.855 492 HD1 PHE 65 HD2 PHE 65 4.579 6.580 -9.297 493 HD2 PHE 65 HD1 PHE 65 7.705 7.157 -12.177 494 HE1 PHE 65 HE2 PHE 65 6.245 5.806 -7.618 495 HE2 PHE 65 HE1 PHE 65 9.390 6.370 -10.513 496 HZ PHE 65 HZ PHE 65 8.662 5.699 -8.228 497 H ILE 66 H ILE 66 2.173 8.969 -11.962 498 HA ILE 66 HA ILE 66 1.868 8.831 -14.827 499 HB ILE 66 HB ILE 66 -0.152 9.838 -12.741 500 HG12 ILE 66 HG12 ILE 66 0.104 7.053 -13.939 501 HG13 ILE 66 HG13 ILE 66 0.702 7.496 -12.338 502 HG21 ILE 66 HG21 ILE 66 -0.603 8.797 -15.596 503 HG22 ILE 66 HG22 ILE 66 -1.875 9.311 -14.465 504 HG23 ILE 66 HG23 ILE 66 -0.723 10.498 -15.088 505 HD11 ILE 66 HD11 ILE 66 -1.674 8.119 -11.697 506 HD12 ILE 66 HD12 ILE 66 -2.206 7.434 -13.246 507 HD13 ILE 66 HD13 ILE 66 -1.419 6.396 -12.042 508 H ASP 67 H ASP 67 1.748 11.414 -12.390 509 HA ASP 67 HA ASP 67 1.200 13.613 -14.111 510 HB2 ASP 67 HB2 ASP 67 1.084 13.708 -11.654 511 HB3 ASP 67 HB3 ASP 67 2.829 13.423 -11.549 512 H ARG 68 H ARG 68 4.264 12.095 -13.124 513 HA ARG 68 HA ARG 68 5.871 13.997 -14.644 514 HB2 ARG 68 HB2 ARG 68 6.451 11.460 -13.113 515 HB3 ARG 68 HB3 ARG 68 7.700 12.267 -14.072 516 HG2 ARG 68 HG2 ARG 68 7.588 14.241 -12.772 517 HG3 ARG 68 HG3 ARG 68 6.087 13.724 -11.982 518 HD2 ARG 68 HD2 ARG 68 7.293 11.857 -10.914 519 HD3 ARG 68 HD3 ARG 68 8.797 12.382 -11.693 520 HE ARG 68 HE ARG 68 9.025 14.037 -10.104 521 HH11 ARG 68 HH11 ARG 68 5.660 12.964 -10.006 522 HH12 ARG 68 HH12 ARG 68 5.331 13.856 -8.532 523 HH21 ARG 68 HH21 ARG 68 8.500 15.165 -8.248 524 HH22 ARG 68 HH22 ARG 68 6.887 15.073 -7.589 525 H LYS 69 H LYS 69 3.888 11.641 -15.765 526 HA LYS 69 HA LYS 69 3.707 10.585 -17.804 527 HB2 LYS 69 HB2 LYS 69 4.682 13.020 -18.273 528 HB3 LYS 69 HB3 LYS 69 6.076 12.114 -18.849 529 HG2 LYS 69 HG2 LYS 69 4.677 11.009 -20.528 530 HG3 LYS 69 HG3 LYS 69 3.246 11.874 -19.898 531 HD2 LYS 69 HD2 LYS 69 4.425 14.032 -20.289 532 HD3 LYS 69 HD3 LYS 69 5.776 13.145 -21.014 533 HE2 LYS 69 HE2 LYS 69 4.305 12.323 -22.790 534 HE3 LYS 69 HE3 LYS 69 2.917 13.152 -22.036 535 HZ1 LYS 69 HZ1 LYS 69 5.376 14.490 -23.031 536 HZ2 LYS 69 HZ2 LYS 69 4.096 15.252 -22.326 537 HZ3 LYS 69 HZ3 LYS 69 3.909 14.514 -23.788 538 H ALA 70 H ALA 70 5.741 9.717 -15.710 539 HA ALA 70 HA ALA 70 7.960 8.607 -17.247 540 HB1 ALA 70 HB1 ALA 70 8.268 9.634 -15.007 541 HB2 ALA 70 HB2 ALA 70 7.256 8.354 -14.290 542 HB3 ALA 70 HB3 ALA 70 8.815 7.945 -15.050 543 H TRP 71 H TRP 71 6.225 7.305 -18.531 544 HA TRP 71 HA TRP 71 4.845 5.147 -17.438 545 HB2 TRP 71 HB2 TRP 71 6.168 4.993 -20.129 546 HB3 TRP 71 HB3 TRP 71 4.653 4.271 -19.595 547 HD1 TRP 71 HD1 TRP 71 5.307 6.493 -22.053 548 HE1 TRP 71 HE1 TRP 71 3.741 8.465 -22.321 549 HE3 TRP 71 HE3 TRP 71 3.272 6.456 -17.345 550 HZ2 TRP 71 HZ2 TRP 71 1.811 9.845 -20.736 551 HZ3 TRP 71 HZ3 TRP 71 1.531 8.149 -16.792 552 HH2 TRP 71 HH2 TRP 71 0.831 9.838 -18.470 553 HA PRO 72 HA PRO 72 8.216 2.053 -17.970 554 HB2 PRO 72 HB2 PRO 72 10.874 2.642 -18.007 555 HB3 PRO 72 HB3 PRO 72 9.874 2.618 -19.498 556 HG2 PRO 72 HG2 PRO 72 10.655 4.971 -17.789 557 HG3 PRO 72 HG3 PRO 72 10.819 4.761 -19.562 558 HD2 PRO 72 HD2 PRO 72 8.734 6.096 -18.478 559 HD3 PRO 72 HD3 PRO 72 8.523 5.052 -19.925 560 H SER 73 H SER 73 9.004 4.923 -16.005 561 HA SER 73 HA SER 73 10.262 3.411 -13.880 562 HB2 SER 73 HB2 SER 73 8.873 6.105 -13.721 563 HB3 SER 73 HB3 SER 73 10.115 5.470 -12.619 564 HG SER 73 HG SER 73 11.615 5.636 -14.252 565 H LEU 74 H LEU 74 6.982 4.474 -14.711 566 HA LEU 74 HA LEU 74 5.797 3.682 -12.220 567 HB2 LEU 74 HB2 LEU 74 4.788 5.236 -13.866 568 HB3 LEU 74 HB3 LEU 74 4.611 3.922 -15.006 569 HG LEU 74 HG LEU 74 2.836 2.945 -13.810 570 HD11 LEU 74 HD11 LEU 74 3.397 4.845 -11.497 571 HD12 LEU 74 HD12 LEU 74 3.665 3.094 -11.496 572 HD13 LEU 74 HD13 LEU 74 2.020 3.732 -11.623 573 HD21 LEU 74 HD21 LEU 74 1.239 4.772 -13.767 574 HD22 LEU 74 HD22 LEU 74 2.405 5.071 -15.065 575 HD23 LEU 74 HD23 LEU 74 2.537 5.962 -13.537 576 H GLN 75 H GLN 75 6.189 2.043 -15.387 577 HA GLN 75 HA GLN 75 4.982 -0.423 -14.772 578 HB2 GLN 75 HB2 GLN 75 5.952 0.269 -16.982 579 HB3 GLN 75 HB3 GLN 75 7.569 0.069 -16.316 580 HG2 GLN 75 HG2 GLN 75 6.033 -2.344 -15.890 581 HG3 GLN 75 HG3 GLN 75 5.981 -1.875 -17.590 582 HE21 GLN 75 HE21 GLN 75 8.098 -2.717 -14.902 583 HE22 GLN 75 HE22 GLN 75 9.475 -3.132 -15.901 584 H ASN 76 H ASN 76 8.196 0.833 -13.879 585 HA ASN 76 HA ASN 76 9.138 -1.700 -12.819 586 HB2 ASN 76 HB2 ASN 76 10.678 0.052 -13.621 587 HB3 ASN 76 HB3 ASN 76 10.104 1.150 -12.366 588 HD21 ASN 76 HD21 ASN 76 11.348 1.310 -10.644 589 HD22 ASN 76 HD22 ASN 76 12.411 0.044 -10.063 590 H ASP 77 H ASP 77 8.470 1.412 -11.136 591 HA ASP 77 HA ASP 77 8.737 0.262 -8.577 592 HB2 ASP 77 HB2 ASP 77 7.418 2.803 -9.563 593 HB3 ASP 77 HB3 ASP 77 7.513 2.387 -7.846 594 H LEU 78 H LEU 78 5.798 0.708 -10.552 595 HA LEU 78 HA LEU 78 3.950 0.164 -8.436 596 HB2 LEU 78 HB2 LEU 78 3.464 1.129 -10.704 597 HB3 LEU 78 HB3 LEU 78 3.699 -0.468 -11.391 598 HG LEU 78 HG LEU 78 1.750 -1.260 -10.024 599 HD11 LEU 78 HD11 LEU 78 0.182 0.507 -9.232 600 HD12 LEU 78 HD12 LEU 78 1.452 1.710 -9.523 601 HD13 LEU 78 HD13 LEU 78 1.689 0.440 -8.300 602 HD21 LEU 78 HD21 LEU 78 1.302 1.024 -11.986 603 HD22 LEU 78 HD22 LEU 78 0.108 -0.221 -11.551 604 HD23 LEU 78 HD23 LEU 78 1.588 -0.678 -12.411 605 H ARG 79 H ARG 79 5.598 -1.969 -10.798 606 HA ARG 79 HA ARG 79 4.205 -4.320 -9.780 607 HB2 ARG 79 HB2 ARG 79 6.544 -4.001 -11.683 608 HB3 ARG 79 HB3 ARG 79 5.812 -5.558 -11.257 609 HG2 ARG 79 HG2 ARG 79 3.618 -4.757 -12.112 610 HG3 ARG 79 HG3 ARG 79 4.371 -3.228 -12.597 611 HD2 ARG 79 HD2 ARG 79 5.894 -4.468 -14.103 612 HD3 ARG 79 HD3 ARG 79 5.114 -5.990 -13.640 613 HE ARG 79 HE ARG 79 4.043 -3.886 -15.417 614 HH11 ARG 79 HH21 ARG 79 3.246 -6.867 -13.647 615 HH12 ARG 79 HH22 ARG 79 1.821 -7.136 -14.639 616 HH21 ARG 79 HH11 ARG 79 2.252 -4.345 -16.576 617 HH22 ARG 79 HH12 ARG 79 1.292 -5.791 -16.240 618 H LEU 80 H LEU 80 7.239 -2.672 -9.036 619 HA LEU 80 HA LEU 80 8.371 -4.844 -7.505 620 HB2 LEU 80 HB2 LEU 80 8.683 -1.833 -7.386 621 HB3 LEU 80 HB3 LEU 80 9.477 -2.890 -6.230 622 HG LEU 80 HG LEU 80 9.929 -2.999 -9.227 623 HD11 LEU 80 HD11 LEU 80 10.710 -0.885 -8.237 624 HD12 LEU 80 HD12 LEU 80 12.077 -1.913 -8.709 625 HD13 LEU 80 HD13 LEU 80 11.611 -1.788 -6.995 626 HD21 LEU 80 HD21 LEU 80 10.406 -5.152 -8.171 627 HD22 LEU 80 HD22 LEU 80 11.363 -4.350 -6.902 628 HD23 LEU 80 HD23 LEU 80 11.926 -4.344 -8.589 629 H ARG 81 H ARG 81 6.289 -2.027 -6.606 630 HA ARG 81 HA ARG 81 6.071 -2.813 -3.850 631 HB2 ARG 81 HB2 ARG 81 4.611 -0.956 -5.678 632 HB3 ARG 81 HB3 ARG 81 3.764 -1.502 -4.227 633 HG2 ARG 81 HG2 ARG 81 4.804 0.512 -3.613 634 HG3 ARG 81 HG3 ARG 81 5.776 -0.776 -2.880 635 HD2 ARG 81 HD2 ARG 81 7.349 -0.596 -4.829 636 HD3 ARG 81 HD3 ARG 81 6.403 0.795 -5.395 637 HE ARG 81 HE ARG 81 7.256 1.092 -2.630 638 HH11 ARG 81 HH11 ARG 81 8.379 1.463 -5.958 639 HH12 ARG 81 HH12 ARG 81 9.583 2.643 -5.530 640 HH21 ARG 81 HH21 ARG 81 8.777 2.536 -2.129 641 HH22 ARG 81 HH22 ARG 81 9.823 3.238 -3.356 642 H ALA 82 H ALA 82 4.151 -3.636 -6.732 643 HA ALA 82 HA ALA 82 2.094 -5.054 -5.383 644 HB1 ALA 82 HB1 ALA 82 1.738 -6.197 -7.513 645 HB2 ALA 82 HB2 ALA 82 2.131 -4.496 -7.840 646 HB3 ALA 82 HB3 ALA 82 3.364 -5.753 -8.073 647 H SER 83 H SER 83 5.385 -6.039 -6.386 648 HA SER 83 HA SER 83 5.016 -8.789 -5.618 649 HB2 SER 83 HB2 SER 83 7.571 -7.173 -5.929 650 HB3 SER 83 HB3 SER 83 7.462 -8.942 -5.820 651 HG SER 83 HG SER 83 6.507 -7.217 -7.866 652 H TYR 84 H TYR 84 6.351 -5.917 -3.888 653 HA TYR 84 HA TYR 84 7.235 -7.426 -1.615 654 HB2 TYR 84 HB2 TYR 84 6.227 -4.557 -1.651 655 HB3 TYR 84 HB3 TYR 84 7.241 -5.301 -0.413 656 HD1 TYR 84 HD1 TYR 84 9.216 -6.782 -2.267 657 HD2 TYR 84 HD2 TYR 84 7.637 -2.771 -2.358 658 HE1 TYR 84 HE1 TYR 84 11.231 -6.006 -3.512 659 HE2 TYR 84 HE2 TYR 84 9.662 -2.015 -3.606 660 HH TYR 84 HH TYR 84 12.324 -4.230 -4.447 661 H LEU 85 H LEU 85 4.162 -5.729 -2.336 662 HA LEU 85 HA LEU 85 2.906 -6.347 0.147 663 HB2 LEU 85 HB2 LEU 85 2.080 -4.657 -1.478 664 HB3 LEU 85 HB3 LEU 85 1.681 -5.951 -2.609 665 HG LEU 85 HG LEU 85 0.007 -6.838 -1.005 666 HD11 LEU 85 HD11 LEU 85 0.758 -4.386 0.630 667 HD12 LEU 85 HD12 LEU 85 0.933 -6.085 1.116 668 HD13 LEU 85 HD13 LEU 85 -0.682 -5.386 0.911 669 HD21 LEU 85 HD21 LEU 85 -0.644 -5.244 -2.767 670 HD22 LEU 85 HD22 LEU 85 -0.340 -3.892 -1.651 671 HD23 LEU 85 HD23 LEU 85 -1.640 -5.054 -1.309 672 H ARG 86 H ARG 86 3.189 -8.116 -2.907 673 HA ARG 86 HA ARG 86 1.347 -10.199 -2.259 674 HB2 ARG 86 HB2 ARG 86 2.331 -9.708 -4.507 675 HB3 ARG 86 HB3 ARG 86 3.856 -10.393 -3.959 676 HG2 ARG 86 HG2 ARG 86 2.987 -12.574 -3.894 677 HG3 ARG 86 HG3 ARG 86 1.303 -12.001 -3.883 678 HD2 ARG 86 HD2 ARG 86 1.958 -12.892 -6.110 679 HD3 ARG 86 HD3 ARG 86 1.507 -11.176 -6.169 680 HE ARG 86 HE ARG 86 4.329 -11.405 -5.758 681 HH11 ARG 86 HH11 ARG 86 1.941 -11.809 -8.326 682 HH12 ARG 86 HH12 ARG 86 3.094 -11.445 -9.581 683 HH21 ARG 86 HH21 ARG 86 5.740 -10.941 -7.412 684 HH22 ARG 86 HH22 ARG 86 5.203 -10.962 -9.067 685 H TYR 87 H TYR 87 4.884 -9.881 -1.604 686 HA TYR 87 HA TYR 87 5.109 -12.511 -0.477 687 HB2 TYR 87 HB2 TYR 87 6.711 -9.989 0.089 688 HB3 TYR 87 HB3 TYR 87 7.139 -11.603 0.659 689 HD1 TYR 87 HD2 TYR 87 6.755 -13.376 -1.622 690 HD2 TYR 87 HD1 TYR 87 8.259 -9.342 -1.558 691 HE1 TYR 87 HE2 TYR 87 8.013 -13.802 -3.735 692 HE2 TYR 87 HE1 TYR 87 9.515 -9.784 -3.667 693 HH TYR 87 HH TYR 87 10.078 -11.331 -5.259 694 H ASP 88 H ASP 88 4.398 -9.309 0.996 695 HA ASP 88 HA ASP 88 4.286 -10.255 3.685 696 HB2 ASP 88 HB2 ASP 88 2.854 -7.968 2.276 697 HB3 ASP 88 HB3 ASP 88 2.665 -8.308 4.001 698 H LEU 89 H LEU 89 1.631 -9.816 1.272 699 HA LEU 89 HA LEU 89 -0.407 -10.767 3.014 700 HB2 LEU 89 HB2 LEU 89 -0.136 -10.100 0.185 701 HB3 LEU 89 HB3 LEU 89 -1.208 -11.467 0.424 702 HG LEU 89 HG LEU 89 -2.397 -9.314 0.299 703 HD11 LEU 89 HD11 LEU 89 -3.862 -9.651 2.217 704 HD12 LEU 89 HD12 LEU 89 -2.621 -10.619 3.044 705 HD13 LEU 89 HD13 LEU 89 -3.374 -11.218 1.545 706 HD21 LEU 89 HD21 LEU 89 -2.270 -7.654 2.015 707 HD22 LEU 89 HD22 LEU 89 -0.622 -7.950 1.426 708 HD23 LEU 89 HD23 LEU 89 -1.145 -8.636 2.980 709 H LYS 90 H LYS 90 1.751 -12.569 0.823 710 HA LYS 90 HA LYS 90 0.287 -15.044 1.038 711 HB2 LYS 90 HB2 LYS 90 3.178 -14.386 0.410 712 HB3 LYS 90 HB3 LYS 90 2.611 -16.050 0.499 713 HG2 LYS 90 HG2 LYS 90 1.472 -13.947 -1.389 714 HG3 LYS 90 HG3 LYS 90 2.706 -15.126 -1.836 715 HD2 LYS 90 HD2 LYS 90 -0.103 -15.823 -0.883 716 HD3 LYS 90 HD3 LYS 90 0.402 -15.728 -2.574 717 HE2 LYS 90 HE2 LYS 90 2.104 -17.506 -2.140 718 HE3 LYS 90 HE3 LYS 90 1.482 -17.650 -0.478 719 HZ1 LYS 90 HZ1 LYS 90 0.439 -19.269 -1.907 720 HZ2 LYS 90 HZ2 LYS 90 -0.074 -18.102 -2.958 721 HZ3 LYS 90 HZ3 LYS 90 -0.699 -18.165 -1.435 722 H THR 91 H THR 91 2.387 -13.349 3.242 723 HA THR 91 HA THR 91 2.777 -15.742 4.924 724 HB THR 91 HB THR 91 3.399 -12.812 5.550 725 HG1 THR 91 HG1 THR 91 4.622 -13.296 3.790 726 HG21 THR 91 HG21 THR 91 4.479 -15.426 6.679 727 HG22 THR 91 HG22 THR 91 3.411 -14.280 7.527 728 HG23 THR 91 HG23 THR 91 5.064 -13.800 7.090 729 H VAL 92 H VAL 92 0.937 -12.649 4.979 730 HA VAL 92 HA VAL 92 -0.192 -12.898 7.545 731 HB VAL 92 HB VAL 92 -1.410 -11.670 5.022 732 HG11 VAL 92 HG11 VAL 92 -2.734 -10.278 6.677 733 HG12 VAL 92 HG12 VAL 92 -3.213 -11.979 6.617 734 HG13 VAL 92 HG13 VAL 92 -2.201 -11.387 7.956 735 HG21 VAL 92 HG21 VAL 92 0.770 -10.709 5.720 736 HG22 VAL 92 HG22 VAL 92 -0.554 -9.561 5.917 737 HG23 VAL 92 HG23 VAL 92 0.112 -10.418 7.328 738 H ILE 93 H ILE 93 -1.394 -14.262 4.466 739 HA ILE 93 HA ILE 93 -3.924 -15.084 5.475 740 HB ILE 93 HB ILE 93 -3.898 -16.732 3.626 741 HG12 ILE 93 HG12 ILE 93 -1.146 -15.650 3.010 742 HG13 ILE 93 HG13 ILE 93 -1.460 -17.227 3.717 743 HG21 ILE 93 HG21 ILE 93 -4.684 -14.408 3.304 744 HG22 ILE 93 HG22 ILE 93 -3.044 -13.908 2.849 745 HG23 ILE 93 HG23 ILE 93 -3.950 -15.037 1.825 746 HD11 ILE 93 HD11 ILE 93 -2.235 -16.294 0.935 747 HD12 ILE 93 HD12 ILE 93 -1.022 -17.513 1.374 748 HD13 ILE 93 HD13 ILE 93 -2.746 -17.842 1.648 749 H SER 94 H SER 94 -0.841 -16.387 6.249 750 HA SER 94 HA SER 94 -1.758 -19.107 6.693 751 HB2 SER 94 HB2 SER 94 0.653 -17.641 7.781 752 HB3 SER 94 HB3 SER 94 0.419 -19.402 7.706 753 HG SER 94 HG SER 94 1.106 -17.591 5.723 754 H ALA 95 H ALA 95 -2.205 -16.150 8.397 755 HA ALA 95 HA ALA 95 -2.239 -17.177 11.091 756 HB1 ALA 95 HB1 ALA 95 -2.208 -14.742 10.554 757 HB2 ALA 95 HB2 ALA 95 -3.829 -14.879 9.836 758 HB3 ALA 95 HB3 ALA 95 -3.600 -15.161 11.578 759 H LYS 96 H LYS 96 -4.553 -17.159 8.419 760 HA LYS 96 HA LYS 96 -6.177 -19.119 9.873 761 HB2 LYS 96 HB2 LYS 96 -6.983 -16.623 10.063 762 HB3 LYS 96 HB3 LYS 96 -7.602 -16.897 8.439 763 HG2 LYS 96 HG2 LYS 96 -9.381 -17.817 9.426 764 HG3 LYS 96 HG3 LYS 96 -8.325 -19.180 9.837 765 HD2 LYS 96 HD2 LYS 96 -7.581 -17.756 11.854 766 HD3 LYS 96 HD3 LYS 96 -9.023 -16.767 11.511 767 HE2 LYS 96 HE2 LYS 96 -10.345 -18.874 11.530 768 HE3 LYS 96 HE3 LYS 96 -8.873 -19.716 12.073 769 HZ1 LYS 96 HZ1 LYS 96 -10.277 -19.056 13.946 770 HZ2 LYS 96 HZ2 LYS 96 -10.207 -17.474 13.487 771 HZ3 LYS 96 HZ3 LYS 96 -8.841 -18.243 14.003 772 HA PRO 97 HA PRO 97 -5.339 -20.091 5.456 773 HB2 PRO 97 HB2 PRO 97 -4.598 -22.689 5.712 774 HB3 PRO 97 HB3 PRO 97 -3.523 -21.341 6.179 775 HG2 PRO 97 HG2 PRO 97 -5.371 -22.948 7.920 776 HG3 PRO 97 HG3 PRO 97 -3.614 -22.648 8.119 777 HD2 PRO 97 HD2 PRO 97 -5.456 -21.150 9.407 778 HD3 PRO 97 HD3 PRO 97 -3.946 -20.422 8.759 779 H LYS 98 H LYS 98 -8.027 -19.867 6.275 780 HA LYS 98 HA LYS 98 -9.144 -22.162 4.773 781 HB2 LYS 98 HB2 LYS 98 -9.421 -22.388 7.317 782 HB3 LYS 98 HB3 LYS 98 -10.592 -21.085 7.202 783 HG2 LYS 98 HG2 LYS 98 -11.744 -23.254 7.227 784 HG3 LYS 98 HG3 LYS 98 -11.986 -22.478 5.662 785 HD2 LYS 98 HD2 LYS 98 -11.577 -24.838 5.286 786 HD3 LYS 98 HD3 LYS 98 -10.195 -23.932 4.673 787 HE2 LYS 98 HE2 LYS 98 -9.307 -25.838 5.798 788 HE3 LYS 98 HE3 LYS 98 -8.991 -24.457 6.857 789 HZ1 LYS 98 HZ1 LYS 98 -10.929 -25.117 8.173 790 HZ2 LYS 98 HZ2 LYS 98 -9.844 -26.357 8.088 791 HZ3 LYS 98 HZ3 LYS 98 -11.217 -26.399 7.176 792 H ASP 99 H ASP 99 -11.735 -20.297 5.890 793 HA ASP 99 HA ASP 99 -12.245 -19.411 3.223 794 HB2 ASP 99 HB2 ASP 99 -13.979 -19.871 4.972 795 HB3 ASP 99 HB3 ASP 99 -13.491 -18.373 5.784 796 H GLU 100 H GLU 100 -11.080 -17.695 6.129 797 HA GLU 100 HA GLU 100 -11.022 -15.090 5.035 798 HB2 GLU 100 HB2 GLU 100 -9.238 -16.451 7.072 799 HB3 GLU 100 HB3 GLU 100 -9.208 -14.711 6.749 800 HG2 GLU 100 HG2 GLU 100 -11.480 -14.459 7.538 801 HG3 GLU 100 HG3 GLU 100 -11.696 -16.214 7.638 802 H LYS 101 H LYS 101 -8.666 -17.770 4.827 803 HA LYS 101 HA LYS 101 -6.577 -16.327 3.517 804 HB2 LYS 101 HB2 LYS 101 -6.382 -18.603 4.485 805 HB3 LYS 101 HB3 LYS 101 -7.407 -19.230 3.216 806 HG2 LYS 101 HG2 LYS 101 -5.349 -17.949 1.830 807 HG3 LYS 101 HG3 LYS 101 -4.554 -18.692 3.227 808 HD2 LYS 101 HD2 LYS 101 -4.483 -20.328 1.537 809 HD3 LYS 101 HD3 LYS 101 -5.783 -20.842 2.632 810 HE2 LYS 101 HE2 LYS 101 -7.459 -19.842 1.099 811 HE3 LYS 101 HE3 LYS 101 -6.156 -19.326 0.012 812 HZ1 LYS 101 HZ1 LYS 101 -7.145 -21.412 -0.715 813 HZ2 LYS 101 HZ2 LYS 101 -6.790 -22.138 0.724 814 HZ3 LYS 101 HZ3 LYS 101 -5.573 -21.665 -0.284 815 H LYS 102 H LYS 102 -9.504 -17.976 2.272 816 HA LYS 102 HA LYS 102 -8.713 -17.600 -0.495 817 HB2 LYS 102 HB2 LYS 102 -10.397 -19.289 0.558 818 HB3 LYS 102 HB3 LYS 102 -11.567 -17.977 0.490 819 HG2 LYS 102 HG2 LYS 102 -10.048 -18.909 -1.982 820 HG3 LYS 102 HG3 LYS 102 -11.525 -19.715 -1.425 821 HD2 LYS 102 HD2 LYS 102 -12.683 -17.461 -1.512 822 HD3 LYS 102 HD3 LYS 102 -11.247 -16.841 -2.339 823 HE2 LYS 102 HE2 LYS 102 -12.968 -19.159 -3.313 824 HE3 LYS 102 HE3 LYS 102 -13.071 -17.493 -3.904 825 HZ1 LYS 102 HZ1 LYS 102 -10.717 -19.264 -4.184 826 HZ2 LYS 102 HZ2 LYS 102 -10.771 -17.686 -4.672 827 HZ3 LYS 102 HZ3 LYS 102 -11.747 -18.807 -5.389 828 H SER 103 H SER 103 -11.026 -15.917 1.692 829 HA SER 103 HA SER 103 -11.880 -13.958 -0.142 830 HB2 SER 103 HB2 SER 103 -12.865 -14.386 2.093 831 HB3 SER 103 HB3 SER 103 -11.437 -13.658 2.856 832 HG SER 103 HG SER 103 -13.438 -12.326 2.413 833 H LEU 104 H LEU 104 -9.068 -13.832 2.106 834 HA LEU 104 HA LEU 104 -8.253 -11.197 1.371 835 HB2 LEU 104 HB2 LEU 104 -6.886 -13.610 2.548 836 HB3 LEU 104 HB3 LEU 104 -5.914 -12.227 2.058 837 HG LEU 104 HG LEU 104 -8.238 -11.941 3.980 838 HD11 LEU 104 HD11 LEU 104 -6.597 -12.051 5.809 839 HD12 LEU 104 HD12 LEU 104 -5.307 -12.445 4.648 840 HD13 LEU 104 HD13 LEU 104 -6.654 -13.582 4.915 841 HD21 LEU 104 HD21 LEU 104 -6.951 -9.915 4.666 842 HD22 LEU 104 HD22 LEU 104 -7.437 -9.856 2.961 843 HD23 LEU 104 HD23 LEU 104 -5.761 -10.257 3.397 844 H GLN 105 H GLN 105 -7.397 -14.413 -0.029 845 HA GLN 105 HA GLN 105 -5.394 -13.249 -1.744 846 HB2 GLN 105 HB2 GLN 105 -6.824 -15.908 -1.832 847 HB3 GLN 105 HB3 GLN 105 -5.560 -15.446 -2.977 848 HG2 GLN 105 HG2 GLN 105 -5.074 -15.390 0.011 849 HG3 GLN 105 HG3 GLN 105 -4.882 -16.869 -0.929 850 HE21 GLN 105 HE21 GLN 105 -3.700 -13.548 -0.510 851 HE22 GLN 105 HE22 GLN 105 -2.129 -13.847 -1.207 852 H GLU 106 H GLU 106 -8.905 -13.649 -2.132 853 HA GLU 106 HA GLU 106 -8.883 -13.263 -4.985 854 HB2 GLU 106 HB2 GLU 106 -10.987 -12.425 -2.948 855 HB3 GLU 106 HB3 GLU 106 -11.194 -12.399 -4.701 856 HG2 GLU 106 HG2 GLU 106 -10.825 -14.799 -2.936 857 HG3 GLU 106 HG3 GLU 106 -12.261 -14.353 -3.846 858 H LEU 107 H LEU 107 -9.098 -10.946 -2.226 859 HA LEU 107 HA LEU 107 -9.150 -8.660 -4.001 860 HB2 LEU 107 HB2 LEU 107 -8.337 -8.878 -1.089 861 HB3 LEU 107 HB3 LEU 107 -8.465 -7.379 -1.995 862 HG LEU 107 HG LEU 107 -10.714 -9.178 -1.106 863 HD11 LEU 107 HD11 LEU 107 -9.955 -6.260 -0.681 864 HD12 LEU 107 HD12 LEU 107 -9.759 -7.574 0.495 865 HD13 LEU 107 HD13 LEU 107 -11.385 -7.062 -0.010 866 HD21 LEU 107 HD21 LEU 107 -10.808 -6.825 -3.039 867 HD22 LEU 107 HD22 LEU 107 -12.227 -7.492 -2.199 868 HD23 LEU 107 HD23 LEU 107 -11.332 -8.505 -3.350 869 H THR 108 H THR 108 -6.570 -10.446 -2.336 870 HA THR 108 HA THR 108 -4.441 -8.651 -2.881 871 HB THR 108 HB THR 108 -4.338 -11.721 -2.850 872 HG1 THR 108 HG1 THR 108 -5.244 -10.775 -0.937 873 HG21 THR 108 HG21 THR 108 -2.259 -10.853 -3.673 874 HG22 THR 108 HG22 THR 108 -2.023 -11.331 -1.981 875 HG23 THR 108 HG23 THR 108 -2.205 -9.611 -2.400 876 H SER 109 H SER 109 -5.810 -11.331 -4.852 877 HA SER 109 HA SER 109 -3.973 -10.884 -7.037 878 HB2 SER 109 HB2 SER 109 -6.714 -12.220 -7.071 879 HB3 SER 109 HB3 SER 109 -5.405 -12.433 -8.256 880 HG SER 109 HG SER 109 -5.597 -13.328 -5.584 881 H LYS 110 H LYS 110 -7.325 -9.797 -6.317 882 HA LYS 110 HA LYS 110 -7.893 -8.600 -8.836 883 HB2 LYS 110 HB2 LYS 110 -9.495 -9.005 -6.891 884 HB3 LYS 110 HB3 LYS 110 -8.783 -7.594 -6.101 885 HG2 LYS 110 HG2 LYS 110 -9.444 -6.340 -8.307 886 HG3 LYS 110 HG3 LYS 110 -10.522 -7.716 -8.575 887 HD2 LYS 110 HD2 LYS 110 -10.509 -5.967 -6.068 888 HD3 LYS 110 HD3 LYS 110 -11.594 -5.729 -7.440 889 HE2 LYS 110 HE2 LYS 110 -12.579 -7.965 -7.047 890 HE3 LYS 110 HE3 LYS 110 -11.491 -8.189 -5.655 891 HZ1 LYS 110 HZ1 LYS 110 -13.670 -7.332 -4.952 892 HZ2 LYS 110 HZ2 LYS 110 -13.505 -6.001 -5.910 893 HZ3 LYS 110 HZ3 LYS 110 -12.503 -6.215 -4.620 894 H LEU 111 H LEU 111 -6.203 -7.350 -5.960 895 HA LEU 111 HA LEU 111 -5.974 -4.651 -6.842 896 HB2 LEU 111 HB2 LEU 111 -5.575 -5.709 -4.556 897 HB3 LEU 111 HB3 LEU 111 -3.979 -6.161 -5.127 898 HG LEU 111 HG LEU 111 -4.918 -3.280 -5.118 899 HD11 LEU 111 HD11 LEU 111 -5.300 -4.116 -2.881 900 HD12 LEU 111 HD12 LEU 111 -3.835 -3.115 -2.870 901 HD13 LEU 111 HD13 LEU 111 -3.694 -4.885 -2.843 902 HD21 LEU 111 HD21 LEU 111 -2.847 -3.663 -6.329 903 HD22 LEU 111 HD22 LEU 111 -2.169 -4.574 -4.958 904 HD23 LEU 111 HD23 LEU 111 -2.493 -2.829 -4.812 905 H PHE 112 H PHE 112 -3.889 -7.516 -7.331 906 HA PHE 112 HA PHE 112 -1.910 -6.032 -8.800 907 HB2 PHE 112 HB2 PHE 112 -2.506 -8.998 -8.873 908 HB3 PHE 112 HB3 PHE 112 -1.032 -8.207 -9.448 909 HD1 PHE 112 HD2 PHE 112 -0.810 -6.175 -7.070 910 HD2 PHE 112 HD1 PHE 112 -1.485 -10.428 -7.243 911 HE1 PHE 112 HE2 PHE 112 0.123 -6.410 -4.790 912 HE2 PHE 112 HE1 PHE 112 -0.528 -10.658 -4.963 913 HZ PHE 112 HZ PHE 112 0.252 -8.641 -3.724 914 H SER 113 H SER 113 -4.970 -7.563 -9.735 915 HA SER 113 HA SER 113 -4.446 -7.517 -12.560 916 HB2 SER 113 HB2 SER 113 -7.119 -7.217 -11.137 917 HB3 SER 113 HB3 SER 113 -6.865 -7.709 -12.821 918 HG SER 113 HG SER 113 -5.683 -9.529 -11.959 919 H SER 114 H SER 114 -5.879 -5.094 -10.292 920 HA SER 114 HA SER 114 -6.402 -3.179 -12.394 921 HB2 SER 114 HB2 SER 114 -6.112 -1.597 -10.218 922 HB3 SER 114 HB3 SER 114 -7.582 -2.530 -10.560 923 HG SER 114 HG SER 114 -5.425 -3.356 -8.886 924 H ILE 115 H ILE 115 -3.593 -3.953 -10.384 925 HA ILE 115 HA ILE 115 -2.044 -1.640 -11.092 926 HB ILE 115 HB ILE 115 -1.568 -4.287 -9.801 927 HG12 ILE 115 HG12 ILE 115 -0.735 -1.441 -9.214 928 HG13 ILE 115 HG13 ILE 115 -2.159 -2.254 -8.578 929 HG21 ILE 115 HG21 ILE 115 0.257 -4.486 -11.362 930 HG22 ILE 115 HG22 ILE 115 0.715 -2.785 -11.153 931 HG23 ILE 115 HG23 ILE 115 0.965 -3.947 -9.835 932 HD11 ILE 115 HD11 ILE 115 -0.537 -3.927 -7.497 933 HD12 ILE 115 HD12 ILE 115 0.749 -2.761 -7.906 934 HD13 ILE 115 HD13 ILE 115 -0.575 -2.282 -6.833 935 H ASP 116 H ASP 116 -2.369 -4.900 -12.550 936 HA ASP 116 HA ASP 116 -0.303 -4.507 -14.485 937 HB2 ASP 116 HB2 ASP 116 -1.410 -6.683 -13.793 938 HB3 ASP 116 HB3 ASP 116 -2.791 -6.220 -14.800 939 H ASN 117 H ASN 117 -3.788 -3.833 -14.474 940 HA ASN 117 HA ASN 117 -3.946 -2.966 -17.205 941 HB2 ASN 117 HB2 ASN 117 -5.705 -3.343 -15.063 942 HB3 ASN 117 HB3 ASN 117 -5.771 -1.603 -15.364 943 HD21 ASN 117 HD21 ASN 117 -7.585 -4.021 -15.875 944 HD22 ASN 117 HD22 ASN 117 -8.071 -3.804 -17.539 945 H LEU 118 H LEU 118 -3.263 -1.267 -14.141 946 HA LEU 118 HA LEU 118 -3.300 1.383 -15.195 947 HB2 LEU 118 HB2 LEU 118 -3.243 0.477 -12.773 948 HB3 LEU 118 HB3 LEU 118 -1.508 0.409 -12.960 949 HG LEU 118 HG LEU 118 -3.192 2.927 -13.109 950 HD11 LEU 118 HD11 LEU 118 -3.249 1.849 -10.897 951 HD12 LEU 118 HD12 LEU 118 -2.312 3.356 -10.843 952 HD13 LEU 118 HD13 LEU 118 -1.469 1.789 -10.866 953 HD21 LEU 118 HD21 LEU 118 -1.132 3.327 -14.292 954 HD22 LEU 118 HD22 LEU 118 -0.180 2.546 -13.012 955 HD23 LEU 118 HD23 LEU 118 -1.006 4.090 -12.702 956 H ASP 119 H ASP 119 -0.659 -1.024 -14.850 957 HA ASP 119 HA ASP 119 1.430 0.687 -15.848 958 HB2 ASP 119 HB2 ASP 119 2.027 -1.333 -14.689 959 HB3 ASP 119 HB3 ASP 119 1.073 -2.330 -15.807 960 H HIS 120 H HIS 120 -0.765 -1.661 -17.547 961 HA HIS 120 HA HIS 120 0.453 -1.131 -20.094 962 HB2 HIS 120 HB2 HIS 120 -2.210 -2.288 -19.289 963 HB3 HIS 120 HB3 HIS 120 -1.777 -2.011 -20.981 964 HD1 HIS 120 HD1 HIS 120 -1.252 -4.454 -18.221 965 HD2 HIS 120 HD2 HIS 120 0.546 -3.446 -21.856 966 HE1 HIS 120 HE1 HIS 120 0.269 -6.366 -18.849 967 H ALA 121 H ALA 121 -2.277 0.438 -18.400 968 HA ALA 121 HA ALA 121 -3.019 2.146 -20.566 969 HB1 ALA 121 HB1 ALA 121 -3.181 2.509 -17.546 970 HB2 ALA 121 HB2 ALA 121 -3.951 3.583 -18.730 971 HB3 ALA 121 HB3 ALA 121 -4.448 1.878 -18.626 972 H ALA 122 H ALA 122 -0.531 2.427 -18.027 973 HA ALA 122 HA ALA 122 0.208 5.126 -18.653 974 HB1 ALA 122 HB1 ALA 122 1.813 2.857 -17.396 975 HB2 ALA 122 HB2 ALA 122 2.261 4.571 -17.378 976 HB3 ALA 122 HB3 ALA 122 0.795 4.031 -16.532 977 H LYS 123 H LYS 123 1.615 1.952 -19.630 978 HA LYS 123 HA LYS 123 3.712 3.104 -21.194 979 HB2 LYS 123 HB2 LYS 123 2.313 0.419 -21.381 980 HB3 LYS 123 HB3 LYS 123 3.764 0.832 -22.306 981 HG2 LYS 123 HG2 LYS 123 5.034 1.165 -20.236 982 HG3 LYS 123 HG3 LYS 123 3.598 0.802 -19.275 983 HD2 LYS 123 HD2 LYS 123 4.943 -1.141 -21.201 984 HD3 LYS 123 HD3 LYS 123 5.141 -1.124 -19.439 985 HE2 LYS 123 HE2 LYS 123 2.586 -1.358 -19.303 986 HE3 LYS 123 HE3 LYS 123 2.634 -1.760 -21.028 987 HZ1 LYS 123 HZ1 LYS 123 4.253 -3.549 -20.346 988 HZ2 LYS 123 HZ2 LYS 123 2.697 -3.774 -19.841 989 HZ3 LYS 123 HZ3 LYS 123 3.836 -3.234 -18.774 990 H ILE 124 H ILE 124 0.349 2.308 -22.014 991 HA ILE 124 HA ILE 124 0.856 2.753 -24.856 992 HB ILE 124 HB ILE 124 -0.877 1.127 -23.726 993 HG12 ILE 124 HG12 ILE 124 -2.416 1.418 -25.752 994 HG13 ILE 124 HG13 ILE 124 -1.370 2.758 -26.226 995 HG21 ILE 124 HG21 ILE 124 -2.652 3.585 -24.010 996 HG22 ILE 124 HG22 ILE 124 -3.133 1.955 -23.490 997 HG23 ILE 124 HG23 ILE 124 -2.073 2.931 -22.464 998 HD11 ILE 124 HD11 ILE 124 -0.441 -0.117 -25.783 999 HD12 ILE 124 HD12 ILE 124 -0.768 0.628 -27.364 1000 HD13 ILE 124 HD13 ILE 124 0.567 1.231 -26.360 1001 H LYS 125 H LYS 125 0.959 4.840 -22.458 1002 HA LYS 125 HA LYS 125 0.986 7.109 -22.374 1003 HB2 LYS 125 HB2 LYS 125 1.846 6.663 -24.775 1004 HB3 LYS 125 HB3 LYS 125 0.247 7.167 -25.308 1005 HG2 LYS 125 HG2 LYS 125 0.687 9.376 -24.085 1006 HG3 LYS 125 HG3 LYS 125 2.380 8.844 -23.972 1007 HD2 LYS 125 HD2 LYS 125 2.478 8.581 -26.406 1008 HD3 LYS 125 HD3 LYS 125 0.746 8.937 -26.536 1009 HE2 LYS 125 HE2 LYS 125 1.174 11.209 -25.607 1010 HE3 LYS 125 HE3 LYS 125 2.922 10.858 -25.660 1011 HZ1 LYS 125 HZ1 LYS 125 2.163 12.004 -27.672 1012 HZ2 LYS 125 HZ2 LYS 125 1.082 10.802 -27.994 1013 HZ3 LYS 125 HZ3 LYS 125 2.702 10.489 -28.052 1014 H SER 126 H SER 126 -1.463 5.725 -21.753 1015 HA SER 126 HA SER 126 -3.464 7.862 -22.416 1016 HB2 SER 126 HB2 SER 126 -3.857 5.016 -21.432 1017 HB3 SER 126 HB3 SER 126 -5.151 6.209 -21.690 1018 HG SER 126 HG SER 126 -4.768 4.759 -23.486 1019 HA PRO 127 HA PRO 127 -2.105 8.429 -18.072 1020 HB2 PRO 127 HB2 PRO 127 -2.623 11.121 -17.839 1021 HB3 PRO 127 HB3 PRO 127 -1.123 10.470 -18.565 1022 HG2 PRO 127 HG2 PRO 127 -3.635 11.373 -19.954 1023 HG3 PRO 127 HG3 PRO 127 -1.934 11.846 -20.275 1024 HD2 PRO 127 HD2 PRO 127 -3.115 9.945 -21.743 1025 HD3 PRO 127 HD3 PRO 127 -1.410 9.747 -21.207 1026 H THR 128 H THR 128 -5.125 9.599 -19.601 1027 HA THR 128 HA THR 128 -6.551 9.994 -17.162 1028 HB THR 128 HB THR 128 -8.035 9.027 -19.565 1029 HG1 THR 128 HG1 THR 128 -7.047 11.594 -19.820 1030 HG21 THR 128 HG21 THR 128 -9.166 10.122 -17.660 1031 HG22 THR 128 HG22 THR 128 -9.315 11.093 -19.142 1032 HG23 THR 128 HG23 THR 128 -8.150 11.568 -17.882 1033 H GLU 129 H GLU 129 -5.967 7.135 -19.202 1034 HA GLU 129 HA GLU 129 -7.842 5.476 -17.720 1035 HB2 GLU 129 HB2 GLU 129 -5.566 4.776 -19.604 1036 HB3 GLU 129 HB3 GLU 129 -6.711 3.610 -18.931 1037 HG2 GLU 129 HG2 GLU 129 -7.363 5.936 -20.766 1038 HG3 GLU 129 HG3 GLU 129 -7.339 4.219 -21.204 1039 H ALA 130 H ALA 130 -4.371 6.256 -17.576 1040 HA ALA 130 HA ALA 130 -3.711 4.265 -15.619 1041 HB1 ALA 130 HB1 ALA 130 -2.019 5.533 -16.946 1042 HB2 ALA 130 HB2 ALA 130 -2.456 7.014 -16.058 1043 HB3 ALA 130 HB3 ALA 130 -1.724 5.642 -15.195 1044 H GLU 131 H GLU 131 -4.920 7.651 -15.385 1045 HA GLU 131 HA GLU 131 -4.957 7.714 -12.505 1046 HB2 GLU 131 HB2 GLU 131 -6.429 9.247 -14.654 1047 HB3 GLU 131 HB3 GLU 131 -6.798 9.469 -12.941 1048 HG2 GLU 131 HG2 GLU 131 -4.388 9.998 -12.544 1049 HG3 GLU 131 HG3 GLU 131 -4.147 9.987 -14.300 1050 H LYS 132 H LYS 132 -7.310 6.623 -14.956 1051 HA LYS 132 HA LYS 132 -9.510 6.255 -13.175 1052 HB2 LYS 132 HB2 LYS 132 -9.590 6.214 -15.676 1053 HB3 LYS 132 HB3 LYS 132 -8.775 4.650 -15.652 1054 HG2 LYS 132 HG2 LYS 132 -10.708 3.751 -14.306 1055 HG3 LYS 132 HG3 LYS 132 -11.552 5.280 -14.622 1056 HD2 LYS 132 HD2 LYS 132 -10.444 3.425 -16.776 1057 HD3 LYS 132 HD3 LYS 132 -12.131 3.416 -16.226 1058 HE2 LYS 132 HE2 LYS 132 -12.395 5.766 -16.961 1059 HE3 LYS 132 HE3 LYS 132 -10.697 5.796 -17.489 1060 HZ1 LYS 132 HZ1 LYS 132 -12.164 5.357 -19.329 1061 HZ2 LYS 132 HZ2 LYS 132 -12.769 4.001 -18.597 1062 HZ3 LYS 132 HZ3 LYS 132 -11.179 4.069 -19.063 1063 H TYR 133 H TYR 133 -6.931 3.960 -14.229 1064 HA TYR 133 HA TYR 133 -7.948 1.876 -12.485 1065 HB2 TYR 133 HB2 TYR 133 -5.326 2.216 -13.957 1066 HB3 TYR 133 HB3 TYR 133 -5.731 0.789 -12.986 1067 HD1 TYR 133 HD1 TYR 133 -8.314 -0.072 -13.531 1068 HD2 TYR 133 HD2 TYR 133 -5.662 1.926 -16.271 1069 HE1 TYR 133 HE1 TYR 133 -9.584 -1.013 -15.454 1070 HE2 TYR 133 HE2 TYR 133 -6.936 0.968 -18.188 1071 HH TYR 133 HH TYR 133 -8.657 -0.396 -18.834 1072 H TYR 134 H TYR 134 -5.669 4.542 -12.079 1073 HA TYR 134 HA TYR 134 -4.558 3.635 -9.592 1074 HB2 TYR 134 HB2 TYR 134 -3.508 5.490 -10.659 1075 HB3 TYR 134 HB3 TYR 134 -5.027 6.374 -10.777 1076 HD1 TYR 134 HD1 TYR 134 -2.588 5.054 -8.247 1077 HD2 TYR 134 HD2 TYR 134 -5.699 7.899 -9.117 1078 HE1 TYR 134 HE1 TYR 134 -2.177 6.182 -6.067 1079 HE2 TYR 134 HE2 TYR 134 -5.280 9.021 -6.933 1080 HH TYR 134 HH TYR 134 -4.109 9.002 -4.989 1081 H GLY 135 H GLY 135 -7.493 5.602 -10.378 1082 HA2 GLY 135 HA2 GLY 135 -8.308 5.936 -7.673 1083 HA3 GLY 135 HA3 GLY 135 -9.380 5.967 -9.085 1084 H GLN 136 H GLN 136 -8.912 3.285 -9.986 1085 HA GLN 136 HA GLN 136 -10.746 1.869 -8.286 1086 HB2 GLN 136 HB2 GLN 136 -8.896 0.930 -10.503 1087 HB3 GLN 136 HB3 GLN 136 -10.066 -0.118 -9.692 1088 HG2 GLN 136 HG2 GLN 136 -11.915 1.236 -10.479 1089 HG3 GLN 136 HG3 GLN 136 -10.806 2.420 -11.176 1090 HE21 GLN 136 HE21 GLN 136 -11.704 2.148 -13.236 1091 HE22 GLN 136 HE22 GLN 136 -11.359 0.727 -14.193 1092 H THR 137 H THR 137 -7.143 1.678 -8.639 1093 HA THR 137 HA THR 137 -7.077 -0.535 -6.787 1094 HB THR 137 HB THR 137 -5.280 -0.075 -8.541 1095 HG1 THR 137 HG1 THR 137 -4.602 -0.577 -5.821 1096 HG21 THR 137 HG21 THR 137 -4.242 1.790 -6.370 1097 HG22 THR 137 HG22 THR 137 -4.756 2.258 -8.004 1098 HG23 THR 137 HG23 THR 137 -3.339 1.225 -7.790 1099 H VAL 138 H VAL 138 -7.108 2.970 -6.330 1100 HA VAL 138 HA VAL 138 -6.097 2.980 -3.634 1101 HB VAL 138 HB VAL 138 -8.160 4.765 -5.025 1102 HG11 VAL 138 HG11 VAL 138 -8.667 4.899 -2.654 1103 HG12 VAL 138 HG12 VAL 138 -6.943 5.064 -2.244 1104 HG13 VAL 138 HG13 VAL 138 -7.787 6.367 -3.115 1105 HG21 VAL 138 HG21 VAL 138 -5.659 4.790 -5.721 1106 HG22 VAL 138 HG22 VAL 138 -6.406 6.341 -5.307 1107 HG23 VAL 138 HG23 VAL 138 -5.352 5.519 -4.142 1108 H SER 139 H SER 139 -9.391 2.438 -4.987 1109 HA SER 139 HA SER 139 -10.668 2.062 -2.442 1110 HB2 SER 139 HB2 SER 139 -11.907 2.427 -4.566 1111 HB3 SER 139 HB3 SER 139 -11.367 0.838 -5.146 1112 HG SER 139 HG SER 139 -12.548 -0.144 -3.512 1113 H ASN 140 H ASN 140 -9.120 -0.184 -4.746 1114 HA ASN 140 HA ASN 140 -9.724 -2.585 -3.373 1115 HB2 ASN 140 HB2 ASN 140 -8.606 -2.027 -5.704 1116 HB3 ASN 140 HB3 ASN 140 -7.097 -2.200 -4.800 1117 HD21 ASN 140 HD21 ASN 140 -8.492 -3.752 -6.949 1118 HD22 ASN 140 HD22 ASN 140 -8.500 -5.389 -6.341 1119 H ILE 141 H ILE 141 -6.936 -0.361 -3.033 1120 HA ILE 141 HA ILE 141 -5.496 -1.932 -1.122 1121 HB ILE 141 HB ILE 141 -5.551 1.072 -1.696 1122 HG12 ILE 141 HG12 ILE 141 -3.263 -0.844 -2.196 1123 HG13 ILE 141 HG13 ILE 141 -4.614 -0.775 -3.326 1124 HG21 ILE 141 HG21 ILE 141 -3.733 -0.471 0.212 1125 HG22 ILE 141 HG22 ILE 141 -3.359 1.156 -0.393 1126 HG23 ILE 141 HG23 ILE 141 -4.798 0.893 0.612 1127 HD11 ILE 141 HD11 ILE 141 -2.918 0.651 -4.177 1128 HD12 ILE 141 HD12 ILE 141 -4.208 1.698 -3.567 1129 HD13 ILE 141 HD13 ILE 141 -2.720 1.474 -2.616 1130 H ASN 142 H ASN 142 -8.080 0.541 -0.775 1131 HA ASN 142 HA ASN 142 -7.996 0.559 2.096 1132 HB2 ASN 142 HB2 ASN 142 -9.124 2.254 0.598 1133 HB3 ASN 142 HB3 ASN 142 -10.409 1.070 0.321 1134 HD21 ASN 142 HD21 ASN 142 -9.168 3.475 2.395 1135 HD22 ASN 142 HD22 ASN 142 -10.358 3.304 3.663 1136 H GLU 143 H GLU 143 -9.872 -1.413 -0.252 1137 HA GLU 143 HA GLU 143 -11.433 -2.781 1.700 1138 HB2 GLU 143 HB2 GLU 143 -10.419 -3.680 -1.022 1139 HB3 GLU 143 HB3 GLU 143 -11.585 -4.592 -0.071 1140 HG2 GLU 143 HG2 GLU 143 -13.261 -2.932 -0.342 1141 HG3 GLU 143 HG3 GLU 143 -12.105 -1.770 -1.004 1142 H VAL 144 H VAL 144 -8.223 -3.474 0.359 1143 HA VAL 144 HA VAL 144 -7.935 -6.003 1.757 1144 HB VAL 144 HB VAL 144 -5.887 -4.078 0.531 1145 HG11 VAL 144 HG11 VAL 144 -4.282 -6.009 0.682 1146 HG12 VAL 144 HG12 VAL 144 -4.725 -5.328 2.255 1147 HG13 VAL 144 HG13 VAL 144 -5.458 -6.854 1.718 1148 HG21 VAL 144 HG21 VAL 144 -7.413 -5.231 -1.072 1149 HG22 VAL 144 HG22 VAL 144 -5.734 -5.766 -1.246 1150 HG23 VAL 144 HG23 VAL 144 -6.905 -6.795 -0.397 1151 H LEU 145 H LEU 145 -7.259 -2.579 2.491 1152 HA LEU 145 HA LEU 145 -5.582 -3.109 4.762 1153 HB2 LEU 145 HB2 LEU 145 -6.753 -0.802 3.480 1154 HB3 LEU 145 HB3 LEU 145 -6.991 -0.687 5.215 1155 HG LEU 145 HG LEU 145 -4.551 -0.967 5.566 1156 HD11 LEU 145 HD11 LEU 145 -3.030 -0.652 3.612 1157 HD12 LEU 145 HD12 LEU 145 -4.424 -0.860 2.532 1158 HD13 LEU 145 HD13 LEU 145 -3.898 -2.198 3.573 1159 HD21 LEU 145 HD21 LEU 145 -5.326 1.279 3.665 1160 HD22 LEU 145 HD22 LEU 145 -3.932 1.278 4.771 1161 HD23 LEU 145 HD23 LEU 145 -5.583 1.266 5.425 1162 H ALA 146 H ALA 146 -9.088 -2.794 4.400 1163 HA ALA 146 HA ALA 146 -9.638 -2.757 7.230 1164 HB1 ALA 146 HB1 ALA 146 -11.374 -3.653 4.881 1165 HB2 ALA 146 HB2 ALA 146 -11.950 -3.284 6.525 1166 HB3 ALA 146 HB3 ALA 146 -11.258 -1.993 5.513 1167 H LYS 147 H LYS 147 -8.984 -5.348 4.927 1168 HA LYS 147 HA LYS 147 -9.878 -7.417 6.841 1169 HB2 LYS 147 HB2 LYS 147 -8.555 -7.544 4.130 1170 HB3 LYS 147 HB3 LYS 147 -9.017 -8.966 5.091 1171 HG2 LYS 147 HG2 LYS 147 -11.362 -8.160 5.122 1172 HG3 LYS 147 HG3 LYS 147 -10.886 -6.819 4.070 1173 HD2 LYS 147 HD2 LYS 147 -10.176 -8.440 2.351 1174 HD3 LYS 147 HD3 LYS 147 -10.676 -9.776 3.400 1175 HE2 LYS 147 HE2 LYS 147 -12.408 -9.220 1.697 1176 HE3 LYS 147 HE3 LYS 147 -12.993 -9.008 3.359 1177 HZ1 LYS 147 HZ1 LYS 147 -12.012 -6.785 1.650 1178 HZ2 LYS 147 HZ2 LYS 147 -12.654 -6.636 3.156 1179 HZ3 LYS 147 HZ3 LYS 147 -13.605 -7.137 1.904 1180 H LEU 148 H LEU 148 -7.192 -5.519 6.375 1181 HA LEU 148 HA LEU 148 -5.403 -7.413 7.845 1182 HB2 LEU 148 HB2 LEU 148 -4.831 -4.744 6.510 1183 HB3 LEU 148 HB3 LEU 148 -3.643 -5.723 7.357 1184 HG LEU 148 HG LEU 148 -5.051 -6.601 4.827 1185 HD11 LEU 148 HD11 LEU 148 -2.338 -5.303 5.280 1186 HD12 LEU 148 HD12 LEU 148 -3.719 -4.611 4.397 1187 HD13 LEU 148 HD13 LEU 148 -2.874 -6.027 3.746 1188 HD21 LEU 148 HD21 LEU 148 -3.244 -8.247 4.688 1189 HD22 LEU 148 HD22 LEU 148 -4.204 -8.465 6.165 1190 HD23 LEU 148 HD23 LEU 148 -2.606 -7.684 6.249 1191 H GLY 149 H GLY 149 -7.864 -5.523 8.645 1192 HA2 GLY 149 HA2 GLY 149 -6.425 -4.103 10.852 1193 HA3 GLY 149 HA3 GLY 149 -7.883 -3.493 10.053 Start of MODEL 4 1 H1 GLU 1 H1 GLU 1 -1.545 26.570 19.064 2 H2 GLU 1 H2 GLU 1 -1.425 24.930 19.205 3 H3 GLU 1 H3 GLU 1 -2.444 25.595 18.087 4 HA GLU 1 HA GLU 1 -2.725 25.877 21.007 5 HB2 GLU 1 HB2 GLU 1 -3.535 27.775 19.646 6 HB3 GLU 1 HB3 GLU 1 -4.572 26.666 18.738 7 HG2 GLU 1 HG2 GLU 1 -5.811 26.132 20.783 8 HG3 GLU 1 HG3 GLU 1 -4.736 27.188 21.720 9 H ALA 2 H ALA 2 -4.147 24.381 18.015 10 HA ALA 2 HA ALA 2 -6.129 22.921 19.232 11 HB1 ALA 2 HB1 ALA 2 -6.043 21.453 17.245 12 HB2 ALA 2 HB2 ALA 2 -5.867 23.166 16.804 13 HB3 ALA 2 HB3 ALA 2 -4.439 22.100 16.825 14 H ARG 3 H ARG 3 -2.760 21.757 18.818 15 HA ARG 3 HA ARG 3 -1.633 19.955 19.730 16 HB2 ARG 3 HB2 ARG 3 -3.660 20.334 21.957 17 HB3 ARG 3 HB3 ARG 3 -2.239 19.300 22.063 18 HG2 ARG 3 HG2 ARG 3 -0.745 21.120 22.060 19 HG3 ARG 3 HG3 ARG 3 -1.967 22.249 21.445 20 HD2 ARG 3 HD2 ARG 3 -2.192 20.871 24.141 21 HD3 ARG 3 HD3 ARG 3 -1.451 22.474 23.917 22 HE ARG 3 HE ARG 3 -3.939 22.604 22.639 23 HH11 ARG 3 HH11 ARG 3 -2.861 22.070 25.968 24 HH12 ARG 3 HH12 ARG 3 -4.309 22.768 26.640 25 HH21 ARG 3 HH21 ARG 3 -5.733 23.459 23.559 26 HH22 ARG 3 HH22 ARG 3 -5.914 23.545 25.292 27 HA PRO 4 HA PRO 4 -4.944 16.990 18.357 28 HB2 PRO 4 HB2 PRO 4 -3.476 15.706 16.426 29 HB3 PRO 4 HB3 PRO 4 -4.406 17.204 16.102 30 HG2 PRO 4 HG2 PRO 4 -1.487 16.909 16.774 31 HG3 PRO 4 HG3 PRO 4 -2.248 17.791 15.405 32 HD2 PRO 4 HD2 PRO 4 -1.504 19.100 17.613 33 HD3 PRO 4 HD3 PRO 4 -3.069 19.492 16.812 34 H ILE 5 H ILE 5 -5.005 14.725 18.777 35 HA ILE 5 HA ILE 5 -3.351 13.995 20.974 36 HB ILE 5 HB ILE 5 -5.737 13.275 20.602 37 HG12 ILE 5 HG12 ILE 5 -3.814 10.978 21.074 38 HG13 ILE 5 HG13 ILE 5 -4.157 12.246 22.252 39 HG21 ILE 5 HG21 ILE 5 -4.594 11.178 18.699 40 HG22 ILE 5 HG22 ILE 5 -6.296 11.405 19.158 41 HG23 ILE 5 HG23 ILE 5 -5.470 12.625 18.171 42 HD11 ILE 5 HD11 ILE 5 -6.579 11.554 22.225 43 HD12 ILE 5 HD12 ILE 5 -6.136 10.197 21.160 44 HD13 ILE 5 HD13 ILE 5 -5.475 10.287 22.805 45 H VAL 6 H VAL 6 -1.625 12.693 21.202 46 HA VAL 6 HA VAL 6 0.140 12.433 18.983 47 HB VAL 6 HB VAL 6 0.690 12.748 21.476 48 HG11 VAL 6 HG11 VAL 6 0.462 9.706 21.550 49 HG12 VAL 6 HG12 VAL 6 1.016 10.771 22.861 50 HG13 VAL 6 HG13 VAL 6 -0.674 10.837 22.327 51 HG21 VAL 6 HG21 VAL 6 2.267 10.597 20.011 52 HG22 VAL 6 HG22 VAL 6 2.410 12.349 19.737 53 HG23 VAL 6 HG23 VAL 6 2.859 11.659 21.311 54 H VAL 7 H VAL 7 -2.439 10.433 19.900 55 HA VAL 7 HA VAL 7 -1.373 7.874 19.092 56 HB VAL 7 HB VAL 7 -4.258 8.902 19.239 57 HG11 VAL 7 HG11 VAL 7 -4.886 6.475 19.331 58 HG12 VAL 7 HG12 VAL 7 -4.196 6.951 17.769 59 HG13 VAL 7 HG13 VAL 7 -3.201 6.053 18.940 60 HG21 VAL 7 HG21 VAL 7 -4.339 7.661 21.388 61 HG22 VAL 7 HG22 VAL 7 -2.632 7.201 21.193 62 HG23 VAL 7 HG23 VAL 7 -3.076 8.903 21.433 63 H GLY 8 H GLY 8 -2.555 10.724 17.425 64 HA2 GLY 8 HA2 GLY 8 -2.637 11.223 15.206 65 HA3 GLY 8 HA3 GLY 8 -1.413 9.976 15.006 66 HA PRO 9 HA PRO 9 -5.122 7.547 13.723 67 HB2 PRO 9 HB2 PRO 9 -7.709 8.310 14.090 68 HB3 PRO 9 HB3 PRO 9 -6.783 7.505 15.399 69 HG2 PRO 9 HG2 PRO 9 -7.270 10.443 14.957 70 HG3 PRO 9 HG3 PRO 9 -7.517 9.472 16.444 71 HD2 PRO 9 HD2 PRO 9 -5.273 10.944 16.036 72 HD3 PRO 9 HD3 PRO 9 -5.228 9.366 16.894 73 HA PRO 10 HA PRO 10 -5.562 10.049 10.141 74 HB2 PRO 10 HB2 PRO 10 -7.314 8.722 8.502 75 HB3 PRO 10 HB3 PRO 10 -5.652 8.124 8.823 76 HG2 PRO 10 HG2 PRO 10 -8.236 7.327 10.154 77 HG3 PRO 10 HG3 PRO 10 -6.971 6.279 9.433 78 HD2 PRO 10 HD2 PRO 10 -7.062 6.760 12.088 79 HD3 PRO 10 HD3 PRO 10 -5.490 6.649 11.220 80 HA PRO 11 HA PRO 11 -9.136 12.450 11.069 81 HB2 PRO 11 HB2 PRO 11 -9.322 14.142 8.916 82 HB3 PRO 11 HB3 PRO 11 -8.044 14.291 10.167 83 HG2 PRO 11 HG2 PRO 11 -7.911 12.922 7.494 84 HG3 PRO 11 HG3 PRO 11 -6.793 14.130 8.202 85 HD2 PRO 11 HD2 PRO 11 -6.268 11.495 8.304 86 HD3 PRO 11 HD3 PRO 11 -5.882 12.569 9.695 87 HA PRO 12 HA PRO 12 -12.260 10.254 8.883 88 HB2 PRO 12 HB2 PRO 12 -14.549 11.404 9.760 89 HB3 PRO 12 HB3 PRO 12 -13.476 10.497 10.876 90 HG2 PRO 12 HG2 PRO 12 -13.616 13.469 10.397 91 HG3 PRO 12 HG3 PRO 12 -13.679 12.576 11.950 92 HD2 PRO 12 HD2 PRO 12 -11.374 13.663 10.996 93 HD3 PRO 12 HD3 PRO 12 -11.385 12.116 11.914 94 H LEU 13 H LEU 13 -13.821 10.366 7.212 95 HA LEU 13 HA LEU 13 -14.723 11.089 5.248 96 HB2 LEU 13 HB2 LEU 13 -15.054 13.695 6.758 97 HB3 LEU 13 HB3 LEU 13 -15.949 13.206 5.324 98 HG LEU 13 HG LEU 13 -16.111 11.785 8.006 99 HD11 LEU 13 HD11 LEU 13 -16.979 14.085 8.122 100 HD12 LEU 13 HD12 LEU 13 -18.293 12.896 8.225 101 HD13 LEU 13 HD13 LEU 13 -18.010 13.776 6.704 102 HD21 LEU 13 HD21 LEU 13 -18.152 10.757 7.022 103 HD22 LEU 13 HD22 LEU 13 -16.686 10.308 6.134 104 HD23 LEU 13 HD23 LEU 13 -17.784 11.540 5.467 105 H SER 14 H SER 14 -11.783 11.518 5.474 106 HA SER 14 HA SER 14 -11.539 13.406 3.212 107 HB2 SER 14 HB2 SER 14 -9.567 14.481 4.382 108 HB3 SER 14 HB3 SER 14 -11.148 14.865 5.100 109 HG SER 14 HG SER 14 -10.773 13.448 6.734 110 H GLY 15 H GLY 15 -9.327 13.204 2.248 111 HA2 GLY 15 HA2 GLY 15 -8.628 10.334 2.266 112 HA3 GLY 15 HA3 GLY 15 -8.230 11.515 1.016 113 H GLY 16 H GLY 16 -7.531 12.777 4.113 114 HA2 GLY 16 HA2 GLY 16 -5.142 11.653 4.878 115 HA3 GLY 16 HA3 GLY 16 -4.697 12.674 3.497 116 H LEU 17 H LEU 17 -3.472 13.489 5.586 117 HA LEU 17 HA LEU 17 -4.962 15.151 7.414 118 HB2 LEU 17 HB2 LEU 17 -2.040 14.750 6.743 119 HB3 LEU 17 HB3 LEU 17 -2.537 16.100 7.752 120 HG LEU 17 HG LEU 17 -3.617 14.475 9.328 121 HD11 LEU 17 HD11 LEU 17 -2.053 12.392 7.743 122 HD12 LEU 17 HD12 LEU 17 -3.825 12.480 7.906 123 HD13 LEU 17 HD13 LEU 17 -2.825 12.135 9.327 124 HD21 LEU 17 HD21 LEU 17 -1.424 15.517 9.730 125 HD22 LEU 17 HD22 LEU 17 -0.624 14.181 8.866 126 HD23 LEU 17 HD23 LEU 17 -1.492 13.873 10.392 127 HA PRO 18 HA PRO 18 -5.389 18.731 4.926 128 HB2 PRO 18 HB2 PRO 18 -5.315 20.796 6.710 129 HB3 PRO 18 HB3 PRO 18 -6.649 19.597 6.693 130 HG2 PRO 18 HG2 PRO 18 -4.166 19.625 8.403 131 HG3 PRO 18 HG3 PRO 18 -5.883 19.500 8.914 132 HD2 PRO 18 HD2 PRO 18 -4.360 17.307 8.641 133 HD3 PRO 18 HD3 PRO 18 -6.081 17.300 8.115 134 H GLY 19 H GLY 19 -4.414 20.807 4.222 135 HA2 GLY 19 HA2 GLY 19 -2.368 22.259 4.563 136 HA3 GLY 19 HA3 GLY 19 -1.438 20.749 4.554 137 H THR 20 H THR 20 -3.354 19.640 2.484 138 HA THR 20 HA THR 20 -1.897 20.520 0.141 139 HB THR 20 HB THR 20 -2.830 18.193 0.387 140 HG1 THR 20 HG1 THR 20 -4.185 19.070 -1.838 141 HG21 THR 20 HG21 THR 20 -5.200 17.781 -0.055 142 HG22 THR 20 HG22 THR 20 -5.525 19.527 -0.133 143 HG23 THR 20 HG23 THR 20 -5.029 18.777 1.405 144 H GLU 21 H GLU 21 -2.803 21.569 -1.711 145 HA GLU 21 HA GLU 21 -3.811 23.366 -2.703 146 HB2 GLU 21 HB2 GLU 21 -5.544 21.426 -2.485 147 HB3 GLU 21 HB3 GLU 21 -6.401 22.538 -1.412 148 HG2 GLU 21 HG2 GLU 21 -6.695 24.130 -3.187 149 HG3 GLU 21 HG3 GLU 21 -5.499 23.307 -4.204 150 H ASN 22 H ASN 22 -2.685 23.921 -0.129 151 HA ASN 22 HA ASN 22 -2.389 25.643 1.296 152 HB2 ASN 22 HB2 ASN 22 -3.053 27.058 -0.702 153 HB3 ASN 22 HB3 ASN 22 -4.672 27.160 0.005 154 HD21 ASN 22 HD21 ASN 22 -4.809 28.023 2.260 155 HD22 ASN 22 HD22 ASN 22 -3.676 29.286 2.677 156 H SER 23 H SER 23 -5.918 25.147 0.842 157 HA SER 23 HA SER 23 -7.630 25.081 2.380 158 HB2 SER 23 HB2 SER 23 -5.507 23.615 3.996 159 HB3 SER 23 HB3 SER 23 -7.259 23.552 4.289 160 HG SER 23 HG SER 23 -5.896 22.684 1.938 161 H ASP 24 H ASP 24 -7.091 24.884 5.378 162 HA ASP 24 HA ASP 24 -6.464 27.758 5.916 163 HB2 ASP 24 HB2 ASP 24 -7.769 27.555 7.912 164 HB3 ASP 24 HB3 ASP 24 -8.771 26.917 6.598 165 H GLN 25 H GLN 25 -5.510 27.709 8.403 166 HA GLN 25 HA GLN 25 -3.077 26.129 8.052 167 HB2 GLN 25 HB2 GLN 25 -3.299 28.598 8.780 168 HB3 GLN 25 HB3 GLN 25 -3.624 27.961 10.395 169 HG2 GLN 25 HG2 GLN 25 -1.443 26.858 10.434 170 HG3 GLN 25 HG3 GLN 25 -1.168 27.265 8.736 171 HE21 GLN 25 HE21 GLN 25 0.099 28.927 8.368 172 HE22 GLN 25 HE22 GLN 25 0.373 30.258 9.467 173 H ALA 26 H ALA 26 -5.176 24.398 8.496 174 HA ALA 26 HA ALA 26 -5.212 23.558 11.297 175 HB1 ALA 26 HB1 ALA 26 -6.191 22.232 8.730 176 HB2 ALA 26 HB2 ALA 26 -6.499 21.620 10.373 177 HB3 ALA 26 HB3 ALA 26 -7.167 23.187 9.864 178 H ARG 27 H ARG 27 -4.467 21.426 11.999 179 HA ARG 27 HA ARG 27 -2.610 19.934 10.319 180 HB2 ARG 27 HB2 ARG 27 -1.152 21.749 11.271 181 HB3 ARG 27 HB3 ARG 27 -1.585 21.205 12.897 182 HG2 ARG 27 HG2 ARG 27 -0.535 19.025 12.482 183 HG3 ARG 27 HG3 ARG 27 -0.179 19.489 10.809 184 HD2 ARG 27 HD2 ARG 27 0.910 20.888 13.275 185 HD3 ARG 27 HD3 ARG 27 1.780 19.670 12.318 186 HE ARG 27 HE ARG 27 0.873 21.743 10.587 187 HH11 ARG 27 HH11 ARG 27 3.318 21.216 13.083 188 HH12 ARG 27 HH12 ARG 27 4.383 22.432 12.428 189 HH21 ARG 27 HH21 ARG 27 2.281 23.279 9.813 190 HH22 ARG 27 HH22 ARG 27 3.800 23.578 10.610 191 H ASP 28 H ASP 28 -2.493 17.810 11.043 192 HA ASP 28 HA ASP 28 -3.793 17.181 13.650 193 HB2 ASP 28 HB2 ASP 28 -5.163 16.763 11.412 194 HB3 ASP 28 HB3 ASP 28 -4.101 15.353 11.279 195 H GLY 29 H GLY 29 -3.236 14.622 13.981 196 HA2 GLY 29 HA2 GLY 29 -0.259 14.514 13.636 197 HA3 GLY 29 HA3 GLY 29 -1.169 13.776 14.957 198 H THR 30 H THR 30 0.716 12.344 13.525 199 HA THR 30 HA THR 30 -0.908 10.080 12.714 200 HB THR 30 HB THR 30 -0.721 11.399 10.533 201 HG1 THR 30 HG1 THR 30 -0.988 9.210 10.387 202 HG21 THR 30 HG21 THR 30 2.231 10.680 10.737 203 HG22 THR 30 HG22 THR 30 1.570 12.325 10.916 204 HG23 THR 30 HG23 THR 30 1.411 11.464 9.371 205 H LEU 31 H LEU 31 0.760 8.186 12.353 206 HA LEU 31 HA LEU 31 3.368 8.744 13.595 207 HB2 LEU 31 HB2 LEU 31 3.094 7.494 15.516 208 HB3 LEU 31 HB3 LEU 31 1.592 8.386 15.412 209 HG LEU 31 HG LEU 31 1.980 5.440 14.768 210 HD11 LEU 31 HD11 LEU 31 0.697 5.101 16.842 211 HD12 LEU 31 HD12 LEU 31 0.615 6.864 17.089 212 HD13 LEU 31 HD13 LEU 31 2.184 6.021 17.149 213 HD21 LEU 31 HD21 LEU 31 -0.554 5.384 14.825 214 HD22 LEU 31 HD22 LEU 31 0.141 6.170 13.399 215 HD23 LEU 31 HD23 LEU 31 -0.531 7.156 14.717 216 HA PRO 32 HA PRO 32 4.337 5.326 10.990 217 HB2 PRO 32 HB2 PRO 32 6.703 4.409 11.938 218 HB3 PRO 32 HB3 PRO 32 6.566 6.049 11.218 219 HG2 PRO 32 HG2 PRO 32 6.508 5.241 14.120 220 HG3 PRO 32 HG3 PRO 32 7.502 6.501 13.320 221 HD2 PRO 32 HD2 PRO 32 5.166 7.076 14.616 222 HD3 PRO 32 HD3 PRO 32 5.702 7.986 13.162 223 H TYR 33 H TYR 33 4.521 2.967 10.918 224 HA TYR 33 HA TYR 33 3.199 1.630 13.194 225 HB2 TYR 33 HB2 TYR 33 4.013 0.816 10.393 226 HB3 TYR 33 HB3 TYR 33 3.562 -0.399 11.591 227 HD1 TYR 33 HD2 TYR 33 2.001 2.994 10.825 228 HD2 TYR 33 HD1 TYR 33 1.495 -1.290 10.979 229 HE1 TYR 33 HE2 TYR 33 -0.412 3.252 10.295 230 HE2 TYR 33 HE1 TYR 33 -0.919 -1.002 10.447 231 HH TYR 33 HH TYR 33 -2.396 2.211 9.935 232 H THR 34 H THR 34 5.115 2.380 14.453 233 HA THR 34 HA THR 34 6.943 1.947 15.711 234 HB THR 34 HB THR 34 7.744 -0.217 16.175 235 HG1 THR 34 HG1 THR 34 6.842 -0.850 13.558 236 HG21 THR 34 HG21 THR 34 5.792 -1.571 16.507 237 HG22 THR 34 HG22 THR 34 4.921 -0.765 15.189 238 HG23 THR 34 HG23 THR 34 5.287 0.123 16.691 239 H LYS 35 H LYS 35 9.364 1.067 15.556 240 HA LYS 35 HA LYS 35 10.477 1.707 12.863 241 HB2 LYS 35 HB2 LYS 35 10.289 3.847 14.092 242 HB3 LYS 35 HB3 LYS 35 11.181 3.155 15.451 243 HG2 LYS 35 HG2 LYS 35 13.158 2.855 13.965 244 HG3 LYS 35 HG3 LYS 35 12.266 3.653 12.655 245 HD2 LYS 35 HD2 LYS 35 12.033 5.679 14.054 246 HD3 LYS 35 HD3 LYS 35 12.916 4.879 15.371 247 HE2 LYS 35 HE2 LYS 35 14.026 5.469 12.593 248 HE3 LYS 35 HE3 LYS 35 14.362 6.415 14.056 249 HZ1 LYS 35 HZ1 LYS 35 15.080 3.561 13.665 250 HZ2 LYS 35 HZ2 LYS 35 15.386 4.444 15.026 251 HZ3 LYS 35 HZ3 LYS 35 16.132 4.831 13.606 252 H ASP 36 H ASP 36 11.280 0.994 16.268 253 HA ASP 36 HA ASP 36 13.803 -0.329 15.554 254 HB2 ASP 36 HB2 ASP 36 13.973 -0.538 18.006 255 HB3 ASP 36 HB3 ASP 36 13.552 1.123 17.553 256 H ARG 37 H ARG 37 10.508 -1.155 16.156 257 HA ARG 37 HA ARG 37 10.795 -3.565 17.539 258 HB2 ARG 37 HB2 ARG 37 8.743 -2.022 16.913 259 HB3 ARG 37 HB3 ARG 37 8.543 -3.175 15.588 260 HG2 ARG 37 HG2 ARG 37 7.153 -3.966 17.298 261 HG3 ARG 37 HG3 ARG 37 8.598 -4.983 17.399 262 HD2 ARG 37 HD2 ARG 37 9.478 -3.465 19.196 263 HD3 ARG 37 HD3 ARG 37 7.941 -2.575 19.133 264 HE ARG 37 HE ARG 37 7.437 -5.381 19.474 265 HH11 ARG 37 HH11 ARG 37 8.656 -2.629 21.341 266 HH12 ARG 37 HH12 ARG 37 8.152 -3.328 22.855 267 HH21 ARG 37 HH21 ARG 37 6.845 -6.199 21.392 268 HH22 ARG 37 HH22 ARG 37 7.131 -5.334 22.886 269 H PHE 38 H PHE 38 11.168 -2.989 14.123 270 HA PHE 38 HA PHE 38 10.677 -5.650 13.217 271 HB2 PHE 38 HB2 PHE 38 12.585 -3.638 12.000 272 HB3 PHE 38 HB3 PHE 38 11.710 -4.933 11.175 273 HD1 PHE 38 HD2 PHE 38 9.005 -4.756 11.532 274 HD2 PHE 38 HD1 PHE 38 11.798 -1.492 11.742 275 HE1 PHE 38 HE2 PHE 38 7.155 -3.139 11.059 276 HE2 PHE 38 HE1 PHE 38 9.959 0.119 11.272 277 HZ PHE 38 HZ PHE 38 7.636 -0.701 10.935 278 H TYR 39 H TYR 39 13.337 -4.292 14.962 279 HA TYR 39 HA TYR 39 15.073 -6.587 14.159 280 HB2 TYR 39 HB2 TYR 39 16.035 -4.169 15.666 281 HB3 TYR 39 HB3 TYR 39 16.930 -5.231 14.566 282 HD1 TYR 39 HD2 TYR 39 16.123 -5.163 12.020 283 HD2 TYR 39 HD1 TYR 39 15.252 -2.093 14.908 284 HE1 TYR 39 HE2 TYR 39 15.646 -3.548 10.174 285 HE2 TYR 39 HE1 TYR 39 14.776 -0.495 13.057 286 HH TYR 39 HH TYR 39 14.580 -0.200 10.813 287 H LEU 40 H LEU 40 13.419 -5.002 16.807 288 HA LEU 40 HA LEU 40 14.904 -6.249 18.932 289 HB2 LEU 40 HB2 LEU 40 12.548 -4.532 18.629 290 HB3 LEU 40 HB3 LEU 40 12.322 -5.756 19.876 291 HG LEU 40 HG LEU 40 14.483 -5.001 20.923 292 HD11 LEU 40 HD11 LEU 40 15.477 -3.843 18.983 293 HD12 LEU 40 HD12 LEU 40 15.292 -2.736 20.356 294 HD13 LEU 40 HD13 LEU 40 14.146 -2.661 19.001 295 HD21 LEU 40 HD21 LEU 40 13.445 -3.032 21.979 296 HD22 LEU 40 HD22 LEU 40 12.276 -4.353 21.777 297 HD23 LEU 40 HD23 LEU 40 12.245 -2.954 20.671 298 H GLN 41 H GLN 41 11.857 -7.078 17.251 299 HA GLN 41 HA GLN 41 11.990 -9.745 18.586 300 HB2 GLN 41 HB2 GLN 41 9.554 -9.779 18.682 301 HB3 GLN 41 HB3 GLN 41 10.185 -8.411 19.592 302 HG2 GLN 41 HG2 GLN 41 9.530 -6.870 17.895 303 HG3 GLN 41 HG3 GLN 41 9.174 -8.170 16.756 304 HE21 GLN 41 HE21 GLN 41 7.309 -9.348 16.922 305 HE22 GLN 41 HE22 GLN 41 5.961 -8.815 17.916 306 HA PRO 42 HA PRO 42 11.466 -11.217 14.411 307 HB2 PRO 42 HB2 PRO 42 9.968 -13.478 14.680 308 HB3 PRO 42 HB3 PRO 42 11.679 -13.416 15.222 309 HG2 PRO 42 HG2 PRO 42 9.169 -13.027 16.843 310 HG3 PRO 42 HG3 PRO 42 10.551 -14.125 17.155 311 HD2 PRO 42 HD2 PRO 42 10.377 -11.718 18.354 312 HD3 PRO 42 HD3 PRO 42 11.960 -12.358 17.795 313 H LEU 43 H LEU 43 9.679 -11.552 12.795 314 HA LEU 43 HA LEU 43 7.346 -9.854 13.524 315 HB2 LEU 43 HB2 LEU 43 8.619 -10.653 10.891 316 HB3 LEU 43 HB3 LEU 43 7.063 -9.850 10.992 317 HG LEU 43 HG LEU 43 8.142 -7.879 12.035 318 HD11 LEU 43 HD11 LEU 43 10.743 -9.330 11.427 319 HD12 LEU 43 HD12 LEU 43 10.187 -8.721 13.004 320 HD13 LEU 43 HD13 LEU 43 10.617 -7.585 11.717 321 HD21 LEU 43 HD21 LEU 43 7.662 -8.069 9.610 322 HD22 LEU 43 HD22 LEU 43 9.287 -8.742 9.350 323 HD23 LEU 43 HD23 LEU 43 9.097 -7.069 9.925 324 HA PRO 44 HA PRO 44 5.381 -13.946 13.160 325 HB2 PRO 44 HB2 PRO 44 3.232 -13.569 14.788 326 HB3 PRO 44 HB3 PRO 44 4.874 -13.854 15.454 327 HG2 PRO 44 HG2 PRO 44 3.443 -11.266 14.993 328 HG3 PRO 44 HG3 PRO 44 4.233 -11.861 16.487 329 HD2 PRO 44 HD2 PRO 44 5.488 -10.174 14.778 330 HD3 PRO 44 HD3 PRO 44 6.373 -11.475 15.643 331 HA PRO 45 HA PRO 45 2.536 -12.812 10.008 332 HB2 PRO 45 HB2 PRO 45 0.659 -14.800 9.989 333 HB3 PRO 45 HB3 PRO 45 2.354 -15.064 9.481 334 HG2 PRO 45 HG2 PRO 45 1.110 -15.589 12.168 335 HG3 PRO 45 HG3 PRO 45 2.065 -16.700 11.129 336 HD2 PRO 45 HD2 PRO 45 3.236 -15.372 13.136 337 HD3 PRO 45 HD3 PRO 45 4.074 -15.543 11.551 338 H THR 46 H THR 46 1.253 -13.142 13.248 339 HA THR 46 HA THR 46 -1.404 -12.155 12.688 340 HB THR 46 HB THR 46 -1.275 -11.606 15.216 341 HG1 THR 46 HG1 THR 46 0.545 -12.343 16.263 342 HG21 THR 46 HG21 THR 46 -1.371 -13.965 15.875 343 HG22 THR 46 HG22 THR 46 -0.573 -14.452 14.364 344 HG23 THR 46 HG23 THR 46 -2.206 -13.745 14.322 345 H GLU 47 H GLU 47 1.647 -10.658 13.827 346 HA GLU 47 HA GLU 47 0.506 -7.976 13.890 347 HB2 GLU 47 HB2 GLU 47 3.355 -9.001 13.899 348 HB3 GLU 47 HB3 GLU 47 2.898 -7.312 14.147 349 HG2 GLU 47 HG2 GLU 47 1.753 -7.881 16.211 350 HG3 GLU 47 HG3 GLU 47 2.083 -9.606 15.945 351 H ALA 48 H ALA 48 1.967 -10.041 11.501 352 HA ALA 48 HA ALA 48 3.032 -8.083 9.738 353 HB1 ALA 48 HB1 ALA 48 1.798 -10.791 9.096 354 HB2 ALA 48 HB2 ALA 48 2.847 -9.843 8.030 355 HB3 ALA 48 HB3 ALA 48 3.497 -10.501 9.544 356 H ALA 49 H ALA 49 -0.274 -9.026 10.447 357 HA ALA 49 HA ALA 49 -1.531 -8.104 8.083 358 HB1 ALA 49 HB1 ALA 49 -3.533 -7.817 9.519 359 HB2 ALA 49 HB2 ALA 49 -2.714 -9.364 9.845 360 HB3 ALA 49 HB3 ALA 49 -2.518 -7.997 10.966 361 H GLN 50 H GLN 50 -0.342 -6.339 10.939 362 HA GLN 50 HA GLN 50 -1.493 -3.811 10.106 363 HB2 GLN 50 HB2 GLN 50 0.793 -4.430 12.012 364 HB3 GLN 50 HB3 GLN 50 -0.006 -2.865 11.845 365 HG2 GLN 50 HG2 GLN 50 -2.119 -3.835 12.632 366 HG3 GLN 50 HG3 GLN 50 -1.353 -5.426 12.759 367 HE21 GLN 50 HE21 GLN 50 -2.058 -5.325 15.000 368 HE22 GLN 50 HE22 GLN 50 -1.044 -4.489 16.154 369 H ARG 51 H ARG 51 1.706 -5.373 9.798 370 HA ARG 51 HA ARG 51 3.021 -3.042 8.728 371 HB2 ARG 51 HB2 ARG 51 3.691 -5.996 8.425 372 HB3 ARG 51 HB3 ARG 51 4.773 -4.653 8.029 373 HG2 ARG 51 HG2 ARG 51 4.651 -3.914 10.417 374 HG3 ARG 51 HG3 ARG 51 3.684 -5.355 10.776 375 HD2 ARG 51 HD2 ARG 51 5.559 -6.779 9.967 376 HD3 ARG 51 HD3 ARG 51 6.520 -5.312 9.695 377 HE ARG 51 HE ARG 51 6.707 -4.979 12.025 378 HH11 ARG 51 HH21 ARG 51 4.780 -7.868 11.377 379 HH12 ARG 51 HH22 ARG 51 4.863 -8.391 13.041 380 HH21 ARG 51 HH11 ARG 51 6.756 -5.733 14.115 381 HH22 ARG 51 HH12 ARG 51 5.912 -7.202 14.563 382 H ALA 52 H ALA 52 1.227 -5.710 7.261 383 HA ALA 52 HA ALA 52 1.942 -5.183 4.569 384 HB1 ALA 52 HB1 ALA 52 -0.636 -6.347 5.702 385 HB2 ALA 52 HB2 ALA 52 -0.098 -6.463 4.008 386 HB3 ALA 52 HB3 ALA 52 0.841 -7.255 5.296 387 H LYS 53 H LYS 53 -0.295 -3.502 6.713 388 HA LYS 53 HA LYS 53 -1.825 -2.190 4.658 389 HB2 LYS 53 HB2 LYS 53 -1.128 -1.218 7.454 390 HB3 LYS 53 HB3 LYS 53 -2.419 -0.576 6.432 391 HG2 LYS 53 HG2 LYS 53 -3.635 -2.670 6.562 392 HG3 LYS 53 HG3 LYS 53 -2.280 -3.451 7.357 393 HD2 LYS 53 HD2 LYS 53 -3.802 -3.044 9.059 394 HD3 LYS 53 HD3 LYS 53 -2.545 -1.818 9.260 395 HE2 LYS 53 HE2 LYS 53 -3.973 -0.118 8.252 396 HE3 LYS 53 HE3 LYS 53 -5.194 -1.351 7.836 397 HZ1 LYS 53 HZ1 LYS 53 -4.371 -0.661 10.597 398 HZ2 LYS 53 HZ2 LYS 53 -5.496 -1.797 10.179 399 HZ3 LYS 53 HZ3 LYS 53 -5.782 -0.200 9.877 400 H VAL 54 H VAL 54 1.265 -1.484 6.261 401 HA VAL 54 HA VAL 54 1.570 1.126 5.038 402 HB VAL 54 HB VAL 54 3.707 -0.742 6.177 403 HG11 VAL 54 HG11 VAL 54 5.023 1.348 6.466 404 HG12 VAL 54 HG12 VAL 54 4.667 1.035 4.757 405 HG13 VAL 54 HG13 VAL 54 3.741 2.267 5.644 406 HG21 VAL 54 HG21 VAL 54 3.490 0.678 8.223 407 HG22 VAL 54 HG22 VAL 54 2.067 1.457 7.501 408 HG23 VAL 54 HG23 VAL 54 2.039 -0.280 7.889 409 H SER 55 H SER 55 2.728 -2.201 4.330 410 HA SER 55 HA SER 55 4.261 -1.560 2.044 411 HB2 SER 55 HB2 SER 55 2.597 -4.064 2.489 412 HB3 SER 55 HB3 SER 55 4.063 -3.910 1.494 413 HG SER 55 HG SER 55 4.361 -4.784 3.686 414 H ALA 56 H ALA 56 0.767 -2.009 2.414 415 HA ALA 56 HA ALA 56 0.194 -1.971 -0.428 416 HB1 ALA 56 HB1 ALA 56 -1.255 -2.902 1.474 417 HB2 ALA 56 HB2 ALA 56 -1.699 -1.212 1.806 418 HB3 ALA 56 HB3 ALA 56 -2.065 -1.943 0.225 419 H SER 57 H SER 57 0.577 0.468 2.098 420 HA SER 57 HA SER 57 -0.611 2.612 0.560 421 HB2 SER 57 HB2 SER 57 1.288 2.704 2.938 422 HB3 SER 57 HB3 SER 57 0.324 4.060 2.313 423 HG SER 57 HG SER 57 -0.620 1.629 3.468 424 H GLU 58 H GLU 58 2.560 1.118 0.627 425 HA GLU 58 HA GLU 58 4.094 3.303 -0.423 426 HB2 GLU 58 HB2 GLU 58 4.353 0.293 -0.757 427 HB3 GLU 58 HB3 GLU 58 5.534 1.444 -1.367 428 HG2 GLU 58 HG2 GLU 58 4.775 1.080 1.540 429 HG3 GLU 58 HG3 GLU 58 6.246 0.476 0.759 430 H ILE 59 H ILE 59 1.815 1.066 -1.882 431 HA ILE 59 HA ILE 59 2.552 1.476 -4.628 432 HB ILE 59 HB ILE 59 -0.164 0.739 -3.414 433 HG12 ILE 59 HG12 ILE 59 2.001 -1.099 -4.510 434 HG13 ILE 59 HG13 ILE 59 1.788 -0.764 -2.794 435 HG21 ILE 59 HG21 ILE 59 0.879 0.212 -6.241 436 HG22 ILE 59 HG22 ILE 59 -0.723 -0.221 -5.605 437 HG23 ILE 59 HG23 ILE 59 -0.292 1.482 -5.820 438 HD11 ILE 59 HD11 ILE 59 -0.541 -1.701 -2.952 439 HD12 ILE 59 HD12 ILE 59 -0.157 -2.204 -4.618 440 HD13 ILE 59 HD13 ILE 59 0.765 -2.869 -3.256 441 H LEU 60 H LEU 60 0.583 3.280 -2.305 442 HA LEU 60 HA LEU 60 -0.707 4.953 -4.266 443 HB2 LEU 60 HB2 LEU 60 -0.227 5.436 -1.315 444 HB3 LEU 60 HB3 LEU 60 -1.359 6.318 -2.326 445 HG LEU 60 HG LEU 60 -1.594 3.342 -1.729 446 HD11 LEU 60 HD11 LEU 60 -1.806 4.710 0.320 447 HD12 LEU 60 HD12 LEU 60 -3.354 3.977 -0.147 448 HD13 LEU 60 HD13 LEU 60 -3.051 5.700 -0.474 449 HD21 LEU 60 HD21 LEU 60 -3.903 3.657 -2.511 450 HD22 LEU 60 HD22 LEU 60 -2.713 3.984 -3.786 451 HD23 LEU 60 HD23 LEU 60 -3.515 5.336 -2.951 452 H ASN 61 H ASN 61 2.414 5.066 -2.675 453 HA ASN 61 HA ASN 61 2.905 7.876 -2.872 454 HB2 ASN 61 HB2 ASN 61 4.241 6.161 -1.565 455 HB3 ASN 61 HB3 ASN 61 4.934 5.616 -3.097 456 HD21 ASN 61 HD21 ASN 61 5.167 7.812 -0.532 457 HD22 ASN 61 HD22 ASN 61 6.425 8.823 -1.203 458 H VAL 62 H VAL 62 3.168 5.242 -5.176 459 HA VAL 62 HA VAL 62 4.833 6.573 -7.065 460 HB VAL 62 HB VAL 62 2.892 4.368 -7.833 461 HG11 VAL 62 HG11 VAL 62 4.837 3.570 -9.165 462 HG12 VAL 62 HG12 VAL 62 4.421 5.237 -9.591 463 HG13 VAL 62 HG13 VAL 62 5.821 4.913 -8.543 464 HG21 VAL 62 HG21 VAL 62 3.733 3.576 -5.696 465 HG22 VAL 62 HG22 VAL 62 4.646 2.741 -6.958 466 HG23 VAL 62 HG23 VAL 62 5.387 4.104 -6.093 467 H LYS 63 H LYS 63 1.660 7.387 -6.262 468 HA LYS 63 HA LYS 63 0.351 7.876 -8.710 469 HB2 LYS 63 HB2 LYS 63 -0.542 8.337 -6.387 470 HB3 LYS 63 HB3 LYS 63 0.429 9.816 -6.379 471 HG2 LYS 63 HG2 LYS 63 -0.782 10.497 -8.507 472 HG3 LYS 63 HG3 LYS 63 -1.858 9.118 -8.265 473 HD2 LYS 63 HD2 LYS 63 -2.579 10.078 -6.111 474 HD3 LYS 63 HD3 LYS 63 -1.444 11.430 -6.342 475 HE2 LYS 63 HE2 LYS 63 -2.604 11.974 -8.505 476 HE3 LYS 63 HE3 LYS 63 -3.805 10.725 -8.137 477 HZ1 LYS 63 HZ1 LYS 63 -4.409 11.987 -6.157 478 HZ2 LYS 63 HZ2 LYS 63 -4.568 12.925 -7.507 479 HZ3 LYS 63 HZ3 LYS 63 -3.280 13.140 -6.499 480 H GLN 64 H GLN 64 3.028 9.674 -7.247 481 HA GLN 64 HA GLN 64 2.878 12.032 -8.815 482 HB2 GLN 64 HB2 GLN 64 5.334 10.656 -7.669 483 HB3 GLN 64 HB3 GLN 64 5.213 12.357 -8.134 484 HG2 GLN 64 HG2 GLN 64 3.489 12.694 -6.376 485 HG3 GLN 64 HG3 GLN 64 3.657 10.995 -5.904 486 HE21 GLN 64 HE21 GLN 64 5.355 10.341 -4.655 487 HE22 GLN 64 HE22 GLN 64 6.532 11.458 -4.006 488 H PHE 65 H PHE 65 3.905 8.861 -9.760 489 HA PHE 65 HA PHE 65 5.371 9.920 -12.128 490 HB2 PHE 65 HB2 PHE 65 4.945 7.099 -11.089 491 HB3 PHE 65 HB3 PHE 65 5.908 7.540 -12.496 492 HD1 PHE 65 HD1 PHE 65 8.047 8.780 -12.233 493 HD2 PHE 65 HD2 PHE 65 5.788 7.430 -8.836 494 HE1 PHE 65 HE1 PHE 65 10.041 9.124 -10.776 495 HE2 PHE 65 HE2 PHE 65 7.769 7.764 -7.370 496 HZ PHE 65 HZ PHE 65 9.903 8.613 -8.338 497 H ILE 66 H ILE 66 2.402 8.457 -11.082 498 HA ILE 66 HA ILE 66 1.540 7.349 -13.590 499 HB ILE 66 HB ILE 66 0.000 8.091 -11.042 500 HG12 ILE 66 HG12 ILE 66 0.958 5.407 -12.087 501 HG13 ILE 66 HG13 ILE 66 1.811 6.340 -10.877 502 HG21 ILE 66 HG21 ILE 66 -1.554 7.991 -12.980 503 HG22 ILE 66 HG22 ILE 66 -0.910 6.393 -13.407 504 HG23 ILE 66 HG23 ILE 66 -1.813 6.618 -11.898 505 HD11 ILE 66 HD11 ILE 66 -0.876 4.989 -10.601 506 HD12 ILE 66 HD12 ILE 66 0.622 4.629 -9.731 507 HD13 ILE 66 HD13 ILE 66 -0.254 6.134 -9.410 508 H ASP 67 H ASP 67 0.947 10.478 -11.940 509 HA ASP 67 HA ASP 67 -1.044 11.294 -13.882 510 HB2 ASP 67 HB2 ASP 67 -0.988 13.438 -12.761 511 HB3 ASP 67 HB3 ASP 67 -0.944 12.161 -11.537 512 H ARG 68 H ARG 68 2.196 10.840 -14.457 513 HA ARG 68 HA ARG 68 2.296 13.268 -16.174 514 HB2 ARG 68 HB2 ARG 68 4.586 11.994 -14.625 515 HB3 ARG 68 HB3 ARG 68 4.687 13.430 -15.681 516 HG2 ARG 68 HG2 ARG 68 2.913 14.480 -14.229 517 HG3 ARG 68 HG3 ARG 68 3.088 13.101 -13.145 518 HD2 ARG 68 HD2 ARG 68 5.433 13.700 -12.762 519 HD3 ARG 68 HD3 ARG 68 5.179 15.158 -13.768 520 HE ARG 68 HE ARG 68 3.074 14.890 -11.825 521 HH11 ARG 68 HH21 ARG 68 6.483 15.849 -11.970 522 HH12 ARG 68 HH22 ARG 68 6.349 16.868 -10.565 523 HH21 ARG 68 HH11 ARG 68 2.987 16.186 -10.071 524 HH22 ARG 68 HH12 ARG 68 4.388 17.057 -9.499 525 H LYS 69 H LYS 69 4.933 11.098 -16.187 526 HA LYS 69 HA LYS 69 4.174 10.121 -18.895 527 HB2 LYS 69 HB2 LYS 69 6.532 11.993 -18.424 528 HB3 LYS 69 HB3 LYS 69 6.138 11.203 -19.953 529 HG2 LYS 69 HG2 LYS 69 3.990 12.458 -20.026 530 HG3 LYS 69 HG3 LYS 69 4.459 13.303 -18.541 531 HD2 LYS 69 HD2 LYS 69 6.460 14.189 -19.691 532 HD3 LYS 69 HD3 LYS 69 5.924 13.396 -21.193 533 HE2 LYS 69 HE2 LYS 69 3.807 14.688 -21.112 534 HE3 LYS 69 HE3 LYS 69 4.343 15.475 -19.615 535 HZ1 LYS 69 HZ1 LYS 69 4.747 16.875 -21.535 536 HZ2 LYS 69 HZ2 LYS 69 5.678 15.717 -22.249 537 HZ3 LYS 69 HZ3 LYS 69 6.187 16.442 -20.857 538 H ALA 70 H ALA 70 5.128 8.884 -16.258 539 HA ALA 70 HA ALA 70 7.838 8.002 -16.927 540 HB1 ALA 70 HB1 ALA 70 7.119 8.519 -14.599 541 HB2 ALA 70 HB2 ALA 70 5.995 7.140 -14.667 542 HB3 ALA 70 HB3 ALA 70 7.751 6.867 -14.770 543 H TRP 71 H TRP 71 6.056 7.150 -18.959 544 HA TRP 71 HA TRP 71 4.753 4.750 -18.694 545 HB2 TRP 71 HB2 TRP 71 6.342 4.862 -21.169 546 HB3 TRP 71 HB3 TRP 71 4.613 4.697 -20.921 547 HD1 TRP 71 HD1 TRP 71 7.174 7.159 -22.008 548 HE1 TRP 71 HE1 TRP 71 6.186 9.462 -22.412 549 HE3 TRP 71 HE3 TRP 71 2.673 6.407 -19.693 550 HZ2 TRP 71 HZ2 TRP 71 3.714 10.792 -21.897 551 HZ3 TRP 71 HZ3 TRP 71 1.013 8.275 -19.675 552 HH2 TRP 71 HH2 TRP 71 1.537 10.445 -20.785 553 HA PRO 72 HA PRO 72 8.187 1.836 -19.520 554 HB2 PRO 72 HB2 PRO 72 10.830 2.395 -19.581 555 HB3 PRO 72 HB3 PRO 72 9.769 2.726 -20.989 556 HG2 PRO 72 HG2 PRO 72 10.679 4.617 -18.827 557 HG3 PRO 72 HG3 PRO 72 10.779 4.812 -20.606 558 HD2 PRO 72 HD2 PRO 72 8.759 5.887 -19.143 559 HD3 PRO 72 HD3 PRO 72 8.496 5.256 -20.804 560 H SER 73 H SER 73 8.751 4.225 -17.030 561 HA SER 73 HA SER 73 10.320 2.354 -15.381 562 HB2 SER 73 HB2 SER 73 9.264 5.117 -14.694 563 HB3 SER 73 HB3 SER 73 10.570 4.230 -13.876 564 HG SER 73 HG SER 73 11.833 4.467 -15.695 565 H LEU 74 H LEU 74 7.115 3.862 -15.481 566 HA LEU 74 HA LEU 74 6.244 3.154 -12.883 567 HB2 LEU 74 HB2 LEU 74 5.204 4.805 -14.388 568 HB3 LEU 74 HB3 LEU 74 4.711 3.519 -15.478 569 HG LEU 74 HG LEU 74 3.119 2.671 -13.830 570 HD11 LEU 74 HD11 LEU 74 3.980 5.033 -12.104 571 HD12 LEU 74 HD12 LEU 74 4.342 3.327 -11.758 572 HD13 LEU 74 HD13 LEU 74 2.666 3.885 -11.761 573 HD21 LEU 74 HD21 LEU 74 2.924 5.688 -14.217 574 HD22 LEU 74 HD22 LEU 74 1.581 4.548 -13.990 575 HD23 LEU 74 HD23 LEU 74 2.557 4.475 -15.460 576 H GLN 75 H GLN 75 6.065 1.375 -15.966 577 HA GLN 75 HA GLN 75 4.366 -0.706 -15.069 578 HB2 GLN 75 HB2 GLN 75 5.301 -2.011 -16.929 579 HB3 GLN 75 HB3 GLN 75 4.840 -0.379 -17.414 580 HG2 GLN 75 HG2 GLN 75 7.181 0.313 -17.390 581 HG3 GLN 75 HG3 GLN 75 7.666 -1.302 -16.852 582 HE21 GLN 75 HE21 GLN 75 7.748 -2.982 -18.299 583 HE22 GLN 75 HE22 GLN 75 7.546 -2.756 -20.017 584 H ASN 76 H ASN 76 7.766 -0.129 -14.405 585 HA ASN 76 HA ASN 76 8.044 -2.867 -13.280 586 HB2 ASN 76 HB2 ASN 76 9.904 -1.957 -14.630 587 HB3 ASN 76 HB3 ASN 76 10.039 -0.581 -13.523 588 HD21 ASN 76 HD21 ASN 76 11.788 -0.792 -12.314 589 HD22 ASN 76 HD22 ASN 76 12.318 -2.276 -11.559 590 H ASP 77 H ASP 77 8.413 0.574 -12.271 591 HA ASP 77 HA ASP 77 9.100 -0.060 -9.605 592 HB2 ASP 77 HB2 ASP 77 9.431 2.096 -10.917 593 HB3 ASP 77 HB3 ASP 77 7.748 2.489 -10.514 594 H LEU 78 H LEU 78 5.885 0.595 -11.022 595 HA LEU 78 HA LEU 78 4.537 0.740 -8.481 596 HB2 LEU 78 HB2 LEU 78 3.660 1.514 -10.702 597 HB3 LEU 78 HB3 LEU 78 3.465 -0.166 -11.173 598 HG LEU 78 HG LEU 78 1.797 -0.466 -9.359 599 HD11 LEU 78 HD11 LEU 78 2.493 1.264 -7.775 600 HD12 LEU 78 HD12 LEU 78 0.835 1.592 -8.310 601 HD13 LEU 78 HD13 LEU 78 2.183 2.531 -8.982 602 HD21 LEU 78 HD21 LEU 78 1.223 0.194 -11.717 603 HD22 LEU 78 HD22 LEU 78 1.186 1.886 -11.178 604 HD23 LEU 78 HD23 LEU 78 0.036 0.711 -10.507 605 H ARG 79 H ARG 79 5.420 -1.883 -10.704 606 HA ARG 79 HA ARG 79 3.995 -3.919 -9.196 607 HB2 ARG 79 HB2 ARG 79 6.125 -4.060 -11.353 608 HB3 ARG 79 HB3 ARG 79 5.461 -5.489 -10.555 609 HG2 ARG 79 HG2 ARG 79 3.161 -4.781 -11.292 610 HG3 ARG 79 HG3 ARG 79 3.912 -3.485 -12.247 611 HD2 ARG 79 HD2 ARG 79 5.172 -5.152 -13.553 612 HD3 ARG 79 HD3 ARG 79 4.558 -6.452 -12.526 613 HE ARG 79 HE ARG 79 2.472 -6.368 -13.600 614 HH11 ARG 79 HH11 ARG 79 4.551 -3.809 -14.894 615 HH12 ARG 79 HH12 ARG 79 3.533 -3.599 -16.310 616 HH21 ARG 79 HH21 ARG 79 1.235 -6.033 -15.416 617 HH22 ARG 79 HH22 ARG 79 1.692 -4.797 -16.576 618 H LEU 80 H LEU 80 7.134 -2.350 -8.847 619 HA LEU 80 HA LEU 80 8.247 -4.458 -7.181 620 HB2 LEU 80 HB2 LEU 80 8.881 -1.493 -7.348 621 HB3 LEU 80 HB3 LEU 80 9.739 -2.624 -6.316 622 HG LEU 80 HG LEU 80 9.685 -2.741 -9.341 623 HD11 LEU 80 HD11 LEU 80 11.868 -1.874 -7.415 624 HD12 LEU 80 HD12 LEU 80 10.900 -0.786 -8.442 625 HD13 LEU 80 HD13 LEU 80 12.001 -1.966 -9.184 626 HD21 LEU 80 HD21 LEU 80 11.250 -4.367 -7.301 627 HD22 LEU 80 HD22 LEU 80 11.539 -4.371 -9.058 628 HD23 LEU 80 HD23 LEU 80 10.003 -4.975 -8.418 629 H ARG 81 H ARG 81 6.342 -1.462 -6.532 630 HA ARG 81 HA ARG 81 6.380 -1.831 -3.649 631 HB2 ARG 81 HB2 ARG 81 4.217 -0.528 -5.350 632 HB3 ARG 81 HB3 ARG 81 4.409 -0.368 -3.604 633 HG2 ARG 81 HG2 ARG 81 6.230 0.721 -5.756 634 HG3 ARG 81 HG3 ARG 81 5.157 1.622 -4.691 635 HD2 ARG 81 HD2 ARG 81 6.990 1.971 -3.429 636 HD3 ARG 81 HD3 ARG 81 6.734 0.316 -2.852 637 HE ARG 81 HE ARG 81 8.633 -0.338 -3.990 638 HH11 ARG 81 HH21 ARG 81 7.624 2.764 -5.335 639 HH12 ARG 81 HH22 ARG 81 8.982 2.843 -6.431 640 HH21 ARG 81 HH11 ARG 81 10.386 -0.120 -5.366 641 HH22 ARG 81 HH12 ARG 81 10.491 1.259 -6.443 642 H ALA 82 H ALA 82 4.289 -2.942 -6.291 643 HA ALA 82 HA ALA 82 2.344 -4.209 -4.651 644 HB1 ALA 82 HB1 ALA 82 3.255 -5.244 -7.357 645 HB2 ALA 82 HB2 ALA 82 1.634 -5.307 -6.632 646 HB3 ALA 82 HB3 ALA 82 2.295 -3.758 -7.186 647 H SER 83 H SER 83 5.495 -5.382 -5.949 648 HA SER 83 HA SER 83 5.193 -8.055 -4.997 649 HB2 SER 83 HB2 SER 83 7.726 -6.428 -5.421 650 HB3 SER 83 HB3 SER 83 7.650 -8.192 -5.216 651 HG SER 83 HG SER 83 6.535 -6.620 -7.318 652 H TYR 84 H TYR 84 6.501 -5.109 -3.456 653 HA TYR 84 HA TYR 84 7.479 -6.339 -1.087 654 HB2 TYR 84 HB2 TYR 84 7.923 -4.006 -1.801 655 HB3 TYR 84 HB3 TYR 84 6.243 -3.588 -1.486 656 HD1 TYR 84 HD1 TYR 84 8.934 -5.399 0.472 657 HD2 TYR 84 HD2 TYR 84 5.997 -2.250 0.393 658 HE1 TYR 84 HE1 TYR 84 9.510 -4.791 2.825 659 HE2 TYR 84 HE2 TYR 84 6.598 -1.639 2.736 660 HH TYR 84 HH TYR 84 9.092 -3.399 4.583 661 H LEU 85 H LEU 85 4.229 -5.025 -1.887 662 HA LEU 85 HA LEU 85 3.019 -5.746 0.612 663 HB2 LEU 85 HB2 LEU 85 1.937 -4.191 -0.924 664 HB3 LEU 85 HB3 LEU 85 1.868 -5.427 -2.176 665 HG LEU 85 HG LEU 85 0.271 -6.740 -0.835 666 HD11 LEU 85 HD11 LEU 85 -0.848 -5.568 1.105 667 HD12 LEU 85 HD12 LEU 85 0.500 -4.419 1.104 668 HD13 LEU 85 HD13 LEU 85 0.798 -6.140 1.425 669 HD21 LEU 85 HD21 LEU 85 -0.551 -3.852 -1.267 670 HD22 LEU 85 HD22 LEU 85 -1.647 -5.246 -1.138 671 HD23 LEU 85 HD23 LEU 85 -0.518 -5.125 -2.503 672 H ARG 86 H ARG 86 3.412 -7.485 -2.458 673 HA ARG 86 HA ARG 86 1.684 -9.645 -1.884 674 HB2 ARG 86 HB2 ARG 86 2.919 -9.057 -4.082 675 HB3 ARG 86 HB3 ARG 86 4.286 -9.940 -3.419 676 HG2 ARG 86 HG2 ARG 86 3.154 -11.447 -4.852 677 HG3 ARG 86 HG3 ARG 86 2.731 -11.964 -3.210 678 HD2 ARG 86 HD2 ARG 86 0.523 -11.182 -3.403 679 HD3 ARG 86 HD3 ARG 86 0.951 -10.024 -4.661 680 HE ARG 86 HE ARG 86 1.272 -12.802 -5.462 681 HH11 ARG 86 HH11 ARG 86 -0.955 -10.053 -5.413 682 HH12 ARG 86 HH12 ARG 86 -1.930 -10.707 -6.697 683 HH21 ARG 86 HH21 ARG 86 -0.026 -13.559 -7.110 684 HH22 ARG 86 HH22 ARG 86 -1.408 -12.641 -7.640 685 H TYR 87 H TYR 87 5.156 -9.254 -1.060 686 HA TYR 87 HA TYR 87 5.446 -11.927 -0.079 687 HB2 TYR 87 HB2 TYR 87 6.917 -9.424 0.820 688 HB3 TYR 87 HB3 TYR 87 7.444 -11.093 1.061 689 HD1 TYR 87 HD2 TYR 87 7.007 -12.339 -1.602 690 HD2 TYR 87 HD1 TYR 87 8.486 -8.419 -0.607 691 HE1 TYR 87 HE2 TYR 87 8.213 -12.231 -3.782 692 HE2 TYR 87 HE1 TYR 87 9.692 -8.329 -2.791 693 HH TYR 87 HH TYR 87 9.569 -10.994 -5.151 694 H ASP 88 H ASP 88 4.589 -8.860 1.594 695 HA ASP 88 HA ASP 88 4.549 -10.133 4.171 696 HB2 ASP 88 HB2 ASP 88 4.787 -7.614 3.474 697 HB3 ASP 88 HB3 ASP 88 3.017 -7.610 3.534 698 H LEU 89 H LEU 89 1.993 -9.264 1.812 699 HA LEU 89 HA LEU 89 -0.206 -10.105 3.445 700 HB2 LEU 89 HB2 LEU 89 0.099 -8.913 1.002 701 HB3 LEU 89 HB3 LEU 89 -0.354 -10.523 0.490 702 HG LEU 89 HG LEU 89 -2.242 -9.016 0.482 703 HD11 LEU 89 HD11 LEU 89 -2.599 -10.924 2.804 704 HD12 LEU 89 HD12 LEU 89 -2.625 -11.399 1.089 705 HD13 LEU 89 HD13 LEU 89 -3.851 -10.282 1.716 706 HD21 LEU 89 HD21 LEU 89 -3.129 -7.993 2.508 707 HD22 LEU 89 HD22 LEU 89 -1.465 -7.457 2.220 708 HD23 LEU 89 HD23 LEU 89 -1.802 -8.673 3.469 709 H LYS 90 H LYS 90 1.995 -11.878 1.303 710 HA LYS 90 HA LYS 90 0.516 -14.331 1.287 711 HB2 LYS 90 HB2 LYS 90 3.327 -13.482 0.750 712 HB3 LYS 90 HB3 LYS 90 3.105 -15.170 1.151 713 HG2 LYS 90 HG2 LYS 90 1.650 -13.718 -1.098 714 HG3 LYS 90 HG3 LYS 90 3.100 -14.703 -1.304 715 HD2 LYS 90 HD2 LYS 90 0.359 -15.678 -0.374 716 HD3 LYS 90 HD3 LYS 90 1.120 -15.989 -1.938 717 HE2 LYS 90 HE2 LYS 90 2.040 -17.017 0.785 718 HE3 LYS 90 HE3 LYS 90 1.316 -17.970 -0.521 719 HZ1 LYS 90 HZ1 LYS 90 3.718 -18.223 -0.458 720 HZ2 LYS 90 HZ2 LYS 90 3.949 -16.601 -0.651 721 HZ3 LYS 90 HZ3 LYS 90 3.279 -17.490 -1.870 722 H THR 91 H THR 91 2.572 -12.797 3.679 723 HA THR 91 HA THR 91 2.948 -15.222 5.261 724 HB THR 91 HB THR 91 3.341 -12.298 6.062 725 HG1 THR 91 HG1 THR 91 4.747 -12.538 4.444 726 HG21 THR 91 HG21 THR 91 3.359 -13.788 7.975 727 HG22 THR 91 HG22 THR 91 5.013 -13.263 7.612 728 HG23 THR 91 HG23 THR 91 4.481 -14.895 7.145 729 H VAL 92 H VAL 92 0.796 -12.323 5.294 730 HA VAL 92 HA VAL 92 -0.477 -12.971 7.773 731 HB VAL 92 HB VAL 92 -1.676 -11.513 5.358 732 HG11 VAL 92 HG11 VAL 92 -3.433 -12.139 6.939 733 HG12 VAL 92 HG12 VAL 92 -2.464 -11.548 8.311 734 HG13 VAL 92 HG13 VAL 92 -3.110 -10.407 7.114 735 HG21 VAL 92 HG21 VAL 92 0.429 -10.473 6.109 736 HG22 VAL 92 HG22 VAL 92 -0.958 -9.456 6.498 737 HG23 VAL 92 HG23 VAL 92 -0.184 -10.428 7.769 738 H ILE 93 H ILE 93 -1.388 -13.809 4.379 739 HA ILE 93 HA ILE 93 -3.819 -15.115 5.189 740 HB ILE 93 HB ILE 93 -3.853 -16.136 2.959 741 HG12 ILE 93 HG12 ILE 93 -1.835 -14.884 1.524 742 HG13 ILE 93 HG13 ILE 93 -1.012 -15.429 2.977 743 HG21 ILE 93 HG21 ILE 93 -4.701 -13.854 3.321 744 HG22 ILE 93 HG22 ILE 93 -3.099 -13.196 2.926 745 HG23 ILE 93 HG23 ILE 93 -4.042 -14.050 1.683 746 HD11 ILE 93 HD11 ILE 93 -2.605 -17.172 1.063 747 HD12 ILE 93 HD12 ILE 93 -0.836 -17.117 1.231 748 HD13 ILE 93 HD13 ILE 93 -1.829 -17.747 2.560 749 H SER 94 H SER 94 -0.567 -16.157 5.433 750 HA SER 94 HA SER 94 -1.078 -18.995 5.243 751 HB2 SER 94 HB2 SER 94 1.186 -17.898 5.069 752 HB3 SER 94 HB3 SER 94 1.119 -17.608 6.821 753 HG SER 94 HG SER 94 0.759 -19.946 6.997 754 H ALA 95 H ALA 95 -1.570 -16.573 7.739 755 HA ALA 95 HA ALA 95 -1.956 -18.653 9.818 756 HB1 ALA 95 HB1 ALA 95 -2.286 -16.700 11.315 757 HB2 ALA 95 HB2 ALA 95 -0.746 -16.620 10.433 758 HB3 ALA 95 HB3 ALA 95 -2.118 -15.610 9.916 759 H LYS 96 H LYS 96 -3.804 -16.805 7.541 760 HA LYS 96 HA LYS 96 -6.294 -16.767 9.033 761 HB2 LYS 96 HB2 LYS 96 -5.631 -16.447 6.084 762 HB3 LYS 96 HB3 LYS 96 -7.260 -16.268 6.729 763 HG2 LYS 96 HG2 LYS 96 -5.015 -14.584 7.865 764 HG3 LYS 96 HG3 LYS 96 -5.753 -14.149 6.319 765 HD2 LYS 96 HD2 LYS 96 -7.997 -14.122 7.416 766 HD3 LYS 96 HD3 LYS 96 -7.219 -14.432 8.979 767 HE2 LYS 96 HE2 LYS 96 -6.103 -12.305 8.951 768 HE3 LYS 96 HE3 LYS 96 -6.427 -12.081 7.226 769 HZ1 LYS 96 HZ1 LYS 96 -7.935 -10.701 8.420 770 HZ2 LYS 96 HZ2 LYS 96 -8.425 -11.928 9.410 771 HZ3 LYS 96 HZ3 LYS 96 -8.834 -11.945 7.809 772 HA PRO 97 HA PRO 97 -7.422 -20.961 8.203 773 HB2 PRO 97 HB2 PRO 97 -10.166 -20.873 8.095 774 HB3 PRO 97 HB3 PRO 97 -9.253 -20.705 9.631 775 HG2 PRO 97 HG2 PRO 97 -10.361 -18.564 7.853 776 HG3 PRO 97 HG3 PRO 97 -10.558 -18.778 9.620 777 HD2 PRO 97 HD2 PRO 97 -8.714 -17.083 8.628 778 HD3 PRO 97 HD3 PRO 97 -8.345 -18.100 10.066 779 H LYS 98 H LYS 98 -8.406 -22.315 6.479 780 HA LYS 98 HA LYS 98 -7.469 -21.555 4.001 781 HB2 LYS 98 HB2 LYS 98 -9.728 -23.489 4.599 782 HB3 LYS 98 HB3 LYS 98 -8.867 -23.410 3.061 783 HG2 LYS 98 HG2 LYS 98 -7.506 -24.023 5.722 784 HG3 LYS 98 HG3 LYS 98 -8.142 -25.260 4.630 785 HD2 LYS 98 HD2 LYS 98 -6.628 -24.476 2.833 786 HD3 LYS 98 HD3 LYS 98 -5.976 -23.238 3.924 787 HE2 LYS 98 HE2 LYS 98 -4.439 -25.107 3.903 788 HE3 LYS 98 HE3 LYS 98 -5.229 -25.042 5.486 789 HZ1 LYS 98 HZ1 LYS 98 -5.111 -27.304 4.650 790 HZ2 LYS 98 HZ2 LYS 98 -5.951 -26.903 3.286 791 HZ3 LYS 98 HZ3 LYS 98 -6.690 -26.844 4.761 792 H ASP 99 H ASP 99 -10.812 -21.018 5.115 793 HA ASP 99 HA ASP 99 -11.813 -20.165 2.557 794 HB2 ASP 99 HB2 ASP 99 -13.277 -20.893 4.377 795 HB3 ASP 99 HB3 ASP 99 -12.725 -19.543 5.383 796 H GLU 100 H GLU 100 -10.966 -18.218 5.478 797 HA GLU 100 HA GLU 100 -11.227 -15.691 4.226 798 HB2 GLU 100 HB2 GLU 100 -10.035 -16.790 6.687 799 HB3 GLU 100 HB3 GLU 100 -9.247 -15.328 6.106 800 HG2 GLU 100 HG2 GLU 100 -12.218 -15.575 6.579 801 HG3 GLU 100 HG3 GLU 100 -11.061 -14.927 7.759 802 H LYS 101 H LYS 101 -8.510 -17.947 4.436 803 HA LYS 101 HA LYS 101 -6.463 -16.289 3.349 804 HB2 LYS 101 HB2 LYS 101 -6.001 -18.467 4.338 805 HB3 LYS 101 HB3 LYS 101 -7.021 -19.269 3.158 806 HG2 LYS 101 HG2 LYS 101 -5.045 -17.908 1.638 807 HG3 LYS 101 HG3 LYS 101 -4.209 -18.633 3.011 808 HD2 LYS 101 HD2 LYS 101 -4.172 -20.266 1.286 809 HD3 LYS 101 HD3 LYS 101 -5.380 -20.815 2.464 810 HE2 LYS 101 HE2 LYS 101 -7.182 -19.870 1.035 811 HE3 LYS 101 HE3 LYS 101 -5.966 -19.333 -0.137 812 HZ1 LYS 101 HZ1 LYS 101 -6.535 -22.139 0.614 813 HZ2 LYS 101 HZ2 LYS 101 -5.378 -21.667 -0.464 814 HZ3 LYS 101 HZ3 LYS 101 -6.974 -21.412 -0.795 815 H LYS 102 H LYS 102 -9.046 -18.236 1.763 816 HA LYS 102 HA LYS 102 -8.016 -17.694 -0.901 817 HB2 LYS 102 HB2 LYS 102 -9.863 -19.436 0.206 818 HB3 LYS 102 HB3 LYS 102 -10.902 -18.289 -0.633 819 HG2 LYS 102 HG2 LYS 102 -8.579 -19.766 -1.938 820 HG3 LYS 102 HG3 LYS 102 -10.258 -20.328 -1.954 821 HD2 LYS 102 HD2 LYS 102 -10.917 -18.173 -3.065 822 HD3 LYS 102 HD3 LYS 102 -9.191 -17.767 -3.197 823 HE2 LYS 102 HE2 LYS 102 -8.804 -19.828 -4.517 824 HE3 LYS 102 HE3 LYS 102 -10.517 -20.262 -4.361 825 HZ1 LYS 102 HZ1 LYS 102 -10.061 -19.223 -6.491 826 HZ2 LYS 102 HZ2 LYS 102 -9.464 -17.864 -5.763 827 HZ3 LYS 102 HZ3 LYS 102 -11.063 -18.252 -5.610 828 H SER 103 H SER 103 -10.621 -16.340 1.158 829 HA SER 103 HA SER 103 -11.641 -14.492 -0.715 830 HB2 SER 103 HB2 SER 103 -12.646 -15.062 1.490 831 HB3 SER 103 HB3 SER 103 -11.368 -14.137 2.299 832 HG SER 103 HG SER 103 -13.611 -13.196 1.540 833 H LEU 104 H LEU 104 -9.028 -13.988 1.728 834 HA LEU 104 HA LEU 104 -8.451 -11.311 0.881 835 HB2 LEU 104 HB2 LEU 104 -7.192 -13.382 2.574 836 HB3 LEU 104 HB3 LEU 104 -6.056 -12.258 1.835 837 HG LEU 104 HG LEU 104 -8.460 -11.342 3.433 838 HD11 LEU 104 HD11 LEU 104 -6.908 -11.001 5.296 839 HD12 LEU 104 HD12 LEU 104 -5.598 -11.759 4.358 840 HD13 LEU 104 HD13 LEU 104 -7.023 -12.714 4.845 841 HD21 LEU 104 HD21 LEU 104 -5.897 -9.957 2.533 842 HD22 LEU 104 HD22 LEU 104 -7.093 -9.247 3.634 843 HD23 LEU 104 HD23 LEU 104 -7.545 -9.615 1.959 844 H GLN 105 H GLN 105 -7.119 -14.478 -0.170 845 HA GLN 105 HA GLN 105 -5.027 -13.377 -1.778 846 HB2 GLN 105 HB2 GLN 105 -6.557 -15.972 -1.831 847 HB3 GLN 105 HB3 GLN 105 -5.411 -15.587 -3.114 848 HG2 GLN 105 HG2 GLN 105 -4.479 -15.342 -0.274 849 HG3 GLN 105 HG3 GLN 105 -4.690 -16.957 -0.957 850 HE21 GLN 105 HE21 GLN 105 -3.526 -17.494 -2.918 851 HE22 GLN 105 HE22 GLN 105 -1.988 -16.728 -3.219 852 H GLU 106 H GLU 106 -8.510 -13.935 -2.504 853 HA GLU 106 HA GLU 106 -8.149 -13.365 -5.313 854 HB2 GLU 106 HB2 GLU 106 -10.615 -13.187 -3.554 855 HB3 GLU 106 HB3 GLU 106 -10.611 -12.942 -5.304 856 HG2 GLU 106 HG2 GLU 106 -9.922 -15.477 -3.814 857 HG3 GLU 106 HG3 GLU 106 -11.308 -15.198 -4.866 858 H LEU 107 H LEU 107 -8.994 -11.279 -2.488 859 HA LEU 107 HA LEU 107 -9.300 -8.925 -4.144 860 HB2 LEU 107 HB2 LEU 107 -8.542 -9.219 -1.216 861 HB3 LEU 107 HB3 LEU 107 -8.804 -7.681 -2.026 862 HG LEU 107 HG LEU 107 -10.867 -9.780 -1.378 863 HD11 LEU 107 HD11 LEU 107 -11.801 -7.962 -0.044 864 HD12 LEU 107 HD12 LEU 107 -10.587 -6.829 -0.673 865 HD13 LEU 107 HD13 LEU 107 -10.087 -8.173 0.374 866 HD21 LEU 107 HD21 LEU 107 -12.537 -8.218 -2.390 867 HD22 LEU 107 HD22 LEU 107 -11.469 -8.951 -3.601 868 HD23 LEU 107 HD23 LEU 107 -11.205 -7.265 -3.079 869 H THR 108 H THR 108 -6.538 -10.464 -2.524 870 HA THR 108 HA THR 108 -4.592 -8.446 -3.108 871 HB THR 108 HB THR 108 -4.160 -11.479 -2.910 872 HG1 THR 108 HG1 THR 108 -5.241 -10.693 -1.077 873 HG21 THR 108 HG21 THR 108 -2.153 -10.254 -3.674 874 HG22 THR 108 HG22 THR 108 -1.940 -10.881 -2.022 875 HG23 THR 108 HG23 THR 108 -2.296 -9.153 -2.288 876 H SER 109 H SER 109 -5.926 -11.157 -5.023 877 HA SER 109 HA SER 109 -4.070 -10.799 -7.215 878 HB2 SER 109 HB2 SER 109 -5.389 -12.890 -6.708 879 HB3 SER 109 HB3 SER 109 -6.843 -12.045 -7.274 880 HG SER 109 HG SER 109 -5.998 -13.174 -8.989 881 H LYS 110 H LYS 110 -7.414 -9.645 -6.551 882 HA LYS 110 HA LYS 110 -7.783 -8.367 -9.096 883 HB2 LYS 110 HB2 LYS 110 -8.987 -7.860 -6.357 884 HB3 LYS 110 HB3 LYS 110 -9.500 -6.990 -7.803 885 HG2 LYS 110 HG2 LYS 110 -9.641 -10.013 -7.507 886 HG3 LYS 110 HG3 LYS 110 -10.980 -8.903 -7.170 887 HD2 LYS 110 HD2 LYS 110 -10.838 -8.071 -9.518 888 HD3 LYS 110 HD3 LYS 110 -9.583 -9.287 -9.843 889 HE2 LYS 110 HE2 LYS 110 -11.163 -11.083 -9.204 890 HE3 LYS 110 HE3 LYS 110 -12.420 -9.861 -8.918 891 HZ1 LYS 110 HZ1 LYS 110 -12.265 -9.234 -11.243 892 HZ2 LYS 110 HZ2 LYS 110 -12.607 -10.843 -11.122 893 HZ3 LYS 110 HZ3 LYS 110 -11.084 -10.349 -11.517 894 H LEU 111 H LEU 111 -6.357 -7.216 -6.057 895 HA LEU 111 HA LEU 111 -6.134 -4.478 -6.741 896 HB2 LEU 111 HB2 LEU 111 -5.719 -5.663 -4.551 897 HB3 LEU 111 HB3 LEU 111 -4.171 -6.186 -5.167 898 HG LEU 111 HG LEU 111 -4.915 -3.272 -4.786 899 HD11 LEU 111 HD11 LEU 111 -3.610 -5.275 -2.897 900 HD12 LEU 111 HD12 LEU 111 -5.157 -4.419 -2.669 901 HD13 LEU 111 HD13 LEU 111 -3.631 -3.519 -2.638 902 HD21 LEU 111 HD21 LEU 111 -2.456 -2.961 -4.629 903 HD22 LEU 111 HD22 LEU 111 -2.961 -3.550 -6.215 904 HD23 LEU 111 HD23 LEU 111 -2.225 -4.672 -5.052 905 H PHE 112 H PHE 112 -4.021 -7.256 -7.443 906 HA PHE 112 HA PHE 112 -2.022 -5.640 -8.787 907 HB2 PHE 112 HB2 PHE 112 -2.558 -8.614 -8.595 908 HB3 PHE 112 HB3 PHE 112 -1.275 -7.956 -9.616 909 HD1 PHE 112 HD1 PHE 112 -2.416 -7.054 -6.104 910 HD2 PHE 112 HD2 PHE 112 0.795 -8.388 -8.642 911 HE1 PHE 112 HE1 PHE 112 -0.909 -7.006 -4.179 912 HE2 PHE 112 HE2 PHE 112 2.330 -8.333 -6.676 913 HZ PHE 112 HZ PHE 112 1.438 -7.654 -4.439 914 H SER 113 H SER 113 -5.031 -7.173 -9.736 915 HA SER 113 HA SER 113 -4.478 -7.162 -12.581 916 HB2 SER 113 HB2 SER 113 -7.161 -6.980 -11.153 917 HB3 SER 113 HB3 SER 113 -6.893 -7.438 -12.843 918 HG SER 113 HG SER 113 -5.731 -8.849 -10.658 919 H SER 114 H SER 114 -5.836 -4.820 -10.235 920 HA SER 114 HA SER 114 -6.558 -2.863 -12.224 921 HB2 SER 114 HB2 SER 114 -5.780 -2.444 -9.309 922 HB3 SER 114 HB3 SER 114 -6.683 -1.307 -10.334 923 HG SER 114 HG SER 114 -7.985 -2.689 -8.930 924 H ILE 115 H ILE 115 -3.602 -3.583 -10.407 925 HA ILE 115 HA ILE 115 -2.088 -1.308 -11.315 926 HB ILE 115 HB ILE 115 -1.343 -4.037 -10.196 927 HG12 ILE 115 HG12 ILE 115 -0.978 -1.205 -9.151 928 HG13 ILE 115 HG13 ILE 115 -2.337 -2.253 -8.751 929 HG21 ILE 115 HG21 ILE 115 0.490 -3.548 -11.735 930 HG22 ILE 115 HG22 ILE 115 0.592 -1.879 -11.147 931 HG23 ILE 115 HG23 ILE 115 1.054 -3.224 -10.088 932 HD11 ILE 115 HD11 ILE 115 -0.826 -2.348 -6.920 933 HD12 ILE 115 HD12 ILE 115 -0.667 -3.900 -7.773 934 HD13 ILE 115 HD13 ILE 115 0.565 -2.629 -7.981 935 H ASP 116 H ASP 116 -2.675 -4.578 -12.666 936 HA ASP 116 HA ASP 116 -0.767 -4.286 -14.786 937 HB2 ASP 116 HB2 ASP 116 -2.137 -6.362 -13.842 938 HB3 ASP 116 HB3 ASP 116 -3.237 -5.940 -15.163 939 H ASN 117 H ASN 117 -4.240 -3.480 -14.520 940 HA ASN 117 HA ASN 117 -4.559 -2.671 -17.265 941 HB2 ASN 117 HB2 ASN 117 -5.971 -1.772 -14.720 942 HB3 ASN 117 HB3 ASN 117 -6.442 -1.263 -16.343 943 HD21 ASN 117 HD21 ASN 117 -7.729 -2.943 -14.173 944 HD22 ASN 117 HD22 ASN 117 -8.259 -4.362 -15.038 945 H LEU 118 H LEU 118 -3.454 -1.022 -14.323 946 HA LEU 118 HA LEU 118 -3.337 1.618 -15.414 947 HB2 LEU 118 HB2 LEU 118 -3.240 0.709 -12.997 948 HB3 LEU 118 HB3 LEU 118 -1.520 0.505 -13.260 949 HG LEU 118 HG LEU 118 -2.925 3.161 -13.579 950 HD11 LEU 118 HD11 LEU 118 -2.365 3.627 -11.278 951 HD12 LEU 118 HD12 LEU 118 -1.591 2.046 -11.091 952 HD13 LEU 118 HD13 LEU 118 -3.345 2.157 -11.340 953 HD21 LEU 118 HD21 LEU 118 -0.028 2.384 -13.103 954 HD22 LEU 118 HD22 LEU 118 -0.657 4.044 -13.000 955 HD23 LEU 118 HD23 LEU 118 -0.714 3.175 -14.537 956 H ASP 119 H ASP 119 -0.989 -1.052 -15.196 957 HA ASP 119 HA ASP 119 1.239 0.308 -16.357 958 HB2 ASP 119 HB2 ASP 119 1.925 -1.671 -15.462 959 HB3 ASP 119 HB3 ASP 119 0.386 -2.474 -15.794 960 H HIS 120 H HIS 120 -1.465 -1.551 -17.858 961 HA HIS 120 HA HIS 120 -0.416 -1.209 -20.517 962 HB2 HIS 120 HB2 HIS 120 -3.123 -1.919 -19.425 963 HB3 HIS 120 HB3 HIS 120 -2.863 -1.646 -21.154 964 HD1 HIS 120 HD1 HIS 120 -1.844 -4.057 -18.369 965 HD2 HIS 120 HD2 HIS 120 -1.505 -3.606 -22.514 966 HE1 HIS 120 HE1 HIS 120 -0.937 -6.230 -19.281 967 H ALA 121 H ALA 121 -2.609 0.791 -18.533 968 HA ALA 121 HA ALA 121 -3.221 2.647 -20.629 969 HB1 ALA 121 HB1 ALA 121 -3.819 4.181 -18.802 970 HB2 ALA 121 HB2 ALA 121 -4.455 2.549 -18.500 971 HB3 ALA 121 HB3 ALA 121 -3.012 3.115 -17.628 972 H ALA 122 H ALA 122 -0.494 2.384 -18.341 973 HA ALA 122 HA ALA 122 0.704 4.897 -19.059 974 HB1 ALA 122 HB1 ALA 122 1.230 3.547 -17.013 975 HB2 ALA 122 HB2 ALA 122 2.070 2.372 -18.052 976 HB3 ALA 122 HB3 ALA 122 2.674 4.039 -17.932 977 H LYS 123 H LYS 123 1.183 1.536 -20.257 978 HA LYS 123 HA LYS 123 3.320 2.245 -22.042 979 HB2 LYS 123 HB2 LYS 123 1.338 -0.056 -22.053 980 HB3 LYS 123 HB3 LYS 123 2.686 0.066 -23.191 981 HG2 LYS 123 HG2 LYS 123 4.306 0.022 -21.344 982 HG3 LYS 123 HG3 LYS 123 2.998 -0.041 -20.163 983 HD2 LYS 123 HD2 LYS 123 3.595 -2.191 -22.246 984 HD3 LYS 123 HD3 LYS 123 4.006 -2.258 -20.521 985 HE2 LYS 123 HE2 LYS 123 1.507 -1.923 -20.066 986 HE3 LYS 123 HE3 LYS 123 1.243 -2.272 -21.777 987 HZ1 LYS 123 HZ1 LYS 123 2.278 -4.055 -19.680 988 HZ2 LYS 123 HZ2 LYS 123 2.462 -4.419 -21.287 989 HZ3 LYS 123 HZ3 LYS 123 0.952 -4.267 -20.629 990 H ILE 124 H ILE 124 -0.219 2.288 -22.398 991 HA ILE 124 HA ILE 124 0.016 2.852 -25.274 992 HB ILE 124 HB ILE 124 -1.881 1.508 -24.022 993 HG12 ILE 124 HG12 ILE 124 -3.528 2.278 -25.832 994 HG13 ILE 124 HG13 ILE 124 -2.274 3.410 -26.343 995 HG21 ILE 124 HG21 ILE 124 -3.104 4.298 -23.954 996 HG22 ILE 124 HG22 ILE 124 -3.875 2.767 -23.482 997 HG23 ILE 124 HG23 ILE 124 -2.530 3.409 -22.530 998 HD11 ILE 124 HD11 ILE 124 -2.256 1.322 -27.688 999 HD12 ILE 124 HD12 ILE 124 -0.731 1.528 -26.799 1000 HD13 ILE 124 HD13 ILE 124 -1.953 0.376 -26.212 1001 H LYS 125 H LYS 125 0.637 4.597 -22.633 1002 HA LYS 125 HA LYS 125 1.158 6.765 -22.299 1003 HB2 LYS 125 HB2 LYS 125 0.401 7.422 -25.150 1004 HB3 LYS 125 HB3 LYS 125 1.551 8.258 -24.109 1005 HG2 LYS 125 HG2 LYS 125 1.916 5.447 -25.229 1006 HG3 LYS 125 HG3 LYS 125 2.630 6.917 -25.897 1007 HD2 LYS 125 HD2 LYS 125 3.968 7.255 -23.926 1008 HD3 LYS 125 HD3 LYS 125 3.137 5.948 -23.063 1009 HE2 LYS 125 HE2 LYS 125 5.332 5.218 -23.891 1010 HE3 LYS 125 HE3 LYS 125 4.005 4.294 -24.614 1011 HZ1 LYS 125 HZ1 LYS 125 4.180 5.665 -26.583 1012 HZ2 LYS 125 HZ2 LYS 125 5.625 4.937 -26.268 1013 HZ3 LYS 125 HZ3 LYS 125 5.417 6.537 -25.927 1014 H SER 126 H SER 126 -1.544 5.888 -21.775 1015 HA SER 126 HA SER 126 -2.974 8.514 -22.004 1016 HB2 SER 126 HB2 SER 126 -4.040 5.737 -21.366 1017 HB3 SER 126 HB3 SER 126 -5.002 7.230 -21.444 1018 HG SER 126 HG SER 126 -5.149 6.207 -23.414 1019 HA PRO 127 HA PRO 127 -1.534 8.044 -17.682 1020 HB2 PRO 127 HB2 PRO 127 -1.189 10.672 -17.022 1021 HB3 PRO 127 HB3 PRO 127 0.031 9.744 -17.951 1022 HG2 PRO 127 HG2 PRO 127 -2.119 11.585 -18.969 1023 HG3 PRO 127 HG3 PRO 127 -0.368 11.573 -19.351 1024 HD2 PRO 127 HD2 PRO 127 -2.178 10.398 -20.984 1025 HD3 PRO 127 HD3 PRO 127 -0.559 9.669 -20.711 1026 H THR 128 H THR 128 -4.107 10.024 -19.079 1027 HA THR 128 HA THR 128 -5.486 10.621 -16.659 1028 HB THR 128 HB THR 128 -7.080 10.008 -19.111 1029 HG1 THR 128 HG1 THR 128 -5.357 12.247 -19.127 1030 HG21 THR 128 HG21 THR 128 -7.942 12.274 -18.657 1031 HG22 THR 128 HG22 THR 128 -6.726 12.489 -17.372 1032 HG23 THR 128 HG23 THR 128 -8.007 11.267 -17.193 1033 H GLU 129 H GLU 129 -5.722 7.836 -18.951 1034 HA GLU 129 HA GLU 129 -7.722 6.494 -17.381 1035 HB2 GLU 129 HB2 GLU 129 -6.072 5.917 -19.739 1036 HB3 GLU 129 HB3 GLU 129 -6.402 4.494 -18.743 1037 HG2 GLU 129 HG2 GLU 129 -8.095 4.894 -20.548 1038 HG3 GLU 129 HG3 GLU 129 -8.768 4.814 -18.909 1039 H ALA 130 H ALA 130 -4.195 6.616 -17.295 1040 HA ALA 130 HA ALA 130 -3.867 4.403 -15.511 1041 HB1 ALA 130 HB1 ALA 130 -2.050 5.591 -16.844 1042 HB2 ALA 130 HB2 ALA 130 -2.127 6.895 -15.633 1043 HB3 ALA 130 HB3 ALA 130 -1.663 5.255 -15.145 1044 H GLU 131 H GLU 131 -4.653 7.879 -14.981 1045 HA GLU 131 HA GLU 131 -4.590 7.700 -12.099 1046 HB2 GLU 131 HB2 GLU 131 -6.083 9.541 -13.980 1047 HB3 GLU 131 HB3 GLU 131 -6.157 9.680 -12.227 1048 HG2 GLU 131 HG2 GLU 131 -3.719 9.995 -12.151 1049 HG3 GLU 131 HG3 GLU 131 -3.668 9.945 -13.921 1050 H LYS 132 H LYS 132 -7.137 7.030 -14.535 1051 HA LYS 132 HA LYS 132 -9.273 6.690 -12.621 1052 HB2 LYS 132 HB2 LYS 132 -8.793 5.670 -15.425 1053 HB3 LYS 132 HB3 LYS 132 -10.060 4.941 -14.450 1054 HG2 LYS 132 HG2 LYS 132 -11.152 6.550 -15.751 1055 HG3 LYS 132 HG3 LYS 132 -11.033 7.283 -14.143 1056 HD2 LYS 132 HD2 LYS 132 -9.144 8.642 -14.860 1057 HD3 LYS 132 HD3 LYS 132 -9.101 7.808 -16.420 1058 HE2 LYS 132 HE2 LYS 132 -11.444 9.469 -15.466 1059 HE3 LYS 132 HE3 LYS 132 -10.134 10.066 -16.507 1060 HZ1 LYS 132 HZ1 LYS 132 -10.715 8.229 -18.069 1061 HZ2 LYS 132 HZ2 LYS 132 -11.896 9.379 -17.909 1062 HZ3 LYS 132 HZ3 LYS 132 -12.055 7.917 -17.161 1063 H TYR 133 H TYR 133 -6.873 4.420 -14.029 1064 HA TYR 133 HA TYR 133 -7.849 2.185 -12.479 1065 HB2 TYR 133 HB2 TYR 133 -5.202 2.666 -13.874 1066 HB3 TYR 133 HB3 TYR 133 -5.666 1.138 -13.113 1067 HD1 TYR 133 HD1 TYR 133 -8.331 0.525 -13.864 1068 HD2 TYR 133 HD2 TYR 133 -5.367 2.578 -16.212 1069 HE1 TYR 133 HE1 TYR 133 -9.528 -0.127 -15.949 1070 HE2 TYR 133 HE2 TYR 133 -6.570 1.910 -18.296 1071 HH TYR 133 HH TYR 133 -9.546 -0.038 -18.242 1072 H TYR 134 H TYR 134 -5.463 4.752 -11.841 1073 HA TYR 134 HA TYR 134 -4.332 3.545 -9.494 1074 HB2 TYR 134 HB2 TYR 134 -3.284 5.526 -10.443 1075 HB3 TYR 134 HB3 TYR 134 -4.765 6.461 -10.242 1076 HD1 TYR 134 HD1 TYR 134 -2.078 4.700 -8.320 1077 HD2 TYR 134 HD2 TYR 134 -5.244 7.615 -8.218 1078 HE1 TYR 134 HE1 TYR 134 -1.347 5.422 -6.060 1079 HE2 TYR 134 HE2 TYR 134 -4.517 8.314 -5.938 1080 HH TYR 134 HH TYR 134 -3.059 7.959 -4.222 1081 H GLY 135 H GLY 135 -7.217 5.655 -9.989 1082 HA2 GLY 135 HA2 GLY 135 -7.947 5.779 -7.244 1083 HA3 GLY 135 HA3 GLY 135 -9.054 5.953 -8.616 1084 H GLN 136 H GLN 136 -8.734 3.368 -9.751 1085 HA GLN 136 HA GLN 136 -10.519 1.818 -8.101 1086 HB2 GLN 136 HB2 GLN 136 -8.774 1.072 -10.476 1087 HB3 GLN 136 HB3 GLN 136 -9.970 -0.010 -9.755 1088 HG2 GLN 136 HG2 GLN 136 -11.785 1.351 -10.450 1089 HG3 GLN 136 HG3 GLN 136 -10.733 2.728 -10.785 1090 HE21 GLN 136 HE21 GLN 136 -10.958 3.102 -12.888 1091 HE22 GLN 136 HE22 GLN 136 -10.717 1.912 -14.145 1092 H THR 137 H THR 137 -6.989 1.804 -8.611 1093 HA THR 137 HA THR 137 -6.502 -0.580 -7.085 1094 HB THR 137 HB THR 137 -4.589 1.767 -7.528 1095 HG1 THR 137 HG1 THR 137 -5.381 0.986 -9.515 1096 HG21 THR 137 HG21 THR 137 -3.814 0.105 -5.868 1097 HG22 THR 137 HG22 THR 137 -2.861 0.026 -7.361 1098 HG23 THR 137 HG23 THR 137 -4.107 -1.201 -7.043 1099 H VAL 138 H VAL 138 -6.680 2.915 -6.188 1100 HA VAL 138 HA VAL 138 -5.830 2.599 -3.479 1101 HB VAL 138 HB VAL 138 -7.985 4.538 -4.502 1102 HG11 VAL 138 HG11 VAL 138 -7.939 4.389 -2.045 1103 HG12 VAL 138 HG12 VAL 138 -6.180 4.650 -2.037 1104 HG13 VAL 138 HG13 VAL 138 -7.277 5.947 -2.568 1105 HG21 VAL 138 HG21 VAL 138 -5.721 6.066 -4.279 1106 HG22 VAL 138 HG22 VAL 138 -5.033 4.533 -4.859 1107 HG23 VAL 138 HG23 VAL 138 -6.302 5.349 -5.783 1108 H SER 139 H SER 139 -9.076 2.302 -5.005 1109 HA SER 139 HA SER 139 -10.499 1.801 -2.580 1110 HB2 SER 139 HB2 SER 139 -11.571 2.323 -4.776 1111 HB3 SER 139 HB3 SER 139 -11.106 0.712 -5.360 1112 HG SER 139 HG SER 139 -12.445 -0.219 -3.808 1113 H ASN 140 H ASN 140 -8.983 -0.445 -4.945 1114 HA ASN 140 HA ASN 140 -9.774 -2.798 -3.561 1115 HB2 ASN 140 HB2 ASN 140 -8.672 -2.358 -5.942 1116 HB3 ASN 140 HB3 ASN 140 -7.175 -2.706 -5.066 1117 HD21 ASN 140 HD21 ASN 140 -8.189 -4.651 -3.251 1118 HD22 ASN 140 HD22 ASN 140 -8.603 -6.065 -4.196 1119 H ILE 141 H ILE 141 -6.937 -0.653 -3.133 1120 HA ILE 141 HA ILE 141 -5.547 -2.379 -1.283 1121 HB ILE 141 HB ILE 141 -5.479 0.659 -1.699 1122 HG12 ILE 141 HG12 ILE 141 -3.261 -1.356 -2.154 1123 HG13 ILE 141 HG13 ILE 141 -4.492 -1.070 -3.382 1124 HG21 ILE 141 HG21 ILE 141 -3.961 -1.044 0.314 1125 HG22 ILE 141 HG22 ILE 141 -3.335 0.519 -0.246 1126 HG23 ILE 141 HG23 ILE 141 -4.889 0.440 0.609 1127 HD11 ILE 141 HD11 ILE 141 -2.505 0.245 -3.865 1128 HD12 ILE 141 HD12 ILE 141 -3.859 1.322 -3.471 1129 HD13 ILE 141 HD13 ILE 141 -2.581 1.016 -2.270 1130 H ASN 142 H ASN 142 -7.941 0.273 -0.864 1131 HA ASN 142 HA ASN 142 -8.050 0.170 1.972 1132 HB2 ASN 142 HB2 ASN 142 -9.061 1.911 0.464 1133 HB3 ASN 142 HB3 ASN 142 -10.346 0.757 0.078 1134 HD21 ASN 142 HD21 ASN 142 -12.135 1.295 1.098 1135 HD22 ASN 142 HD22 ASN 142 -12.228 1.812 2.765 1136 H GLU 143 H GLU 143 -9.853 -1.725 -0.482 1137 HA GLU 143 HA GLU 143 -11.561 -3.031 1.408 1138 HB2 GLU 143 HB2 GLU 143 -10.591 -3.809 -1.355 1139 HB3 GLU 143 HB3 GLU 143 -11.801 -4.738 -0.466 1140 HG2 GLU 143 HG2 GLU 143 -13.377 -2.956 -0.537 1141 HG3 GLU 143 HG3 GLU 143 -12.155 -1.790 -1.060 1142 H VAL 144 H VAL 144 -8.327 -3.888 0.157 1143 HA VAL 144 HA VAL 144 -8.248 -6.462 1.498 1144 HB VAL 144 HB VAL 144 -6.024 -4.590 0.523 1145 HG11 VAL 144 HG11 VAL 144 -5.083 -5.917 2.343 1146 HG12 VAL 144 HG12 VAL 144 -5.791 -7.405 1.673 1147 HG13 VAL 144 HG13 VAL 144 -4.495 -6.557 0.799 1148 HG21 VAL 144 HG21 VAL 144 -7.002 -7.265 -0.554 1149 HG22 VAL 144 HG22 VAL 144 -7.452 -5.684 -1.220 1150 HG23 VAL 144 HG23 VAL 144 -5.764 -6.220 -1.279 1151 H LEU 145 H LEU 145 -7.429 -3.106 2.356 1152 HA LEU 145 HA LEU 145 -6.073 -3.670 4.809 1153 HB2 LEU 145 HB2 LEU 145 -7.206 -1.359 3.420 1154 HB3 LEU 145 HB3 LEU 145 -7.394 -1.232 5.159 1155 HG LEU 145 HG LEU 145 -4.993 -1.388 5.482 1156 HD11 LEU 145 HD11 LEU 145 -3.448 -1.260 3.517 1157 HD12 LEU 145 HD12 LEU 145 -4.825 -1.615 2.459 1158 HD13 LEU 145 HD13 LEU 145 -4.287 -2.817 3.647 1159 HD21 LEU 145 HD21 LEU 145 -4.380 0.763 4.455 1160 HD22 LEU 145 HD22 LEU 145 -6.039 0.804 5.092 1161 HD23 LEU 145 HD23 LEU 145 -5.763 0.632 3.342 1162 H ALA 146 H ALA 146 -9.521 -3.159 4.078 1163 HA ALA 146 HA ALA 146 -10.399 -3.105 6.789 1164 HB1 ALA 146 HB1 ALA 146 -11.780 -2.389 4.852 1165 HB2 ALA 146 HB2 ALA 146 -11.869 -4.078 4.293 1166 HB3 ALA 146 HB3 ALA 146 -12.623 -3.609 5.835 1167 H LYS 147 H LYS 147 -9.436 -5.802 4.749 1168 HA LYS 147 HA LYS 147 -10.643 -7.758 6.627 1169 HB2 LYS 147 HB2 LYS 147 -8.978 -8.099 4.121 1170 HB3 LYS 147 HB3 LYS 147 -9.635 -9.423 5.091 1171 HG2 LYS 147 HG2 LYS 147 -11.940 -8.464 4.687 1172 HG3 LYS 147 HG3 LYS 147 -11.200 -7.310 3.571 1173 HD2 LYS 147 HD2 LYS 147 -12.037 -9.096 2.236 1174 HD3 LYS 147 HD3 LYS 147 -10.275 -9.276 2.278 1175 HE2 LYS 147 HE2 LYS 147 -11.342 -11.445 2.528 1176 HE3 LYS 147 HE3 LYS 147 -10.499 -11.020 4.023 1177 HZ1 LYS 147 HZ1 LYS 147 -12.634 -10.314 4.937 1178 HZ2 LYS 147 HZ2 LYS 147 -12.648 -11.911 4.519 1179 HZ3 LYS 147 HZ3 LYS 147 -13.410 -10.793 3.563 1180 H LEU 148 H LEU 148 -7.721 -6.019 6.316 1181 HA LEU 148 HA LEU 148 -6.085 -8.066 7.673 1182 HB2 LEU 148 HB2 LEU 148 -5.565 -5.161 6.943 1183 HB3 LEU 148 HB3 LEU 148 -4.409 -6.186 7.780 1184 HG LEU 148 HG LEU 148 -5.471 -6.763 5.003 1185 HD11 LEU 148 HD11 LEU 148 -3.275 -5.973 4.214 1186 HD12 LEU 148 HD12 LEU 148 -2.843 -5.514 5.879 1187 HD13 LEU 148 HD13 LEU 148 -4.169 -4.683 5.039 1188 HD21 LEU 148 HD21 LEU 148 -3.154 -7.948 6.563 1189 HD22 LEU 148 HD22 LEU 148 -3.583 -8.329 4.883 1190 HD23 LEU 148 HD23 LEU 148 -4.691 -8.763 6.187 1191 H GLY 149 H GLY 149 -7.937 -5.130 8.411 1192 HA2 GLY 149 HA2 GLY 149 -8.801 -4.605 10.560 1193 HA3 GLY 149 HA3 GLY 149 -7.656 -5.748 11.304 Start of MODEL 5 1 H1 GLU 1 H1 GLU 1 -5.320 26.408 10.760 2 H2 GLU 1 H2 GLU 1 -6.147 25.046 10.341 3 H3 GLU 1 H3 GLU 1 -6.970 26.441 10.670 4 HA GLU 1 HA GLU 1 -6.155 26.372 12.975 5 HB2 GLU 1 HB2 GLU 1 -7.921 24.264 11.762 6 HB3 GLU 1 HB3 GLU 1 -7.486 24.103 13.464 7 HG2 GLU 1 HG2 GLU 1 -9.673 25.316 12.937 8 HG3 GLU 1 HG3 GLU 1 -8.553 26.102 14.065 9 H ALA 2 H ALA 2 -5.219 25.038 14.669 10 HA ALA 2 HA ALA 2 -2.885 23.596 13.719 11 HB1 ALA 2 HB1 ALA 2 -2.833 25.013 15.748 12 HB2 ALA 2 HB2 ALA 2 -4.018 23.939 16.536 13 HB3 ALA 2 HB3 ALA 2 -2.398 23.331 16.124 14 H ARG 3 H ARG 3 -6.127 22.697 14.524 15 HA ARG 3 HA ARG 3 -5.425 19.901 15.165 16 HB2 ARG 3 HB2 ARG 3 -8.097 21.324 14.838 17 HB3 ARG 3 HB3 ARG 3 -7.916 19.634 15.310 18 HG2 ARG 3 HG2 ARG 3 -6.652 20.397 17.335 19 HG3 ARG 3 HG3 ARG 3 -7.042 22.073 16.893 20 HD2 ARG 3 HD2 ARG 3 -9.089 19.863 17.364 21 HD3 ARG 3 HD3 ARG 3 -8.624 21.078 18.570 22 HE ARG 3 HE ARG 3 -9.408 22.523 16.315 23 HH11 ARG 3 HH11 ARG 3 -10.988 20.215 18.464 24 HH12 ARG 3 HH12 ARG 3 -12.561 20.923 18.221 25 HH21 ARG 3 HH21 ARG 3 -11.450 23.380 16.060 26 HH22 ARG 3 HH22 ARG 3 -12.812 22.678 16.883 27 HA PRO 4 HA PRO 4 -6.220 18.590 10.918 28 HB2 PRO 4 HB2 PRO 4 -6.690 15.944 11.265 29 HB3 PRO 4 HB3 PRO 4 -5.082 16.651 11.600 30 HG2 PRO 4 HG2 PRO 4 -7.302 16.046 13.527 31 HG3 PRO 4 HG3 PRO 4 -5.577 15.565 13.605 32 HD2 PRO 4 HD2 PRO 4 -6.553 17.741 14.925 33 HD3 PRO 4 HD3 PRO 4 -4.890 17.700 14.246 34 H ILE 5 H ILE 5 -8.224 20.085 11.543 35 HA ILE 5 HA ILE 5 -10.726 18.474 11.221 36 HB ILE 5 HB ILE 5 -10.221 19.309 13.615 37 HG12 ILE 5 HG12 ILE 5 -12.822 20.322 12.429 38 HG13 ILE 5 HG13 ILE 5 -12.465 18.616 12.693 39 HG21 ILE 5 HG21 ILE 5 -10.571 21.655 14.155 40 HG22 ILE 5 HG22 ILE 5 -9.352 21.585 12.868 41 HG23 ILE 5 HG23 ILE 5 -11.027 22.040 12.483 42 HD11 ILE 5 HD11 ILE 5 -12.149 19.111 15.141 43 HD12 ILE 5 HD12 ILE 5 -12.684 20.780 14.817 44 HD13 ILE 5 HD13 ILE 5 -13.794 19.422 14.541 45 H VAL 6 H VAL 6 -8.733 20.363 9.625 46 HA VAL 6 HA VAL 6 -10.907 21.986 8.414 47 HB VAL 6 HB VAL 6 -9.580 23.504 9.806 48 HG11 VAL 6 HG11 VAL 6 -7.138 22.572 8.231 49 HG12 VAL 6 HG12 VAL 6 -7.177 23.925 9.367 50 HG13 VAL 6 HG13 VAL 6 -7.457 22.278 9.955 51 HG21 VAL 6 HG21 VAL 6 -8.876 23.925 6.873 52 HG22 VAL 6 HG22 VAL 6 -10.447 24.306 7.615 53 HG23 VAL 6 HG23 VAL 6 -8.989 25.169 8.143 54 H VAL 7 H VAL 7 -11.200 21.606 6.371 55 HA VAL 7 HA VAL 7 -9.221 20.017 4.882 56 HB VAL 7 HB VAL 7 -11.575 19.389 4.624 57 HG11 VAL 7 HG11 VAL 7 -13.246 20.907 3.573 58 HG12 VAL 7 HG12 VAL 7 -12.707 21.480 5.159 59 HG13 VAL 7 HG13 VAL 7 -12.079 22.244 3.679 60 HG21 VAL 7 HG21 VAL 7 -10.079 19.192 2.638 61 HG22 VAL 7 HG22 VAL 7 -11.787 19.399 2.208 62 HG23 VAL 7 HG23 VAL 7 -10.669 20.773 2.070 63 H GLY 8 H GLY 8 -7.941 20.843 3.247 64 HA2 GLY 8 HA2 GLY 8 -8.178 23.158 1.801 65 HA3 GLY 8 HA3 GLY 8 -7.513 23.714 3.354 66 HA PRO 9 HA PRO 9 -4.120 21.938 0.686 67 HB2 PRO 9 HB2 PRO 9 -2.545 24.142 0.371 68 HB3 PRO 9 HB3 PRO 9 -3.970 23.849 -0.679 69 HG2 PRO 9 HG2 PRO 9 -3.760 25.566 1.788 70 HG3 PRO 9 HG3 PRO 9 -4.394 25.999 0.166 71 HD2 PRO 9 HD2 PRO 9 -6.034 25.252 2.192 72 HD3 PRO 9 HD3 PRO 9 -6.373 24.783 0.488 73 HA PRO 10 HA PRO 10 -1.616 21.607 4.333 74 HB2 PRO 10 HB2 PRO 10 0.877 20.994 3.387 75 HB3 PRO 10 HB3 PRO 10 -0.486 19.832 3.280 76 HG2 PRO 10 HG2 PRO 10 0.529 21.751 1.196 77 HG3 PRO 10 HG3 PRO 10 0.235 19.988 1.054 78 HD2 PRO 10 HD2 PRO 10 -1.595 21.781 0.223 79 HD3 PRO 10 HD3 PRO 10 -2.099 20.262 1.045 80 HA PRO 11 HA PRO 11 0.222 25.557 4.844 81 HB2 PRO 11 HB2 PRO 11 2.371 25.176 6.536 82 HB3 PRO 11 HB3 PRO 11 0.663 25.112 7.085 83 HG2 PRO 11 HG2 PRO 11 2.460 22.840 6.264 84 HG3 PRO 11 HG3 PRO 11 1.497 23.022 7.767 85 HD2 PRO 11 HD2 PRO 11 0.578 21.580 5.728 86 HD3 PRO 11 HD3 PRO 11 -0.530 22.681 6.618 87 HA PRO 12 HA PRO 12 3.302 25.587 1.722 88 HB2 PRO 12 HB2 PRO 12 3.981 28.202 1.576 89 HB3 PRO 12 HB3 PRO 12 2.312 27.647 1.227 90 HG2 PRO 12 HG2 PRO 12 3.429 28.748 3.794 91 HG3 PRO 12 HG3 PRO 12 1.989 29.289 2.873 92 HD2 PRO 12 HD2 PRO 12 1.792 27.581 4.974 93 HD3 PRO 12 HD3 PRO 12 0.724 27.433 3.534 94 H LEU 13 H LEU 13 4.303 25.659 4.852 95 HA LEU 13 HA LEU 13 7.147 26.285 4.157 96 HB2 LEU 13 HB2 LEU 13 5.541 26.431 6.689 97 HB3 LEU 13 HB3 LEU 13 7.235 25.960 6.812 98 HG LEU 13 HG LEU 13 7.907 28.062 5.688 99 HD11 LEU 13 HD11 LEU 13 5.897 28.636 4.431 100 HD12 LEU 13 HD12 LEU 13 6.269 29.937 5.576 101 HD13 LEU 13 HD13 LEU 13 4.957 28.789 5.937 102 HD21 LEU 13 HD21 LEU 13 6.181 28.390 8.177 103 HD22 LEU 13 HD22 LEU 13 7.476 29.490 7.647 104 HD23 LEU 13 HD23 LEU 13 7.873 27.832 8.141 105 H SER 14 H SER 14 5.540 24.133 6.542 106 HA SER 14 HA SER 14 6.436 21.723 5.180 107 HB2 SER 14 HB2 SER 14 7.822 20.935 7.088 108 HB3 SER 14 HB3 SER 14 8.535 22.362 6.311 109 HG SER 14 HG SER 14 8.555 22.618 8.549 110 H GLY 15 H GLY 15 5.516 19.835 6.317 111 HA2 GLY 15 HA2 GLY 15 4.189 18.908 8.080 112 HA3 GLY 15 HA3 GLY 15 3.570 20.519 8.454 113 H GLY 16 H GLY 16 1.633 18.860 8.418 114 HA2 GLY 16 HA2 GLY 16 -0.113 19.569 6.319 115 HA3 GLY 16 HA3 GLY 16 0.571 17.959 5.946 116 H LEU 17 H LEU 17 -1.982 17.594 6.441 117 HA LEU 17 HA LEU 17 -2.019 16.480 9.159 118 HB2 LEU 17 HB2 LEU 17 -4.207 17.507 9.688 119 HB3 LEU 17 HB3 LEU 17 -2.897 18.660 9.591 120 HG LEU 17 HG LEU 17 -3.830 19.106 7.160 121 HD11 LEU 17 HD11 LEU 17 -6.324 19.019 7.143 122 HD12 LEU 17 HD12 LEU 17 -6.278 18.024 8.616 123 HD13 LEU 17 HD13 LEU 17 -5.585 17.413 7.104 124 HD21 LEU 17 HD21 LEU 17 -5.215 20.903 8.138 125 HD22 LEU 17 HD22 LEU 17 -3.661 20.738 8.980 126 HD23 LEU 17 HD23 LEU 17 -5.145 20.099 9.721 127 HA PRO 18 HA PRO 18 -4.206 13.445 6.809 128 HB2 PRO 18 HB2 PRO 18 -5.414 11.944 8.714 129 HB3 PRO 18 HB3 PRO 18 -3.625 12.006 8.589 130 HG2 PRO 18 HG2 PRO 18 -5.452 13.589 10.386 131 HG3 PRO 18 HG3 PRO 18 -4.017 12.608 10.822 132 HD2 PRO 18 HD2 PRO 18 -3.863 15.292 10.468 133 HD3 PRO 18 HD3 PRO 18 -2.524 14.200 9.979 134 H GLY 19 H GLY 19 -6.470 12.625 6.330 135 HA2 GLY 19 HA2 GLY 19 -8.778 12.857 6.258 136 HA3 GLY 19 HA3 GLY 19 -8.687 14.010 7.594 137 H THR 20 H THR 20 -6.714 14.632 4.804 138 HA THR 20 HA THR 20 -7.959 17.160 4.332 139 HB THR 20 HB THR 20 -5.557 16.597 3.800 140 HG1 THR 20 HG1 THR 20 -6.436 18.419 2.834 141 HG21 THR 20 HG21 THR 20 -5.955 14.373 2.728 142 HG22 THR 20 HG22 THR 20 -5.010 15.474 1.707 143 HG23 THR 20 HG23 THR 20 -6.727 15.203 1.355 144 H GLU 21 H GLU 21 -8.868 14.003 3.355 145 HA GLU 21 HA GLU 21 -10.314 14.772 0.948 146 HB2 GLU 21 HB2 GLU 21 -11.128 12.486 1.003 147 HB3 GLU 21 HB3 GLU 21 -9.389 12.522 1.311 148 HG2 GLU 21 HG2 GLU 21 -9.984 12.423 3.811 149 HG3 GLU 21 HG3 GLU 21 -11.620 11.995 3.282 150 H ASN 22 H ASN 22 -10.864 15.138 4.287 151 HA ASN 22 HA ASN 22 -12.617 15.829 5.534 152 HB2 ASN 22 HB2 ASN 22 -12.527 17.496 3.550 153 HB3 ASN 22 HB3 ASN 22 -14.028 16.727 3.029 154 HD21 ASN 22 HD21 ASN 22 -15.771 17.766 3.666 155 HD22 ASN 22 HD22 ASN 22 -15.929 18.700 5.133 156 H SER 23 H SER 23 -12.869 13.035 4.386 157 HA SER 23 HA SER 23 -15.744 12.659 4.030 158 HB2 SER 23 HB2 SER 23 -14.037 11.132 3.022 159 HB3 SER 23 HB3 SER 23 -13.588 10.602 4.657 160 HG SER 23 HG SER 23 -15.901 10.068 4.884 161 H ASP 24 H ASP 24 -13.400 12.578 6.657 162 HA ASP 24 HA ASP 24 -15.587 12.468 8.623 163 HB2 ASP 24 HB2 ASP 24 -14.786 10.616 9.809 164 HB3 ASP 24 HB3 ASP 24 -14.662 10.071 8.130 165 H GLN 25 H GLN 25 -14.326 12.620 10.911 166 HA GLN 25 HA GLN 25 -12.326 14.804 10.599 167 HB2 GLN 25 HB2 GLN 25 -14.298 15.163 12.085 168 HB3 GLN 25 HB3 GLN 25 -13.774 13.805 13.086 169 HG2 GLN 25 HG2 GLN 25 -11.665 15.002 13.611 170 HG3 GLN 25 HG3 GLN 25 -12.184 16.359 12.602 171 HE21 GLN 25 HE21 GLN 25 -14.968 16.272 13.410 172 HE22 GLN 25 HE22 GLN 25 -15.025 16.860 15.053 173 H ALA 26 H ALA 26 -10.571 13.570 9.961 174 HA ALA 26 HA ALA 26 -9.856 11.072 10.966 175 HB1 ALA 26 HB1 ALA 26 -7.588 11.573 10.096 176 HB2 ALA 26 HB2 ALA 26 -8.874 12.023 8.955 177 HB3 ALA 26 HB3 ALA 26 -8.052 13.284 9.915 178 H ARG 27 H ARG 27 -9.154 10.329 12.773 179 HA ARG 27 HA ARG 27 -8.436 12.179 14.946 180 HB2 ARG 27 HB2 ARG 27 -10.080 10.145 14.930 181 HB3 ARG 27 HB3 ARG 27 -8.620 9.170 15.132 182 HG2 ARG 27 HG2 ARG 27 -8.116 10.334 17.227 183 HG3 ARG 27 HG3 ARG 27 -9.515 11.404 16.989 184 HD2 ARG 27 HD2 ARG 27 -11.019 9.458 17.041 185 HD3 ARG 27 HD3 ARG 27 -9.631 8.377 17.254 186 HE ARG 27 HE ARG 27 -10.866 10.116 19.266 187 HH11 ARG 27 HH11 ARG 27 -8.024 8.167 18.483 188 HH12 ARG 27 HH12 ARG 27 -7.568 7.993 20.156 189 HH21 ARG 27 HH21 ARG 27 -10.217 9.856 21.375 190 HH22 ARG 27 HH22 ARG 27 -8.781 8.948 21.760 191 H ASP 28 H ASP 28 -6.709 10.851 12.559 192 HA ASP 28 HA ASP 28 -4.568 10.157 12.192 193 HB2 ASP 28 HB2 ASP 28 -4.279 12.428 13.449 194 HB3 ASP 28 HB3 ASP 28 -3.677 11.434 14.779 195 H GLY 29 H GLY 29 -2.780 9.684 14.810 196 HA2 GLY 29 HA2 GLY 29 -2.438 7.865 16.261 197 HA3 GLY 29 HA3 GLY 29 -3.986 7.159 15.744 198 H THR 30 H THR 30 -1.738 8.371 13.353 199 HA THR 30 HA THR 30 -1.594 5.765 12.106 200 HB THR 30 HB THR 30 0.018 6.906 10.530 201 HG1 THR 30 HG1 THR 30 -0.591 9.267 12.024 202 HG21 THR 30 HG21 THR 30 -1.606 8.479 9.582 203 HG22 THR 30 HG22 THR 30 -2.519 8.497 11.105 204 HG23 THR 30 HG23 THR 30 -2.434 7.006 10.135 205 H LEU 31 H LEU 31 -0.261 4.151 12.546 206 HA LEU 31 HA LEU 31 2.339 4.759 13.891 207 HB2 LEU 31 HB2 LEU 31 0.369 2.543 14.517 208 HB3 LEU 31 HB3 LEU 31 2.009 2.625 15.155 209 HG LEU 31 HG LEU 31 -0.126 4.717 15.681 210 HD11 LEU 31 HD11 LEU 31 -0.292 3.692 17.913 211 HD12 LEU 31 HD12 LEU 31 0.851 2.419 17.420 212 HD13 LEU 31 HD13 LEU 31 -0.746 2.544 16.640 213 HD21 LEU 31 HD21 LEU 31 2.123 5.635 15.921 214 HD22 LEU 31 HD22 LEU 31 2.618 4.247 16.921 215 HD23 LEU 31 HD23 LEU 31 1.406 5.401 17.525 216 HA PRO 32 HA PRO 32 3.168 1.964 10.335 217 HB2 PRO 32 HB2 PRO 32 5.291 3.276 9.254 218 HB3 PRO 32 HB3 PRO 32 3.607 3.797 8.917 219 HG2 PRO 32 HG2 PRO 32 5.558 4.882 10.938 220 HG3 PRO 32 HG3 PRO 32 4.580 5.771 9.731 221 HD2 PRO 32 HD2 PRO 32 3.816 5.504 12.336 222 HD3 PRO 32 HD3 PRO 32 2.627 5.562 10.988 223 H TYR 33 H TYR 33 5.236 0.641 10.028 224 HA TYR 33 HA TYR 33 6.575 0.247 12.585 225 HB2 TYR 33 HB2 TYR 33 8.006 -1.357 11.320 226 HB3 TYR 33 HB3 TYR 33 6.284 -1.706 11.211 227 HD1 TYR 33 HD2 TYR 33 9.161 -0.214 9.306 228 HD2 TYR 33 HD1 TYR 33 5.207 -1.922 9.079 229 HE1 TYR 33 HE2 TYR 33 9.324 -0.288 6.820 230 HE2 TYR 33 HE1 TYR 33 5.408 -2.000 6.589 231 HH TYR 33 HH TYR 33 6.678 -1.515 4.765 232 H THR 34 H THR 34 8.533 1.086 13.228 233 HA THR 34 HA THR 34 10.060 2.768 11.296 234 HB THR 34 HB THR 34 10.229 4.540 13.099 235 HG1 THR 34 HG1 THR 34 7.907 3.471 14.258 236 HG21 THR 34 HG21 THR 34 8.078 5.579 12.718 237 HG22 THR 34 HG22 THR 34 7.361 4.026 12.246 238 HG23 THR 34 HG23 THR 34 8.599 4.779 11.219 239 H LYS 35 H LYS 35 12.107 3.513 12.367 240 HA LYS 35 HA LYS 35 14.158 2.845 13.132 241 HB2 LYS 35 HB2 LYS 35 12.948 4.007 15.013 242 HB3 LYS 35 HB3 LYS 35 12.611 2.416 15.700 243 HG2 LYS 35 HG2 LYS 35 14.532 3.278 16.846 244 HG3 LYS 35 HG3 LYS 35 15.124 2.011 15.767 245 HD2 LYS 35 HD2 LYS 35 15.678 3.869 14.089 246 HD3 LYS 35 HD3 LYS 35 15.343 5.020 15.395 247 HE2 LYS 35 HE2 LYS 35 17.428 2.799 15.382 248 HE3 LYS 35 HE3 LYS 35 17.748 4.533 15.233 249 HZ1 LYS 35 HZ1 LYS 35 16.890 4.810 17.476 250 HZ2 LYS 35 HZ2 LYS 35 18.139 3.730 17.465 251 HZ3 LYS 35 HZ3 LYS 35 16.587 3.192 17.598 252 H ASP 36 H ASP 36 14.168 0.916 11.787 253 HA ASP 36 HA ASP 36 14.977 -1.190 11.498 254 HB2 ASP 36 HB2 ASP 36 15.876 -0.943 14.372 255 HB3 ASP 36 HB3 ASP 36 16.671 -1.826 13.058 256 H ARG 37 H ARG 37 12.218 -1.053 12.577 257 HA ARG 37 HA ARG 37 11.627 -2.842 14.598 258 HB2 ARG 37 HB2 ARG 37 10.113 -1.298 13.260 259 HB3 ARG 37 HB3 ARG 37 10.004 -2.566 12.046 260 HG2 ARG 37 HG2 ARG 37 9.382 -3.468 14.796 261 HG3 ARG 37 HG3 ARG 37 8.309 -2.199 14.188 262 HD2 ARG 37 HD2 ARG 37 8.125 -3.660 12.049 263 HD3 ARG 37 HD3 ARG 37 8.779 -4.965 13.053 264 HE ARG 37 HE ARG 37 6.191 -3.524 13.468 265 HH11 ARG 37 HH11 ARG 37 8.212 -6.331 14.265 266 HH12 ARG 37 HH12 ARG 37 6.881 -7.139 15.063 267 HH21 ARG 37 HH21 ARG 37 4.590 -4.643 14.516 268 HH22 ARG 37 HH22 ARG 37 4.948 -6.214 15.226 269 H PHE 38 H PHE 38 12.523 -3.731 11.287 270 HA PHE 38 HA PHE 38 11.474 -6.425 11.521 271 HB2 PHE 38 HB2 PHE 38 13.523 -5.282 9.592 272 HB3 PHE 38 HB3 PHE 38 12.687 -6.827 9.422 273 HD1 PHE 38 HD2 PHE 38 9.939 -5.425 10.552 274 HD2 PHE 38 HD1 PHE 38 12.708 -4.651 7.340 275 HE1 PHE 38 HE2 PHE 38 8.139 -4.307 9.279 276 HE2 PHE 38 HE1 PHE 38 10.891 -3.536 6.056 277 HZ PHE 38 HZ PHE 38 8.603 -3.384 7.016 278 H TYR 39 H TYR 39 14.228 -4.948 12.838 279 HA TYR 39 HA TYR 39 15.620 -7.589 13.046 280 HB2 TYR 39 HB2 TYR 39 16.741 -4.804 13.513 281 HB3 TYR 39 HB3 TYR 39 17.645 -6.323 13.457 282 HD1 TYR 39 HD2 TYR 39 17.683 -7.615 11.204 283 HD2 TYR 39 HD1 TYR 39 16.352 -3.535 11.540 284 HE1 TYR 39 HE2 TYR 39 18.002 -7.301 8.748 285 HE2 TYR 39 HE1 TYR 39 16.667 -3.235 9.081 286 HH TYR 39 HH TYR 39 17.886 -5.852 6.987 287 H LEU 40 H LEU 40 14.465 -4.700 14.753 288 HA LEU 40 HA LEU 40 15.348 -5.610 17.358 289 HB2 LEU 40 HB2 LEU 40 13.771 -3.351 16.211 290 HB3 LEU 40 HB3 LEU 40 13.450 -3.747 17.890 291 HG LEU 40 HG LEU 40 15.062 -1.896 17.590 292 HD11 LEU 40 HD11 LEU 40 16.651 -2.653 19.281 293 HD12 LEU 40 HD12 LEU 40 16.258 -4.352 18.938 294 HD13 LEU 40 HD13 LEU 40 15.030 -3.280 19.647 295 HD21 LEU 40 HD21 LEU 40 17.035 -3.998 16.612 296 HD22 LEU 40 HD22 LEU 40 17.321 -2.258 16.842 297 HD23 LEU 40 HD23 LEU 40 16.227 -2.814 15.563 298 H GLN 41 H GLN 41 12.375 -5.991 15.476 299 HA GLN 41 HA GLN 41 11.181 -7.394 17.827 300 HB2 GLN 41 HB2 GLN 41 9.775 -5.699 15.737 301 HB3 GLN 41 HB3 GLN 41 8.971 -6.623 17.010 302 HG2 GLN 41 HG2 GLN 41 10.064 -5.243 18.728 303 HG3 GLN 41 HG3 GLN 41 10.927 -4.340 17.476 304 HE21 GLN 41 HE21 GLN 41 9.779 -2.626 18.839 305 HE22 GLN 41 HE22 GLN 41 8.228 -2.108 18.227 306 HA PRO 42 HA PRO 42 10.889 -10.714 14.929 307 HB2 PRO 42 HB2 PRO 42 8.908 -12.263 15.972 308 HB3 PRO 42 HB3 PRO 42 10.487 -12.079 16.805 309 HG2 PRO 42 HG2 PRO 42 7.910 -10.590 17.287 310 HG3 PRO 42 HG3 PRO 42 8.947 -11.455 18.469 311 HD2 PRO 42 HD2 PRO 42 9.130 -8.780 18.110 312 HD3 PRO 42 HD3 PRO 42 10.591 -9.782 18.422 313 H LEU 43 H LEU 43 9.337 -11.715 13.344 314 HA LEU 43 HA LEU 43 7.013 -9.909 12.815 315 HB2 LEU 43 HB2 LEU 43 8.898 -11.202 10.823 316 HB3 LEU 43 HB3 LEU 43 7.420 -10.339 10.398 317 HG LEU 43 HG LEU 43 9.805 -9.084 11.810 318 HD11 LEU 43 HD11 LEU 43 10.360 -9.771 9.522 319 HD12 LEU 43 HD12 LEU 43 10.238 -8.006 9.632 320 HD13 LEU 43 HD13 LEU 43 8.910 -8.947 8.903 321 HD21 LEU 43 HD21 LEU 43 7.729 -7.914 12.338 322 HD22 LEU 43 HD22 LEU 43 7.268 -7.879 10.623 323 HD23 LEU 43 HD23 LEU 43 8.671 -6.950 11.196 324 HA PRO 44 HA PRO 44 5.386 -14.214 12.948 325 HB2 PRO 44 HB2 PRO 44 3.192 -13.735 14.505 326 HB3 PRO 44 HB3 PRO 44 4.812 -14.020 15.220 327 HG2 PRO 44 HG2 PRO 44 3.436 -11.431 14.629 328 HG3 PRO 44 HG3 PRO 44 4.188 -11.985 16.157 329 HD2 PRO 44 HD2 PRO 44 5.507 -10.380 14.428 330 HD3 PRO 44 HD3 PRO 44 6.358 -11.680 15.329 331 HA PRO 45 HA PRO 45 2.691 -13.282 9.663 332 HB2 PRO 45 HB2 PRO 45 0.545 -14.998 9.845 333 HB3 PRO 45 HB3 PRO 45 2.195 -15.524 9.385 334 HG2 PRO 45 HG2 PRO 45 0.910 -15.583 12.105 335 HG3 PRO 45 HG3 PRO 45 1.717 -16.914 11.209 336 HD2 PRO 45 HD2 PRO 45 3.058 -15.538 13.054 337 HD3 PRO 45 HD3 PRO 45 3.854 -15.942 11.492 338 H THR 46 H THR 46 1.192 -13.073 12.846 339 HA THR 46 HA THR 46 -1.211 -11.721 11.997 340 HB THR 46 HB THR 46 -1.019 -10.861 14.464 341 HG1 THR 46 HG1 THR 46 0.566 -11.825 15.657 342 HG21 THR 46 HG21 THR 46 -2.444 -12.779 13.780 343 HG22 THR 46 HG22 THR 46 -1.685 -13.052 15.362 344 HG23 THR 46 HG23 THR 46 -1.037 -13.863 13.920 345 H GLU 47 H GLU 47 2.038 -10.658 13.056 346 HA GLU 47 HA GLU 47 1.302 -7.843 12.855 347 HB2 GLU 47 HB2 GLU 47 3.923 -9.267 13.349 348 HB3 GLU 47 HB3 GLU 47 3.734 -7.507 13.367 349 HG2 GLU 47 HG2 GLU 47 2.182 -7.622 15.223 350 HG3 GLU 47 HG3 GLU 47 2.141 -9.390 15.143 351 H ALA 48 H ALA 48 2.285 -10.214 10.606 352 HA ALA 48 HA ALA 48 3.713 -8.514 8.776 353 HB1 ALA 48 HB1 ALA 48 3.096 -10.218 7.081 354 HB2 ALA 48 HB2 ALA 48 3.736 -10.964 8.565 355 HB3 ALA 48 HB3 ALA 48 1.987 -10.970 8.249 356 H ALA 49 H ALA 49 0.354 -8.773 9.726 357 HA ALA 49 HA ALA 49 -0.811 -7.528 7.411 358 HB1 ALA 49 HB1 ALA 49 -2.148 -8.734 9.113 359 HB2 ALA 49 HB2 ALA 49 -1.721 -7.506 10.327 360 HB3 ALA 49 HB3 ALA 49 -2.716 -7.059 8.922 361 H GLN 50 H GLN 50 0.851 -6.283 10.301 362 HA GLN 50 HA GLN 50 0.058 -3.534 9.943 363 HB2 GLN 50 HB2 GLN 50 2.563 -4.653 11.249 364 HB3 GLN 50 HB3 GLN 50 1.939 -3.015 11.434 365 HG2 GLN 50 HG2 GLN 50 -0.103 -3.932 12.510 366 HG3 GLN 50 HG3 GLN 50 0.563 -5.565 12.358 367 HE21 GLN 50 HE21 GLN 50 -0.141 -4.663 14.827 368 HE22 GLN 50 HE22 GLN 50 1.292 -4.360 15.778 369 H ARG 51 H ARG 51 2.734 -5.542 8.725 370 HA ARG 51 HA ARG 51 4.210 -3.385 7.498 371 HB2 ARG 51 HB2 ARG 51 4.016 -6.353 6.889 372 HB3 ARG 51 HB3 ARG 51 5.065 -5.257 5.992 373 HG2 ARG 51 HG2 ARG 51 6.438 -4.850 7.868 374 HG3 ARG 51 HG3 ARG 51 5.270 -5.563 9.000 375 HD2 ARG 51 HD2 ARG 51 7.235 -7.060 8.458 376 HD3 ARG 51 HD3 ARG 51 5.648 -7.769 8.135 377 HE ARG 51 HE ARG 51 5.956 -7.463 5.772 378 HH11 ARG 51 HH11 ARG 51 8.928 -6.782 7.598 379 HH12 ARG 51 HH12 ARG 51 9.914 -6.940 6.172 380 HH21 ARG 51 HH21 ARG 51 7.232 -7.621 4.075 381 HH22 ARG 51 HH22 ARG 51 8.972 -7.410 4.194 382 H ALA 52 H ALA 52 1.609 -5.536 6.415 383 HA ALA 52 HA ALA 52 1.591 -4.740 3.708 384 HB1 ALA 52 HB1 ALA 52 0.403 -6.719 4.614 385 HB2 ALA 52 HB2 ALA 52 -0.761 -5.638 5.412 386 HB3 ALA 52 HB3 ALA 52 -0.662 -5.680 3.638 387 H LYS 53 H LYS 53 0.143 -3.146 6.557 388 HA LYS 53 HA LYS 53 -1.572 -1.367 5.166 389 HB2 LYS 53 HB2 LYS 53 0.038 -0.761 7.690 390 HB3 LYS 53 HB3 LYS 53 -1.397 0.102 7.123 391 HG2 LYS 53 HG2 LYS 53 -2.618 -2.126 7.314 392 HG3 LYS 53 HG3 LYS 53 -1.221 -2.724 8.180 393 HD2 LYS 53 HD2 LYS 53 -1.563 -1.037 9.926 394 HD3 LYS 53 HD3 LYS 53 -2.933 -0.365 9.003 395 HE2 LYS 53 HE2 LYS 53 -4.041 -2.631 9.095 396 HE3 LYS 53 HE3 LYS 53 -2.736 -3.195 10.148 397 HZ1 LYS 53 HZ1 LYS 53 -4.644 -1.015 10.794 398 HZ2 LYS 53 HZ2 LYS 53 -3.441 -1.551 11.787 399 HZ3 LYS 53 HZ3 LYS 53 -4.699 -2.548 11.396 400 H VAL 54 H VAL 54 1.897 -1.094 5.957 401 HA VAL 54 HA VAL 54 2.149 1.529 4.749 402 HB VAL 54 HB VAL 54 4.283 -0.556 5.425 403 HG11 VAL 54 HG11 VAL 54 4.524 2.440 4.867 404 HG12 VAL 54 HG12 VAL 54 5.840 1.395 5.454 405 HG13 VAL 54 HG13 VAL 54 5.147 1.124 3.846 406 HG21 VAL 54 HG21 VAL 54 4.623 0.879 7.476 407 HG22 VAL 54 HG22 VAL 54 3.151 1.777 7.041 408 HG23 VAL 54 HG23 VAL 54 3.058 0.044 7.444 409 H SER 55 H SER 55 2.904 -1.829 3.711 410 HA SER 55 HA SER 55 4.089 -1.157 1.232 411 HB2 SER 55 HB2 SER 55 2.426 -3.597 1.971 412 HB3 SER 55 HB3 SER 55 3.565 -3.491 0.613 413 HG SER 55 HG SER 55 4.272 -4.431 2.778 414 H ALA 56 H ALA 56 0.655 -1.426 2.109 415 HA ALA 56 HA ALA 56 -0.232 -1.281 -0.670 416 HB1 ALA 56 HB1 ALA 56 -2.390 -1.343 0.204 417 HB2 ALA 56 HB2 ALA 56 -1.447 -2.349 1.310 418 HB3 ALA 56 HB3 ALA 56 -1.887 -0.692 1.784 419 H SER 57 H SER 57 0.187 0.986 2.042 420 HA SER 57 HA SER 57 -1.139 3.185 0.760 421 HB2 SER 57 HB2 SER 57 1.050 3.191 2.887 422 HB3 SER 57 HB3 SER 57 0.001 4.561 2.465 423 HG SER 57 HG SER 57 -0.695 2.092 3.684 424 H GLU 58 H GLU 58 2.094 1.823 0.514 425 HA GLU 58 HA GLU 58 3.464 4.037 -0.615 426 HB2 GLU 58 HB2 GLU 58 3.718 1.098 -0.502 427 HB3 GLU 58 HB3 GLU 58 4.439 1.815 -1.934 428 HG2 GLU 58 HG2 GLU 58 5.069 2.549 0.928 429 HG3 GLU 58 HG3 GLU 58 6.085 1.588 -0.162 430 H ILE 59 H ILE 59 1.168 1.746 -2.055 431 HA ILE 59 HA ILE 59 1.789 2.436 -4.786 432 HB ILE 59 HB ILE 59 -0.750 1.212 -3.626 433 HG12 ILE 59 HG12 ILE 59 1.651 -0.145 -4.904 434 HG13 ILE 59 HG13 ILE 59 1.433 -0.005 -3.160 435 HG21 ILE 59 HG21 ILE 59 0.336 1.283 -6.495 436 HG22 ILE 59 HG22 ILE 59 -1.050 0.307 -5.966 437 HG23 ILE 59 HG23 ILE 59 -1.147 2.070 -5.911 438 HD11 ILE 59 HD11 ILE 59 -0.697 -1.284 -3.353 439 HD12 ILE 59 HD12 ILE 59 -0.327 -1.549 -5.075 440 HD13 ILE 59 HD13 ILE 59 0.760 -2.189 -3.828 441 H LEU 60 H LEU 60 -0.148 3.988 -2.296 442 HA LEU 60 HA LEU 60 -1.777 5.541 -4.107 443 HB2 LEU 60 HB2 LEU 60 -0.871 6.155 -1.279 444 HB3 LEU 60 HB3 LEU 60 -2.125 7.020 -2.152 445 HG LEU 60 HG LEU 60 -2.314 4.055 -1.495 446 HD11 LEU 60 HD11 LEU 60 -3.774 4.712 0.360 447 HD12 LEU 60 HD12 LEU 60 -3.490 6.431 0.001 448 HD13 LEU 60 HD13 LEU 60 -2.154 5.405 0.574 449 HD21 LEU 60 HD21 LEU 60 -4.374 6.105 -2.365 450 HD22 LEU 60 HD22 LEU 60 -4.713 4.422 -1.893 451 HD23 LEU 60 HD23 LEU 60 -3.736 4.753 -3.335 452 H ASN 61 H ASN 61 1.572 5.725 -3.115 453 HA ASN 61 HA ASN 61 1.965 8.535 -3.685 454 HB2 ASN 61 HB2 ASN 61 3.452 6.963 -2.311 455 HB3 ASN 61 HB3 ASN 61 4.052 6.333 -3.852 456 HD21 ASN 61 HD21 ASN 61 4.141 8.902 -1.566 457 HD22 ASN 61 HD22 ASN 61 5.355 9.861 -2.372 458 H VAL 62 H VAL 62 1.555 5.745 -5.706 459 HA VAL 62 HA VAL 62 3.130 6.549 -7.957 460 HB VAL 62 HB VAL 62 0.647 4.772 -7.830 461 HG11 VAL 62 HG11 VAL 62 1.566 3.723 -9.907 462 HG12 VAL 62 HG12 VAL 62 1.055 5.394 -10.158 463 HG13 VAL 62 HG13 VAL 62 2.787 5.014 -9.994 464 HG21 VAL 62 HG21 VAL 62 3.614 4.012 -7.803 465 HG22 VAL 62 HG22 VAL 62 2.590 4.076 -6.352 466 HG23 VAL 62 HG23 VAL 62 2.223 2.919 -7.626 467 H LYS 63 H LYS 63 0.315 7.984 -6.662 468 HA LYS 63 HA LYS 63 -0.909 9.062 -9.003 469 HB2 LYS 63 HB2 LYS 63 -1.632 9.259 -6.565 470 HB3 LYS 63 HB3 LYS 63 -0.421 10.528 -6.390 471 HG2 LYS 63 HG2 LYS 63 -1.564 11.820 -8.172 472 HG3 LYS 63 HG3 LYS 63 -2.795 10.543 -8.280 473 HD2 LYS 63 HD2 LYS 63 -3.315 10.888 -5.883 474 HD3 LYS 63 HD3 LYS 63 -2.126 12.209 -5.837 475 HE2 LYS 63 HE2 LYS 63 -3.410 13.421 -7.572 476 HE3 LYS 63 HE3 LYS 63 -4.593 12.098 -7.627 477 HZ1 LYS 63 HZ1 LYS 63 -4.019 13.782 -5.254 478 HZ2 LYS 63 HZ2 LYS 63 -5.122 12.556 -5.309 479 HZ3 LYS 63 HZ3 LYS 63 -5.349 13.911 -6.222 480 H GLN 64 H GLN 64 2.109 9.855 -7.316 481 HA GLN 64 HA GLN 64 2.515 12.370 -8.667 482 HB2 GLN 64 HB2 GLN 64 4.559 10.509 -7.402 483 HB3 GLN 64 HB3 GLN 64 4.804 12.211 -7.812 484 HG2 GLN 64 HG2 GLN 64 2.922 11.088 -5.698 485 HG3 GLN 64 HG3 GLN 64 4.402 12.011 -5.426 486 HE21 GLN 64 HE21 GLN 64 4.420 14.272 -6.176 487 HE22 GLN 64 HE22 GLN 64 2.917 15.159 -6.188 488 H PHE 65 H PHE 65 2.877 9.084 -9.787 489 HA PHE 65 HA PHE 65 4.936 9.711 -11.760 490 HB2 PHE 65 HB2 PHE 65 4.991 7.468 -11.701 491 HB3 PHE 65 HB3 PHE 65 3.403 7.360 -10.951 492 HD1 PHE 65 HD1 PHE 65 5.244 7.384 -14.155 493 HD2 PHE 65 HD2 PHE 65 1.374 7.077 -12.297 494 HE1 PHE 65 HE1 PHE 65 4.264 6.651 -16.327 495 HE2 PHE 65 HE2 PHE 65 0.395 6.347 -14.459 496 HZ PHE 65 HZ PHE 65 1.827 6.160 -16.484 497 H ILE 66 H ILE 66 1.451 10.114 -11.529 498 HA ILE 66 HA ILE 66 0.782 10.102 -14.288 499 HB ILE 66 HB ILE 66 -0.408 11.842 -12.061 500 HG12 ILE 66 HG12 ILE 66 -0.465 9.442 -11.483 501 HG13 ILE 66 HG13 ILE 66 -2.073 10.108 -11.734 502 HG21 ILE 66 HG21 ILE 66 -1.550 11.060 -14.792 503 HG22 ILE 66 HG22 ILE 66 -2.487 11.833 -13.491 504 HG23 ILE 66 HG23 ILE 66 -1.128 12.692 -14.233 505 HD11 ILE 66 HD11 ILE 66 -1.826 7.823 -12.663 506 HD12 ILE 66 HD12 ILE 66 -2.243 9.005 -13.918 507 HD13 ILE 66 HD13 ILE 66 -0.575 8.411 -13.774 508 H ASP 67 H ASP 67 2.138 12.669 -12.221 509 HA ASP 67 HA ASP 67 2.091 14.673 -14.333 510 HB2 ASP 67 HB2 ASP 67 2.105 15.224 -11.908 511 HB3 ASP 67 HB3 ASP 67 3.727 14.521 -11.775 512 H ARG 68 H ARG 68 4.502 12.413 -13.006 513 HA ARG 68 HA ARG 68 6.714 13.496 -14.501 514 HB2 ARG 68 HB2 ARG 68 6.311 10.812 -13.147 515 HB3 ARG 68 HB3 ARG 68 7.841 11.347 -13.854 516 HG2 ARG 68 HG2 ARG 68 7.889 13.276 -12.331 517 HG3 ARG 68 HG3 ARG 68 6.359 12.756 -11.609 518 HD2 ARG 68 HD2 ARG 68 7.406 10.634 -10.912 519 HD3 ARG 68 HD3 ARG 68 8.944 11.161 -11.618 520 HE ARG 68 HE ARG 68 7.711 12.075 -9.116 521 HH11 ARG 68 HH21 ARG 68 10.200 12.786 -11.525 522 HH12 ARG 68 HH22 ARG 68 11.115 13.774 -10.420 523 HH21 ARG 68 HH11 ARG 68 8.935 13.349 -7.771 524 HH22 ARG 68 HH12 ARG 68 10.402 14.095 -8.341 525 H LYS 69 H LYS 69 4.291 11.091 -15.273 526 HA LYS 69 HA LYS 69 3.826 9.965 -17.220 527 HB2 LYS 69 HB2 LYS 69 5.328 12.335 -18.377 528 HB3 LYS 69 HB3 LYS 69 4.301 11.244 -19.313 529 HG2 LYS 69 HG2 LYS 69 2.329 11.960 -18.224 530 HG3 LYS 69 HG3 LYS 69 3.225 12.622 -16.865 531 HD2 LYS 69 HD2 LYS 69 4.163 14.365 -18.365 532 HD3 LYS 69 HD3 LYS 69 3.022 13.811 -19.620 533 HE2 LYS 69 HE2 LYS 69 1.126 14.284 -18.167 534 HE3 LYS 69 HE3 LYS 69 2.197 14.570 -16.785 535 HZ1 LYS 69 HZ1 LYS 69 1.419 16.631 -17.720 536 HZ2 LYS 69 HZ2 LYS 69 2.073 16.274 -19.196 537 HZ3 LYS 69 HZ3 LYS 69 3.052 16.515 -17.886 538 H ALA 70 H ALA 70 6.012 8.941 -15.869 539 HA ALA 70 HA ALA 70 8.158 8.303 -17.739 540 HB1 ALA 70 HB1 ALA 70 7.429 7.075 -15.034 541 HB2 ALA 70 HB2 ALA 70 8.955 6.832 -15.918 542 HB3 ALA 70 HB3 ALA 70 8.543 8.443 -15.286 543 H TRP 71 H TRP 71 6.253 7.694 -19.288 544 HA TRP 71 HA TRP 71 4.552 5.610 -19.006 545 HB2 TRP 71 HB2 TRP 71 6.070 6.227 -21.548 546 HB3 TRP 71 HB3 TRP 71 4.509 5.438 -21.432 547 HD1 TRP 71 HD1 TRP 71 5.654 8.526 -22.574 548 HE1 TRP 71 HE1 TRP 71 4.069 10.484 -22.266 549 HE3 TRP 71 HE3 TRP 71 2.717 6.503 -18.900 550 HZ2 TRP 71 HZ2 TRP 71 1.756 11.070 -20.716 551 HZ3 TRP 71 HZ3 TRP 71 0.799 7.843 -18.030 552 HH2 TRP 71 HH2 TRP 71 0.336 10.105 -18.950 553 HA PRO 72 HA PRO 72 6.954 2.132 -20.619 554 HB2 PRO 72 HB2 PRO 72 9.622 1.977 -21.025 555 HB3 PRO 72 HB3 PRO 72 8.534 2.765 -22.215 556 HG2 PRO 72 HG2 PRO 72 10.215 4.033 -20.059 557 HG3 PRO 72 HG3 PRO 72 10.111 4.452 -21.798 558 HD2 PRO 72 HD2 PRO 72 8.695 5.776 -19.871 559 HD3 PRO 72 HD3 PRO 72 8.066 5.530 -21.536 560 H SER 73 H SER 73 8.598 3.925 -18.089 561 HA SER 73 HA SER 73 9.946 1.584 -17.003 562 HB2 SER 73 HB2 SER 73 9.686 4.387 -15.869 563 HB3 SER 73 HB3 SER 73 10.927 3.177 -15.472 564 HG SER 73 HG SER 73 11.821 3.444 -17.455 565 H LEU 74 H LEU 74 6.827 2.925 -16.505 566 HA LEU 74 HA LEU 74 6.606 2.851 -13.725 567 HB2 LEU 74 HB2 LEU 74 4.903 3.814 -15.224 568 HB3 LEU 74 HB3 LEU 74 4.484 2.197 -15.799 569 HG LEU 74 HG LEU 74 3.750 1.580 -13.521 570 HD11 LEU 74 HD11 LEU 74 3.365 3.389 -11.834 571 HD12 LEU 74 HD12 LEU 74 4.283 4.507 -12.863 572 HD13 LEU 74 HD13 LEU 74 5.084 3.097 -12.133 573 HD21 LEU 74 HD21 LEU 74 2.419 4.039 -14.577 574 HD22 LEU 74 HD22 LEU 74 1.720 2.842 -13.476 575 HD23 LEU 74 HD23 LEU 74 2.151 2.374 -15.121 576 H GLN 75 H GLN 75 6.135 0.094 -15.961 577 HA GLN 75 HA GLN 75 5.015 -1.708 -14.187 578 HB2 GLN 75 HB2 GLN 75 5.596 -2.027 -16.647 579 HB3 GLN 75 HB3 GLN 75 7.224 -2.422 -16.141 580 HG2 GLN 75 HG2 GLN 75 5.986 -4.462 -16.566 581 HG3 GLN 75 HG3 GLN 75 6.346 -4.350 -14.842 582 HE21 GLN 75 HE21 GLN 75 3.927 -4.861 -17.155 583 HE22 GLN 75 HE22 GLN 75 2.563 -4.831 -16.056 584 H ASN 76 H ASN 76 8.443 -0.738 -14.317 585 HA ASN 76 HA ASN 76 9.306 -2.904 -12.583 586 HB2 ASN 76 HB2 ASN 76 10.816 -1.632 -14.142 587 HB3 ASN 76 HB3 ASN 76 10.643 -0.219 -13.093 588 HD21 ASN 76 HD21 ASN 76 12.271 0.058 -11.738 589 HD22 ASN 76 HD22 ASN 76 13.229 -1.221 -11.036 590 H ASP 77 H ASP 77 8.706 0.587 -12.098 591 HA ASP 77 HA ASP 77 9.331 0.587 -9.307 592 HB2 ASP 77 HB2 ASP 77 9.295 2.557 -10.878 593 HB3 ASP 77 HB3 ASP 77 7.528 2.463 -10.884 594 H LEU 78 H LEU 78 6.295 0.214 -11.113 595 HA LEU 78 HA LEU 78 4.624 0.375 -8.780 596 HB2 LEU 78 HB2 LEU 78 3.988 0.865 -11.144 597 HB3 LEU 78 HB3 LEU 78 4.068 -0.855 -11.497 598 HG LEU 78 HG LEU 78 2.207 -1.268 -9.970 599 HD11 LEU 78 HD11 LEU 78 2.288 1.715 -9.529 600 HD12 LEU 78 HD12 LEU 78 2.429 0.430 -8.309 601 HD13 LEU 78 HD13 LEU 78 0.883 0.704 -9.134 602 HD21 LEU 78 HD21 LEU 78 1.664 0.978 -11.946 603 HD22 LEU 78 HD22 LEU 78 0.472 -0.189 -11.336 604 HD23 LEU 78 HD23 LEU 78 1.810 -0.747 -12.358 605 H ARG 79 H ARG 79 6.016 -2.388 -10.634 606 HA ARG 79 HA ARG 79 4.529 -4.306 -9.049 607 HB2 ARG 79 HB2 ARG 79 6.861 -4.578 -10.941 608 HB3 ARG 79 HB3 ARG 79 6.280 -5.937 -9.971 609 HG2 ARG 79 HG2 ARG 79 3.989 -5.576 -10.902 610 HG3 ARG 79 HG3 ARG 79 4.677 -4.375 -12.006 611 HD2 ARG 79 HD2 ARG 79 6.134 -6.062 -12.993 612 HD3 ARG 79 HD3 ARG 79 5.609 -7.252 -11.785 613 HE ARG 79 HE ARG 79 3.401 -6.168 -13.358 614 HH11 ARG 79 HH11 ARG 79 5.918 -8.653 -13.339 615 HH12 ARG 79 HH12 ARG 79 5.024 -9.692 -14.415 616 HH21 ARG 79 HH21 ARG 79 2.317 -7.550 -14.708 617 HH22 ARG 79 HH22 ARG 79 3.034 -9.077 -15.178 618 H LEU 80 H LEU 80 7.525 -2.575 -8.456 619 HA LEU 80 HA LEU 80 8.616 -4.414 -6.543 620 HB2 LEU 80 HB2 LEU 80 8.675 -1.399 -6.809 621 HB3 LEU 80 HB3 LEU 80 9.397 -2.194 -5.417 622 HG LEU 80 HG LEU 80 10.221 -2.788 -8.272 623 HD11 LEU 80 HD11 LEU 80 12.134 -1.309 -7.857 624 HD12 LEU 80 HD12 LEU 80 11.495 -0.904 -6.247 625 HD13 LEU 80 HD13 LEU 80 10.612 -0.410 -7.711 626 HD21 LEU 80 HD21 LEU 80 12.261 -3.683 -7.167 627 HD22 LEU 80 HD22 LEU 80 10.800 -4.565 -6.687 628 HD23 LEU 80 HD23 LEU 80 11.522 -3.373 -5.577 629 H ARG 81 H ARG 81 6.258 -1.738 -6.237 630 HA ARG 81 HA ARG 81 5.794 -2.152 -3.436 631 HB2 ARG 81 HB2 ARG 81 4.074 -0.858 -5.568 632 HB3 ARG 81 HB3 ARG 81 3.768 -0.771 -3.826 633 HG2 ARG 81 HG2 ARG 81 5.905 0.365 -3.480 634 HG3 ARG 81 HG3 ARG 81 6.266 0.259 -5.216 635 HD2 ARG 81 HD2 ARG 81 4.346 1.649 -5.742 636 HD3 ARG 81 HD3 ARG 81 3.857 1.656 -4.043 637 HE ARG 81 HE ARG 81 5.566 3.170 -3.504 638 HH11 ARG 81 HH11 ARG 81 5.888 2.204 -6.897 639 HH12 ARG 81 HH12 ARG 81 6.998 3.503 -7.256 640 HH21 ARG 81 HH21 ARG 81 6.968 4.753 -4.019 641 HH22 ARG 81 HH22 ARG 81 7.602 4.916 -5.648 642 H ALA 82 H ALA 82 4.161 -3.382 -6.349 643 HA ALA 82 HA ALA 82 2.038 -4.701 -4.971 644 HB1 ALA 82 HB1 ALA 82 3.402 -5.503 -7.580 645 HB2 ALA 82 HB2 ALA 82 1.787 -6.002 -7.039 646 HB3 ALA 82 HB3 ALA 82 2.100 -4.297 -7.433 647 H SER 83 H SER 83 5.396 -5.663 -5.684 648 HA SER 83 HA SER 83 5.084 -8.405 -4.919 649 HB2 SER 83 HB2 SER 83 7.564 -6.648 -4.879 650 HB3 SER 83 HB3 SER 83 7.544 -8.419 -4.752 651 HG SER 83 HG SER 83 6.737 -6.798 -6.946 652 H TYR 84 H TYR 84 5.819 -5.438 -3.045 653 HA TYR 84 HA TYR 84 6.630 -6.807 -0.675 654 HB2 TYR 84 HB2 TYR 84 5.123 -4.176 -0.833 655 HB3 TYR 84 HB3 TYR 84 6.106 -4.751 0.514 656 HD1 TYR 84 HD1 TYR 84 8.469 -5.824 -1.300 657 HD2 TYR 84 HD2 TYR 84 6.297 -2.102 -1.172 658 HE1 TYR 84 HE1 TYR 84 10.416 -4.641 -2.313 659 HE2 TYR 84 HE2 TYR 84 8.259 -0.937 -2.182 660 HH TYR 84 HH TYR 84 10.383 -1.141 -2.994 661 H LEU 85 H LEU 85 3.397 -5.774 -1.851 662 HA LEU 85 HA LEU 85 1.948 -6.740 0.444 663 HB2 LEU 85 HB2 LEU 85 1.099 -6.620 -2.482 664 HB3 LEU 85 HB3 LEU 85 0.009 -6.911 -1.122 665 HG LEU 85 HG LEU 85 1.687 -4.452 -1.492 666 HD11 LEU 85 HD11 LEU 85 -0.495 -3.375 -2.097 667 HD12 LEU 85 HD12 LEU 85 -1.239 -4.988 -2.123 668 HD13 LEU 85 HD13 LEU 85 0.055 -4.582 -3.276 669 HD21 LEU 85 HD21 LEU 85 0.119 -3.540 0.240 670 HD22 LEU 85 HD22 LEU 85 1.052 -4.895 0.864 671 HD23 LEU 85 HD23 LEU 85 -0.644 -5.128 0.379 672 H ARG 86 H ARG 86 2.895 -8.145 -2.638 673 HA ARG 86 HA ARG 86 1.502 -10.590 -2.268 674 HB2 ARG 86 HB2 ARG 86 2.539 -9.937 -4.412 675 HB3 ARG 86 HB3 ARG 86 4.140 -10.197 -3.722 676 HG2 ARG 86 HG2 ARG 86 3.540 -12.081 -5.133 677 HG3 ARG 86 HG3 ARG 86 3.651 -12.619 -3.456 678 HD2 ARG 86 HD2 ARG 86 0.981 -11.877 -4.710 679 HD3 ARG 86 HD3 ARG 86 1.676 -13.497 -4.887 680 HE ARG 86 HE ARG 86 1.717 -12.791 -2.130 681 HH11 ARG 86 HH11 ARG 86 -0.702 -13.632 -4.588 682 HH12 ARG 86 HH12 ARG 86 -1.816 -14.239 -3.382 683 HH21 ARG 86 HH21 ARG 86 0.241 -13.564 -0.699 684 HH22 ARG 86 HH22 ARG 86 -1.291 -14.225 -1.248 685 H TYR 87 H TYR 87 4.783 -9.673 -1.117 686 HA TYR 87 HA TYR 87 5.249 -12.274 0.069 687 HB2 TYR 87 HB2 TYR 87 6.457 -9.592 0.832 688 HB3 TYR 87 HB3 TYR 87 7.096 -11.188 1.237 689 HD1 TYR 87 HD2 TYR 87 6.834 -12.619 -1.410 690 HD2 TYR 87 HD1 TYR 87 8.130 -8.608 -0.516 691 HE1 TYR 87 HE2 TYR 87 8.160 -12.565 -3.521 692 HE2 TYR 87 HE1 TYR 87 9.451 -8.574 -2.633 693 HH TYR 87 HH TYR 87 10.064 -9.728 -4.515 694 H ASP 88 H ASP 88 4.030 -9.144 1.374 695 HA ASP 88 HA ASP 88 3.974 -10.011 4.091 696 HB2 ASP 88 HB2 ASP 88 2.381 -7.886 2.605 697 HB3 ASP 88 HB3 ASP 88 2.272 -8.137 4.355 698 H LEU 89 H LEU 89 1.362 -9.875 1.629 699 HA LEU 89 HA LEU 89 -0.640 -10.940 3.387 700 HB2 LEU 89 HB2 LEU 89 -0.350 -10.532 0.437 701 HB3 LEU 89 HB3 LEU 89 -1.602 -11.625 0.984 702 HG LEU 89 HG LEU 89 -2.435 -9.364 0.500 703 HD11 LEU 89 HD11 LEU 89 -3.830 -9.168 2.477 704 HD12 LEU 89 HD12 LEU 89 -2.679 -10.123 3.435 705 HD13 LEU 89 HD13 LEU 89 -3.574 -10.879 2.092 706 HD21 LEU 89 HD21 LEU 89 -0.889 -8.442 2.949 707 HD22 LEU 89 HD22 LEU 89 -2.003 -7.480 1.952 708 HD23 LEU 89 HD23 LEU 89 -0.471 -8.049 1.264 709 H LYS 90 H LYS 90 1.791 -12.465 1.322 710 HA LYS 90 HA LYS 90 0.606 -15.083 1.285 711 HB2 LYS 90 HB2 LYS 90 2.519 -14.470 -0.167 712 HB3 LYS 90 HB3 LYS 90 3.532 -14.220 1.250 713 HG2 LYS 90 HG2 LYS 90 4.218 -16.296 0.429 714 HG3 LYS 90 HG3 LYS 90 3.169 -16.704 1.782 715 HD2 LYS 90 HD2 LYS 90 2.375 -18.176 0.193 716 HD3 LYS 90 HD3 LYS 90 1.291 -16.805 -0.088 717 HE2 LYS 90 HE2 LYS 90 2.084 -17.582 -2.237 718 HE3 LYS 90 HE3 LYS 90 2.859 -16.021 -1.907 719 HZ1 LYS 90 HZ1 LYS 90 4.846 -17.231 -1.201 720 HZ2 LYS 90 HZ2 LYS 90 4.450 -17.646 -2.748 721 HZ3 LYS 90 HZ3 LYS 90 4.123 -18.681 -1.507 722 H THR 91 H THR 91 2.595 -13.281 3.605 723 HA THR 91 HA THR 91 2.982 -15.562 5.353 724 HB THR 91 HB THR 91 3.276 -12.605 6.048 725 HG1 THR 91 HG1 THR 91 4.551 -12.861 4.279 726 HG21 THR 91 HG21 THR 91 3.460 -14.252 7.917 727 HG22 THR 91 HG22 THR 91 4.986 -13.413 7.586 728 HG23 THR 91 HG23 THR 91 4.751 -15.081 7.022 729 H VAL 92 H VAL 92 0.833 -12.655 5.389 730 HA VAL 92 HA VAL 92 -0.354 -13.140 7.898 731 HB VAL 92 HB VAL 92 -1.661 -11.900 5.421 732 HG11 VAL 92 HG11 VAL 92 -2.486 -11.898 8.363 733 HG12 VAL 92 HG12 VAL 92 -3.115 -10.743 7.176 734 HG13 VAL 92 HG13 VAL 92 -3.436 -12.468 6.969 735 HG21 VAL 92 HG21 VAL 92 0.396 -10.739 6.195 736 HG22 VAL 92 HG22 VAL 92 -1.055 -9.760 6.419 737 HG23 VAL 92 HG23 VAL 92 -0.317 -10.592 7.809 738 H ILE 93 H ILE 93 -1.417 -14.410 4.692 739 HA ILE 93 HA ILE 93 -3.871 -15.441 5.670 740 HB ILE 93 HB ILE 93 -3.805 -17.037 3.780 741 HG12 ILE 93 HG12 ILE 93 -1.119 -15.832 3.108 742 HG13 ILE 93 HG13 ILE 93 -1.352 -17.437 3.785 743 HG21 ILE 93 HG21 ILE 93 -4.656 -14.702 3.555 744 HG22 ILE 93 HG22 ILE 93 -3.060 -14.193 2.974 745 HG23 ILE 93 HG23 ILE 93 -4.033 -15.341 2.028 746 HD11 ILE 93 HD11 ILE 93 -2.224 -16.457 1.049 747 HD12 ILE 93 HD12 ILE 93 -0.996 -17.682 1.432 748 HD13 ILE 93 HD13 ILE 93 -2.714 -18.024 1.741 749 H SER 94 H SER 94 -0.662 -16.662 6.214 750 HA SER 94 HA SER 94 -1.349 -19.414 6.512 751 HB2 SER 94 HB2 SER 94 0.794 -17.783 7.881 752 HB3 SER 94 HB3 SER 94 0.752 -19.555 7.738 753 HG SER 94 HG SER 94 1.382 -17.609 5.859 754 H ALA 95 H ALA 95 -1.788 -16.625 8.611 755 HA ALA 95 HA ALA 95 -2.382 -18.312 10.961 756 HB1 ALA 95 HB1 ALA 95 -1.153 -16.197 11.249 757 HB2 ALA 95 HB2 ALA 95 -2.504 -15.292 10.531 758 HB3 ALA 95 HB3 ALA 95 -2.714 -16.128 12.088 759 H LYS 96 H LYS 96 -4.107 -17.829 8.251 760 HA LYS 96 HA LYS 96 -6.657 -17.256 9.700 761 HB2 LYS 96 HB2 LYS 96 -5.753 -16.730 6.861 762 HB3 LYS 96 HB3 LYS 96 -7.450 -16.682 7.320 763 HG2 LYS 96 HG2 LYS 96 -5.329 -14.967 8.679 764 HG3 LYS 96 HG3 LYS 96 -6.269 -14.443 7.273 765 HD2 LYS 96 HD2 LYS 96 -8.361 -14.949 8.573 766 HD3 LYS 96 HD3 LYS 96 -7.360 -15.193 10.009 767 HE2 LYS 96 HE2 LYS 96 -6.582 -12.869 9.886 768 HE3 LYS 96 HE3 LYS 96 -7.464 -12.633 8.359 769 HZ1 LYS 96 HZ1 LYS 96 -9.539 -13.050 9.539 770 HZ2 LYS 96 HZ2 LYS 96 -8.734 -11.782 10.235 771 HZ3 LYS 96 HZ3 LYS 96 -8.735 -13.263 10.967 772 HA PRO 97 HA PRO 97 -8.052 -21.316 8.742 773 HB2 PRO 97 HB2 PRO 97 -10.763 -20.988 8.636 774 HB3 PRO 97 HB3 PRO 97 -9.844 -20.829 10.166 775 HG2 PRO 97 HG2 PRO 97 -10.723 -18.670 8.271 776 HG3 PRO 97 HG3 PRO 97 -11.003 -18.799 10.037 777 HD2 PRO 97 HD2 PRO 97 -8.982 -17.328 9.075 778 HD3 PRO 97 HD3 PRO 97 -8.751 -18.342 10.541 779 H LYS 98 H LYS 98 -9.417 -22.558 7.129 780 HA LYS 98 HA LYS 98 -8.448 -22.212 4.580 781 HB2 LYS 98 HB2 LYS 98 -9.587 -24.232 5.533 782 HB3 LYS 98 HB3 LYS 98 -11.136 -23.424 5.309 783 HG2 LYS 98 HG2 LYS 98 -10.972 -24.898 3.496 784 HG3 LYS 98 HG3 LYS 98 -10.566 -23.325 2.797 785 HD2 LYS 98 HD2 LYS 98 -8.156 -23.892 2.925 786 HD3 LYS 98 HD3 LYS 98 -8.569 -25.448 3.685 787 HE2 LYS 98 HE2 LYS 98 -9.929 -26.024 1.654 788 HE3 LYS 98 HE3 LYS 98 -9.356 -24.531 0.886 789 HZ1 LYS 98 HZ1 LYS 98 -7.631 -26.781 1.777 790 HZ2 LYS 98 HZ2 LYS 98 -7.093 -25.399 1.053 791 HZ3 LYS 98 HZ3 LYS 98 -8.047 -26.455 0.217 792 H ASP 99 H ASP 99 -11.663 -20.974 5.647 793 HA ASP 99 HA ASP 99 -12.356 -20.080 3.007 794 HB2 ASP 99 HB2 ASP 99 -14.012 -20.545 4.774 795 HB3 ASP 99 HB3 ASP 99 -13.404 -19.163 5.701 796 H GLU 100 H GLU 100 -11.193 -18.240 5.898 797 HA GLU 100 HA GLU 100 -11.190 -15.733 4.524 798 HB2 GLU 100 HB2 GLU 100 -9.605 -16.719 6.911 799 HB3 GLU 100 HB3 GLU 100 -9.547 -15.059 6.307 800 HG2 GLU 100 HG2 GLU 100 -12.064 -14.993 6.614 801 HG3 GLU 100 HG3 GLU 100 -11.895 -16.510 7.525 802 H LYS 101 H LYS 101 -8.833 -18.344 4.819 803 HA LYS 101 HA LYS 101 -6.572 -17.033 3.675 804 HB2 LYS 101 HB2 LYS 101 -6.566 -19.206 4.832 805 HB3 LYS 101 HB3 LYS 101 -7.490 -19.929 3.528 806 HG2 LYS 101 HG2 LYS 101 -5.665 -19.796 2.001 807 HG3 LYS 101 HG3 LYS 101 -4.730 -18.768 3.099 808 HD2 LYS 101 HD2 LYS 101 -5.610 -21.581 3.863 809 HD3 LYS 101 HD3 LYS 101 -4.072 -21.259 3.034 810 HE2 LYS 101 HE2 LYS 101 -3.338 -19.806 4.848 811 HE3 LYS 101 HE3 LYS 101 -4.891 -19.960 5.660 812 HZ1 LYS 101 HZ1 LYS 101 -4.399 -22.274 6.075 813 HZ2 LYS 101 HZ2 LYS 101 -3.242 -21.293 6.712 814 HZ3 LYS 101 HZ3 LYS 101 -2.932 -22.137 5.327 815 H LYS 102 H LYS 102 -9.398 -18.653 2.182 816 HA LYS 102 HA LYS 102 -8.380 -18.324 -0.532 817 HB2 LYS 102 HB2 LYS 102 -10.050 -20.059 -0.031 818 HB3 LYS 102 HB3 LYS 102 -11.154 -18.850 0.611 819 HG2 LYS 102 HG2 LYS 102 -12.123 -19.091 -1.414 820 HG3 LYS 102 HG3 LYS 102 -10.953 -17.849 -1.855 821 HD2 LYS 102 HD2 LYS 102 -9.388 -19.777 -2.516 822 HD3 LYS 102 HD3 LYS 102 -10.821 -20.817 -2.382 823 HE2 LYS 102 HE2 LYS 102 -10.322 -18.498 -4.274 824 HE3 LYS 102 HE3 LYS 102 -10.695 -20.177 -4.683 825 HZ1 LYS 102 HZ1 LYS 102 -12.954 -19.781 -3.811 826 HZ2 LYS 102 HZ2 LYS 102 -12.591 -18.713 -5.023 827 HZ3 LYS 102 HZ3 LYS 102 -12.563 -18.208 -3.463 828 H SER 103 H SER 103 -10.853 -16.605 1.441 829 HA SER 103 HA SER 103 -11.550 -14.716 -0.528 830 HB2 SER 103 HB2 SER 103 -12.783 -15.077 1.583 831 HB3 SER 103 HB3 SER 103 -11.440 -14.365 2.495 832 HG SER 103 HG SER 103 -13.072 -13.075 0.553 833 H LEU 104 H LEU 104 -8.958 -14.510 1.960 834 HA LEU 104 HA LEU 104 -8.127 -11.865 1.222 835 HB2 LEU 104 HB2 LEU 104 -6.886 -14.177 2.682 836 HB3 LEU 104 HB3 LEU 104 -5.857 -12.838 2.184 837 HG LEU 104 HG LEU 104 -8.351 -12.406 3.843 838 HD11 LEU 104 HD11 LEU 104 -5.501 -12.816 4.814 839 HD12 LEU 104 HD12 LEU 104 -6.859 -13.948 5.039 840 HD13 LEU 104 HD13 LEU 104 -6.899 -12.349 5.812 841 HD21 LEU 104 HD21 LEU 104 -7.117 -10.318 4.482 842 HD22 LEU 104 HD22 LEU 104 -7.477 -10.395 2.746 843 HD23 LEU 104 HD23 LEU 104 -5.838 -10.752 3.331 844 H GLN 105 H GLN 105 -7.124 -15.123 0.031 845 HA GLN 105 HA GLN 105 -4.928 -14.123 -1.523 846 HB2 GLN 105 HB2 GLN 105 -6.668 -16.586 -1.665 847 HB3 GLN 105 HB3 GLN 105 -5.490 -16.251 -2.935 848 HG2 GLN 105 HG2 GLN 105 -4.597 -16.225 -0.070 849 HG3 GLN 105 HG3 GLN 105 -4.862 -17.767 -0.900 850 HE21 GLN 105 HE21 GLN 105 -3.406 -18.504 -2.338 851 HE22 GLN 105 HE22 GLN 105 -1.949 -17.647 -2.777 852 H GLU 106 H GLU 106 -8.404 -14.545 -2.264 853 HA GLU 106 HA GLU 106 -8.086 -13.883 -5.049 854 HB2 GLU 106 HB2 GLU 106 -10.465 -13.852 -3.173 855 HB3 GLU 106 HB3 GLU 106 -10.583 -13.472 -4.901 856 HG2 GLU 106 HG2 GLU 106 -9.676 -15.670 -5.473 857 HG3 GLU 106 HG3 GLU 106 -9.503 -16.068 -3.759 858 H LEU 107 H LEU 107 -8.838 -11.895 -2.140 859 HA LEU 107 HA LEU 107 -9.194 -9.509 -3.726 860 HB2 LEU 107 HB2 LEU 107 -9.340 -10.256 -0.964 861 HB3 LEU 107 HB3 LEU 107 -8.309 -8.826 -1.101 862 HG LEU 107 HG LEU 107 -11.045 -9.069 -2.386 863 HD11 LEU 107 HD11 LEU 107 -11.262 -9.197 0.038 864 HD12 LEU 107 HD12 LEU 107 -11.866 -7.641 -0.562 865 HD13 LEU 107 HD13 LEU 107 -10.273 -7.726 0.226 866 HD21 LEU 107 HD21 LEU 107 -9.346 -6.605 -1.827 867 HD22 LEU 107 HD22 LEU 107 -10.916 -6.648 -2.648 868 HD23 LEU 107 HD23 LEU 107 -9.498 -7.379 -3.413 869 H THR 108 H THR 108 -6.404 -11.001 -2.120 870 HA THR 108 HA THR 108 -4.515 -8.898 -2.534 871 HB THR 108 HB THR 108 -4.032 -11.936 -2.634 872 HG1 THR 108 HG1 THR 108 -5.029 -11.290 -0.690 873 HG21 THR 108 HG21 THR 108 -1.784 -11.331 -1.722 874 HG22 THR 108 HG22 THR 108 -2.165 -9.616 -2.026 875 HG23 THR 108 HG23 THR 108 -2.059 -10.758 -3.386 876 H SER 109 H SER 109 -5.685 -11.559 -4.630 877 HA SER 109 HA SER 109 -3.937 -10.877 -6.828 878 HB2 SER 109 HB2 SER 109 -5.035 -13.112 -6.419 879 HB3 SER 109 HB3 SER 109 -6.571 -12.387 -6.934 880 HG SER 109 HG SER 109 -5.407 -11.805 -8.917 881 H LYS 110 H LYS 110 -7.259 -9.909 -5.913 882 HA LYS 110 HA LYS 110 -8.033 -8.784 -8.409 883 HB2 LYS 110 HB2 LYS 110 -9.469 -9.170 -6.300 884 HB3 LYS 110 HB3 LYS 110 -8.789 -7.655 -5.692 885 HG2 LYS 110 HG2 LYS 110 -9.633 -6.645 -7.953 886 HG3 LYS 110 HG3 LYS 110 -10.634 -8.096 -8.052 887 HD2 LYS 110 HD2 LYS 110 -10.661 -6.060 -5.778 888 HD3 LYS 110 HD3 LYS 110 -11.839 -6.148 -7.088 889 HE2 LYS 110 HE2 LYS 110 -12.467 -8.445 -6.299 890 HE3 LYS 110 HE3 LYS 110 -11.359 -8.224 -4.921 891 HZ1 LYS 110 HZ1 LYS 110 -12.666 -6.171 -4.383 892 HZ2 LYS 110 HZ2 LYS 110 -13.537 -7.559 -4.230 893 HZ3 LYS 110 HZ3 LYS 110 -13.756 -6.588 -5.541 894 H LEU 111 H LEU 111 -6.215 -7.430 -5.671 895 HA LEU 111 HA LEU 111 -6.065 -4.762 -6.618 896 HB2 LEU 111 HB2 LEU 111 -5.501 -5.633 -4.346 897 HB3 LEU 111 HB3 LEU 111 -4.009 -6.297 -4.992 898 HG LEU 111 HG LEU 111 -4.555 -3.349 -5.291 899 HD11 LEU 111 HD11 LEU 111 -5.099 -3.833 -2.957 900 HD12 LEU 111 HD12 LEU 111 -3.547 -2.976 -3.057 901 HD13 LEU 111 HD13 LEU 111 -3.574 -4.731 -2.762 902 HD21 LEU 111 HD21 LEU 111 -2.032 -4.992 -4.827 903 HD22 LEU 111 HD22 LEU 111 -2.092 -3.220 -4.969 904 HD23 LEU 111 HD23 LEU 111 -2.536 -4.229 -6.352 905 H PHE 112 H PHE 112 -3.952 -7.581 -7.258 906 HA PHE 112 HA PHE 112 -2.038 -6.048 -8.735 907 HB2 PHE 112 HB2 PHE 112 -2.619 -9.014 -8.886 908 HB3 PHE 112 HB3 PHE 112 -1.162 -8.203 -9.471 909 HD1 PHE 112 HD2 PHE 112 -0.767 -6.257 -7.104 910 HD2 PHE 112 HD1 PHE 112 -1.673 -10.463 -7.268 911 HE1 PHE 112 HE2 PHE 112 0.243 -6.556 -4.859 912 HE2 PHE 112 HE1 PHE 112 -0.652 -10.760 -5.027 913 HZ PHE 112 HZ PHE 112 0.300 -8.806 -3.809 914 H SER 113 H SER 113 -5.165 -7.265 -9.673 915 HA SER 113 HA SER 113 -4.644 -7.384 -12.511 916 HB2 SER 113 HB2 SER 113 -6.676 -8.343 -11.428 917 HB3 SER 113 HB3 SER 113 -7.229 -6.698 -11.048 918 HG SER 113 HG SER 113 -8.123 -7.585 -13.002 919 H SER 114 H SER 114 -5.688 -4.795 -10.256 920 HA SER 114 HA SER 114 -5.971 -2.801 -12.317 921 HB2 SER 114 HB2 SER 114 -5.418 -2.469 -9.342 922 HB3 SER 114 HB3 SER 114 -5.989 -1.201 -10.447 923 HG SER 114 HG SER 114 -7.884 -2.384 -10.761 924 H ILE 115 H ILE 115 -3.250 -4.009 -10.431 925 HA ILE 115 HA ILE 115 -1.448 -1.843 -10.871 926 HB ILE 115 HB ILE 115 -1.016 -4.824 -10.391 927 HG12 ILE 115 HG12 ILE 115 -1.962 -3.501 -8.542 928 HG13 ILE 115 HG13 ILE 115 -0.402 -4.212 -8.159 929 HG21 ILE 115 HG21 ILE 115 1.088 -2.731 -10.871 930 HG22 ILE 115 HG22 ILE 115 1.423 -4.144 -9.852 931 HG23 ILE 115 HG23 ILE 115 0.956 -4.356 -11.552 932 HD11 ILE 115 HD11 ILE 115 -0.811 -1.290 -8.928 933 HD12 ILE 115 HD12 ILE 115 -0.671 -1.907 -7.273 934 HD13 ILE 115 HD13 ILE 115 0.706 -2.045 -8.381 935 H ASP 116 H ASP 116 -1.905 -4.891 -12.785 936 HA ASP 116 HA ASP 116 0.093 -4.034 -14.690 937 HB2 ASP 116 HB2 ASP 116 -1.931 -6.245 -14.559 938 HB3 ASP 116 HB3 ASP 116 -1.202 -5.846 -16.125 939 H ASN 117 H ASN 117 -3.428 -3.587 -14.495 940 HA ASN 117 HA ASN 117 -3.683 -2.645 -17.211 941 HB2 ASN 117 HB2 ASN 117 -5.344 -2.196 -14.716 942 HB3 ASN 117 HB3 ASN 117 -5.753 -1.493 -16.284 943 HD21 ASN 117 HD21 ASN 117 -7.112 -3.536 -14.585 944 HD22 ASN 117 HD22 ASN 117 -7.359 -4.888 -15.659 945 H LEU 118 H LEU 118 -2.762 -1.082 -14.156 946 HA LEU 118 HA LEU 118 -2.911 1.618 -15.117 947 HB2 LEU 118 HB2 LEU 118 -2.450 0.416 -12.736 948 HB3 LEU 118 HB3 LEU 118 -0.808 0.875 -13.142 949 HG LEU 118 HG LEU 118 -3.143 2.802 -12.951 950 HD11 LEU 118 HD11 LEU 118 -1.017 2.072 -10.899 951 HD12 LEU 118 HD12 LEU 118 -2.754 1.697 -10.806 952 HD13 LEU 118 HD13 LEU 118 -2.206 3.384 -10.733 953 HD21 LEU 118 HD21 LEU 118 -1.525 4.562 -12.830 954 HD22 LEU 118 HD22 LEU 118 -1.186 3.612 -14.290 955 HD23 LEU 118 HD23 LEU 118 -0.183 3.403 -12.839 956 H ASP 119 H ASP 119 -0.362 -0.905 -15.258 957 HA ASP 119 HA ASP 119 1.602 0.874 -16.430 958 HB2 ASP 119 HB2 ASP 119 2.205 -1.255 -15.311 959 HB3 ASP 119 HB3 ASP 119 1.434 -2.137 -16.643 960 H HIS 120 H HIS 120 -0.919 -1.248 -17.819 961 HA HIS 120 HA HIS 120 0.031 -0.934 -20.533 962 HB2 HIS 120 HB2 HIS 120 -2.657 -1.645 -19.334 963 HB3 HIS 120 HB3 HIS 120 -2.443 -1.423 -21.076 964 HD1 HIS 120 HD1 HIS 120 -1.223 -3.699 -18.253 965 HD2 HIS 120 HD2 HIS 120 -1.312 -3.496 -22.421 966 HE1 HIS 120 HE1 HIS 120 -0.440 -5.943 -19.123 967 H ALA 121 H ALA 121 -2.186 0.913 -18.426 968 HA ALA 121 HA ALA 121 -2.941 2.823 -20.428 969 HB1 ALA 121 HB1 ALA 121 -2.760 3.069 -17.408 970 HB2 ALA 121 HB2 ALA 121 -3.571 4.217 -18.494 971 HB3 ALA 121 HB3 ALA 121 -4.178 2.553 -18.351 972 H ALA 122 H ALA 122 -0.173 2.571 -18.211 973 HA ALA 122 HA ALA 122 0.869 5.189 -18.742 974 HB1 ALA 122 HB1 ALA 122 2.386 2.652 -17.968 975 HB2 ALA 122 HB2 ALA 122 2.947 4.321 -17.770 976 HB3 ALA 122 HB3 ALA 122 1.565 3.730 -16.824 977 H LYS 123 H LYS 123 1.488 1.964 -20.220 978 HA LYS 123 HA LYS 123 3.472 3.024 -22.028 979 HB2 LYS 123 HB2 LYS 123 1.931 0.438 -21.862 980 HB3 LYS 123 HB3 LYS 123 3.045 0.776 -23.203 981 HG2 LYS 123 HG2 LYS 123 4.888 1.104 -21.683 982 HG3 LYS 123 HG3 LYS 123 3.820 0.946 -20.279 983 HD2 LYS 123 HD2 LYS 123 3.431 -1.372 -20.727 984 HD3 LYS 123 HD3 LYS 123 4.230 -1.263 -22.313 985 HE2 LYS 123 HE2 LYS 123 5.711 -2.286 -20.609 986 HE3 LYS 123 HE3 LYS 123 6.373 -0.767 -21.246 987 HZ1 LYS 123 HZ1 LYS 123 6.586 -0.788 -18.880 988 HZ2 LYS 123 HZ2 LYS 123 4.975 -1.118 -18.660 989 HZ3 LYS 123 HZ3 LYS 123 5.445 0.338 -19.265 990 H ILE 124 H ILE 124 -0.032 2.793 -22.245 991 HA ILE 124 HA ILE 124 0.061 3.459 -25.113 992 HB ILE 124 HB ILE 124 -1.792 2.065 -23.832 993 HG12 ILE 124 HG12 ILE 124 -3.502 2.909 -25.541 994 HG13 ILE 124 HG13 ILE 124 -2.272 4.067 -26.053 995 HG21 ILE 124 HG21 ILE 124 -3.763 3.330 -23.194 996 HG22 ILE 124 HG22 ILE 124 -2.385 3.896 -22.246 997 HG23 ILE 124 HG23 ILE 124 -2.970 4.865 -23.613 998 HD11 ILE 124 HD11 ILE 124 -0.753 2.222 -26.668 999 HD12 ILE 124 HD12 ILE 124 -1.928 1.031 -26.056 1000 HD13 ILE 124 HD13 ILE 124 -2.320 2.024 -27.478 1001 H LYS 125 H LYS 125 0.638 5.048 -22.298 1002 HA LYS 125 HA LYS 125 1.163 7.173 -21.801 1003 HB2 LYS 125 HB2 LYS 125 0.734 7.899 -24.706 1004 HB3 LYS 125 HB3 LYS 125 1.756 8.721 -23.523 1005 HG2 LYS 125 HG2 LYS 125 3.216 6.718 -23.410 1006 HG3 LYS 125 HG3 LYS 125 2.193 5.919 -24.610 1007 HD2 LYS 125 HD2 LYS 125 2.671 7.760 -26.201 1008 HD3 LYS 125 HD3 LYS 125 3.834 8.419 -25.023 1009 HE2 LYS 125 HE2 LYS 125 5.111 6.326 -25.079 1010 HE3 LYS 125 HE3 LYS 125 3.908 5.593 -26.158 1011 HZ1 LYS 125 HZ1 LYS 125 4.480 7.244 -27.825 1012 HZ2 LYS 125 HZ2 LYS 125 5.822 6.394 -27.387 1013 HZ3 LYS 125 HZ3 LYS 125 5.601 7.931 -26.829 1014 H SER 126 H SER 126 -1.666 6.357 -21.729 1015 HA SER 126 HA SER 126 -3.006 8.997 -22.068 1016 HB2 SER 126 HB2 SER 126 -4.087 6.234 -21.448 1017 HB3 SER 126 HB3 SER 126 -5.072 7.711 -21.551 1018 HG SER 126 HG SER 126 -4.966 6.467 -23.524 1019 HA PRO 127 HA PRO 127 -1.968 9.059 -17.667 1020 HB2 PRO 127 HB2 PRO 127 -2.634 11.675 -17.118 1021 HB3 PRO 127 HB3 PRO 127 -1.074 11.192 -17.848 1022 HG2 PRO 127 HG2 PRO 127 -3.568 12.175 -19.214 1023 HG3 PRO 127 HG3 PRO 127 -1.873 12.724 -19.421 1024 HD2 PRO 127 HD2 PRO 127 -2.982 10.983 -21.142 1025 HD3 PRO 127 HD3 PRO 127 -1.274 10.787 -20.615 1026 H THR 128 H THR 128 -4.991 10.332 -19.128 1027 HA THR 128 HA THR 128 -6.473 10.318 -16.697 1028 HB THR 128 HB THR 128 -7.934 9.798 -19.226 1029 HG1 THR 128 HG1 THR 128 -6.537 12.242 -18.901 1030 HG21 THR 128 HG21 THR 128 -9.151 11.810 -18.494 1031 HG22 THR 128 HG22 THR 128 -7.957 12.080 -17.200 1032 HG23 THR 128 HG23 THR 128 -9.015 10.653 -17.148 1033 H GLU 129 H GLU 129 -5.561 7.722 -18.851 1034 HA GLU 129 HA GLU 129 -7.628 5.903 -17.787 1035 HB2 GLU 129 HB2 GLU 129 -5.263 5.565 -19.655 1036 HB3 GLU 129 HB3 GLU 129 -6.197 4.190 -19.045 1037 HG2 GLU 129 HG2 GLU 129 -7.300 6.509 -20.652 1038 HG3 GLU 129 HG3 GLU 129 -6.968 4.878 -21.269 1039 H ALA 130 H ALA 130 -4.182 6.688 -17.386 1040 HA ALA 130 HA ALA 130 -3.612 4.565 -15.544 1041 HB1 ALA 130 HB1 ALA 130 -2.368 7.336 -15.826 1042 HB2 ALA 130 HB2 ALA 130 -1.686 5.983 -14.902 1043 HB3 ALA 130 HB3 ALA 130 -1.843 5.858 -16.667 1044 H GLU 131 H GLU 131 -4.919 7.875 -15.188 1045 HA GLU 131 HA GLU 131 -5.097 7.869 -12.327 1046 HB2 GLU 131 HB2 GLU 131 -6.655 9.282 -14.507 1047 HB3 GLU 131 HB3 GLU 131 -6.994 9.533 -12.791 1048 HG2 GLU 131 HG2 GLU 131 -4.728 10.340 -12.412 1049 HG3 GLU 131 HG3 GLU 131 -4.304 10.022 -14.096 1050 H LYS 132 H LYS 132 -7.256 6.563 -14.868 1051 HA LYS 132 HA LYS 132 -9.472 6.032 -13.113 1052 HB2 LYS 132 HB2 LYS 132 -8.803 5.539 -15.849 1053 HB3 LYS 132 HB3 LYS 132 -9.230 3.987 -15.137 1054 HG2 LYS 132 HG2 LYS 132 -11.301 4.696 -15.849 1055 HG3 LYS 132 HG3 LYS 132 -11.302 5.290 -14.179 1056 HD2 LYS 132 HD2 LYS 132 -12.078 7.121 -15.454 1057 HD3 LYS 132 HD3 LYS 132 -10.364 7.495 -15.165 1058 HE2 LYS 132 HE2 LYS 132 -9.852 6.427 -17.400 1059 HE3 LYS 132 HE3 LYS 132 -11.591 6.294 -17.680 1060 HZ1 LYS 132 HZ1 LYS 132 -10.080 8.792 -17.261 1061 HZ2 LYS 132 HZ2 LYS 132 -11.712 8.703 -17.516 1062 HZ3 LYS 132 HZ3 LYS 132 -10.662 8.235 -18.703 1063 H TYR 133 H TYR 133 -6.765 3.959 -14.244 1064 HA TYR 133 HA TYR 133 -7.619 1.741 -12.616 1065 HB2 TYR 133 HB2 TYR 133 -4.976 2.343 -13.947 1066 HB3 TYR 133 HB3 TYR 133 -5.384 0.805 -13.162 1067 HD1 TYR 133 HD1 TYR 133 -7.876 -0.093 -13.962 1068 HD2 TYR 133 HD2 TYR 133 -5.231 2.388 -16.272 1069 HE1 TYR 133 HE1 TYR 133 -9.036 -0.794 -16.055 1070 HE2 TYR 133 HE2 TYR 133 -6.402 1.683 -18.360 1071 HH TYR 133 HH TYR 133 -8.180 0.547 -19.241 1072 H TYR 134 H TYR 134 -5.457 4.503 -12.048 1073 HA TYR 134 HA TYR 134 -4.403 3.582 -9.549 1074 HB2 TYR 134 HB2 TYR 134 -3.482 5.554 -10.622 1075 HB3 TYR 134 HB3 TYR 134 -5.049 6.366 -10.574 1076 HD1 TYR 134 HD1 TYR 134 -2.203 5.203 -8.459 1077 HD2 TYR 134 HD2 TYR 134 -5.842 7.502 -8.601 1078 HE1 TYR 134 HE1 TYR 134 -1.676 6.193 -6.234 1079 HE2 TYR 134 HE2 TYR 134 -5.313 8.470 -6.366 1080 HH TYR 134 HH TYR 134 -2.298 7.756 -4.630 1081 H GLY 135 H GLY 135 -7.410 5.420 -10.358 1082 HA2 GLY 135 HA2 GLY 135 -8.290 5.696 -7.671 1083 HA3 GLY 135 HA3 GLY 135 -9.330 5.701 -9.106 1084 H GLN 136 H GLN 136 -8.859 3.071 -10.046 1085 HA GLN 136 HA GLN 136 -10.592 1.541 -8.325 1086 HB2 GLN 136 HB2 GLN 136 -8.732 0.701 -10.578 1087 HB3 GLN 136 HB3 GLN 136 -9.878 -0.379 -9.778 1088 HG2 GLN 136 HG2 GLN 136 -11.740 1.103 -10.479 1089 HG3 GLN 136 HG3 GLN 136 -10.586 2.111 -11.357 1090 HE21 GLN 136 HE21 GLN 136 -12.849 0.681 -12.435 1091 HE22 GLN 136 HE22 GLN 136 -12.210 -0.462 -13.591 1092 H THR 137 H THR 137 -7.050 1.746 -8.683 1093 HA THR 137 HA THR 137 -6.479 -0.503 -7.008 1094 HB THR 137 HB THR 137 -4.701 1.940 -7.439 1095 HG1 THR 137 HG1 THR 137 -5.330 1.021 -9.437 1096 HG21 THR 137 HG21 THR 137 -4.164 -0.962 -6.703 1097 HG22 THR 137 HG22 THR 137 -3.845 0.481 -5.705 1098 HG23 THR 137 HG23 THR 137 -2.916 0.201 -7.192 1099 H VAL 138 H VAL 138 -7.066 2.981 -6.271 1100 HA VAL 138 HA VAL 138 -6.319 2.864 -3.510 1101 HB VAL 138 HB VAL 138 -8.620 4.492 -4.736 1102 HG11 VAL 138 HG11 VAL 138 -8.762 4.419 -2.284 1103 HG12 VAL 138 HG12 VAL 138 -7.048 4.874 -2.146 1104 HG13 VAL 138 HG13 VAL 138 -8.230 6.027 -2.808 1105 HG21 VAL 138 HG21 VAL 138 -6.811 6.355 -4.629 1106 HG22 VAL 138 HG22 VAL 138 -5.644 5.019 -4.567 1107 HG23 VAL 138 HG23 VAL 138 -6.736 5.190 -5.948 1108 H SER 139 H SER 139 -9.451 2.165 -5.162 1109 HA SER 139 HA SER 139 -10.877 1.511 -2.773 1110 HB2 SER 139 HB2 SER 139 -11.305 0.381 -5.564 1111 HB3 SER 139 HB3 SER 139 -12.509 0.493 -4.260 1112 HG SER 139 HG SER 139 -12.215 2.805 -4.387 1113 H ASN 140 H ASN 140 -8.896 -0.429 -4.999 1114 HA ASN 140 HA ASN 140 -9.482 -2.983 -3.845 1115 HB2 ASN 140 HB2 ASN 140 -7.689 -1.844 -5.811 1116 HB3 ASN 140 HB3 ASN 140 -6.804 -2.966 -4.780 1117 HD21 ASN 140 HD21 ASN 140 -8.396 -2.761 -7.590 1118 HD22 ASN 140 HD22 ASN 140 -8.953 -4.409 -7.721 1119 H ILE 141 H ILE 141 -6.977 -0.522 -3.123 1120 HA ILE 141 HA ILE 141 -5.548 -2.087 -1.194 1121 HB ILE 141 HB ILE 141 -5.886 0.945 -1.503 1122 HG12 ILE 141 HG12 ILE 141 -3.367 -0.667 -1.920 1123 HG13 ILE 141 HG13 ILE 141 -4.586 -0.580 -3.188 1124 HG21 ILE 141 HG21 ILE 141 -3.787 0.992 0.050 1125 HG22 ILE 141 HG22 ILE 141 -5.385 0.778 0.797 1126 HG23 ILE 141 HG23 ILE 141 -4.320 -0.621 0.562 1127 HD11 ILE 141 HD11 ILE 141 -3.083 1.770 -1.980 1128 HD12 ILE 141 HD12 ILE 141 -2.906 1.098 -3.613 1129 HD13 ILE 141 HD13 ILE 141 -4.409 1.915 -3.156 1130 H ASN 142 H ASN 142 -8.295 0.215 -0.890 1131 HA ASN 142 HA ASN 142 -8.568 -0.025 1.919 1132 HB2 ASN 142 HB2 ASN 142 -9.721 1.638 0.425 1133 HB3 ASN 142 HB3 ASN 142 -10.817 0.346 -0.085 1134 HD21 ASN 142 HD21 ASN 142 -12.716 0.884 0.801 1135 HD22 ASN 142 HD22 ASN 142 -12.958 1.198 2.502 1136 H GLU 143 H GLU 143 -10.045 -2.033 -0.695 1137 HA GLU 143 HA GLU 143 -11.642 -3.586 1.092 1138 HB2 GLU 143 HB2 GLU 143 -10.444 -4.194 -1.625 1139 HB3 GLU 143 HB3 GLU 143 -11.421 -5.355 -0.737 1140 HG2 GLU 143 HG2 GLU 143 -13.286 -3.685 -0.740 1141 HG3 GLU 143 HG3 GLU 143 -12.316 -2.725 -1.877 1142 H VAL 144 H VAL 144 -8.331 -4.138 -0.150 1143 HA VAL 144 HA VAL 144 -8.086 -6.740 1.071 1144 HB VAL 144 HB VAL 144 -5.937 -4.681 0.292 1145 HG11 VAL 144 HG11 VAL 144 -5.619 -7.611 1.098 1146 HG12 VAL 144 HG12 VAL 144 -4.340 -6.613 0.369 1147 HG13 VAL 144 HG13 VAL 144 -4.986 -6.195 1.965 1148 HG21 VAL 144 HG21 VAL 144 -5.586 -6.090 -1.681 1149 HG22 VAL 144 HG22 VAL 144 -6.814 -7.237 -1.121 1150 HG23 VAL 144 HG23 VAL 144 -7.283 -5.601 -1.610 1151 H LEU 145 H LEU 145 -7.542 -3.391 2.157 1152 HA LEU 145 HA LEU 145 -6.167 -4.331 4.535 1153 HB2 LEU 145 HB2 LEU 145 -6.821 -1.699 3.343 1154 HB3 LEU 145 HB3 LEU 145 -6.690 -1.730 5.094 1155 HG LEU 145 HG LEU 145 -4.555 -1.106 4.018 1156 HD11 LEU 145 HD11 LEU 145 -4.467 -3.764 5.446 1157 HD12 LEU 145 HD12 LEU 145 -4.599 -2.170 6.207 1158 HD13 LEU 145 HD13 LEU 145 -3.149 -2.616 5.284 1159 HD21 LEU 145 HD21 LEU 145 -4.669 -2.456 1.959 1160 HD22 LEU 145 HD22 LEU 145 -4.508 -3.941 2.911 1161 HD23 LEU 145 HD23 LEU 145 -3.177 -2.772 2.866 1162 H ALA 146 H ALA 146 -9.507 -3.623 3.826 1163 HA ALA 146 HA ALA 146 -10.307 -3.311 6.582 1164 HB1 ALA 146 HB1 ALA 146 -11.759 -2.684 4.664 1165 HB2 ALA 146 HB2 ALA 146 -11.857 -4.394 4.175 1166 HB3 ALA 146 HB3 ALA 146 -12.569 -3.866 5.721 1167 H LYS 147 H LYS 147 -9.411 -6.068 4.615 1168 HA LYS 147 HA LYS 147 -10.486 -7.998 6.584 1169 HB2 LYS 147 HB2 LYS 147 -8.721 -8.322 4.148 1170 HB3 LYS 147 HB3 LYS 147 -9.340 -9.646 5.140 1171 HG2 LYS 147 HG2 LYS 147 -11.691 -8.725 4.617 1172 HG3 LYS 147 HG3 LYS 147 -10.902 -7.751 3.367 1173 HD2 LYS 147 HD2 LYS 147 -11.687 -9.716 2.273 1174 HD3 LYS 147 HD3 LYS 147 -9.936 -9.916 2.438 1175 HE2 LYS 147 HE2 LYS 147 -10.997 -12.017 3.003 1176 HE3 LYS 147 HE3 LYS 147 -10.354 -11.321 4.497 1177 HZ1 LYS 147 HZ1 LYS 147 -13.182 -11.248 3.615 1178 HZ2 LYS 147 HZ2 LYS 147 -12.610 -10.501 4.971 1179 HZ3 LYS 147 HZ3 LYS 147 -12.570 -12.146 4.856 1180 H LEU 148 H LEU 148 -7.824 -6.015 6.355 1181 HA LEU 148 HA LEU 148 -6.124 -7.812 8.034 1182 HB2 LEU 148 HB2 LEU 148 -5.387 -5.379 6.387 1183 HB3 LEU 148 HB3 LEU 148 -4.266 -6.300 7.375 1184 HG LEU 148 HG LEU 148 -5.748 -7.402 4.969 1185 HD11 LEU 148 HD11 LEU 148 -2.885 -6.458 5.310 1186 HD12 LEU 148 HD12 LEU 148 -4.143 -5.700 4.311 1187 HD13 LEU 148 HD13 LEU 148 -3.523 -7.300 3.882 1188 HD21 LEU 148 HD21 LEU 148 -3.523 -8.560 6.667 1189 HD22 LEU 148 HD22 LEU 148 -4.132 -9.257 5.148 1190 HD23 LEU 148 HD23 LEU 148 -5.197 -9.155 6.559 1191 H GLY 149 H GLY 149 -8.465 -5.677 8.542 1192 HA2 GLY 149 HA2 GLY 149 -7.123 -3.880 10.417 1193 HA3 GLY 149 HA3 GLY 149 -8.870 -4.068 10.175 Start of MODEL 6 1 H1 GLU 1 H1 GLU 1 -3.125 16.330 -0.328 2 H2 GLU 1 H2 GLU 1 -2.553 17.863 -0.159 3 H3 GLU 1 H3 GLU 1 -3.256 17.403 -1.578 4 HA GLU 1 HA GLU 1 -1.528 15.893 -2.077 5 HB2 GLU 1 HB2 GLU 1 0.465 17.583 -2.026 6 HB3 GLU 1 HB3 GLU 1 -0.935 17.848 -3.054 7 HG2 GLU 1 HG2 GLU 1 -1.302 19.843 -2.150 8 HG3 GLU 1 HG3 GLU 1 -1.425 19.149 -0.526 9 H ALA 2 H ALA 2 0.533 17.690 0.263 10 HA ALA 2 HA ALA 2 1.694 15.219 1.130 11 HB1 ALA 2 HB1 ALA 2 2.851 17.407 1.199 12 HB2 ALA 2 HB2 ALA 2 1.731 17.962 2.464 13 HB3 ALA 2 HB3 ALA 2 2.852 16.616 2.793 14 H ARG 3 H ARG 3 -1.080 16.998 2.235 15 HA ARG 3 HA ARG 3 -1.637 14.843 4.237 16 HB2 ARG 3 HB2 ARG 3 -1.654 17.802 4.586 17 HB3 ARG 3 HB3 ARG 3 -3.164 17.015 5.042 18 HG2 ARG 3 HG2 ARG 3 -1.846 17.175 7.023 19 HG3 ARG 3 HG3 ARG 3 -1.860 15.472 6.542 20 HD2 ARG 3 HD2 ARG 3 0.368 16.087 7.257 21 HD3 ARG 3 HD3 ARG 3 0.382 15.773 5.518 22 HE ARG 3 HE ARG 3 -0.047 18.568 6.073 23 HH11 ARG 3 HH11 ARG 3 2.503 16.140 5.894 24 HH12 ARG 3 HH12 ARG 3 3.746 17.328 5.593 25 HH21 ARG 3 HH21 ARG 3 1.585 20.030 5.676 26 HH22 ARG 3 HH22 ARG 3 3.226 19.491 5.457 27 HA PRO 4 HA PRO 4 -4.937 14.487 1.412 28 HB2 PRO 4 HB2 PRO 4 -7.079 13.606 2.874 29 HB3 PRO 4 HB3 PRO 4 -5.648 12.578 2.541 30 HG2 PRO 4 HG2 PRO 4 -6.250 14.237 4.979 31 HG3 PRO 4 HG3 PRO 4 -5.775 12.512 4.878 32 HD2 PRO 4 HD2 PRO 4 -3.969 14.433 5.402 33 HD3 PRO 4 HD3 PRO 4 -3.553 13.041 4.339 34 H ILE 5 H ILE 5 -6.518 15.720 0.458 35 HA ILE 5 HA ILE 5 -8.316 17.440 1.912 36 HB ILE 5 HB ILE 5 -6.082 18.756 2.007 37 HG12 ILE 5 HG12 ILE 5 -8.280 20.152 0.451 38 HG13 ILE 5 HG13 ILE 5 -8.410 19.732 2.162 39 HG21 ILE 5 HG21 ILE 5 -5.207 19.805 0.009 40 HG22 ILE 5 HG22 ILE 5 -5.332 18.066 -0.317 41 HG23 ILE 5 HG23 ILE 5 -6.544 19.182 -0.982 42 HD11 ILE 5 HD11 ILE 5 -6.394 21.143 2.633 43 HD12 ILE 5 HD12 ILE 5 -6.381 21.636 0.920 44 HD13 ILE 5 HD13 ILE 5 -7.759 22.061 1.958 45 H VAL 6 H VAL 6 -9.792 18.453 0.265 46 HA VAL 6 HA VAL 6 -9.674 17.017 -2.357 47 HB VAL 6 HB VAL 6 -11.998 18.504 -1.023 48 HG11 VAL 6 HG11 VAL 6 -12.140 18.607 -3.480 49 HG12 VAL 6 HG12 VAL 6 -11.896 16.843 -3.589 50 HG13 VAL 6 HG13 VAL 6 -13.370 17.502 -2.845 51 HG21 VAL 6 HG21 VAL 6 -11.493 15.514 -1.383 52 HG22 VAL 6 HG22 VAL 6 -11.522 16.406 0.157 53 HG23 VAL 6 HG23 VAL 6 -13.010 16.233 -0.789 54 H VAL 7 H VAL 7 -8.937 18.221 -4.017 55 HA VAL 7 HA VAL 7 -8.989 21.196 -3.722 56 HB VAL 7 HB VAL 7 -6.816 19.965 -3.086 57 HG11 VAL 7 HG11 VAL 7 -6.753 18.401 -5.005 58 HG12 VAL 7 HG12 VAL 7 -6.488 19.776 -6.106 59 HG13 VAL 7 HG13 VAL 7 -5.273 19.371 -4.876 60 HG21 VAL 7 HG21 VAL 7 -5.404 21.755 -3.957 61 HG22 VAL 7 HG22 VAL 7 -6.640 22.176 -5.164 62 HG23 VAL 7 HG23 VAL 7 -6.972 22.403 -3.431 63 H GLY 8 H GLY 8 -10.227 18.806 -5.467 64 HA2 GLY 8 HA2 GLY 8 -11.152 20.173 -7.620 65 HA3 GLY 8 HA3 GLY 8 -9.524 19.735 -8.160 66 HA PRO 9 HA PRO 9 -11.138 15.752 -9.116 67 HB2 PRO 9 HB2 PRO 9 -9.639 13.791 -7.930 68 HB3 PRO 9 HB3 PRO 9 -8.995 14.795 -9.272 69 HG2 PRO 9 HG2 PRO 9 -8.636 15.152 -6.304 70 HG3 PRO 9 HG3 PRO 9 -7.389 15.106 -7.591 71 HD2 PRO 9 HD2 PRO 9 -8.326 17.442 -6.632 72 HD3 PRO 9 HD3 PRO 9 -7.963 17.243 -8.379 73 HA PRO 10 HA PRO 10 -13.900 14.914 -5.815 74 HB2 PRO 10 HB2 PRO 10 -14.879 12.403 -6.325 75 HB3 PRO 10 HB3 PRO 10 -15.277 13.818 -7.353 76 HG2 PRO 10 HG2 PRO 10 -13.141 11.738 -7.758 77 HG3 PRO 10 HG3 PRO 10 -14.414 12.283 -8.901 78 HD2 PRO 10 HD2 PRO 10 -11.928 13.290 -9.028 79 HD3 PRO 10 HD3 PRO 10 -13.357 14.358 -9.258 80 HA PRO 11 HA PRO 11 -11.662 12.716 -2.737 81 HB2 PRO 11 HB2 PRO 11 -13.571 11.933 -0.932 82 HB3 PRO 11 HB3 PRO 11 -13.115 13.651 -1.154 83 HG2 PRO 11 HG2 PRO 11 -15.401 12.134 -2.383 84 HG3 PRO 11 HG3 PRO 11 -15.432 13.688 -1.486 85 HD2 PRO 11 HD2 PRO 11 -15.396 13.644 -4.170 86 HD3 PRO 11 HD3 PRO 11 -14.434 14.863 -3.262 87 HA PRO 12 HA PRO 12 -11.997 8.389 -3.709 88 HB2 PRO 12 HB2 PRO 12 -10.734 7.163 -1.639 89 HB3 PRO 12 HB3 PRO 12 -9.838 8.226 -2.772 90 HG2 PRO 12 HG2 PRO 12 -11.010 8.895 -0.082 91 HG3 PRO 12 HG3 PRO 12 -9.338 9.154 -0.674 92 HD2 PRO 12 HD2 PRO 12 -11.198 11.123 -0.737 93 HD3 PRO 12 HD3 PRO 12 -9.979 10.943 -2.047 94 H LEU 13 H LEU 13 -12.714 6.218 -2.611 95 HA LEU 13 HA LEU 13 -15.355 6.519 -1.534 96 HB2 LEU 13 HB2 LEU 13 -13.423 4.249 -1.947 97 HB3 LEU 13 HB3 LEU 13 -14.787 4.004 -0.863 98 HG LEU 13 HG LEU 13 -16.355 4.574 -2.697 99 HD11 LEU 13 HD11 LEU 13 -14.974 5.943 -4.165 100 HD12 LEU 13 HD12 LEU 13 -15.511 4.505 -5.051 101 HD13 LEU 13 HD13 LEU 13 -13.846 4.592 -4.427 102 HD21 LEU 13 HD21 LEU 13 -16.059 2.438 -3.893 103 HD22 LEU 13 HD22 LEU 13 -15.773 2.252 -2.151 104 HD23 LEU 13 HD23 LEU 13 -14.395 2.319 -3.273 105 H SER 14 H SER 14 -16.098 5.890 0.566 106 HA SER 14 HA SER 14 -14.746 7.147 2.684 107 HB2 SER 14 HB2 SER 14 -16.808 4.924 2.881 108 HB3 SER 14 HB3 SER 14 -16.489 6.198 4.079 109 HG SER 14 HG SER 14 -17.255 7.717 2.596 110 H GLY 15 H GLY 15 -13.750 6.349 4.562 111 HA2 GLY 15 HA2 GLY 15 -13.019 4.188 5.718 112 HA3 GLY 15 HA3 GLY 15 -12.363 3.735 4.136 113 H GLY 16 H GLY 16 -12.318 6.998 5.597 114 HA2 GLY 16 HA2 GLY 16 -9.631 6.865 6.558 115 HA3 GLY 16 HA3 GLY 16 -9.676 7.582 4.920 116 H LEU 17 H LEU 17 -8.920 9.437 6.552 117 HA LEU 17 HA LEU 17 -9.360 11.416 7.619 118 HB2 LEU 17 HB2 LEU 17 -11.726 11.237 5.741 119 HB3 LEU 17 HB3 LEU 17 -11.480 12.612 6.792 120 HG LEU 17 HG LEU 17 -10.811 13.119 4.547 121 HD11 LEU 17 HD11 LEU 17 -8.683 14.142 5.038 122 HD12 LEU 17 HD12 LEU 17 -8.366 12.988 6.351 123 HD13 LEU 17 HD13 LEU 17 -9.681 14.177 6.503 124 HD21 LEU 17 HD21 LEU 17 -8.950 12.149 3.400 125 HD22 LEU 17 HD22 LEU 17 -10.049 10.831 3.851 126 HD23 LEU 17 HD23 LEU 17 -8.553 11.103 4.779 127 HA PRO 18 HA PRO 18 -12.528 9.590 10.463 128 HB2 PRO 18 HB2 PRO 18 -11.032 9.246 12.725 129 HB3 PRO 18 HB3 PRO 18 -11.099 8.005 11.430 130 HG2 PRO 18 HG2 PRO 18 -9.033 10.154 11.882 131 HG3 PRO 18 HG3 PRO 18 -8.789 8.394 11.632 132 HD2 PRO 18 HD2 PRO 18 -8.553 10.162 9.603 133 HD3 PRO 18 HD3 PRO 18 -9.279 8.538 9.344 134 H GLY 19 H GLY 19 -13.701 10.880 11.896 135 HA2 GLY 19 HA2 GLY 19 -13.037 12.748 13.703 136 HA3 GLY 19 HA3 GLY 19 -12.708 13.631 12.196 137 H THR 20 H THR 20 -14.454 15.035 13.052 138 HA THR 20 HA THR 20 -17.130 14.004 12.168 139 HB THR 20 HB THR 20 -18.134 15.560 13.870 140 HG1 THR 20 HG1 THR 20 -16.314 16.925 14.088 141 HG21 THR 20 HG21 THR 20 -16.191 13.594 15.146 142 HG22 THR 20 HG22 THR 20 -17.746 13.136 14.410 143 HG23 THR 20 HG23 THR 20 -17.712 14.202 15.834 144 H GLU 21 H GLU 21 -16.144 14.837 10.107 145 HA GLU 21 HA GLU 21 -15.813 16.424 8.492 146 HB2 GLU 21 HB2 GLU 21 -18.357 16.855 9.743 147 HB3 GLU 21 HB3 GLU 21 -17.732 18.418 9.227 148 HG2 GLU 21 HG2 GLU 21 -19.051 17.450 7.446 149 HG3 GLU 21 HG3 GLU 21 -17.346 17.504 6.960 150 H ASN 22 H ASN 22 -14.033 16.631 10.626 151 HA ASN 22 HA ASN 22 -13.790 19.359 11.532 152 HB2 ASN 22 HB2 ASN 22 -11.786 17.070 11.464 153 HB3 ASN 22 HB3 ASN 22 -11.543 18.603 12.308 154 HD21 ASN 22 HD21 ASN 22 -13.556 19.170 13.762 155 HD22 ASN 22 HD22 ASN 22 -14.084 17.851 14.779 156 H SER 23 H SER 23 -12.504 21.000 10.806 157 HA SER 23 HA SER 23 -11.052 20.577 8.232 158 HB2 SER 23 HB2 SER 23 -11.963 22.805 7.541 159 HB3 SER 23 HB3 SER 23 -13.218 21.563 7.743 160 HG SER 23 HG SER 23 -13.877 23.441 8.772 161 H ASP 24 H ASP 24 -10.158 20.718 11.067 162 HA ASP 24 HA ASP 24 -8.709 23.304 11.113 163 HB2 ASP 24 HB2 ASP 24 -8.124 22.745 13.392 164 HB3 ASP 24 HB3 ASP 24 -9.866 22.529 13.177 165 H GLN 25 H GLN 25 -6.681 21.374 12.776 166 HA GLN 25 HA GLN 25 -4.818 21.039 10.544 167 HB2 GLN 25 HB2 GLN 25 -4.760 19.966 13.397 168 HB3 GLN 25 HB3 GLN 25 -3.421 19.898 12.244 169 HG2 GLN 25 HG2 GLN 25 -3.461 22.414 12.168 170 HG3 GLN 25 HG3 GLN 25 -4.651 22.383 13.478 171 HE21 GLN 25 HE21 GLN 25 -1.776 23.343 13.225 172 HE22 GLN 25 HE22 GLN 25 -0.975 22.611 14.594 173 H ALA 26 H ALA 26 -3.994 18.840 9.977 174 HA ALA 26 HA ALA 26 -6.066 17.150 9.125 175 HB1 ALA 26 HB1 ALA 26 -3.828 17.155 8.122 176 HB2 ALA 26 HB2 ALA 26 -3.137 16.473 9.618 177 HB3 ALA 26 HB3 ALA 26 -4.271 15.517 8.640 178 H ARG 27 H ARG 27 -7.100 15.431 9.922 179 HA ARG 27 HA ARG 27 -6.639 14.853 12.802 180 HB2 ARG 27 HB2 ARG 27 -8.858 15.812 11.665 181 HB3 ARG 27 HB3 ARG 27 -9.148 14.106 11.334 182 HG2 ARG 27 HG2 ARG 27 -10.075 14.009 13.373 183 HG3 ARG 27 HG3 ARG 27 -8.430 14.086 14.009 184 HD2 ARG 27 HD2 ARG 27 -10.428 16.348 13.673 185 HD3 ARG 27 HD3 ARG 27 -9.706 15.759 15.168 186 HE ARG 27 HE ARG 27 -8.696 17.821 13.446 187 HH11 ARG 27 HH11 ARG 27 -7.465 15.163 15.445 188 HH12 ARG 27 HH12 ARG 27 -5.948 15.975 15.726 189 HH21 ARG 27 HH21 ARG 27 -6.789 18.777 13.889 190 HH22 ARG 27 HH22 ARG 27 -5.559 17.965 14.833 191 H ASP 28 H ASP 28 -5.872 13.544 9.892 192 HA ASP 28 HA ASP 28 -6.490 10.750 10.672 193 HB2 ASP 28 HB2 ASP 28 -5.932 10.186 8.386 194 HB3 ASP 28 HB3 ASP 28 -7.098 11.518 8.388 195 H GLY 29 H GLY 29 -4.869 9.129 10.619 196 HA2 GLY 29 HA2 GLY 29 -2.228 9.242 10.018 197 HA3 GLY 29 HA3 GLY 29 -2.279 10.058 11.595 198 H THR 30 H THR 30 -0.856 7.674 11.306 199 HA THR 30 HA THR 30 -2.207 6.061 13.329 200 HB THR 30 HB THR 30 -1.258 4.470 10.924 201 HG1 THR 30 HG1 THR 30 -3.676 5.903 11.142 202 HG21 THR 30 HG21 THR 30 -3.117 2.950 11.768 203 HG22 THR 30 HG22 THR 30 -3.311 4.059 13.138 204 HG23 THR 30 HG23 THR 30 -1.772 3.189 12.902 205 H LEU 31 H LEU 31 -0.644 4.708 14.398 206 HA LEU 31 HA LEU 31 2.129 5.542 14.076 207 HB2 LEU 31 HB2 LEU 31 0.817 3.322 15.695 208 HB3 LEU 31 HB3 LEU 31 2.526 3.728 15.782 209 HG LEU 31 HG LEU 31 0.267 5.611 16.546 210 HD11 LEU 31 HD11 LEU 31 2.159 3.967 18.280 211 HD12 LEU 31 HD12 LEU 31 0.420 3.665 18.050 212 HD13 LEU 31 HD13 LEU 31 0.960 5.147 18.864 213 HD21 LEU 31 HD21 LEU 31 3.292 5.825 16.893 214 HD22 LEU 31 HD22 LEU 31 2.100 6.924 17.624 215 HD23 LEU 31 HD23 LEU 31 2.265 6.850 15.860 216 HA PRO 32 HA PRO 32 3.088 2.385 11.120 217 HB2 PRO 32 HB2 PRO 32 5.734 1.909 11.517 218 HB3 PRO 32 HB3 PRO 32 5.159 3.500 10.922 219 HG2 PRO 32 HG2 PRO 32 5.817 2.661 13.737 220 HG3 PRO 32 HG3 PRO 32 6.430 4.070 12.812 221 HD2 PRO 32 HD2 PRO 32 4.356 4.292 14.540 222 HD3 PRO 32 HD3 PRO 32 4.401 5.228 13.006 223 H TYR 33 H TYR 33 4.309 0.128 11.041 224 HA TYR 33 HA TYR 33 3.079 -1.631 12.926 225 HB2 TYR 33 HB2 TYR 33 4.646 -3.327 11.880 226 HB3 TYR 33 HB3 TYR 33 3.579 -2.472 10.774 227 HD1 TYR 33 HD2 TYR 33 7.119 -2.265 12.094 228 HD2 TYR 33 HD1 TYR 33 4.408 -1.501 8.838 229 HE1 TYR 33 HE2 TYR 33 9.034 -1.608 10.642 230 HE2 TYR 33 HE1 TYR 33 6.331 -0.846 7.396 231 HH TYR 33 HH TYR 33 8.595 -0.557 7.260 232 H THR 34 H THR 34 4.280 -3.217 14.279 233 HA THR 34 HA THR 34 5.544 -1.945 16.399 234 HB THR 34 HB THR 34 6.391 -4.491 16.748 235 HG1 THR 34 HG1 THR 34 5.125 -5.875 15.549 236 HG21 THR 34 HG21 THR 34 4.683 -3.298 18.099 237 HG22 THR 34 HG22 THR 34 4.189 -4.961 17.719 238 HG23 THR 34 HG23 THR 34 3.481 -3.602 16.818 239 H LYS 35 H LYS 35 7.264 -0.644 15.913 240 HA LYS 35 HA LYS 35 9.599 -1.402 14.490 241 HB2 LYS 35 HB2 LYS 35 8.964 0.935 15.201 242 HB3 LYS 35 HB3 LYS 35 9.388 0.498 16.863 243 HG2 LYS 35 HG2 LYS 35 11.725 0.037 16.113 244 HG3 LYS 35 HG3 LYS 35 11.283 0.570 14.481 245 HD2 LYS 35 HD2 LYS 35 10.723 2.805 15.378 246 HD3 LYS 35 HD3 LYS 35 11.155 2.251 17.013 247 HE2 LYS 35 HE2 LYS 35 13.461 1.743 16.206 248 HE3 LYS 35 HE3 LYS 35 13.026 2.385 14.608 249 HZ1 LYS 35 HZ1 LYS 35 13.028 3.932 17.139 250 HZ2 LYS 35 HZ2 LYS 35 12.623 4.535 15.657 251 HZ3 LYS 35 HZ3 LYS 35 14.167 4.035 15.953 252 H ASP 36 H ASP 36 11.458 -2.349 15.078 253 HA ASP 36 HA ASP 36 13.006 -3.528 16.177 254 HB2 ASP 36 HB2 ASP 36 12.568 -1.585 17.866 255 HB3 ASP 36 HB3 ASP 36 11.859 -2.865 18.867 256 H ARG 37 H ARG 37 9.697 -4.235 17.312 257 HA ARG 37 HA ARG 37 10.382 -6.684 18.596 258 HB2 ARG 37 HB2 ARG 37 8.111 -5.442 18.571 259 HB3 ARG 37 HB3 ARG 37 7.795 -6.330 17.069 260 HG2 ARG 37 HG2 ARG 37 8.235 -8.469 18.305 261 HG3 ARG 37 HG3 ARG 37 8.463 -7.529 19.785 262 HD2 ARG 37 HD2 ARG 37 6.100 -6.660 19.460 263 HD3 ARG 37 HD3 ARG 37 5.928 -7.876 18.176 264 HE ARG 37 HE ARG 37 6.966 -9.082 20.557 265 HH11 ARG 37 HH21 ARG 37 3.902 -7.907 19.214 266 HH12 ARG 37 HH22 ARG 37 2.966 -8.903 20.306 267 HH21 ARG 37 HH11 ARG 37 5.696 -10.341 21.857 268 HH22 ARG 37 HH12 ARG 37 3.959 -10.270 21.746 269 H PHE 38 H PHE 38 10.007 -5.900 15.198 270 HA PHE 38 HA PHE 38 9.951 -8.624 14.249 271 HB2 PHE 38 HB2 PHE 38 10.730 -6.014 12.901 272 HB3 PHE 38 HB3 PHE 38 10.568 -7.557 12.064 273 HD1 PHE 38 HD2 PHE 38 8.215 -8.810 12.592 274 HD2 PHE 38 HD1 PHE 38 8.892 -4.579 12.819 275 HE1 PHE 38 HE2 PHE 38 5.784 -8.418 12.267 276 HE2 PHE 38 HE1 PHE 38 6.462 -4.183 12.531 277 HZ PHE 38 HZ PHE 38 4.899 -6.089 12.244 278 H TYR 39 H TYR 39 12.480 -6.967 15.754 279 HA TYR 39 HA TYR 39 14.502 -8.663 14.335 280 HB2 TYR 39 HB2 TYR 39 14.913 -6.111 15.938 281 HB3 TYR 39 HB3 TYR 39 16.185 -7.081 15.188 282 HD1 TYR 39 HD2 TYR 39 15.443 -7.648 12.513 283 HD2 TYR 39 HD1 TYR 39 14.523 -4.114 14.793 284 HE1 TYR 39 HE2 TYR 39 15.179 -6.351 10.399 285 HE2 TYR 39 HE1 TYR 39 14.267 -2.822 12.667 286 HH TYR 39 HH TYR 39 14.425 -2.869 10.380 287 H LEU 40 H LEU 40 13.280 -7.467 17.459 288 HA LEU 40 HA LEU 40 15.025 -9.047 19.108 289 HB2 LEU 40 HB2 LEU 40 12.209 -8.007 19.600 290 HB3 LEU 40 HB3 LEU 40 13.267 -8.666 20.845 291 HG LEU 40 HG LEU 40 13.906 -6.173 19.231 292 HD11 LEU 40 HD11 LEU 40 11.862 -5.860 20.560 293 HD12 LEU 40 HD12 LEU 40 13.211 -4.923 21.229 294 HD13 LEU 40 HD13 LEU 40 12.709 -6.439 22.018 295 HD21 LEU 40 HD21 LEU 40 15.116 -7.298 21.786 296 HD22 LEU 40 HD22 LEU 40 15.524 -5.734 21.038 297 HD23 LEU 40 HD23 LEU 40 15.892 -7.243 20.185 298 H GLN 41 H GLN 41 11.948 -9.660 17.481 299 HA GLN 41 HA GLN 41 12.157 -12.533 18.276 300 HB2 GLN 41 HB2 GLN 41 9.652 -10.839 17.895 301 HB3 GLN 41 HB3 GLN 41 9.654 -12.589 18.118 302 HG2 GLN 41 HG2 GLN 41 10.813 -10.678 20.172 303 HG3 GLN 41 HG3 GLN 41 9.120 -11.180 20.168 304 HE21 GLN 41 HE21 GLN 41 12.451 -12.246 20.632 305 HE22 GLN 41 HE22 GLN 41 12.026 -13.740 21.446 306 HA PRO 42 HA PRO 42 12.084 -12.944 13.858 307 HB2 PRO 42 HB2 PRO 42 10.644 -15.235 13.403 308 HB3 PRO 42 HB3 PRO 42 12.316 -15.268 14.053 309 HG2 PRO 42 HG2 PRO 42 9.702 -15.409 15.552 310 HG3 PRO 42 HG3 PRO 42 11.130 -16.488 15.674 311 HD2 PRO 42 HD2 PRO 42 10.740 -14.488 17.433 312 HD3 PRO 42 HD3 PRO 42 12.390 -14.874 16.830 313 H LEU 43 H LEU 43 10.624 -12.464 12.110 314 HA LEU 43 HA LEU 43 8.520 -10.760 12.843 315 HB2 LEU 43 HB2 LEU 43 9.100 -12.137 10.201 316 HB3 LEU 43 HB3 LEU 43 7.840 -10.937 10.412 317 HG LEU 43 HG LEU 43 9.644 -9.282 11.056 318 HD11 LEU 43 HD11 LEU 43 11.545 -10.704 11.535 319 HD12 LEU 43 HD12 LEU 43 11.913 -9.739 10.102 320 HD13 LEU 43 HD13 LEU 43 11.451 -11.448 9.915 321 HD21 LEU 43 HD21 LEU 43 8.478 -9.318 8.897 322 HD22 LEU 43 HD22 LEU 43 9.656 -10.496 8.270 323 HD23 LEU 43 HD23 LEU 43 10.178 -8.848 8.693 324 HA PRO 44 HA PRO 44 5.541 -14.039 13.234 325 HB2 PRO 44 HB2 PRO 44 3.558 -12.807 14.612 326 HB3 PRO 44 HB3 PRO 44 5.099 -13.277 15.401 327 HG2 PRO 44 HG2 PRO 44 4.251 -10.619 14.324 328 HG3 PRO 44 HG3 PRO 44 4.990 -11.006 15.904 329 HD2 PRO 44 HD2 PRO 44 6.410 -10.074 13.745 330 HD3 PRO 44 HD3 PRO 44 7.117 -11.154 14.993 331 HA PRO 45 HA PRO 45 3.129 -12.838 9.702 332 HB2 PRO 45 HB2 PRO 45 1.217 -14.743 9.600 333 HB3 PRO 45 HB3 PRO 45 2.938 -15.118 9.294 334 HG2 PRO 45 HG2 PRO 45 1.386 -15.426 11.858 335 HG3 PRO 45 HG3 PRO 45 2.381 -16.644 10.992 336 HD2 PRO 45 HD2 PRO 45 3.391 -15.218 13.048 337 HD3 PRO 45 HD3 PRO 45 4.396 -15.599 11.607 338 H THR 46 H THR 46 1.814 -12.845 12.902 339 HA THR 46 HA THR 46 -0.805 -11.799 12.201 340 HB THR 46 HB THR 46 -0.757 -11.128 14.692 341 HG1 THR 46 HG1 THR 46 0.977 -11.925 15.866 342 HG21 THR 46 HG21 THR 46 -0.975 -13.440 15.477 343 HG22 THR 46 HG22 THR 46 -0.144 -14.042 14.026 344 HG23 THR 46 HG23 THR 46 -1.743 -13.270 13.886 345 H GLU 47 H GLU 47 2.271 -10.357 13.421 346 HA GLU 47 HA GLU 47 1.155 -7.671 13.166 347 HB2 GLU 47 HB2 GLU 47 3.991 -8.571 13.701 348 HB3 GLU 47 HB3 GLU 47 3.397 -6.908 13.792 349 HG2 GLU 47 HG2 GLU 47 1.773 -7.641 15.548 350 HG3 GLU 47 HG3 GLU 47 2.541 -9.236 15.538 351 H ALA 48 H ALA 48 2.490 -9.932 11.018 352 HA ALA 48 HA ALA 48 3.712 -8.119 9.165 353 HB1 ALA 48 HB1 ALA 48 2.304 -10.761 8.627 354 HB2 ALA 48 HB2 ALA 48 3.394 -9.908 7.514 355 HB3 ALA 48 HB3 ALA 48 4.023 -10.569 9.042 356 H ALA 49 H ALA 49 0.385 -8.659 10.105 357 HA ALA 49 HA ALA 49 -0.854 -7.647 7.707 358 HB1 ALA 49 HB1 ALA 49 -2.113 -8.849 9.472 359 HB2 ALA 49 HB2 ALA 49 -1.795 -7.523 10.611 360 HB3 ALA 49 HB3 ALA 49 -2.805 -7.240 9.178 361 H GLN 50 H GLN 50 0.552 -6.158 10.604 362 HA GLN 50 HA GLN 50 -0.303 -3.467 10.044 363 HB2 GLN 50 HB2 GLN 50 2.173 -4.402 11.530 364 HB3 GLN 50 HB3 GLN 50 1.418 -2.817 11.652 365 HG2 GLN 50 HG2 GLN 50 -0.511 -3.767 12.781 366 HG3 GLN 50 HG3 GLN 50 0.092 -5.411 12.514 367 HE21 GLN 50 HE21 GLN 50 -0.273 -5.348 14.948 368 HE22 GLN 50 HE22 GLN 50 1.114 -4.897 15.908 369 H ARG 51 H ARG 51 2.493 -5.476 9.139 370 HA ARG 51 HA ARG 51 3.991 -3.348 7.870 371 HB2 ARG 51 HB2 ARG 51 4.025 -6.347 7.374 372 HB3 ARG 51 HB3 ARG 51 5.186 -5.197 6.718 373 HG2 ARG 51 HG2 ARG 51 6.033 -4.691 8.926 374 HG3 ARG 51 HG3 ARG 51 4.751 -5.653 9.690 375 HD2 ARG 51 HD2 ARG 51 6.844 -6.936 9.618 376 HD3 ARG 51 HD3 ARG 51 5.607 -7.687 8.601 377 HE ARG 51 HE ARG 51 6.788 -7.134 6.663 378 HH11 ARG 51 HH11 ARG 51 8.450 -5.801 9.501 379 HH12 ARG 51 HH12 ARG 51 9.899 -5.451 8.598 380 HH21 ARG 51 HH21 ARG 51 8.656 -6.651 5.594 381 HH22 ARG 51 HH22 ARG 51 10.015 -5.933 6.421 382 H ALA 52 H ALA 52 1.703 -5.823 6.700 383 HA ALA 52 HA ALA 52 1.844 -5.164 3.958 384 HB1 ALA 52 HB1 ALA 52 0.788 -7.209 4.830 385 HB2 ALA 52 HB2 ALA 52 -0.501 -6.241 5.575 386 HB3 ALA 52 HB3 ALA 52 -0.343 -6.298 3.807 387 H LYS 53 H LYS 53 -0.047 -3.681 6.593 388 HA LYS 53 HA LYS 53 -1.744 -2.066 4.977 389 HB2 LYS 53 HB2 LYS 53 -2.368 -2.090 7.195 390 HB3 LYS 53 HB3 LYS 53 -0.709 -2.042 7.773 391 HG2 LYS 53 HG2 LYS 53 -0.568 0.356 7.214 392 HG3 LYS 53 HG3 LYS 53 -2.263 0.320 6.686 393 HD2 LYS 53 HD2 LYS 53 -2.979 -0.306 8.939 394 HD3 LYS 53 HD3 LYS 53 -1.293 -0.469 9.458 395 HE2 LYS 53 HE2 LYS 53 -2.084 1.630 10.289 396 HE3 LYS 53 HE3 LYS 53 -0.948 1.970 8.976 397 HZ1 LYS 53 HZ1 LYS 53 -2.827 2.397 7.525 398 HZ2 LYS 53 HZ2 LYS 53 -2.952 3.348 8.870 399 HZ3 LYS 53 HZ3 LYS 53 -3.905 2.011 8.714 400 H VAL 54 H VAL 54 1.600 -1.550 6.138 401 HA VAL 54 HA VAL 54 1.760 1.107 4.960 402 HB VAL 54 HB VAL 54 3.979 -0.766 5.923 403 HG11 VAL 54 HG11 VAL 54 5.339 1.326 6.061 404 HG12 VAL 54 HG12 VAL 54 4.873 0.939 4.394 405 HG13 VAL 54 HG13 VAL 54 4.014 2.221 5.280 406 HG21 VAL 54 HG21 VAL 54 3.954 0.721 7.951 407 HG22 VAL 54 HG22 VAL 54 2.498 1.516 7.314 408 HG23 VAL 54 HG23 VAL 54 2.457 -0.208 7.758 409 H SER 55 H SER 55 2.836 -2.196 4.014 410 HA SER 55 HA SER 55 4.188 -1.449 1.645 411 HB2 SER 55 HB2 SER 55 2.593 -3.981 2.180 412 HB3 SER 55 HB3 SER 55 3.910 -3.787 1.001 413 HG SER 55 HG SER 55 4.627 -4.718 3.013 414 H ALA 56 H ALA 56 0.712 -1.872 2.239 415 HA ALA 56 HA ALA 56 0.013 -1.699 -0.589 416 HB1 ALA 56 HB1 ALA 56 -1.796 -1.126 1.744 417 HB2 ALA 56 HB2 ALA 56 -2.203 -1.774 0.139 418 HB3 ALA 56 HB3 ALA 56 -1.328 -2.785 1.303 419 H SER 57 H SER 57 0.492 0.557 2.081 420 HA SER 57 HA SER 57 -0.788 2.800 0.796 421 HB2 SER 57 HB2 SER 57 1.328 2.741 2.980 422 HB3 SER 57 HB3 SER 57 0.329 4.138 2.532 423 HG SER 57 HG SER 57 -0.557 1.645 3.609 424 H GLU 58 H GLU 58 2.384 1.320 0.584 425 HA GLU 58 HA GLU 58 3.867 3.482 -0.536 426 HB2 GLU 58 HB2 GLU 58 3.944 0.481 -0.962 427 HB3 GLU 58 HB3 GLU 58 5.094 1.566 -1.720 428 HG2 GLU 58 HG2 GLU 58 4.704 1.562 1.267 429 HG3 GLU 58 HG3 GLU 58 5.762 0.385 0.469 430 H ILE 59 H ILE 59 1.555 1.198 -1.939 431 HA ILE 59 HA ILE 59 2.116 1.799 -4.687 432 HB ILE 59 HB ILE 59 -0.418 0.691 -3.398 433 HG12 ILE 59 HG12 ILE 59 1.881 -0.807 -4.713 434 HG13 ILE 59 HG13 ILE 59 1.747 -0.574 -2.970 435 HG21 ILE 59 HG21 ILE 59 0.523 0.483 -6.303 436 HG22 ILE 59 HG22 ILE 59 -0.969 -0.204 -5.621 437 HG23 ILE 59 HG23 ILE 59 -0.783 1.547 -5.736 438 HD11 ILE 59 HD11 ILE 59 -0.462 -1.772 -3.032 439 HD12 ILE 59 HD12 ILE 59 -0.123 -2.169 -4.734 440 HD13 ILE 59 HD13 ILE 59 0.953 -2.762 -3.455 441 H LEU 60 H LEU 60 -0.001 3.262 -2.241 442 HA LEU 60 HA LEU 60 -1.583 4.862 -4.019 443 HB2 LEU 60 HB2 LEU 60 -0.681 5.479 -1.184 444 HB3 LEU 60 HB3 LEU 60 -1.983 6.284 -2.036 445 HG LEU 60 HG LEU 60 -2.031 3.337 -1.300 446 HD11 LEU 60 HD11 LEU 60 -1.889 4.792 0.710 447 HD12 LEU 60 HD12 LEU 60 -3.467 3.989 0.571 448 HD13 LEU 60 HD13 LEU 60 -3.300 5.707 0.134 449 HD21 LEU 60 HD21 LEU 60 -4.442 3.553 -1.673 450 HD22 LEU 60 HD22 LEU 60 -3.536 3.966 -3.142 451 HD23 LEU 60 HD23 LEU 60 -4.229 5.258 -2.130 452 H ASN 61 H ASN 61 1.603 5.346 -2.503 453 HA ASN 61 HA ASN 61 1.864 8.112 -3.204 454 HB2 ASN 61 HB2 ASN 61 3.209 6.857 -1.490 455 HB3 ASN 61 HB3 ASN 61 4.066 6.056 -2.815 456 HD21 ASN 61 HD21 ASN 61 6.057 6.883 -2.345 457 HD22 ASN 61 HD22 ASN 61 6.445 8.577 -2.524 458 H VAL 62 H VAL 62 2.288 5.180 -5.105 459 HA VAL 62 HA VAL 62 4.066 6.335 -7.044 460 HB VAL 62 HB VAL 62 2.128 4.049 -7.610 461 HG11 VAL 62 HG11 VAL 62 3.420 4.895 -9.557 462 HG12 VAL 62 HG12 VAL 62 4.932 4.723 -8.636 463 HG13 VAL 62 HG13 VAL 62 3.993 3.282 -9.081 464 HG21 VAL 62 HG21 VAL 62 3.260 3.509 -5.509 465 HG22 VAL 62 HG22 VAL 62 3.962 2.543 -6.809 466 HG23 VAL 62 HG23 VAL 62 4.834 3.965 -6.195 467 H LYS 63 H LYS 63 0.771 7.014 -6.406 468 HA LYS 63 HA LYS 63 -0.241 7.574 -9.001 469 HB2 LYS 63 HB2 LYS 63 -1.309 7.679 -6.627 470 HB3 LYS 63 HB3 LYS 63 -0.790 9.366 -6.634 471 HG2 LYS 63 HG2 LYS 63 -2.273 8.375 -9.029 472 HG3 LYS 63 HG3 LYS 63 -3.190 8.492 -7.519 473 HD2 LYS 63 HD2 LYS 63 -2.623 10.861 -7.309 474 HD3 LYS 63 HD3 LYS 63 -1.617 10.767 -8.770 475 HE2 LYS 63 HE2 LYS 63 -3.606 9.997 -10.042 476 HE3 LYS 63 HE3 LYS 63 -4.599 10.271 -8.604 477 HZ1 LYS 63 HZ1 LYS 63 -4.215 12.574 -8.769 478 HZ2 LYS 63 HZ2 LYS 63 -4.547 12.072 -10.316 479 HZ3 LYS 63 HZ3 LYS 63 -2.996 12.399 -9.870 480 H GLN 64 H GLN 64 2.305 9.122 -7.219 481 HA GLN 64 HA GLN 64 2.419 11.691 -8.421 482 HB2 GLN 64 HB2 GLN 64 4.523 9.719 -7.488 483 HB3 GLN 64 HB3 GLN 64 4.949 11.317 -8.097 484 HG2 GLN 64 HG2 GLN 64 3.062 10.888 -5.759 485 HG3 GLN 64 HG3 GLN 64 4.809 11.096 -5.585 486 HE21 GLN 64 HE21 GLN 64 2.181 12.735 -5.040 487 HE22 GLN 64 HE22 GLN 64 2.654 14.338 -5.558 488 H PHE 65 H PHE 65 3.011 8.537 -9.903 489 HA PHE 65 HA PHE 65 4.838 9.379 -11.930 490 HB2 PHE 65 HB2 PHE 65 4.770 7.134 -12.072 491 HB3 PHE 65 HB3 PHE 65 3.159 7.049 -11.360 492 HD1 PHE 65 HD1 PHE 65 5.041 7.257 -14.531 493 HD2 PHE 65 HD2 PHE 65 1.151 7.051 -12.727 494 HE1 PHE 65 HE1 PHE 65 4.036 6.758 -16.758 495 HE2 PHE 65 HE2 PHE 65 0.140 6.542 -14.941 496 HZ PHE 65 HZ PHE 65 1.578 6.406 -16.961 497 H ILE 66 H ILE 66 1.349 9.775 -11.629 498 HA ILE 66 HA ILE 66 0.685 10.101 -14.361 499 HB ILE 66 HB ILE 66 -0.456 11.543 -11.915 500 HG12 ILE 66 HG12 ILE 66 -0.623 9.067 -11.849 501 HG13 ILE 66 HG13 ILE 66 -2.193 9.864 -11.931 502 HG21 ILE 66 HG21 ILE 66 -1.498 11.418 -14.788 503 HG22 ILE 66 HG22 ILE 66 -2.520 11.857 -13.401 504 HG23 ILE 66 HG23 ILE 66 -1.123 12.861 -13.824 505 HD11 ILE 66 HD11 ILE 66 -2.144 7.863 -13.360 506 HD12 ILE 66 HD12 ILE 66 -2.379 9.310 -14.344 507 HD13 ILE 66 HD13 ILE 66 -0.788 8.524 -14.283 508 H ASP 67 H ASP 67 1.891 12.582 -12.062 509 HA ASP 67 HA ASP 67 1.826 14.689 -14.050 510 HB2 ASP 67 HB2 ASP 67 1.797 15.199 -11.659 511 HB3 ASP 67 HB3 ASP 67 3.358 14.388 -11.447 512 H ARG 68 H ARG 68 4.274 12.426 -12.849 513 HA ARG 68 HA ARG 68 6.427 13.761 -14.256 514 HB2 ARG 68 HB2 ARG 68 6.318 11.029 -12.931 515 HB3 ARG 68 HB3 ARG 68 7.791 11.890 -13.419 516 HG2 ARG 68 HG2 ARG 68 7.258 13.723 -11.844 517 HG3 ARG 68 HG3 ARG 68 5.754 12.914 -11.392 518 HD2 ARG 68 HD2 ARG 68 7.166 10.941 -10.651 519 HD3 ARG 68 HD3 ARG 68 8.573 12.018 -10.819 520 HE ARG 68 HE ARG 68 6.480 13.275 -9.283 521 HH11 ARG 68 HH21 ARG 68 9.028 10.851 -8.946 522 HH12 ARG 68 HH22 ARG 68 9.130 11.067 -7.220 523 HH21 ARG 68 HH11 ARG 68 6.640 13.474 -7.086 524 HH22 ARG 68 HH12 ARG 68 7.820 12.547 -6.191 525 H LYS 69 H LYS 69 4.070 11.492 -15.211 526 HA LYS 69 HA LYS 69 3.698 10.320 -17.146 527 HB2 LYS 69 HB2 LYS 69 5.493 12.495 -18.273 528 HB3 LYS 69 HB3 LYS 69 4.408 11.472 -19.223 529 HG2 LYS 69 HG2 LYS 69 2.452 12.403 -18.131 530 HG3 LYS 69 HG3 LYS 69 3.457 13.259 -16.963 531 HD2 LYS 69 HD2 LYS 69 4.451 14.573 -18.863 532 HD3 LYS 69 HD3 LYS 69 3.234 13.829 -19.921 533 HE2 LYS 69 HE2 LYS 69 2.324 15.943 -19.242 534 HE3 LYS 69 HE3 LYS 69 1.460 14.709 -18.303 535 HZ1 LYS 69 HZ1 LYS 69 3.043 15.206 -16.447 536 HZ2 LYS 69 HZ2 LYS 69 2.088 16.492 -16.843 537 HZ3 LYS 69 HZ3 LYS 69 3.662 16.452 -17.325 538 H ALA 70 H ALA 70 5.785 9.295 -15.542 539 HA ALA 70 HA ALA 70 8.019 8.564 -17.258 540 HB1 ALA 70 HB1 ALA 70 8.251 8.996 -14.813 541 HB2 ALA 70 HB2 ALA 70 7.284 7.535 -14.484 542 HB3 ALA 70 HB3 ALA 70 8.861 7.402 -15.297 543 H TRP 71 H TRP 71 6.248 7.655 -18.840 544 HA TRP 71 HA TRP 71 4.863 5.279 -18.455 545 HB2 TRP 71 HB2 TRP 71 6.337 5.735 -21.029 546 HB3 TRP 71 HB3 TRP 71 4.721 5.104 -20.759 547 HD1 TRP 71 HD1 TRP 71 6.431 8.159 -21.846 548 HE1 TRP 71 HE1 TRP 71 4.925 10.204 -21.880 549 HE3 TRP 71 HE3 TRP 71 2.602 6.265 -19.034 550 HZ2 TRP 71 HZ2 TRP 71 2.353 10.922 -20.880 551 HZ3 TRP 71 HZ3 TRP 71 0.598 7.710 -18.606 552 HH2 TRP 71 HH2 TRP 71 0.498 10.023 -19.526 553 HA PRO 72 HA PRO 72 8.264 2.397 -19.625 554 HB2 PRO 72 HB2 PRO 72 10.900 2.979 -19.740 555 HB3 PRO 72 HB3 PRO 72 9.796 3.383 -21.095 556 HG2 PRO 72 HG2 PRO 72 10.754 5.146 -18.852 557 HG3 PRO 72 HG3 PRO 72 10.813 5.443 -20.619 558 HD2 PRO 72 HD2 PRO 72 8.825 6.428 -19.061 559 HD3 PRO 72 HD3 PRO 72 8.521 5.873 -20.742 560 H SER 73 H SER 73 8.725 4.605 -16.990 561 HA SER 73 HA SER 73 10.472 2.759 -15.499 562 HB2 SER 73 HB2 SER 73 9.177 5.326 -14.546 563 HB3 SER 73 HB3 SER 73 10.619 4.525 -13.890 564 HG SER 73 HG SER 73 11.743 5.092 -15.720 565 H LEU 74 H LEU 74 7.084 3.817 -15.562 566 HA LEU 74 HA LEU 74 6.379 3.008 -12.955 567 HB2 LEU 74 HB2 LEU 74 4.974 4.371 -14.529 568 HB3 LEU 74 HB3 LEU 74 4.629 2.893 -15.436 569 HG LEU 74 HG LEU 74 3.646 1.912 -13.320 570 HD11 LEU 74 HD11 LEU 74 4.729 3.291 -11.650 571 HD12 LEU 74 HD12 LEU 74 2.978 3.546 -11.561 572 HD13 LEU 74 HD13 LEU 74 4.009 4.757 -12.345 573 HD21 LEU 74 HD21 LEU 74 1.622 3.461 -13.361 574 HD22 LEU 74 HD22 LEU 74 2.095 2.642 -14.859 575 HD23 LEU 74 HD23 LEU 74 2.500 4.354 -14.609 576 H GLN 75 H GLN 75 6.389 1.130 -15.977 577 HA GLN 75 HA GLN 75 5.135 -1.189 -15.087 578 HB2 GLN 75 HB2 GLN 75 6.458 -2.368 -16.798 579 HB3 GLN 75 HB3 GLN 75 5.757 -0.866 -17.403 580 HG2 GLN 75 HG2 GLN 75 7.799 0.216 -17.538 581 HG3 GLN 75 HG3 GLN 75 8.592 -0.887 -16.413 582 HE21 GLN 75 HE21 GLN 75 10.112 -0.592 -18.372 583 HE22 GLN 75 HE22 GLN 75 10.002 -1.874 -19.562 584 H ASN 76 H ASN 76 8.294 -0.032 -14.144 585 HA ASN 76 HA ASN 76 9.039 -2.700 -13.085 586 HB2 ASN 76 HB2 ASN 76 10.691 -1.259 -14.329 587 HB3 ASN 76 HB3 ASN 76 10.578 -0.069 -13.030 588 HD21 ASN 76 HD21 ASN 76 12.410 -2.503 -14.192 589 HD22 ASN 76 HD22 ASN 76 13.166 -3.029 -12.708 590 H ASP 77 H ASP 77 8.885 0.711 -11.885 591 HA ASP 77 HA ASP 77 9.179 -0.021 -9.183 592 HB2 ASP 77 HB2 ASP 77 9.499 2.261 -10.089 593 HB3 ASP 77 HB3 ASP 77 7.744 2.408 -10.292 594 H LEU 78 H LEU 78 6.104 0.489 -10.998 595 HA LEU 78 HA LEU 78 4.477 0.380 -8.645 596 HB2 LEU 78 HB2 LEU 78 3.792 1.187 -10.915 597 HB3 LEU 78 HB3 LEU 78 3.771 -0.478 -11.471 598 HG LEU 78 HG LEU 78 1.940 -0.971 -9.879 599 HD11 LEU 78 HD11 LEU 78 1.988 2.021 -9.328 600 HD12 LEU 78 HD12 LEU 78 2.338 0.728 -8.157 601 HD13 LEU 78 HD13 LEU 78 0.706 0.898 -8.825 602 HD21 LEU 78 HD21 LEU 78 1.509 -0.304 -12.231 603 HD22 LEU 78 HD22 LEU 78 1.418 1.399 -11.723 604 HD23 LEU 78 HD23 LEU 78 0.210 0.229 -11.148 605 H ARG 79 H ARG 79 5.827 -2.108 -10.784 606 HA ARG 79 HA ARG 79 4.355 -4.255 -9.482 607 HB2 ARG 79 HB2 ARG 79 6.677 -4.227 -11.424 608 HB3 ARG 79 HB3 ARG 79 6.045 -5.712 -10.699 609 HG2 ARG 79 HG2 ARG 79 3.766 -5.089 -11.572 610 HG3 ARG 79 HG3 ARG 79 4.541 -3.779 -12.483 611 HD2 ARG 79 HD2 ARG 79 5.945 -5.424 -13.667 612 HD3 ARG 79 HD3 ARG 79 5.236 -6.735 -12.704 613 HE ARG 79 HE ARG 79 3.274 -6.638 -13.972 614 HH11 ARG 79 HH11 ARG 79 5.348 -3.923 -14.871 615 HH12 ARG 79 HH12 ARG 79 4.351 -3.511 -16.256 616 HH21 ARG 79 HH21 ARG 79 2.076 -6.093 -15.740 617 HH22 ARG 79 HH22 ARG 79 2.547 -4.736 -16.753 618 H LEU 80 H LEU 80 7.417 -2.599 -8.834 619 HA LEU 80 HA LEU 80 8.459 -4.689 -7.121 620 HB2 LEU 80 HB2 LEU 80 8.890 -1.681 -7.086 621 HB3 LEU 80 HB3 LEU 80 9.722 -2.801 -6.025 622 HG LEU 80 HG LEU 80 9.983 -2.761 -9.041 623 HD11 LEU 80 HD11 LEU 80 12.178 -1.775 -8.619 624 HD12 LEU 80 HD12 LEU 80 11.884 -1.811 -6.864 625 HD13 LEU 80 HD13 LEU 80 10.909 -0.756 -7.914 626 HD21 LEU 80 HD21 LEU 80 11.938 -4.238 -8.635 627 HD22 LEU 80 HD22 LEU 80 10.409 -5.002 -8.169 628 HD23 LEU 80 HD23 LEU 80 11.487 -4.337 -6.916 629 H ARG 81 H ARG 81 6.504 -1.723 -6.503 630 HA ARG 81 HA ARG 81 6.277 -2.192 -3.674 631 HB2 ARG 81 HB2 ARG 81 4.173 -0.835 -5.395 632 HB3 ARG 81 HB3 ARG 81 4.480 -0.578 -3.680 633 HG2 ARG 81 HG2 ARG 81 6.314 0.226 -5.963 634 HG3 ARG 81 HG3 ARG 81 5.241 1.306 -5.099 635 HD2 ARG 81 HD2 ARG 81 6.570 1.288 -3.168 636 HD3 ARG 81 HD3 ARG 81 7.402 -0.213 -3.632 637 HE ARG 81 HE ARG 81 8.081 1.447 -5.685 638 HH11 ARG 81 HH21 ARG 81 8.290 2.017 -2.160 639 HH12 ARG 81 HH22 ARG 81 9.708 3.007 -2.367 640 HH21 ARG 81 HH11 ARG 81 9.805 2.710 -5.817 641 HH22 ARG 81 HH12 ARG 81 10.537 3.426 -4.388 642 H ALA 82 H ALA 82 4.281 -3.162 -6.463 643 HA ALA 82 HA ALA 82 2.209 -4.424 -4.988 644 HB1 ALA 82 HB1 ALA 82 1.689 -5.567 -7.091 645 HB2 ALA 82 HB2 ALA 82 2.122 -3.876 -7.423 646 HB3 ALA 82 HB3 ALA 82 3.294 -5.173 -7.737 647 H SER 83 H SER 83 5.350 -5.711 -6.177 648 HA SER 83 HA SER 83 4.745 -8.421 -5.417 649 HB2 SER 83 HB2 SER 83 7.431 -7.045 -5.802 650 HB3 SER 83 HB3 SER 83 7.177 -8.800 -5.667 651 HG SER 83 HG SER 83 6.337 -7.017 -7.707 652 H TYR 84 H TYR 84 6.347 -5.690 -3.752 653 HA TYR 84 HA TYR 84 7.222 -7.209 -1.503 654 HB2 TYR 84 HB2 TYR 84 7.906 -4.868 -2.141 655 HB3 TYR 84 HB3 TYR 84 6.339 -4.301 -1.551 656 HD1 TYR 84 HD2 TYR 84 9.382 -6.236 -0.435 657 HD2 TYR 84 HD1 TYR 84 6.112 -3.687 0.709 658 HE1 TYR 84 HE2 TYR 84 10.305 -6.075 1.883 659 HE2 TYR 84 HE1 TYR 84 7.033 -3.541 3.013 660 HH TYR 84 HH TYR 84 8.684 -4.125 4.412 661 H LEU 85 H LEU 85 4.173 -5.404 -2.131 662 HA LEU 85 HA LEU 85 2.938 -6.037 0.364 663 HB2 LEU 85 HB2 LEU 85 2.042 -4.329 -1.165 664 HB3 LEU 85 HB3 LEU 85 1.732 -5.564 -2.384 665 HG LEU 85 HG LEU 85 0.048 -6.622 -0.910 666 HD11 LEU 85 HD11 LEU 85 0.638 -4.270 0.917 667 HD12 LEU 85 HD12 LEU 85 0.838 -5.995 1.291 668 HD13 LEU 85 HD13 LEU 85 -0.785 -5.319 1.061 669 HD21 LEU 85 HD21 LEU 85 -0.393 -3.668 -1.414 670 HD22 LEU 85 HD22 LEU 85 -1.663 -4.878 -1.130 671 HD23 LEU 85 HD23 LEU 85 -0.643 -4.985 -2.578 672 H ARG 86 H ARG 86 3.059 -7.748 -2.729 673 HA ARG 86 HA ARG 86 1.175 -9.782 -2.122 674 HB2 ARG 86 HB2 ARG 86 2.156 -9.256 -4.352 675 HB3 ARG 86 HB3 ARG 86 3.675 -9.978 -3.838 676 HG2 ARG 86 HG2 ARG 86 2.816 -12.142 -3.870 677 HG3 ARG 86 HG3 ARG 86 1.130 -11.579 -3.791 678 HD2 ARG 86 HD2 ARG 86 1.738 -12.362 -6.071 679 HD3 ARG 86 HD3 ARG 86 1.279 -10.649 -6.033 680 HE ARG 86 HE ARG 86 4.124 -10.943 -5.747 681 HH11 ARG 86 HH11 ARG 86 1.576 -11.007 -8.194 682 HH12 ARG 86 HH12 ARG 86 2.661 -10.531 -9.470 683 HH21 ARG 86 HH21 ARG 86 5.448 -10.326 -7.435 684 HH22 ARG 86 HH22 ARG 86 4.811 -10.163 -9.045 685 H TYR 87 H TYR 87 4.693 -9.612 -1.431 686 HA TYR 87 HA TYR 87 4.786 -12.300 -0.395 687 HB2 TYR 87 HB2 TYR 87 6.609 -9.946 0.211 688 HB3 TYR 87 HB3 TYR 87 6.957 -11.648 0.538 689 HD1 TYR 87 HD2 TYR 87 5.997 -12.930 -2.039 690 HD2 TYR 87 HD1 TYR 87 8.275 -9.333 -1.367 691 HE1 TYR 87 HE2 TYR 87 6.979 -13.117 -4.321 692 HE2 TYR 87 HE1 TYR 87 9.260 -9.544 -3.651 693 HH TYR 87 HH TYR 87 9.387 -10.805 -5.563 694 H ASP 88 H ASP 88 4.391 -9.076 1.185 695 HA ASP 88 HA ASP 88 4.314 -10.085 3.862 696 HB2 ASP 88 HB2 ASP 88 3.141 -7.639 2.510 697 HB3 ASP 88 HB3 ASP 88 2.698 -8.035 4.175 698 H LEU 89 H LEU 89 1.652 -9.516 1.482 699 HA LEU 89 HA LEU 89 -0.402 -10.346 3.279 700 HB2 LEU 89 HB2 LEU 89 -0.191 -9.494 0.561 701 HB3 LEU 89 HB3 LEU 89 -1.052 -11.016 0.533 702 HG LEU 89 HG LEU 89 -2.571 -9.122 0.534 703 HD11 LEU 89 HD11 LEU 89 -4.034 -9.759 2.390 704 HD12 LEU 89 HD12 LEU 89 -2.698 -10.633 3.171 705 HD13 LEU 89 HD13 LEU 89 -3.337 -11.188 1.603 706 HD21 LEU 89 HD21 LEU 89 -1.098 -7.570 1.785 707 HD22 LEU 89 HD22 LEU 89 -1.514 -8.429 3.283 708 HD23 LEU 89 HD23 LEU 89 -2.776 -7.587 2.357 709 H LYS 90 H LYS 90 1.528 -12.276 0.952 710 HA LYS 90 HA LYS 90 -0.103 -14.619 1.323 711 HB2 LYS 90 HB2 LYS 90 2.703 -14.151 0.319 712 HB3 LYS 90 HB3 LYS 90 2.122 -15.796 0.595 713 HG2 LYS 90 HG2 LYS 90 0.700 -13.801 -1.210 714 HG3 LYS 90 HG3 LYS 90 1.883 -14.996 -1.775 715 HD2 LYS 90 HD2 LYS 90 0.446 -16.819 -0.822 716 HD3 LYS 90 HD3 LYS 90 -0.776 -15.603 -0.400 717 HE2 LYS 90 HE2 LYS 90 -0.988 -14.978 -2.777 718 HE3 LYS 90 HE3 LYS 90 0.246 -16.182 -3.206 719 HZ1 LYS 90 HZ1 LYS 90 -2.377 -16.797 -1.942 720 HZ2 LYS 90 HZ2 LYS 90 -1.227 -17.907 -2.353 721 HZ3 LYS 90 HZ3 LYS 90 -1.994 -17.044 -3.530 722 H THR 91 H THR 91 2.443 -13.127 3.209 723 HA THR 91 HA THR 91 2.868 -15.451 4.907 724 HB THR 91 HB THR 91 3.449 -12.510 5.500 725 HG1 THR 91 HG1 THR 91 4.567 -13.008 3.660 726 HG21 THR 91 HG21 THR 91 5.242 -13.476 6.920 727 HG22 THR 91 HG22 THR 91 4.604 -15.102 6.589 728 HG23 THR 91 HG23 THR 91 3.617 -13.918 7.479 729 H VAL 92 H VAL 92 0.881 -12.422 5.098 730 HA VAL 92 HA VAL 92 -0.078 -12.924 7.744 731 HB VAL 92 HB VAL 92 -1.420 -11.402 5.440 732 HG11 VAL 92 HG11 VAL 92 -2.635 -10.195 7.307 733 HG12 VAL 92 HG12 VAL 92 -3.121 -11.887 7.116 734 HG13 VAL 92 HG13 VAL 92 -2.020 -11.419 8.437 735 HG21 VAL 92 HG21 VAL 92 0.833 -10.569 6.156 736 HG22 VAL 92 HG22 VAL 92 -0.476 -9.419 6.436 737 HG23 VAL 92 HG23 VAL 92 0.188 -10.368 7.786 738 H ILE 93 H ILE 93 -1.507 -13.803 4.545 739 HA ILE 93 HA ILE 93 -3.948 -14.771 5.680 740 HB ILE 93 HB ILE 93 -4.305 -15.959 3.545 741 HG12 ILE 93 HG12 ILE 93 -2.369 -15.130 1.798 742 HG13 ILE 93 HG13 ILE 93 -1.408 -15.514 3.219 743 HG21 ILE 93 HG21 ILE 93 -4.428 -13.955 2.128 744 HG22 ILE 93 HG22 ILE 93 -4.797 -13.495 3.799 745 HG23 ILE 93 HG23 ILE 93 -3.202 -13.139 3.116 746 HD11 ILE 93 HD11 ILE 93 -3.341 -17.418 1.838 747 HD12 ILE 93 HD12 ILE 93 -1.570 -17.438 1.688 748 HD13 ILE 93 HD13 ILE 93 -2.330 -17.811 3.246 749 H SER 94 H SER 94 -0.822 -16.183 5.639 750 HA SER 94 HA SER 94 -1.770 -18.918 5.734 751 HB2 SER 94 HB2 SER 94 0.890 -17.624 6.316 752 HB3 SER 94 HB3 SER 94 0.604 -19.380 6.292 753 HG SER 94 HG SER 94 0.712 -17.542 4.189 754 H ALA 95 H ALA 95 -1.616 -16.365 8.022 755 HA ALA 95 HA ALA 95 -1.237 -18.092 10.357 756 HB1 ALA 95 HB1 ALA 95 -0.479 -15.733 10.266 757 HB2 ALA 95 HB2 ALA 95 -2.164 -15.197 10.166 758 HB3 ALA 95 HB3 ALA 95 -1.573 -16.035 11.625 759 H LYS 96 H LYS 96 -3.805 -17.991 8.345 760 HA LYS 96 HA LYS 96 -5.789 -18.464 10.543 761 HB2 LYS 96 HB2 LYS 96 -5.702 -16.230 8.703 762 HB3 LYS 96 HB3 LYS 96 -7.055 -17.261 8.255 763 HG2 LYS 96 HG2 LYS 96 -7.838 -15.509 9.759 764 HG3 LYS 96 HG3 LYS 96 -7.987 -17.067 10.554 765 HD2 LYS 96 HD2 LYS 96 -7.219 -15.443 12.147 766 HD3 LYS 96 HD3 LYS 96 -5.928 -16.605 11.853 767 HE2 LYS 96 HE2 LYS 96 -4.841 -14.982 10.301 768 HE3 LYS 96 HE3 LYS 96 -6.141 -13.815 10.644 769 HZ1 LYS 96 HZ1 LYS 96 -4.279 -14.955 12.647 770 HZ2 LYS 96 HZ2 LYS 96 -5.479 -13.867 12.969 771 HZ3 LYS 96 HZ3 LYS 96 -4.198 -13.425 12.029 772 HA PRO 97 HA PRO 97 -6.605 -21.863 7.853 773 HB2 PRO 97 HB2 PRO 97 -9.332 -22.092 7.560 774 HB3 PRO 97 HB3 PRO 97 -8.466 -22.575 9.054 775 HG2 PRO 97 HG2 PRO 97 -9.896 -20.019 8.445 776 HG3 PRO 97 HG3 PRO 97 -10.032 -21.075 9.882 777 HD2 PRO 97 HD2 PRO 97 -8.514 -18.862 9.889 778 HD3 PRO 97 HD3 PRO 97 -7.977 -20.347 10.743 779 H LYS 98 H LYS 98 -6.611 -22.126 5.659 780 HA LYS 98 HA LYS 98 -6.418 -19.652 4.248 781 HB2 LYS 98 HB2 LYS 98 -5.802 -22.485 3.796 782 HB3 LYS 98 HB3 LYS 98 -6.289 -21.647 2.325 783 HG2 LYS 98 HG2 LYS 98 -3.839 -21.588 2.610 784 HG3 LYS 98 HG3 LYS 98 -4.538 -19.966 2.627 785 HD2 LYS 98 HD2 LYS 98 -2.829 -20.062 4.324 786 HD3 LYS 98 HD3 LYS 98 -4.392 -19.947 5.131 787 HE2 LYS 98 HE2 LYS 98 -4.319 -22.467 5.440 788 HE3 LYS 98 HE3 LYS 98 -2.656 -22.431 4.820 789 HZ1 LYS 98 HZ1 LYS 98 -2.069 -20.962 6.657 790 HZ2 LYS 98 HZ2 LYS 98 -2.761 -22.328 7.261 791 HZ3 LYS 98 HZ3 LYS 98 -3.627 -20.921 7.195 792 H ASP 99 H ASP 99 -9.063 -21.914 4.455 793 HA ASP 99 HA ASP 99 -10.231 -21.357 1.924 794 HB2 ASP 99 HB2 ASP 99 -10.782 -23.285 3.403 795 HB3 ASP 99 HB3 ASP 99 -11.633 -22.171 4.485 796 H GLU 100 H GLU 100 -11.343 -20.079 5.152 797 HA GLU 100 HA GLU 100 -13.126 -18.211 3.920 798 HB2 GLU 100 HB2 GLU 100 -13.222 -17.112 6.125 799 HB3 GLU 100 HB3 GLU 100 -13.401 -18.856 6.242 800 HG2 GLU 100 HG2 GLU 100 -12.011 -18.447 8.042 801 HG3 GLU 100 HG3 GLU 100 -10.842 -18.879 6.796 802 H LYS 101 H LYS 101 -9.725 -18.073 4.820 803 HA LYS 101 HA LYS 101 -9.534 -15.247 4.441 804 HB2 LYS 101 HB2 LYS 101 -8.080 -16.783 5.860 805 HB3 LYS 101 HB3 LYS 101 -7.251 -17.227 4.369 806 HG2 LYS 101 HG2 LYS 101 -6.031 -15.507 5.576 807 HG3 LYS 101 HG3 LYS 101 -6.599 -14.926 4.010 808 HD2 LYS 101 HD2 LYS 101 -6.863 -13.157 5.665 809 HD3 LYS 101 HD3 LYS 101 -8.457 -13.690 5.139 810 HE2 LYS 101 HE2 LYS 101 -7.897 -15.304 7.361 811 HE3 LYS 101 HE3 LYS 101 -7.248 -13.718 7.801 812 HZ1 LYS 101 HZ1 LYS 101 -10.034 -14.358 7.004 813 HZ2 LYS 101 HZ2 LYS 101 -9.477 -12.806 7.196 814 HZ3 LYS 101 HZ3 LYS 101 -9.516 -13.846 8.475 815 H LYS 102 H LYS 102 -9.723 -17.804 2.225 816 HA LYS 102 HA LYS 102 -8.198 -16.780 0.051 817 HB2 LYS 102 HB2 LYS 102 -9.533 -19.017 0.426 818 HB3 LYS 102 HB3 LYS 102 -10.857 -18.140 -0.331 819 HG2 LYS 102 HG2 LYS 102 -8.241 -18.072 -1.760 820 HG3 LYS 102 HG3 LYS 102 -9.027 -19.657 -1.633 821 HD2 LYS 102 HD2 LYS 102 -11.138 -18.587 -2.500 822 HD3 LYS 102 HD3 LYS 102 -10.171 -17.137 -2.842 823 HE2 LYS 102 HE2 LYS 102 -8.631 -18.560 -4.229 824 HE3 LYS 102 HE3 LYS 102 -9.720 -19.939 -3.963 825 HZ1 LYS 102 HZ1 LYS 102 -11.480 -18.547 -5.020 826 HZ2 LYS 102 HZ2 LYS 102 -10.243 -18.928 -6.045 827 HZ3 LYS 102 HZ3 LYS 102 -10.330 -17.415 -5.391 828 H SER 103 H SER 103 -11.282 -15.785 1.471 829 HA SER 103 HA SER 103 -12.261 -14.151 -0.640 830 HB2 SER 103 HB2 SER 103 -13.522 -14.583 1.429 831 HB3 SER 103 HB3 SER 103 -12.309 -13.696 2.373 832 HG SER 103 HG SER 103 -14.074 -12.668 0.399 833 H LEU 104 H LEU 104 -9.777 -13.466 1.861 834 HA LEU 104 HA LEU 104 -9.387 -10.723 1.000 835 HB2 LEU 104 HB2 LEU 104 -8.591 -12.279 3.163 836 HB3 LEU 104 HB3 LEU 104 -7.089 -12.065 2.264 837 HG LEU 104 HG LEU 104 -8.894 -9.861 3.299 838 HD11 LEU 104 HD11 LEU 104 -6.156 -10.826 4.201 839 HD12 LEU 104 HD12 LEU 104 -7.694 -10.980 5.090 840 HD13 LEU 104 HD13 LEU 104 -6.989 -9.380 4.820 841 HD21 LEU 104 HD21 LEU 104 -7.023 -8.325 2.709 842 HD22 LEU 104 HD22 LEU 104 -7.823 -9.039 1.299 843 HD23 LEU 104 HD23 LEU 104 -6.247 -9.666 1.831 844 H GLN 105 H GLN 105 -8.002 -13.885 0.168 845 HA GLN 105 HA GLN 105 -5.755 -12.845 -1.288 846 HB2 GLN 105 HB2 GLN 105 -7.206 -15.492 -1.609 847 HB3 GLN 105 HB3 GLN 105 -5.652 -15.076 -2.333 848 HG2 GLN 105 HG2 GLN 105 -4.754 -14.696 -0.011 849 HG3 GLN 105 HG3 GLN 105 -6.270 -15.350 0.622 850 HE21 GLN 105 HE21 GLN 105 -6.510 -17.530 0.779 851 HE22 GLN 105 HE22 GLN 105 -5.347 -18.681 0.170 852 H GLU 106 H GLU 106 -9.164 -13.410 -2.187 853 HA GLU 106 HA GLU 106 -8.734 -13.033 -5.013 854 HB2 GLU 106 HB2 GLU 106 -11.187 -12.465 -3.301 855 HB3 GLU 106 HB3 GLU 106 -11.149 -12.423 -5.068 856 HG2 GLU 106 HG2 GLU 106 -10.686 -14.822 -3.298 857 HG3 GLU 106 HG3 GLU 106 -12.075 -14.525 -4.343 858 H LEU 107 H LEU 107 -9.437 -10.760 -2.319 859 HA LEU 107 HA LEU 107 -9.553 -8.440 -4.035 860 HB2 LEU 107 HB2 LEU 107 -8.809 -8.719 -1.106 861 HB3 LEU 107 HB3 LEU 107 -8.981 -7.190 -1.947 862 HG LEU 107 HG LEU 107 -11.176 -9.155 -1.315 863 HD11 LEU 107 HD11 LEU 107 -10.327 -7.859 0.530 864 HD12 LEU 107 HD12 LEU 107 -11.923 -7.230 0.061 865 HD13 LEU 107 HD13 LEU 107 -10.446 -6.367 -0.408 866 HD21 LEU 107 HD21 LEU 107 -11.288 -6.529 -2.867 867 HD22 LEU 107 HD22 LEU 107 -12.709 -7.370 -2.206 868 HD23 LEU 107 HD23 LEU 107 -11.733 -8.146 -3.471 869 H THR 108 H THR 108 -6.958 -10.093 -2.279 870 HA THR 108 HA THR 108 -4.872 -8.222 -2.752 871 HB THR 108 HB THR 108 -4.692 -11.284 -2.592 872 HG1 THR 108 HG1 THR 108 -5.763 -10.325 -0.789 873 HG21 THR 108 HG21 THR 108 -2.452 -10.855 -1.605 874 HG22 THR 108 HG22 THR 108 -2.635 -9.128 -2.013 875 HG23 THR 108 HG23 THR 108 -2.578 -10.350 -3.307 876 H SER 109 H SER 109 -6.082 -10.982 -4.703 877 HA SER 109 HA SER 109 -4.154 -10.611 -6.810 878 HB2 SER 109 HB2 SER 109 -6.884 -11.951 -6.896 879 HB3 SER 109 HB3 SER 109 -5.551 -12.185 -8.051 880 HG SER 109 HG SER 109 -5.762 -12.991 -5.346 881 H LYS 110 H LYS 110 -7.491 -9.439 -6.295 882 HA LYS 110 HA LYS 110 -7.852 -8.333 -8.912 883 HB2 LYS 110 HB2 LYS 110 -9.598 -8.776 -7.125 884 HB3 LYS 110 HB3 LYS 110 -9.029 -7.322 -6.300 885 HG2 LYS 110 HG2 LYS 110 -9.554 -6.049 -8.450 886 HG3 LYS 110 HG3 LYS 110 -10.365 -7.516 -9.020 887 HD2 LYS 110 HD2 LYS 110 -11.050 -5.998 -6.465 888 HD3 LYS 110 HD3 LYS 110 -11.924 -5.852 -7.997 889 HE2 LYS 110 HE2 LYS 110 -12.489 -8.280 -7.881 890 HE3 LYS 110 HE3 LYS 110 -11.669 -8.376 -6.307 891 HZ1 LYS 110 HZ1 LYS 110 -13.239 -6.741 -5.455 892 HZ2 LYS 110 HZ2 LYS 110 -14.053 -8.049 -6.048 893 HZ3 LYS 110 HZ3 LYS 110 -14.001 -6.645 -6.914 894 H LEU 111 H LEU 111 -6.399 -7.056 -5.939 895 HA LEU 111 HA LEU 111 -6.085 -4.353 -6.745 896 HB2 LEU 111 HB2 LEU 111 -5.704 -5.522 -4.491 897 HB3 LEU 111 HB3 LEU 111 -4.127 -5.980 -5.084 898 HG LEU 111 HG LEU 111 -5.028 -3.099 -4.779 899 HD11 LEU 111 HD11 LEU 111 -5.199 -4.176 -2.629 900 HD12 LEU 111 HD12 LEU 111 -3.705 -3.225 -2.633 901 HD13 LEU 111 HD13 LEU 111 -3.627 -4.986 -2.842 902 HD21 LEU 111 HD21 LEU 111 -3.073 -3.331 -6.217 903 HD22 LEU 111 HD22 LEU 111 -2.273 -4.368 -5.012 904 HD23 LEU 111 HD23 LEU 111 -2.595 -2.654 -4.653 905 H PHE 112 H PHE 112 -3.953 -7.213 -7.164 906 HA PHE 112 HA PHE 112 -1.965 -5.703 -8.602 907 HB2 PHE 112 HB2 PHE 112 -2.430 -8.694 -8.521 908 HB3 PHE 112 HB3 PHE 112 -0.966 -7.879 -9.086 909 HD1 PHE 112 HD2 PHE 112 -0.742 -5.726 -6.935 910 HD2 PHE 112 HD1 PHE 112 -1.610 -9.935 -6.671 911 HE1 PHE 112 HE2 PHE 112 0.119 -5.748 -4.615 912 HE2 PHE 112 HE1 PHE 112 -0.734 -9.956 -4.341 913 HZ PHE 112 HZ PHE 112 0.109 -7.854 -3.303 914 H SER 113 H SER 113 -4.896 -7.393 -9.588 915 HA SER 113 HA SER 113 -4.246 -7.513 -12.397 916 HB2 SER 113 HB2 SER 113 -6.088 -8.816 -11.366 917 HB3 SER 113 HB3 SER 113 -6.957 -7.308 -11.023 918 HG SER 113 HG SER 113 -6.197 -8.213 -13.610 919 H SER 114 H SER 114 -5.846 -5.082 -10.303 920 HA SER 114 HA SER 114 -6.453 -3.232 -12.416 921 HB2 SER 114 HB2 SER 114 -7.442 -3.116 -10.138 922 HB3 SER 114 HB3 SER 114 -5.853 -2.694 -9.473 923 HG SER 114 HG SER 114 -6.080 -0.722 -10.176 924 H ILE 115 H ILE 115 -3.615 -3.720 -10.317 925 HA ILE 115 HA ILE 115 -2.110 -1.478 -11.239 926 HB ILE 115 HB ILE 115 -1.535 -4.042 -9.798 927 HG12 ILE 115 HG12 ILE 115 -0.836 -1.139 -9.261 928 HG13 ILE 115 HG13 ILE 115 -2.309 -1.947 -8.718 929 HG21 ILE 115 HG21 ILE 115 0.669 -2.389 -11.109 930 HG22 ILE 115 HG22 ILE 115 0.960 -3.503 -9.759 931 HG23 ILE 115 HG23 ILE 115 0.359 -4.127 -11.301 932 HD11 ILE 115 HD11 ILE 115 0.526 -2.383 -7.792 933 HD12 ILE 115 HD12 ILE 115 -0.919 -1.980 -6.849 934 HD13 ILE 115 HD13 ILE 115 -0.739 -3.608 -7.518 935 H ASP 116 H ASP 116 -2.335 -4.841 -12.514 936 HA ASP 116 HA ASP 116 -0.219 -4.392 -14.415 937 HB2 ASP 116 HB2 ASP 116 -1.197 -6.618 -13.574 938 HB3 ASP 116 HB3 ASP 116 -2.461 -6.384 -14.793 939 H ASN 117 H ASN 117 -3.745 -3.884 -14.486 940 HA ASN 117 HA ASN 117 -3.816 -3.264 -17.312 941 HB2 ASN 117 HB2 ASN 117 -5.728 -3.745 -15.496 942 HB3 ASN 117 HB3 ASN 117 -5.746 -1.977 -15.422 943 HD21 ASN 117 HD21 ASN 117 -7.794 -3.805 -16.390 944 HD22 ASN 117 HD22 ASN 117 -8.056 -3.399 -18.069 945 H LEU 118 H LEU 118 -3.256 -1.410 -14.340 946 HA LEU 118 HA LEU 118 -3.215 1.197 -15.500 947 HB2 LEU 118 HB2 LEU 118 -3.166 0.277 -13.041 948 HB3 LEU 118 HB3 LEU 118 -1.427 0.343 -13.228 949 HG LEU 118 HG LEU 118 -3.272 2.729 -13.524 950 HD11 LEU 118 HD11 LEU 118 -2.589 3.277 -11.242 951 HD12 LEU 118 HD12 LEU 118 -1.613 1.800 -11.149 952 HD13 LEU 118 HD13 LEU 118 -3.385 1.699 -11.278 953 HD21 LEU 118 HD21 LEU 118 -0.279 2.487 -13.226 954 HD22 LEU 118 HD22 LEU 118 -1.192 4.004 -13.114 955 HD23 LEU 118 HD23 LEU 118 -1.172 3.108 -14.632 956 H ASP 119 H ASP 119 -0.698 -1.316 -15.113 957 HA ASP 119 HA ASP 119 1.513 0.189 -16.169 958 HB2 ASP 119 HB2 ASP 119 2.159 -1.801 -15.195 959 HB3 ASP 119 HB3 ASP 119 0.799 -2.706 -15.860 960 H HIS 120 H HIS 120 -1.044 -1.766 -17.786 961 HA HIS 120 HA HIS 120 0.111 -1.464 -20.423 962 HB2 HIS 120 HB2 HIS 120 -2.699 -2.097 -19.460 963 HB3 HIS 120 HB3 HIS 120 -2.309 -1.912 -21.169 964 HD1 HIS 120 HD1 HIS 120 -1.179 -4.091 -18.173 965 HD2 HIS 120 HD2 HIS 120 -1.428 -4.193 -22.366 966 HE1 HIS 120 HE1 HIS 120 -0.533 -6.435 -18.895 967 H ALA 121 H ALA 121 -2.285 0.418 -18.539 968 HA ALA 121 HA ALA 121 -2.900 2.278 -20.615 969 HB1 ALA 121 HB1 ALA 121 -4.261 2.051 -18.584 970 HB2 ALA 121 HB2 ALA 121 -2.908 2.636 -17.588 971 HB3 ALA 121 HB3 ALA 121 -3.683 3.724 -18.758 972 H ALA 122 H ALA 122 -0.295 2.189 -18.181 973 HA ALA 122 HA ALA 122 0.721 4.808 -18.802 974 HB1 ALA 122 HB1 ALA 122 1.229 3.607 -16.731 975 HB2 ALA 122 HB2 ALA 122 2.115 2.371 -17.654 976 HB3 ALA 122 HB3 ALA 122 2.718 4.044 -17.602 977 H LYS 123 H LYS 123 1.514 1.512 -19.998 978 HA LYS 123 HA LYS 123 3.746 2.380 -21.587 979 HB2 LYS 123 HB2 LYS 123 1.885 -0.011 -21.664 980 HB3 LYS 123 HB3 LYS 123 3.142 0.204 -22.890 981 HG2 LYS 123 HG2 LYS 123 4.880 0.076 -21.283 982 HG3 LYS 123 HG3 LYS 123 3.740 0.195 -19.928 983 HD2 LYS 123 HD2 LYS 123 2.770 -1.947 -20.474 984 HD3 LYS 123 HD3 LYS 123 3.778 -2.081 -21.937 985 HE2 LYS 123 HE2 LYS 123 5.758 -2.329 -20.692 986 HE3 LYS 123 HE3 LYS 123 5.011 -1.677 -19.225 987 HZ1 LYS 123 HZ1 LYS 123 5.271 -4.057 -19.113 988 HZ2 LYS 123 HZ2 LYS 123 4.303 -4.267 -20.433 989 HZ3 LYS 123 HZ3 LYS 123 3.674 -3.630 -19.041 990 H ILE 124 H ILE 124 0.258 2.249 -22.205 991 HA ILE 124 HA ILE 124 0.683 2.942 -25.032 992 HB ILE 124 HB ILE 124 -1.226 1.433 -23.996 993 HG12 ILE 124 HG12 ILE 124 -2.768 2.197 -25.898 994 HG13 ILE 124 HG13 ILE 124 -1.548 3.421 -26.258 995 HG21 ILE 124 HG21 ILE 124 -3.341 2.566 -23.599 996 HG22 ILE 124 HG22 ILE 124 -2.127 3.187 -22.477 997 HG23 ILE 124 HG23 ILE 124 -2.599 4.154 -23.889 998 HD11 ILE 124 HD11 ILE 124 -1.051 0.406 -26.217 999 HD12 ILE 124 HD12 ILE 124 -1.305 1.391 -27.677 1000 HD13 ILE 124 HD13 ILE 124 0.134 1.656 -26.670 1001 H LYS 125 H LYS 125 1.047 4.566 -22.281 1002 HA LYS 125 HA LYS 125 1.337 6.741 -21.747 1003 HB2 LYS 125 HB2 LYS 125 1.033 7.270 -24.713 1004 HB3 LYS 125 HB3 LYS 125 1.734 8.371 -23.526 1005 HG2 LYS 125 HG2 LYS 125 3.674 7.065 -23.267 1006 HG3 LYS 125 HG3 LYS 125 2.912 5.612 -23.919 1007 HD2 LYS 125 HD2 LYS 125 4.427 6.443 -25.575 1008 HD3 LYS 125 HD3 LYS 125 2.770 6.708 -26.147 1009 HE2 LYS 125 HE2 LYS 125 2.911 9.080 -25.380 1010 HE3 LYS 125 HE3 LYS 125 4.594 8.796 -24.882 1011 HZ1 LYS 125 HZ1 LYS 125 4.463 9.770 -27.097 1012 HZ2 LYS 125 HZ2 LYS 125 3.542 8.516 -27.644 1013 HZ3 LYS 125 HZ3 LYS 125 5.107 8.254 -27.192 1014 H SER 126 H SER 126 -1.340 5.712 -21.595 1015 HA SER 126 HA SER 126 -2.948 8.152 -22.191 1016 HB2 SER 126 HB2 SER 126 -3.843 6.029 -23.020 1017 HB3 SER 126 HB3 SER 126 -3.858 5.394 -21.357 1018 HG SER 126 HG SER 126 -5.876 6.356 -22.131 1019 HA PRO 127 HA PRO 127 -2.199 8.539 -17.757 1020 HB2 PRO 127 HB2 PRO 127 -2.726 11.198 -17.438 1021 HB3 PRO 127 HB3 PRO 127 -1.176 10.602 -18.115 1022 HG2 PRO 127 HG2 PRO 127 -3.623 11.571 -19.581 1023 HG3 PRO 127 HG3 PRO 127 -1.912 12.071 -19.790 1024 HD2 PRO 127 HD2 PRO 127 -3.053 10.226 -21.405 1025 HD3 PRO 127 HD3 PRO 127 -1.342 10.075 -20.877 1026 H THR 128 H THR 128 -5.028 9.497 -19.661 1027 HA THR 128 HA THR 128 -6.826 9.975 -17.472 1028 HB THR 128 HB THR 128 -8.429 9.047 -19.470 1029 HG1 THR 128 HG1 THR 128 -7.395 9.373 -21.428 1030 HG21 THR 128 HG21 THR 128 -8.475 11.347 -20.359 1031 HG22 THR 128 HG22 THR 128 -6.943 11.711 -19.532 1032 HG23 THR 128 HG23 THR 128 -8.412 11.366 -18.584 1033 H GLU 129 H GLU 129 -5.998 7.107 -19.428 1034 HA GLU 129 HA GLU 129 -7.876 5.393 -18.057 1035 HB2 GLU 129 HB2 GLU 129 -5.444 4.866 -19.795 1036 HB3 GLU 129 HB3 GLU 129 -6.490 3.580 -19.158 1037 HG2 GLU 129 HG2 GLU 129 -7.313 5.834 -21.020 1038 HG3 GLU 129 HG3 GLU 129 -7.121 4.129 -21.456 1039 H ALA 130 H ALA 130 -4.426 6.216 -17.642 1040 HA ALA 130 HA ALA 130 -3.911 4.272 -15.612 1041 HB1 ALA 130 HB1 ALA 130 -1.987 5.693 -15.042 1042 HB2 ALA 130 HB2 ALA 130 -2.131 5.499 -16.805 1043 HB3 ALA 130 HB3 ALA 130 -2.654 7.014 -16.027 1044 H GLU 131 H GLU 131 -5.165 7.642 -15.442 1045 HA GLU 131 HA GLU 131 -5.286 7.840 -12.594 1046 HB2 GLU 131 HB2 GLU 131 -6.847 9.069 -14.866 1047 HB3 GLU 131 HB3 GLU 131 -7.327 9.372 -13.200 1048 HG2 GLU 131 HG2 GLU 131 -4.499 9.871 -14.109 1049 HG3 GLU 131 HG3 GLU 131 -5.777 11.057 -14.411 1050 H LYS 132 H LYS 132 -7.580 6.539 -15.010 1051 HA LYS 132 HA LYS 132 -9.746 6.083 -13.250 1052 HB2 LYS 132 HB2 LYS 132 -9.392 5.861 -15.883 1053 HB3 LYS 132 HB3 LYS 132 -9.079 4.174 -15.473 1054 HG2 LYS 132 HG2 LYS 132 -11.383 4.553 -14.113 1055 HG3 LYS 132 HG3 LYS 132 -11.609 5.727 -15.423 1056 HD2 LYS 132 HD2 LYS 132 -10.988 2.770 -15.696 1057 HD3 LYS 132 HD3 LYS 132 -12.539 3.546 -16.041 1058 HE2 LYS 132 HE2 LYS 132 -9.916 3.908 -17.543 1059 HE3 LYS 132 HE3 LYS 132 -11.329 3.031 -18.109 1060 HZ1 LYS 132 HZ1 LYS 132 -11.053 5.245 -19.081 1061 HZ2 LYS 132 HZ2 LYS 132 -11.295 5.941 -17.604 1062 HZ3 LYS 132 HZ3 LYS 132 -12.511 5.077 -18.313 1063 H TYR 133 H TYR 133 -6.960 4.012 -14.153 1064 HA TYR 133 HA TYR 133 -7.914 1.847 -12.464 1065 HB2 TYR 133 HB2 TYR 133 -5.301 2.318 -13.900 1066 HB3 TYR 133 HB3 TYR 133 -5.649 0.866 -12.945 1067 HD1 TYR 133 HD1 TYR 133 -8.169 -0.129 -13.548 1068 HD2 TYR 133 HD2 TYR 133 -5.593 2.057 -16.217 1069 HE1 TYR 133 HE1 TYR 133 -9.382 -1.076 -15.505 1070 HE2 TYR 133 HE2 TYR 133 -6.816 1.098 -18.170 1071 HH TYR 133 HH TYR 133 -9.583 -1.121 -17.776 1072 H TYR 134 H TYR 134 -5.746 4.638 -11.940 1073 HA TYR 134 HA TYR 134 -4.664 3.638 -9.462 1074 HB2 TYR 134 HB2 TYR 134 -5.046 6.383 -10.634 1075 HB3 TYR 134 HB3 TYR 134 -4.774 6.242 -8.894 1076 HD1 TYR 134 HD1 TYR 134 -2.733 4.663 -8.176 1077 HD2 TYR 134 HD2 TYR 134 -3.155 6.570 -12.003 1078 HE1 TYR 134 HE1 TYR 134 -0.277 4.423 -8.572 1079 HE2 TYR 134 HE2 TYR 134 -0.713 6.330 -12.386 1080 HH TYR 134 HH TYR 134 1.479 4.894 -10.003 1081 H GLY 135 H GLY 135 -7.656 5.494 -10.253 1082 HA2 GLY 135 HA2 GLY 135 -8.531 5.760 -7.567 1083 HA3 GLY 135 HA3 GLY 135 -9.586 5.723 -8.993 1084 H GLN 136 H GLN 136 -9.053 3.094 -9.897 1085 HA GLN 136 HA GLN 136 -10.769 1.570 -8.160 1086 HB2 GLN 136 HB2 GLN 136 -8.933 0.748 -10.437 1087 HB3 GLN 136 HB3 GLN 136 -10.072 -0.349 -9.648 1088 HG2 GLN 136 HG2 GLN 136 -11.957 0.888 -10.433 1089 HG3 GLN 136 HG3 GLN 136 -10.945 2.240 -10.950 1090 HE21 GLN 136 HE21 GLN 136 -10.538 2.372 -13.014 1091 HE22 GLN 136 HE22 GLN 136 -10.527 1.029 -14.142 1092 H THR 137 H THR 137 -7.233 1.679 -8.633 1093 HA THR 137 HA THR 137 -6.678 -0.573 -6.948 1094 HB THR 137 HB THR 137 -4.822 1.785 -7.535 1095 HG1 THR 137 HG1 THR 137 -5.530 0.984 -9.492 1096 HG21 THR 137 HG21 THR 137 -3.059 0.094 -7.313 1097 HG22 THR 137 HG22 THR 137 -4.275 -1.154 -6.960 1098 HG23 THR 137 HG23 THR 137 -4.013 0.185 -5.819 1099 H VAL 138 H VAL 138 -6.937 2.957 -6.282 1100 HA VAL 138 HA VAL 138 -6.032 2.882 -3.574 1101 HB VAL 138 HB VAL 138 -8.130 4.668 -4.928 1102 HG11 VAL 138 HG11 VAL 138 -8.586 4.757 -2.540 1103 HG12 VAL 138 HG12 VAL 138 -6.856 4.950 -2.169 1104 HG13 VAL 138 HG13 VAL 138 -7.746 6.248 -3.000 1105 HG21 VAL 138 HG21 VAL 138 -5.631 4.743 -5.668 1106 HG22 VAL 138 HG22 VAL 138 -6.418 6.272 -5.245 1107 HG23 VAL 138 HG23 VAL 138 -5.325 5.483 -4.094 1108 H SER 139 H SER 139 -9.338 2.446 -4.953 1109 HA SER 139 HA SER 139 -10.592 2.031 -2.419 1110 HB2 SER 139 HB2 SER 139 -11.368 0.949 -5.154 1111 HB3 SER 139 HB3 SER 139 -12.433 1.079 -3.738 1112 HG SER 139 HG SER 139 -12.558 2.849 -5.292 1113 H ASN 140 H ASN 140 -9.042 -0.223 -4.726 1114 HA ASN 140 HA ASN 140 -9.848 -2.597 -3.333 1115 HB2 ASN 140 HB2 ASN 140 -8.799 -2.213 -5.724 1116 HB3 ASN 140 HB3 ASN 140 -7.263 -2.424 -4.873 1117 HD21 ASN 140 HD21 ASN 140 -7.909 -4.384 -3.021 1118 HD22 ASN 140 HD22 ASN 140 -8.303 -5.852 -3.895 1119 H ILE 141 H ILE 141 -7.059 -0.394 -2.979 1120 HA ILE 141 HA ILE 141 -5.593 -2.067 -1.145 1121 HB ILE 141 HB ILE 141 -5.585 0.946 -1.666 1122 HG12 ILE 141 HG12 ILE 141 -3.352 -1.053 -2.093 1123 HG13 ILE 141 HG13 ILE 141 -4.630 -0.859 -3.290 1124 HG21 ILE 141 HG21 ILE 141 -3.397 0.912 -0.272 1125 HG22 ILE 141 HG22 ILE 141 -4.921 0.832 0.639 1126 HG23 ILE 141 HG23 ILE 141 -3.968 -0.640 0.370 1127 HD11 ILE 141 HD11 ILE 141 -2.709 0.456 -3.923 1128 HD12 ILE 141 HD12 ILE 141 -4.053 1.537 -3.512 1129 HD13 ILE 141 HD13 ILE 141 -2.714 1.299 -2.363 1130 H ASN 142 H ASN 142 -8.079 0.494 -0.708 1131 HA ASN 142 HA ASN 142 -8.005 0.442 2.144 1132 HB2 ASN 142 HB2 ASN 142 -9.174 2.080 0.485 1133 HB3 ASN 142 HB3 ASN 142 -10.535 0.953 0.565 1134 HD21 ASN 142 HD21 ASN 142 -9.698 3.786 1.646 1135 HD22 ASN 142 HD22 ASN 142 -10.263 3.739 3.301 1136 H GLU 143 H GLU 143 -9.981 -1.407 -0.201 1137 HA GLU 143 HA GLU 143 -11.523 -2.829 1.714 1138 HB2 GLU 143 HB2 GLU 143 -10.685 -3.239 -1.141 1139 HB3 GLU 143 HB3 GLU 143 -11.452 -4.574 -0.304 1140 HG2 GLU 143 HG2 GLU 143 -12.742 -1.855 -0.369 1141 HG3 GLU 143 HG3 GLU 143 -12.907 -2.991 -1.719 1142 H VAL 144 H VAL 144 -8.336 -3.592 0.307 1143 HA VAL 144 HA VAL 144 -8.154 -6.193 1.563 1144 HB VAL 144 HB VAL 144 -6.085 -4.225 0.452 1145 HG11 VAL 144 HG11 VAL 144 -5.512 -6.937 1.725 1146 HG12 VAL 144 HG12 VAL 144 -4.363 -6.024 0.722 1147 HG13 VAL 144 HG13 VAL 144 -4.915 -5.355 2.268 1148 HG21 VAL 144 HG21 VAL 144 -7.497 -5.503 -1.147 1149 HG22 VAL 144 HG22 VAL 144 -5.787 -5.956 -1.265 1150 HG23 VAL 144 HG23 VAL 144 -6.929 -7.021 -0.421 1151 H LEU 145 H LEU 145 -7.376 -2.843 2.528 1152 HA LEU 145 HA LEU 145 -5.824 -3.592 4.832 1153 HB2 LEU 145 HB2 LEU 145 -6.805 -1.144 3.594 1154 HB3 LEU 145 HB3 LEU 145 -6.908 -1.066 5.349 1155 HG LEU 145 HG LEU 145 -4.505 -1.607 5.530 1156 HD11 LEU 145 HD11 LEU 145 -4.133 -2.887 3.492 1157 HD12 LEU 145 HD12 LEU 145 -3.088 -1.459 3.484 1158 HD13 LEU 145 HD13 LEU 145 -4.558 -1.484 2.493 1159 HD21 LEU 145 HD21 LEU 145 -5.263 0.734 5.458 1160 HD22 LEU 145 HD22 LEU 145 -5.140 0.732 3.685 1161 HD23 LEU 145 HD23 LEU 145 -3.675 0.559 4.677 1162 H ALA 146 H ALA 146 -9.280 -2.754 4.469 1163 HA ALA 146 HA ALA 146 -9.781 -2.747 7.298 1164 HB1 ALA 146 HB1 ALA 146 -12.162 -2.930 6.626 1165 HB2 ALA 146 HB2 ALA 146 -11.313 -1.733 5.618 1166 HB3 ALA 146 HB3 ALA 146 -11.671 -3.354 4.968 1167 H LYS 147 H LYS 147 -9.445 -5.335 4.971 1168 HA LYS 147 HA LYS 147 -10.601 -7.308 6.848 1169 HB2 LYS 147 HB2 LYS 147 -9.323 -7.529 4.124 1170 HB3 LYS 147 HB3 LYS 147 -9.987 -8.900 5.033 1171 HG2 LYS 147 HG2 LYS 147 -12.216 -7.824 5.040 1172 HG3 LYS 147 HG3 LYS 147 -11.553 -6.467 4.117 1173 HD2 LYS 147 HD2 LYS 147 -12.338 -7.648 2.365 1174 HD3 LYS 147 HD3 LYS 147 -10.756 -8.429 2.512 1175 HE2 LYS 147 HE2 LYS 147 -12.390 -10.150 2.241 1176 HE3 LYS 147 HE3 LYS 147 -11.843 -10.201 3.933 1177 HZ1 LYS 147 HZ1 LYS 147 -14.325 -8.871 2.985 1178 HZ2 LYS 147 HZ2 LYS 147 -13.831 -8.968 4.554 1179 HZ3 LYS 147 HZ3 LYS 147 -14.271 -10.337 3.743 1180 H LEU 148 H LEU 148 -7.595 -5.844 6.351 1181 HA LEU 148 HA LEU 148 -6.036 -8.094 7.468 1182 HB2 LEU 148 HB2 LEU 148 -5.365 -5.211 6.816 1183 HB3 LEU 148 HB3 LEU 148 -4.244 -6.285 7.633 1184 HG LEU 148 HG LEU 148 -5.353 -6.813 4.872 1185 HD11 LEU 148 HD11 LEU 148 -3.125 -6.040 4.087 1186 HD12 LEU 148 HD12 LEU 148 -2.712 -5.583 5.757 1187 HD13 LEU 148 HD13 LEU 148 -4.026 -4.752 4.902 1188 HD21 LEU 148 HD21 LEU 148 -3.485 -8.408 4.712 1189 HD22 LEU 148 HD22 LEU 148 -4.574 -8.836 6.039 1190 HD23 LEU 148 HD23 LEU 148 -3.021 -8.042 6.388 1191 H GLY 149 H GLY 149 -8.140 -5.641 8.606 1192 HA2 GLY 149 HA2 GLY 149 -6.815 -5.176 11.149 1193 HA3 GLY 149 HA3 GLY 149 -8.482 -4.762 10.722 Start of MODEL 7 1 H1 GLU 1 H1 GLU 1 22.148 32.582 6.246 2 H2 GLU 1 H2 GLU 1 23.426 32.081 5.331 3 H3 GLU 1 H3 GLU 1 21.917 31.474 5.045 4 HA GLU 1 HA GLU 1 23.229 29.841 6.205 5 HB2 GLU 1 HB2 GLU 1 24.693 31.576 7.215 6 HB3 GLU 1 HB3 GLU 1 23.383 32.014 8.318 7 HG2 GLU 1 HG2 GLU 1 23.440 29.766 9.295 8 HG3 GLU 1 HG3 GLU 1 24.731 29.305 8.169 9 H ALA 2 H ALA 2 21.568 28.437 6.554 10 HA ALA 2 HA ALA 2 19.723 28.846 8.758 11 HB1 ALA 2 HB1 ALA 2 18.711 29.003 5.867 12 HB2 ALA 2 HB2 ALA 2 17.670 28.796 7.291 13 HB3 ALA 2 HB3 ALA 2 18.601 30.293 7.090 14 H ARG 3 H ARG 3 18.592 26.860 9.185 15 HA ARG 3 HA ARG 3 18.519 24.742 7.242 16 HB2 ARG 3 HB2 ARG 3 19.804 23.047 8.298 17 HB3 ARG 3 HB3 ARG 3 20.864 24.439 8.119 18 HG2 ARG 3 HG2 ARG 3 20.449 24.968 10.553 19 HG3 ARG 3 HG3 ARG 3 19.564 23.427 10.657 20 HD2 ARG 3 HD2 ARG 3 21.620 22.299 9.684 21 HD3 ARG 3 HD3 ARG 3 22.471 23.838 9.863 22 HE ARG 3 HE ARG 3 22.394 23.614 12.231 23 HH11 ARG 3 HH11 ARG 3 21.074 20.739 10.616 24 HH12 ARG 3 HH12 ARG 3 21.256 19.764 12.046 25 HH21 ARG 3 HH21 ARG 3 22.579 22.281 13.997 26 HH22 ARG 3 HH22 ARG 3 22.074 20.616 13.912 27 HA PRO 4 HA PRO 4 14.879 24.508 9.458 28 HB2 PRO 4 HB2 PRO 4 13.866 22.037 8.908 29 HB3 PRO 4 HB3 PRO 4 14.205 23.239 7.630 30 HG2 PRO 4 HG2 PRO 4 15.952 21.003 8.599 31 HG3 PRO 4 HG3 PRO 4 15.387 21.356 6.935 32 HD2 PRO 4 HD2 PRO 4 17.798 22.186 7.774 33 HD3 PRO 4 HD3 PRO 4 16.776 23.237 6.731 34 H ILE 5 H ILE 5 16.935 24.050 11.381 35 HA ILE 5 HA ILE 5 15.335 22.446 13.322 36 HB ILE 5 HB ILE 5 17.647 21.487 12.607 37 HG12 ILE 5 HG12 ILE 5 17.159 21.882 15.572 38 HG13 ILE 5 HG13 ILE 5 16.198 20.813 14.548 39 HG21 ILE 5 HG21 ILE 5 18.695 23.477 14.636 40 HG22 ILE 5 HG22 ILE 5 19.611 22.342 13.636 41 HG23 ILE 5 HG23 ILE 5 18.826 23.738 12.878 42 HD11 ILE 5 HD11 ILE 5 19.181 20.532 15.105 43 HD12 ILE 5 HD12 ILE 5 17.877 19.507 15.737 44 HD13 ILE 5 HD13 ILE 5 18.246 19.495 13.998 45 H VAL 6 H VAL 6 16.574 25.456 12.348 46 HA VAL 6 HA VAL 6 15.544 26.658 14.849 47 HB VAL 6 HB VAL 6 18.211 27.612 13.653 48 HG11 VAL 6 HG11 VAL 6 16.712 28.446 16.187 49 HG12 VAL 6 HG12 VAL 6 18.295 29.073 15.664 50 HG13 VAL 6 HG13 VAL 6 16.844 29.409 14.699 51 HG21 VAL 6 HG21 VAL 6 19.189 26.882 15.873 52 HG22 VAL 6 HG22 VAL 6 17.674 25.992 16.170 53 HG23 VAL 6 HG23 VAL 6 18.712 25.571 14.791 54 H VAL 7 H VAL 7 16.951 27.311 11.590 55 HA VAL 7 HA VAL 7 14.900 29.459 11.261 56 HB VAL 7 HB VAL 7 17.752 29.444 10.160 57 HG11 VAL 7 HG11 VAL 7 15.563 31.568 10.044 58 HG12 VAL 7 HG12 VAL 7 17.247 31.803 9.522 59 HG13 VAL 7 HG13 VAL 7 16.218 30.638 8.673 60 HG21 VAL 7 HG21 VAL 7 16.521 31.012 12.465 61 HG22 VAL 7 HG22 VAL 7 17.865 29.851 12.542 62 HG23 VAL 7 HG23 VAL 7 18.090 31.401 11.717 63 H GLY 8 H GLY 8 13.485 28.956 9.729 64 HA2 GLY 8 HA2 GLY 8 14.463 27.856 7.175 65 HA3 GLY 8 HA3 GLY 8 13.339 26.841 8.082 66 HA PRO 9 HA PRO 9 10.636 30.514 7.086 67 HB2 PRO 9 HB2 PRO 9 11.422 32.515 5.387 68 HB3 PRO 9 HB3 PRO 9 11.730 32.574 7.155 69 HG2 PRO 9 HG2 PRO 9 13.570 31.666 4.947 70 HG3 PRO 9 HG3 PRO 9 13.883 32.848 6.260 71 HD2 PRO 9 HD2 PRO 9 14.686 30.282 6.473 72 HD3 PRO 9 HD3 PRO 9 14.026 31.165 7.895 73 HA PRO 10 HA PRO 10 9.759 28.437 3.318 74 HB2 PRO 10 HB2 PRO 10 7.264 29.320 2.678 75 HB3 PRO 10 HB3 PRO 10 7.566 28.298 4.120 76 HG2 PRO 10 HG2 PRO 10 7.330 31.290 3.950 77 HG3 PRO 10 HG3 PRO 10 6.464 30.153 5.033 78 HD2 PRO 10 HD2 PRO 10 8.680 31.488 5.842 79 HD3 PRO 10 HD3 PRO 10 8.363 29.796 6.363 80 HA PRO 11 HA PRO 11 10.738 31.325 0.080 81 HB2 PRO 11 HB2 PRO 11 10.071 29.965 -2.184 82 HB3 PRO 11 HB3 PRO 11 11.421 29.417 -1.138 83 HG2 PRO 11 HG2 PRO 11 8.571 28.484 -1.202 84 HG3 PRO 11 HG3 PRO 11 10.074 27.512 -1.287 85 HD2 PRO 11 HD2 PRO 11 8.714 27.872 1.037 86 HD3 PRO 11 HD3 PRO 11 10.511 27.780 0.997 87 HA PRO 12 HA PRO 12 6.888 33.317 -0.927 88 HB2 PRO 12 HB2 PRO 12 7.187 34.419 -3.401 89 HB3 PRO 12 HB3 PRO 12 8.088 35.026 -1.974 90 HG2 PRO 12 HG2 PRO 12 8.993 33.067 -4.075 91 HG3 PRO 12 HG3 PRO 12 9.801 34.567 -3.513 92 HD2 PRO 12 HD2 PRO 12 10.499 32.164 -2.525 93 HD3 PRO 12 HD3 PRO 12 10.406 33.601 -1.450 94 H LEU 13 H LEU 13 7.989 30.646 -2.694 95 HA LEU 13 HA LEU 13 5.566 30.338 -4.351 96 HB2 LEU 13 HB2 LEU 13 7.941 28.493 -3.899 97 HB3 LEU 13 HB3 LEU 13 6.680 28.278 -5.110 98 HG LEU 13 HG LEU 13 8.679 30.573 -5.064 99 HD11 LEU 13 HD11 LEU 13 9.725 29.403 -6.959 100 HD12 LEU 13 HD12 LEU 13 8.557 28.071 -6.794 101 HD13 LEU 13 HD13 LEU 13 9.736 28.390 -5.500 102 HD21 LEU 13 HD21 LEU 13 6.604 31.228 -6.189 103 HD22 LEU 13 HD22 LEU 13 6.622 29.734 -7.156 104 HD23 LEU 13 HD23 LEU 13 7.882 30.967 -7.392 105 H SER 14 H SER 14 6.036 30.195 -1.228 106 HA SER 14 HA SER 14 5.033 29.236 0.544 107 HB2 SER 14 HB2 SER 14 3.482 27.428 -1.330 108 HB3 SER 14 HB3 SER 14 3.118 27.797 0.366 109 HG SER 14 HG SER 14 3.101 29.589 -1.839 110 H GLY 15 H GLY 15 5.038 27.338 1.917 111 HA2 GLY 15 HA2 GLY 15 6.075 24.835 1.400 112 HA3 GLY 15 HA3 GLY 15 7.511 25.893 1.506 113 H GLY 16 H GLY 16 7.777 24.376 3.549 114 HA2 GLY 16 HA2 GLY 16 7.216 26.008 5.822 115 HA3 GLY 16 HA3 GLY 16 6.088 24.638 5.777 116 H LEU 17 H LEU 17 7.536 24.549 7.907 117 HA LEU 17 HA LEU 17 10.134 23.248 7.573 118 HB2 LEU 17 HB2 LEU 17 8.274 23.789 9.919 119 HB3 LEU 17 HB3 LEU 17 9.703 22.801 10.093 120 HG LEU 17 HG LEU 17 10.102 24.974 10.994 121 HD11 LEU 17 HD11 LEU 17 11.977 23.780 9.893 122 HD12 LEU 17 HD12 LEU 17 12.169 25.544 9.868 123 HD13 LEU 17 HD13 LEU 17 11.655 24.692 8.394 124 HD21 LEU 17 HD21 LEU 17 9.652 26.174 8.239 125 HD22 LEU 17 HD22 LEU 17 10.119 27.029 9.724 126 HD23 LEU 17 HD23 LEU 17 8.514 26.284 9.606 127 HA PRO 18 HA PRO 18 8.369 19.174 7.415 128 HB2 PRO 18 HB2 PRO 18 10.201 17.587 8.652 129 HB3 PRO 18 HB3 PRO 18 10.543 18.375 7.083 130 HG2 PRO 18 HG2 PRO 18 11.285 19.274 9.845 131 HG3 PRO 18 HG3 PRO 18 12.334 19.080 8.404 132 HD2 PRO 18 HD2 PRO 18 11.311 21.479 9.133 133 HD3 PRO 18 HD3 PRO 18 11.511 21.024 7.405 134 H GLY 19 H GLY 19 7.718 17.293 8.937 135 HA2 GLY 19 HA2 GLY 19 6.415 18.487 11.236 136 HA3 GLY 19 HA3 GLY 19 6.250 16.827 10.664 137 H THR 20 H THR 20 9.481 18.006 11.291 138 HA THR 20 HA THR 20 9.438 16.716 13.969 139 HB THR 20 HB THR 20 10.511 15.026 12.601 140 HG1 THR 20 HG1 THR 20 12.704 15.216 13.423 141 HG21 THR 20 HG21 THR 20 12.537 15.559 11.229 142 HG22 THR 20 HG22 THR 20 12.193 17.285 11.456 143 HG23 THR 20 HG23 THR 20 11.040 16.250 10.582 144 H GLU 21 H GLU 21 10.484 17.833 15.488 145 HA GLU 21 HA GLU 21 11.144 20.600 14.934 146 HB2 GLU 21 HB2 GLU 21 10.034 19.690 16.996 147 HB3 GLU 21 HB3 GLU 21 11.540 18.868 17.408 148 HG2 GLU 21 HG2 GLU 21 12.670 21.031 17.655 149 HG3 GLU 21 HG3 GLU 21 11.180 21.871 17.182 150 H ASN 22 H ASN 22 12.861 17.584 15.315 151 HA ASN 22 HA ASN 22 15.461 18.965 15.647 152 HB2 ASN 22 HB2 ASN 22 14.537 16.112 16.096 153 HB3 ASN 22 HB3 ASN 22 16.235 16.602 16.192 154 HD21 ASN 22 HD21 ASN 22 13.161 16.639 17.782 155 HD22 ASN 22 HD22 ASN 22 13.707 17.419 19.243 156 H SER 23 H SER 23 14.248 19.035 12.993 157 HA SER 23 HA SER 23 15.424 16.975 11.357 158 HB2 SER 23 HB2 SER 23 15.104 19.267 9.768 159 HB3 SER 23 HB3 SER 23 13.957 17.930 9.975 160 HG SER 23 HG SER 23 14.025 20.453 11.244 161 H ASP 24 H ASP 24 17.591 16.668 11.589 162 HA ASP 24 HA ASP 24 19.455 18.899 11.562 163 HB2 ASP 24 HB2 ASP 24 21.177 17.184 11.488 164 HB3 ASP 24 HB3 ASP 24 19.949 16.706 12.671 165 H GLN 25 H GLN 25 18.009 16.659 9.315 166 HA GLN 25 HA GLN 25 19.505 17.852 7.032 167 HB2 GLN 25 HB2 GLN 25 19.194 15.245 7.779 168 HB3 GLN 25 HB3 GLN 25 17.810 15.425 6.704 169 HG2 GLN 25 HG2 GLN 25 20.623 16.180 5.881 170 HG3 GLN 25 HG3 GLN 25 19.973 14.544 5.690 171 HE21 GLN 25 HE21 GLN 25 17.913 14.350 4.485 172 HE22 GLN 25 HE22 GLN 25 17.660 15.437 3.134 173 H ALA 26 H ALA 26 18.242 18.246 5.050 174 HA ALA 26 HA ALA 26 15.873 19.756 5.667 175 HB1 ALA 26 HB1 ALA 26 17.440 20.410 3.879 176 HB2 ALA 26 HB2 ALA 26 17.058 18.916 2.990 177 HB3 ALA 26 HB3 ALA 26 15.805 20.159 3.223 178 H ARG 27 H ARG 27 13.882 19.103 5.858 179 HA ARG 27 HA ARG 27 11.955 17.885 5.726 180 HB2 ARG 27 HB2 ARG 27 12.399 18.590 3.286 181 HB3 ARG 27 HB3 ARG 27 12.879 16.917 3.027 182 HG2 ARG 27 HG2 ARG 27 10.508 16.378 4.101 183 HG3 ARG 27 HG3 ARG 27 10.149 18.058 3.660 184 HD2 ARG 27 HD2 ARG 27 9.459 16.592 1.855 185 HD3 ARG 27 HD3 ARG 27 10.867 17.536 1.320 186 HE ARG 27 HE ARG 27 11.743 15.074 2.490 187 HH11 ARG 27 HH11 ARG 27 10.184 16.242 -0.462 188 HH12 ARG 27 HH12 ARG 27 10.801 14.926 -1.422 189 HH21 ARG 27 HH21 ARG 27 12.498 13.438 1.207 190 HH22 ARG 27 HH22 ARG 27 12.092 13.357 -0.486 191 H ASP 28 H ASP 28 13.862 16.620 7.205 192 HA ASP 28 HA ASP 28 13.738 13.768 6.417 193 HB2 ASP 28 HB2 ASP 28 15.788 15.165 7.429 194 HB3 ASP 28 HB3 ASP 28 15.061 14.629 8.949 195 H GLY 29 H GLY 29 13.740 12.625 8.994 196 HA2 GLY 29 HA2 GLY 29 12.309 12.352 10.890 197 HA3 GLY 29 HA3 GLY 29 11.147 13.498 10.192 198 H THR 30 H THR 30 12.603 11.026 8.195 199 HA THR 30 HA THR 30 9.941 9.907 7.671 200 HB THR 30 HB THR 30 12.664 9.070 6.559 201 HG1 THR 30 HG1 THR 30 12.138 11.239 6.064 202 HG21 THR 30 HG21 THR 30 9.816 8.583 5.586 203 HG22 THR 30 HG22 THR 30 10.946 7.352 6.203 204 HG23 THR 30 HG23 THR 30 11.290 8.191 4.676 205 H LEU 31 H LEU 31 9.101 8.240 8.778 206 HA LEU 31 HA LEU 31 10.981 6.340 10.106 207 HB2 LEU 31 HB2 LEU 31 9.125 5.833 11.651 208 HB3 LEU 31 HB3 LEU 31 9.841 7.414 11.828 209 HG LEU 31 HG LEU 31 7.223 7.125 10.357 210 HD11 LEU 31 HD11 LEU 31 7.625 7.238 13.372 211 HD12 LEU 31 HD12 LEU 31 6.983 5.859 12.446 212 HD13 LEU 31 HD13 LEU 31 6.066 7.377 12.526 213 HD21 LEU 31 HD21 LEU 31 6.806 9.365 11.350 214 HD22 LEU 31 HD22 LEU 31 8.251 9.358 10.331 215 HD23 LEU 31 HD23 LEU 31 8.418 9.325 12.098 216 HA PRO 32 HA PRO 32 8.781 3.962 6.937 217 HB2 PRO 32 HB2 PRO 32 10.696 2.127 6.345 218 HB3 PRO 32 HB3 PRO 32 10.774 3.808 5.723 219 HG2 PRO 32 HG2 PRO 32 12.127 2.628 8.145 220 HG3 PRO 32 HG3 PRO 32 12.853 3.561 6.796 221 HD2 PRO 32 HD2 PRO 32 12.164 4.738 9.137 222 HD3 PRO 32 HD3 PRO 32 11.956 5.586 7.565 223 H TYR 33 H TYR 33 7.822 1.859 6.959 224 HA TYR 33 HA TYR 33 7.313 0.838 9.577 225 HB2 TYR 33 HB2 TYR 33 5.938 -0.821 8.480 226 HB3 TYR 33 HB3 TYR 33 5.686 0.758 7.742 227 HD1 TYR 33 HD2 TYR 33 6.851 1.250 5.466 228 HD2 TYR 33 HD1 TYR 33 6.549 -2.707 7.142 229 HE1 TYR 33 HE2 TYR 33 7.260 0.266 3.221 230 HE2 TYR 33 HE1 TYR 33 6.950 -3.683 4.872 231 HH TYR 33 HH TYR 33 7.240 -3.229 2.616 232 H THR 34 H THR 34 9.791 0.075 7.281 233 HA THR 34 HA THR 34 10.909 -1.797 9.218 234 HB THR 34 HB THR 34 9.541 -3.292 7.719 235 HG1 THR 34 HG1 THR 34 11.372 -4.660 7.230 236 HG21 THR 34 HG21 THR 34 10.160 -3.646 5.419 237 HG22 THR 34 HG22 THR 34 11.508 -2.495 5.538 238 HG23 THR 34 HG23 THR 34 9.825 -1.918 5.615 239 H LYS 35 H LYS 35 13.134 -2.053 8.931 240 HA LYS 35 HA LYS 35 14.558 -0.831 6.719 241 HB2 LYS 35 HB2 LYS 35 13.953 1.125 8.254 242 HB3 LYS 35 HB3 LYS 35 15.006 0.424 9.468 243 HG2 LYS 35 HG2 LYS 35 16.023 1.075 6.671 244 HG3 LYS 35 HG3 LYS 35 15.925 2.315 7.937 245 HD2 LYS 35 HD2 LYS 35 17.290 0.843 9.414 246 HD3 LYS 35 HD3 LYS 35 17.507 -0.261 8.049 247 HE2 LYS 35 HE2 LYS 35 18.630 1.525 6.776 248 HE3 LYS 35 HE3 LYS 35 18.429 2.627 8.167 249 HZ1 LYS 35 HZ1 LYS 35 19.902 0.036 8.215 250 HZ2 LYS 35 HZ2 LYS 35 19.683 1.012 9.513 251 HZ3 LYS 35 HZ3 LYS 35 20.602 1.537 8.237 252 H ASP 36 H ASP 36 15.623 -1.192 10.131 253 HA ASP 36 HA ASP 36 17.289 -3.525 9.305 254 HB2 ASP 36 HB2 ASP 36 17.264 -1.844 11.846 255 HB3 ASP 36 HB3 ASP 36 18.361 -3.201 11.537 256 H ARG 37 H ARG 37 14.257 -3.095 10.124 257 HA ARG 37 HA ARG 37 13.734 -4.353 12.567 258 HB2 ARG 37 HB2 ARG 37 12.104 -3.088 11.132 259 HB3 ARG 37 HB3 ARG 37 12.003 -4.501 10.076 260 HG2 ARG 37 HG2 ARG 37 11.092 -5.853 11.915 261 HG3 ARG 37 HG3 ARG 37 11.270 -4.478 13.025 262 HD2 ARG 37 HD2 ARG 37 9.756 -3.164 11.505 263 HD3 ARG 37 HD3 ARG 37 9.451 -4.660 10.598 264 HE ARG 37 HE ARG 37 8.832 -5.464 13.110 265 HH11 ARG 37 HH11 ARG 37 7.847 -2.531 11.362 266 HH12 ARG 37 HH12 ARG 37 6.382 -2.380 12.300 267 HH21 ARG 37 HH21 ARG 37 6.966 -5.191 14.245 268 HH22 ARG 37 HH22 ARG 37 5.894 -3.847 13.893 269 H PHE 38 H PHE 38 14.158 -5.889 9.369 270 HA PHE 38 HA PHE 38 13.260 -8.460 10.285 271 HB2 PHE 38 HB2 PHE 38 14.998 -7.721 7.906 272 HB3 PHE 38 HB3 PHE 38 14.180 -9.268 8.152 273 HD1 PHE 38 HD2 PHE 38 11.505 -8.740 8.921 274 HD2 PHE 38 HD1 PHE 38 13.977 -6.461 6.234 275 HE1 PHE 38 HE2 PHE 38 9.467 -7.887 7.785 276 HE2 PHE 38 HE1 PHE 38 11.941 -5.604 5.085 277 HZ PHE 38 HZ PHE 38 9.671 -6.318 5.864 278 H TYR 39 H TYR 39 16.126 -6.840 11.027 279 HA TYR 39 HA TYR 39 17.607 -9.414 11.346 280 HB2 TYR 39 HB2 TYR 39 18.725 -6.616 11.632 281 HB3 TYR 39 HB3 TYR 39 19.606 -8.128 11.367 282 HD1 TYR 39 HD2 TYR 39 18.582 -9.417 9.074 283 HD2 TYR 39 HD1 TYR 39 18.708 -5.176 9.807 284 HE1 TYR 39 HE2 TYR 39 18.469 -8.983 6.622 285 HE2 TYR 39 HE1 TYR 39 18.577 -4.752 7.351 286 HH TYR 39 HH TYR 39 18.428 -7.416 4.971 287 H LEU 40 H LEU 40 16.476 -6.467 12.964 288 HA LEU 40 HA LEU 40 17.540 -7.228 15.566 289 HB2 LEU 40 HB2 LEU 40 15.815 -5.055 14.429 290 HB3 LEU 40 HB3 LEU 40 15.680 -5.387 16.153 291 HG LEU 40 HG LEU 40 18.065 -4.925 16.475 292 HD11 LEU 40 HD11 LEU 40 19.370 -3.821 14.658 293 HD12 LEU 40 HD12 LEU 40 18.084 -4.249 13.508 294 HD13 LEU 40 HD13 LEU 40 19.018 -5.525 14.318 295 HD21 LEU 40 HD21 LEU 40 16.373 -3.137 16.686 296 HD22 LEU 40 HD22 LEU 40 16.576 -2.738 14.961 297 HD23 LEU 40 HD23 LEU 40 17.921 -2.496 16.098 298 H GLN 41 H GLN 41 14.406 -7.501 13.899 299 HA GLN 41 HA GLN 41 13.359 -8.993 16.265 300 HB2 GLN 41 HB2 GLN 41 11.860 -7.114 14.397 301 HB3 GLN 41 HB3 GLN 41 11.127 -8.073 15.689 302 HG2 GLN 41 HG2 GLN 41 12.519 -6.848 17.351 303 HG3 GLN 41 HG3 GLN 41 13.171 -5.854 16.041 304 HE21 GLN 41 HE21 GLN 41 12.226 -3.970 15.736 305 HE22 GLN 41 HE22 GLN 41 10.583 -3.577 16.184 306 HA PRO 42 HA PRO 42 12.404 -12.044 13.168 307 HB2 PRO 42 HB2 PRO 42 10.284 -13.374 14.242 308 HB3 PRO 42 HB3 PRO 42 11.928 -13.515 14.948 309 HG2 PRO 42 HG2 PRO 42 9.655 -11.721 15.787 310 HG3 PRO 42 HG3 PRO 42 10.639 -12.835 16.791 311 HD2 PRO 42 HD2 PRO 42 11.183 -10.185 16.636 312 HD3 PRO 42 HD3 PRO 42 12.495 -11.409 16.758 313 H LEU 43 H LEU 43 10.488 -12.663 11.716 314 HA LEU 43 HA LEU 43 8.635 -10.333 11.454 315 HB2 LEU 43 HB2 LEU 43 8.578 -11.010 9.009 316 HB3 LEU 43 HB3 LEU 43 10.012 -10.207 9.606 317 HG LEU 43 HG LEU 43 10.169 -13.170 9.596 318 HD11 LEU 43 HD11 LEU 43 10.037 -11.569 7.009 319 HD12 LEU 43 HD12 LEU 43 8.870 -12.804 7.549 320 HD13 LEU 43 HD13 LEU 43 10.538 -13.269 7.157 321 HD21 LEU 43 HD21 LEU 43 12.100 -11.633 10.117 322 HD22 LEU 43 HD22 LEU 43 12.007 -11.015 8.455 323 HD23 LEU 43 HD23 LEU 43 12.413 -12.718 8.749 324 HA PRO 44 HA PRO 44 6.073 -14.114 12.073 325 HB2 PRO 44 HB2 PRO 44 4.342 -13.193 13.965 326 HB3 PRO 44 HB3 PRO 44 5.998 -13.738 14.387 327 HG2 PRO 44 HG2 PRO 44 5.003 -10.960 13.866 328 HG3 PRO 44 HG3 PRO 44 5.914 -11.580 15.278 329 HD2 PRO 44 HD2 PRO 44 7.154 -10.327 13.230 330 HD3 PRO 44 HD3 PRO 44 7.912 -11.723 14.071 331 HA PRO 45 HA PRO 45 2.852 -12.805 9.367 332 HB2 PRO 45 HB2 PRO 45 0.677 -14.309 10.036 333 HB3 PRO 45 HB3 PRO 45 2.131 -15.004 9.256 334 HG2 PRO 45 HG2 PRO 45 1.433 -14.921 12.178 335 HG3 PRO 45 HG3 PRO 45 1.906 -16.331 11.168 336 HD2 PRO 45 HD2 PRO 45 3.723 -15.070 12.676 337 HD3 PRO 45 HD3 PRO 45 4.146 -15.606 11.012 338 H THR 46 H THR 46 2.271 -12.507 12.815 339 HA THR 46 HA THR 46 -0.196 -11.033 12.643 340 HB THR 46 HB THR 46 0.628 -10.186 14.958 341 HG1 THR 46 HG1 THR 46 2.441 -11.255 15.750 342 HG21 THR 46 HG21 THR 46 0.525 -13.199 14.496 343 HG22 THR 46 HG22 THR 46 -0.894 -12.139 14.682 344 HG23 THR 46 HG23 THR 46 0.238 -12.359 16.034 345 H GLU 47 H GLU 47 3.275 -10.097 12.867 346 HA GLU 47 HA GLU 47 2.777 -7.258 12.669 347 HB2 GLU 47 HB2 GLU 47 5.183 -8.986 12.001 348 HB3 GLU 47 HB3 GLU 47 5.147 -7.235 11.767 349 HG2 GLU 47 HG2 GLU 47 4.583 -7.037 14.217 350 HG3 GLU 47 HG3 GLU 47 5.023 -8.750 14.357 351 H ALA 48 H ALA 48 3.278 -9.898 10.371 352 HA ALA 48 HA ALA 48 3.810 -8.372 8.071 353 HB1 ALA 48 HB1 ALA 48 2.255 -10.977 8.203 354 HB2 ALA 48 HB2 ALA 48 3.142 -10.330 6.809 355 HB3 ALA 48 HB3 ALA 48 4.024 -10.854 8.259 356 H ALA 49 H ALA 49 0.714 -8.981 9.716 357 HA ALA 49 HA ALA 49 -0.972 -8.179 7.564 358 HB1 ALA 49 HB1 ALA 49 -1.381 -7.828 10.571 359 HB2 ALA 49 HB2 ALA 49 -2.652 -7.723 9.329 360 HB3 ALA 49 HB3 ALA 49 -1.816 -9.268 9.623 361 H GLN 50 H GLN 50 0.671 -6.275 10.114 362 HA GLN 50 HA GLN 50 -0.484 -3.800 9.067 363 HB2 GLN 50 HB2 GLN 50 1.618 -4.304 11.193 364 HB3 GLN 50 HB3 GLN 50 0.988 -2.712 10.742 365 HG2 GLN 50 HG2 GLN 50 -1.334 -3.596 11.272 366 HG3 GLN 50 HG3 GLN 50 -0.552 -5.019 11.978 367 HE21 GLN 50 HE21 GLN 50 -0.776 -4.811 14.128 368 HE22 GLN 50 HE22 GLN 50 -0.380 -3.374 15.039 369 H ARG 51 H ARG 51 2.620 -5.547 8.758 370 HA ARG 51 HA ARG 51 3.978 -3.354 7.439 371 HB2 ARG 51 HB2 ARG 51 4.352 -6.355 7.167 372 HB3 ARG 51 HB3 ARG 51 5.414 -5.139 6.453 373 HG2 ARG 51 HG2 ARG 51 5.802 -4.274 8.836 374 HG3 ARG 51 HG3 ARG 51 5.035 -5.777 9.384 375 HD2 ARG 51 HD2 ARG 51 7.492 -5.517 7.617 376 HD3 ARG 51 HD3 ARG 51 7.463 -6.079 9.297 377 HE ARG 51 HE ARG 51 6.424 -7.524 6.884 378 HH11 ARG 51 HH11 ARG 51 7.219 -7.662 10.364 379 HH12 ARG 51 HH12 ARG 51 7.052 -9.387 10.396 380 HH21 ARG 51 HH21 ARG 51 6.229 -9.695 7.039 381 HH22 ARG 51 HH22 ARG 51 6.533 -10.525 8.556 382 H ALA 52 H ALA 52 1.917 -6.047 6.284 383 HA ALA 52 HA ALA 52 2.159 -5.403 3.504 384 HB1 ALA 52 HB1 ALA 52 0.080 -6.759 3.266 385 HB2 ALA 52 HB2 ALA 52 1.289 -7.575 4.285 386 HB3 ALA 52 HB3 ALA 52 -0.110 -6.767 5.034 387 H LYS 53 H LYS 53 -0.045 -4.259 6.093 388 HA LYS 53 HA LYS 53 -1.790 -2.769 4.423 389 HB2 LYS 53 HB2 LYS 53 -2.506 -3.105 6.606 390 HB3 LYS 53 HB3 LYS 53 -0.952 -2.679 7.300 391 HG2 LYS 53 HG2 LYS 53 -1.314 -0.345 6.905 392 HG3 LYS 53 HG3 LYS 53 -2.822 -0.694 6.035 393 HD2 LYS 53 HD2 LYS 53 -3.765 -1.711 8.087 394 HD3 LYS 53 HD3 LYS 53 -2.270 -1.335 8.961 395 HE2 LYS 53 HE2 LYS 53 -4.080 0.738 7.652 396 HE3 LYS 53 HE3 LYS 53 -4.135 0.292 9.370 397 HZ1 LYS 53 HZ1 LYS 53 -1.787 1.462 7.989 398 HZ2 LYS 53 HZ2 LYS 53 -1.846 1.043 9.585 399 HZ3 LYS 53 HZ3 LYS 53 -2.796 2.266 9.015 400 H VAL 54 H VAL 54 1.373 -1.840 5.896 401 HA VAL 54 HA VAL 54 1.190 0.827 4.725 402 HB VAL 54 HB VAL 54 3.654 -0.595 5.829 403 HG11 VAL 54 HG11 VAL 54 4.472 1.786 6.114 404 HG12 VAL 54 HG12 VAL 54 4.284 1.310 4.416 405 HG13 VAL 54 HG13 VAL 54 3.061 2.341 5.192 406 HG21 VAL 54 HG21 VAL 54 3.205 0.747 7.883 407 HG22 VAL 54 HG22 VAL 54 1.685 1.326 7.165 408 HG23 VAL 54 HG23 VAL 54 1.895 -0.394 7.554 409 H SER 55 H SER 55 2.636 -2.290 3.742 410 HA SER 55 HA SER 55 4.089 -1.272 1.491 411 HB2 SER 55 HB2 SER 55 2.757 -3.987 1.823 412 HB3 SER 55 HB3 SER 55 4.028 -3.578 0.656 413 HG SER 55 HG SER 55 4.234 -3.525 3.503 414 H ALA 56 H ALA 56 0.674 -2.073 1.974 415 HA ALA 56 HA ALA 56 -0.022 -1.832 -0.838 416 HB1 ALA 56 HB1 ALA 56 -1.855 -1.494 1.548 417 HB2 ALA 56 HB2 ALA 56 -2.258 -2.040 -0.096 418 HB3 ALA 56 HB3 ALA 56 -1.312 -3.087 0.972 419 H SER 57 H SER 57 0.248 0.344 1.948 420 HA SER 57 HA SER 57 -1.077 2.569 0.684 421 HB2 SER 57 HB2 SER 57 -0.725 2.308 3.155 422 HB3 SER 57 HB3 SER 57 1.003 2.630 2.899 423 HG SER 57 HG SER 57 0.303 4.643 1.895 424 H GLU 58 H GLU 58 2.207 1.278 0.576 425 HA GLU 58 HA GLU 58 3.560 3.563 -0.487 426 HB2 GLU 58 HB2 GLU 58 3.911 0.577 -0.862 427 HB3 GLU 58 HB3 GLU 58 4.949 1.727 -1.676 428 HG2 GLU 58 HG2 GLU 58 4.601 1.667 1.332 429 HG3 GLU 58 HG3 GLU 58 5.838 0.734 0.473 430 H ILE 59 H ILE 59 1.492 1.089 -1.952 431 HA ILE 59 HA ILE 59 2.067 1.742 -4.684 432 HB ILE 59 HB ILE 59 -0.407 0.450 -3.452 433 HG12 ILE 59 HG12 ILE 59 2.040 -0.837 -4.728 434 HG13 ILE 59 HG13 ILE 59 1.791 -0.693 -2.988 435 HG21 ILE 59 HG21 ILE 59 0.582 0.325 -6.333 436 HG22 ILE 59 HG22 ILE 59 -0.880 -0.441 -5.666 437 HG23 ILE 59 HG23 ILE 59 -0.786 1.317 -5.777 438 HD11 ILE 59 HD11 ILE 59 -0.349 -2.040 -3.270 439 HD12 ILE 59 HD12 ILE 59 0.183 -2.367 -4.939 440 HD13 ILE 59 HD13 ILE 59 1.172 -2.911 -3.567 441 H LEU 60 H LEU 60 -0.261 3.011 -2.307 442 HA LEU 60 HA LEU 60 -1.874 4.528 -4.122 443 HB2 LEU 60 HB2 LEU 60 -1.093 5.211 -1.265 444 HB3 LEU 60 HB3 LEU 60 -2.437 5.903 -2.150 445 HG LEU 60 HG LEU 60 -2.262 2.974 -1.366 446 HD11 LEU 60 HD11 LEU 60 -2.289 4.476 0.616 447 HD12 LEU 60 HD12 LEU 60 -3.793 3.544 0.459 448 HD13 LEU 60 HD13 LEU 60 -3.756 5.260 -0.013 449 HD21 LEU 60 HD21 LEU 60 -4.602 4.684 -2.253 450 HD22 LEU 60 HD22 LEU 60 -4.658 2.965 -1.809 451 HD23 LEU 60 HD23 LEU 60 -3.771 3.475 -3.259 452 H ASN 61 H ASN 61 1.190 5.200 -2.462 453 HA ASN 61 HA ASN 61 1.294 7.984 -3.118 454 HB2 ASN 61 HB2 ASN 61 2.568 6.762 -1.307 455 HB3 ASN 61 HB3 ASN 61 3.625 6.122 -2.575 456 HD21 ASN 61 HD21 ASN 61 5.497 7.136 -2.360 457 HD22 ASN 61 HD22 ASN 61 5.690 8.868 -2.254 458 H VAL 62 H VAL 62 1.965 5.170 -5.077 459 HA VAL 62 HA VAL 62 3.913 6.438 -6.784 460 HB VAL 62 HB VAL 62 2.128 4.097 -7.583 461 HG11 VAL 62 HG11 VAL 62 4.169 3.432 -8.884 462 HG12 VAL 62 HG12 VAL 62 3.527 4.998 -9.404 463 HG13 VAL 62 HG13 VAL 62 4.968 4.934 -8.367 464 HG21 VAL 62 HG21 VAL 62 3.076 3.524 -5.424 465 HG22 VAL 62 HG22 VAL 62 3.972 2.650 -6.666 466 HG23 VAL 62 HG23 VAL 62 4.681 4.098 -5.913 467 H LYS 63 H LYS 63 0.586 7.046 -6.413 468 HA LYS 63 HA LYS 63 -0.279 7.618 -9.045 469 HB2 LYS 63 HB2 LYS 63 -1.544 7.747 -6.816 470 HB3 LYS 63 HB3 LYS 63 -0.914 9.392 -6.672 471 HG2 LYS 63 HG2 LYS 63 -2.278 8.627 -9.242 472 HG3 LYS 63 HG3 LYS 63 -3.294 8.804 -7.806 473 HD2 LYS 63 HD2 LYS 63 -2.565 11.118 -7.495 474 HD3 LYS 63 HD3 LYS 63 -1.397 10.963 -8.813 475 HE2 LYS 63 HE2 LYS 63 -3.329 10.408 -10.351 476 HE3 LYS 63 HE3 LYS 63 -4.418 10.874 -9.037 477 HZ1 LYS 63 HZ1 LYS 63 -2.363 12.670 -10.204 478 HZ2 LYS 63 HZ2 LYS 63 -3.539 13.093 -9.129 479 HZ3 LYS 63 HZ3 LYS 63 -3.950 12.653 -10.672 480 H GLN 64 H GLN 64 2.132 9.280 -7.088 481 HA GLN 64 HA GLN 64 2.205 11.800 -8.395 482 HB2 GLN 64 HB2 GLN 64 4.458 10.115 -7.247 483 HB3 GLN 64 HB3 GLN 64 4.610 11.810 -7.727 484 HG2 GLN 64 HG2 GLN 64 2.919 12.439 -6.040 485 HG3 GLN 64 HG3 GLN 64 2.799 10.747 -5.535 486 HE21 GLN 64 HE21 GLN 64 3.452 11.365 -3.413 487 HE22 GLN 64 HE22 GLN 64 5.122 11.728 -3.068 488 H PHE 65 H PHE 65 3.045 8.680 -9.749 489 HA PHE 65 HA PHE 65 4.996 9.608 -11.644 490 HB2 PHE 65 HB2 PHE 65 5.067 7.415 -12.018 491 HB3 PHE 65 HB3 PHE 65 3.584 7.169 -11.097 492 HD1 PHE 65 HD2 PHE 65 1.391 7.092 -12.234 493 HD2 PHE 65 HD1 PHE 65 5.041 7.508 -14.457 494 HE1 PHE 65 HE2 PHE 65 0.179 6.510 -14.327 495 HE2 PHE 65 HE1 PHE 65 3.830 6.951 -16.561 496 HZ PHE 65 HZ PHE 65 1.390 6.463 -16.500 497 H ILE 66 H ILE 66 1.502 9.923 -11.460 498 HA ILE 66 HA ILE 66 0.950 10.341 -14.243 499 HB ILE 66 HB ILE 66 -0.392 11.517 -11.745 500 HG12 ILE 66 HG12 ILE 66 -0.445 9.031 -11.911 501 HG13 ILE 66 HG13 ILE 66 -2.035 9.776 -11.963 502 HG21 ILE 66 HG21 ILE 66 -1.307 11.584 -14.661 503 HG22 ILE 66 HG22 ILE 66 -2.395 11.883 -13.284 504 HG23 ILE 66 HG23 ILE 66 -1.016 12.962 -13.576 505 HD11 ILE 66 HD11 ILE 66 -2.206 9.393 -14.370 506 HD12 ILE 66 HD12 ILE 66 -0.545 8.772 -14.419 507 HD13 ILE 66 HD13 ILE 66 -1.803 7.880 -13.541 508 H ASP 67 H ASP 67 1.865 12.572 -11.603 509 HA ASP 67 HA ASP 67 1.812 14.945 -13.187 510 HB2 ASP 67 HB2 ASP 67 3.491 14.312 -10.733 511 HB3 ASP 67 HB3 ASP 67 3.024 15.922 -11.304 512 H ARG 68 H ARG 68 4.212 12.441 -12.648 513 HA ARG 68 HA ARG 68 6.399 13.955 -13.888 514 HB2 ARG 68 HB2 ARG 68 6.097 11.044 -13.067 515 HB3 ARG 68 HB3 ARG 68 7.574 11.727 -13.754 516 HG2 ARG 68 HG2 ARG 68 7.795 13.258 -11.890 517 HG3 ARG 68 HG3 ARG 68 6.274 12.674 -11.185 518 HD2 ARG 68 HD2 ARG 68 7.176 10.499 -10.793 519 HD3 ARG 68 HD3 ARG 68 8.602 10.834 -11.791 520 HE ARG 68 HE ARG 68 8.118 11.704 -9.024 521 HH11 ARG 68 HH21 ARG 68 10.176 12.059 -11.878 522 HH12 ARG 68 HH22 ARG 68 11.494 12.731 -10.958 523 HH21 ARG 68 HH11 ARG 68 9.835 12.590 -7.928 524 HH22 ARG 68 HH12 ARG 68 11.302 13.025 -8.762 525 H LYS 69 H LYS 69 3.796 12.030 -15.045 526 HA LYS 69 HA LYS 69 3.268 11.130 -17.087 527 HB2 LYS 69 HB2 LYS 69 3.781 13.622 -17.488 528 HB3 LYS 69 HB3 LYS 69 5.268 13.083 -18.264 529 HG2 LYS 69 HG2 LYS 69 4.029 11.953 -19.983 530 HG3 LYS 69 HG3 LYS 69 2.495 12.210 -19.118 531 HD2 LYS 69 HD2 LYS 69 2.700 14.623 -19.357 532 HD3 LYS 69 HD3 LYS 69 4.298 14.455 -20.106 533 HE2 LYS 69 HE2 LYS 69 1.758 13.275 -21.280 534 HE3 LYS 69 HE3 LYS 69 2.397 14.878 -21.711 535 HZ1 LYS 69 HZ1 LYS 69 3.889 12.340 -22.000 536 HZ2 LYS 69 HZ2 LYS 69 4.425 13.833 -22.447 537 HZ3 LYS 69 HZ3 LYS 69 3.148 13.146 -23.239 538 H ALA 70 H ALA 70 5.452 9.911 -15.604 539 HA ALA 70 HA ALA 70 7.516 9.229 -17.564 540 HB1 ALA 70 HB1 ALA 70 7.207 8.465 -14.635 541 HB2 ALA 70 HB2 ALA 70 8.645 8.178 -15.640 542 HB3 ALA 70 HB3 ALA 70 8.138 9.842 -15.277 543 H TRP 71 H TRP 71 6.046 7.987 -19.003 544 HA TRP 71 HA TRP 71 4.778 5.592 -18.362 545 HB2 TRP 71 HB2 TRP 71 6.379 5.834 -20.892 546 HB3 TRP 71 HB3 TRP 71 4.815 5.082 -20.632 547 HD1 TRP 71 HD1 TRP 71 6.118 7.883 -22.358 548 HE1 TRP 71 HE1 TRP 71 4.513 9.818 -22.644 549 HE3 TRP 71 HE3 TRP 71 2.726 6.520 -18.778 550 HZ2 TRP 71 HZ2 TRP 71 2.038 10.676 -21.496 551 HZ3 TRP 71 HZ3 TRP 71 0.720 7.972 -18.416 552 HH2 TRP 71 HH2 TRP 71 0.405 10.040 -19.769 553 HA PRO 72 HA PRO 72 8.365 2.873 -19.219 554 HB2 PRO 72 HB2 PRO 72 10.982 3.559 -19.183 555 HB3 PRO 72 HB3 PRO 72 9.941 3.870 -20.611 556 HG2 PRO 72 HG2 PRO 72 10.678 5.743 -18.374 557 HG3 PRO 72 HG3 PRO 72 10.841 5.986 -20.144 558 HD2 PRO 72 HD2 PRO 72 8.714 6.936 -18.775 559 HD3 PRO 72 HD3 PRO 72 8.534 6.271 -20.436 560 H SER 73 H SER 73 8.733 5.113 -16.517 561 HA SER 73 HA SER 73 10.412 3.178 -15.061 562 HB2 SER 73 HB2 SER 73 10.438 4.814 -13.276 563 HB3 SER 73 HB3 SER 73 10.784 5.621 -14.820 564 HG SER 73 HG SER 73 8.665 5.904 -13.094 565 H LEU 74 H LEU 74 7.008 4.046 -15.327 566 HA LEU 74 HA LEU 74 6.217 3.182 -12.753 567 HB2 LEU 74 HB2 LEU 74 4.810 4.468 -14.418 568 HB3 LEU 74 HB3 LEU 74 4.557 2.942 -15.283 569 HG LEU 74 HG LEU 74 3.657 1.988 -13.092 570 HD11 LEU 74 HD11 LEU 74 2.833 3.642 -11.444 571 HD12 LEU 74 HD12 LEU 74 3.686 4.918 -12.326 572 HD13 LEU 74 HD13 LEU 74 4.599 3.619 -11.543 573 HD21 LEU 74 HD21 LEU 74 1.486 3.154 -13.263 574 HD22 LEU 74 HD22 LEU 74 2.123 2.525 -14.785 575 HD23 LEU 74 HD23 LEU 74 2.234 4.261 -14.424 576 H GLN 75 H GLN 75 6.562 1.339 -15.777 577 HA GLN 75 HA GLN 75 5.394 -1.067 -14.846 578 HB2 GLN 75 HB2 GLN 75 6.683 -2.153 -16.657 579 HB3 GLN 75 HB3 GLN 75 5.847 -0.697 -17.199 580 HG2 GLN 75 HG2 GLN 75 7.869 0.547 -17.292 581 HG3 GLN 75 HG3 GLN 75 8.776 -0.721 -16.453 582 HE21 GLN 75 HE21 GLN 75 10.247 -1.280 -17.951 583 HE22 GLN 75 HE22 GLN 75 9.844 -1.912 -19.529 584 H ASN 76 H ASN 76 8.383 0.395 -13.936 585 HA ASN 76 HA ASN 76 9.388 -2.154 -12.765 586 HB2 ASN 76 HB2 ASN 76 11.037 -0.689 -13.891 587 HB3 ASN 76 HB3 ASN 76 10.565 0.662 -12.855 588 HD21 ASN 76 HD21 ASN 76 11.696 1.006 -11.064 589 HD22 ASN 76 HD22 ASN 76 12.752 -0.184 -10.330 590 H ASP 77 H ASP 77 8.806 1.255 -11.792 591 HA ASP 77 HA ASP 77 9.195 0.800 -9.061 592 HB2 ASP 77 HB2 ASP 77 7.493 2.936 -10.402 593 HB3 ASP 77 HB3 ASP 77 8.136 3.018 -8.754 594 H LEU 78 H LEU 78 6.061 0.917 -10.823 595 HA LEU 78 HA LEU 78 4.493 0.787 -8.397 596 HB2 LEU 78 HB2 LEU 78 3.700 1.611 -10.610 597 HB3 LEU 78 HB3 LEU 78 3.809 -0.017 -11.248 598 HG LEU 78 HG LEU 78 2.044 -0.699 -9.577 599 HD11 LEU 78 HD11 LEU 78 0.610 1.107 -8.678 600 HD12 LEU 78 HD12 LEU 78 1.766 2.318 -9.270 601 HD13 LEU 78 HD13 LEU 78 2.245 1.172 -7.994 602 HD21 LEU 78 HD21 LEU 78 1.603 -0.262 -11.975 603 HD22 LEU 78 HD22 LEU 78 1.309 1.452 -11.598 604 HD23 LEU 78 HD23 LEU 78 0.229 0.197 -10.954 605 H ARG 79 H ARG 79 5.627 -1.587 -10.779 606 HA ARG 79 HA ARG 79 4.133 -3.722 -9.531 607 HB2 ARG 79 HB2 ARG 79 6.298 -3.809 -11.652 608 HB3 ARG 79 HB3 ARG 79 5.259 -5.167 -11.167 609 HG2 ARG 79 HG2 ARG 79 3.278 -3.549 -11.685 610 HG3 ARG 79 HG3 ARG 79 4.469 -2.598 -12.585 611 HD2 ARG 79 HD2 ARG 79 3.881 -5.539 -13.078 612 HD3 ARG 79 HD3 ARG 79 3.139 -4.198 -13.969 613 HE ARG 79 HE ARG 79 5.984 -3.936 -14.040 614 HH11 ARG 79 HH21 ARG 79 3.357 -5.819 -15.515 615 HH12 ARG 79 HH22 ARG 79 4.291 -6.148 -16.942 616 HH21 ARG 79 HH11 ARG 79 7.088 -4.401 -15.868 617 HH22 ARG 79 HH12 ARG 79 6.376 -5.349 -17.146 618 H LEU 80 H LEU 80 7.361 -2.407 -9.032 619 HA LEU 80 HA LEU 80 8.340 -4.697 -7.560 620 HB2 LEU 80 HB2 LEU 80 9.014 -1.757 -7.614 621 HB3 LEU 80 HB3 LEU 80 9.695 -2.795 -6.369 622 HG LEU 80 HG LEU 80 10.064 -3.272 -9.341 623 HD11 LEU 80 HD11 LEU 80 11.944 -2.008 -7.308 624 HD12 LEU 80 HD12 LEU 80 11.076 -1.144 -8.603 625 HD13 LEU 80 HD13 LEU 80 12.309 -2.351 -9.016 626 HD21 LEU 80 HD21 LEU 80 11.422 -4.484 -6.894 627 HD22 LEU 80 HD22 LEU 80 11.927 -4.739 -8.581 628 HD23 LEU 80 HD23 LEU 80 10.346 -5.323 -8.037 629 H ARG 81 H ARG 81 6.567 -1.703 -6.568 630 HA ARG 81 HA ARG 81 6.548 -2.442 -3.771 631 HB2 ARG 81 HB2 ARG 81 4.633 -0.664 -5.339 632 HB3 ARG 81 HB3 ARG 81 4.687 -0.783 -3.579 633 HG2 ARG 81 HG2 ARG 81 6.991 0.196 -5.314 634 HG3 ARG 81 HG3 ARG 81 5.830 1.250 -4.500 635 HD2 ARG 81 HD2 ARG 81 6.860 1.038 -2.493 636 HD3 ARG 81 HD3 ARG 81 7.103 -0.703 -2.684 637 HE ARG 81 HE ARG 81 9.054 -0.193 -4.114 638 HH11 ARG 81 HH21 ARG 81 7.985 2.422 -1.929 639 HH12 ARG 81 HH22 ARG 81 9.550 3.182 -2.001 640 HH21 ARG 81 HH11 ARG 81 10.986 0.870 -4.111 641 HH22 ARG 81 HH12 ARG 81 11.199 2.328 -3.183 642 H ALA 82 H ALA 82 4.339 -3.029 -6.499 643 HA ALA 82 HA ALA 82 2.297 -4.317 -4.995 644 HB1 ALA 82 HB1 ALA 82 2.037 -3.562 -7.341 645 HB2 ALA 82 HB2 ALA 82 3.180 -4.821 -7.870 646 HB3 ALA 82 HB3 ALA 82 1.621 -5.280 -7.162 647 H SER 83 H SER 83 5.315 -5.601 -6.466 648 HA SER 83 HA SER 83 4.715 -8.340 -5.858 649 HB2 SER 83 HB2 SER 83 7.403 -6.962 -6.224 650 HB3 SER 83 HB3 SER 83 7.134 -8.719 -6.203 651 HG SER 83 HG SER 83 6.191 -6.804 -8.082 652 H TYR 84 H TYR 84 6.434 -5.758 -4.053 653 HA TYR 84 HA TYR 84 7.337 -7.406 -1.915 654 HB2 TYR 84 HB2 TYR 84 7.934 -4.972 -2.389 655 HB3 TYR 84 HB3 TYR 84 6.380 -4.530 -1.675 656 HD1 TYR 84 HD1 TYR 84 5.924 -5.225 0.789 657 HD2 TYR 84 HD2 TYR 84 9.835 -5.400 -1.011 658 HE1 TYR 84 HE1 TYR 84 6.968 -5.304 3.050 659 HE2 TYR 84 HE2 TYR 84 10.866 -5.443 1.258 660 HH TYR 84 HH TYR 84 10.507 -5.474 3.493 661 H LEU 85 H LEU 85 4.275 -5.604 -2.392 662 HA LEU 85 HA LEU 85 3.092 -6.330 0.094 663 HB2 LEU 85 HB2 LEU 85 2.146 -4.583 -1.342 664 HB3 LEU 85 HB3 LEU 85 1.856 -5.759 -2.619 665 HG LEU 85 HG LEU 85 0.177 -6.904 -1.219 666 HD11 LEU 85 HD11 LEU 85 0.965 -6.367 1.010 667 HD12 LEU 85 HD12 LEU 85 -0.681 -5.745 0.804 668 HD13 LEU 85 HD13 LEU 85 0.701 -4.632 0.717 669 HD21 LEU 85 HD21 LEU 85 -0.274 -3.925 -1.567 670 HD22 LEU 85 HD22 LEU 85 -1.543 -5.155 -1.367 671 HD23 LEU 85 HD23 LEU 85 -0.505 -5.179 -2.805 672 H ARG 86 H ARG 86 3.062 -7.902 -3.089 673 HA ARG 86 HA ARG 86 1.265 -9.988 -2.403 674 HB2 ARG 86 HB2 ARG 86 2.072 -9.306 -4.697 675 HB3 ARG 86 HB3 ARG 86 3.578 -10.158 -4.372 676 HG2 ARG 86 HG2 ARG 86 2.542 -12.264 -4.433 677 HG3 ARG 86 HG3 ARG 86 0.921 -11.586 -4.165 678 HD2 ARG 86 HD2 ARG 86 0.810 -10.666 -6.362 679 HD3 ARG 86 HD3 ARG 86 2.541 -10.916 -6.645 680 HE ARG 86 HE ARG 86 0.381 -12.878 -6.901 681 HH11 ARG 86 HH21 ARG 86 3.883 -12.421 -6.760 682 HH12 ARG 86 HH22 ARG 86 4.205 -13.938 -7.556 683 HH21 ARG 86 HH11 ARG 86 0.873 -14.795 -7.916 684 HH22 ARG 86 HH12 ARG 86 2.532 -15.254 -8.194 685 H TYR 87 H TYR 87 4.780 -9.733 -1.862 686 HA TYR 87 HA TYR 87 4.992 -12.515 -1.055 687 HB2 TYR 87 HB2 TYR 87 6.837 -10.175 -0.455 688 HB3 TYR 87 HB3 TYR 87 7.218 -11.884 -0.229 689 HD1 TYR 87 HD2 TYR 87 6.204 -13.110 -2.765 690 HD2 TYR 87 HD1 TYR 87 8.319 -9.417 -2.115 691 HE1 TYR 87 HE2 TYR 87 7.078 -13.186 -5.103 692 HE2 TYR 87 HE1 TYR 87 9.181 -9.505 -4.453 693 HH TYR 87 HH TYR 87 8.422 -12.178 -6.675 694 H ASP 88 H ASP 88 4.873 -9.401 0.807 695 HA ASP 88 HA ASP 88 5.121 -10.825 3.303 696 HB2 ASP 88 HB2 ASP 88 5.553 -8.292 2.637 697 HB3 ASP 88 HB3 ASP 88 3.880 -8.088 3.179 698 H LEU 89 H LEU 89 2.334 -9.685 1.408 699 HA LEU 89 HA LEU 89 0.379 -10.203 3.474 700 HB2 LEU 89 HB2 LEU 89 0.085 -8.736 1.484 701 HB3 LEU 89 HB3 LEU 89 0.110 -10.153 0.451 702 HG LEU 89 HG LEU 89 -2.033 -10.888 1.290 703 HD11 LEU 89 HD11 LEU 89 -3.330 -9.448 2.852 704 HD12 LEU 89 HD12 LEU 89 -1.857 -8.498 3.156 705 HD13 LEU 89 HD13 LEU 89 -1.928 -10.215 3.613 706 HD21 LEU 89 HD21 LEU 89 -3.381 -9.029 0.442 707 HD22 LEU 89 HD22 LEU 89 -1.900 -9.190 -0.519 708 HD23 LEU 89 HD23 LEU 89 -2.031 -7.898 0.696 709 H LYS 90 H LYS 90 2.170 -12.237 1.291 710 HA LYS 90 HA LYS 90 0.315 -14.436 1.231 711 HB2 LYS 90 HB2 LYS 90 2.800 -13.874 0.097 712 HB3 LYS 90 HB3 LYS 90 3.163 -15.170 1.234 713 HG2 LYS 90 HG2 LYS 90 2.695 -16.230 -0.803 714 HG3 LYS 90 HG3 LYS 90 1.235 -16.454 0.180 715 HD2 LYS 90 HD2 LYS 90 0.194 -14.491 -0.990 716 HD3 LYS 90 HD3 LYS 90 1.643 -14.362 -2.004 717 HE2 LYS 90 HE2 LYS 90 -0.229 -16.754 -1.838 718 HE3 LYS 90 HE3 LYS 90 -0.159 -15.573 -3.164 719 HZ1 LYS 90 HZ1 LYS 90 2.137 -16.280 -3.566 720 HZ2 LYS 90 HZ2 LYS 90 1.104 -17.562 -3.700 721 HZ3 LYS 90 HZ3 LYS 90 2.043 -17.393 -2.355 722 H THR 91 H THR 91 2.712 -13.279 3.560 723 HA THR 91 HA THR 91 2.801 -15.679 5.148 724 HB THR 91 HB THR 91 3.168 -12.909 6.312 725 HG1 THR 91 HG1 THR 91 4.740 -12.469 4.984 726 HG21 THR 91 HG21 THR 91 3.610 -14.992 7.655 727 HG22 THR 91 HG22 THR 91 5.040 -13.958 7.450 728 HG23 THR 91 HG23 THR 91 4.863 -15.431 6.473 729 H VAL 92 H VAL 92 0.783 -12.738 5.107 730 HA VAL 92 HA VAL 92 -0.463 -13.180 7.635 731 HB VAL 92 HB VAL 92 -1.683 -11.731 5.239 732 HG11 VAL 92 HG11 VAL 92 -2.709 -10.329 7.074 733 HG12 VAL 92 HG12 VAL 92 -3.274 -12.005 7.050 734 HG13 VAL 92 HG13 VAL 92 -2.069 -11.487 8.254 735 HG21 VAL 92 HG21 VAL 92 -0.595 -9.704 6.096 736 HG22 VAL 92 HG22 VAL 92 0.231 -10.672 7.332 737 HG23 VAL 92 HG23 VAL 92 0.603 -10.907 5.611 738 H ILE 93 H ILE 93 -1.462 -14.090 4.303 739 HA ILE 93 HA ILE 93 -4.061 -14.990 5.097 740 HB ILE 93 HB ILE 93 -4.152 -16.163 2.938 741 HG12 ILE 93 HG12 ILE 93 -1.312 -15.243 2.477 742 HG13 ILE 93 HG13 ILE 93 -1.724 -16.888 2.959 743 HG21 ILE 93 HG21 ILE 93 -4.560 -13.691 3.140 744 HG22 ILE 93 HG22 ILE 93 -2.885 -13.405 2.627 745 HG23 ILE 93 HG23 ILE 93 -4.038 -14.187 1.522 746 HD11 ILE 93 HD11 ILE 93 -1.356 -16.843 0.582 747 HD12 ILE 93 HD12 ILE 93 -3.087 -17.119 0.880 748 HD13 ILE 93 HD13 ILE 93 -2.513 -15.511 0.370 749 H SER 94 H SER 94 -0.961 -16.465 5.492 750 HA SER 94 HA SER 94 -1.924 -19.196 5.625 751 HB2 SER 94 HB2 SER 94 0.466 -18.540 5.235 752 HB3 SER 94 HB3 SER 94 0.548 -17.984 6.919 753 HG SER 94 HG SER 94 0.036 -20.116 7.564 754 H ALA 95 H ALA 95 -1.679 -16.487 7.881 755 HA ALA 95 HA ALA 95 -2.226 -18.156 10.232 756 HB1 ALA 95 HB1 ALA 95 -2.098 -15.115 9.873 757 HB2 ALA 95 HB2 ALA 95 -2.229 -15.971 11.428 758 HB3 ALA 95 HB3 ALA 95 -0.776 -16.169 10.429 759 H LYS 96 H LYS 96 -4.038 -16.106 7.986 760 HA LYS 96 HA LYS 96 -6.402 -15.807 9.593 761 HB2 LYS 96 HB2 LYS 96 -5.533 -15.239 6.871 762 HB3 LYS 96 HB3 LYS 96 -7.152 -15.931 6.851 763 HG2 LYS 96 HG2 LYS 96 -7.323 -13.517 6.892 764 HG3 LYS 96 HG3 LYS 96 -7.921 -14.142 8.432 765 HD2 LYS 96 HD2 LYS 96 -5.984 -13.405 9.612 766 HD3 LYS 96 HD3 LYS 96 -5.056 -13.211 8.116 767 HE2 LYS 96 HE2 LYS 96 -5.626 -11.006 8.913 768 HE3 LYS 96 HE3 LYS 96 -6.538 -11.325 7.440 769 HZ1 LYS 96 HZ1 LYS 96 -7.623 -11.340 10.200 770 HZ2 LYS 96 HZ2 LYS 96 -8.495 -11.765 8.861 771 HZ3 LYS 96 HZ3 LYS 96 -7.923 -10.226 9.016 772 HA PRO 97 HA PRO 97 -8.039 -19.904 9.230 773 HB2 PRO 97 HB2 PRO 97 -10.759 -19.512 9.158 774 HB3 PRO 97 HB3 PRO 97 -9.790 -19.338 10.657 775 HG2 PRO 97 HG2 PRO 97 -10.713 -17.222 8.754 776 HG3 PRO 97 HG3 PRO 97 -10.852 -17.276 10.537 777 HD2 PRO 97 HD2 PRO 97 -8.882 -15.888 9.339 778 HD3 PRO 97 HD3 PRO 97 -8.567 -16.814 10.847 779 H LYS 98 H LYS 98 -9.052 -21.295 7.599 780 HA LYS 98 HA LYS 98 -8.021 -20.514 5.122 781 HB2 LYS 98 HB2 LYS 98 -9.494 -22.841 6.175 782 HB3 LYS 98 HB3 LYS 98 -9.549 -22.638 4.422 783 HG2 LYS 98 HG2 LYS 98 -7.653 -24.082 5.035 784 HG3 LYS 98 HG3 LYS 98 -7.072 -22.568 4.325 785 HD2 LYS 98 HD2 LYS 98 -6.615 -21.684 6.629 786 HD3 LYS 98 HD3 LYS 98 -7.123 -23.241 7.309 787 HE2 LYS 98 HE2 LYS 98 -5.280 -24.371 6.154 788 HE3 LYS 98 HE3 LYS 98 -4.835 -22.859 5.334 789 HZ1 LYS 98 HZ1 LYS 98 -3.425 -23.250 7.265 790 HZ2 LYS 98 HZ2 LYS 98 -4.729 -23.291 8.272 791 HZ3 LYS 98 HZ3 LYS 98 -4.325 -21.888 7.503 792 H ASP 99 H ASP 99 -11.368 -20.061 6.143 793 HA ASP 99 HA ASP 99 -12.259 -19.589 3.412 794 HB2 ASP 99 HB2 ASP 99 -13.730 -20.233 5.390 795 HB3 ASP 99 HB3 ASP 99 -13.560 -18.559 5.944 796 H GLU 100 H GLU 100 -11.260 -17.507 6.170 797 HA GLU 100 HA GLU 100 -11.590 -15.034 4.730 798 HB2 GLU 100 HB2 GLU 100 -10.078 -15.894 7.184 799 HB3 GLU 100 HB3 GLU 100 -9.774 -14.307 6.484 800 HG2 GLU 100 HG2 GLU 100 -12.487 -15.332 7.375 801 HG3 GLU 100 HG3 GLU 100 -11.451 -14.215 8.285 802 H LYS 101 H LYS 101 -9.010 -17.428 4.982 803 HA LYS 101 HA LYS 101 -6.957 -15.967 3.623 804 HB2 LYS 101 HB2 LYS 101 -6.496 -18.088 4.728 805 HB3 LYS 101 HB3 LYS 101 -7.657 -18.914 3.714 806 HG2 LYS 101 HG2 LYS 101 -5.797 -17.783 1.906 807 HG3 LYS 101 HG3 LYS 101 -4.844 -18.423 3.237 808 HD2 LYS 101 HD2 LYS 101 -5.075 -20.131 1.544 809 HD3 LYS 101 HD3 LYS 101 -5.996 -20.628 2.977 810 HE2 LYS 101 HE2 LYS 101 -8.065 -20.244 1.934 811 HE3 LYS 101 HE3 LYS 101 -7.378 -19.106 0.768 812 HZ1 LYS 101 HZ1 LYS 101 -6.390 -20.892 -0.405 813 HZ2 LYS 101 HZ2 LYS 101 -7.988 -21.247 -0.200 814 HZ3 LYS 101 HZ3 LYS 101 -6.853 -22.007 0.725 815 H LYS 102 H LYS 102 -9.761 -17.885 2.397 816 HA LYS 102 HA LYS 102 -8.985 -17.638 -0.381 817 HB2 LYS 102 HB2 LYS 102 -10.623 -19.327 0.249 818 HB3 LYS 102 HB3 LYS 102 -11.672 -18.109 0.963 819 HG2 LYS 102 HG2 LYS 102 -12.697 -18.673 -1.078 820 HG3 LYS 102 HG3 LYS 102 -11.954 -17.096 -1.345 821 HD2 LYS 102 HD2 LYS 102 -9.931 -18.473 -2.289 822 HD3 LYS 102 HD3 LYS 102 -11.103 -19.802 -2.378 823 HE2 LYS 102 HE2 LYS 102 -11.104 -17.138 -3.827 824 HE3 LYS 102 HE3 LYS 102 -11.179 -18.769 -4.517 825 HZ1 LYS 102 HZ1 LYS 102 -13.334 -17.962 -4.698 826 HZ2 LYS 102 HZ2 LYS 102 -13.312 -17.181 -3.253 827 HZ3 LYS 102 HZ3 LYS 102 -13.453 -18.833 -3.300 828 H SER 103 H SER 103 -11.221 -15.772 1.718 829 HA SER 103 HA SER 103 -12.025 -13.952 -0.298 830 HB2 SER 103 HB2 SER 103 -13.103 -14.278 1.940 831 HB3 SER 103 HB3 SER 103 -11.758 -13.383 2.677 832 HG SER 103 HG SER 103 -13.472 -12.397 0.620 833 H LEU 104 H LEU 104 -9.278 -13.754 2.033 834 HA LEU 104 HA LEU 104 -8.413 -11.183 1.106 835 HB2 LEU 104 HB2 LEU 104 -7.364 -13.321 2.812 836 HB3 LEU 104 HB3 LEU 104 -6.103 -12.562 1.844 837 HG LEU 104 HG LEU 104 -8.035 -11.019 3.582 838 HD11 LEU 104 HD11 LEU 104 -6.585 -12.531 4.923 839 HD12 LEU 104 HD12 LEU 104 -6.249 -10.809 5.210 840 HD13 LEU 104 HD13 LEU 104 -5.152 -11.768 4.188 841 HD21 LEU 104 HD21 LEU 104 -6.300 -9.209 3.339 842 HD22 LEU 104 HD22 LEU 104 -7.093 -9.631 1.813 843 HD23 LEU 104 HD23 LEU 104 -5.454 -10.233 2.154 844 H GLN 105 H GLN 105 -7.624 -14.523 0.020 845 HA GLN 105 HA GLN 105 -5.533 -13.728 -1.751 846 HB2 GLN 105 HB2 GLN 105 -7.358 -16.126 -1.623 847 HB3 GLN 105 HB3 GLN 105 -6.290 -15.890 -3.007 848 HG2 GLN 105 HG2 GLN 105 -4.355 -15.752 -1.469 849 HG3 GLN 105 HG3 GLN 105 -5.423 -16.136 -0.118 850 HE21 GLN 105 HE21 GLN 105 -3.329 -17.386 -2.358 851 HE22 GLN 105 HE22 GLN 105 -3.837 -19.055 -2.323 852 H GLU 106 H GLU 106 -9.086 -13.970 -2.332 853 HA GLU 106 HA GLU 106 -8.673 -13.442 -5.161 854 HB2 GLU 106 HB2 GLU 106 -11.101 -13.219 -5.304 855 HB3 GLU 106 HB3 GLU 106 -10.589 -14.687 -4.474 856 HG2 GLU 106 HG2 GLU 106 -11.028 -13.510 -2.305 857 HG3 GLU 106 HG3 GLU 106 -11.771 -12.200 -3.227 858 H LEU 107 H LEU 107 -9.401 -11.364 -2.310 859 HA LEU 107 HA LEU 107 -9.680 -8.954 -3.879 860 HB2 LEU 107 HB2 LEU 107 -8.750 -9.396 -1.015 861 HB3 LEU 107 HB3 LEU 107 -8.994 -7.813 -1.739 862 HG LEU 107 HG LEU 107 -11.144 -9.862 -1.220 863 HD11 LEU 107 HD11 LEU 107 -10.239 -8.802 0.788 864 HD12 LEU 107 HD12 LEU 107 -11.893 -8.248 0.465 865 HD13 LEU 107 HD13 LEU 107 -10.516 -7.196 0.075 866 HD21 LEU 107 HD21 LEU 107 -12.711 -8.003 -1.817 867 HD22 LEU 107 HD22 LEU 107 -11.762 -8.578 -3.194 868 HD23 LEU 107 HD23 LEU 107 -11.323 -7.054 -2.384 869 H THR 108 H THR 108 -6.901 -10.615 -2.415 870 HA THR 108 HA THR 108 -4.880 -8.706 -3.029 871 HB THR 108 HB THR 108 -4.706 -11.775 -2.949 872 HG1 THR 108 HG1 THR 108 -5.455 -10.881 -1.002 873 HG21 THR 108 HG21 THR 108 -2.570 -9.649 -2.729 874 HG22 THR 108 HG22 THR 108 -2.692 -10.950 -3.940 875 HG23 THR 108 HG23 THR 108 -2.343 -11.346 -2.237 876 H SER 109 H SER 109 -6.294 -11.377 -4.957 877 HA SER 109 HA SER 109 -4.496 -10.976 -7.180 878 HB2 SER 109 HB2 SER 109 -7.264 -12.258 -7.118 879 HB3 SER 109 HB3 SER 109 -6.040 -12.453 -8.392 880 HG SER 109 HG SER 109 -5.934 -13.314 -5.678 881 H LYS 110 H LYS 110 -7.753 -9.691 -6.352 882 HA LYS 110 HA LYS 110 -8.260 -8.433 -8.893 883 HB2 LYS 110 HB2 LYS 110 -9.148 -7.807 -6.055 884 HB3 LYS 110 HB3 LYS 110 -9.686 -6.857 -7.435 885 HG2 LYS 110 HG2 LYS 110 -10.121 -9.850 -7.286 886 HG3 LYS 110 HG3 LYS 110 -11.250 -8.678 -6.586 887 HD2 LYS 110 HD2 LYS 110 -11.428 -7.579 -8.825 888 HD3 LYS 110 HD3 LYS 110 -10.440 -8.892 -9.508 889 HE2 LYS 110 HE2 LYS 110 -12.113 -10.546 -8.756 890 HE3 LYS 110 HE3 LYS 110 -13.084 -9.245 -8.033 891 HZ1 LYS 110 HZ1 LYS 110 -13.911 -9.860 -10.217 892 HZ2 LYS 110 HZ2 LYS 110 -12.459 -9.507 -10.920 893 HZ3 LYS 110 HZ3 LYS 110 -13.363 -8.305 -10.242 894 H LEU 111 H LEU 111 -6.600 -7.360 -5.933 895 HA LEU 111 HA LEU 111 -6.148 -4.677 -6.709 896 HB2 LEU 111 HB2 LEU 111 -5.779 -5.862 -4.475 897 HB3 LEU 111 HB3 LEU 111 -4.248 -6.425 -5.112 898 HG LEU 111 HG LEU 111 -4.960 -3.496 -4.766 899 HD11 LEU 111 HD11 LEU 111 -3.562 -5.467 -2.916 900 HD12 LEU 111 HD12 LEU 111 -5.091 -4.600 -2.624 901 HD13 LEU 111 HD13 LEU 111 -3.564 -3.705 -2.686 902 HD21 LEU 111 HD21 LEU 111 -3.084 -3.767 -6.285 903 HD22 LEU 111 HD22 LEU 111 -2.292 -4.898 -5.168 904 HD23 LEU 111 HD23 LEU 111 -2.486 -3.184 -4.728 905 H PHE 112 H PHE 112 -4.096 -7.597 -7.229 906 HA PHE 112 HA PHE 112 -2.187 -6.005 -8.702 907 HB2 PHE 112 HB2 PHE 112 -2.484 -9.002 -8.495 908 HB3 PHE 112 HB3 PHE 112 -1.098 -8.145 -9.187 909 HD1 PHE 112 HD2 PHE 112 -0.634 -5.926 -7.337 910 HD2 PHE 112 HD1 PHE 112 -1.758 -9.987 -6.482 911 HE1 PHE 112 HE2 PHE 112 0.332 -5.709 -5.065 912 HE2 PHE 112 HE1 PHE 112 -0.752 -9.769 -4.217 913 HZ PHE 112 HZ PHE 112 0.266 -7.628 -3.499 914 H SER 113 H SER 113 -5.144 -7.557 -9.625 915 HA SER 113 HA SER 113 -4.512 -7.754 -12.443 916 HB2 SER 113 HB2 SER 113 -7.204 -7.341 -11.076 917 HB3 SER 113 HB3 SER 113 -6.956 -7.822 -12.766 918 HG SER 113 HG SER 113 -6.093 -9.278 -10.466 919 H SER 114 H SER 114 -5.864 -5.161 -10.314 920 HA SER 114 HA SER 114 -6.258 -3.394 -12.588 921 HB2 SER 114 HB2 SER 114 -6.691 -1.645 -10.950 922 HB3 SER 114 HB3 SER 114 -7.567 -3.126 -10.523 923 HG SER 114 HG SER 114 -5.395 -1.889 -9.261 924 H ILE 115 H ILE 115 -3.578 -4.137 -10.412 925 HA ILE 115 HA ILE 115 -1.931 -1.877 -11.073 926 HB ILE 115 HB ILE 115 -1.238 -4.719 -10.198 927 HG12 ILE 115 HG12 ILE 115 -2.370 -3.194 -8.569 928 HG13 ILE 115 HG13 ILE 115 -0.801 -3.790 -8.048 929 HG21 ILE 115 HG21 ILE 115 1.101 -3.793 -9.714 930 HG22 ILE 115 HG22 ILE 115 0.717 -4.063 -11.422 931 HG23 ILE 115 HG23 ILE 115 0.678 -2.417 -10.759 932 HD11 ILE 115 HD11 ILE 115 -1.232 -1.407 -7.512 933 HD12 ILE 115 HD12 ILE 115 0.229 -1.650 -8.476 934 HD13 ILE 115 HD13 ILE 115 -1.259 -1.031 -9.240 935 H ASP 116 H ASP 116 -2.235 -5.142 -12.605 936 HA ASP 116 HA ASP 116 -0.130 -4.602 -14.479 937 HB2 ASP 116 HB2 ASP 116 -1.125 -6.864 -13.876 938 HB3 ASP 116 HB3 ASP 116 -2.476 -6.459 -14.949 939 H ASN 117 H ASN 117 -3.644 -4.056 -14.561 940 HA ASN 117 HA ASN 117 -3.733 -3.155 -17.294 941 HB2 ASN 117 HB2 ASN 117 -5.480 -2.770 -14.864 942 HB3 ASN 117 HB3 ASN 117 -5.776 -1.842 -16.335 943 HD21 ASN 117 HD21 ASN 117 -6.573 -4.613 -14.728 944 HD22 ASN 117 HD22 ASN 117 -7.186 -5.524 -16.089 945 H LEU 118 H LEU 118 -3.004 -1.537 -14.207 946 HA LEU 118 HA LEU 118 -3.001 1.148 -15.240 947 HB2 LEU 118 HB2 LEU 118 -2.840 -0.018 -12.800 948 HB3 LEU 118 HB3 LEU 118 -1.156 0.389 -13.025 949 HG LEU 118 HG LEU 118 -3.421 2.385 -13.194 950 HD11 LEU 118 HD11 LEU 118 -2.849 2.959 -10.896 951 HD12 LEU 118 HD12 LEU 118 -1.626 1.679 -10.851 952 HD13 LEU 118 HD13 LEU 118 -3.352 1.266 -11.002 953 HD21 LEU 118 HD21 LEU 118 -1.764 4.064 -12.897 954 HD22 LEU 118 HD22 LEU 118 -1.277 3.058 -14.265 955 HD23 LEU 118 HD23 LEU 118 -0.489 2.848 -12.685 956 H ASP 119 H ASP 119 -0.520 -1.379 -14.873 957 HA ASP 119 HA ASP 119 1.720 0.211 -15.719 958 HB2 ASP 119 HB2 ASP 119 2.415 -1.742 -14.708 959 HB3 ASP 119 HB3 ASP 119 1.056 -2.683 -15.341 960 H HIS 120 H HIS 120 -0.542 -1.941 -17.526 961 HA HIS 120 HA HIS 120 0.683 -1.369 -20.056 962 HB2 HIS 120 HB2 HIS 120 -2.039 -2.406 -19.261 963 HB3 HIS 120 HB3 HIS 120 -1.598 -2.112 -20.948 964 HD1 HIS 120 HD1 HIS 120 -0.732 -4.411 -18.039 965 HD2 HIS 120 HD2 HIS 120 0.140 -3.907 -22.093 966 HE1 HIS 120 HE1 HIS 120 0.492 -6.487 -18.791 967 H ALA 121 H ALA 121 -1.929 0.272 -18.236 968 HA ALA 121 HA ALA 121 -2.681 2.050 -20.331 969 HB1 ALA 121 HB1 ALA 121 -3.997 1.759 -18.259 970 HB2 ALA 121 HB2 ALA 121 -2.691 2.519 -17.319 971 HB3 ALA 121 HB3 ALA 121 -3.584 3.470 -18.527 972 H ALA 122 H ALA 122 -0.014 2.167 -17.942 973 HA ALA 122 HA ALA 122 0.783 4.855 -18.706 974 HB1 ALA 122 HB1 ALA 122 2.330 2.615 -17.366 975 HB2 ALA 122 HB2 ALA 122 2.829 4.320 -17.462 976 HB3 ALA 122 HB3 ALA 122 1.366 3.872 -16.556 977 H LYS 123 H LYS 123 1.774 1.546 -19.671 978 HA LYS 123 HA LYS 123 3.973 2.399 -21.311 979 HB2 LYS 123 HB2 LYS 123 2.231 -0.063 -21.153 980 HB3 LYS 123 HB3 LYS 123 3.369 0.111 -22.492 981 HG2 LYS 123 HG2 LYS 123 5.194 -0.272 -21.200 982 HG3 LYS 123 HG3 LYS 123 4.533 0.601 -19.807 983 HD2 LYS 123 HD2 LYS 123 4.799 -1.773 -19.278 984 HD3 LYS 123 HD3 LYS 123 3.103 -1.313 -19.254 985 HE2 LYS 123 HE2 LYS 123 2.791 -2.289 -21.508 986 HE3 LYS 123 HE3 LYS 123 4.494 -2.807 -21.500 987 HZ1 LYS 123 HZ1 LYS 123 2.761 -4.481 -20.708 988 HZ2 LYS 123 HZ2 LYS 123 2.604 -3.564 -19.342 989 HZ3 LYS 123 HZ3 LYS 123 4.054 -4.251 -19.705 990 H ILE 124 H ILE 124 0.493 2.075 -21.905 991 HA ILE 124 HA ILE 124 0.881 2.724 -24.755 992 HB ILE 124 HB ILE 124 -0.815 0.997 -23.733 993 HG12 ILE 124 HG12 ILE 124 -2.458 1.542 -25.619 994 HG13 ILE 124 HG13 ILE 124 -1.423 2.925 -25.983 995 HG21 ILE 124 HG21 ILE 124 -1.894 2.689 -22.202 996 HG22 ILE 124 HG22 ILE 124 -2.604 3.458 -23.632 997 HG23 ILE 124 HG23 ILE 124 -3.021 1.781 -23.218 998 HD11 ILE 124 HD11 ILE 124 -0.504 0.014 -25.935 999 HD12 ILE 124 HD12 ILE 124 -0.905 0.940 -27.400 1000 HD13 ILE 124 HD13 ILE 124 0.488 1.415 -26.401 1001 H LYS 125 H LYS 125 1.355 4.499 -22.296 1002 HA LYS 125 HA LYS 125 1.223 6.652 -21.694 1003 HB2 LYS 125 HB2 LYS 125 1.658 8.285 -23.449 1004 HB3 LYS 125 HB3 LYS 125 2.634 6.827 -23.613 1005 HG2 LYS 125 HG2 LYS 125 1.188 6.045 -25.441 1006 HG3 LYS 125 HG3 LYS 125 0.174 7.485 -25.267 1007 HD2 LYS 125 HD2 LYS 125 2.080 8.897 -25.892 1008 HD3 LYS 125 HD3 LYS 125 3.105 7.443 -26.037 1009 HE2 LYS 125 HE2 LYS 125 1.543 6.532 -27.739 1010 HE3 LYS 125 HE3 LYS 125 0.552 7.995 -27.609 1011 HZ1 LYS 125 HZ1 LYS 125 2.034 8.072 -29.511 1012 HZ2 LYS 125 HZ2 LYS 125 3.361 7.915 -28.545 1013 HZ3 LYS 125 HZ3 LYS 125 2.423 9.270 -28.446 1014 H SER 126 H SER 126 -1.371 5.532 -21.564 1015 HA SER 126 HA SER 126 -3.088 7.896 -22.207 1016 HB2 SER 126 HB2 SER 126 -3.795 5.086 -21.290 1017 HB3 SER 126 HB3 SER 126 -4.960 6.390 -21.616 1018 HG SER 126 HG SER 126 -4.764 5.140 -23.451 1019 HA PRO 127 HA PRO 127 -2.107 8.362 -17.802 1020 HB2 PRO 127 HB2 PRO 127 -2.615 11.028 -17.476 1021 HB3 PRO 127 HB3 PRO 127 -1.105 10.413 -18.219 1022 HG2 PRO 127 HG2 PRO 127 -3.610 11.389 -19.580 1023 HG3 PRO 127 HG3 PRO 127 -1.907 11.865 -19.878 1024 HD2 PRO 127 HD2 PRO 127 -3.147 10.015 -21.411 1025 HD3 PRO 127 HD3 PRO 127 -1.416 9.847 -20.969 1026 H THR 128 H THR 128 -5.056 9.499 -19.452 1027 HA THR 128 HA THR 128 -6.627 9.938 -17.131 1028 HB THR 128 HB THR 128 -7.649 8.877 -19.796 1029 HG1 THR 128 HG1 THR 128 -7.630 11.102 -20.413 1030 HG21 THR 128 HG21 THR 128 -9.327 9.174 -18.006 1031 HG22 THR 128 HG22 THR 128 -9.556 10.357 -19.308 1032 HG23 THR 128 HG23 THR 128 -8.787 10.854 -17.781 1033 H GLU 129 H GLU 129 -6.008 7.035 -19.115 1034 HA GLU 129 HA GLU 129 -7.800 5.363 -17.585 1035 HB2 GLU 129 HB2 GLU 129 -5.719 4.927 -19.699 1036 HB3 GLU 129 HB3 GLU 129 -6.346 3.542 -18.791 1037 HG2 GLU 129 HG2 GLU 129 -7.565 3.971 -20.940 1038 HG3 GLU 129 HG3 GLU 129 -8.595 3.976 -19.498 1039 H ALA 130 H ALA 130 -4.361 6.207 -17.394 1040 HA ALA 130 HA ALA 130 -3.686 4.180 -15.478 1041 HB1 ALA 130 HB1 ALA 130 -1.766 5.629 -14.951 1042 HB2 ALA 130 HB2 ALA 130 -1.989 5.494 -16.709 1043 HB3 ALA 130 HB3 ALA 130 -2.508 6.966 -15.855 1044 H GLU 131 H GLU 131 -4.986 7.542 -15.153 1045 HA GLU 131 HA GLU 131 -5.104 7.443 -12.269 1046 HB2 GLU 131 HB2 GLU 131 -6.639 9.076 -14.311 1047 HB3 GLU 131 HB3 GLU 131 -6.855 9.241 -12.562 1048 HG2 GLU 131 HG2 GLU 131 -4.357 9.644 -12.412 1049 HG3 GLU 131 HG3 GLU 131 -4.371 9.808 -14.175 1050 H LYS 132 H LYS 132 -7.344 6.457 -14.850 1051 HA LYS 132 HA LYS 132 -9.627 5.938 -13.228 1052 HB2 LYS 132 HB2 LYS 132 -8.997 5.670 -15.892 1053 HB3 LYS 132 HB3 LYS 132 -9.028 3.992 -15.402 1054 HG2 LYS 132 HG2 LYS 132 -11.191 4.403 -16.189 1055 HG3 LYS 132 HG3 LYS 132 -11.349 4.440 -14.431 1056 HD2 LYS 132 HD2 LYS 132 -12.649 6.264 -15.427 1057 HD3 LYS 132 HD3 LYS 132 -11.313 6.933 -14.481 1058 HE2 LYS 132 HE2 LYS 132 -11.589 8.153 -16.610 1059 HE3 LYS 132 HE3 LYS 132 -10.019 7.349 -16.536 1060 HZ1 LYS 132 HZ1 LYS 132 -11.136 5.513 -17.859 1061 HZ2 LYS 132 HZ2 LYS 132 -10.821 6.907 -18.669 1062 HZ3 LYS 132 HZ3 LYS 132 -12.361 6.576 -18.156 1063 H TYR 133 H TYR 133 -6.845 3.849 -14.119 1064 HA TYR 133 HA TYR 133 -7.869 1.680 -12.469 1065 HB2 TYR 133 HB2 TYR 133 -5.318 2.115 -14.006 1066 HB3 TYR 133 HB3 TYR 133 -5.537 0.725 -12.925 1067 HD1 TYR 133 HD1 TYR 133 -7.842 -0.602 -13.269 1068 HD2 TYR 133 HD2 TYR 133 -5.953 1.841 -16.269 1069 HE1 TYR 133 HE1 TYR 133 -9.117 -1.791 -15.044 1070 HE2 TYR 133 HE2 TYR 133 -7.240 0.646 -18.042 1071 HH TYR 133 HH TYR 133 -9.494 -2.016 -17.291 1072 H TYR 134 H TYR 134 -5.697 4.443 -11.883 1073 HA TYR 134 HA TYR 134 -4.637 3.404 -9.411 1074 HB2 TYR 134 HB2 TYR 134 -4.999 6.159 -10.547 1075 HB3 TYR 134 HB3 TYR 134 -4.813 6.017 -8.801 1076 HD1 TYR 134 HD1 TYR 134 -2.824 4.283 -8.080 1077 HD2 TYR 134 HD2 TYR 134 -3.005 6.561 -11.730 1078 HE1 TYR 134 HE1 TYR 134 -0.356 4.063 -8.345 1079 HE2 TYR 134 HE2 TYR 134 -0.542 6.342 -11.976 1080 HH TYR 134 HH TYR 134 1.393 5.495 -11.093 1081 H GLY 135 H GLY 135 -7.649 5.228 -10.205 1082 HA2 GLY 135 HA2 GLY 135 -8.587 5.364 -7.525 1083 HA3 GLY 135 HA3 GLY 135 -9.605 5.383 -8.977 1084 H GLN 136 H GLN 136 -9.012 2.799 -9.990 1085 HA GLN 136 HA GLN 136 -10.746 1.174 -8.362 1086 HB2 GLN 136 HB2 GLN 136 -8.835 0.471 -10.618 1087 HB3 GLN 136 HB3 GLN 136 -9.985 -0.667 -9.909 1088 HG2 GLN 136 HG2 GLN 136 -11.856 0.582 -10.708 1089 HG3 GLN 136 HG3 GLN 136 -10.840 1.960 -11.146 1090 HE21 GLN 136 HE21 GLN 136 -10.633 2.168 -13.244 1091 HE22 GLN 136 HE22 GLN 136 -10.456 0.853 -14.389 1092 H THR 137 H THR 137 -7.208 1.388 -8.728 1093 HA THR 137 HA THR 137 -6.646 -0.927 -7.127 1094 HB THR 137 HB THR 137 -4.843 1.485 -7.634 1095 HG1 THR 137 HG1 THR 137 -5.479 0.641 -9.606 1096 HG21 THR 137 HG21 THR 137 -3.038 -0.082 -7.321 1097 HG22 THR 137 HG22 THR 137 -4.178 -1.429 -7.100 1098 HG23 THR 137 HG23 THR 137 -4.076 -0.132 -5.889 1099 H VAL 138 H VAL 138 -7.074 2.557 -6.356 1100 HA VAL 138 HA VAL 138 -6.262 2.423 -3.621 1101 HB VAL 138 HB VAL 138 -8.420 4.144 -4.959 1102 HG11 VAL 138 HG11 VAL 138 -8.173 5.655 -2.960 1103 HG12 VAL 138 HG12 VAL 138 -8.922 4.092 -2.582 1104 HG13 VAL 138 HG13 VAL 138 -7.216 4.380 -2.166 1105 HG21 VAL 138 HG21 VAL 138 -5.827 4.346 -5.548 1106 HG22 VAL 138 HG22 VAL 138 -6.813 5.798 -5.299 1107 HG23 VAL 138 HG23 VAL 138 -5.756 5.206 -4.008 1108 H SER 139 H SER 139 -9.462 1.803 -5.174 1109 HA SER 139 HA SER 139 -10.798 1.200 -2.727 1110 HB2 SER 139 HB2 SER 139 -11.358 0.119 -5.513 1111 HB3 SER 139 HB3 SER 139 -12.488 0.132 -4.142 1112 HG SER 139 HG SER 139 -12.855 1.913 -5.492 1113 H ASN 140 H ASN 140 -9.079 -0.923 -5.066 1114 HA ASN 140 HA ASN 140 -9.677 -3.375 -3.723 1115 HB2 ASN 140 HB2 ASN 140 -7.342 -2.515 -5.471 1116 HB3 ASN 140 HB3 ASN 140 -7.479 -4.139 -4.789 1117 HD21 ASN 140 HD21 ASN 140 -7.746 -2.757 -7.584 1118 HD22 ASN 140 HD22 ASN 140 -9.126 -3.599 -8.244 1119 H ILE 141 H ILE 141 -7.037 -0.997 -3.264 1120 HA ILE 141 HA ILE 141 -5.585 -2.557 -1.331 1121 HB ILE 141 HB ILE 141 -5.689 0.440 -1.927 1122 HG12 ILE 141 HG12 ILE 141 -3.367 -1.482 -2.213 1123 HG13 ILE 141 HG13 ILE 141 -4.594 -1.338 -3.470 1124 HG21 ILE 141 HG21 ILE 141 -3.578 0.560 -0.439 1125 HG22 ILE 141 HG22 ILE 141 -5.132 0.416 0.407 1126 HG23 ILE 141 HG23 ILE 141 -4.088 -1.005 0.218 1127 HD11 ILE 141 HD11 ILE 141 -2.796 0.891 -2.485 1128 HD12 ILE 141 HD12 ILE 141 -2.675 0.017 -4.020 1129 HD13 ILE 141 HD13 ILE 141 -4.076 1.061 -3.710 1130 H ASN 142 H ASN 142 -8.186 -0.098 -1.040 1131 HA ASN 142 HA ASN 142 -8.188 -0.059 1.812 1132 HB2 ASN 142 HB2 ASN 142 -9.320 1.576 0.252 1133 HB3 ASN 142 HB3 ASN 142 -10.571 0.355 -0.020 1134 HD21 ASN 142 HD21 ASN 142 -12.333 0.790 1.098 1135 HD22 ASN 142 HD22 ASN 142 -12.369 1.430 2.722 1136 H GLU 143 H GLU 143 -10.010 -2.119 -0.511 1137 HA GLU 143 HA GLU 143 -11.565 -3.407 1.539 1138 HB2 GLU 143 HB2 GLU 143 -10.791 -4.235 -1.273 1139 HB3 GLU 143 HB3 GLU 143 -11.887 -5.174 -0.247 1140 HG2 GLU 143 HG2 GLU 143 -13.450 -3.302 -0.121 1141 HG3 GLU 143 HG3 GLU 143 -12.346 -2.280 -1.048 1142 H VAL 144 H VAL 144 -8.409 -4.192 0.046 1143 HA VAL 144 HA VAL 144 -8.095 -6.703 1.443 1144 HB VAL 144 HB VAL 144 -6.082 -4.712 0.258 1145 HG11 VAL 144 HG11 VAL 144 -5.489 -7.393 1.586 1146 HG12 VAL 144 HG12 VAL 144 -4.344 -6.497 0.563 1147 HG13 VAL 144 HG13 VAL 144 -4.897 -5.794 2.091 1148 HG21 VAL 144 HG21 VAL 144 -5.752 -6.479 -1.425 1149 HG22 VAL 144 HG22 VAL 144 -6.892 -7.536 -0.566 1150 HG23 VAL 144 HG23 VAL 144 -7.466 -6.038 -1.331 1151 H LEU 145 H LEU 145 -7.405 -3.274 2.248 1152 HA LEU 145 HA LEU 145 -5.950 -3.825 4.659 1153 HB2 LEU 145 HB2 LEU 145 -7.069 -1.507 3.292 1154 HB3 LEU 145 HB3 LEU 145 -7.281 -1.391 5.032 1155 HG LEU 145 HG LEU 145 -4.851 -1.699 5.358 1156 HD11 LEU 145 HD11 LEU 145 -3.333 -1.437 3.400 1157 HD12 LEU 145 HD12 LEU 145 -4.732 -1.628 2.325 1158 HD13 LEU 145 HD13 LEU 145 -4.231 -2.966 3.375 1159 HD21 LEU 145 HD21 LEU 145 -4.210 0.536 4.499 1160 HD22 LEU 145 HD22 LEU 145 -5.846 0.547 5.198 1161 HD23 LEU 145 HD23 LEU 145 -5.634 0.528 3.432 1162 H ALA 146 H ALA 146 -9.436 -3.499 4.022 1163 HA ALA 146 HA ALA 146 -10.191 -3.384 6.799 1164 HB1 ALA 146 HB1 ALA 146 -12.437 -4.003 5.961 1165 HB2 ALA 146 HB2 ALA 146 -11.709 -2.749 4.930 1166 HB3 ALA 146 HB3 ALA 146 -11.740 -4.443 4.382 1167 H LYS 147 H LYS 147 -9.253 -6.008 4.672 1168 HA LYS 147 HA LYS 147 -10.172 -8.091 6.540 1169 HB2 LYS 147 HB2 LYS 147 -8.397 -8.119 4.087 1170 HB3 LYS 147 HB3 LYS 147 -8.813 -9.557 5.011 1171 HG2 LYS 147 HG2 LYS 147 -10.843 -7.781 3.621 1172 HG3 LYS 147 HG3 LYS 147 -10.155 -9.276 2.961 1173 HD2 LYS 147 HD2 LYS 147 -10.940 -10.425 5.069 1174 HD3 LYS 147 HD3 LYS 147 -11.893 -8.971 5.420 1175 HE2 LYS 147 HE2 LYS 147 -13.078 -9.228 3.292 1176 HE3 LYS 147 HE3 LYS 147 -12.054 -10.620 2.876 1177 HZ1 LYS 147 HZ1 LYS 147 -12.930 -11.709 4.938 1178 HZ2 LYS 147 HZ2 LYS 147 -14.080 -11.459 3.779 1179 HZ3 LYS 147 HZ3 LYS 147 -14.011 -10.477 5.104 1180 H LEU 148 H LEU 148 -7.569 -5.945 6.416 1181 HA LEU 148 HA LEU 148 -5.763 -7.802 7.882 1182 HB2 LEU 148 HB2 LEU 148 -5.288 -5.054 6.684 1183 HB3 LEU 148 HB3 LEU 148 -4.091 -5.960 7.606 1184 HG LEU 148 HG LEU 148 -5.327 -6.937 5.015 1185 HD11 LEU 148 HD11 LEU 148 -2.603 -5.686 5.520 1186 HD12 LEU 148 HD12 LEU 148 -3.952 -4.924 4.652 1187 HD13 LEU 148 HD13 LEU 148 -3.176 -6.369 3.980 1188 HD21 LEU 148 HD21 LEU 148 -3.012 -7.942 6.681 1189 HD22 LEU 148 HD22 LEU 148 -3.451 -8.540 5.073 1190 HD23 LEU 148 HD23 LEU 148 -4.571 -8.757 6.417 1191 H GLY 149 H GLY 149 -8.279 -5.818 8.602 1192 HA2 GLY 149 HA2 GLY 149 -7.131 -4.625 11.026 1193 HA3 GLY 149 HA3 GLY 149 -8.844 -4.665 10.556 Start of MODEL 8 1 H1 GLU 1 H1 GLU 1 -9.937 13.919 28.538 2 H2 GLU 1 H2 GLU 1 -9.252 12.975 27.364 3 H3 GLU 1 H3 GLU 1 -8.435 13.270 28.768 4 HA GLU 1 HA GLU 1 -9.106 15.272 26.718 5 HB2 GLU 1 HB2 GLU 1 -7.607 15.463 29.352 6 HB3 GLU 1 HB3 GLU 1 -7.690 16.750 28.137 7 HG2 GLU 1 HG2 GLU 1 -10.123 16.864 28.387 8 HG3 GLU 1 HG3 GLU 1 -10.077 15.557 29.563 9 H ALA 2 H ALA 2 -7.112 16.211 25.756 10 HA ALA 2 HA ALA 2 -5.276 15.904 24.490 11 HB1 ALA 2 HB1 ALA 2 -3.256 15.758 25.780 12 HB2 ALA 2 HB2 ALA 2 -4.486 16.618 26.735 13 HB3 ALA 2 HB3 ALA 2 -4.100 14.918 27.099 14 H ARG 3 H ARG 3 -6.839 13.354 24.252 15 HA ARG 3 HA ARG 3 -4.528 11.753 23.316 16 HB2 ARG 3 HB2 ARG 3 -5.111 11.009 25.622 17 HB3 ARG 3 HB3 ARG 3 -6.707 10.531 25.043 18 HG2 ARG 3 HG2 ARG 3 -5.743 8.860 23.591 19 HG3 ARG 3 HG3 ARG 3 -4.097 9.474 23.887 20 HD2 ARG 3 HD2 ARG 3 -4.389 7.471 25.183 21 HD3 ARG 3 HD3 ARG 3 -4.354 8.852 26.296 22 HE ARG 3 HE ARG 3 -6.587 8.491 26.846 23 HH11 ARG 3 HH11 ARG 3 -5.719 6.325 24.205 24 HH12 ARG 3 HH12 ARG 3 -7.152 5.350 24.398 25 HH21 ARG 3 HH21 ARG 3 -8.385 7.196 27.055 26 HH22 ARG 3 HH22 ARG 3 -8.643 5.844 25.990 27 HA PRO 4 HA PRO 4 -7.642 11.249 20.101 28 HB2 PRO 4 HB2 PRO 4 -6.074 10.138 18.177 29 HB3 PRO 4 HB3 PRO 4 -5.962 11.881 18.568 30 HG2 PRO 4 HG2 PRO 4 -4.255 9.624 19.568 31 HG3 PRO 4 HG3 PRO 4 -3.741 11.166 18.823 32 HD2 PRO 4 HD2 PRO 4 -3.794 10.831 21.504 33 HD3 PRO 4 HD3 PRO 4 -4.240 12.409 20.747 34 H ILE 5 H ILE 5 -8.689 9.382 19.184 35 HA ILE 5 HA ILE 5 -7.763 6.733 20.194 36 HB ILE 5 HB ILE 5 -10.118 6.178 20.874 37 HG12 ILE 5 HG12 ILE 5 -10.619 9.174 20.615 38 HG13 ILE 5 HG13 ILE 5 -11.202 7.965 19.457 39 HG21 ILE 5 HG21 ILE 5 -9.068 8.604 22.418 40 HG22 ILE 5 HG22 ILE 5 -10.028 7.266 23.057 41 HG23 ILE 5 HG23 ILE 5 -8.350 6.979 22.537 42 HD11 ILE 5 HD11 ILE 5 -13.019 8.547 20.951 43 HD12 ILE 5 HD12 ILE 5 -12.503 6.886 21.323 44 HD13 ILE 5 HD13 ILE 5 -12.019 8.227 22.383 45 H VAL 6 H VAL 6 -9.200 5.000 19.070 46 HA VAL 6 HA VAL 6 -8.828 5.248 16.282 47 HB VAL 6 HB VAL 6 -10.769 3.379 17.741 48 HG11 VAL 6 HG11 VAL 6 -11.122 3.320 15.324 49 HG12 VAL 6 HG12 VAL 6 -9.382 3.134 15.046 50 HG13 VAL 6 HG13 VAL 6 -10.300 1.826 15.833 51 HG21 VAL 6 HG21 VAL 6 -7.784 3.115 17.179 52 HG22 VAL 6 HG22 VAL 6 -8.572 3.149 18.765 53 HG23 VAL 6 HG23 VAL 6 -8.821 1.761 17.690 54 H VAL 7 H VAL 7 -11.604 6.110 18.265 55 HA VAL 7 HA VAL 7 -13.479 6.337 16.080 56 HB VAL 7 HB VAL 7 -13.583 7.671 18.833 57 HG11 VAL 7 HG11 VAL 7 -16.077 7.445 18.514 58 HG12 VAL 7 HG12 VAL 7 -15.318 8.536 17.337 59 HG13 VAL 7 HG13 VAL 7 -15.771 6.892 16.850 60 HG21 VAL 7 HG21 VAL 7 -14.428 4.861 17.999 61 HG22 VAL 7 HG22 VAL 7 -13.211 5.297 19.225 62 HG23 VAL 7 HG23 VAL 7 -14.918 5.635 19.519 63 H GLY 8 H GLY 8 -10.933 8.430 17.343 64 HA2 GLY 8 HA2 GLY 8 -10.735 10.180 15.331 65 HA3 GLY 8 HA3 GLY 8 -12.168 10.826 16.149 66 HA PRO 9 HA PRO 9 -8.247 12.625 18.007 67 HB2 PRO 9 HB2 PRO 9 -8.749 15.257 17.437 68 HB3 PRO 9 HB3 PRO 9 -8.046 14.147 16.216 69 HG2 PRO 9 HG2 PRO 9 -10.917 14.939 16.612 70 HG3 PRO 9 HG3 PRO 9 -9.915 15.015 15.127 71 HD2 PRO 9 HD2 PRO 9 -11.577 12.930 15.622 72 HD3 PRO 9 HD3 PRO 9 -9.974 12.671 14.847 73 HA PRO 10 HA PRO 10 -10.384 13.813 21.681 74 HB2 PRO 10 HB2 PRO 10 -8.934 15.854 22.808 75 HB3 PRO 10 HB3 PRO 10 -8.329 14.174 22.758 76 HG2 PRO 10 HG2 PRO 10 -7.755 16.437 20.855 77 HG3 PRO 10 HG3 PRO 10 -6.601 15.376 21.713 78 HD2 PRO 10 HD2 PRO 10 -7.300 14.859 19.180 79 HD3 PRO 10 HD3 PRO 10 -7.114 13.523 20.359 80 HA PRO 11 HA PRO 11 -12.970 17.106 20.412 81 HB2 PRO 11 HB2 PRO 11 -14.308 17.813 22.693 82 HB3 PRO 11 HB3 PRO 11 -14.546 16.223 21.917 83 HG2 PRO 11 HG2 PRO 11 -12.773 16.954 24.212 84 HG3 PRO 11 HG3 PRO 11 -13.975 15.635 24.094 85 HD2 PRO 11 HD2 PRO 11 -11.330 15.219 23.664 86 HD3 PRO 11 HD3 PRO 11 -12.581 14.346 22.717 87 HA PRO 12 HA PRO 12 -10.963 20.922 21.115 88 HB2 PRO 12 HB2 PRO 12 -12.919 22.845 21.216 89 HB3 PRO 12 HB3 PRO 12 -12.461 22.006 19.702 90 HG2 PRO 12 HG2 PRO 12 -14.701 21.348 21.599 91 HG3 PRO 12 HG3 PRO 12 -14.781 21.613 19.829 92 HD2 PRO 12 HD2 PRO 12 -14.647 19.136 20.817 93 HD3 PRO 12 HD3 PRO 12 -13.654 19.574 19.378 94 H LEU 13 H LEU 13 -10.489 22.557 22.648 95 HA LEU 13 HA LEU 13 -10.140 23.415 24.701 96 HB2 LEU 13 HB2 LEU 13 -12.912 22.449 25.462 97 HB3 LEU 13 HB3 LEU 13 -11.945 23.628 26.330 98 HG LEU 13 HG LEU 13 -13.025 24.032 23.516 99 HD11 LEU 13 HD11 LEU 13 -14.039 25.102 26.175 100 HD12 LEU 13 HD12 LEU 13 -14.829 23.851 25.191 101 HD13 LEU 13 HD13 LEU 13 -14.687 25.513 24.564 102 HD21 LEU 13 HD21 LEU 13 -12.483 26.434 23.984 103 HD22 LEU 13 HD22 LEU 13 -11.042 25.409 23.935 104 HD23 LEU 13 HD23 LEU 13 -11.698 25.942 25.500 105 H SER 14 H SER 14 -10.071 20.284 24.089 106 HA SER 14 HA SER 14 -9.435 19.521 26.917 107 HB2 SER 14 HB2 SER 14 -9.999 17.779 24.484 108 HB3 SER 14 HB3 SER 14 -9.683 17.213 26.137 109 HG SER 14 HG SER 14 -11.773 19.029 25.550 110 H GLY 15 H GLY 15 -7.971 20.610 24.147 111 HA2 GLY 15 HA2 GLY 15 -5.779 20.733 23.534 112 HA3 GLY 15 HA3 GLY 15 -5.382 19.987 25.081 113 H GLY 16 H GLY 16 -3.661 19.377 23.378 114 HA2 GLY 16 HA2 GLY 16 -2.636 17.289 22.911 115 HA3 GLY 16 HA3 GLY 16 -4.231 16.556 22.678 116 H LEU 17 H LEU 17 -1.941 16.382 20.987 117 HA LEU 17 HA LEU 17 -1.435 16.239 18.815 118 HB2 LEU 17 HB2 LEU 17 -4.133 17.484 18.199 119 HB3 LEU 17 HB3 LEU 17 -3.040 16.787 17.023 120 HG LEU 17 HG LEU 17 -4.375 15.230 19.266 121 HD11 LEU 17 HD11 LEU 17 -5.977 16.055 17.581 122 HD12 LEU 17 HD12 LEU 17 -5.766 14.292 17.437 123 HD13 LEU 17 HD13 LEU 17 -4.967 15.388 16.281 124 HD21 LEU 17 HD21 LEU 17 -2.665 14.361 16.901 125 HD22 LEU 17 HD22 LEU 17 -3.623 13.257 17.900 126 HD23 LEU 17 HD23 LEU 17 -2.286 14.163 18.628 127 HA PRO 18 HA PRO 18 0.398 20.101 18.204 128 HB2 PRO 18 HB2 PRO 18 1.825 19.739 15.930 129 HB3 PRO 18 HB3 PRO 18 2.212 18.837 17.423 130 HG2 PRO 18 HG2 PRO 18 0.560 17.965 15.078 131 HG3 PRO 18 HG3 PRO 18 1.943 17.130 15.856 132 HD2 PRO 18 HD2 PRO 18 -0.621 16.531 16.471 133 HD3 PRO 18 HD3 PRO 18 0.679 16.516 17.722 134 H GLY 19 H GLY 19 0.429 22.035 16.923 135 HA2 GLY 19 HA2 GLY 19 -0.001 22.979 14.665 136 HA3 GLY 19 HA3 GLY 19 -1.500 22.033 14.617 137 H THR 20 H THR 20 -2.318 22.471 17.307 138 HA THR 20 HA THR 20 -2.443 25.414 17.612 139 HB THR 20 HB THR 20 -4.551 24.909 16.441 140 HG1 THR 20 HG1 THR 20 -5.272 25.098 19.183 141 HG21 THR 20 HG21 THR 20 -4.785 22.518 16.897 142 HG22 THR 20 HG22 THR 20 -6.231 23.392 17.427 143 HG23 THR 20 HG23 THR 20 -5.045 22.841 18.627 144 H GLU 21 H GLU 21 -2.441 25.961 19.729 145 HA GLU 21 HA GLU 21 -1.538 25.854 21.758 146 HB2 GLU 21 HB2 GLU 21 -2.806 24.789 23.460 147 HB3 GLU 21 HB3 GLU 21 -3.871 25.495 22.252 148 HG2 GLU 21 HG2 GLU 21 -3.259 22.586 21.861 149 HG3 GLU 21 HG3 GLU 21 -4.111 22.976 23.351 150 H ASN 22 H ASN 22 -0.819 23.010 20.051 151 HA ASN 22 HA ASN 22 1.272 22.354 22.081 152 HB2 ASN 22 HB2 ASN 22 -0.944 20.609 21.036 153 HB3 ASN 22 HB3 ASN 22 0.638 19.869 21.300 154 HD21 ASN 22 HD21 ASN 22 -2.210 21.109 22.746 155 HD22 ASN 22 HD22 ASN 22 -1.743 20.777 24.413 156 H SER 23 H SER 23 2.879 20.798 21.195 157 HA SER 23 HA SER 23 3.192 20.889 18.236 158 HB2 SER 23 HB2 SER 23 5.529 21.667 18.473 159 HB3 SER 23 HB3 SER 23 4.368 22.874 19.090 160 HG SER 23 HG SER 23 5.951 21.054 20.596 161 H ASP 24 H ASP 24 2.441 18.765 20.041 162 HA ASP 24 HA ASP 24 4.813 17.206 20.687 163 HB2 ASP 24 HB2 ASP 24 3.249 15.552 21.497 164 HB3 ASP 24 HB3 ASP 24 2.709 17.152 22.033 165 H GLN 25 H GLN 25 4.445 14.684 20.057 166 HA GLN 25 HA GLN 25 4.066 14.554 17.108 167 HB2 GLN 25 HB2 GLN 25 6.348 13.307 18.672 168 HB3 GLN 25 HB3 GLN 25 6.050 13.122 16.937 169 HG2 GLN 25 HG2 GLN 25 6.358 15.594 16.683 170 HG3 GLN 25 HG3 GLN 25 6.818 15.678 18.390 171 HE21 GLN 25 HE21 GLN 25 8.138 15.875 15.514 172 HE22 GLN 25 HE22 GLN 25 9.639 15.014 15.772 173 H ALA 26 H ALA 26 2.097 13.750 19.048 174 HA ALA 26 HA ALA 26 2.295 11.024 19.822 175 HB1 ALA 26 HB1 ALA 26 -0.182 12.608 18.981 176 HB2 ALA 26 HB2 ALA 26 -0.199 11.065 19.867 177 HB3 ALA 26 HB3 ALA 26 0.502 12.518 20.621 178 H ARG 27 H ARG 27 1.062 12.428 16.814 179 HA ARG 27 HA ARG 27 0.611 11.511 14.746 180 HB2 ARG 27 HB2 ARG 27 3.151 11.747 15.236 181 HB3 ARG 27 HB3 ARG 27 3.173 9.985 15.145 182 HG2 ARG 27 HG2 ARG 27 2.389 10.040 12.876 183 HG3 ARG 27 HG3 ARG 27 2.048 11.775 12.959 184 HD2 ARG 27 HD2 ARG 27 4.813 10.588 13.290 185 HD3 ARG 27 HD3 ARG 27 4.167 11.170 11.737 186 HE ARG 27 HE ARG 27 3.826 13.216 13.667 187 HH11 ARG 27 HH11 ARG 27 6.504 11.617 12.013 188 HH12 ARG 27 HH12 ARG 27 7.527 13.027 12.117 189 HH21 ARG 27 HH21 ARG 27 5.198 14.974 13.760 190 HH22 ARG 27 HH22 ARG 27 6.799 14.891 13.104 191 H ASP 28 H ASP 28 -0.983 10.098 16.350 192 HA ASP 28 HA ASP 28 -0.622 7.295 16.474 193 HB2 ASP 28 HB2 ASP 28 -3.033 7.239 16.949 194 HB3 ASP 28 HB3 ASP 28 -2.254 8.568 17.814 195 H GLY 29 H GLY 29 -1.898 9.313 13.843 196 HA2 GLY 29 HA2 GLY 29 -3.191 7.213 12.445 197 HA3 GLY 29 HA3 GLY 29 -2.627 8.730 11.739 198 H THR 30 H THR 30 0.252 7.825 12.719 199 HA THR 30 HA THR 30 0.682 5.753 10.617 200 HB THR 30 HB THR 30 2.642 6.988 9.735 201 HG1 THR 30 HG1 THR 30 3.026 8.208 11.653 202 HG21 THR 30 HG21 THR 30 0.378 7.351 8.686 203 HG22 THR 30 HG22 THR 30 1.509 8.716 8.485 204 HG23 THR 30 HG23 THR 30 0.211 8.805 9.698 205 H LEU 31 H LEU 31 0.628 5.084 13.251 206 HA LEU 31 HA LEU 31 3.157 5.297 14.597 207 HB2 LEU 31 HB2 LEU 31 0.958 3.204 14.730 208 HB3 LEU 31 HB3 LEU 31 2.349 3.220 15.801 209 HG LEU 31 HG LEU 31 0.371 5.490 15.623 210 HD11 LEU 31 HD11 LEU 31 0.551 3.193 17.612 211 HD12 LEU 31 HD12 LEU 31 -0.739 3.468 16.412 212 HD13 LEU 31 HD13 LEU 31 -0.533 4.614 17.754 213 HD21 LEU 31 HD21 LEU 31 2.584 4.864 17.609 214 HD22 LEU 31 HD22 LEU 31 1.366 6.138 17.830 215 HD23 LEU 31 HD23 LEU 31 2.521 6.243 16.487 216 HA PRO 32 HA PRO 32 5.535 2.624 12.124 217 HB2 PRO 32 HB2 PRO 32 7.500 1.721 13.807 218 HB3 PRO 32 HB3 PRO 32 7.398 3.429 13.250 219 HG2 PRO 32 HG2 PRO 32 6.413 2.218 15.827 220 HG3 PRO 32 HG3 PRO 32 7.413 3.686 15.578 221 HD2 PRO 32 HD2 PRO 32 4.750 3.840 15.955 222 HD3 PRO 32 HD3 PRO 32 5.608 4.958 14.841 223 H TYR 33 H TYR 33 5.557 0.592 11.381 224 HA TYR 33 HA TYR 33 3.904 -1.385 12.630 225 HB2 TYR 33 HB2 TYR 33 4.531 -2.741 10.638 226 HB3 TYR 33 HB3 TYR 33 3.866 -1.155 10.276 227 HD1 TYR 33 HD2 TYR 33 7.398 -0.865 11.215 228 HD2 TYR 33 HD1 TYR 33 4.757 -1.852 7.963 229 HE1 TYR 33 HE2 TYR 33 9.237 -0.475 9.589 230 HE2 TYR 33 HE1 TYR 33 6.614 -1.478 6.349 231 HH TYR 33 HH TYR 33 8.802 -0.869 6.072 232 H THR 34 H THR 34 5.275 -1.563 14.695 233 HA THR 34 HA THR 34 6.938 -2.548 15.985 234 HB THR 34 HB THR 34 7.248 -5.060 15.564 235 HG1 THR 34 HG1 THR 34 6.583 -4.713 13.232 236 HG21 THR 34 HG21 THR 34 4.394 -4.010 15.730 237 HG22 THR 34 HG22 THR 34 5.531 -4.150 17.093 238 HG23 THR 34 HG23 THR 34 4.969 -5.613 16.260 239 H LYS 35 H LYS 35 8.028 -0.911 14.216 240 HA LYS 35 HA LYS 35 9.884 -1.909 12.378 241 HB2 LYS 35 HB2 LYS 35 9.124 0.481 12.644 242 HB3 LYS 35 HB3 LYS 35 10.146 0.580 14.097 243 HG2 LYS 35 HG2 LYS 35 12.105 0.009 12.651 244 HG3 LYS 35 HG3 LYS 35 11.067 0.147 11.236 245 HD2 LYS 35 HD2 LYS 35 10.814 2.468 11.525 246 HD3 LYS 35 HD3 LYS 35 11.230 2.391 13.255 247 HE2 LYS 35 HE2 LYS 35 13.053 3.391 11.887 248 HE3 LYS 35 HE3 LYS 35 13.560 1.951 12.777 249 HZ1 LYS 35 HZ1 LYS 35 13.351 0.680 10.763 250 HZ2 LYS 35 HZ2 LYS 35 14.393 1.947 10.537 251 HZ3 LYS 35 HZ3 LYS 35 12.873 2.008 9.903 252 H ASP 36 H ASP 36 11.963 -2.498 12.463 253 HA ASP 36 HA ASP 36 13.948 -3.251 13.177 254 HB2 ASP 36 HB2 ASP 36 13.522 -1.639 15.700 255 HB3 ASP 36 HB3 ASP 36 15.054 -2.256 15.085 256 H ARG 37 H ARG 37 11.242 -3.844 15.313 257 HA ARG 37 HA ARG 37 12.489 -5.804 16.983 258 HB2 ARG 37 HB2 ARG 37 10.203 -4.729 17.268 259 HB3 ARG 37 HB3 ARG 37 9.612 -5.786 15.984 260 HG2 ARG 37 HG2 ARG 37 9.005 -6.730 18.117 261 HG3 ARG 37 HG3 ARG 37 10.246 -7.768 17.396 262 HD2 ARG 37 HD2 ARG 37 11.981 -6.685 18.769 263 HD3 ARG 37 HD3 ARG 37 10.761 -5.606 19.474 264 HE ARG 37 HE ARG 37 9.836 -8.179 19.947 265 HH11 ARG 37 HH11 ARG 37 12.762 -6.394 20.787 266 HH12 ARG 37 HH12 ARG 37 12.996 -7.289 22.276 267 HH21 ARG 37 HH21 ARG 37 10.212 -9.283 21.862 268 HH22 ARG 37 HH22 ARG 37 11.603 -8.907 22.849 269 H PHE 38 H PHE 38 11.429 -5.855 13.692 270 HA PHE 38 HA PHE 38 11.206 -8.610 13.174 271 HB2 PHE 38 HB2 PHE 38 12.442 -6.450 11.412 272 HB3 PHE 38 HB3 PHE 38 11.803 -8.008 10.860 273 HD1 PHE 38 HD2 PHE 38 9.253 -8.409 11.850 274 HD2 PHE 38 HD1 PHE 38 11.077 -4.623 10.968 275 HE1 PHE 38 HE2 PHE 38 7.018 -7.431 11.513 276 HE2 PHE 38 HE1 PHE 38 8.819 -3.615 10.635 277 HZ PHE 38 HZ PHE 38 6.780 -5.040 10.895 278 H TYR 39 H TYR 39 14.104 -6.726 13.832 279 HA TYR 39 HA TYR 39 15.876 -8.746 12.592 280 HB2 TYR 39 HB2 TYR 39 16.527 -6.334 14.296 281 HB3 TYR 39 HB3 TYR 39 17.668 -7.270 13.341 282 HD1 TYR 39 HD2 TYR 39 16.503 -7.544 10.711 283 HD2 TYR 39 HD1 TYR 39 16.205 -4.198 13.408 284 HE1 TYR 39 HE2 TYR 39 16.112 -6.009 8.781 285 HE2 TYR 39 HE1 TYR 39 15.801 -2.684 11.470 286 HH TYR 39 HH TYR 39 15.718 -2.489 9.208 287 H LEU 40 H LEU 40 14.444 -8.017 15.667 288 HA LEU 40 HA LEU 40 16.486 -9.528 17.189 289 HB2 LEU 40 HB2 LEU 40 13.964 -8.017 17.957 290 HB3 LEU 40 HB3 LEU 40 14.847 -9.020 19.080 291 HG LEU 40 HG LEU 40 15.331 -6.752 19.524 292 HD11 LEU 40 HD11 LEU 40 17.753 -6.789 19.529 293 HD12 LEU 40 HD12 LEU 40 17.771 -7.988 18.222 294 HD13 LEU 40 HD13 LEU 40 17.136 -8.441 19.817 295 HD21 LEU 40 HD21 LEU 40 16.477 -5.236 17.995 296 HD22 LEU 40 HD22 LEU 40 14.937 -5.765 17.282 297 HD23 LEU 40 HD23 LEU 40 16.470 -6.465 16.720 298 H GLN 41 H GLN 41 13.051 -9.775 16.227 299 HA GLN 41 HA GLN 41 13.112 -12.605 17.194 300 HB2 GLN 41 HB2 GLN 41 10.731 -10.725 17.187 301 HB3 GLN 41 HB3 GLN 41 10.748 -12.392 17.772 302 HG2 GLN 41 HG2 GLN 41 12.226 -10.020 18.992 303 HG3 GLN 41 HG3 GLN 41 10.757 -10.773 19.621 304 HE21 GLN 41 HE21 GLN 41 11.686 -13.538 19.058 305 HE22 GLN 41 HE22 GLN 41 12.863 -13.858 20.294 306 HA PRO 42 HA PRO 42 11.624 -13.353 13.072 307 HB2 PRO 42 HB2 PRO 42 10.257 -15.706 13.361 308 HB3 PRO 42 HB3 PRO 42 12.051 -15.625 13.339 309 HG2 PRO 42 HG2 PRO 42 10.195 -15.765 15.709 310 HG3 PRO 42 HG3 PRO 42 11.672 -16.725 15.362 311 HD2 PRO 42 HD2 PRO 42 11.686 -14.561 17.010 312 HD3 PRO 42 HD3 PRO 42 13.087 -14.971 15.952 313 H LEU 43 H LEU 43 9.732 -12.625 12.068 314 HA LEU 43 HA LEU 43 7.801 -11.510 13.862 315 HB2 LEU 43 HB2 LEU 43 7.078 -10.210 12.158 316 HB3 LEU 43 HB3 LEU 43 8.776 -10.440 11.801 317 HG LEU 43 HG LEU 43 6.501 -11.836 10.345 318 HD11 LEU 43 HD11 LEU 43 6.948 -10.212 8.545 319 HD12 LEU 43 HD12 LEU 43 8.137 -9.399 9.598 320 HD13 LEU 43 HD13 LEU 43 6.417 -9.418 10.037 321 HD21 LEU 43 HD21 LEU 43 9.476 -11.617 9.714 322 HD22 LEU 43 HD22 LEU 43 8.238 -12.287 8.624 323 HD23 LEU 43 HD23 LEU 43 8.585 -13.099 10.152 324 HA PRO 44 HA PRO 44 4.697 -14.700 13.233 325 HB2 PRO 44 HB2 PRO 44 2.648 -13.609 14.644 326 HB3 PRO 44 HB3 PRO 44 4.100 -14.260 15.485 327 HG2 PRO 44 HG2 PRO 44 3.477 -11.411 14.726 328 HG3 PRO 44 HG3 PRO 44 3.979 -12.070 16.307 329 HD2 PRO 44 HD2 PRO 44 5.725 -10.942 14.555 330 HD3 PRO 44 HD3 PRO 44 6.196 -12.300 15.633 331 HA PRO 45 HA PRO 45 2.570 -12.823 9.861 332 HB2 PRO 45 HB2 PRO 45 0.005 -13.819 9.833 333 HB3 PRO 45 HB3 PRO 45 1.444 -14.795 9.368 334 HG2 PRO 45 HG2 PRO 45 0.056 -14.652 12.040 335 HG3 PRO 45 HG3 PRO 45 0.481 -16.092 11.075 336 HD2 PRO 45 HD2 PRO 45 2.041 -15.277 13.099 337 HD3 PRO 45 HD3 PRO 45 2.779 -15.874 11.573 338 H THR 46 H THR 46 1.307 -12.409 13.082 339 HA THR 46 HA THR 46 -0.644 -10.387 12.592 340 HB THR 46 HB THR 46 1.027 -10.070 15.003 341 HG1 THR 46 HG1 THR 46 0.287 -12.189 15.772 342 HG21 THR 46 HG21 THR 46 -1.129 -10.354 16.129 343 HG22 THR 46 HG22 THR 46 -1.875 -10.915 14.613 344 HG23 THR 46 HG23 THR 46 -1.313 -9.230 14.762 345 H GLU 47 H GLU 47 2.929 -10.284 12.814 346 HA GLU 47 HA GLU 47 2.894 -7.321 12.780 347 HB2 GLU 47 HB2 GLU 47 5.138 -9.357 12.741 348 HB3 GLU 47 HB3 GLU 47 5.368 -7.602 12.686 349 HG2 GLU 47 HG2 GLU 47 4.198 -7.377 14.847 350 HG3 GLU 47 HG3 GLU 47 4.051 -9.139 14.935 351 H ALA 48 H ALA 48 3.172 -10.076 10.629 352 HA ALA 48 HA ALA 48 4.216 -8.630 8.360 353 HB1 ALA 48 HB1 ALA 48 3.452 -10.520 7.038 354 HB2 ALA 48 HB2 ALA 48 4.141 -11.138 8.559 355 HB3 ALA 48 HB3 ALA 48 2.375 -11.062 8.346 356 H ALA 49 H ALA 49 1.017 -8.949 9.842 357 HA ALA 49 HA ALA 49 -0.501 -7.900 7.646 358 HB1 ALA 49 HB1 ALA 49 -2.263 -7.486 9.333 359 HB2 ALA 49 HB2 ALA 49 -1.514 -9.078 9.597 360 HB3 ALA 49 HB3 ALA 49 -1.077 -7.725 10.650 361 H GLN 50 H GLN 50 1.241 -6.400 10.352 362 HA GLN 50 HA GLN 50 0.345 -3.725 9.847 363 HB2 GLN 50 HB2 GLN 50 2.945 -4.693 11.080 364 HB3 GLN 50 HB3 GLN 50 2.288 -3.057 11.188 365 HG2 GLN 50 HG2 GLN 50 0.369 -3.893 12.451 366 HG3 GLN 50 HG3 GLN 50 0.967 -5.549 12.296 367 HE21 GLN 50 HE21 GLN 50 1.527 -6.143 14.288 368 HE22 GLN 50 HE22 GLN 50 2.626 -5.244 15.323 369 H ARG 51 H ARG 51 3.128 -5.658 8.698 370 HA ARG 51 HA ARG 51 4.316 -3.575 7.120 371 HB2 ARG 51 HB2 ARG 51 4.352 -6.596 6.845 372 HB3 ARG 51 HB3 ARG 51 5.222 -5.519 5.752 373 HG2 ARG 51 HG2 ARG 51 6.522 -4.627 7.630 374 HG3 ARG 51 HG3 ARG 51 5.701 -5.778 8.737 375 HD2 ARG 51 HD2 ARG 51 6.525 -7.656 7.434 376 HD3 ARG 51 HD3 ARG 51 7.157 -6.573 6.191 377 HE ARG 51 HE ARG 51 8.351 -6.008 8.745 378 HH11 ARG 51 HH21 ARG 51 8.470 -8.339 6.102 379 HH12 ARG 51 HH22 ARG 51 10.143 -8.756 6.402 380 HH21 ARG 51 HH11 ARG 51 10.484 -6.549 9.059 381 HH22 ARG 51 HH12 ARG 51 11.271 -7.748 8.042 382 H ALA 52 H ALA 52 1.868 -6.066 6.346 383 HA ALA 52 HA ALA 52 1.681 -5.486 3.597 384 HB1 ALA 52 HB1 ALA 52 0.692 -7.480 4.650 385 HB2 ALA 52 HB2 ALA 52 -0.494 -6.455 5.489 386 HB3 ALA 52 HB3 ALA 52 -0.533 -6.582 3.721 387 H LYS 53 H LYS 53 0.064 -3.849 6.370 388 HA LYS 53 HA LYS 53 -1.698 -2.269 4.762 389 HB2 LYS 53 HB2 LYS 53 -0.407 -1.698 7.439 390 HB3 LYS 53 HB3 LYS 53 -1.559 -0.594 6.670 391 HG2 LYS 53 HG2 LYS 53 -3.256 -2.406 6.699 392 HG3 LYS 53 HG3 LYS 53 -2.108 -3.439 7.573 393 HD2 LYS 53 HD2 LYS 53 -1.937 -1.723 9.372 394 HD3 LYS 53 HD3 LYS 53 -3.159 -0.745 8.526 395 HE2 LYS 53 HE2 LYS 53 -3.624 -3.583 9.502 396 HE3 LYS 53 HE3 LYS 53 -4.027 -2.141 10.431 397 HZ1 LYS 53 HZ1 LYS 53 -5.932 -3.061 9.250 398 HZ2 LYS 53 HZ2 LYS 53 -5.207 -2.788 7.784 399 HZ3 LYS 53 HZ3 LYS 53 -5.620 -1.513 8.754 400 H VAL 54 H VAL 54 1.645 -1.690 5.878 401 HA VAL 54 HA VAL 54 1.791 0.926 4.658 402 HB VAL 54 HB VAL 54 4.031 -0.977 5.503 403 HG11 VAL 54 HG11 VAL 54 4.081 2.015 4.858 404 HG12 VAL 54 HG12 VAL 54 5.418 1.092 5.575 405 HG13 VAL 54 HG13 VAL 54 4.882 0.724 3.921 406 HG21 VAL 54 HG21 VAL 54 4.097 0.530 7.533 407 HG22 VAL 54 HG22 VAL 54 2.611 1.316 6.939 408 HG23 VAL 54 HG23 VAL 54 2.599 -0.403 7.383 409 H SER 55 H SER 55 2.846 -2.351 3.594 410 HA SER 55 HA SER 55 4.058 -1.472 1.174 411 HB2 SER 55 HB2 SER 55 2.697 -4.118 1.835 412 HB3 SER 55 HB3 SER 55 3.787 -3.824 0.462 413 HG SER 55 HG SER 55 4.701 -4.716 2.549 414 H ALA 56 H ALA 56 0.645 -2.128 1.941 415 HA ALA 56 HA ALA 56 -0.194 -1.942 -0.838 416 HB1 ALA 56 HB1 ALA 56 -1.859 -1.471 1.664 417 HB2 ALA 56 HB2 ALA 56 -2.423 -1.966 0.052 418 HB3 ALA 56 HB3 ALA 56 -1.468 -3.087 1.039 419 H SER 57 H SER 57 0.216 0.299 1.884 420 HA SER 57 HA SER 57 -1.136 2.514 0.623 421 HB2 SER 57 HB2 SER 57 0.952 2.497 2.836 422 HB3 SER 57 HB3 SER 57 -0.096 3.859 2.405 423 HG SER 57 HG SER 57 -0.847 1.318 3.471 424 H GLU 58 H GLU 58 2.140 1.225 0.489 425 HA GLU 58 HA GLU 58 3.483 3.501 -0.608 426 HB2 GLU 58 HB2 GLU 58 3.842 0.518 -0.707 427 HB3 GLU 58 HB3 GLU 58 4.785 1.515 -1.801 428 HG2 GLU 58 HG2 GLU 58 4.731 1.867 1.203 429 HG3 GLU 58 HG3 GLU 58 5.953 0.932 0.321 430 H ILE 59 H ILE 59 1.375 1.055 -2.088 431 HA ILE 59 HA ILE 59 1.967 1.786 -4.796 432 HB ILE 59 HB ILE 59 -0.577 0.501 -3.681 433 HG12 ILE 59 HG12 ILE 59 1.884 -0.865 -4.842 434 HG13 ILE 59 HG13 ILE 59 1.602 -0.682 -3.115 435 HG21 ILE 59 HG21 ILE 59 -0.850 1.356 -6.015 436 HG22 ILE 59 HG22 ILE 59 0.610 0.464 -6.516 437 HG23 ILE 59 HG23 ILE 59 -0.852 -0.421 -5.996 438 HD11 ILE 59 HD11 ILE 59 -0.005 -2.354 -5.059 439 HD12 ILE 59 HD12 ILE 59 0.914 -2.895 -3.647 440 HD13 ILE 59 HD13 ILE 59 -0.584 -1.960 -3.430 441 H LEU 60 H LEU 60 -0.174 3.196 -2.343 442 HA LEU 60 HA LEU 60 -1.791 4.730 -4.168 443 HB2 LEU 60 HB2 LEU 60 -0.961 5.390 -1.329 444 HB3 LEU 60 HB3 LEU 60 -2.249 6.191 -2.210 445 HG LEU 60 HG LEU 60 -2.298 3.231 -1.509 446 HD11 LEU 60 HD11 LEU 60 -3.548 5.582 -0.025 447 HD12 LEU 60 HD12 LEU 60 -2.146 4.627 0.537 448 HD13 LEU 60 HD13 LEU 60 -3.741 3.862 0.365 449 HD21 LEU 60 HD21 LEU 60 -3.787 3.907 -3.329 450 HD22 LEU 60 HD22 LEU 60 -4.488 5.179 -2.313 451 HD23 LEU 60 HD23 LEU 60 -4.711 3.464 -1.882 452 H ASN 61 H ASN 61 1.481 5.118 -2.943 453 HA ASN 61 HA ASN 61 1.693 7.954 -3.523 454 HB2 ASN 61 HB2 ASN 61 3.113 6.748 -1.863 455 HB3 ASN 61 HB3 ASN 61 3.858 5.855 -3.201 456 HD21 ASN 61 HD21 ASN 61 3.394 9.102 -1.861 457 HD22 ASN 61 HD22 ASN 61 4.848 9.760 -2.544 458 H VAL 62 H VAL 62 1.711 5.150 -5.541 459 HA VAL 62 HA VAL 62 3.651 5.937 -7.451 460 HB VAL 62 HB VAL 62 2.366 3.677 -7.091 461 HG11 VAL 62 HG11 VAL 62 0.720 4.770 -9.416 462 HG12 VAL 62 HG12 VAL 62 0.534 3.225 -8.553 463 HG13 VAL 62 HG13 VAL 62 0.115 4.734 -7.740 464 HG21 VAL 62 HG21 VAL 62 3.150 4.652 -9.832 465 HG22 VAL 62 HG22 VAL 62 4.243 4.031 -8.601 466 HG23 VAL 62 HG23 VAL 62 3.038 2.956 -9.318 467 H LYS 63 H LYS 63 0.611 7.379 -6.847 468 HA LYS 63 HA LYS 63 -0.217 8.216 -9.426 469 HB2 LYS 63 HB2 LYS 63 -1.446 8.587 -7.274 470 HB3 LYS 63 HB3 LYS 63 -0.272 9.846 -6.858 471 HG2 LYS 63 HG2 LYS 63 -0.949 11.115 -8.889 472 HG3 LYS 63 HG3 LYS 63 -2.186 9.874 -9.241 473 HD2 LYS 63 HD2 LYS 63 -3.276 10.359 -7.100 474 HD3 LYS 63 HD3 LYS 63 -1.989 11.491 -6.667 475 HE2 LYS 63 HE2 LYS 63 -3.861 12.781 -7.414 476 HE3 LYS 63 HE3 LYS 63 -2.583 12.911 -8.628 477 HZ1 LYS 63 HZ1 LYS 63 -4.806 10.983 -8.902 478 HZ2 LYS 63 HZ2 LYS 63 -3.784 11.542 -10.078 479 HZ3 LYS 63 HZ3 LYS 63 -4.916 12.535 -9.452 480 H GLN 64 H GLN 64 2.447 9.385 -7.368 481 HA GLN 64 HA GLN 64 2.897 11.827 -8.755 482 HB2 GLN 64 HB2 GLN 64 4.929 10.030 -7.390 483 HB3 GLN 64 HB3 GLN 64 5.164 11.727 -7.807 484 HG2 GLN 64 HG2 GLN 64 3.195 10.599 -5.776 485 HG3 GLN 64 HG3 GLN 64 4.648 11.533 -5.430 486 HE21 GLN 64 HE21 GLN 64 4.683 13.797 -6.050 487 HE22 GLN 64 HE22 GLN 64 3.169 14.674 -6.173 488 H PHE 65 H PHE 65 3.807 8.499 -9.655 489 HA PHE 65 HA PHE 65 5.735 9.374 -11.661 490 HB2 PHE 65 HB2 PHE 65 4.321 6.761 -11.089 491 HB3 PHE 65 HB3 PHE 65 5.339 6.989 -12.517 492 HD1 PHE 65 HD1 PHE 65 7.770 7.397 -12.291 493 HD2 PHE 65 HD2 PHE 65 5.303 6.548 -8.870 494 HE1 PHE 65 HE1 PHE 65 9.813 6.864 -10.970 495 HE2 PHE 65 HE2 PHE 65 7.344 5.998 -7.540 496 HZ PHE 65 HZ PHE 65 9.596 6.140 -8.585 497 H ILE 66 H ILE 66 2.235 8.959 -11.533 498 HA ILE 66 HA ILE 66 1.845 8.812 -14.414 499 HB ILE 66 HB ILE 66 -0.108 9.806 -12.266 500 HG12 ILE 66 HG12 ILE 66 0.160 7.009 -13.436 501 HG13 ILE 66 HG13 ILE 66 0.765 7.479 -11.847 502 HG21 ILE 66 HG21 ILE 66 -1.852 9.207 -13.965 503 HG22 ILE 66 HG22 ILE 66 -0.769 10.478 -14.539 504 HG23 ILE 66 HG23 ILE 66 -0.564 8.810 -15.120 505 HD11 ILE 66 HD11 ILE 66 -2.141 7.344 -12.733 506 HD12 ILE 66 HD12 ILE 66 -1.320 6.378 -11.502 507 HD13 ILE 66 HD13 ILE 66 -1.617 8.106 -11.202 508 H ASP 67 H ASP 67 1.775 11.426 -11.950 509 HA ASP 67 HA ASP 67 1.175 13.535 -13.817 510 HB2 ASP 67 HB2 ASP 67 0.969 13.656 -11.308 511 HB3 ASP 67 HB3 ASP 67 2.729 13.666 -11.197 512 H ARG 68 H ARG 68 4.213 12.092 -12.652 513 HA ARG 68 HA ARG 68 5.933 13.940 -14.104 514 HB2 ARG 68 HB2 ARG 68 6.352 11.192 -12.893 515 HB3 ARG 68 HB3 ARG 68 7.641 12.069 -13.731 516 HG2 ARG 68 HG2 ARG 68 7.692 13.784 -12.101 517 HG3 ARG 68 HG3 ARG 68 6.144 13.290 -11.395 518 HD2 ARG 68 HD2 ARG 68 7.963 12.567 -9.950 519 HD3 ARG 68 HD3 ARG 68 7.158 11.158 -10.667 520 HE ARG 68 HE ARG 68 9.388 11.944 -12.281 521 HH11 ARG 68 HH11 ARG 68 8.664 10.328 -9.233 522 HH12 ARG 68 HH12 ARG 68 10.139 9.392 -9.251 523 HH21 ARG 68 HH21 ARG 68 11.267 10.714 -12.246 524 HH22 ARG 68 HH22 ARG 68 11.575 9.610 -10.937 525 H LYS 69 H LYS 69 3.837 11.547 -15.167 526 HA LYS 69 HA LYS 69 3.566 10.375 -17.108 527 HB2 LYS 69 HB2 LYS 69 5.192 12.700 -18.184 528 HB3 LYS 69 HB3 LYS 69 4.269 11.564 -19.182 529 HG2 LYS 69 HG2 LYS 69 2.189 12.213 -18.032 530 HG3 LYS 69 HG3 LYS 69 3.106 13.311 -16.995 531 HD2 LYS 69 HD2 LYS 69 3.795 14.599 -19.004 532 HD3 LYS 69 HD3 LYS 69 2.717 13.567 -19.978 533 HE2 LYS 69 HE2 LYS 69 0.793 14.240 -18.577 534 HE3 LYS 69 HE3 LYS 69 1.868 15.229 -17.578 535 HZ1 LYS 69 HZ1 LYS 69 2.317 16.600 -19.490 536 HZ2 LYS 69 HZ2 LYS 69 0.697 16.570 -19.183 537 HZ3 LYS 69 HZ3 LYS 69 1.299 15.693 -20.444 538 H ALA 70 H ALA 70 5.603 9.493 -15.439 539 HA ALA 70 HA ALA 70 7.943 8.874 -17.095 540 HB1 ALA 70 HB1 ALA 70 8.765 7.783 -15.065 541 HB2 ALA 70 HB2 ALA 70 8.120 9.383 -14.677 542 HB3 ALA 70 HB3 ALA 70 7.162 7.931 -14.300 543 H TRP 71 H TRP 71 6.304 7.811 -18.697 544 HA TRP 71 HA TRP 71 4.989 5.394 -18.343 545 HB2 TRP 71 HB2 TRP 71 6.715 5.845 -20.747 546 HB3 TRP 71 HB3 TRP 71 5.120 5.114 -20.620 547 HD1 TRP 71 HD1 TRP 71 6.574 8.104 -21.913 548 HE1 TRP 71 HE1 TRP 71 5.013 10.111 -22.007 549 HE3 TRP 71 HE3 TRP 71 3.001 6.377 -18.690 550 HZ2 TRP 71 HZ2 TRP 71 2.509 10.855 -20.876 551 HZ3 TRP 71 HZ3 TRP 71 1.005 7.813 -18.224 552 HH2 TRP 71 HH2 TRP 71 0.787 10.047 -19.295 553 HA PRO 72 HA PRO 72 8.595 2.565 -18.922 554 HB2 PRO 72 HB2 PRO 72 11.190 3.237 -18.541 555 HB3 PRO 72 HB3 PRO 72 10.373 3.487 -20.118 556 HG2 PRO 72 HG2 PRO 72 10.832 5.471 -17.890 557 HG3 PRO 72 HG3 PRO 72 11.199 5.637 -19.636 558 HD2 PRO 72 HD2 PRO 72 8.935 6.636 -18.552 559 HD3 PRO 72 HD3 PRO 72 8.955 5.933 -20.200 560 H SER 73 H SER 73 8.922 5.030 -16.385 561 HA SER 73 HA SER 73 10.112 3.124 -14.486 562 HB2 SER 73 HB2 SER 73 8.995 5.885 -13.945 563 HB3 SER 73 HB3 SER 73 10.168 4.985 -12.990 564 HG SER 73 HG SER 73 11.602 5.119 -14.793 565 H LEU 74 H LEU 74 6.925 4.581 -15.126 566 HA LEU 74 HA LEU 74 5.681 3.957 -12.661 567 HB2 LEU 74 HB2 LEU 74 4.778 5.471 -14.354 568 HB3 LEU 74 HB3 LEU 74 4.597 4.160 -15.488 569 HG LEU 74 HG LEU 74 2.698 3.277 -14.352 570 HD11 LEU 74 HD11 LEU 74 3.098 5.351 -12.167 571 HD12 LEU 74 HD12 LEU 74 3.419 3.614 -12.007 572 HD13 LEU 74 HD13 LEU 74 1.770 4.183 -12.305 573 HD21 LEU 74 HD21 LEU 74 1.179 5.169 -14.549 574 HD22 LEU 74 HD22 LEU 74 2.449 5.372 -15.767 575 HD23 LEU 74 HD23 LEU 74 2.498 6.338 -14.282 576 H GLN 75 H GLN 75 5.911 2.018 -15.679 577 HA GLN 75 HA GLN 75 4.353 -0.158 -14.663 578 HB2 GLN 75 HB2 GLN 75 5.280 -1.391 -16.562 579 HB3 GLN 75 HB3 GLN 75 4.701 0.212 -17.023 580 HG2 GLN 75 HG2 GLN 75 7.027 1.036 -17.001 581 HG3 GLN 75 HG3 GLN 75 7.596 -0.606 -16.641 582 HE21 GLN 75 HE21 GLN 75 6.687 1.632 -19.028 583 HE22 GLN 75 HE22 GLN 75 6.742 0.536 -20.403 584 H ASN 76 H ASN 76 7.599 0.784 -13.949 585 HA ASN 76 HA ASN 76 8.334 -1.966 -13.124 586 HB2 ASN 76 HB2 ASN 76 9.953 -0.538 -14.413 587 HB3 ASN 76 HB3 ASN 76 9.966 0.596 -13.047 588 HD21 ASN 76 HD21 ASN 76 11.171 -2.363 -14.309 589 HD22 ASN 76 HD22 ASN 76 12.195 -2.741 -12.944 590 H ASP 77 H ASP 77 8.007 1.324 -11.748 591 HA ASP 77 HA ASP 77 8.530 0.607 -9.052 592 HB2 ASP 77 HB2 ASP 77 8.471 2.935 -10.001 593 HB3 ASP 77 HB3 ASP 77 6.717 2.807 -10.128 594 H LEU 78 H LEU 78 5.536 0.605 -10.972 595 HA LEU 78 HA LEU 78 3.691 0.069 -8.864 596 HB2 LEU 78 HB2 LEU 78 3.858 -0.663 -11.788 597 HB3 LEU 78 HB3 LEU 78 2.602 -1.376 -10.792 598 HG LEU 78 HG LEU 78 2.920 1.601 -11.135 599 HD11 LEU 78 HD11 LEU 78 2.527 0.516 -13.322 600 HD12 LEU 78 HD12 LEU 78 1.089 1.410 -12.792 601 HD13 LEU 78 HD13 LEU 78 1.124 -0.355 -12.640 602 HD21 LEU 78 HD21 LEU 78 1.633 0.800 -9.133 603 HD22 LEU 78 HD22 LEU 78 0.539 -0.063 -10.243 604 HD23 LEU 78 HD23 LEU 78 0.655 1.707 -10.292 605 H ARG 79 H ARG 79 5.713 -2.115 -10.815 606 HA ARG 79 HA ARG 79 4.531 -4.452 -9.554 607 HB2 ARG 79 HB2 ARG 79 6.857 -4.065 -11.445 608 HB3 ARG 79 HB3 ARG 79 6.388 -5.655 -10.805 609 HG2 ARG 79 HG2 ARG 79 4.111 -5.349 -11.718 610 HG3 ARG 79 HG3 ARG 79 4.583 -3.784 -12.392 611 HD2 ARG 79 HD2 ARG 79 6.163 -4.840 -13.894 612 HD3 ARG 79 HD3 ARG 79 5.924 -6.405 -13.105 613 HE ARG 79 HE ARG 79 3.843 -6.661 -14.167 614 HH11 ARG 79 HH11 ARG 79 5.190 -3.511 -15.028 615 HH12 ARG 79 HH12 ARG 79 4.068 -3.312 -16.365 616 HH21 ARG 79 HH21 ARG 79 2.402 -6.298 -15.806 617 HH22 ARG 79 HH22 ARG 79 2.493 -4.848 -16.770 618 H LEU 80 H LEU 80 7.433 -2.480 -8.956 619 HA LEU 80 HA LEU 80 8.640 -4.368 -7.134 620 HB2 LEU 80 HB2 LEU 80 8.754 -1.350 -7.349 621 HB3 LEU 80 HB3 LEU 80 9.642 -2.241 -6.131 622 HG LEU 80 HG LEU 80 10.011 -2.622 -9.114 623 HD11 LEU 80 HD11 LEU 80 11.666 -1.032 -7.097 624 HD12 LEU 80 HD12 LEU 80 10.650 -0.365 -8.396 625 HD13 LEU 80 HD13 LEU 80 12.073 -1.321 -8.813 626 HD21 LEU 80 HD21 LEU 80 11.668 -3.566 -6.720 627 HD22 LEU 80 HD22 LEU 80 12.110 -3.766 -8.431 628 HD23 LEU 80 HD23 LEU 80 10.685 -4.595 -7.785 629 H ARG 81 H ARG 81 6.514 -1.510 -6.568 630 HA ARG 81 HA ARG 81 6.301 -2.014 -3.747 631 HB2 ARG 81 HB2 ARG 81 4.654 -0.403 -5.715 632 HB3 ARG 81 HB3 ARG 81 4.249 -0.501 -3.988 633 HG2 ARG 81 HG2 ARG 81 6.291 0.527 -3.329 634 HG3 ARG 81 HG3 ARG 81 7.005 0.329 -4.925 635 HD2 ARG 81 HD2 ARG 81 5.963 2.130 -5.790 636 HD3 ARG 81 HD3 ARG 81 4.510 1.910 -4.810 637 HE ARG 81 HE ARG 81 6.327 2.624 -2.922 638 HH11 ARG 81 HH11 ARG 81 5.619 4.156 -6.042 639 HH12 ARG 81 HH12 ARG 81 5.892 5.756 -5.378 640 HH21 ARG 81 HH21 ARG 81 6.725 4.642 -2.222 641 HH22 ARG 81 HH22 ARG 81 6.541 6.024 -3.297 642 H ALA 82 H ALA 82 4.322 -3.088 -6.515 643 HA ALA 82 HA ALA 82 2.298 -4.300 -4.872 644 HB1 ALA 82 HB1 ALA 82 3.238 -5.101 -7.678 645 HB2 ALA 82 HB2 ALA 82 1.704 -5.559 -6.897 646 HB3 ALA 82 HB3 ALA 82 2.015 -3.871 -7.297 647 H SER 83 H SER 83 5.431 -5.579 -6.212 648 HA SER 83 HA SER 83 4.942 -8.245 -5.352 649 HB2 SER 83 HB2 SER 83 7.279 -8.666 -5.663 650 HB3 SER 83 HB3 SER 83 6.745 -7.572 -6.950 651 HG SER 83 HG SER 83 7.609 -5.835 -5.609 652 H TYR 84 H TYR 84 6.228 -5.433 -3.615 653 HA TYR 84 HA TYR 84 7.121 -6.725 -1.257 654 HB2 TYR 84 HB2 TYR 84 6.572 -4.069 -2.181 655 HB3 TYR 84 HB3 TYR 84 5.708 -4.265 -0.657 656 HD1 TYR 84 HD1 TYR 84 6.986 -4.888 1.440 657 HD2 TYR 84 HD2 TYR 84 8.952 -3.819 -2.249 658 HE1 TYR 84 HE1 TYR 84 9.110 -4.442 2.679 659 HE2 TYR 84 HE2 TYR 84 11.061 -3.368 -0.989 660 HH TYR 84 HH TYR 84 11.294 -3.776 2.547 661 H LEU 85 H LEU 85 3.880 -5.381 -2.080 662 HA LEU 85 HA LEU 85 2.599 -6.214 0.311 663 HB2 LEU 85 HB2 LEU 85 1.634 -4.574 -1.241 664 HB3 LEU 85 HB3 LEU 85 1.487 -5.823 -2.476 665 HG LEU 85 HG LEU 85 -0.178 -7.019 -1.120 666 HD11 LEU 85 HD11 LEU 85 0.147 -4.706 0.833 667 HD12 LEU 85 HD12 LEU 85 0.441 -6.432 1.144 668 HD13 LEU 85 HD13 LEU 85 -1.212 -5.863 0.858 669 HD21 LEU 85 HD21 LEU 85 -1.988 -5.379 -1.389 670 HD22 LEU 85 HD22 LEU 85 -0.881 -5.353 -2.769 671 HD23 LEU 85 HD23 LEU 85 -0.789 -4.072 -1.539 672 H ARG 86 H ARG 86 3.112 -7.894 -2.772 673 HA ARG 86 HA ARG 86 1.386 -10.102 -2.154 674 HB2 ARG 86 HB2 ARG 86 3.202 -9.348 -4.232 675 HB3 ARG 86 HB3 ARG 86 3.586 -11.007 -3.752 676 HG2 ARG 86 HG2 ARG 86 0.740 -10.090 -4.360 677 HG3 ARG 86 HG3 ARG 86 1.840 -10.684 -5.622 678 HD2 ARG 86 HD2 ARG 86 0.966 -12.242 -3.163 679 HD3 ARG 86 HD3 ARG 86 0.262 -12.407 -4.801 680 HE ARG 86 HE ARG 86 2.896 -13.364 -3.862 681 HH11 ARG 86 HH11 ARG 86 0.914 -12.718 -6.722 682 HH12 ARG 86 HH12 ARG 86 1.891 -13.739 -7.740 683 HH21 ARG 86 HH21 ARG 86 4.096 -14.658 -5.228 684 HH22 ARG 86 HH22 ARG 86 3.657 -14.816 -6.903 685 H TYR 87 H TYR 87 4.864 -9.545 -1.379 686 HA TYR 87 HA TYR 87 5.206 -12.230 -0.363 687 HB2 TYR 87 HB2 TYR 87 6.723 -9.649 0.134 688 HB3 TYR 87 HB3 TYR 87 7.177 -11.203 0.825 689 HD1 TYR 87 HD2 TYR 87 7.247 -13.216 -1.029 690 HD2 TYR 87 HD1 TYR 87 7.873 -9.029 -1.825 691 HE1 TYR 87 HE2 TYR 87 8.527 -13.792 -3.098 692 HE2 TYR 87 HE1 TYR 87 9.114 -9.620 -3.909 693 HH TYR 87 HH TYR 87 9.693 -13.000 -4.884 694 H ASP 88 H ASP 88 4.443 -9.080 1.210 695 HA ASP 88 HA ASP 88 4.430 -10.146 3.875 696 HB2 ASP 88 HB2 ASP 88 2.986 -7.783 2.607 697 HB3 ASP 88 HB3 ASP 88 2.888 -8.167 4.343 698 H LEU 89 H LEU 89 1.764 -9.606 1.541 699 HA LEU 89 HA LEU 89 -0.245 -10.487 3.347 700 HB2 LEU 89 HB2 LEU 89 -0.383 -9.023 1.261 701 HB3 LEU 89 HB3 LEU 89 -0.431 -10.523 0.333 702 HG LEU 89 HG LEU 89 -2.571 -11.112 1.350 703 HD11 LEU 89 HD11 LEU 89 -3.752 -9.381 2.781 704 HD12 LEU 89 HD12 LEU 89 -2.204 -8.546 2.958 705 HD13 LEU 89 HD13 LEU 89 -2.408 -10.191 3.592 706 HD21 LEU 89 HD21 LEU 89 -2.467 -8.211 0.401 707 HD22 LEU 89 HD22 LEU 89 -3.891 -9.279 0.347 708 HD23 LEU 89 HD23 LEU 89 -2.467 -9.643 -0.649 709 H LYS 90 H LYS 90 1.840 -12.311 1.182 710 HA LYS 90 HA LYS 90 0.252 -14.740 1.225 711 HB2 LYS 90 HB2 LYS 90 3.155 -14.079 0.666 712 HB3 LYS 90 HB3 LYS 90 2.652 -15.762 0.872 713 HG2 LYS 90 HG2 LYS 90 1.344 -13.921 -1.144 714 HG3 LYS 90 HG3 LYS 90 2.743 -14.948 -1.513 715 HD2 LYS 90 HD2 LYS 90 1.412 -16.941 -0.827 716 HD3 LYS 90 HD3 LYS 90 0.005 -15.896 -0.588 717 HE2 LYS 90 HE2 LYS 90 0.121 -15.200 -2.957 718 HE3 LYS 90 HE3 LYS 90 1.518 -16.271 -3.190 719 HZ1 LYS 90 HZ1 LYS 90 -1.198 -17.141 -2.398 720 HZ2 LYS 90 HZ2 LYS 90 0.097 -18.145 -2.584 721 HZ3 LYS 90 HZ3 LYS 90 -0.520 -17.338 -3.890 722 H THR 91 H THR 91 2.397 -13.177 3.509 723 HA THR 91 HA THR 91 2.624 -15.596 5.150 724 HB THR 91 HB THR 91 3.274 -12.720 5.906 725 HG1 THR 91 HG1 THR 91 4.544 -13.153 4.170 726 HG21 THR 91 HG21 THR 91 3.192 -14.245 7.839 727 HG22 THR 91 HG22 THR 91 4.866 -13.777 7.467 728 HG23 THR 91 HG23 THR 91 4.279 -15.377 6.988 729 H VAL 92 H VAL 92 0.783 -12.524 5.143 730 HA VAL 92 HA VAL 92 -0.459 -12.800 7.663 731 HB VAL 92 HB VAL 92 -1.606 -11.577 5.116 732 HG11 VAL 92 HG11 VAL 92 -3.428 -11.925 6.724 733 HG12 VAL 92 HG12 VAL 92 -2.444 -11.238 8.037 734 HG13 VAL 92 HG13 VAL 92 -2.999 -10.213 6.701 735 HG21 VAL 92 HG21 VAL 92 -0.072 -10.355 7.431 736 HG22 VAL 92 HG22 VAL 92 0.527 -10.576 5.780 737 HG23 VAL 92 HG23 VAL 92 -0.803 -9.451 6.083 738 H ILE 93 H ILE 93 -1.566 -14.140 4.507 739 HA ILE 93 HA ILE 93 -4.090 -14.997 5.500 740 HB ILE 93 HB ILE 93 -4.115 -16.570 3.575 741 HG12 ILE 93 HG12 ILE 93 -1.355 -15.475 2.962 742 HG13 ILE 93 HG13 ILE 93 -1.655 -17.070 3.631 743 HG21 ILE 93 HG21 ILE 93 -4.805 -14.159 3.386 744 HG22 ILE 93 HG22 ILE 93 -3.164 -13.756 2.828 745 HG23 ILE 93 HG23 ILE 93 -4.208 -14.815 1.853 746 HD11 ILE 93 HD11 ILE 93 -3.019 -17.608 1.572 747 HD12 ILE 93 HD12 ILE 93 -2.474 -16.054 0.893 748 HD13 ILE 93 HD13 ILE 93 -1.286 -17.317 1.272 749 H SER 94 H SER 94 -1.049 -16.259 6.330 750 HA SER 94 HA SER 94 -2.014 -18.989 6.818 751 HB2 SER 94 HB2 SER 94 0.164 -19.414 7.747 752 HB3 SER 94 HB3 SER 94 0.401 -18.422 6.287 753 HG SER 94 HG SER 94 0.750 -16.638 7.576 754 H ALA 95 H ALA 95 -2.280 -15.956 8.460 755 HA ALA 95 HA ALA 95 -2.122 -16.877 11.172 756 HB1 ALA 95 HB1 ALA 95 -3.321 -14.776 11.727 757 HB2 ALA 95 HB2 ALA 95 -2.045 -14.483 10.513 758 HB3 ALA 95 HB3 ALA 95 -3.746 -14.567 10.011 759 H LYS 96 H LYS 96 -4.745 -16.697 8.829 760 HA LYS 96 HA LYS 96 -6.412 -18.475 10.563 761 HB2 LYS 96 HB2 LYS 96 -7.351 -16.136 8.890 762 HB3 LYS 96 HB3 LYS 96 -8.414 -17.237 9.766 763 HG2 LYS 96 HG2 LYS 96 -6.363 -15.380 11.060 764 HG3 LYS 96 HG3 LYS 96 -8.070 -14.995 10.849 765 HD2 LYS 96 HD2 LYS 96 -8.685 -16.953 12.223 766 HD3 LYS 96 HD3 LYS 96 -6.964 -17.246 12.535 767 HE2 LYS 96 HE2 LYS 96 -6.742 -14.965 13.473 768 HE3 LYS 96 HE3 LYS 96 -8.471 -14.689 13.197 769 HZ1 LYS 96 HZ1 LYS 96 -8.961 -16.478 14.727 770 HZ2 LYS 96 HZ2 LYS 96 -8.023 -15.340 15.475 771 HZ3 LYS 96 HZ3 LYS 96 -7.347 -16.763 14.982 772 HA PRO 97 HA PRO 97 -5.479 -19.810 6.284 773 HB2 PRO 97 HB2 PRO 97 -4.614 -22.349 6.697 774 HB3 PRO 97 HB3 PRO 97 -3.608 -20.924 7.095 775 HG2 PRO 97 HG2 PRO 97 -5.387 -22.544 8.902 776 HG3 PRO 97 HG3 PRO 97 -3.675 -22.095 9.129 777 HD2 PRO 97 HD2 PRO 97 -5.713 -20.706 10.264 778 HD3 PRO 97 HD3 PRO 97 -4.203 -19.906 9.710 779 H LYS 98 H LYS 98 -8.193 -19.902 7.514 780 HA LYS 98 HA LYS 98 -9.213 -22.316 6.093 781 HB2 LYS 98 HB2 LYS 98 -10.303 -21.001 8.594 782 HB3 LYS 98 HB3 LYS 98 -11.139 -22.270 7.695 783 HG2 LYS 98 HG2 LYS 98 -8.423 -22.619 8.992 784 HG3 LYS 98 HG3 LYS 98 -9.963 -23.062 9.742 785 HD2 LYS 98 HD2 LYS 98 -10.421 -24.586 7.798 786 HD3 LYS 98 HD3 LYS 98 -8.773 -24.248 7.188 787 HE2 LYS 98 HE2 LYS 98 -7.825 -25.134 9.303 788 HE3 LYS 98 HE3 LYS 98 -9.458 -25.426 9.926 789 HZ1 LYS 98 HZ1 LYS 98 -9.800 -26.994 8.105 790 HZ2 LYS 98 HZ2 LYS 98 -8.518 -27.450 9.026 791 HZ3 LYS 98 HZ3 LYS 98 -8.261 -26.744 7.548 792 H ASP 99 H ASP 99 -11.649 -20.284 7.318 793 HA ASP 99 HA ASP 99 -12.820 -20.116 4.766 794 HB2 ASP 99 HB2 ASP 99 -13.955 -19.995 7.015 795 HB3 ASP 99 HB3 ASP 99 -13.376 -18.326 7.160 796 H GLU 100 H GLU 100 -11.526 -17.332 6.667 797 HA GLU 100 HA GLU 100 -11.825 -15.505 4.535 798 HB2 GLU 100 HB2 GLU 100 -10.549 -13.982 5.860 799 HB3 GLU 100 HB3 GLU 100 -11.560 -14.947 6.961 800 HG2 GLU 100 HG2 GLU 100 -9.611 -16.361 7.502 801 HG3 GLU 100 HG3 GLU 100 -8.617 -15.423 6.380 802 H LYS 101 H LYS 101 -9.447 -17.978 4.980 803 HA LYS 101 HA LYS 101 -7.151 -16.735 3.876 804 HB2 LYS 101 HB2 LYS 101 -7.441 -18.988 5.007 805 HB3 LYS 101 HB3 LYS 101 -8.020 -19.618 3.491 806 HG2 LYS 101 HG2 LYS 101 -5.294 -18.339 3.870 807 HG3 LYS 101 HG3 LYS 101 -5.601 -20.048 4.112 808 HD2 LYS 101 HD2 LYS 101 -5.781 -18.530 1.505 809 HD3 LYS 101 HD3 LYS 101 -4.622 -19.785 1.948 810 HE2 LYS 101 HE2 LYS 101 -7.607 -20.134 1.486 811 HE3 LYS 101 HE3 LYS 101 -6.301 -20.708 0.430 812 HZ1 LYS 101 HZ1 LYS 101 -5.611 -22.205 2.238 813 HZ2 LYS 101 HZ2 LYS 101 -7.181 -22.487 1.843 814 HZ3 LYS 101 HZ3 LYS 101 -6.822 -21.648 3.210 815 H LYS 102 H LYS 102 -9.956 -18.320 2.316 816 HA LYS 102 HA LYS 102 -8.812 -17.997 -0.339 817 HB2 LYS 102 HB2 LYS 102 -10.461 -19.752 0.206 818 HB3 LYS 102 HB3 LYS 102 -11.677 -18.506 0.504 819 HG2 LYS 102 HG2 LYS 102 -11.990 -19.521 -1.714 820 HG3 LYS 102 HG3 LYS 102 -11.563 -17.804 -1.874 821 HD2 LYS 102 HD2 LYS 102 -9.271 -18.371 -2.479 822 HD3 LYS 102 HD3 LYS 102 -9.546 -20.080 -2.100 823 HE2 LYS 102 HE2 LYS 102 -9.594 -19.783 -4.500 824 HE3 LYS 102 HE3 LYS 102 -11.221 -20.205 -3.928 825 HZ1 LYS 102 HZ1 LYS 102 -10.338 -17.449 -4.569 826 HZ2 LYS 102 HZ2 LYS 102 -11.859 -17.878 -4.128 827 HZ3 LYS 102 HZ3 LYS 102 -11.253 -18.405 -5.559 828 H SER 103 H SER 103 -11.210 -16.176 1.622 829 HA SER 103 HA SER 103 -11.994 -14.381 -0.426 830 HB2 SER 103 HB2 SER 103 -13.130 -14.589 1.763 831 HB3 SER 103 HB3 SER 103 -11.736 -13.849 2.568 832 HG SER 103 HG SER 103 -13.442 -12.667 0.618 833 H LEU 104 H LEU 104 -9.310 -14.087 1.988 834 HA LEU 104 HA LEU 104 -8.496 -11.510 1.073 835 HB2 LEU 104 HB2 LEU 104 -7.533 -13.565 2.895 836 HB3 LEU 104 HB3 LEU 104 -6.209 -12.836 1.990 837 HG LEU 104 HG LEU 104 -8.263 -11.221 3.518 838 HD11 LEU 104 HD11 LEU 104 -6.914 -12.638 5.036 839 HD12 LEU 104 HD12 LEU 104 -6.530 -10.917 5.218 840 HD13 LEU 104 HD13 LEU 104 -5.427 -11.972 4.313 841 HD21 LEU 104 HD21 LEU 104 -6.475 -9.428 3.272 842 HD22 LEU 104 HD22 LEU 104 -7.218 -9.902 1.736 843 HD23 LEU 104 HD23 LEU 104 -5.605 -10.514 2.172 844 H GLN 105 H GLN 105 -7.628 -14.786 -0.042 845 HA GLN 105 HA GLN 105 -5.463 -13.936 -1.736 846 HB2 GLN 105 HB2 GLN 105 -7.300 -16.332 -1.744 847 HB3 GLN 105 HB3 GLN 105 -6.088 -16.089 -2.993 848 HG2 GLN 105 HG2 GLN 105 -4.317 -16.065 -1.309 849 HG3 GLN 105 HG3 GLN 105 -5.509 -16.276 -0.025 850 HE21 GLN 105 HE21 GLN 105 -3.250 -17.945 -0.732 851 HE22 GLN 105 HE22 GLN 105 -3.894 -19.522 -1.135 852 H GLU 106 H GLU 106 -9.009 -14.035 -2.201 853 HA GLU 106 HA GLU 106 -8.836 -13.570 -5.052 854 HB2 GLU 106 HB2 GLU 106 -11.035 -13.048 -3.024 855 HB3 GLU 106 HB3 GLU 106 -11.210 -12.764 -4.774 856 HG2 GLU 106 HG2 GLU 106 -10.657 -15.124 -5.205 857 HG3 GLU 106 HG3 GLU 106 -10.542 -15.413 -3.468 858 H LEU 107 H LEU 107 -9.139 -11.358 -2.209 859 HA LEU 107 HA LEU 107 -9.184 -8.970 -3.825 860 HB2 LEU 107 HB2 LEU 107 -8.133 -9.403 -1.004 861 HB3 LEU 107 HB3 LEU 107 -8.326 -7.842 -1.778 862 HG LEU 107 HG LEU 107 -10.519 -9.730 -0.933 863 HD11 LEU 107 HD11 LEU 107 -9.720 -6.945 -0.076 864 HD12 LEU 107 HD12 LEU 107 -9.346 -8.446 0.804 865 HD13 LEU 107 HD13 LEU 107 -11.030 -7.922 0.606 866 HD21 LEU 107 HD21 LEU 107 -10.721 -7.078 -2.422 867 HD22 LEU 107 HD22 LEU 107 -12.086 -7.860 -1.608 868 HD23 LEU 107 HD23 LEU 107 -11.308 -8.661 -2.989 869 H THR 108 H THR 108 -6.571 -10.958 -2.478 870 HA THR 108 HA THR 108 -4.390 -9.270 -3.118 871 HB THR 108 HB THR 108 -4.438 -12.340 -3.324 872 HG1 THR 108 HG1 THR 108 -5.154 -11.483 -1.264 873 HG21 THR 108 HG21 THR 108 -2.387 -11.441 -4.252 874 HG22 THR 108 HG22 THR 108 -2.042 -12.111 -2.639 875 HG23 THR 108 HG23 THR 108 -2.192 -10.351 -2.864 876 H SER 109 H SER 109 -6.138 -11.708 -5.124 877 HA SER 109 HA SER 109 -4.398 -11.220 -7.389 878 HB2 SER 109 HB2 SER 109 -5.925 -12.660 -8.618 879 HB3 SER 109 HB3 SER 109 -5.591 -13.360 -7.017 880 HG SER 109 HG SER 109 -7.667 -12.078 -6.474 881 H LYS 110 H LYS 110 -7.552 -9.885 -6.338 882 HA LYS 110 HA LYS 110 -8.256 -8.757 -8.890 883 HB2 LYS 110 HB2 LYS 110 -9.209 -8.565 -6.090 884 HB3 LYS 110 HB3 LYS 110 -9.403 -7.077 -7.010 885 HG2 LYS 110 HG2 LYS 110 -11.423 -8.118 -7.378 886 HG3 LYS 110 HG3 LYS 110 -10.504 -8.559 -8.829 887 HD2 LYS 110 HD2 LYS 110 -9.960 -10.753 -7.782 888 HD3 LYS 110 HD3 LYS 110 -10.921 -10.289 -6.365 889 HE2 LYS 110 HE2 LYS 110 -12.919 -10.024 -7.836 890 HE3 LYS 110 HE3 LYS 110 -11.949 -10.591 -9.213 891 HZ1 LYS 110 HZ1 LYS 110 -12.521 -12.147 -6.749 892 HZ2 LYS 110 HZ2 LYS 110 -11.627 -12.684 -8.033 893 HZ3 LYS 110 HZ3 LYS 110 -13.235 -12.380 -8.211 894 H LEU 111 H LEU 111 -6.526 -7.473 -6.065 895 HA LEU 111 HA LEU 111 -6.284 -4.789 -6.967 896 HB2 LEU 111 HB2 LEU 111 -5.737 -5.759 -4.708 897 HB3 LEU 111 HB3 LEU 111 -4.263 -6.441 -5.365 898 HG LEU 111 HG LEU 111 -4.781 -3.462 -5.451 899 HD11 LEU 111 HD11 LEU 111 -3.626 -3.342 -3.243 900 HD12 LEU 111 HD12 LEU 111 -3.728 -5.113 -3.113 901 HD13 LEU 111 HD13 LEU 111 -5.208 -4.127 -3.162 902 HD21 LEU 111 HD21 LEU 111 -2.331 -3.333 -5.283 903 HD22 LEU 111 HD22 LEU 111 -2.799 -4.298 -6.693 904 HD23 LEU 111 HD23 LEU 111 -2.214 -5.100 -5.213 905 H PHE 112 H PHE 112 -4.250 -7.668 -7.596 906 HA PHE 112 HA PHE 112 -2.301 -6.196 -9.097 907 HB2 PHE 112 HB2 PHE 112 -2.925 -9.096 -8.699 908 HB3 PHE 112 HB3 PHE 112 -1.719 -8.594 -9.894 909 HD1 PHE 112 HD1 PHE 112 -2.574 -7.696 -6.314 910 HD2 PHE 112 HD2 PHE 112 0.484 -8.635 -9.182 911 HE1 PHE 112 HE1 PHE 112 -0.884 -7.450 -4.550 912 HE2 PHE 112 HE2 PHE 112 2.207 -8.394 -7.400 913 HZ PHE 112 HZ PHE 112 1.497 -7.801 -5.073 914 H SER 113 H SER 113 -5.388 -7.556 -10.029 915 HA SER 113 HA SER 113 -4.855 -7.646 -12.860 916 HB2 SER 113 HB2 SER 113 -6.849 -8.681 -11.701 917 HB3 SER 113 HB3 SER 113 -7.480 -7.040 -11.460 918 HG SER 113 HG SER 113 -7.276 -6.833 -13.831 919 H SER 114 H SER 114 -5.994 -5.090 -10.603 920 HA SER 114 HA SER 114 -6.325 -3.120 -12.678 921 HB2 SER 114 HB2 SER 114 -5.854 -2.775 -9.696 922 HB3 SER 114 HB3 SER 114 -6.415 -1.513 -10.815 923 HG SER 114 HG SER 114 -8.217 -2.937 -11.280 924 H ILE 115 H ILE 115 -3.546 -4.184 -10.755 925 HA ILE 115 HA ILE 115 -1.845 -1.927 -11.324 926 HB ILE 115 HB ILE 115 -1.098 -4.882 -10.880 927 HG12 ILE 115 HG12 ILE 115 -2.219 -3.775 -8.936 928 HG13 ILE 115 HG13 ILE 115 -0.594 -4.306 -8.603 929 HG21 ILE 115 HG21 ILE 115 0.680 -2.409 -11.064 930 HG22 ILE 115 HG22 ILE 115 1.208 -3.935 -10.286 931 HG23 ILE 115 HG23 ILE 115 0.769 -3.915 -11.998 932 HD11 ILE 115 HD11 ILE 115 -1.370 -1.420 -9.181 933 HD12 ILE 115 HD12 ILE 115 -1.113 -2.123 -7.583 934 HD13 ILE 115 HD13 ILE 115 0.252 -1.998 -8.711 935 H ASP 116 H ASP 116 -2.476 -5.019 -13.051 936 HA ASP 116 HA ASP 116 -0.588 -4.496 -15.136 937 HB2 ASP 116 HB2 ASP 116 -1.645 -6.712 -14.564 938 HB3 ASP 116 HB3 ASP 116 -3.133 -6.126 -15.314 939 H ASN 117 H ASN 117 -4.014 -3.591 -14.699 940 HA ASN 117 HA ASN 117 -4.351 -2.611 -17.397 941 HB2 ASN 117 HB2 ASN 117 -5.759 -1.755 -14.839 942 HB3 ASN 117 HB3 ASN 117 -6.280 -1.384 -16.487 943 HD21 ASN 117 HD21 ASN 117 -5.664 -3.973 -17.613 944 HD22 ASN 117 HD22 ASN 117 -6.860 -5.078 -16.980 945 H LEU 118 H LEU 118 -3.287 -1.104 -14.338 946 HA LEU 118 HA LEU 118 -3.103 1.577 -15.358 947 HB2 LEU 118 HB2 LEU 118 -2.905 0.378 -12.930 948 HB3 LEU 118 HB3 LEU 118 -1.199 0.639 -13.245 949 HG LEU 118 HG LEU 118 -3.328 2.810 -13.216 950 HD11 LEU 118 HD11 LEU 118 -1.299 1.948 -11.116 951 HD12 LEU 118 HD12 LEU 118 -3.064 1.799 -11.015 952 HD13 LEU 118 HD13 LEU 118 -2.311 3.408 -11.015 953 HD21 LEU 118 HD21 LEU 118 -1.408 4.360 -13.077 954 HD22 LEU 118 HD22 LEU 118 -1.413 3.443 -14.590 955 HD23 LEU 118 HD23 LEU 118 -0.292 2.992 -13.290 956 H ASP 119 H ASP 119 -0.819 -1.163 -15.161 957 HA ASP 119 HA ASP 119 1.483 0.160 -16.198 958 HB2 ASP 119 HB2 ASP 119 1.967 -1.923 -15.330 959 HB3 ASP 119 HB3 ASP 119 0.475 -2.655 -15.954 960 H HIS 120 H HIS 120 -1.231 -1.539 -17.890 961 HA HIS 120 HA HIS 120 -0.062 -1.107 -20.488 962 HB2 HIS 120 HB2 HIS 120 -2.823 -1.802 -19.519 963 HB3 HIS 120 HB3 HIS 120 -2.532 -1.380 -21.202 964 HD1 HIS 120 HD1 HIS 120 -1.765 -4.115 -18.693 965 HD2 HIS 120 HD2 HIS 120 -1.068 -3.189 -22.710 966 HE1 HIS 120 HE1 HIS 120 -0.865 -6.202 -19.779 967 H ALA 121 H ALA 121 -2.300 0.843 -18.483 968 HA ALA 121 HA ALA 121 -2.755 2.830 -20.493 969 HB1 ALA 121 HB1 ALA 121 -2.755 3.065 -17.465 970 HB2 ALA 121 HB2 ALA 121 -3.433 4.245 -18.609 971 HB3 ALA 121 HB3 ALA 121 -4.143 2.619 -18.493 972 H ALA 122 H ALA 122 -0.160 2.331 -18.127 973 HA ALA 122 HA ALA 122 1.114 4.877 -18.507 974 HB1 ALA 122 HB1 ALA 122 1.546 3.280 -16.615 975 HB2 ALA 122 HB2 ALA 122 2.375 2.198 -17.756 976 HB3 ALA 122 HB3 ALA 122 3.029 3.820 -17.430 977 H LYS 123 H LYS 123 1.559 1.660 -20.049 978 HA LYS 123 HA LYS 123 3.804 2.555 -21.597 979 HB2 LYS 123 HB2 LYS 123 1.837 0.256 -21.993 980 HB3 LYS 123 HB3 LYS 123 3.261 0.477 -23.013 981 HG2 LYS 123 HG2 LYS 123 4.745 0.197 -21.105 982 HG3 LYS 123 HG3 LYS 123 3.382 0.097 -19.997 983 HD2 LYS 123 HD2 LYS 123 3.975 -1.926 -22.202 984 HD3 LYS 123 HD3 LYS 123 4.385 -2.125 -20.482 985 HE2 LYS 123 HE2 LYS 123 1.902 -1.766 -20.001 986 HE3 LYS 123 HE3 LYS 123 1.626 -1.978 -21.731 987 HZ1 LYS 123 HZ1 LYS 123 1.291 -4.065 -20.785 988 HZ2 LYS 123 HZ2 LYS 123 2.559 -3.941 -19.740 989 HZ3 LYS 123 HZ3 LYS 123 2.842 -4.197 -21.350 990 H ILE 124 H ILE 124 0.296 2.590 -22.188 991 HA ILE 124 HA ILE 124 0.667 3.428 -24.977 992 HB ILE 124 HB ILE 124 -1.323 2.051 -23.935 993 HG12 ILE 124 HG12 ILE 124 -2.898 3.079 -25.673 994 HG13 ILE 124 HG13 ILE 124 -1.599 4.213 -26.041 995 HG21 ILE 124 HG21 ILE 124 -1.943 3.787 -22.253 996 HG22 ILE 124 HG22 ILE 124 -2.422 4.870 -23.578 997 HG23 ILE 124 HG23 ILE 124 -3.290 3.353 -23.315 998 HD11 ILE 124 HD11 ILE 124 -1.614 2.306 -27.600 999 HD12 ILE 124 HD12 ILE 124 -0.124 2.298 -26.635 1000 HD13 ILE 124 HD13 ILE 124 -1.437 1.170 -26.236 1001 H LYS 125 H LYS 125 1.203 4.909 -22.129 1002 HA LYS 125 HA LYS 125 1.649 7.031 -21.497 1003 HB2 LYS 125 HB2 LYS 125 1.294 7.843 -24.386 1004 HB3 LYS 125 HB3 LYS 125 2.212 8.693 -23.146 1005 HG2 LYS 125 HG2 LYS 125 3.772 6.731 -23.027 1006 HG3 LYS 125 HG3 LYS 125 2.902 5.985 -24.376 1007 HD2 LYS 125 HD2 LYS 125 4.232 8.726 -24.486 1008 HD3 LYS 125 HD3 LYS 125 4.973 7.225 -25.061 1009 HE2 LYS 125 HE2 LYS 125 3.053 6.910 -26.641 1010 HE3 LYS 125 HE3 LYS 125 2.390 8.460 -26.109 1011 HZ1 LYS 125 HZ1 LYS 125 5.005 8.082 -27.429 1012 HZ2 LYS 125 HZ2 LYS 125 4.391 9.538 -26.918 1013 HZ3 LYS 125 HZ3 LYS 125 3.655 8.709 -28.128 1014 H SER 126 H SER 126 -1.159 6.206 -21.415 1015 HA SER 126 HA SER 126 -2.486 8.848 -21.865 1016 HB2 SER 126 HB2 SER 126 -3.633 6.923 -22.852 1017 HB3 SER 126 HB3 SER 126 -3.710 6.149 -21.244 1018 HG SER 126 HG SER 126 -5.595 7.464 -22.001 1019 HA PRO 127 HA PRO 127 -1.777 8.941 -17.438 1020 HB2 PRO 127 HB2 PRO 127 -2.282 11.565 -16.941 1021 HB3 PRO 127 HB3 PRO 127 -0.749 11.005 -17.673 1022 HG2 PRO 127 HG2 PRO 127 -3.181 12.116 -19.053 1023 HG3 PRO 127 HG3 PRO 127 -1.455 12.574 -19.232 1024 HD2 PRO 127 HD2 PRO 127 -2.665 10.858 -20.954 1025 HD3 PRO 127 HD3 PRO 127 -0.951 10.637 -20.468 1026 H THR 128 H THR 128 -4.627 10.207 -19.196 1027 HA THR 128 HA THR 128 -6.353 10.461 -16.958 1028 HB THR 128 HB THR 128 -7.278 9.567 -19.717 1029 HG1 THR 128 HG1 THR 128 -7.179 11.948 -20.101 1030 HG21 THR 128 HG21 THR 128 -8.358 11.582 -17.700 1031 HG22 THR 128 HG22 THR 128 -8.992 9.932 -17.952 1032 HG23 THR 128 HG23 THR 128 -9.116 11.150 -19.247 1033 H GLU 129 H GLU 129 -5.669 7.747 -19.179 1034 HA GLU 129 HA GLU 129 -7.576 5.980 -17.910 1035 HB2 GLU 129 HB2 GLU 129 -5.190 5.473 -19.721 1036 HB3 GLU 129 HB3 GLU 129 -6.342 4.228 -19.215 1037 HG2 GLU 129 HG2 GLU 129 -7.009 6.723 -20.816 1038 HG3 GLU 129 HG3 GLU 129 -6.864 5.084 -21.461 1039 H ALA 130 H ALA 130 -4.124 6.701 -17.483 1040 HA ALA 130 HA ALA 130 -3.569 4.552 -15.696 1041 HB1 ALA 130 HB1 ALA 130 -2.339 7.343 -15.843 1042 HB2 ALA 130 HB2 ALA 130 -1.645 5.942 -15.000 1043 HB3 ALA 130 HB3 ALA 130 -1.813 5.918 -16.765 1044 H GLU 131 H GLU 131 -4.841 7.884 -15.149 1045 HA GLU 131 HA GLU 131 -4.978 7.525 -12.284 1046 HB2 GLU 131 HB2 GLU 131 -6.356 9.479 -14.146 1047 HB3 GLU 131 HB3 GLU 131 -6.555 9.467 -12.387 1048 HG2 GLU 131 HG2 GLU 131 -3.982 9.551 -12.271 1049 HG3 GLU 131 HG3 GLU 131 -4.056 10.046 -13.970 1050 H LYS 132 H LYS 132 -7.228 6.796 -14.945 1051 HA LYS 132 HA LYS 132 -9.525 6.349 -13.310 1052 HB2 LYS 132 HB2 LYS 132 -9.328 6.445 -15.892 1053 HB3 LYS 132 HB3 LYS 132 -8.815 4.752 -15.791 1054 HG2 LYS 132 HG2 LYS 132 -11.067 4.566 -14.343 1055 HG3 LYS 132 HG3 LYS 132 -11.491 5.992 -15.307 1056 HD2 LYS 132 HD2 LYS 132 -10.654 3.258 -16.340 1057 HD3 LYS 132 HD3 LYS 132 -12.286 3.953 -16.391 1058 HE2 LYS 132 HE2 LYS 132 -9.815 4.904 -17.884 1059 HE3 LYS 132 HE3 LYS 132 -11.191 4.065 -18.575 1060 HZ1 LYS 132 HZ1 LYS 132 -12.524 5.982 -18.273 1061 HZ2 LYS 132 HZ2 LYS 132 -11.116 6.451 -18.997 1062 HZ3 LYS 132 HZ3 LYS 132 -11.357 6.753 -17.382 1063 H TYR 133 H TYR 133 -6.890 4.162 -14.424 1064 HA TYR 133 HA TYR 133 -7.990 1.914 -12.923 1065 HB2 TYR 133 HB2 TYR 133 -5.349 2.360 -14.340 1066 HB3 TYR 133 HB3 TYR 133 -5.780 0.848 -13.502 1067 HD1 TYR 133 HD1 TYR 133 -8.353 0.059 -14.108 1068 HD2 TYR 133 HD2 TYR 133 -5.730 2.317 -16.673 1069 HE1 TYR 133 HE1 TYR 133 -9.639 -0.697 -16.110 1070 HE2 TYR 133 HE2 TYR 133 -7.034 1.561 -18.668 1071 HH TYR 133 HH TYR 133 -9.835 -0.637 -18.375 1072 H TYR 134 H TYR 134 -5.672 4.509 -12.226 1073 HA TYR 134 HA TYR 134 -4.577 3.354 -9.845 1074 HB2 TYR 134 HB2 TYR 134 -3.605 5.364 -10.774 1075 HB3 TYR 134 HB3 TYR 134 -5.130 6.218 -10.677 1076 HD1 TYR 134 HD1 TYR 134 -2.401 4.767 -8.577 1077 HD2 TYR 134 HD2 TYR 134 -5.798 7.412 -8.733 1078 HE1 TYR 134 HE1 TYR 134 -1.808 5.670 -6.328 1079 HE2 TYR 134 HE2 TYR 134 -5.182 8.310 -6.482 1080 HH TYR 134 HH TYR 134 -2.271 7.293 -4.737 1081 H GLY 135 H GLY 135 -7.555 5.320 -10.428 1082 HA2 GLY 135 HA2 GLY 135 -8.373 5.390 -7.702 1083 HA3 GLY 135 HA3 GLY 135 -9.441 5.539 -9.106 1084 H GLN 136 H GLN 136 -8.879 2.905 -10.205 1085 HA GLN 136 HA GLN 136 -10.698 1.321 -8.587 1086 HB2 GLN 136 HB2 GLN 136 -8.902 0.624 -10.938 1087 HB3 GLN 136 HB3 GLN 136 -10.063 -0.498 -10.217 1088 HG2 GLN 136 HG2 GLN 136 -11.918 0.871 -10.869 1089 HG3 GLN 136 HG3 GLN 136 -10.859 2.209 -11.316 1090 HE21 GLN 136 HE21 GLN 136 -11.047 2.495 -13.415 1091 HE22 GLN 136 HE22 GLN 136 -10.882 1.244 -14.616 1092 H THR 137 H THR 137 -7.170 1.447 -9.055 1093 HA THR 137 HA THR 137 -6.595 -0.887 -7.497 1094 HB THR 137 HB THR 137 -4.773 1.536 -7.861 1095 HG1 THR 137 HG1 THR 137 -5.531 0.793 -9.894 1096 HG21 THR 137 HG21 THR 137 -4.023 -0.241 -6.259 1097 HG22 THR 137 HG22 THR 137 -2.976 -0.107 -7.688 1098 HG23 THR 137 HG23 THR 137 -4.165 -1.423 -7.561 1099 H VAL 138 H VAL 138 -6.943 2.576 -6.675 1100 HA VAL 138 HA VAL 138 -6.171 2.433 -3.930 1101 HB VAL 138 HB VAL 138 -8.271 4.197 -5.298 1102 HG11 VAL 138 HG11 VAL 138 -8.771 4.188 -2.905 1103 HG12 VAL 138 HG12 VAL 138 -7.049 4.445 -2.521 1104 HG13 VAL 138 HG13 VAL 138 -7.978 5.714 -3.329 1105 HG21 VAL 138 HG21 VAL 138 -6.624 5.790 -5.669 1106 HG22 VAL 138 HG22 VAL 138 -5.579 5.198 -4.379 1107 HG23 VAL 138 HG23 VAL 138 -5.685 4.310 -5.906 1108 H SER 139 H SER 139 -9.333 1.756 -5.537 1109 HA SER 139 HA SER 139 -10.767 1.332 -3.103 1110 HB2 SER 139 HB2 SER 139 -11.822 1.636 -5.349 1111 HB3 SER 139 HB3 SER 139 -11.267 -0.004 -5.789 1112 HG SER 139 HG SER 139 -12.564 -0.832 -4.123 1113 H ASN 140 H ASN 140 -8.998 -0.937 -5.264 1114 HA ASN 140 HA ASN 140 -9.580 -3.284 -3.721 1115 HB2 ASN 140 HB2 ASN 140 -7.255 -2.576 -5.549 1116 HB3 ASN 140 HB3 ASN 140 -7.461 -4.164 -4.805 1117 HD21 ASN 140 HD21 ASN 140 -7.811 -2.685 -7.616 1118 HD22 ASN 140 HD22 ASN 140 -9.164 -3.557 -8.259 1119 H ILE 141 H ILE 141 -6.982 -0.846 -3.495 1120 HA ILE 141 HA ILE 141 -5.417 -2.207 -1.509 1121 HB ILE 141 HB ILE 141 -5.723 0.748 -2.229 1122 HG12 ILE 141 HG12 ILE 141 -3.279 -1.027 -2.515 1123 HG13 ILE 141 HG13 ILE 141 -4.549 -1.006 -3.746 1124 HG21 ILE 141 HG21 ILE 141 -3.918 -0.483 -0.095 1125 HG22 ILE 141 HG22 ILE 141 -3.632 1.123 -0.807 1126 HG23 ILE 141 HG23 ILE 141 -5.113 0.807 0.110 1127 HD11 ILE 141 HD11 ILE 141 -2.799 0.485 -4.439 1128 HD12 ILE 141 HD12 ILE 141 -4.189 1.474 -3.998 1129 HD13 ILE 141 HD13 ILE 141 -2.805 1.342 -2.883 1130 H ASN 142 H ASN 142 -8.130 0.118 -1.291 1131 HA ASN 142 HA ASN 142 -8.142 0.299 1.547 1132 HB2 ASN 142 HB2 ASN 142 -9.384 1.766 -0.085 1133 HB3 ASN 142 HB3 ASN 142 -10.533 0.442 -0.297 1134 HD21 ASN 142 HD21 ASN 142 -12.343 0.845 0.744 1135 HD22 ASN 142 HD22 ASN 142 -12.452 1.530 2.348 1136 H GLU 143 H GLU 143 -9.819 -1.996 -0.662 1137 HA GLU 143 HA GLU 143 -11.255 -3.281 1.459 1138 HB2 GLU 143 HB2 GLU 143 -10.437 -4.185 -1.307 1139 HB3 GLU 143 HB3 GLU 143 -11.398 -5.196 -0.206 1140 HG2 GLU 143 HG2 GLU 143 -13.119 -3.420 -0.111 1141 HG3 GLU 143 HG3 GLU 143 -12.171 -2.458 -1.256 1142 H VAL 144 H VAL 144 -8.050 -3.904 0.034 1143 HA VAL 144 HA VAL 144 -7.595 -6.327 1.556 1144 HB VAL 144 HB VAL 144 -5.663 -4.307 0.291 1145 HG11 VAL 144 HG11 VAL 144 -3.882 -6.069 0.646 1146 HG12 VAL 144 HG12 VAL 144 -4.450 -5.306 2.139 1147 HG13 VAL 144 HG13 VAL 144 -5.015 -6.935 1.721 1148 HG21 VAL 144 HG21 VAL 144 -5.305 -6.079 -1.367 1149 HG22 VAL 144 HG22 VAL 144 -6.408 -7.157 -0.490 1150 HG23 VAL 144 HG23 VAL 144 -7.034 -5.695 -1.271 1151 H LEU 145 H LEU 145 -7.100 -2.815 2.164 1152 HA LEU 145 HA LEU 145 -5.649 -3.182 4.619 1153 HB2 LEU 145 HB2 LEU 145 -6.782 -0.998 3.108 1154 HB3 LEU 145 HB3 LEU 145 -7.193 -0.816 4.803 1155 HG LEU 145 HG LEU 145 -4.769 -1.042 5.387 1156 HD11 LEU 145 HD11 LEU 145 -3.958 -2.241 3.411 1157 HD12 LEU 145 HD12 LEU 145 -3.135 -0.674 3.540 1158 HD13 LEU 145 HD13 LEU 145 -4.444 -0.887 2.360 1159 HD21 LEU 145 HD21 LEU 145 -4.161 1.221 4.631 1160 HD22 LEU 145 HD22 LEU 145 -5.845 1.146 5.192 1161 HD23 LEU 145 HD23 LEU 145 -5.489 1.191 3.445 1162 H ALA 146 H ALA 146 -9.108 -3.001 3.873 1163 HA ALA 146 HA ALA 146 -10.001 -2.872 6.590 1164 HB1 ALA 146 HB1 ALA 146 -12.175 -3.550 5.654 1165 HB2 ALA 146 HB2 ALA 146 -11.416 -2.277 4.666 1166 HB3 ALA 146 HB3 ALA 146 -11.387 -3.969 4.109 1167 H LYS 147 H LYS 147 -9.113 -5.587 4.466 1168 HA LYS 147 HA LYS 147 -10.039 -7.635 6.353 1169 HB2 LYS 147 HB2 LYS 147 -8.124 -7.678 3.998 1170 HB3 LYS 147 HB3 LYS 147 -8.484 -9.109 4.972 1171 HG2 LYS 147 HG2 LYS 147 -10.573 -7.525 3.473 1172 HG3 LYS 147 HG3 LYS 147 -9.728 -8.953 2.848 1173 HD2 LYS 147 HD2 LYS 147 -10.554 -10.263 4.803 1174 HD3 LYS 147 HD3 LYS 147 -11.568 -8.868 5.253 1175 HE2 LYS 147 HE2 LYS 147 -11.651 -10.275 2.548 1176 HE3 LYS 147 HE3 LYS 147 -12.772 -10.599 3.897 1177 HZ1 LYS 147 HZ1 LYS 147 -12.433 -7.991 2.514 1178 HZ2 LYS 147 HZ2 LYS 147 -13.466 -8.274 3.779 1179 HZ3 LYS 147 HZ3 LYS 147 -13.713 -9.013 2.327 1180 H LEU 148 H LEU 148 -7.346 -5.525 6.236 1181 HA LEU 148 HA LEU 148 -5.678 -7.314 7.920 1182 HB2 LEU 148 HB2 LEU 148 -5.177 -4.609 6.613 1183 HB3 LEU 148 HB3 LEU 148 -4.017 -5.420 7.659 1184 HG LEU 148 HG LEU 148 -4.990 -6.658 5.072 1185 HD11 LEU 148 HD11 LEU 148 -2.521 -4.960 5.588 1186 HD12 LEU 148 HD12 LEU 148 -3.925 -4.493 4.596 1187 HD13 LEU 148 HD13 LEU 148 -2.893 -5.845 4.097 1188 HD21 LEU 148 HD21 LEU 148 -2.926 -7.975 5.322 1189 HD22 LEU 148 HD22 LEU 148 -4.001 -8.186 6.708 1190 HD23 LEU 148 HD23 LEU 148 -2.569 -7.144 6.858 1191 H GLY 149 H GLY 149 -8.237 -5.326 8.480 1192 HA2 GLY 149 HA2 GLY 149 -7.016 -3.857 10.753 1193 HA3 GLY 149 HA3 GLY 149 -8.621 -3.573 10.051 Start of MODEL 9 1 H1 GLU 1 H1 GLU 1 -1.842 22.287 18.408 2 H2 GLU 1 H2 GLU 1 -0.972 22.049 19.786 3 H3 GLU 1 H3 GLU 1 -0.961 20.905 18.597 4 HA GLU 1 HA GLU 1 -2.339 20.251 20.474 5 HB2 GLU 1 HB2 GLU 1 -4.433 21.457 20.871 6 HB3 GLU 1 HB3 GLU 1 -3.016 22.466 21.156 7 HG2 GLU 1 HG2 GLU 1 -3.375 23.419 18.812 8 HG3 GLU 1 HG3 GLU 1 -4.950 22.605 18.834 9 H ALA 2 H ALA 2 -3.557 21.602 17.325 10 HA ALA 2 HA ALA 2 -5.351 19.401 16.897 11 HB1 ALA 2 HB1 ALA 2 -5.600 21.569 15.730 12 HB2 ALA 2 HB2 ALA 2 -4.023 21.330 14.933 13 HB3 ALA 2 HB3 ALA 2 -5.384 20.250 14.556 14 H ARG 3 H ARG 3 -5.056 17.615 15.479 15 HA ARG 3 HA ARG 3 -2.366 16.466 15.563 16 HB2 ARG 3 HB2 ARG 3 -5.090 15.575 14.564 17 HB3 ARG 3 HB3 ARG 3 -3.634 14.661 14.163 18 HG2 ARG 3 HG2 ARG 3 -4.014 13.556 16.053 19 HG3 ARG 3 HG3 ARG 3 -3.296 14.940 16.862 20 HD2 ARG 3 HD2 ARG 3 -6.260 14.951 16.306 21 HD3 ARG 3 HD3 ARG 3 -5.635 13.921 17.602 22 HE ARG 3 HE ARG 3 -4.570 16.554 17.901 23 HH11 ARG 3 HH11 ARG 3 -7.600 14.774 18.369 24 HH12 ARG 3 HH12 ARG 3 -8.136 15.867 19.627 25 HH21 ARG 3 HH21 ARG 3 -5.328 17.892 19.492 26 HH22 ARG 3 HH22 ARG 3 -6.878 17.583 20.249 27 HA PRO 4 HA PRO 4 -1.023 18.101 11.803 28 HB2 PRO 4 HB2 PRO 4 0.764 16.286 10.829 29 HB3 PRO 4 HB3 PRO 4 0.998 17.097 12.405 30 HG2 PRO 4 HG2 PRO 4 -0.237 14.412 11.847 31 HG3 PRO 4 HG3 PRO 4 1.126 14.818 12.940 32 HD2 PRO 4 HD2 PRO 4 -1.387 14.592 13.882 33 HD3 PRO 4 HD3 PRO 4 -0.283 15.869 14.501 34 H ILE 5 H ILE 5 -3.560 16.776 11.389 35 HA ILE 5 HA ILE 5 -3.332 16.010 8.509 36 HB ILE 5 HB ILE 5 -4.578 14.472 10.077 37 HG12 ILE 5 HG12 ILE 5 -5.066 15.035 7.507 38 HG13 ILE 5 HG13 ILE 5 -5.894 13.776 8.416 39 HG21 ILE 5 HG21 ILE 5 -6.834 15.130 10.918 40 HG22 ILE 5 HG22 ILE 5 -5.532 16.082 11.650 41 HG23 ILE 5 HG23 ILE 5 -6.543 16.800 10.376 42 HD11 ILE 5 HD11 ILE 5 -7.878 15.174 8.708 43 HD12 ILE 5 HD12 ILE 5 -7.048 16.577 7.990 44 HD13 ILE 5 HD13 ILE 5 -7.429 15.161 6.992 45 H VAL 6 H VAL 6 -4.014 18.486 10.770 46 HA VAL 6 HA VAL 6 -5.902 19.999 9.214 47 HB VAL 6 HB VAL 6 -5.612 20.171 11.708 48 HG11 VAL 6 HG11 VAL 6 -3.787 21.571 12.630 49 HG12 VAL 6 HG12 VAL 6 -3.168 20.098 11.864 50 HG13 VAL 6 HG13 VAL 6 -3.040 21.650 11.026 51 HG21 VAL 6 HG21 VAL 6 -6.742 21.961 10.371 52 HG22 VAL 6 HG22 VAL 6 -6.011 22.538 11.883 53 HG23 VAL 6 HG23 VAL 6 -5.201 22.851 10.342 54 H VAL 7 H VAL 7 -5.582 21.650 7.766 55 HA VAL 7 HA VAL 7 -3.092 21.641 6.321 56 HB VAL 7 HB VAL 7 -5.437 21.971 5.360 57 HG11 VAL 7 HG11 VAL 7 -6.225 23.682 6.994 58 HG12 VAL 7 HG12 VAL 7 -5.078 24.853 6.300 59 HG13 VAL 7 HG13 VAL 7 -6.408 24.211 5.311 60 HG21 VAL 7 HG21 VAL 7 -3.381 22.374 4.041 61 HG22 VAL 7 HG22 VAL 7 -4.711 23.448 3.561 62 HG23 VAL 7 HG23 VAL 7 -3.383 24.074 4.565 63 H GLY 8 H GLY 8 -4.217 23.449 9.022 64 HA2 GLY 8 HA2 GLY 8 -2.121 25.531 8.619 65 HA3 GLY 8 HA3 GLY 8 -3.507 25.658 9.714 66 HA PRO 9 HA PRO 9 -0.335 22.594 11.599 67 HB2 PRO 9 HB2 PRO 9 2.294 23.348 11.444 68 HB3 PRO 9 HB3 PRO 9 1.504 22.352 10.178 69 HG2 PRO 9 HG2 PRO 9 1.914 25.332 10.244 70 HG3 PRO 9 HG3 PRO 9 2.361 24.162 8.958 71 HD2 PRO 9 HD2 PRO 9 0.081 25.567 8.803 72 HD3 PRO 9 HD3 PRO 9 0.118 23.834 8.323 73 HA PRO 10 HA PRO 10 -0.185 25.189 15.141 74 HB2 PRO 10 HB2 PRO 10 1.530 23.925 16.872 75 HB3 PRO 10 HB3 PRO 10 -0.088 23.263 16.467 76 HG2 PRO 10 HG2 PRO 10 2.583 22.583 15.256 77 HG3 PRO 10 HG3 PRO 10 1.342 21.480 15.940 78 HD2 PRO 10 HD2 PRO 10 1.484 21.921 13.296 79 HD3 PRO 10 HD3 PRO 10 -0.114 21.811 14.116 80 HA PRO 11 HA PRO 11 3.246 27.832 14.564 81 HB2 PRO 11 HB2 PRO 11 3.497 29.199 16.926 82 HB3 PRO 11 HB3 PRO 11 2.100 29.433 15.826 83 HG2 PRO 11 HG2 PRO 11 2.315 27.657 18.245 84 HG3 PRO 11 HG3 PRO 11 1.068 28.888 17.860 85 HD2 PRO 11 HD2 PRO 11 0.647 26.285 17.340 86 HD3 PRO 11 HD3 PRO 11 0.105 27.549 16.180 87 HA PRO 12 HA PRO 12 6.838 25.801 16.158 88 HB2 PRO 12 HB2 PRO 12 8.781 27.723 16.054 89 HB3 PRO 12 HB3 PRO 12 8.082 26.995 14.572 90 HG2 PRO 12 HG2 PRO 12 7.322 29.564 15.948 91 HG3 PRO 12 HG3 PRO 12 7.751 29.292 14.225 92 HD2 PRO 12 HD2 PRO 12 5.184 29.387 15.010 93 HD3 PRO 12 HD3 PRO 12 5.719 28.189 13.779 94 H LEU 13 H LEU 13 8.418 25.848 17.931 95 HA LEU 13 HA LEU 13 9.076 26.089 20.090 96 HB2 LEU 13 HB2 LEU 13 8.420 28.711 19.408 97 HB3 LEU 13 HB3 LEU 13 7.548 28.436 20.909 98 HG LEU 13 HG LEU 13 10.532 27.997 20.544 99 HD11 LEU 13 HD11 LEU 13 9.911 30.358 20.214 100 HD12 LEU 13 HD12 LEU 13 10.792 30.139 21.740 101 HD13 LEU 13 HD13 LEU 13 9.025 30.351 21.759 102 HD21 LEU 13 HD21 LEU 13 8.805 28.137 23.049 103 HD22 LEU 13 HD22 LEU 13 10.584 28.071 23.028 104 HD23 LEU 13 HD23 LEU 13 9.639 26.700 22.419 105 H SER 14 H SER 14 5.677 26.248 19.302 106 HA SER 14 HA SER 14 4.767 25.489 21.966 107 HB2 SER 14 HB2 SER 14 3.324 26.651 20.287 108 HB3 SER 14 HB3 SER 14 3.393 25.202 19.262 109 HG SER 14 HG SER 14 1.533 25.424 20.738 110 H GLY 15 H GLY 15 4.107 23.401 22.616 111 HA2 GLY 15 HA2 GLY 15 5.493 21.219 21.138 112 HA3 GLY 15 HA3 GLY 15 5.090 21.217 22.859 113 H GLY 16 H GLY 16 4.418 18.984 21.753 114 HA2 GLY 16 HA2 GLY 16 1.478 19.224 21.243 115 HA3 GLY 16 HA3 GLY 16 2.503 17.997 20.467 116 H LEU 17 H LEU 17 0.169 17.842 22.429 117 HA LEU 17 HA LEU 17 1.477 15.892 24.222 118 HB2 LEU 17 HB2 LEU 17 0.176 16.769 26.164 119 HB3 LEU 17 HB3 LEU 17 1.477 17.807 25.613 120 HG LEU 17 HG LEU 17 -1.160 18.492 24.456 121 HD11 LEU 17 HD11 LEU 17 -1.991 19.537 26.528 122 HD12 LEU 17 HD12 LEU 17 -0.643 18.816 27.439 123 HD13 LEU 17 HD13 LEU 17 -1.877 17.773 26.691 124 HD21 LEU 17 HD21 LEU 17 0.871 19.908 24.190 125 HD22 LEU 17 HD22 LEU 17 0.949 20.115 25.954 126 HD23 LEU 17 HD23 LEU 17 -0.427 20.772 25.039 127 HA PRO 18 HA PRO 18 -2.763 14.653 22.762 128 HB2 PRO 18 HB2 PRO 18 -2.218 12.564 21.107 129 HB3 PRO 18 HB3 PRO 18 -2.214 14.257 20.512 130 HG2 PRO 18 HG2 PRO 18 0.100 12.548 21.390 131 HG3 PRO 18 HG3 PRO 18 -0.086 13.500 19.883 132 HD2 PRO 18 HD2 PRO 18 1.282 14.435 22.038 133 HD3 PRO 18 HD3 PRO 18 0.314 15.520 20.980 134 H GLY 19 H GLY 19 -3.858 12.753 23.600 135 HA2 GLY 19 HA2 GLY 19 -2.230 10.629 24.804 136 HA3 GLY 19 HA3 GLY 19 -2.969 11.728 25.978 137 H THR 20 H THR 20 -5.408 12.110 25.603 138 HA THR 20 HA THR 20 -6.691 9.516 24.827 139 HB THR 20 HB THR 20 -8.429 10.113 26.562 140 HG1 THR 20 HG1 THR 20 -8.048 12.324 26.759 141 HG21 THR 20 HG21 THR 20 -5.613 9.959 27.713 142 HG22 THR 20 HG22 THR 20 -6.533 8.561 27.105 143 HG23 THR 20 HG23 THR 20 -7.122 9.475 28.511 144 H GLU 21 H GLU 21 -8.926 9.777 24.102 145 HA GLU 21 HA GLU 21 -10.421 10.628 22.605 146 HB2 GLU 21 HB2 GLU 21 -10.586 11.983 24.860 147 HB3 GLU 21 HB3 GLU 21 -10.133 13.347 23.829 148 HG2 GLU 21 HG2 GLU 21 -12.080 12.940 22.399 149 HG3 GLU 21 HG3 GLU 21 -12.460 11.459 23.295 150 H ASN 22 H ASN 22 -7.651 10.716 21.727 151 HA ASN 22 HA ASN 22 -7.080 13.176 20.405 152 HB2 ASN 22 HB2 ASN 22 -6.159 10.372 19.685 153 HB3 ASN 22 HB3 ASN 22 -5.411 11.880 19.146 154 HD21 ASN 22 HD21 ASN 22 -4.833 9.428 21.012 155 HD22 ASN 22 HD22 ASN 22 -4.066 10.179 22.390 156 H SER 23 H SER 23 -8.970 10.367 19.504 157 HA SER 23 HA SER 23 -10.154 9.788 17.629 158 HB2 SER 23 HB2 SER 23 -10.517 12.792 17.368 159 HB3 SER 23 HB3 SER 23 -11.591 11.520 16.741 160 HG SER 23 HG SER 23 -11.088 12.284 19.424 161 H ASP 24 H ASP 24 -7.524 9.624 17.031 162 HA ASP 24 HA ASP 24 -7.381 10.661 14.261 163 HB2 ASP 24 HB2 ASP 24 -5.119 11.426 14.571 164 HB3 ASP 24 HB3 ASP 24 -6.136 12.189 15.798 165 H GLN 25 H GLN 25 -5.286 9.773 13.220 166 HA GLN 25 HA GLN 25 -4.677 6.987 14.022 167 HB2 GLN 25 HB2 GLN 25 -5.607 7.846 11.243 168 HB3 GLN 25 HB3 GLN 25 -4.918 6.268 11.646 169 HG2 GLN 25 HG2 GLN 25 -6.838 5.876 13.201 170 HG3 GLN 25 HG3 GLN 25 -7.553 7.397 12.646 171 HE21 GLN 25 HE21 GLN 25 -8.194 4.376 12.404 172 HE22 GLN 25 HE22 GLN 25 -8.585 4.204 10.709 173 H ALA 26 H ALA 26 -2.652 6.368 12.778 174 HA ALA 26 HA ALA 26 -0.444 6.829 12.370 175 HB1 ALA 26 HB1 ALA 26 -1.433 7.354 10.140 176 HB2 ALA 26 HB2 ALA 26 -1.597 9.058 10.631 177 HB3 ALA 26 HB3 ALA 26 0.016 8.328 10.482 178 H ARG 27 H ARG 27 -1.256 7.845 14.782 179 HA ARG 27 HA ARG 27 -0.614 10.616 15.146 180 HB2 ARG 27 HB2 ARG 27 -2.003 9.142 16.677 181 HB3 ARG 27 HB3 ARG 27 -0.498 8.367 17.189 182 HG2 ARG 27 HG2 ARG 27 0.329 10.561 18.019 183 HG3 ARG 27 HG3 ARG 27 -1.193 11.312 17.517 184 HD2 ARG 27 HD2 ARG 27 -1.301 10.858 19.887 185 HD3 ARG 27 HD3 ARG 27 -2.413 9.762 19.053 186 HE ARG 27 HE ARG 27 -1.126 7.957 19.715 187 HH11 ARG 27 HH11 ARG 27 0.782 10.873 20.315 188 HH12 ARG 27 HH12 ARG 27 2.014 9.997 21.183 189 HH21 ARG 27 HH21 ARG 27 0.483 6.924 20.847 190 HH22 ARG 27 HH22 ARG 27 1.841 7.814 21.478 191 H ASP 28 H ASP 28 1.209 11.590 15.730 192 HA ASP 28 HA ASP 28 3.347 12.047 16.282 193 HB2 ASP 28 HB2 ASP 28 2.904 9.977 17.875 194 HB3 ASP 28 HB3 ASP 28 4.087 9.191 16.817 195 H GLY 29 H GLY 29 5.621 11.798 15.629 196 HA2 GLY 29 HA2 GLY 29 5.625 11.391 12.726 197 HA3 GLY 29 HA3 GLY 29 6.923 12.073 13.714 198 H THR 30 H THR 30 5.241 8.898 13.381 199 HA THR 30 HA THR 30 7.946 7.663 13.106 200 HB THR 30 HB THR 30 7.273 7.437 15.488 201 HG1 THR 30 HG1 THR 30 7.261 5.046 15.446 202 HG21 THR 30 HG21 THR 30 4.793 7.453 15.165 203 HG22 THR 30 HG22 THR 30 5.354 6.086 16.145 204 HG23 THR 30 HG23 THR 30 4.901 5.831 14.446 205 H LEU 31 H LEU 31 8.047 5.785 11.920 206 HA LEU 31 HA LEU 31 5.567 5.066 10.408 207 HB2 LEU 31 HB2 LEU 31 8.443 5.123 9.443 208 HB3 LEU 31 HB3 LEU 31 7.076 4.488 8.527 209 HG LEU 31 HG LEU 31 7.396 7.385 9.398 210 HD11 LEU 31 HD11 LEU 31 7.879 7.817 7.027 211 HD12 LEU 31 HD12 LEU 31 7.771 6.076 6.673 212 HD13 LEU 31 HD13 LEU 31 9.069 6.697 7.722 213 HD21 LEU 31 HD21 LEU 31 5.549 7.799 7.766 214 HD22 LEU 31 HD22 LEU 31 5.032 6.821 9.148 215 HD23 LEU 31 HD23 LEU 31 5.349 6.042 7.577 216 HA PRO 32 HA PRO 32 7.106 1.434 12.666 217 HB2 PRO 32 HB2 PRO 32 4.741 0.264 13.315 218 HB3 PRO 32 HB3 PRO 32 5.342 1.726 14.164 219 HG2 PRO 32 HG2 PRO 32 3.368 1.546 11.890 220 HG3 PRO 32 HG3 PRO 32 3.214 2.418 13.448 221 HD2 PRO 32 HD2 PRO 32 4.009 3.647 11.145 222 HD3 PRO 32 HD3 PRO 32 4.625 4.137 12.761 223 H TYR 33 H TYR 33 7.998 0.789 10.577 224 HA TYR 33 HA TYR 33 6.464 -1.521 9.456 225 HB2 TYR 33 HB2 TYR 33 6.299 0.321 7.863 226 HB3 TYR 33 HB3 TYR 33 8.046 0.554 7.891 227 HD1 TYR 33 HD1 TYR 33 5.525 -2.188 7.202 228 HD2 TYR 33 HD2 TYR 33 9.309 -0.415 6.158 229 HE1 TYR 33 HE1 TYR 33 5.774 -3.805 5.307 230 HE2 TYR 33 HE2 TYR 33 9.551 -2.048 4.293 231 HH TYR 33 HH TYR 33 8.591 -3.738 3.121 232 H THR 34 H THR 34 9.706 -0.156 8.721 233 HA THR 34 HA THR 34 10.914 -2.568 10.000 234 HB THR 34 HB THR 34 11.658 -1.433 7.259 235 HG1 THR 34 HG1 THR 34 9.793 -2.724 7.194 236 HG21 THR 34 HG21 THR 34 13.662 -2.255 8.339 237 HG22 THR 34 HG22 THR 34 13.125 -3.487 7.179 238 HG23 THR 34 HG23 THR 34 12.817 -3.714 8.913 239 H LYS 35 H LYS 35 12.134 -1.834 11.585 240 HA LYS 35 HA LYS 35 14.339 -0.065 11.025 241 HB2 LYS 35 HB2 LYS 35 13.612 1.417 13.128 242 HB3 LYS 35 HB3 LYS 35 13.257 1.879 11.468 243 HG2 LYS 35 HG2 LYS 35 10.951 1.125 11.657 244 HG3 LYS 35 HG3 LYS 35 11.246 0.454 13.270 245 HD2 LYS 35 HD2 LYS 35 11.618 3.405 12.612 246 HD3 LYS 35 HD3 LYS 35 10.079 2.728 13.179 247 HE2 LYS 35 HE2 LYS 35 11.211 1.876 15.218 248 HE3 LYS 35 HE3 LYS 35 12.728 2.605 14.681 249 HZ1 LYS 35 HZ1 LYS 35 11.702 4.765 14.869 250 HZ2 LYS 35 HZ2 LYS 35 11.566 3.954 16.300 251 HZ3 LYS 35 HZ3 LYS 35 10.256 4.100 15.308 252 H ASP 36 H ASP 36 12.409 -0.806 13.952 253 HA ASP 36 HA ASP 36 14.774 -2.263 15.049 254 HB2 ASP 36 HB2 ASP 36 14.035 -1.352 17.265 255 HB3 ASP 36 HB3 ASP 36 14.584 -0.125 16.117 256 H ARG 37 H ARG 37 11.419 -2.403 14.357 257 HA ARG 37 HA ARG 37 10.325 -3.829 16.425 258 HB2 ARG 37 HB2 ARG 37 9.225 -2.880 14.347 259 HB3 ARG 37 HB3 ARG 37 9.729 -4.334 13.485 260 HG2 ARG 37 HG2 ARG 37 7.451 -4.633 14.088 261 HG3 ARG 37 HG3 ARG 37 8.384 -5.685 15.169 262 HD2 ARG 37 HD2 ARG 37 8.146 -4.148 17.001 263 HD3 ARG 37 HD3 ARG 37 7.512 -2.877 15.932 264 HE ARG 37 HE ARG 37 5.768 -5.062 15.655 265 HH11 ARG 37 HH11 ARG 37 6.733 -2.890 18.280 266 HH12 ARG 37 HH12 ARG 37 5.205 -3.060 19.097 267 HH21 ARG 37 HH21 ARG 37 3.871 -5.245 16.750 268 HH22 ARG 37 HH22 ARG 37 3.610 -4.362 18.240 269 H PHE 38 H PHE 38 12.077 -5.296 13.680 270 HA PHE 38 HA PHE 38 11.400 -7.967 14.556 271 HB2 PHE 38 HB2 PHE 38 13.526 -7.133 12.567 272 HB3 PHE 38 HB3 PHE 38 12.701 -8.692 12.672 273 HD1 PHE 38 HD2 PHE 38 9.858 -7.984 12.911 274 HD2 PHE 38 HD1 PHE 38 12.946 -6.120 10.555 275 HE1 PHE 38 HE2 PHE 38 8.132 -7.100 11.354 276 HE2 PHE 38 HE1 PHE 38 11.220 -5.248 8.986 277 HZ PHE 38 HZ PHE 38 8.820 -5.713 9.388 278 H TYR 39 H TYR 39 13.747 -5.781 15.666 279 HA TYR 39 HA TYR 39 15.593 -7.972 16.475 280 HB2 TYR 39 HB2 TYR 39 15.786 -4.967 16.907 281 HB3 TYR 39 HB3 TYR 39 17.033 -6.160 17.286 282 HD1 TYR 39 HD2 TYR 39 17.583 -7.773 15.100 283 HD2 TYR 39 HD1 TYR 39 16.147 -3.721 14.967 284 HE1 TYR 39 HE2 TYR 39 18.510 -7.511 12.798 285 HE2 TYR 39 HE1 TYR 39 17.072 -3.467 12.667 286 HH TYR 39 HH TYR 39 18.833 -6.103 11.028 287 H LEU 40 H LEU 40 13.143 -5.731 17.620 288 HA LEU 40 HA LEU 40 13.719 -6.216 20.445 289 HB2 LEU 40 HB2 LEU 40 11.803 -4.635 18.796 290 HB3 LEU 40 HB3 LEU 40 11.219 -5.144 20.373 291 HG LEU 40 HG LEU 40 12.994 -3.940 21.499 292 HD11 LEU 40 HD11 LEU 40 14.507 -2.407 20.252 293 HD12 LEU 40 HD12 LEU 40 13.954 -3.132 18.726 294 HD13 LEU 40 HD13 LEU 40 14.842 -4.114 19.911 295 HD21 LEU 40 HD21 LEU 40 12.270 -1.662 20.910 296 HD22 LEU 40 HD22 LEU 40 10.893 -2.783 20.901 297 HD23 LEU 40 HD23 LEU 40 11.622 -2.251 19.363 298 H GLN 41 H GLN 41 11.164 -7.201 18.109 299 HA GLN 41 HA GLN 41 10.470 -9.377 20.023 300 HB2 GLN 41 HB2 GLN 41 8.119 -9.114 19.519 301 HB3 GLN 41 HB3 GLN 41 8.776 -7.621 20.185 302 HG2 GLN 41 HG2 GLN 41 8.756 -6.563 18.038 303 HG3 GLN 41 HG3 GLN 41 8.375 -8.091 17.227 304 HE21 GLN 41 HE21 GLN 41 6.330 -8.735 17.026 305 HE22 GLN 41 HE22 GLN 41 4.959 -7.857 17.684 306 HA PRO 42 HA PRO 42 10.574 -11.930 16.368 307 HB2 PRO 42 HB2 PRO 42 8.697 -13.842 16.863 308 HB3 PRO 42 HB3 PRO 42 10.255 -13.803 17.751 309 HG2 PRO 42 HG2 PRO 42 7.580 -12.698 18.582 310 HG3 PRO 42 HG3 PRO 42 8.674 -13.794 19.486 311 HD2 PRO 42 HD2 PRO 42 8.662 -11.135 19.930 312 HD3 PRO 42 HD3 PRO 42 10.195 -12.072 19.956 313 H LEU 43 H LEU 43 9.103 -12.557 14.532 314 HA LEU 43 HA LEU 43 6.896 -10.568 14.296 315 HB2 LEU 43 HB2 LEU 43 7.371 -10.794 11.816 316 HB3 LEU 43 HB3 LEU 43 8.522 -9.915 12.805 317 HG LEU 43 HG LEU 43 9.184 -12.781 12.405 318 HD11 LEU 43 HD11 LEU 43 9.986 -12.459 10.118 319 HD12 LEU 43 HD12 LEU 43 9.322 -10.809 10.099 320 HD13 LEU 43 HD13 LEU 43 8.228 -12.214 10.204 321 HD21 LEU 43 HD21 LEU 43 10.696 -11.106 13.527 322 HD22 LEU 43 HD22 LEU 43 10.805 -10.229 11.988 323 HD23 LEU 43 HD23 LEU 43 11.434 -11.886 12.114 324 HA PRO 44 HA PRO 44 4.570 -14.516 13.741 325 HB2 PRO 44 HB2 PRO 44 2.264 -13.655 14.942 326 HB3 PRO 44 HB3 PRO 44 3.650 -14.275 15.895 327 HG2 PRO 44 HG2 PRO 44 2.940 -11.433 15.229 328 HG3 PRO 44 HG3 PRO 44 3.262 -12.167 16.834 329 HD2 PRO 44 HD2 PRO 44 5.192 -10.859 15.515 330 HD3 PRO 44 HD3 PRO 44 5.564 -12.370 16.405 331 HA PRO 45 HA PRO 45 2.513 -12.962 10.143 332 HB2 PRO 45 HB2 PRO 45 0.068 -14.200 10.041 333 HB3 PRO 45 HB3 PRO 45 1.616 -15.034 9.691 334 HG2 PRO 45 HG2 PRO 45 0.086 -14.950 12.283 335 HG3 PRO 45 HG3 PRO 45 0.696 -16.376 11.378 336 HD2 PRO 45 HD2 PRO 45 2.096 -15.387 13.417 337 HD3 PRO 45 HD3 PRO 45 2.946 -15.878 11.909 338 H THR 46 H THR 46 0.964 -12.458 13.244 339 HA THR 46 HA THR 46 -1.047 -10.602 12.408 340 HB THR 46 HB THR 46 0.494 -10.269 14.981 341 HG1 THR 46 HG1 THR 46 -0.949 -12.065 15.709 342 HG21 THR 46 HG21 THR 46 -1.511 -8.875 14.496 343 HG22 THR 46 HG22 THR 46 -1.758 -9.944 15.895 344 HG23 THR 46 HG23 THR 46 -2.480 -10.360 14.321 345 H GLU 47 H GLU 47 2.456 -10.277 13.118 346 HA GLU 47 HA GLU 47 2.477 -7.373 12.875 347 HB2 GLU 47 HB2 GLU 47 4.645 -9.498 12.683 348 HB3 GLU 47 HB3 GLU 47 4.968 -7.770 12.550 349 HG2 GLU 47 HG2 GLU 47 3.702 -9.113 14.952 350 HG3 GLU 47 HG3 GLU 47 5.416 -8.695 14.800 351 H ALA 48 H ALA 48 2.744 -10.155 10.715 352 HA ALA 48 HA ALA 48 3.719 -8.679 8.451 353 HB1 ALA 48 HB1 ALA 48 2.050 -11.222 8.447 354 HB2 ALA 48 HB2 ALA 48 3.071 -10.607 7.132 355 HB3 ALA 48 HB3 ALA 48 3.819 -11.170 8.647 356 H ALA 49 H ALA 49 0.513 -9.075 9.911 357 HA ALA 49 HA ALA 49 -0.941 -8.107 7.606 358 HB1 ALA 49 HB1 ALA 49 -2.001 -9.368 9.505 359 HB2 ALA 49 HB2 ALA 49 -1.729 -7.956 10.553 360 HB3 ALA 49 HB3 ALA 49 -2.814 -7.825 9.154 361 H GLN 50 H GLN 50 0.524 -6.591 10.477 362 HA GLN 50 HA GLN 50 -0.398 -3.946 9.941 363 HB2 GLN 50 HB2 GLN 50 2.100 -4.903 11.359 364 HB3 GLN 50 HB3 GLN 50 1.512 -3.238 11.385 365 HG2 GLN 50 HG2 GLN 50 -0.326 -5.459 12.231 366 HG3 GLN 50 HG3 GLN 50 0.944 -4.919 13.339 367 HE21 GLN 50 HE21 GLN 50 -0.256 -3.934 14.871 368 HE22 GLN 50 HE22 GLN 50 -1.293 -2.561 14.571 369 H ARG 51 H ARG 51 2.553 -5.734 9.036 370 HA ARG 51 HA ARG 51 3.824 -3.644 7.547 371 HB2 ARG 51 HB2 ARG 51 3.909 -6.665 7.421 372 HB3 ARG 51 HB3 ARG 51 4.870 -5.669 6.329 373 HG2 ARG 51 HG2 ARG 51 6.247 -4.884 8.014 374 HG3 ARG 51 HG3 ARG 51 5.063 -5.214 9.294 375 HD2 ARG 51 HD2 ARG 51 7.035 -6.787 9.218 376 HD3 ARG 51 HD3 ARG 51 5.443 -7.552 9.199 377 HE ARG 51 HE ARG 51 6.002 -7.364 6.528 378 HH11 ARG 51 HH11 ARG 51 7.900 -8.673 9.211 379 HH12 ARG 51 HH12 ARG 51 8.655 -9.873 8.199 380 HH21 ARG 51 HH21 ARG 51 6.964 -8.894 5.328 381 HH22 ARG 51 HH22 ARG 51 8.158 -9.981 6.020 382 H ALA 52 H ALA 52 1.491 -6.166 6.567 383 HA ALA 52 HA ALA 52 1.644 -5.687 3.788 384 HB1 ALA 52 HB1 ALA 52 -0.700 -6.633 5.484 385 HB2 ALA 52 HB2 ALA 52 -0.599 -6.750 3.715 386 HB3 ALA 52 HB3 ALA 52 0.540 -7.656 4.734 387 H LYS 53 H LYS 53 -0.311 -4.055 6.316 388 HA LYS 53 HA LYS 53 -1.878 -2.515 4.462 389 HB2 LYS 53 HB2 LYS 53 -1.041 -1.974 7.324 390 HB3 LYS 53 HB3 LYS 53 -2.163 -0.950 6.415 391 HG2 LYS 53 HG2 LYS 53 -3.645 -2.918 6.066 392 HG3 LYS 53 HG3 LYS 53 -2.576 -3.885 7.083 393 HD2 LYS 53 HD2 LYS 53 -3.937 -1.351 8.033 394 HD3 LYS 53 HD3 LYS 53 -4.628 -2.975 8.217 395 HE2 LYS 53 HE2 LYS 53 -2.615 -3.688 9.470 396 HE3 LYS 53 HE3 LYS 53 -1.962 -2.044 9.343 397 HZ1 LYS 53 HZ1 LYS 53 -3.917 -1.273 10.566 398 HZ2 LYS 53 HZ2 LYS 53 -3.044 -2.368 11.444 399 HZ3 LYS 53 HZ3 LYS 53 -4.467 -2.818 10.724 400 H VAL 54 H VAL 54 1.331 -1.954 5.946 401 HA VAL 54 HA VAL 54 1.611 0.699 4.836 402 HB VAL 54 HB VAL 54 3.789 -1.289 5.655 403 HG11 VAL 54 HG11 VAL 54 5.202 0.766 5.900 404 HG12 VAL 54 HG12 VAL 54 4.707 0.480 4.225 405 HG13 VAL 54 HG13 VAL 54 3.888 1.729 5.190 406 HG21 VAL 54 HG21 VAL 54 3.848 0.006 7.785 407 HG22 VAL 54 HG22 VAL 54 2.441 0.947 7.237 408 HG23 VAL 54 HG23 VAL 54 2.290 -0.798 7.542 409 H SER 55 H SER 55 2.718 -2.566 3.766 410 HA SER 55 HA SER 55 4.008 -1.667 1.400 411 HB2 SER 55 HB2 SER 55 2.643 -4.313 2.008 412 HB3 SER 55 HB3 SER 55 3.771 -4.021 0.663 413 HG SER 55 HG SER 55 4.542 -4.861 2.905 414 H ALA 56 H ALA 56 0.575 -2.299 2.037 415 HA ALA 56 HA ALA 56 -0.200 -2.128 -0.761 416 HB1 ALA 56 HB1 ALA 56 -1.923 -1.561 1.667 417 HB2 ALA 56 HB2 ALA 56 -2.437 -2.122 0.060 418 HB3 ALA 56 HB3 ALA 56 -1.535 -3.206 1.131 419 H SER 57 H SER 57 0.150 0.141 1.951 420 HA SER 57 HA SER 57 -1.086 2.365 0.600 421 HB2 SER 57 HB2 SER 57 0.876 2.329 2.921 422 HB3 SER 57 HB3 SER 57 -0.135 3.703 2.426 423 HG SER 57 HG SER 57 -0.960 1.183 3.465 424 H GLU 58 H GLU 58 2.166 1.024 0.600 425 HA GLU 58 HA GLU 58 3.613 3.288 -0.337 426 HB2 GLU 58 HB2 GLU 58 3.880 0.298 -0.711 427 HB3 GLU 58 HB3 GLU 58 4.969 1.393 -1.544 428 HG2 GLU 58 HG2 GLU 58 4.592 1.288 1.464 429 HG3 GLU 58 HG3 GLU 58 5.904 0.507 0.570 430 H ILE 59 H ILE 59 1.521 0.983 -2.009 431 HA ILE 59 HA ILE 59 2.286 1.643 -4.679 432 HB ILE 59 HB ILE 59 -0.419 0.635 -3.681 433 HG12 ILE 59 HG12 ILE 59 1.930 -1.050 -4.614 434 HG13 ILE 59 HG13 ILE 59 1.604 -0.718 -2.914 435 HG21 ILE 59 HG21 ILE 59 -0.458 1.376 -6.066 436 HG22 ILE 59 HG22 ILE 59 0.935 0.328 -6.416 437 HG23 ILE 59 HG23 ILE 59 -0.630 -0.379 -5.955 438 HD11 ILE 59 HD11 ILE 59 -0.141 -2.296 -4.826 439 HD12 ILE 59 HD12 ILE 59 0.681 -2.863 -3.357 440 HD13 ILE 59 HD13 ILE 59 -0.695 -1.748 -3.223 441 H LEU 60 H LEU 60 0.165 3.260 -2.353 442 HA LEU 60 HA LEU 60 -1.390 4.758 -4.238 443 HB2 LEU 60 HB2 LEU 60 -0.534 5.507 -1.426 444 HB3 LEU 60 HB3 LEU 60 -1.818 6.281 -2.336 445 HG LEU 60 HG LEU 60 -1.913 3.351 -1.538 446 HD11 LEU 60 HD11 LEU 60 -1.725 4.789 0.468 447 HD12 LEU 60 HD12 LEU 60 -3.334 4.052 0.334 448 HD13 LEU 60 HD13 LEU 60 -3.101 5.762 -0.104 449 HD21 LEU 60 HD21 LEU 60 -4.314 3.620 -1.892 450 HD22 LEU 60 HD22 LEU 60 -3.404 3.993 -3.369 451 HD23 LEU 60 HD23 LEU 60 -4.063 5.315 -2.375 452 H ASN 61 H ASN 61 1.899 5.181 -3.036 453 HA ASN 61 HA ASN 61 2.088 7.995 -3.684 454 HB2 ASN 61 HB2 ASN 61 3.550 6.732 -2.071 455 HB3 ASN 61 HB3 ASN 61 4.317 5.945 -3.458 456 HD21 ASN 61 HD21 ASN 61 6.261 6.792 -3.722 457 HD22 ASN 61 HD22 ASN 61 6.630 8.500 -3.704 458 H VAL 62 H VAL 62 2.083 5.181 -5.671 459 HA VAL 62 HA VAL 62 4.029 5.933 -7.592 460 HB VAL 62 HB VAL 62 2.729 3.691 -7.152 461 HG11 VAL 62 HG11 VAL 62 0.498 4.778 -7.829 462 HG12 VAL 62 HG12 VAL 62 1.082 4.692 -9.512 463 HG13 VAL 62 HG13 VAL 62 0.871 3.215 -8.548 464 HG21 VAL 62 HG21 VAL 62 3.625 4.607 -9.896 465 HG22 VAL 62 HG22 VAL 62 4.615 3.849 -8.631 466 HG23 VAL 62 HG23 VAL 62 3.337 2.919 -9.432 467 H LYS 63 H LYS 63 0.971 7.381 -7.030 468 HA LYS 63 HA LYS 63 0.155 8.086 -9.651 469 HB2 LYS 63 HB2 LYS 63 -1.056 8.444 -7.428 470 HB3 LYS 63 HB3 LYS 63 -0.083 9.899 -7.223 471 HG2 LYS 63 HG2 LYS 63 -1.495 9.647 -9.834 472 HG3 LYS 63 HG3 LYS 63 -2.548 9.820 -8.423 473 HD2 LYS 63 HD2 LYS 63 -1.612 11.939 -7.847 474 HD3 LYS 63 HD3 LYS 63 -0.215 11.700 -8.908 475 HE2 LYS 63 HE2 LYS 63 -1.695 13.268 -9.990 476 HE3 LYS 63 HE3 LYS 63 -1.727 11.745 -10.892 477 HZ1 LYS 63 HZ1 LYS 63 -3.803 11.228 -9.628 478 HZ2 LYS 63 HZ2 LYS 63 -3.937 12.482 -10.691 479 HZ3 LYS 63 HZ3 LYS 63 -3.806 12.778 -9.065 480 H GLN 64 H GLN 64 2.806 9.307 -7.692 481 HA GLN 64 HA GLN 64 3.218 11.810 -8.964 482 HB2 GLN 64 HB2 GLN 64 5.239 9.812 -7.876 483 HB3 GLN 64 HB3 GLN 64 5.610 11.478 -8.338 484 HG2 GLN 64 HG2 GLN 64 4.003 12.280 -6.610 485 HG3 GLN 64 HG3 GLN 64 3.756 10.604 -6.097 486 HE21 GLN 64 HE21 GLN 64 4.535 11.863 -4.066 487 HE22 GLN 64 HE22 GLN 64 6.254 11.806 -3.770 488 H PHE 65 H PHE 65 4.116 8.506 -10.043 489 HA PHE 65 HA PHE 65 5.863 9.500 -12.126 490 HB2 PHE 65 HB2 PHE 65 4.533 6.825 -11.683 491 HB3 PHE 65 HB3 PHE 65 5.659 7.162 -13.001 492 HD1 PHE 65 HD1 PHE 65 8.034 7.642 -12.553 493 HD2 PHE 65 HD2 PHE 65 5.325 6.544 -9.401 494 HE1 PHE 65 HE1 PHE 65 9.972 7.147 -11.069 495 HE2 PHE 65 HE2 PHE 65 7.248 6.066 -7.903 496 HZ PHE 65 HZ PHE 65 9.579 6.358 -8.734 497 H ILE 66 H ILE 66 2.388 9.033 -11.921 498 HA ILE 66 HA ILE 66 1.941 8.939 -14.790 499 HB ILE 66 HB ILE 66 0.023 9.927 -12.598 500 HG12 ILE 66 HG12 ILE 66 0.180 7.160 -13.842 501 HG13 ILE 66 HG13 ILE 66 0.861 7.560 -12.266 502 HG21 ILE 66 HG21 ILE 66 -0.641 10.635 -14.885 503 HG22 ILE 66 HG22 ILE 66 -0.497 8.959 -15.463 504 HG23 ILE 66 HG23 ILE 66 -1.753 9.397 -14.289 505 HD11 ILE 66 HD11 ILE 66 -2.081 7.552 -13.047 506 HD12 ILE 66 HD12 ILE 66 -1.257 6.489 -11.889 507 HD13 ILE 66 HD13 ILE 66 -1.473 8.212 -11.511 508 H ASP 67 H ASP 67 1.910 11.462 -12.260 509 HA ASP 67 HA ASP 67 1.332 13.685 -13.963 510 HB2 ASP 67 HB2 ASP 67 1.154 13.743 -11.505 511 HB3 ASP 67 HB3 ASP 67 2.903 13.514 -11.364 512 H ARG 68 H ARG 68 4.388 12.222 -12.884 513 HA ARG 68 HA ARG 68 6.060 14.123 -14.294 514 HB2 ARG 68 HB2 ARG 68 6.584 11.393 -13.089 515 HB3 ARG 68 HB3 ARG 68 7.848 12.388 -13.821 516 HG2 ARG 68 HG2 ARG 68 7.562 14.127 -12.183 517 HG3 ARG 68 HG3 ARG 68 6.097 13.367 -11.541 518 HD2 ARG 68 HD2 ARG 68 7.910 12.891 -10.036 519 HD3 ARG 68 HD3 ARG 68 7.452 11.389 -10.863 520 HE ARG 68 HE ARG 68 9.535 12.657 -12.331 521 HH11 ARG 68 HH11 ARG 68 9.105 10.964 -9.261 522 HH12 ARG 68 HH12 ARG 68 10.761 10.424 -9.221 523 HH21 ARG 68 HH21 ARG 68 11.635 11.938 -12.209 524 HH22 ARG 68 HH22 ARG 68 12.169 10.974 -10.859 525 H LYS 69 H LYS 69 3.995 11.947 -15.608 526 HA LYS 69 HA LYS 69 3.760 11.069 -17.713 527 HB2 LYS 69 HB2 LYS 69 4.814 13.558 -17.915 528 HB3 LYS 69 HB3 LYS 69 6.054 12.662 -18.787 529 HG2 LYS 69 HG2 LYS 69 4.422 11.895 -20.400 530 HG3 LYS 69 HG3 LYS 69 3.096 12.592 -19.432 531 HD2 LYS 69 HD2 LYS 69 4.156 14.836 -19.671 532 HD3 LYS 69 HD3 LYS 69 5.374 14.122 -20.745 533 HE2 LYS 69 HE2 LYS 69 3.616 13.482 -22.335 534 HE3 LYS 69 HE3 LYS 69 2.371 14.117 -21.230 535 HZ1 LYS 69 HZ1 LYS 69 3.380 16.309 -21.448 536 HZ2 LYS 69 HZ2 LYS 69 2.947 15.741 -22.934 537 HZ3 LYS 69 HZ3 LYS 69 4.534 15.728 -22.473 538 H ALA 70 H ALA 70 5.654 9.797 -15.857 539 HA ALA 70 HA ALA 70 7.894 8.934 -17.563 540 HB1 ALA 70 HB1 ALA 70 8.821 8.043 -15.490 541 HB2 ALA 70 HB2 ALA 70 8.267 9.711 -15.236 542 HB3 ALA 70 HB3 ALA 70 7.287 8.351 -14.637 543 H TRP 71 H TRP 71 6.121 7.787 -18.930 544 HA TRP 71 HA TRP 71 4.711 5.532 -18.235 545 HB2 TRP 71 HB2 TRP 71 6.333 5.536 -20.752 546 HB3 TRP 71 HB3 TRP 71 4.703 4.944 -20.465 547 HD1 TRP 71 HD1 TRP 71 6.321 7.670 -22.151 548 HE1 TRP 71 HE1 TRP 71 4.882 9.734 -22.457 549 HE3 TRP 71 HE3 TRP 71 2.704 6.532 -18.710 550 HZ2 TRP 71 HZ2 TRP 71 2.433 10.755 -21.401 551 HZ3 TRP 71 HZ3 TRP 71 0.808 8.134 -18.392 552 HH2 TRP 71 HH2 TRP 71 0.693 10.229 -19.737 553 HA PRO 72 HA PRO 72 8.039 2.389 -18.627 554 HB2 PRO 72 HB2 PRO 72 10.712 2.868 -18.591 555 HB3 PRO 72 HB3 PRO 72 9.746 2.970 -20.100 556 HG2 PRO 72 HG2 PRO 72 10.588 5.189 -18.246 557 HG3 PRO 72 HG3 PRO 72 10.786 5.070 -20.024 558 HD2 PRO 72 HD2 PRO 72 8.728 6.428 -18.900 559 HD3 PRO 72 HD3 PRO 72 8.522 5.497 -20.422 560 H SER 73 H SER 73 8.843 5.133 -16.510 561 HA SER 73 HA SER 73 10.086 3.444 -14.483 562 HB2 SER 73 HB2 SER 73 8.963 6.247 -14.188 563 HB3 SER 73 HB3 SER 73 10.193 5.465 -13.173 564 HG SER 73 HG SER 73 11.586 5.477 -14.962 565 H LEU 74 H LEU 74 6.904 4.804 -15.179 566 HA LEU 74 HA LEU 74 5.683 4.360 -12.661 567 HB2 LEU 74 HB2 LEU 74 4.696 5.731 -14.410 568 HB3 LEU 74 HB3 LEU 74 4.621 4.370 -15.502 569 HG LEU 74 HG LEU 74 2.724 3.439 -14.463 570 HD11 LEU 74 HD11 LEU 74 1.672 4.320 -12.425 571 HD12 LEU 74 HD12 LEU 74 3.024 5.438 -12.183 572 HD13 LEU 74 HD13 LEU 74 3.284 3.684 -12.073 573 HD21 LEU 74 HD21 LEU 74 2.494 5.545 -15.835 574 HD22 LEU 74 HD22 LEU 74 2.433 6.472 -14.326 575 HD23 LEU 74 HD23 LEU 74 1.166 5.278 -14.693 576 H GLN 75 H GLN 75 5.734 2.243 -15.583 577 HA GLN 75 HA GLN 75 4.222 0.222 -14.244 578 HB2 GLN 75 HB2 GLN 75 4.768 -1.197 -16.107 579 HB3 GLN 75 HB3 GLN 75 4.325 0.412 -16.663 580 HG2 GLN 75 HG2 GLN 75 6.096 -0.156 -18.050 581 HG3 GLN 75 HG3 GLN 75 6.867 0.857 -16.831 582 HE21 GLN 75 HE21 GLN 75 8.895 0.073 -16.712 583 HE22 GLN 75 HE22 GLN 75 9.294 -1.611 -16.423 584 H ASN 76 H ASN 76 7.577 1.041 -14.059 585 HA ASN 76 HA ASN 76 8.439 -1.613 -13.172 586 HB2 ASN 76 HB2 ASN 76 10.013 -0.045 -14.263 587 HB3 ASN 76 HB3 ASN 76 9.772 1.117 -12.955 588 HD21 ASN 76 HD21 ASN 76 11.470 1.178 -11.674 589 HD22 ASN 76 HD22 ASN 76 12.381 -0.212 -11.138 590 H ASP 77 H ASP 77 8.061 1.609 -11.592 591 HA ASP 77 HA ASP 77 8.569 0.615 -8.965 592 HB2 ASP 77 HB2 ASP 77 8.662 3.014 -9.721 593 HB3 ASP 77 HB3 ASP 77 6.891 3.020 -9.753 594 H LEU 78 H LEU 78 5.599 0.991 -10.850 595 HA LEU 78 HA LEU 78 3.726 0.554 -8.773 596 HB2 LEU 78 HB2 LEU 78 3.244 1.326 -11.089 597 HB3 LEU 78 HB3 LEU 78 3.649 -0.274 -11.693 598 HG LEU 78 HG LEU 78 1.718 -1.152 -10.330 599 HD11 LEU 78 HD11 LEU 78 1.442 0.748 -8.804 600 HD12 LEU 78 HD12 LEU 78 -0.036 0.462 -9.741 601 HD13 LEU 78 HD13 LEU 78 1.047 1.796 -10.188 602 HD21 LEU 78 HD21 LEU 78 1.214 0.874 -12.534 603 HD22 LEU 78 HD22 LEU 78 0.099 -0.420 -12.037 604 HD23 LEU 78 HD23 LEU 78 1.664 -0.835 -12.753 605 H ARG 79 H ARG 79 5.371 -1.793 -10.954 606 HA ARG 79 HA ARG 79 3.998 -4.036 -9.715 607 HB2 ARG 79 HB2 ARG 79 6.362 -3.829 -11.605 608 HB3 ARG 79 HB3 ARG 79 5.796 -5.371 -10.944 609 HG2 ARG 79 HG2 ARG 79 3.520 -4.885 -11.878 610 HG3 ARG 79 HG3 ARG 79 4.202 -3.467 -12.694 611 HD2 ARG 79 HD2 ARG 79 5.745 -4.900 -13.952 612 HD3 ARG 79 HD3 ARG 79 5.201 -6.321 -13.042 613 HE ARG 79 HE ARG 79 3.164 -6.344 -14.235 614 HH11 ARG 79 HH11 ARG 79 5.174 -3.641 -15.345 615 HH12 ARG 79 HH12 ARG 79 4.176 -3.381 -16.755 616 HH21 ARG 79 HH21 ARG 79 1.962 -5.965 -16.036 617 HH22 ARG 79 HH22 ARG 79 2.398 -4.669 -17.137 618 H LEU 80 H LEU 80 7.128 -2.407 -9.204 619 HA LEU 80 HA LEU 80 8.210 -4.437 -7.499 620 HB2 LEU 80 HB2 LEU 80 8.658 -1.450 -7.700 621 HB3 LEU 80 HB3 LEU 80 9.505 -2.433 -6.512 622 HG LEU 80 HG LEU 80 9.664 -2.915 -9.505 623 HD11 LEU 80 HD11 LEU 80 11.578 -1.436 -7.657 624 HD12 LEU 80 HD12 LEU 80 10.557 -0.700 -8.917 625 HD13 LEU 80 HD13 LEU 80 11.860 -1.816 -9.373 626 HD21 LEU 80 HD21 LEU 80 11.693 -4.213 -8.890 627 HD22 LEU 80 HD22 LEU 80 10.222 -4.903 -8.183 628 HD23 LEU 80 HD23 LEU 80 11.330 -3.948 -7.170 629 H ARG 81 H ARG 81 6.402 -1.414 -6.673 630 HA ARG 81 HA ARG 81 6.434 -1.988 -3.850 631 HB2 ARG 81 HB2 ARG 81 4.638 -0.225 -5.552 632 HB3 ARG 81 HB3 ARG 81 4.539 -0.309 -3.785 633 HG2 ARG 81 HG2 ARG 81 6.899 0.421 -3.608 634 HG3 ARG 81 HG3 ARG 81 7.005 0.534 -5.374 635 HD2 ARG 81 HD2 ARG 81 5.947 2.533 -5.419 636 HD3 ARG 81 HD3 ARG 81 4.720 2.001 -4.267 637 HE ARG 81 HE ARG 81 6.033 2.754 -2.454 638 HH11 ARG 81 HH11 ARG 81 7.758 3.365 -5.509 639 HH12 ARG 81 HH12 ARG 81 8.879 4.442 -4.714 640 HH21 ARG 81 HH21 ARG 81 7.480 4.082 -1.569 641 HH22 ARG 81 HH22 ARG 81 8.731 4.849 -2.537 642 H ALA 82 H ALA 82 4.107 -2.806 -6.439 643 HA ALA 82 HA ALA 82 2.151 -3.903 -4.662 644 HB1 ALA 82 HB1 ALA 82 2.728 -4.693 -7.543 645 HB2 ALA 82 HB2 ALA 82 1.209 -4.935 -6.643 646 HB3 ALA 82 HB3 ALA 82 1.747 -3.293 -7.046 647 H SER 83 H SER 83 5.152 -5.248 -6.016 648 HA SER 83 HA SER 83 4.534 -7.985 -5.429 649 HB2 SER 83 HB2 SER 83 7.223 -6.584 -5.623 650 HB3 SER 83 HB3 SER 83 6.985 -8.342 -5.554 651 HG SER 83 HG SER 83 6.086 -6.534 -7.565 652 H TYR 84 H TYR 84 5.898 -5.357 -3.423 653 HA TYR 84 HA TYR 84 6.758 -7.030 -1.258 654 HB2 TYR 84 HB2 TYR 84 5.976 -4.144 -1.545 655 HB3 TYR 84 HB3 TYR 84 6.087 -4.832 0.076 656 HD1 TYR 84 HD2 TYR 84 8.086 -4.358 -3.073 657 HD2 TYR 84 HD1 TYR 84 8.163 -5.059 1.170 658 HE1 TYR 84 HE2 TYR 84 10.560 -4.048 -3.067 659 HE2 TYR 84 HE1 TYR 84 10.640 -4.729 1.169 660 HH TYR 84 HH TYR 84 12.497 -4.252 -0.079 661 H LEU 85 H LEU 85 3.617 -5.474 -1.991 662 HA LEU 85 HA LEU 85 2.292 -6.347 0.374 663 HB2 LEU 85 HB2 LEU 85 1.355 -4.655 -1.146 664 HB3 LEU 85 HB3 LEU 85 1.213 -5.862 -2.419 665 HG LEU 85 HG LEU 85 -0.465 -7.097 -1.107 666 HD11 LEU 85 HD11 LEU 85 0.138 -6.584 1.158 667 HD12 LEU 85 HD12 LEU 85 -1.482 -5.919 0.884 668 HD13 LEU 85 HD13 LEU 85 -0.067 -4.844 0.884 669 HD21 LEU 85 HD21 LEU 85 -1.160 -5.396 -2.722 670 HD22 LEU 85 HD22 LEU 85 -1.073 -4.143 -1.466 671 HD23 LEU 85 HD23 LEU 85 -2.273 -5.447 -1.340 672 H ARG 86 H ARG 86 2.769 -7.871 -2.785 673 HA ARG 86 HA ARG 86 1.120 -10.147 -2.344 674 HB2 ARG 86 HB2 ARG 86 2.731 -9.162 -4.364 675 HB3 ARG 86 HB3 ARG 86 3.580 -10.632 -3.908 676 HG2 ARG 86 HG2 ARG 86 0.598 -10.612 -4.486 677 HG3 ARG 86 HG3 ARG 86 1.792 -10.733 -5.785 678 HD2 ARG 86 HD2 ARG 86 1.540 -12.655 -3.455 679 HD3 ARG 86 HD3 ARG 86 0.921 -12.935 -5.094 680 HE ARG 86 HE ARG 86 3.724 -13.026 -4.186 681 HH11 ARG 86 HH11 ARG 86 1.615 -12.895 -7.027 682 HH12 ARG 86 HH12 ARG 86 2.865 -13.483 -8.089 683 HH21 ARG 86 HH21 ARG 86 5.260 -13.763 -5.614 684 HH22 ARG 86 HH22 ARG 86 4.884 -13.962 -7.303 685 H TYR 87 H TYR 87 4.466 -9.482 -1.328 686 HA TYR 87 HA TYR 87 4.885 -12.249 -0.484 687 HB2 TYR 87 HB2 TYR 87 6.466 -9.744 0.189 688 HB3 TYR 87 HB3 TYR 87 6.982 -11.411 0.465 689 HD1 TYR 87 HD2 TYR 87 6.220 -12.744 -2.107 690 HD2 TYR 87 HD1 TYR 87 7.983 -8.878 -1.404 691 HE1 TYR 87 HE2 TYR 87 7.207 -12.765 -4.400 692 HE2 TYR 87 HE1 TYR 87 8.963 -8.917 -3.696 693 HH TYR 87 HH TYR 87 9.181 -10.089 -5.658 694 H ASP 88 H ASP 88 4.133 -9.128 1.169 695 HA ASP 88 HA ASP 88 4.262 -10.234 3.809 696 HB2 ASP 88 HB2 ASP 88 2.842 -7.852 2.599 697 HB3 ASP 88 HB3 ASP 88 2.541 -8.331 4.276 698 H LEU 89 H LEU 89 1.480 -9.803 1.564 699 HA LEU 89 HA LEU 89 -0.467 -10.806 3.382 700 HB2 LEU 89 HB2 LEU 89 -0.380 -9.906 0.702 701 HB3 LEU 89 HB3 LEU 89 -1.086 -11.504 0.641 702 HG LEU 89 HG LEU 89 -2.762 -9.745 0.715 703 HD11 LEU 89 HD11 LEU 89 -2.787 -11.316 3.314 704 HD12 LEU 89 HD12 LEU 89 -3.264 -11.958 1.724 705 HD13 LEU 89 HD13 LEU 89 -4.182 -10.632 2.453 706 HD21 LEU 89 HD21 LEU 89 -1.764 -9.069 3.480 707 HD22 LEU 89 HD22 LEU 89 -3.124 -8.334 2.603 708 HD23 LEU 89 HD23 LEU 89 -1.468 -8.111 2.015 709 H LYS 90 H LYS 90 1.847 -12.489 1.369 710 HA LYS 90 HA LYS 90 0.507 -15.020 1.285 711 HB2 LYS 90 HB2 LYS 90 2.524 -14.334 -0.087 712 HB3 LYS 90 HB3 LYS 90 3.499 -14.451 1.372 713 HG2 LYS 90 HG2 LYS 90 3.891 -16.452 0.168 714 HG3 LYS 90 HG3 LYS 90 2.867 -16.888 1.536 715 HD2 LYS 90 HD2 LYS 90 2.014 -18.069 -0.334 716 HD3 LYS 90 HD3 LYS 90 0.872 -16.743 -0.053 717 HE2 LYS 90 HE2 LYS 90 1.937 -15.435 -1.861 718 HE3 LYS 90 HE3 LYS 90 3.137 -16.725 -2.097 719 HZ1 LYS 90 HZ1 LYS 90 1.327 -18.212 -2.703 720 HZ2 LYS 90 HZ2 LYS 90 1.340 -16.894 -3.697 721 HZ3 LYS 90 HZ3 LYS 90 0.215 -17.011 -2.496 722 H THR 91 H THR 91 2.452 -13.356 3.709 723 HA THR 91 HA THR 91 2.723 -15.721 5.409 724 HB THR 91 HB THR 91 3.173 -12.789 6.132 725 HG1 THR 91 HG1 THR 91 4.517 -13.100 4.452 726 HG21 THR 91 HG21 THR 91 3.186 -14.332 8.053 727 HG22 THR 91 HG22 THR 91 4.827 -13.751 7.705 728 HG23 THR 91 HG23 THR 91 4.346 -15.386 7.208 729 H VAL 92 H VAL 92 0.720 -12.743 5.327 730 HA VAL 92 HA VAL 92 -0.475 -13.010 7.862 731 HB VAL 92 HB VAL 92 -1.797 -11.924 5.320 732 HG11 VAL 92 HG11 VAL 92 -3.067 -10.493 6.973 733 HG12 VAL 92 HG12 VAL 92 -3.464 -12.212 7.077 734 HG13 VAL 92 HG13 VAL 92 -2.384 -11.471 8.283 735 HG21 VAL 92 HG21 VAL 92 0.322 -10.816 5.695 736 HG22 VAL 92 HG22 VAL 92 -0.991 -9.726 6.128 737 HG23 VAL 92 HG23 VAL 92 -0.075 -10.565 7.399 738 H ILE 93 H ILE 93 -1.554 -14.412 4.733 739 HA ILE 93 HA ILE 93 -4.066 -15.319 5.717 740 HB ILE 93 HB ILE 93 -4.022 -16.896 3.814 741 HG12 ILE 93 HG12 ILE 93 -1.290 -15.760 3.202 742 HG13 ILE 93 HG13 ILE 93 -1.569 -17.362 3.878 743 HG21 ILE 93 HG21 ILE 93 -3.149 -14.075 3.065 744 HG22 ILE 93 HG22 ILE 93 -4.156 -15.168 2.091 745 HG23 ILE 93 HG23 ILE 93 -4.777 -14.522 3.614 746 HD11 ILE 93 HD11 ILE 93 -2.398 -16.370 1.125 747 HD12 ILE 93 HD12 ILE 93 -1.182 -17.604 1.519 748 HD13 ILE 93 HD13 ILE 93 -2.903 -17.934 1.815 749 H SER 94 H SER 94 -0.947 -16.545 6.439 750 HA SER 94 HA SER 94 -1.823 -19.287 6.864 751 HB2 SER 94 HB2 SER 94 0.635 -17.803 7.805 752 HB3 SER 94 HB3 SER 94 0.399 -19.565 7.824 753 HG SER 94 HG SER 94 0.877 -17.828 5.682 754 H ALA 95 H ALA 95 -2.121 -16.328 8.626 755 HA ALA 95 HA ALA 95 -2.177 -17.483 11.296 756 HB1 ALA 95 HB1 ALA 95 -1.854 -15.033 10.831 757 HB2 ALA 95 HB2 ALA 95 -3.519 -14.948 10.229 758 HB3 ALA 95 HB3 ALA 95 -3.208 -15.346 11.936 759 H LYS 96 H LYS 96 -4.397 -17.118 8.620 760 HA LYS 96 HA LYS 96 -6.528 -18.537 10.175 761 HB2 LYS 96 HB2 LYS 96 -6.868 -16.222 8.227 762 HB3 LYS 96 HB3 LYS 96 -8.180 -17.155 8.949 763 HG2 LYS 96 HG2 LYS 96 -6.225 -15.466 10.546 764 HG3 LYS 96 HG3 LYS 96 -7.811 -14.927 9.973 765 HD2 LYS 96 HD2 LYS 96 -8.730 -17.028 11.171 766 HD3 LYS 96 HD3 LYS 96 -7.186 -17.035 12.042 767 HE2 LYS 96 HE2 LYS 96 -7.647 -14.981 13.087 768 HE3 LYS 96 HE3 LYS 96 -8.794 -14.491 11.815 769 HZ1 LYS 96 HZ1 LYS 96 -9.285 -16.651 13.771 770 HZ2 LYS 96 HZ2 LYS 96 -10.321 -16.154 12.581 771 HZ3 LYS 96 HZ3 LYS 96 -9.946 -15.139 13.825 772 HA PRO 97 HA PRO 97 -5.313 -20.316 6.081 773 HB2 PRO 97 HB2 PRO 97 -4.626 -22.849 6.760 774 HB3 PRO 97 HB3 PRO 97 -3.568 -21.457 7.133 775 HG2 PRO 97 HG2 PRO 97 -5.587 -22.807 8.907 776 HG3 PRO 97 HG3 PRO 97 -3.850 -22.489 9.220 777 HD2 PRO 97 HD2 PRO 97 -5.802 -20.826 10.115 778 HD3 PRO 97 HD3 PRO 97 -4.211 -20.207 9.561 779 H LYS 98 H LYS 98 -8.090 -20.104 7.093 780 HA LYS 98 HA LYS 98 -9.207 -22.598 5.875 781 HB2 LYS 98 HB2 LYS 98 -10.417 -20.942 8.116 782 HB3 LYS 98 HB3 LYS 98 -11.174 -22.349 7.352 783 HG2 LYS 98 HG2 LYS 98 -8.568 -22.410 8.940 784 HG3 LYS 98 HG3 LYS 98 -10.158 -22.884 9.554 785 HD2 LYS 98 HD2 LYS 98 -10.289 -24.671 7.820 786 HD3 LYS 98 HD3 LYS 98 -8.666 -24.226 7.257 787 HE2 LYS 98 HE2 LYS 98 -7.755 -24.721 9.513 788 HE3 LYS 98 HE3 LYS 98 -9.375 -25.218 10.044 789 HZ1 LYS 98 HZ1 LYS 98 -7.816 -26.503 7.868 790 HZ2 LYS 98 HZ2 LYS 98 -9.319 -26.967 8.365 791 HZ3 LYS 98 HZ3 LYS 98 -8.030 -27.119 9.384 792 H ASP 99 H ASP 99 -11.845 -20.719 6.440 793 HA ASP 99 HA ASP 99 -12.145 -20.141 3.653 794 HB2 ASP 99 HB2 ASP 99 -14.025 -20.481 5.246 795 HB3 ASP 99 HB3 ASP 99 -13.626 -18.933 6.010 796 H GLU 100 H GLU 100 -11.260 -18.126 6.441 797 HA GLU 100 HA GLU 100 -11.234 -15.601 5.188 798 HB2 GLU 100 HB2 GLU 100 -9.494 -16.769 7.367 799 HB3 GLU 100 HB3 GLU 100 -9.555 -15.047 6.984 800 HG2 GLU 100 HG2 GLU 100 -11.738 -14.816 7.822 801 HG3 GLU 100 HG3 GLU 100 -12.083 -16.548 7.691 802 H LYS 101 H LYS 101 -8.912 -18.266 5.064 803 HA LYS 101 HA LYS 101 -6.658 -16.898 3.988 804 HB2 LYS 101 HB2 LYS 101 -6.949 -19.332 4.775 805 HB3 LYS 101 HB3 LYS 101 -7.555 -19.628 3.165 806 HG2 LYS 101 HG2 LYS 101 -5.309 -18.536 2.390 807 HG3 LYS 101 HG3 LYS 101 -4.795 -18.853 4.059 808 HD2 LYS 101 HD2 LYS 101 -4.123 -20.758 2.850 809 HD3 LYS 101 HD3 LYS 101 -5.626 -21.244 3.677 810 HE2 LYS 101 HE2 LYS 101 -6.859 -20.513 1.581 811 HE3 LYS 101 HE3 LYS 101 -5.284 -20.360 0.799 812 HZ1 LYS 101 HZ1 LYS 101 -6.267 -22.523 0.370 813 HZ2 LYS 101 HZ2 LYS 101 -6.380 -22.850 1.982 814 HZ3 LYS 101 HZ3 LYS 101 -4.898 -22.718 1.271 815 H LYS 102 H LYS 102 -9.527 -18.336 2.417 816 HA LYS 102 HA LYS 102 -8.575 -17.649 -0.249 817 HB2 LYS 102 HB2 LYS 102 -11.026 -18.836 0.970 818 HB3 LYS 102 HB3 LYS 102 -11.274 -17.964 -0.533 819 HG2 LYS 102 HG2 LYS 102 -9.379 -20.315 -0.125 820 HG3 LYS 102 HG3 LYS 102 -10.956 -20.372 -0.917 821 HD2 LYS 102 HD2 LYS 102 -8.437 -18.971 -1.917 822 HD3 LYS 102 HD3 LYS 102 -9.241 -20.371 -2.630 823 HE2 LYS 102 HE2 LYS 102 -10.316 -17.522 -2.511 824 HE3 LYS 102 HE3 LYS 102 -9.687 -18.341 -3.938 825 HZ1 LYS 102 HZ1 LYS 102 -11.570 -19.812 -3.901 826 HZ2 LYS 102 HZ2 LYS 102 -12.117 -18.251 -3.842 827 HZ3 LYS 102 HZ3 LYS 102 -12.123 -19.181 -2.479 828 H SER 103 H SER 103 -10.865 -16.238 2.092 829 HA SER 103 HA SER 103 -11.934 -14.240 0.410 830 HB2 SER 103 HB2 SER 103 -12.731 -14.873 2.702 831 HB3 SER 103 HB3 SER 103 -11.341 -14.010 3.389 832 HG SER 103 HG SER 103 -13.614 -12.979 2.916 833 H LEU 104 H LEU 104 -9.051 -14.076 2.573 834 HA LEU 104 HA LEU 104 -8.331 -11.405 1.804 835 HB2 LEU 104 HB2 LEU 104 -6.918 -13.762 3.031 836 HB3 LEU 104 HB3 LEU 104 -5.968 -12.374 2.513 837 HG LEU 104 HG LEU 104 -8.302 -12.064 4.412 838 HD11 LEU 104 HD11 LEU 104 -6.675 -12.160 6.262 839 HD12 LEU 104 HD12 LEU 104 -5.386 -12.605 5.117 840 HD13 LEU 104 HD13 LEU 104 -6.759 -13.708 5.396 841 HD21 LEU 104 HD21 LEU 104 -7.147 -10.012 5.049 842 HD22 LEU 104 HD22 LEU 104 -7.355 -10.027 3.285 843 HD23 LEU 104 HD23 LEU 104 -5.774 -10.409 3.998 844 H GLN 105 H GLN 105 -7.388 -14.625 0.527 845 HA GLN 105 HA GLN 105 -5.348 -13.670 -1.203 846 HB2 GLN 105 HB2 GLN 105 -7.074 -16.133 -1.159 847 HB3 GLN 105 HB3 GLN 105 -6.044 -15.807 -2.555 848 HG2 GLN 105 HG2 GLN 105 -4.074 -15.693 -1.100 849 HG3 GLN 105 HG3 GLN 105 -5.082 -16.060 0.301 850 HE21 GLN 105 HE21 GLN 105 -3.076 -17.343 -1.985 851 HE22 GLN 105 HE22 GLN 105 -3.586 -19.012 -1.909 852 H GLU 106 H GLU 106 -8.893 -13.916 -1.789 853 HA GLU 106 HA GLU 106 -8.535 -13.451 -4.616 854 HB2 GLU 106 HB2 GLU 106 -10.943 -13.171 -2.811 855 HB3 GLU 106 HB3 GLU 106 -10.971 -12.825 -4.551 856 HG2 GLU 106 HG2 GLU 106 -10.043 -15.139 -4.941 857 HG3 GLU 106 HG3 GLU 106 -10.302 -15.467 -3.226 858 H LEU 107 H LEU 107 -9.150 -11.209 -1.859 859 HA LEU 107 HA LEU 107 -9.330 -8.884 -3.572 860 HB2 LEU 107 HB2 LEU 107 -8.489 -9.211 -0.673 861 HB3 LEU 107 HB3 LEU 107 -8.566 -7.656 -1.488 862 HG LEU 107 HG LEU 107 -10.914 -9.480 -0.946 863 HD11 LEU 107 HD11 LEU 107 -10.000 -8.399 1.028 864 HD12 LEU 107 HD12 LEU 107 -11.555 -7.660 0.589 865 HD13 LEU 107 HD13 LEU 107 -10.039 -6.822 0.213 866 HD21 LEU 107 HD21 LEU 107 -10.778 -6.737 -2.281 867 HD22 LEU 107 HD22 LEU 107 -12.275 -7.494 -1.695 868 HD23 LEU 107 HD23 LEU 107 -11.361 -8.254 -3.009 869 H THR 108 H THR 108 -6.664 -10.572 -1.951 870 HA THR 108 HA THR 108 -4.579 -8.745 -2.554 871 HB THR 108 HB THR 108 -4.380 -11.809 -2.511 872 HG1 THR 108 HG1 THR 108 -5.359 -11.000 -0.606 873 HG21 THR 108 HG21 THR 108 -2.308 -10.738 -3.305 874 HG22 THR 108 HG22 THR 108 -2.082 -11.401 -1.667 875 HG23 THR 108 HG23 THR 108 -2.320 -9.651 -1.894 876 H SER 109 H SER 109 -5.911 -11.496 -4.438 877 HA SER 109 HA SER 109 -4.010 -11.151 -6.587 878 HB2 SER 109 HB2 SER 109 -6.709 -12.561 -6.595 879 HB3 SER 109 HB3 SER 109 -5.382 -12.802 -7.753 880 HG SER 109 HG SER 109 -5.481 -13.448 -4.983 881 H LYS 110 H LYS 110 -7.328 -9.984 -5.985 882 HA LYS 110 HA LYS 110 -7.939 -9.160 -8.640 883 HB2 LYS 110 HB2 LYS 110 -9.448 -9.338 -6.546 884 HB3 LYS 110 HB3 LYS 110 -8.846 -7.746 -6.112 885 HG2 LYS 110 HG2 LYS 110 -10.864 -7.273 -7.190 886 HG3 LYS 110 HG3 LYS 110 -9.667 -7.007 -8.464 887 HD2 LYS 110 HD2 LYS 110 -11.433 -8.241 -9.478 888 HD3 LYS 110 HD3 LYS 110 -10.131 -9.417 -9.223 889 HE2 LYS 110 HE2 LYS 110 -11.263 -10.199 -7.142 890 HE3 LYS 110 HE3 LYS 110 -12.555 -9.016 -7.407 891 HZ1 LYS 110 HZ1 LYS 110 -13.170 -11.219 -8.190 892 HZ2 LYS 110 HZ2 LYS 110 -11.891 -11.256 -9.231 893 HZ3 LYS 110 HZ3 LYS 110 -13.109 -10.166 -9.458 894 H LEU 111 H LEU 111 -6.157 -7.591 -6.036 895 HA LEU 111 HA LEU 111 -6.067 -4.961 -7.008 896 HB2 LEU 111 HB2 LEU 111 -5.247 -5.757 -4.807 897 HB3 LEU 111 HB3 LEU 111 -3.902 -6.565 -5.596 898 HG LEU 111 HG LEU 111 -4.040 -3.698 -6.239 899 HD11 LEU 111 HD11 LEU 111 -3.240 -2.988 -3.991 900 HD12 LEU 111 HD12 LEU 111 -3.652 -4.596 -3.358 901 HD13 LEU 111 HD13 LEU 111 -4.930 -3.528 -3.982 902 HD21 LEU 111 HD21 LEU 111 -2.110 -5.188 -6.736 903 HD22 LEU 111 HD22 LEU 111 -1.886 -5.474 -4.998 904 HD23 LEU 111 HD23 LEU 111 -1.648 -3.848 -5.674 905 H PHE 112 H PHE 112 -4.056 -7.769 -7.926 906 HA PHE 112 HA PHE 112 -2.245 -6.155 -9.451 907 HB2 PHE 112 HB2 PHE 112 -2.704 -9.131 -9.386 908 HB3 PHE 112 HB3 PHE 112 -1.412 -8.338 -10.302 909 HD1 PHE 112 HD1 PHE 112 -2.680 -9.102 -6.929 910 HD2 PHE 112 HD2 PHE 112 0.512 -7.337 -9.190 911 HE1 PHE 112 HE1 PHE 112 -1.324 -8.934 -4.854 912 HE2 PHE 112 HE2 PHE 112 1.898 -7.190 -7.122 913 HZ PHE 112 HZ PHE 112 0.958 -7.953 -4.940 914 H SER 113 H SER 113 -5.394 -7.352 -10.248 915 HA SER 113 HA SER 113 -4.978 -7.385 -13.122 916 HB2 SER 113 HB2 SER 113 -6.979 -8.399 -12.068 917 HB3 SER 113 HB3 SER 113 -7.495 -6.797 -11.503 918 HG SER 113 HG SER 113 -7.010 -7.333 -14.242 919 H SER 114 H SER 114 -5.955 -4.923 -10.698 920 HA SER 114 HA SER 114 -6.249 -2.800 -12.610 921 HB2 SER 114 HB2 SER 114 -5.443 -1.781 -10.063 922 HB3 SER 114 HB3 SER 114 -7.071 -1.814 -10.772 923 HG SER 114 HG SER 114 -5.801 -3.725 -9.103 924 H ILE 115 H ILE 115 -3.499 -4.095 -10.786 925 HA ILE 115 HA ILE 115 -1.657 -1.962 -11.300 926 HB ILE 115 HB ILE 115 -1.226 -4.962 -10.863 927 HG12 ILE 115 HG12 ILE 115 -2.174 -3.760 -8.944 928 HG13 ILE 115 HG13 ILE 115 -0.576 -4.399 -8.609 929 HG21 ILE 115 HG21 ILE 115 0.733 -4.363 -12.019 930 HG22 ILE 115 HG22 ILE 115 0.851 -2.802 -11.199 931 HG23 ILE 115 HG23 ILE 115 1.192 -4.296 -10.304 932 HD11 ILE 115 HD11 ILE 115 -1.208 -1.488 -9.232 933 HD12 ILE 115 HD12 ILE 115 -0.920 -2.174 -7.622 934 HD13 ILE 115 HD13 ILE 115 0.392 -2.152 -8.813 935 H ASP 116 H ASP 116 -2.350 -5.012 -13.106 936 HA ASP 116 HA ASP 116 -0.367 -4.430 -15.096 937 HB2 ASP 116 HB2 ASP 116 -1.782 -6.626 -14.411 938 HB3 ASP 116 HB3 ASP 116 -2.690 -6.127 -15.847 939 H ASN 117 H ASN 117 -3.851 -3.719 -14.866 940 HA ASN 117 HA ASN 117 -4.098 -2.755 -17.569 941 HB2 ASN 117 HB2 ASN 117 -5.658 -2.163 -15.030 942 HB3 ASN 117 HB3 ASN 117 -6.066 -1.475 -16.605 943 HD21 ASN 117 HD21 ASN 117 -7.538 -3.337 -14.835 944 HD22 ASN 117 HD22 ASN 117 -7.913 -4.699 -15.858 945 H LEU 118 H LEU 118 -3.173 -1.182 -14.493 946 HA LEU 118 HA LEU 118 -3.159 1.492 -15.536 947 HB2 LEU 118 HB2 LEU 118 -3.077 0.579 -13.112 948 HB3 LEU 118 HB3 LEU 118 -1.354 0.456 -13.352 949 HG LEU 118 HG LEU 118 -2.972 3.015 -13.460 950 HD11 LEU 118 HD11 LEU 118 -1.192 1.844 -11.298 951 HD12 LEU 118 HD12 LEU 118 -2.964 1.950 -11.250 952 HD13 LEU 118 HD13 LEU 118 -1.983 3.431 -11.239 953 HD21 LEU 118 HD21 LEU 118 -0.760 4.144 -13.165 954 HD22 LEU 118 HD22 LEU 118 -0.947 3.350 -14.734 955 HD23 LEU 118 HD23 LEU 118 0.035 2.582 -13.470 956 H ASP 119 H ASP 119 -0.686 -1.078 -15.288 957 HA ASP 119 HA ASP 119 1.498 0.387 -16.370 958 HB2 ASP 119 HB2 ASP 119 2.244 -1.614 -15.577 959 HB3 ASP 119 HB3 ASP 119 0.747 -2.455 -15.988 960 H HIS 120 H HIS 120 -1.076 -1.533 -18.045 961 HA HIS 120 HA HIS 120 0.081 -1.040 -20.630 962 HB2 HIS 120 HB2 HIS 120 -2.640 -1.926 -19.711 963 HB3 HIS 120 HB3 HIS 120 -2.306 -1.579 -21.414 964 HD1 HIS 120 HD1 HIS 120 -1.304 -4.022 -18.658 965 HD2 HIS 120 HD2 HIS 120 -0.787 -3.425 -22.759 966 HE1 HIS 120 HE1 HIS 120 -0.244 -6.121 -19.580 967 H ALA 121 H ALA 121 -2.411 0.707 -18.757 968 HA ALA 121 HA ALA 121 -2.995 2.639 -20.769 969 HB1 ALA 121 HB1 ALA 121 -4.363 2.365 -18.778 970 HB2 ALA 121 HB2 ALA 121 -3.007 2.869 -17.737 971 HB3 ALA 121 HB3 ALA 121 -3.748 4.031 -18.860 972 H ALA 122 H ALA 122 -0.396 2.404 -18.360 973 HA ALA 122 HA ALA 122 0.660 5.039 -18.805 974 HB1 ALA 122 HB1 ALA 122 1.143 3.670 -16.794 975 HB2 ALA 122 HB2 ALA 122 2.046 2.518 -17.798 976 HB3 ALA 122 HB3 ALA 122 2.638 4.180 -17.621 977 H LYS 123 H LYS 123 1.533 1.798 -20.136 978 HA LYS 123 HA LYS 123 3.775 2.822 -21.618 979 HB2 LYS 123 HB2 LYS 123 2.004 0.378 -22.053 980 HB3 LYS 123 HB3 LYS 123 3.469 0.690 -22.988 981 HG2 LYS 123 HG2 LYS 123 4.853 0.540 -20.978 982 HG3 LYS 123 HG3 LYS 123 3.422 0.324 -19.971 983 HD2 LYS 123 HD2 LYS 123 4.348 -1.609 -22.145 984 HD3 LYS 123 HD3 LYS 123 4.565 -1.822 -20.396 985 HE2 LYS 123 HE2 LYS 123 2.003 -1.600 -20.229 986 HE3 LYS 123 HE3 LYS 123 1.975 -1.847 -21.981 987 HZ1 LYS 123 HZ1 LYS 123 3.196 -3.975 -21.497 988 HZ2 LYS 123 HZ2 LYS 123 1.640 -3.922 -20.943 989 HZ3 LYS 123 HZ3 LYS 123 2.886 -3.714 -19.890 990 H ILE 124 H ILE 124 0.309 2.504 -22.345 991 HA ILE 124 HA ILE 124 0.738 3.355 -25.121 992 HB ILE 124 HB ILE 124 -1.026 1.630 -24.212 993 HG12 ILE 124 HG12 ILE 124 -2.643 2.344 -26.062 994 HG13 ILE 124 HG13 ILE 124 -1.564 3.714 -26.341 995 HG21 ILE 124 HG21 ILE 124 -2.049 3.267 -22.582 996 HG22 ILE 124 HG22 ILE 124 -2.730 4.139 -23.967 997 HG23 ILE 124 HG23 ILE 124 -3.205 2.458 -23.649 998 HD11 ILE 124 HD11 ILE 124 -0.738 0.775 -26.481 999 HD12 ILE 124 HD12 ILE 124 -1.111 1.807 -27.880 1000 HD13 ILE 124 HD13 ILE 124 0.298 2.174 -26.860 1001 H LYS 125 H LYS 125 1.243 4.975 -22.556 1002 HA LYS 125 HA LYS 125 1.148 7.102 -21.827 1003 HB2 LYS 125 HB2 LYS 125 1.593 8.833 -23.539 1004 HB3 LYS 125 HB3 LYS 125 2.632 7.417 -23.635 1005 HG2 LYS 125 HG2 LYS 125 1.575 6.614 -25.598 1006 HG3 LYS 125 HG3 LYS 125 0.214 7.732 -25.423 1007 HD2 LYS 125 HD2 LYS 125 2.957 8.879 -25.729 1008 HD3 LYS 125 HD3 LYS 125 2.139 8.179 -27.144 1009 HE2 LYS 125 HE2 LYS 125 0.109 9.573 -26.555 1010 HE3 LYS 125 HE3 LYS 125 1.113 10.412 -25.356 1011 HZ1 LYS 125 HZ1 LYS 125 1.643 10.270 -28.270 1012 HZ2 LYS 125 HZ2 LYS 125 2.601 11.045 -27.176 1013 HZ3 LYS 125 HZ3 LYS 125 1.069 11.588 -27.465 1014 H SER 126 H SER 126 -1.410 6.073 -21.709 1015 HA SER 126 HA SER 126 -3.117 8.464 -22.293 1016 HB2 SER 126 HB2 SER 126 -3.796 5.638 -21.396 1017 HB3 SER 126 HB3 SER 126 -4.976 6.948 -21.614 1018 HG SER 126 HG SER 126 -4.724 5.511 -23.436 1019 HA PRO 127 HA PRO 127 -1.828 8.795 -17.940 1020 HB2 PRO 127 HB2 PRO 127 -2.294 11.466 -17.504 1021 HB3 PRO 127 HB3 PRO 127 -0.822 10.839 -18.310 1022 HG2 PRO 127 HG2 PRO 127 -3.347 11.895 -19.569 1023 HG3 PRO 127 HG3 PRO 127 -1.644 12.344 -19.909 1024 HD2 PRO 127 HD2 PRO 127 -2.939 10.568 -21.460 1025 HD3 PRO 127 HD3 PRO 127 -1.213 10.314 -21.020 1026 H THR 128 H THR 128 -4.868 10.302 -19.183 1027 HA THR 128 HA THR 128 -6.125 10.400 -16.616 1028 HB THR 128 HB THR 128 -7.631 10.018 -19.219 1029 HG1 THR 128 HG1 THR 128 -6.465 12.461 -18.355 1030 HG21 THR 128 HG21 THR 128 -8.024 11.816 -16.785 1031 HG22 THR 128 HG22 THR 128 -8.948 10.342 -17.160 1032 HG23 THR 128 HG23 THR 128 -9.081 11.765 -18.217 1033 H GLU 129 H GLU 129 -5.732 7.864 -19.022 1034 HA GLU 129 HA GLU 129 -7.736 6.097 -17.881 1035 HB2 GLU 129 HB2 GLU 129 -6.862 6.115 -20.254 1036 HB3 GLU 129 HB3 GLU 129 -5.359 5.431 -19.631 1037 HG2 GLU 129 HG2 GLU 129 -6.628 3.493 -18.778 1038 HG3 GLU 129 HG3 GLU 129 -8.102 4.175 -19.492 1039 H ALA 130 H ALA 130 -4.210 6.599 -17.604 1040 HA ALA 130 HA ALA 130 -3.714 4.387 -15.853 1041 HB1 ALA 130 HB1 ALA 130 -1.640 5.611 -15.279 1042 HB2 ALA 130 HB2 ALA 130 -1.911 5.615 -17.037 1043 HB3 ALA 130 HB3 ALA 130 -2.264 7.070 -16.075 1044 H GLU 131 H GLU 131 -4.721 7.793 -15.290 1045 HA GLU 131 HA GLU 131 -4.694 7.608 -12.419 1046 HB2 GLU 131 HB2 GLU 131 -6.227 9.363 -14.352 1047 HB3 GLU 131 HB3 GLU 131 -6.390 9.499 -12.596 1048 HG2 GLU 131 HG2 GLU 131 -3.952 9.889 -12.423 1049 HG3 GLU 131 HG3 GLU 131 -3.850 9.877 -14.188 1050 H LYS 132 H LYS 132 -7.145 6.776 -14.873 1051 HA LYS 132 HA LYS 132 -9.287 6.337 -13.015 1052 HB2 LYS 132 HB2 LYS 132 -9.483 6.518 -15.516 1053 HB3 LYS 132 HB3 LYS 132 -8.758 4.915 -15.650 1054 HG2 LYS 132 HG2 LYS 132 -10.669 4.039 -14.227 1055 HG3 LYS 132 HG3 LYS 132 -11.436 5.626 -14.425 1056 HD2 LYS 132 HD2 LYS 132 -10.580 3.781 -16.697 1057 HD3 LYS 132 HD3 LYS 132 -12.234 3.923 -16.071 1058 HE2 LYS 132 HE2 LYS 132 -12.245 6.341 -16.694 1059 HE3 LYS 132 HE3 LYS 132 -10.614 6.156 -17.378 1060 HZ1 LYS 132 HZ1 LYS 132 -11.507 4.539 -18.934 1061 HZ2 LYS 132 HZ2 LYS 132 -12.311 5.972 -19.083 1062 HZ3 LYS 132 HZ3 LYS 132 -13.023 4.703 -18.306 1063 H TYR 133 H TYR 133 -6.842 4.096 -14.433 1064 HA TYR 133 HA TYR 133 -7.790 1.869 -12.857 1065 HB2 TYR 133 HB2 TYR 133 -5.214 2.377 -14.363 1066 HB3 TYR 133 HB3 TYR 133 -5.534 0.877 -13.476 1067 HD1 TYR 133 HD1 TYR 133 -8.182 0.046 -13.993 1068 HD2 TYR 133 HD2 TYR 133 -5.540 2.119 -16.688 1069 HE1 TYR 133 HE1 TYR 133 -9.465 -0.836 -15.935 1070 HE2 TYR 133 HE2 TYR 133 -6.821 1.203 -18.631 1071 HH TYR 133 HH TYR 133 -9.626 -0.967 -18.202 1072 H TYR 134 H TYR 134 -5.444 4.459 -12.263 1073 HA TYR 134 HA TYR 134 -4.309 3.330 -9.880 1074 HB2 TYR 134 HB2 TYR 134 -3.283 5.268 -10.876 1075 HB3 TYR 134 HB3 TYR 134 -4.783 6.182 -10.775 1076 HD1 TYR 134 HD1 TYR 134 -2.098 4.647 -8.657 1077 HD2 TYR 134 HD2 TYR 134 -5.370 7.441 -8.857 1078 HE1 TYR 134 HE1 TYR 134 -1.465 5.563 -6.422 1079 HE2 TYR 134 HE2 TYR 134 -4.728 8.345 -6.625 1080 HH TYR 134 HH TYR 134 -1.868 7.240 -4.852 1081 H GLY 135 H GLY 135 -7.252 5.351 -10.451 1082 HA2 GLY 135 HA2 GLY 135 -7.997 5.502 -7.706 1083 HA3 GLY 135 HA3 GLY 135 -9.098 5.633 -9.089 1084 H GLN 136 H GLN 136 -8.660 3.013 -10.183 1085 HA GLN 136 HA GLN 136 -10.407 1.448 -8.498 1086 HB2 GLN 136 HB2 GLN 136 -8.646 0.679 -10.854 1087 HB3 GLN 136 HB3 GLN 136 -9.810 -0.405 -10.086 1088 HG2 GLN 136 HG2 GLN 136 -11.656 1.067 -10.706 1089 HG3 GLN 136 HG3 GLN 136 -10.528 2.252 -11.374 1090 HE21 GLN 136 HE21 GLN 136 -10.833 -1.304 -11.686 1091 HE22 GLN 136 HE22 GLN 136 -10.877 -1.291 -13.433 1092 H THR 137 H THR 137 -6.875 1.570 -8.972 1093 HA THR 137 HA THR 137 -6.288 -0.744 -7.376 1094 HB THR 137 HB THR 137 -4.491 1.701 -7.766 1095 HG1 THR 137 HG1 THR 137 -5.219 0.900 -9.788 1096 HG21 THR 137 HG21 THR 137 -2.681 0.065 -7.563 1097 HG22 THR 137 HG22 THR 137 -3.861 -1.248 -7.357 1098 HG23 THR 137 HG23 THR 137 -3.705 0.015 -6.116 1099 H VAL 138 H VAL 138 -6.577 2.765 -6.610 1100 HA VAL 138 HA VAL 138 -5.862 2.626 -3.851 1101 HB VAL 138 HB VAL 138 -7.910 4.434 -5.257 1102 HG11 VAL 138 HG11 VAL 138 -6.666 4.687 -2.485 1103 HG12 VAL 138 HG12 VAL 138 -7.557 5.986 -3.310 1104 HG13 VAL 138 HG13 VAL 138 -8.389 4.484 -2.874 1105 HG21 VAL 138 HG21 VAL 138 -5.150 5.297 -4.380 1106 HG22 VAL 138 HG22 VAL 138 -5.374 4.498 -5.934 1107 HG23 VAL 138 HG23 VAL 138 -6.218 6.015 -5.592 1108 H SER 139 H SER 139 -9.028 2.164 -5.504 1109 HA SER 139 HA SER 139 -10.531 1.752 -3.113 1110 HB2 SER 139 HB2 SER 139 -11.494 2.176 -5.381 1111 HB3 SER 139 HB3 SER 139 -11.016 0.535 -5.858 1112 HG SER 139 HG SER 139 -12.292 -0.002 -3.788 1113 H ASN 140 H ASN 140 -8.723 -0.546 -5.204 1114 HA ASN 140 HA ASN 140 -9.595 -2.865 -3.731 1115 HB2 ASN 140 HB2 ASN 140 -8.439 -2.614 -6.091 1116 HB3 ASN 140 HB3 ASN 140 -6.942 -2.761 -5.158 1117 HD21 ASN 140 HD21 ASN 140 -7.454 -4.629 -3.286 1118 HD22 ASN 140 HD22 ASN 140 -7.893 -6.146 -4.046 1119 H ILE 141 H ILE 141 -6.872 -0.585 -3.364 1120 HA ILE 141 HA ILE 141 -5.450 -2.095 -1.362 1121 HB ILE 141 HB ILE 141 -5.553 0.892 -2.016 1122 HG12 ILE 141 HG12 ILE 141 -3.226 -1.029 -2.298 1123 HG13 ILE 141 HG13 ILE 141 -4.463 -0.906 -3.546 1124 HG21 ILE 141 HG21 ILE 141 -3.504 1.119 -0.539 1125 HG22 ILE 141 HG22 ILE 141 -4.990 0.776 0.364 1126 HG23 ILE 141 HG23 ILE 141 -3.814 -0.519 0.062 1127 HD11 ILE 141 HD11 ILE 141 -2.590 0.469 -4.165 1128 HD12 ILE 141 HD12 ILE 141 -3.963 1.523 -3.780 1129 HD13 ILE 141 HD13 ILE 141 -2.635 1.325 -2.612 1130 H ASN 142 H ASN 142 -8.029 0.406 -1.194 1131 HA ASN 142 HA ASN 142 -8.225 0.529 1.629 1132 HB2 ASN 142 HB2 ASN 142 -9.418 2.018 0.005 1133 HB3 ASN 142 HB3 ASN 142 -10.504 0.675 -0.380 1134 HD21 ASN 142 HD21 ASN 142 -12.217 0.243 0.921 1135 HD22 ASN 142 HD22 ASN 142 -12.548 1.128 2.389 1136 H GLU 143 H GLU 143 -9.822 -1.718 -0.678 1137 HA GLU 143 HA GLU 143 -11.349 -3.051 1.339 1138 HB2 GLU 143 HB2 GLU 143 -10.407 -3.860 -1.427 1139 HB3 GLU 143 HB3 GLU 143 -11.387 -4.929 -0.420 1140 HG2 GLU 143 HG2 GLU 143 -12.193 -2.155 -1.330 1141 HG3 GLU 143 HG3 GLU 143 -12.746 -3.684 -2.040 1142 H VAL 144 H VAL 144 -8.103 -3.705 0.020 1143 HA VAL 144 HA VAL 144 -7.777 -6.208 1.442 1144 HB VAL 144 HB VAL 144 -5.747 -4.177 0.346 1145 HG11 VAL 144 HG11 VAL 144 -4.050 -6.020 0.609 1146 HG12 VAL 144 HG12 VAL 144 -4.618 -5.343 2.144 1147 HG13 VAL 144 HG13 VAL 144 -5.239 -6.915 1.589 1148 HG21 VAL 144 HG21 VAL 144 -6.442 -6.976 -0.647 1149 HG22 VAL 144 HG22 VAL 144 -7.176 -5.496 -1.290 1150 HG23 VAL 144 HG23 VAL 144 -5.430 -5.760 -1.459 1151 H LEU 145 H LEU 145 -7.222 -2.754 2.232 1152 HA LEU 145 HA LEU 145 -5.828 -3.245 4.704 1153 HB2 LEU 145 HB2 LEU 145 -7.023 -0.962 3.295 1154 HB3 LEU 145 HB3 LEU 145 -7.222 -0.855 5.039 1155 HG LEU 145 HG LEU 145 -4.785 -1.052 5.348 1156 HD11 LEU 145 HD11 LEU 145 -4.682 -1.006 2.315 1157 HD12 LEU 145 HD12 LEU 145 -4.141 -2.324 3.374 1158 HD13 LEU 145 HD13 LEU 145 -3.287 -0.768 3.389 1159 HD21 LEU 145 HD21 LEU 145 -5.857 1.152 5.168 1160 HD22 LEU 145 HD22 LEU 145 -5.639 1.124 3.402 1161 HD23 LEU 145 HD23 LEU 145 -4.221 1.182 4.476 1162 H ALA 146 H ALA 146 -9.278 -2.661 3.951 1163 HA ALA 146 HA ALA 146 -10.180 -2.758 6.657 1164 HB1 ALA 146 HB1 ALA 146 -11.528 -1.874 4.768 1165 HB2 ALA 146 HB2 ALA 146 -11.645 -3.511 4.080 1166 HB3 ALA 146 HB3 ALA 146 -12.408 -3.147 5.647 1167 H LYS 147 H LYS 147 -9.305 -5.286 4.386 1168 HA LYS 147 HA LYS 147 -10.560 -7.414 5.966 1169 HB2 LYS 147 HB2 LYS 147 -9.543 -7.114 3.355 1170 HB3 LYS 147 HB3 LYS 147 -8.463 -8.252 4.138 1171 HG2 LYS 147 HG2 LYS 147 -10.175 -9.508 3.050 1172 HG3 LYS 147 HG3 LYS 147 -10.493 -9.611 4.794 1173 HD2 LYS 147 HD2 LYS 147 -12.235 -7.918 4.627 1174 HD3 LYS 147 HD3 LYS 147 -11.808 -7.589 2.939 1175 HE2 LYS 147 HE2 LYS 147 -12.448 -9.911 2.338 1176 HE3 LYS 147 HE3 LYS 147 -12.949 -10.186 4.025 1177 HZ1 LYS 147 HZ1 LYS 147 -14.068 -8.101 2.231 1178 HZ2 LYS 147 HZ2 LYS 147 -14.551 -8.392 3.780 1179 HZ3 LYS 147 HZ3 LYS 147 -14.814 -9.523 2.609 1180 H LEU 148 H LEU 148 -7.575 -5.685 6.084 1181 HA LEU 148 HA LEU 148 -6.157 -7.902 7.433 1182 HB2 LEU 148 HB2 LEU 148 -5.383 -5.109 6.567 1183 HB3 LEU 148 HB3 LEU 148 -4.323 -6.116 7.552 1184 HG LEU 148 HG LEU 148 -5.367 -7.009 4.851 1185 HD11 LEU 148 HD11 LEU 148 -3.175 -6.316 3.955 1186 HD12 LEU 148 HD12 LEU 148 -2.763 -5.601 5.529 1187 HD13 LEU 148 HD13 LEU 148 -4.102 -4.933 4.567 1188 HD21 LEU 148 HD21 LEU 148 -3.022 -7.913 6.550 1189 HD22 LEU 148 HD22 LEU 148 -3.476 -8.558 4.960 1190 HD23 LEU 148 HD23 LEU 148 -4.557 -8.787 6.338 1191 H GLY 149 H GLY 149 -7.749 -4.838 8.230 1192 HA2 GLY 149 HA2 GLY 149 -8.494 -4.256 10.390 1193 HA3 GLY 149 HA3 GLY 149 -7.496 -5.546 11.083 Start of MODEL 10 1 H1 GLU 1 H1 GLU 1 0.377 11.442 29.001 2 H2 GLU 1 H2 GLU 1 -1.169 11.807 28.543 3 H3 GLU 1 H3 GLU 1 -0.114 13.019 28.903 4 HA GLU 1 HA GLU 1 -0.036 12.441 31.192 5 HB2 GLU 1 HB2 GLU 1 -2.828 12.613 30.022 6 HB3 GLU 1 HB3 GLU 1 -2.525 12.629 31.762 7 HG2 GLU 1 HG2 GLU 1 -2.786 14.906 30.956 8 HG3 GLU 1 HG3 GLU 1 -1.121 14.639 31.508 9 H ALA 2 H ALA 2 -1.773 10.030 29.198 10 HA ALA 2 HA ALA 2 -2.735 8.482 31.371 11 HB1 ALA 2 HB1 ALA 2 -2.098 7.652 28.506 12 HB2 ALA 2 HB2 ALA 2 -3.103 6.741 29.656 13 HB3 ALA 2 HB3 ALA 2 -3.639 8.338 29.085 14 H ARG 3 H ARG 3 0.330 8.396 29.639 15 HA ARG 3 HA ARG 3 2.296 7.377 30.006 16 HB2 ARG 3 HB2 ARG 3 1.249 6.401 32.679 17 HB3 ARG 3 HB3 ARG 3 2.933 6.490 32.171 18 HG2 ARG 3 HG2 ARG 3 2.742 8.961 32.032 19 HG3 ARG 3 HG3 ARG 3 1.067 8.843 32.591 20 HD2 ARG 3 HD2 ARG 3 1.840 7.733 34.660 21 HD3 ARG 3 HD3 ARG 3 3.521 7.956 34.122 22 HE ARG 3 HE ARG 3 2.212 10.471 34.050 23 HH11 ARG 3 HH11 ARG 3 3.306 8.154 36.474 24 HH12 ARG 3 HH12 ARG 3 3.563 9.399 37.676 25 HH21 ARG 3 HH21 ARG 3 2.566 11.995 35.656 26 HH22 ARG 3 HH22 ARG 3 3.163 11.499 37.222 27 HA PRO 4 HA PRO 4 1.557 3.305 28.531 28 HB2 PRO 4 HB2 PRO 4 4.073 2.381 28.150 29 HB3 PRO 4 HB3 PRO 4 3.466 3.809 27.259 30 HG2 PRO 4 HG2 PRO 4 5.123 3.726 29.769 31 HG3 PRO 4 HG3 PRO 4 5.429 4.627 28.251 32 HD2 PRO 4 HD2 PRO 4 4.242 5.756 30.420 33 HD3 PRO 4 HD3 PRO 4 3.830 6.229 28.739 34 H ILE 5 H ILE 5 0.881 3.245 31.179 35 HA ILE 5 HA ILE 5 2.149 0.718 32.122 36 HB ILE 5 HB ILE 5 3.231 2.629 33.331 37 HG12 ILE 5 HG12 ILE 5 1.441 0.974 35.150 38 HG13 ILE 5 HG13 ILE 5 2.872 0.344 34.330 39 HG21 ILE 5 HG21 ILE 5 1.200 4.167 33.282 40 HG22 ILE 5 HG22 ILE 5 0.492 3.186 34.578 41 HG23 ILE 5 HG23 ILE 5 2.008 4.071 34.857 42 HD11 ILE 5 HD11 ILE 5 3.450 0.884 36.621 43 HD12 ILE 5 HD12 ILE 5 4.272 2.039 35.547 44 HD13 ILE 5 HD13 ILE 5 2.816 2.534 36.449 45 H VAL 6 H VAL 6 0.785 -0.735 32.998 46 HA VAL 6 HA VAL 6 -2.024 0.114 33.545 47 HB VAL 6 HB VAL 6 -1.130 -2.498 32.208 48 HG11 VAL 6 HG11 VAL 6 -3.054 -2.847 33.707 49 HG12 VAL 6 HG12 VAL 6 -3.918 -1.485 32.949 50 HG13 VAL 6 HG13 VAL 6 -3.571 -2.959 32.015 51 HG21 VAL 6 HG21 VAL 6 -1.058 -0.661 30.593 52 HG22 VAL 6 HG22 VAL 6 -2.467 -1.681 30.254 53 HG23 VAL 6 HG23 VAL 6 -2.680 -0.119 31.082 54 H VAL 7 H VAL 7 -2.430 -0.294 35.661 55 HA VAL 7 HA VAL 7 -1.230 -2.658 36.925 56 HB VAL 7 HB VAL 7 0.587 -1.136 37.312 57 HG11 VAL 7 HG11 VAL 7 0.401 1.083 38.319 58 HG12 VAL 7 HG12 VAL 7 -0.577 1.019 36.844 59 HG13 VAL 7 HG13 VAL 7 -1.359 0.930 38.444 60 HG21 VAL 7 HG21 VAL 7 -0.175 -2.525 39.263 61 HG22 VAL 7 HG22 VAL 7 0.739 -1.068 39.708 62 HG23 VAL 7 HG23 VAL 7 -1.026 -1.091 39.888 63 H GLY 8 H GLY 8 -3.186 0.309 37.519 64 HA2 GLY 8 HA2 GLY 8 -5.534 -0.016 38.133 65 HA3 GLY 8 HA3 GLY 8 -5.051 -1.418 39.097 66 HA PRO 9 HA PRO 9 -4.741 1.472 42.427 67 HB2 PRO 9 HB2 PRO 9 -2.854 0.436 44.108 68 HB3 PRO 9 HB3 PRO 9 -4.448 -0.354 43.876 69 HG2 PRO 9 HG2 PRO 9 -1.825 -0.960 42.533 70 HG3 PRO 9 HG3 PRO 9 -2.940 -2.079 43.383 71 HD2 PRO 9 HD2 PRO 9 -2.984 -1.818 40.705 72 HD3 PRO 9 HD3 PRO 9 -4.506 -2.025 41.636 73 HA PRO 10 HA PRO 10 -1.434 4.122 41.329 74 HB2 PRO 10 HB2 PRO 10 -0.935 5.649 43.549 75 HB3 PRO 10 HB3 PRO 10 -2.438 5.816 42.585 76 HG2 PRO 10 HG2 PRO 10 -1.979 4.213 45.096 77 HG3 PRO 10 HG3 PRO 10 -3.264 5.416 44.748 78 HD2 PRO 10 HD2 PRO 10 -3.718 2.779 44.463 79 HD3 PRO 10 HD3 PRO 10 -4.386 3.957 43.278 80 HA PRO 11 HA PRO 11 2.215 2.064 42.667 81 HB2 PRO 11 HB2 PRO 11 4.218 3.834 42.021 82 HB3 PRO 11 HB3 PRO 11 3.308 2.901 40.789 83 HG2 PRO 11 HG2 PRO 11 2.846 5.710 41.754 84 HG3 PRO 11 HG3 PRO 11 2.990 5.108 40.074 85 HD2 PRO 11 HD2 PRO 11 0.595 5.538 41.214 86 HD3 PRO 11 HD3 PRO 11 0.864 4.124 40.133 87 HA PRO 12 HA PRO 12 2.664 3.643 46.736 88 HB2 PRO 12 HB2 PRO 12 4.741 2.189 47.740 89 HB3 PRO 12 HB3 PRO 12 3.160 1.448 47.332 90 HG2 PRO 12 HG2 PRO 12 5.662 1.576 45.659 91 HG3 PRO 12 HG3 PRO 12 4.675 0.143 46.100 92 HD2 PRO 12 HD2 PRO 12 4.332 1.388 43.735 93 HD3 PRO 12 HD3 PRO 12 2.919 0.769 44.662 94 H LEU 13 H LEU 13 5.282 4.008 44.500 95 HA LEU 13 HA LEU 13 6.634 5.940 46.322 96 HB2 LEU 13 HB2 LEU 13 8.612 5.644 45.079 97 HB3 LEU 13 HB3 LEU 13 8.011 4.052 45.490 98 HG LEU 13 HG LEU 13 7.732 5.303 42.733 99 HD11 LEU 13 HD11 LEU 13 10.091 5.086 43.383 100 HD12 LEU 13 HD12 LEU 13 9.670 3.915 42.119 101 HD13 LEU 13 HD13 LEU 13 9.828 3.376 43.808 102 HD21 LEU 13 HD21 LEU 13 7.379 2.441 43.722 103 HD22 LEU 13 HD22 LEU 13 7.507 2.900 42.007 104 HD23 LEU 13 HD23 LEU 13 6.152 3.489 42.972 105 H SER 14 H SER 14 4.191 6.127 44.406 106 HA SER 14 HA SER 14 3.281 7.622 42.931 107 HB2 SER 14 HB2 SER 14 4.166 9.234 44.702 108 HB3 SER 14 HB3 SER 14 5.545 9.525 43.624 109 HG SER 14 HG SER 14 3.673 10.987 43.437 110 H GLY 15 H GLY 15 4.748 9.568 41.225 111 HA2 GLY 15 HA2 GLY 15 6.926 8.348 39.906 112 HA3 GLY 15 HA3 GLY 15 5.455 7.786 39.102 113 H GLY 16 H GLY 16 7.756 9.569 38.286 114 HA2 GLY 16 HA2 GLY 16 6.361 12.118 37.717 115 HA3 GLY 16 HA3 GLY 16 8.063 11.731 37.393 116 H LEU 17 H LEU 17 7.653 12.647 35.226 117 HA LEU 17 HA LEU 17 5.808 11.403 33.438 118 HB2 LEU 17 HB2 LEU 17 6.909 12.543 31.680 119 HB3 LEU 17 HB3 LEU 17 6.833 13.632 33.049 120 HG LEU 17 HG LEU 17 9.348 12.128 32.244 121 HD11 LEU 17 HD11 LEU 17 8.566 13.565 30.411 122 HD12 LEU 17 HD12 LEU 17 10.045 14.206 31.144 123 HD13 LEU 17 HD13 LEU 17 8.473 14.949 31.523 124 HD21 LEU 17 HD21 LEU 17 8.864 14.526 34.067 125 HD22 LEU 17 HD22 LEU 17 10.466 14.010 33.497 126 HD23 LEU 17 HD23 LEU 17 9.518 12.929 34.525 127 HA PRO 18 HA PRO 18 8.052 7.693 32.827 128 HB2 PRO 18 HB2 PRO 18 6.952 6.689 30.544 129 HB3 PRO 18 HB3 PRO 18 6.018 6.806 32.072 130 HG2 PRO 18 HG2 PRO 18 6.050 8.684 29.719 131 HG3 PRO 18 HG3 PRO 18 4.648 7.987 30.580 132 HD2 PRO 18 HD2 PRO 18 5.585 10.482 31.090 133 HD3 PRO 18 HD3 PRO 18 4.868 9.446 32.371 134 H GLY 19 H GLY 19 10.058 7.198 31.946 135 HA2 GLY 19 HA2 GLY 19 11.748 7.177 30.337 136 HA3 GLY 19 HA3 GLY 19 10.686 8.045 29.227 137 H THR 20 H THR 20 11.392 9.174 32.492 138 HA THR 20 HA THR 20 12.080 11.774 31.579 139 HB THR 20 HB THR 20 11.185 11.236 33.860 140 HG1 THR 20 HG1 THR 20 13.540 12.738 33.458 141 HG21 THR 20 HG21 THR 20 14.032 10.356 34.490 142 HG22 THR 20 HG22 THR 20 12.643 9.251 34.336 143 HG23 THR 20 HG23 THR 20 12.671 10.476 35.621 144 H GLU 21 H GLU 21 14.040 8.917 31.707 145 HA GLU 21 HA GLU 21 16.583 10.269 32.046 146 HB2 GLU 21 HB2 GLU 21 17.559 8.183 31.272 147 HB3 GLU 21 HB3 GLU 21 16.311 7.866 32.476 148 HG2 GLU 21 HG2 GLU 21 15.424 7.763 29.633 149 HG3 GLU 21 HG3 GLU 21 16.559 6.510 30.143 150 H ASN 22 H ASN 22 14.296 10.158 29.487 151 HA ASN 22 HA ASN 22 16.356 10.780 27.424 152 HB2 ASN 22 HB2 ASN 22 13.351 10.685 27.088 153 HB3 ASN 22 HB3 ASN 22 14.580 10.599 25.823 154 HD21 ASN 22 HD21 ASN 22 12.298 8.886 26.956 155 HD22 ASN 22 HD22 ASN 22 13.014 7.288 27.015 156 H SER 23 H SER 23 15.236 12.421 29.850 157 HA SER 23 HA SER 23 14.625 14.525 30.380 158 HB2 SER 23 HB2 SER 23 15.797 15.241 27.672 159 HB3 SER 23 HB3 SER 23 15.473 16.367 29.009 160 HG SER 23 HG SER 23 17.223 14.122 29.068 161 H ASP 24 H ASP 24 14.044 15.579 27.067 162 HA ASP 24 HA ASP 24 11.286 16.192 27.855 163 HB2 ASP 24 HB2 ASP 24 11.221 17.460 25.783 164 HB3 ASP 24 HB3 ASP 24 12.699 17.848 26.677 165 H GLN 25 H GLN 25 12.934 13.774 25.919 166 HA GLN 25 HA GLN 25 10.536 13.191 24.343 167 HB2 GLN 25 HB2 GLN 25 12.913 12.939 23.522 168 HB3 GLN 25 HB3 GLN 25 13.048 11.527 24.566 169 HG2 GLN 25 HG2 GLN 25 11.058 10.536 23.334 170 HG3 GLN 25 HG3 GLN 25 11.141 11.910 22.224 171 HE21 GLN 25 HE21 GLN 25 13.631 9.817 23.716 172 HE22 GLN 25 HE22 GLN 25 14.347 9.319 22.201 173 H ALA 26 H ALA 26 9.206 12.964 26.300 174 HA ALA 26 HA ALA 26 9.452 10.758 28.088 175 HB1 ALA 26 HB1 ALA 26 7.116 11.212 28.642 176 HB2 ALA 26 HB2 ALA 26 7.960 12.758 28.403 177 HB3 ALA 26 HB3 ALA 26 6.896 12.125 27.126 178 H ARG 27 H ARG 27 8.327 8.758 28.149 179 HA ARG 27 HA ARG 27 7.958 7.571 25.445 180 HB2 ARG 27 HB2 ARG 27 8.088 6.300 28.205 181 HB3 ARG 27 HB3 ARG 27 7.876 5.411 26.691 182 HG2 ARG 27 HG2 ARG 27 10.047 6.390 25.884 183 HG3 ARG 27 HG3 ARG 27 10.289 7.042 27.511 184 HD2 ARG 27 HD2 ARG 27 10.058 4.699 28.409 185 HD3 ARG 27 HD3 ARG 27 9.988 4.117 26.737 186 HE ARG 27 HE ARG 27 12.270 4.929 26.404 187 HH11 ARG 27 HH11 ARG 27 11.268 4.699 29.792 188 HH12 ARG 27 HH12 ARG 27 12.929 4.729 30.364 189 HH21 ARG 27 HH21 ARG 27 14.348 4.944 27.254 190 HH22 ARG 27 HH22 ARG 27 14.584 4.837 28.989 191 H ASP 28 H ASP 28 5.933 9.381 26.859 192 HA ASP 28 HA ASP 28 3.614 7.550 27.067 193 HB2 ASP 28 HB2 ASP 28 4.079 9.620 28.589 194 HB3 ASP 28 HB3 ASP 28 3.532 10.576 27.206 195 H GLY 29 H GLY 29 1.920 7.564 25.547 196 HA2 GLY 29 HA2 GLY 29 0.850 8.060 23.539 197 HA3 GLY 29 HA3 GLY 29 1.958 9.422 23.307 198 H THR 30 H THR 30 1.902 8.721 21.073 199 HA THR 30 HA THR 30 2.844 7.835 19.218 200 HB THR 30 HB THR 30 5.073 6.709 20.948 201 HG1 THR 30 HG1 THR 30 5.039 8.808 21.496 202 HG21 THR 30 HG21 THR 30 6.423 7.209 18.931 203 HG22 THR 30 HG22 THR 30 4.959 7.742 18.079 204 HG23 THR 30 HG23 THR 30 5.138 6.037 18.573 205 H LEU 31 H LEU 31 1.709 6.327 18.225 206 HA LEU 31 HA LEU 31 1.816 3.535 19.291 207 HB2 LEU 31 HB2 LEU 31 -0.263 4.863 17.527 208 HB3 LEU 31 HB3 LEU 31 -0.291 3.186 18.069 209 HG LEU 31 HG LEU 31 -0.485 5.617 19.887 210 HD11 LEU 31 HD11 LEU 31 -2.618 3.661 18.941 211 HD12 LEU 31 HD12 LEU 31 -2.446 5.356 18.422 212 HD13 LEU 31 HD13 LEU 31 -2.850 4.983 20.108 213 HD21 LEU 31 HD21 LEU 31 -1.207 3.951 21.600 214 HD22 LEU 31 HD22 LEU 31 0.476 3.723 21.092 215 HD23 LEU 31 HD23 LEU 31 -0.793 2.641 20.469 216 HA PRO 32 HA PRO 32 3.922 3.396 15.240 217 HB2 PRO 32 HB2 PRO 32 5.840 1.544 15.789 218 HB3 PRO 32 HB3 PRO 32 6.021 3.259 16.280 219 HG2 PRO 32 HG2 PRO 32 5.065 0.913 17.908 220 HG3 PRO 32 HG3 PRO 32 6.315 2.133 18.315 221 HD2 PRO 32 HD2 PRO 32 3.750 2.323 19.205 222 HD3 PRO 32 HD3 PRO 32 4.721 3.776 18.784 223 H TYR 33 H TYR 33 3.695 1.812 13.589 224 HA TYR 33 HA TYR 33 1.686 -0.184 14.050 225 HB2 TYR 33 HB2 TYR 33 1.829 -0.663 11.758 226 HB3 TYR 33 HB3 TYR 33 2.160 1.060 11.889 227 HD1 TYR 33 HD2 TYR 33 4.710 1.781 11.864 228 HD2 TYR 33 HD1 TYR 33 3.291 -2.067 10.549 229 HE1 TYR 33 HE2 TYR 33 6.802 1.447 10.547 230 HE2 TYR 33 HE1 TYR 33 5.382 -2.380 9.239 231 HH TYR 33 HH TYR 33 7.943 0.082 9.095 232 H THR 34 H THR 34 5.111 -0.183 14.317 233 HA THR 34 HA THR 34 5.253 -2.539 15.843 234 HB THR 34 HB THR 34 7.026 -3.456 13.821 235 HG1 THR 34 HG1 THR 34 4.403 -3.058 12.786 236 HG21 THR 34 HG21 THR 34 5.580 -5.436 13.755 237 HG22 THR 34 HG22 THR 34 4.284 -4.537 14.570 238 HG23 THR 34 HG23 THR 34 5.804 -4.880 15.423 239 H LYS 35 H LYS 35 7.123 -0.992 13.234 240 HA LYS 35 HA LYS 35 9.231 -0.124 13.144 241 HB2 LYS 35 HB2 LYS 35 7.830 1.697 14.124 242 HB3 LYS 35 HB3 LYS 35 8.441 1.277 15.724 243 HG2 LYS 35 HG2 LYS 35 10.729 1.871 15.054 244 HG3 LYS 35 HG3 LYS 35 10.223 2.056 13.372 245 HD2 LYS 35 HD2 LYS 35 10.041 4.249 13.818 246 HD3 LYS 35 HD3 LYS 35 8.533 3.832 14.636 247 HE2 LYS 35 HE2 LYS 35 9.907 5.282 16.050 248 HE3 LYS 35 HE3 LYS 35 9.730 3.694 16.799 249 HZ1 LYS 35 HZ1 LYS 35 12.128 4.387 15.213 250 HZ2 LYS 35 HZ2 LYS 35 11.942 3.156 16.310 251 HZ3 LYS 35 HZ3 LYS 35 12.019 4.715 16.826 252 H ASP 36 H ASP 36 9.651 0.241 16.599 253 HA ASP 36 HA ASP 36 12.242 -0.907 16.460 254 HB2 ASP 36 HB2 ASP 36 10.532 -0.427 18.905 255 HB3 ASP 36 HB3 ASP 36 12.303 -0.475 18.832 256 H ARG 37 H ARG 37 9.120 -2.300 17.100 257 HA ARG 37 HA ARG 37 9.949 -4.518 18.662 258 HB2 ARG 37 HB2 ARG 37 7.584 -3.610 18.037 259 HB3 ARG 37 HB3 ARG 37 7.714 -4.709 16.658 260 HG2 ARG 37 HG2 ARG 37 8.102 -6.587 18.233 261 HG3 ARG 37 HG3 ARG 37 7.934 -5.458 19.589 262 HD2 ARG 37 HD2 ARG 37 5.636 -4.888 18.694 263 HD3 ARG 37 HD3 ARG 37 5.825 -6.232 17.558 264 HE ARG 37 HE ARG 37 5.277 -6.381 20.408 265 HH11 ARG 37 HH21 ARG 37 6.508 -8.234 17.654 266 HH12 ARG 37 HH22 ARG 37 6.312 -9.753 18.493 267 HH21 ARG 37 HH11 ARG 37 4.961 -8.357 21.339 268 HH22 ARG 37 HH12 ARG 37 5.439 -9.819 20.511 269 H PHE 38 H PHE 38 10.353 -3.931 15.224 270 HA PHE 38 HA PHE 38 10.598 -6.658 14.375 271 HB2 PHE 38 HB2 PHE 38 11.995 -4.150 13.349 272 HB3 PHE 38 HB3 PHE 38 11.985 -5.711 12.526 273 HD1 PHE 38 HD2 PHE 38 9.162 -6.587 12.792 274 HD2 PHE 38 HD1 PHE 38 10.812 -2.702 11.961 275 HE1 PHE 38 HE2 PHE 38 7.080 -5.963 11.582 276 HE2 PHE 38 HE1 PHE 38 8.737 -2.072 10.751 277 HZ PHE 38 HZ PHE 38 6.870 -3.702 10.553 278 H TYR 39 H TYR 39 12.805 -4.515 16.092 279 HA TYR 39 HA TYR 39 15.106 -6.271 15.509 280 HB2 TYR 39 HB2 TYR 39 14.939 -3.842 17.321 281 HB3 TYR 39 HB3 TYR 39 16.400 -4.586 16.652 282 HD1 TYR 39 HD2 TYR 39 16.506 -4.660 13.981 283 HD2 TYR 39 HD1 TYR 39 13.992 -2.000 16.236 284 HE1 TYR 39 HE2 TYR 39 16.329 -3.143 12.006 285 HE2 TYR 39 HE1 TYR 39 13.794 -0.503 14.250 286 HH TYR 39 HH TYR 39 15.452 -1.211 11.168 287 H LEU 40 H LEU 40 12.651 -5.845 17.876 288 HA LEU 40 HA LEU 40 14.280 -7.005 20.045 289 HB2 LEU 40 HB2 LEU 40 11.401 -6.035 19.940 290 HB3 LEU 40 HB3 LEU 40 12.230 -6.569 21.403 291 HG LEU 40 HG LEU 40 13.211 -4.231 19.728 292 HD11 LEU 40 HD11 LEU 40 12.097 -2.753 21.350 293 HD12 LEU 40 HD12 LEU 40 11.335 -4.167 22.119 294 HD13 LEU 40 HD13 LEU 40 10.934 -3.727 20.440 295 HD21 LEU 40 HD21 LEU 40 13.718 -5.046 22.615 296 HD22 LEU 40 HD22 LEU 40 14.348 -3.583 21.820 297 HD23 LEU 40 HD23 LEU 40 14.868 -5.184 21.263 298 H GLN 41 H GLN 41 11.307 -7.790 18.171 299 HA GLN 41 HA GLN 41 11.791 -10.639 18.923 300 HB2 GLN 41 HB2 GLN 41 9.098 -9.254 18.655 301 HB3 GLN 41 HB3 GLN 41 9.338 -11.004 18.777 302 HG2 GLN 41 HG2 GLN 41 10.536 -10.591 20.970 303 HG3 GLN 41 HG3 GLN 41 9.981 -8.914 20.877 304 HE21 GLN 41 HE21 GLN 41 9.148 -9.886 23.037 305 HE22 GLN 41 HE22 GLN 41 7.511 -10.493 22.984 306 HA PRO 42 HA PRO 42 11.510 -11.058 14.500 307 HB2 PRO 42 HB2 PRO 42 10.625 -13.635 14.192 308 HB3 PRO 42 HB3 PRO 42 12.320 -13.256 14.641 309 HG2 PRO 42 HG2 PRO 42 10.012 -14.022 16.423 310 HG3 PRO 42 HG3 PRO 42 11.675 -14.690 16.383 311 HD2 PRO 42 HD2 PRO 42 10.922 -12.808 18.182 312 HD3 PRO 42 HD3 PRO 42 12.573 -12.822 17.469 313 H LEU 43 H LEU 43 9.770 -10.617 13.086 314 HA LEU 43 HA LEU 43 7.323 -9.991 14.430 315 HB2 LEU 43 HB2 LEU 43 6.562 -9.081 12.334 316 HB3 LEU 43 HB3 LEU 43 8.187 -8.554 12.723 317 HG LEU 43 HG LEU 43 8.545 -10.778 11.029 318 HD11 LEU 43 HD11 LEU 43 6.370 -8.908 9.994 319 HD12 LEU 43 HD12 LEU 43 6.170 -10.627 10.400 320 HD13 LEU 43 HD13 LEU 43 7.211 -10.159 9.043 321 HD21 LEU 43 HD21 LEU 43 9.451 -9.109 9.490 322 HD22 LEU 43 HD22 LEU 43 9.940 -8.744 11.155 323 HD23 LEU 43 HD23 LEU 43 8.639 -7.805 10.391 324 HA PRO 44 HA PRO 44 5.309 -13.890 13.518 325 HB2 PRO 44 HB2 PRO 44 2.917 -13.417 14.739 326 HB3 PRO 44 HB3 PRO 44 4.416 -13.692 15.684 327 HG2 PRO 44 HG2 PRO 44 3.136 -11.103 14.885 328 HG3 PRO 44 HG3 PRO 44 3.648 -11.649 16.512 329 HD2 PRO 44 HD2 PRO 44 5.201 -10.059 14.983 330 HD3 PRO 44 HD3 PRO 44 5.907 -11.335 16.030 331 HA PRO 45 HA PRO 45 2.944 -12.925 9.900 332 HB2 PRO 45 HB2 PRO 45 0.856 -14.684 9.857 333 HB3 PRO 45 HB3 PRO 45 2.548 -15.192 9.588 334 HG2 PRO 45 HG2 PRO 45 0.971 -15.258 12.145 335 HG3 PRO 45 HG3 PRO 45 1.873 -16.585 11.339 336 HD2 PRO 45 HD2 PRO 45 3.017 -15.202 13.316 337 HD3 PRO 45 HD3 PRO 45 3.971 -15.612 11.849 338 H THR 46 H THR 46 1.325 -12.714 12.996 339 HA THR 46 HA THR 46 -1.067 -11.399 12.016 340 HB THR 46 HB THR 46 -1.018 -10.571 14.511 341 HG1 THR 46 HG1 THR 46 0.397 -11.744 15.790 342 HG21 THR 46 HG21 THR 46 -1.821 -12.760 15.296 343 HG22 THR 46 HG22 THR 46 -1.094 -13.555 13.882 344 HG23 THR 46 HG23 THR 46 -2.453 -12.423 13.671 345 H GLU 47 H GLU 47 2.114 -10.297 13.291 346 HA GLU 47 HA GLU 47 1.353 -7.490 13.014 347 HB2 GLU 47 HB2 GLU 47 3.992 -8.856 13.579 348 HB3 GLU 47 HB3 GLU 47 3.781 -7.098 13.495 349 HG2 GLU 47 HG2 GLU 47 2.067 -7.226 15.272 350 HG3 GLU 47 HG3 GLU 47 2.344 -8.968 15.402 351 H ALA 48 H ALA 48 2.537 -9.938 10.910 352 HA ALA 48 HA ALA 48 3.774 -8.210 8.971 353 HB1 ALA 48 HB1 ALA 48 3.423 -10.053 7.398 354 HB2 ALA 48 HB2 ALA 48 4.017 -10.688 8.950 355 HB3 ALA 48 HB3 ALA 48 2.297 -10.838 8.525 356 H ALA 49 H ALA 49 0.447 -8.664 10.000 357 HA ALA 49 HA ALA 49 -0.778 -7.703 7.554 358 HB1 ALA 49 HB1 ALA 49 -1.837 -7.537 10.410 359 HB2 ALA 49 HB2 ALA 49 -2.783 -7.410 8.911 360 HB3 ALA 49 HB3 ALA 49 -2.013 -8.954 9.348 361 H GLN 50 H GLN 50 0.609 -6.200 10.454 362 HA GLN 50 HA GLN 50 -0.317 -3.532 9.805 363 HB2 GLN 50 HB2 GLN 50 2.019 -4.442 11.532 364 HB3 GLN 50 HB3 GLN 50 1.376 -2.806 11.450 365 HG2 GLN 50 HG2 GLN 50 -0.840 -4.476 12.016 366 HG3 GLN 50 HG3 GLN 50 0.482 -5.042 13.048 367 HE21 GLN 50 HE21 GLN 50 0.377 -4.144 15.002 368 HE22 GLN 50 HE22 GLN 50 -0.093 -2.497 15.340 369 H ARG 51 H ARG 51 2.546 -5.518 9.034 370 HA ARG 51 HA ARG 51 3.966 -3.387 7.673 371 HB2 ARG 51 HB2 ARG 51 4.052 -6.402 7.290 372 HB3 ARG 51 HB3 ARG 51 5.103 -5.255 6.470 373 HG2 ARG 51 HG2 ARG 51 5.919 -4.491 8.713 374 HG3 ARG 51 HG3 ARG 51 4.986 -5.815 9.446 375 HD2 ARG 51 HD2 ARG 51 7.286 -6.534 9.109 376 HD3 ARG 51 HD3 ARG 51 6.219 -7.424 7.998 377 HE ARG 51 HE ARG 51 7.218 -5.048 6.743 378 HH11 ARG 51 HH11 ARG 51 8.223 -8.317 7.586 379 HH12 ARG 51 HH12 ARG 51 9.389 -8.387 6.295 380 HH21 ARG 51 HH21 ARG 51 8.707 -5.205 5.124 381 HH22 ARG 51 HH22 ARG 51 9.659 -6.649 4.926 382 H ALA 52 H ALA 52 1.667 -5.906 6.603 383 HA ALA 52 HA ALA 52 1.761 -5.293 3.841 384 HB1 ALA 52 HB1 ALA 52 0.671 -7.325 4.790 385 HB2 ALA 52 HB2 ALA 52 -0.614 -6.306 5.484 386 HB3 ALA 52 HB3 ALA 52 -0.432 -6.429 3.719 387 H LYS 53 H LYS 53 -0.117 -3.829 6.510 388 HA LYS 53 HA LYS 53 -1.791 -2.161 4.977 389 HB2 LYS 53 HB2 LYS 53 -1.731 -2.663 7.493 390 HB3 LYS 53 HB3 LYS 53 -0.480 -1.420 7.610 391 HG2 LYS 53 HG2 LYS 53 -2.038 0.215 6.675 392 HG3 LYS 53 HG3 LYS 53 -3.277 -1.052 6.585 393 HD2 LYS 53 HD2 LYS 53 -3.104 -1.381 9.033 394 HD3 LYS 53 HD3 LYS 53 -1.902 -0.075 9.114 395 HE2 LYS 53 HE2 LYS 53 -3.571 1.522 8.239 396 HE3 LYS 53 HE3 LYS 53 -4.772 0.214 8.134 397 HZ1 LYS 53 HZ1 LYS 53 -5.021 1.503 10.173 398 HZ2 LYS 53 HZ2 LYS 53 -3.480 1.144 10.639 399 HZ3 LYS 53 HZ3 LYS 53 -4.608 -0.053 10.533 400 H VAL 54 H VAL 54 1.576 -1.647 6.115 401 HA VAL 54 HA VAL 54 1.723 1.052 5.043 402 HB VAL 54 HB VAL 54 3.941 -0.862 5.932 403 HG11 VAL 54 HG11 VAL 54 4.862 0.881 4.470 404 HG12 VAL 54 HG12 VAL 54 4.006 2.143 5.387 405 HG13 VAL 54 HG13 VAL 54 5.318 1.215 6.152 406 HG21 VAL 54 HG21 VAL 54 2.519 1.404 7.407 407 HG22 VAL 54 HG22 VAL 54 2.399 -0.331 7.772 408 HG23 VAL 54 HG23 VAL 54 3.935 0.515 8.015 409 H SER 55 H SER 55 2.853 -2.185 3.935 410 HA SER 55 HA SER 55 4.182 -1.245 1.594 411 HB2 SER 55 HB2 SER 55 2.768 -3.894 2.100 412 HB3 SER 55 HB3 SER 55 3.953 -3.581 0.813 413 HG SER 55 HG SER 55 4.699 -4.544 2.950 414 H ALA 56 H ALA 56 0.780 -1.955 2.267 415 HA ALA 56 HA ALA 56 -0.136 -1.726 -0.458 416 HB1 ALA 56 HB1 ALA 56 -1.653 -1.209 2.124 417 HB2 ALA 56 HB2 ALA 56 -2.329 -1.638 0.542 418 HB3 ALA 56 HB3 ALA 56 -1.373 -2.822 1.435 419 H SER 57 H SER 57 0.444 0.602 2.176 420 HA SER 57 HA SER 57 -0.974 2.765 0.950 421 HB2 SER 57 HB2 SER 57 -0.296 2.651 3.358 422 HB3 SER 57 HB3 SER 57 1.387 2.921 2.860 423 HG SER 57 HG SER 57 0.571 4.883 1.821 424 H GLU 58 H GLU 58 2.298 1.480 0.475 425 HA GLU 58 HA GLU 58 3.359 3.800 -0.852 426 HB2 GLU 58 HB2 GLU 58 4.064 0.964 -0.503 427 HB3 GLU 58 HB3 GLU 58 4.585 1.639 -2.043 428 HG2 GLU 58 HG2 GLU 58 5.266 2.714 0.712 429 HG3 GLU 58 HG3 GLU 58 6.367 1.885 -0.402 430 H ILE 59 H ILE 59 1.335 1.133 -1.930 431 HA ILE 59 HA ILE 59 1.661 1.571 -4.758 432 HB ILE 59 HB ILE 59 -0.617 0.327 -3.157 433 HG12 ILE 59 HG12 ILE 59 1.531 -0.968 -4.879 434 HG13 ILE 59 HG13 ILE 59 1.721 -0.708 -3.147 435 HG21 ILE 59 HG21 ILE 59 -1.493 1.119 -5.351 436 HG22 ILE 59 HG22 ILE 59 -0.185 0.253 -6.183 437 HG23 ILE 59 HG23 ILE 59 -1.430 -0.645 -5.289 438 HD11 ILE 59 HD11 ILE 59 -0.362 -2.474 -4.453 439 HD12 ILE 59 HD12 ILE 59 1.078 -2.991 -3.553 440 HD13 ILE 59 HD13 ILE 59 -0.236 -2.145 -2.711 441 H LEU 60 H LEU 60 -0.295 3.182 -2.279 442 HA LEU 60 HA LEU 60 -2.039 4.586 -4.095 443 HB2 LEU 60 HB2 LEU 60 -1.041 5.491 -1.378 444 HB3 LEU 60 HB3 LEU 60 -2.479 6.063 -2.202 445 HG LEU 60 HG LEU 60 -2.114 3.222 -1.179 446 HD11 LEU 60 HD11 LEU 60 -3.564 3.898 0.682 447 HD12 LEU 60 HD12 LEU 60 -3.610 5.565 0.062 448 HD13 LEU 60 HD13 LEU 60 -2.083 4.875 0.658 449 HD21 LEU 60 HD21 LEU 60 -4.539 3.072 -1.425 450 HD22 LEU 60 HD22 LEU 60 -3.760 3.411 -2.982 451 HD23 LEU 60 HD23 LEU 60 -4.581 4.716 -2.089 452 H ASN 61 H ASN 61 1.298 4.972 -3.219 453 HA ASN 61 HA ASN 61 1.543 7.797 -3.777 454 HB2 ASN 61 HB2 ASN 61 3.032 6.027 -2.431 455 HB3 ASN 61 HB3 ASN 61 3.857 5.887 -3.988 456 HD21 ASN 61 HD21 ASN 61 5.297 6.708 -1.910 457 HD22 ASN 61 HD22 ASN 61 5.613 8.428 -2.012 458 H VAL 62 H VAL 62 0.828 5.321 -5.882 459 HA VAL 62 HA VAL 62 2.645 5.739 -8.037 460 HB VAL 62 HB VAL 62 1.040 3.800 -7.746 461 HG11 VAL 62 HG11 VAL 62 -0.994 5.146 -7.263 462 HG12 VAL 62 HG12 VAL 62 -1.013 5.686 -8.963 463 HG13 VAL 62 HG13 VAL 62 -1.230 3.967 -8.564 464 HG21 VAL 62 HG21 VAL 62 0.917 5.152 -10.468 465 HG22 VAL 62 HG22 VAL 62 2.283 4.192 -9.853 466 HG23 VAL 62 HG23 VAL 62 0.703 3.428 -10.124 467 H LYS 63 H LYS 63 0.134 7.836 -6.869 468 HA LYS 63 HA LYS 63 -0.551 9.127 -9.318 469 HB2 LYS 63 HB2 LYS 63 -1.135 9.479 -6.609 470 HB3 LYS 63 HB3 LYS 63 -0.313 10.978 -7.062 471 HG2 LYS 63 HG2 LYS 63 -2.689 9.796 -8.562 472 HG3 LYS 63 HG3 LYS 63 -2.828 11.029 -7.299 473 HD2 LYS 63 HD2 LYS 63 -1.492 12.600 -8.650 474 HD3 LYS 63 HD3 LYS 63 -1.294 11.365 -9.908 475 HE2 LYS 63 HE2 LYS 63 -3.757 11.279 -10.209 476 HE3 LYS 63 HE3 LYS 63 -3.935 12.579 -9.013 477 HZ1 LYS 63 HZ1 LYS 63 -2.313 12.884 -11.469 478 HZ2 LYS 63 HZ2 LYS 63 -2.840 14.078 -10.462 479 HZ3 LYS 63 HZ3 LYS 63 -3.917 13.263 -11.426 480 H GLN 64 H GLN 64 2.377 9.283 -7.356 481 HA GLN 64 HA GLN 64 3.393 11.721 -8.488 482 HB2 GLN 64 HB2 GLN 64 4.865 9.312 -7.364 483 HB3 GLN 64 HB3 GLN 64 5.593 10.885 -7.705 484 HG2 GLN 64 HG2 GLN 64 3.368 10.382 -5.688 485 HG3 GLN 64 HG3 GLN 64 5.081 10.565 -5.302 486 HE21 GLN 64 HE21 GLN 64 5.921 12.569 -5.048 487 HE22 GLN 64 HE22 GLN 64 5.021 14.045 -5.301 488 H PHE 65 H PHE 65 3.383 8.351 -9.678 489 HA PHE 65 HA PHE 65 5.385 8.802 -11.706 490 HB2 PHE 65 HB2 PHE 65 5.071 6.569 -11.793 491 HB3 PHE 65 HB3 PHE 65 3.491 6.678 -11.016 492 HD1 PHE 65 HD1 PHE 65 5.267 6.783 -14.290 493 HD2 PHE 65 HD2 PHE 65 1.444 6.678 -12.310 494 HE1 PHE 65 HE1 PHE 65 4.143 6.444 -16.482 495 HE2 PHE 65 HE2 PHE 65 0.317 6.346 -14.500 496 HZ PHE 65 HZ PHE 65 1.659 6.263 -16.592 497 H ILE 66 H ILE 66 1.914 9.457 -11.453 498 HA ILE 66 HA ILE 66 1.449 9.733 -14.259 499 HB ILE 66 HB ILE 66 -0.115 10.996 -11.945 500 HG12 ILE 66 HG12 ILE 66 -0.476 8.343 -13.402 501 HG13 ILE 66 HG13 ILE 66 0.141 8.526 -11.762 502 HG21 ILE 66 HG21 ILE 66 -2.008 11.095 -13.552 503 HG22 ILE 66 HG22 ILE 66 -0.631 12.008 -14.189 504 HG23 ILE 66 HG23 ILE 66 -0.987 10.385 -14.823 505 HD11 ILE 66 HD11 ILE 66 -2.105 7.821 -11.547 506 HD12 ILE 66 HD12 ILE 66 -2.112 9.551 -11.151 507 HD13 ILE 66 HD13 ILE 66 -2.678 8.995 -12.743 508 H ASP 67 H ASP 67 2.639 11.979 -11.765 509 HA ASP 67 HA ASP 67 2.623 14.208 -13.650 510 HB2 ASP 67 HB2 ASP 67 2.521 14.464 -11.145 511 HB3 ASP 67 HB3 ASP 67 4.230 13.994 -11.102 512 H ARG 68 H ARG 68 4.989 11.797 -12.509 513 HA ARG 68 HA ARG 68 7.282 12.951 -13.814 514 HB2 ARG 68 HB2 ARG 68 6.589 10.108 -13.018 515 HB3 ARG 68 HB3 ARG 68 8.133 10.544 -13.751 516 HG2 ARG 68 HG2 ARG 68 8.695 11.981 -11.903 517 HG3 ARG 68 HG3 ARG 68 7.095 11.749 -11.171 518 HD2 ARG 68 HD2 ARG 68 7.531 9.362 -10.886 519 HD3 ARG 68 HD3 ARG 68 9.099 9.529 -11.702 520 HE ARG 68 HE ARG 68 9.079 11.332 -9.535 521 HH11 ARG 68 HH21 ARG 68 9.019 7.824 -9.983 522 HH12 ARG 68 HH22 ARG 68 9.835 7.524 -8.475 523 HH21 ARG 68 HH11 ARG 68 10.133 10.869 -7.631 524 HH22 ARG 68 HH12 ARG 68 10.451 9.219 -7.169 525 H LYS 69 H LYS 69 4.639 10.969 -14.979 526 HA LYS 69 HA LYS 69 4.062 10.186 -17.057 527 HB2 LYS 69 HB2 LYS 69 5.850 12.465 -17.975 528 HB3 LYS 69 HB3 LYS 69 4.730 11.585 -19.015 529 HG2 LYS 69 HG2 LYS 69 2.833 12.524 -18.012 530 HG3 LYS 69 HG3 LYS 69 3.682 12.857 -16.498 531 HD2 LYS 69 HD2 LYS 69 5.012 14.620 -17.623 532 HD3 LYS 69 HD3 LYS 69 4.082 14.342 -19.108 533 HE2 LYS 69 HE2 LYS 69 3.162 16.269 -17.927 534 HE3 LYS 69 HE3 LYS 69 1.986 14.943 -17.879 535 HZ1 LYS 69 HZ1 LYS 69 2.555 14.515 -15.620 536 HZ2 LYS 69 HZ2 LYS 69 2.326 16.146 -15.721 537 HZ3 LYS 69 HZ3 LYS 69 3.852 15.525 -15.639 538 H ALA 70 H ALA 70 6.297 9.007 -15.685 539 HA ALA 70 HA ALA 70 8.265 8.260 -17.723 540 HB1 ALA 70 HB1 ALA 70 9.235 6.886 -15.914 541 HB2 ALA 70 HB2 ALA 70 8.925 8.541 -15.348 542 HB3 ALA 70 HB3 ALA 70 7.823 7.219 -14.882 543 H TRP 71 H TRP 71 6.329 7.556 -19.103 544 HA TRP 71 HA TRP 71 4.566 5.569 -18.519 545 HB2 TRP 71 HB2 TRP 71 5.871 5.714 -21.234 546 HB3 TRP 71 HB3 TRP 71 4.218 5.294 -20.833 547 HD1 TRP 71 HD1 TRP 71 6.201 8.099 -22.069 548 HE1 TRP 71 HE1 TRP 71 4.992 10.328 -21.955 549 HE3 TRP 71 HE3 TRP 71 2.428 6.692 -18.916 550 HZ2 TRP 71 HZ2 TRP 71 2.653 11.371 -20.708 551 HZ3 TRP 71 HZ3 TRP 71 0.702 8.390 -18.281 552 HH2 TRP 71 HH2 TRP 71 0.839 10.717 -19.178 553 HA PRO 72 HA PRO 72 6.843 1.878 -19.914 554 HB2 PRO 72 HB2 PRO 72 9.493 1.661 -20.421 555 HB3 PRO 72 HB3 PRO 72 8.355 2.329 -21.638 556 HG2 PRO 72 HG2 PRO 72 10.118 3.805 -19.689 557 HG3 PRO 72 HG3 PRO 72 9.964 4.031 -21.461 558 HD2 PRO 72 HD2 PRO 72 8.615 5.579 -19.675 559 HD3 PRO 72 HD3 PRO 72 7.911 5.120 -21.264 560 H SER 73 H SER 73 8.518 3.925 -17.628 561 HA SER 73 HA SER 73 9.993 1.840 -16.295 562 HB2 SER 73 HB2 SER 73 9.140 4.554 -15.231 563 HB3 SER 73 HB3 SER 73 10.525 3.575 -14.696 564 HG SER 73 HG SER 73 11.513 3.946 -16.661 565 H LEU 74 H LEU 74 6.701 2.903 -16.134 566 HA LEU 74 HA LEU 74 6.180 2.493 -13.402 567 HB2 LEU 74 HB2 LEU 74 4.685 3.622 -15.067 568 HB3 LEU 74 HB3 LEU 74 4.278 2.032 -15.726 569 HG LEU 74 HG LEU 74 3.359 1.366 -13.534 570 HD11 LEU 74 HD11 LEU 74 4.630 2.712 -11.975 571 HD12 LEU 74 HD12 LEU 74 2.942 3.220 -11.839 572 HD13 LEU 74 HD13 LEU 74 4.093 4.211 -12.754 573 HD21 LEU 74 HD21 LEU 74 2.185 3.938 -14.479 574 HD22 LEU 74 HD22 LEU 74 1.384 2.658 -13.547 575 HD23 LEU 74 HD23 LEU 74 1.915 2.345 -15.196 576 H GLN 75 H GLN 75 6.229 0.131 -16.065 577 HA GLN 75 HA GLN 75 4.976 -2.005 -14.755 578 HB2 GLN 75 HB2 GLN 75 5.777 -1.846 -17.171 579 HB3 GLN 75 HB3 GLN 75 7.372 -2.334 -16.588 580 HG2 GLN 75 HG2 GLN 75 6.485 -4.429 -15.764 581 HG3 GLN 75 HG3 GLN 75 4.825 -3.908 -16.084 582 HE21 GLN 75 HE21 GLN 75 3.979 -4.954 -17.718 583 HE22 GLN 75 HE22 GLN 75 4.827 -5.438 -19.171 584 H ASN 76 H ASN 76 8.176 -0.673 -14.186 585 HA ASN 76 HA ASN 76 8.854 -3.005 -12.456 586 HB2 ASN 76 HB2 ASN 76 10.600 -2.045 -13.976 587 HB3 ASN 76 HB3 ASN 76 10.487 -0.519 -13.086 588 HD21 ASN 76 HD21 ASN 76 12.265 -0.330 -11.897 589 HD22 ASN 76 HD22 ASN 76 12.935 -1.587 -10.888 590 H ASP 77 H ASP 77 8.509 0.568 -12.319 591 HA ASP 77 HA ASP 77 9.081 0.869 -9.592 592 HB2 ASP 77 HB2 ASP 77 8.880 2.641 -11.386 593 HB3 ASP 77 HB3 ASP 77 7.123 2.534 -11.219 594 H LEU 78 H LEU 78 5.818 0.473 -11.083 595 HA LEU 78 HA LEU 78 4.522 0.652 -8.482 596 HB2 LEU 78 HB2 LEU 78 3.479 1.317 -10.601 597 HB3 LEU 78 HB3 LEU 78 3.525 -0.341 -11.170 598 HG LEU 78 HG LEU 78 1.886 -0.997 -9.497 599 HD11 LEU 78 HD11 LEU 78 0.705 0.859 -8.200 600 HD12 LEU 78 HD12 LEU 78 2.114 1.877 -8.563 601 HD13 LEU 78 HD13 LEU 78 2.311 0.391 -7.612 602 HD21 LEU 78 HD21 LEU 78 1.131 -0.164 -11.679 603 HD22 LEU 78 HD22 LEU 78 1.140 1.504 -11.071 604 HD23 LEU 78 HD23 LEU 78 -0.015 0.324 -10.416 605 H ARG 79 H ARG 79 5.567 -1.998 -10.623 606 HA ARG 79 HA ARG 79 4.078 -3.927 -9.045 607 HB2 ARG 79 HB2 ARG 79 6.131 -4.422 -11.201 608 HB3 ARG 79 HB3 ARG 79 4.994 -5.600 -10.520 609 HG2 ARG 79 HG2 ARG 79 3.181 -3.791 -11.206 610 HG3 ARG 79 HG3 ARG 79 4.433 -3.234 -12.318 611 HD2 ARG 79 HD2 ARG 79 3.223 -6.011 -12.176 612 HD3 ARG 79 HD3 ARG 79 2.908 -4.782 -13.414 613 HE ARG 79 HE ARG 79 5.703 -5.277 -13.329 614 HH11 ARG 79 HH21 ARG 79 2.698 -6.864 -14.362 615 HH12 ARG 79 HH22 ARG 79 3.543 -7.895 -15.500 616 HH21 ARG 79 HH11 ARG 79 6.686 -6.619 -14.810 617 HH22 ARG 79 HH12 ARG 79 5.748 -7.733 -15.769 618 H LEU 80 H LEU 80 7.239 -2.532 -8.742 619 HA LEU 80 HA LEU 80 8.361 -4.605 -7.060 620 HB2 LEU 80 HB2 LEU 80 8.754 -1.623 -7.344 621 HB3 LEU 80 HB3 LEU 80 9.484 -2.478 -5.989 622 HG LEU 80 HG LEU 80 10.000 -3.233 -8.880 623 HD11 LEU 80 HD11 LEU 80 12.120 -1.993 -8.638 624 HD12 LEU 80 HD12 LEU 80 11.608 -1.426 -7.031 625 HD13 LEU 80 HD13 LEU 80 10.714 -0.919 -8.485 626 HD21 LEU 80 HD21 LEU 80 11.464 -3.885 -6.285 627 HD22 LEU 80 HD22 LEU 80 12.001 -4.338 -7.919 628 HD23 LEU 80 HD23 LEU 80 10.502 -5.015 -7.264 629 H ARG 81 H ARG 81 6.230 -1.782 -6.486 630 HA ARG 81 HA ARG 81 6.072 -2.168 -3.626 631 HB2 ARG 81 HB2 ARG 81 4.152 -0.851 -5.577 632 HB3 ARG 81 HB3 ARG 81 4.024 -0.753 -3.820 633 HG2 ARG 81 HG2 ARG 81 6.044 0.473 -3.643 634 HG3 ARG 81 HG3 ARG 81 6.476 0.167 -5.335 635 HD2 ARG 81 HD2 ARG 81 4.744 1.568 -6.146 636 HD3 ARG 81 HD3 ARG 81 3.955 1.622 -4.558 637 HE ARG 81 HE ARG 81 5.482 3.201 -3.793 638 HH11 ARG 81 HH11 ARG 81 6.566 2.066 -6.977 639 HH12 ARG 81 HH12 ARG 81 7.743 3.347 -7.125 640 HH21 ARG 81 HH21 ARG 81 6.987 4.721 -4.017 641 HH22 ARG 81 HH22 ARG 81 7.974 4.833 -5.466 642 H ALA 82 H ALA 82 4.215 -3.344 -6.404 643 HA ALA 82 HA ALA 82 2.162 -4.648 -4.937 644 HB1 ALA 82 HB1 ALA 82 2.203 -4.229 -7.433 645 HB2 ALA 82 HB2 ALA 82 3.366 -5.564 -7.582 646 HB3 ALA 82 HB3 ALA 82 1.733 -5.879 -6.975 647 H SER 83 H SER 83 5.447 -5.775 -5.927 648 HA SER 83 HA SER 83 4.946 -8.442 -4.960 649 HB2 SER 83 HB2 SER 83 7.304 -8.849 -5.275 650 HB3 SER 83 HB3 SER 83 6.679 -7.920 -6.652 651 HG SER 83 HG SER 83 8.525 -6.914 -6.074 652 H TYR 84 H TYR 84 6.343 -5.504 -3.436 653 HA TYR 84 HA TYR 84 7.180 -6.818 -1.033 654 HB2 TYR 84 HB2 TYR 84 6.278 -3.988 -1.637 655 HB3 TYR 84 HB3 TYR 84 6.644 -4.503 0.011 656 HD1 TYR 84 HD1 TYR 84 9.001 -5.882 0.194 657 HD2 TYR 84 HD2 TYR 84 8.045 -2.906 -2.763 658 HE1 TYR 84 HE1 TYR 84 11.434 -5.443 -0.162 659 HE2 TYR 84 HE2 TYR 84 10.475 -2.476 -3.111 660 HH TYR 84 HH TYR 84 12.611 -2.999 -2.474 661 H LEU 85 H LEU 85 4.038 -5.314 -1.940 662 HA LEU 85 HA LEU 85 2.751 -5.898 0.542 663 HB2 LEU 85 HB2 LEU 85 1.760 -4.369 -1.102 664 HB3 LEU 85 HB3 LEU 85 1.628 -5.681 -2.272 665 HG LEU 85 HG LEU 85 -0.034 -6.823 -0.863 666 HD11 LEU 85 HD11 LEU 85 -1.059 -5.572 1.058 667 HD12 LEU 85 HD12 LEU 85 0.297 -4.425 0.976 668 HD13 LEU 85 HD13 LEU 85 0.593 -6.134 1.365 669 HD21 LEU 85 HD21 LEU 85 -1.878 -5.279 -1.216 670 HD22 LEU 85 HD22 LEU 85 -0.745 -5.187 -2.580 671 HD23 LEU 85 HD23 LEU 85 -0.749 -3.912 -1.339 672 H ARG 86 H ARG 86 3.129 -7.749 -2.452 673 HA ARG 86 HA ARG 86 1.459 -9.912 -1.680 674 HB2 ARG 86 HB2 ARG 86 2.470 -9.369 -3.975 675 HB3 ARG 86 HB3 ARG 86 3.919 -10.214 -3.420 676 HG2 ARG 86 HG2 ARG 86 2.656 -12.277 -3.148 677 HG3 ARG 86 HG3 ARG 86 1.133 -11.422 -3.460 678 HD2 ARG 86 HD2 ARG 86 1.682 -12.530 -5.486 679 HD3 ARG 86 HD3 ARG 86 2.042 -10.818 -5.745 680 HE ARG 86 HE ARG 86 4.435 -11.352 -5.363 681 HH11 ARG 86 HH11 ARG 86 2.325 -14.056 -6.229 682 HH12 ARG 86 HH12 ARG 86 3.652 -15.014 -6.828 683 HH21 ARG 86 HH21 ARG 86 6.068 -12.639 -6.139 684 HH22 ARG 86 HH22 ARG 86 5.726 -14.223 -6.781 685 H TYR 87 H TYR 87 4.958 -9.349 -1.046 686 HA TYR 87 HA TYR 87 5.396 -11.980 0.010 687 HB2 TYR 87 HB2 TYR 87 6.825 -9.374 0.654 688 HB3 TYR 87 HB3 TYR 87 7.392 -10.986 1.098 689 HD1 TYR 87 HD2 TYR 87 6.866 -12.540 -1.424 690 HD2 TYR 87 HD1 TYR 87 8.458 -8.575 -0.862 691 HE1 TYR 87 HE2 TYR 87 8.048 -12.692 -3.614 692 HE2 TYR 87 HE1 TYR 87 9.633 -8.743 -3.053 693 HH TYR 87 HH TYR 87 10.109 -10.069 -4.859 694 H ASP 88 H ASP 88 4.573 -8.871 1.650 695 HA ASP 88 HA ASP 88 4.582 -10.016 4.282 696 HB2 ASP 88 HB2 ASP 88 3.141 -7.619 3.084 697 HB3 ASP 88 HB3 ASP 88 2.956 -8.087 4.782 698 H LEU 89 H LEU 89 1.919 -9.400 1.950 699 HA LEU 89 HA LEU 89 -0.112 -10.421 3.642 700 HB2 LEU 89 HB2 LEU 89 -0.270 -8.925 1.624 701 HB3 LEU 89 HB3 LEU 89 -0.105 -10.348 0.616 702 HG LEU 89 HG LEU 89 -2.278 -11.029 0.987 703 HD11 LEU 89 HD11 LEU 89 -3.709 -10.156 2.896 704 HD12 LEU 89 HD12 LEU 89 -2.230 -9.484 3.605 705 HD13 LEU 89 HD13 LEU 89 -2.396 -11.238 3.380 706 HD21 LEU 89 HD21 LEU 89 -2.418 -8.021 1.475 707 HD22 LEU 89 HD22 LEU 89 -3.665 -9.041 0.723 708 HD23 LEU 89 HD23 LEU 89 -2.121 -8.779 -0.105 709 H LYS 90 H LYS 90 1.967 -12.107 1.294 710 HA LYS 90 HA LYS 90 0.565 -14.575 1.194 711 HB2 LYS 90 HB2 LYS 90 2.431 -14.028 -0.297 712 HB3 LYS 90 HB3 LYS 90 3.532 -13.896 1.073 713 HG2 LYS 90 HG2 LYS 90 3.996 -15.944 -0.047 714 HG3 LYS 90 HG3 LYS 90 3.239 -16.325 1.503 715 HD2 LYS 90 HD2 LYS 90 1.028 -16.241 -0.087 716 HD3 LYS 90 HD3 LYS 90 2.245 -16.756 -1.270 717 HE2 LYS 90 HE2 LYS 90 1.706 -18.023 1.433 718 HE3 LYS 90 HE3 LYS 90 1.159 -18.666 -0.132 719 HZ1 LYS 90 HZ1 LYS 90 3.497 -18.909 -0.769 720 HZ2 LYS 90 HZ2 LYS 90 3.190 -19.759 0.610 721 HZ3 LYS 90 HZ3 LYS 90 3.993 -18.321 0.691 722 H THR 91 H THR 91 2.624 -13.124 3.660 723 HA THR 91 HA THR 91 2.820 -15.612 5.201 724 HB THR 91 HB THR 91 3.529 -12.766 6.049 725 HG1 THR 91 HG1 THR 91 4.796 -13.036 4.324 726 HG21 THR 91 HG21 THR 91 3.537 -14.385 7.875 727 HG22 THR 91 HG22 THR 91 5.199 -13.944 7.447 728 HG23 THR 91 HG23 THR 91 4.533 -15.502 6.914 729 H VAL 92 H VAL 92 1.031 -12.501 5.367 730 HA VAL 92 HA VAL 92 -0.220 -12.892 7.871 731 HB VAL 92 HB VAL 92 -1.342 -11.510 5.376 732 HG11 VAL 92 HG11 VAL 92 -3.177 -11.870 6.938 733 HG12 VAL 92 HG12 VAL 92 -2.181 -11.316 8.305 734 HG13 VAL 92 HG13 VAL 92 -2.692 -10.171 7.045 735 HG21 VAL 92 HG21 VAL 92 -0.487 -9.470 6.350 736 HG22 VAL 92 HG22 VAL 92 0.124 -10.377 7.753 737 HG23 VAL 92 HG23 VAL 92 0.826 -10.626 6.155 738 H ILE 93 H ILE 93 -1.282 -14.026 4.620 739 HA ILE 93 HA ILE 93 -3.860 -14.874 5.504 740 HB ILE 93 HB ILE 93 -3.887 -16.341 3.534 741 HG12 ILE 93 HG12 ILE 93 -1.124 -15.335 2.877 742 HG13 ILE 93 HG13 ILE 93 -1.428 -16.903 3.622 743 HG21 ILE 93 HG21 ILE 93 -4.465 -13.864 3.424 744 HG22 ILE 93 HG22 ILE 93 -2.814 -13.555 2.853 745 HG23 ILE 93 HG23 ILE 93 -3.923 -14.532 1.873 746 HD11 ILE 93 HD11 ILE 93 -1.152 -17.242 1.259 747 HD12 ILE 93 HD12 ILE 93 -2.870 -17.502 1.646 748 HD13 ILE 93 HD13 ILE 93 -2.344 -15.983 0.877 749 H SER 94 H SER 94 -0.879 -16.179 6.312 750 HA SER 94 HA SER 94 -1.917 -18.914 6.647 751 HB2 SER 94 HB2 SER 94 0.761 -17.680 7.331 752 HB3 SER 94 HB3 SER 94 0.364 -19.408 7.393 753 HG SER 94 HG SER 94 0.792 -17.729 5.201 754 H ALA 95 H ALA 95 -1.999 -16.035 8.458 755 HA ALA 95 HA ALA 95 -1.594 -17.229 11.084 756 HB1 ALA 95 HB1 ALA 95 -2.883 -14.578 10.293 757 HB2 ALA 95 HB2 ALA 95 -2.316 -15.036 11.917 758 HB3 ALA 95 HB3 ALA 95 -1.152 -14.829 10.591 759 H LYS 96 H LYS 96 -4.202 -17.297 8.895 760 HA LYS 96 HA LYS 96 -6.128 -18.048 11.069 761 HB2 LYS 96 HB2 LYS 96 -6.299 -15.871 9.084 762 HB3 LYS 96 HB3 LYS 96 -7.630 -17.015 8.930 763 HG2 LYS 96 HG2 LYS 96 -8.474 -15.368 10.360 764 HG3 LYS 96 HG3 LYS 96 -8.023 -16.679 11.457 765 HD2 LYS 96 HD2 LYS 96 -5.901 -15.488 11.979 766 HD3 LYS 96 HD3 LYS 96 -6.372 -14.176 10.889 767 HE2 LYS 96 HE2 LYS 96 -7.932 -15.052 13.364 768 HE3 LYS 96 HE3 LYS 96 -6.806 -13.689 13.315 769 HZ1 LYS 96 HZ1 LYS 96 -9.308 -13.880 11.721 770 HZ2 LYS 96 HZ2 LYS 96 -8.259 -12.603 11.701 771 HZ3 LYS 96 HZ3 LYS 96 -9.102 -12.958 13.071 772 HA PRO 97 HA PRO 97 -6.570 -21.552 8.474 773 HB2 PRO 97 HB2 PRO 97 -9.281 -21.980 8.106 774 HB3 PRO 97 HB3 PRO 97 -8.403 -22.380 9.619 775 HG2 PRO 97 HG2 PRO 97 -10.001 -19.928 8.963 776 HG3 PRO 97 HG3 PRO 97 -10.079 -20.970 10.413 777 HD2 PRO 97 HD2 PRO 97 -8.717 -18.669 10.435 778 HD3 PRO 97 HD3 PRO 97 -8.058 -20.125 11.257 779 H LYS 98 H LYS 98 -6.608 -22.059 6.299 780 HA LYS 98 HA LYS 98 -6.414 -19.760 4.642 781 HB2 LYS 98 HB2 LYS 98 -5.886 -22.625 4.430 782 HB3 LYS 98 HB3 LYS 98 -6.528 -21.967 2.923 783 HG2 LYS 98 HG2 LYS 98 -4.245 -21.695 2.640 784 HG3 LYS 98 HG3 LYS 98 -4.741 -20.094 3.226 785 HD2 LYS 98 HD2 LYS 98 -4.049 -20.735 5.522 786 HD3 LYS 98 HD3 LYS 98 -3.561 -22.333 4.915 787 HE2 LYS 98 HE2 LYS 98 -1.986 -21.140 3.326 788 HE3 LYS 98 HE3 LYS 98 -2.372 -19.633 4.190 789 HZ1 LYS 98 HZ1 LYS 98 -1.091 -22.057 5.313 790 HZ2 LYS 98 HZ2 LYS 98 -1.644 -20.816 6.246 791 HZ3 LYS 98 HZ3 LYS 98 -0.429 -20.550 5.165 792 H ASP 99 H ASP 99 -9.143 -21.946 5.049 793 HA ASP 99 HA ASP 99 -10.231 -21.611 2.456 794 HB2 ASP 99 HB2 ASP 99 -10.859 -23.353 4.150 795 HB3 ASP 99 HB3 ASP 99 -11.794 -22.113 4.999 796 H GLU 100 H GLU 100 -11.322 -19.957 5.497 797 HA GLU 100 HA GLU 100 -13.073 -18.132 4.204 798 HB2 GLU 100 HB2 GLU 100 -12.635 -16.698 6.251 799 HB3 GLU 100 HB3 GLU 100 -13.150 -18.353 6.601 800 HG2 GLU 100 HG2 GLU 100 -11.078 -18.992 7.423 801 HG3 GLU 100 HG3 GLU 100 -10.205 -17.762 6.523 802 H LYS 101 H LYS 101 -9.609 -18.216 4.555 803 HA LYS 101 HA LYS 101 -9.265 -15.434 3.978 804 HB2 LYS 101 HB2 LYS 101 -7.812 -17.142 5.331 805 HB3 LYS 101 HB3 LYS 101 -7.069 -17.466 3.767 806 HG2 LYS 101 HG2 LYS 101 -5.827 -15.814 5.005 807 HG3 LYS 101 HG3 LYS 101 -6.508 -15.153 3.513 808 HD2 LYS 101 HD2 LYS 101 -6.649 -13.545 5.457 809 HD3 LYS 101 HD3 LYS 101 -8.216 -13.919 4.749 810 HE2 LYS 101 HE2 LYS 101 -8.484 -15.677 6.606 811 HE3 LYS 101 HE3 LYS 101 -7.079 -14.926 7.370 812 HZ1 LYS 101 HZ1 LYS 101 -8.311 -12.931 7.671 813 HZ2 LYS 101 HZ2 LYS 101 -9.356 -14.152 8.090 814 HZ3 LYS 101 HZ3 LYS 101 -9.509 -13.398 6.638 815 H LYS 102 H LYS 102 -9.812 -18.106 2.015 816 HA LYS 102 HA LYS 102 -8.450 -17.397 -0.387 817 HB2 LYS 102 HB2 LYS 102 -11.170 -18.640 0.102 818 HB3 LYS 102 HB3 LYS 102 -10.586 -18.313 -1.524 819 HG2 LYS 102 HG2 LYS 102 -9.057 -20.032 0.444 820 HG3 LYS 102 HG3 LYS 102 -10.240 -20.670 -0.714 821 HD2 LYS 102 HD2 LYS 102 -8.946 -19.649 -2.574 822 HD3 LYS 102 HD3 LYS 102 -7.734 -19.099 -1.408 823 HE2 LYS 102 HE2 LYS 102 -7.334 -21.454 -0.739 824 HE3 LYS 102 HE3 LYS 102 -8.492 -21.977 -1.988 825 HZ1 LYS 102 HZ1 LYS 102 -7.087 -20.913 -3.645 826 HZ2 LYS 102 HZ2 LYS 102 -6.205 -22.022 -2.800 827 HZ3 LYS 102 HZ3 LYS 102 -6.021 -20.409 -2.489 828 H SER 103 H SER 103 -11.393 -16.043 1.109 829 HA SER 103 HA SER 103 -12.160 -14.398 -1.076 830 HB2 SER 103 HB2 SER 103 -13.512 -14.800 0.971 831 HB3 SER 103 HB3 SER 103 -12.374 -13.809 1.903 832 HG SER 103 HG SER 103 -13.999 -12.977 -0.281 833 H LEU 104 H LEU 104 -9.687 -13.875 1.453 834 HA LEU 104 HA LEU 104 -9.126 -11.143 0.587 835 HB2 LEU 104 HB2 LEU 104 -8.674 -12.464 2.873 836 HB3 LEU 104 HB3 LEU 104 -7.127 -12.791 2.098 837 HG LEU 104 HG LEU 104 -8.287 -10.032 2.602 838 HD11 LEU 104 HD11 LEU 104 -6.641 -9.866 4.406 839 HD12 LEU 104 HD12 LEU 104 -6.103 -11.531 4.088 840 HD13 LEU 104 HD13 LEU 104 -7.753 -11.212 4.688 841 HD21 LEU 104 HD21 LEU 104 -6.763 -9.831 0.790 842 HD22 LEU 104 HD22 LEU 104 -5.575 -10.896 1.578 843 HD23 LEU 104 HD23 LEU 104 -5.916 -9.279 2.239 844 H GLN 105 H GLN 105 -7.759 -14.399 0.032 845 HA GLN 105 HA GLN 105 -5.436 -13.591 -1.429 846 HB2 GLN 105 HB2 GLN 105 -7.147 -16.097 -1.618 847 HB3 GLN 105 HB3 GLN 105 -5.595 -15.904 -2.433 848 HG2 GLN 105 HG2 GLN 105 -4.400 -15.840 -0.378 849 HG3 GLN 105 HG3 GLN 105 -5.873 -15.616 0.566 850 HE21 GLN 105 HE21 GLN 105 -6.225 -17.339 1.763 851 HE22 GLN 105 HE22 GLN 105 -6.117 -18.996 1.229 852 H GLU 106 H GLU 106 -8.818 -14.107 -2.409 853 HA GLU 106 HA GLU 106 -8.422 -13.859 -5.230 854 HB2 GLU 106 HB2 GLU 106 -10.735 -13.331 -3.355 855 HB3 GLU 106 HB3 GLU 106 -10.870 -13.004 -5.082 856 HG2 GLU 106 HG2 GLU 106 -9.794 -15.670 -4.516 857 HG3 GLU 106 HG3 GLU 106 -11.402 -15.407 -3.815 858 H LEU 107 H LEU 107 -9.283 -11.385 -2.729 859 HA LEU 107 HA LEU 107 -9.293 -9.214 -4.606 860 HB2 LEU 107 HB2 LEU 107 -8.735 -9.228 -1.623 861 HB3 LEU 107 HB3 LEU 107 -8.878 -7.782 -2.601 862 HG LEU 107 HG LEU 107 -11.003 -9.548 -1.523 863 HD11 LEU 107 HD11 LEU 107 -10.350 -7.340 -0.576 864 HD12 LEU 107 HD12 LEU 107 -12.028 -7.338 -1.160 865 HD13 LEU 107 HD13 LEU 107 -10.752 -6.569 -2.127 866 HD21 LEU 107 HD21 LEU 107 -12.677 -8.633 -3.130 867 HD22 LEU 107 HD22 LEU 107 -11.555 -9.775 -3.894 868 HD23 LEU 107 HD23 LEU 107 -11.348 -8.020 -4.138 869 H THR 108 H THR 108 -6.730 -10.650 -2.612 870 HA THR 108 HA THR 108 -4.702 -8.729 -3.087 871 HB THR 108 HB THR 108 -4.367 -11.773 -2.884 872 HG1 THR 108 HG1 THR 108 -5.557 -10.857 -1.131 873 HG21 THR 108 HG21 THR 108 -2.279 -10.771 -3.525 874 HG22 THR 108 HG22 THR 108 -2.189 -11.147 -1.789 875 HG23 THR 108 HG23 THR 108 -2.468 -9.471 -2.328 876 H SER 109 H SER 109 -5.716 -11.586 -4.998 877 HA SER 109 HA SER 109 -3.696 -11.197 -7.019 878 HB2 SER 109 HB2 SER 109 -6.358 -12.664 -7.212 879 HB3 SER 109 HB3 SER 109 -4.941 -12.889 -8.259 880 HG SER 109 HG SER 109 -5.250 -13.531 -5.505 881 H LYS 110 H LYS 110 -7.141 -10.227 -6.737 882 HA LYS 110 HA LYS 110 -7.370 -9.209 -9.426 883 HB2 LYS 110 HB2 LYS 110 -8.924 -9.056 -6.888 884 HB3 LYS 110 HB3 LYS 110 -9.131 -7.691 -7.981 885 HG2 LYS 110 HG2 LYS 110 -10.875 -9.205 -8.494 886 HG3 LYS 110 HG3 LYS 110 -9.710 -9.326 -9.820 887 HD2 LYS 110 HD2 LYS 110 -8.808 -11.415 -8.827 888 HD3 LYS 110 HD3 LYS 110 -9.970 -11.276 -7.490 889 HE2 LYS 110 HE2 LYS 110 -11.845 -11.419 -9.080 890 HE3 LYS 110 HE3 LYS 110 -10.705 -11.526 -10.435 891 HZ1 LYS 110 HZ1 LYS 110 -10.906 -13.527 -8.237 892 HZ2 LYS 110 HZ2 LYS 110 -9.919 -13.624 -9.551 893 HZ3 LYS 110 HZ3 LYS 110 -11.553 -13.704 -9.742 894 H LEU 111 H LEU 111 -6.224 -7.789 -6.390 895 HA LEU 111 HA LEU 111 -6.202 -5.075 -7.230 896 HB2 LEU 111 HB2 LEU 111 -5.892 -6.022 -4.918 897 HB3 LEU 111 HB3 LEU 111 -4.247 -6.460 -5.356 898 HG LEU 111 HG LEU 111 -5.098 -3.604 -5.700 899 HD11 LEU 111 HD11 LEU 111 -4.341 -4.800 -3.016 900 HD12 LEU 111 HD12 LEU 111 -6.003 -4.379 -3.497 901 HD13 LEU 111 HD13 LEU 111 -4.778 -3.117 -3.379 902 HD21 LEU 111 HD21 LEU 111 -2.784 -3.173 -4.933 903 HD22 LEU 111 HD22 LEU 111 -2.807 -4.260 -6.329 904 HD23 LEU 111 HD23 LEU 111 -2.532 -4.920 -4.703 905 H PHE 112 H PHE 112 -3.804 -7.701 -7.605 906 HA PHE 112 HA PHE 112 -1.821 -5.975 -8.763 907 HB2 PHE 112 HB2 PHE 112 -2.169 -8.971 -9.068 908 HB3 PHE 112 HB3 PHE 112 -0.716 -8.044 -9.464 909 HD1 PHE 112 HD2 PHE 112 -0.660 -6.166 -7.053 910 HD2 PHE 112 HD1 PHE 112 -1.380 -10.400 -7.352 911 HE1 PHE 112 HE2 PHE 112 0.123 -6.453 -4.716 912 HE2 PHE 112 HE1 PHE 112 -0.598 -10.691 -5.010 913 HZ PHE 112 HZ PHE 112 0.143 -8.709 -3.678 914 H SER 113 H SER 113 -4.590 -7.746 -10.123 915 HA SER 113 HA SER 113 -3.817 -7.370 -12.866 916 HB2 SER 113 HB2 SER 113 -6.635 -7.494 -11.731 917 HB3 SER 113 HB3 SER 113 -6.126 -7.871 -13.390 918 HG SER 113 HG SER 113 -4.775 -9.538 -12.379 919 H SER 114 H SER 114 -5.567 -5.324 -10.500 920 HA SER 114 HA SER 114 -6.274 -3.292 -12.431 921 HB2 SER 114 HB2 SER 114 -5.838 -3.030 -9.429 922 HB3 SER 114 HB3 SER 114 -6.718 -1.891 -10.469 923 HG SER 114 HG SER 114 -8.195 -3.606 -10.914 924 H ILE 115 H ILE 115 -3.422 -4.005 -10.490 925 HA ILE 115 HA ILE 115 -2.075 -1.488 -10.965 926 HB ILE 115 HB ILE 115 -1.405 -4.162 -9.810 927 HG12 ILE 115 HG12 ILE 115 -0.787 -1.312 -8.987 928 HG13 ILE 115 HG13 ILE 115 -2.219 -2.226 -8.514 929 HG21 ILE 115 HG21 ILE 115 0.470 -4.073 -11.321 930 HG22 ILE 115 HG22 ILE 115 0.763 -2.360 -10.958 931 HG23 ILE 115 HG23 ILE 115 1.071 -3.601 -9.727 932 HD11 ILE 115 HD11 ILE 115 -0.784 -2.368 -6.668 933 HD12 ILE 115 HD12 ILE 115 -0.589 -3.932 -7.480 934 HD13 ILE 115 HD13 ILE 115 0.647 -2.661 -7.669 935 H ASP 116 H ASP 116 -2.086 -4.688 -12.607 936 HA ASP 116 HA ASP 116 -0.096 -3.939 -14.544 937 HB2 ASP 116 HB2 ASP 116 -2.272 -6.050 -14.502 938 HB3 ASP 116 HB3 ASP 116 -1.207 -5.821 -15.898 939 H ASN 117 H ASN 117 -3.635 -3.516 -14.391 940 HA ASN 117 HA ASN 117 -3.914 -2.611 -17.112 941 HB2 ASN 117 HB2 ASN 117 -5.534 -2.011 -14.608 942 HB3 ASN 117 HB3 ASN 117 -5.966 -1.435 -16.220 943 HD21 ASN 117 HD21 ASN 117 -7.604 -3.074 -14.644 944 HD22 ASN 117 HD22 ASN 117 -7.771 -4.602 -15.474 945 H LEU 118 H LEU 118 -2.955 -1.008 -14.094 946 HA LEU 118 HA LEU 118 -3.076 1.677 -15.116 947 HB2 LEU 118 HB2 LEU 118 -2.705 0.542 -12.689 948 HB3 LEU 118 HB3 LEU 118 -1.039 0.966 -13.055 949 HG LEU 118 HG LEU 118 -3.306 2.974 -13.121 950 HD11 LEU 118 HD11 LEU 118 -1.510 2.233 -10.788 951 HD12 LEU 118 HD12 LEU 118 -3.259 1.934 -10.912 952 HD13 LEU 118 HD13 LEU 118 -2.646 3.598 -10.827 953 HD21 LEU 118 HD21 LEU 118 -1.162 3.643 -14.219 954 HD22 LEU 118 HD22 LEU 118 -0.360 3.440 -12.646 955 HD23 LEU 118 HD23 LEU 118 -1.635 4.659 -12.843 956 H ASP 119 H ASP 119 -0.569 -0.887 -15.155 957 HA ASP 119 HA ASP 119 1.483 0.783 -16.328 958 HB2 ASP 119 HB2 ASP 119 2.002 -1.380 -15.241 959 HB3 ASP 119 HB3 ASP 119 1.131 -2.218 -16.539 960 H HIS 120 H HIS 120 -1.086 -1.277 -17.745 961 HA HIS 120 HA HIS 120 -0.115 -0.926 -20.439 962 HB2 HIS 120 HB2 HIS 120 -2.827 -1.654 -19.302 963 HB3 HIS 120 HB3 HIS 120 -2.546 -1.469 -21.038 964 HD1 HIS 120 HD1 HIS 120 -1.461 -3.682 -18.118 965 HD2 HIS 120 HD2 HIS 120 -1.294 -3.546 -22.286 966 HE1 HIS 120 HE1 HIS 120 -0.604 -5.932 -18.901 967 H ALA 121 H ALA 121 -2.415 0.907 -18.390 968 HA ALA 121 HA ALA 121 -3.137 2.790 -20.429 969 HB1 ALA 121 HB1 ALA 121 -4.413 2.519 -18.363 970 HB2 ALA 121 HB2 ALA 121 -3.030 3.103 -17.407 971 HB3 ALA 121 HB3 ALA 121 -3.857 4.199 -18.540 972 H ALA 122 H ALA 122 -0.419 2.596 -18.149 973 HA ALA 122 HA ALA 122 0.596 5.230 -18.630 974 HB1 ALA 122 HB1 ALA 122 2.094 2.674 -17.858 975 HB2 ALA 122 HB2 ALA 122 2.707 4.327 -17.699 976 HB3 ALA 122 HB3 ALA 122 1.316 3.798 -16.732 977 H LYS 123 H LYS 123 1.441 2.032 -20.053 978 HA LYS 123 HA LYS 123 3.381 3.166 -21.842 979 HB2 LYS 123 HB2 LYS 123 1.929 0.521 -21.766 980 HB3 LYS 123 HB3 LYS 123 3.181 0.906 -22.963 981 HG2 LYS 123 HG2 LYS 123 4.798 1.323 -21.183 982 HG3 LYS 123 HG3 LYS 123 3.567 0.977 -19.953 983 HD2 LYS 123 HD2 LYS 123 3.330 -1.287 -20.777 984 HD3 LYS 123 HD3 LYS 123 4.511 -0.962 -22.069 985 HE2 LYS 123 HE2 LYS 123 6.246 -0.516 -20.402 986 HE3 LYS 123 HE3 LYS 123 5.064 -0.771 -19.092 987 HZ1 LYS 123 HZ1 LYS 123 4.767 -2.994 -19.802 988 HZ2 LYS 123 HZ2 LYS 123 6.385 -2.754 -19.594 989 HZ3 LYS 123 HZ3 LYS 123 5.748 -2.798 -21.119 990 H ILE 124 H ILE 124 -0.099 2.643 -22.201 991 HA ILE 124 HA ILE 124 0.039 3.188 -25.075 992 HB ILE 124 HB ILE 124 -1.785 1.814 -23.718 993 HG12 ILE 124 HG12 ILE 124 -3.492 2.452 -25.519 994 HG13 ILE 124 HG13 ILE 124 -2.290 3.606 -26.103 995 HG21 ILE 124 HG21 ILE 124 -2.468 3.774 -22.297 996 HG22 ILE 124 HG22 ILE 124 -3.117 4.555 -23.755 997 HG23 ILE 124 HG23 ILE 124 -3.807 3.024 -23.175 998 HD11 ILE 124 HD11 ILE 124 -0.694 1.765 -26.523 999 HD12 ILE 124 HD12 ILE 124 -1.850 0.593 -25.846 1000 HD13 ILE 124 HD13 ILE 124 -2.233 1.453 -27.354 1001 H LYS 125 H LYS 125 0.605 4.999 -22.429 1002 HA LYS 125 HA LYS 125 1.008 7.199 -22.106 1003 HB2 LYS 125 HB2 LYS 125 1.658 6.810 -24.641 1004 HB3 LYS 125 HB3 LYS 125 0.306 7.906 -24.931 1005 HG2 LYS 125 HG2 LYS 125 1.458 9.507 -23.283 1006 HG3 LYS 125 HG3 LYS 125 2.872 8.446 -23.419 1007 HD2 LYS 125 HD2 LYS 125 1.465 9.821 -25.742 1008 HD3 LYS 125 HD3 LYS 125 2.965 10.384 -24.982 1009 HE2 LYS 125 HE2 LYS 125 4.078 8.249 -25.629 1010 HE3 LYS 125 HE3 LYS 125 2.578 7.719 -26.420 1011 HZ1 LYS 125 HZ1 LYS 125 2.751 9.610 -27.906 1012 HZ2 LYS 125 HZ2 LYS 125 4.109 8.679 -28.007 1013 HZ3 LYS 125 HZ3 LYS 125 4.149 10.109 -27.184 1014 H SER 126 H SER 126 -1.631 6.183 -21.629 1015 HA SER 126 HA SER 126 -3.261 8.649 -22.110 1016 HB2 SER 126 HB2 SER 126 -4.208 6.544 -22.992 1017 HB3 SER 126 HB3 SER 126 -4.182 5.861 -21.353 1018 HG SER 126 HG SER 126 -6.213 6.830 -22.066 1019 HA PRO 127 HA PRO 127 -2.122 8.663 -17.695 1020 HB2 PRO 127 HB2 PRO 127 -2.353 11.356 -17.225 1021 HB3 PRO 127 HB3 PRO 127 -0.884 10.612 -17.930 1022 HG2 PRO 127 HG2 PRO 127 -3.193 11.929 -19.352 1023 HG3 PRO 127 HG3 PRO 127 -1.434 12.232 -19.538 1024 HD2 PRO 127 HD2 PRO 127 -2.738 10.624 -21.247 1025 HD3 PRO 127 HD3 PRO 127 -1.088 10.199 -20.668 1026 H THR 128 H THR 128 -4.876 10.129 -19.396 1027 HA THR 128 HA THR 128 -6.474 10.594 -17.070 1028 HB THR 128 HB THR 128 -7.835 9.808 -19.601 1029 HG1 THR 128 HG1 THR 128 -6.424 12.237 -19.620 1030 HG21 THR 128 HG21 THR 128 -8.980 11.009 -17.748 1031 HG22 THR 128 HG22 THR 128 -8.948 11.978 -19.240 1032 HG23 THR 128 HG23 THR 128 -7.825 12.350 -17.910 1033 H GLU 129 H GLU 129 -5.737 7.688 -18.955 1034 HA GLU 129 HA GLU 129 -7.902 6.174 -17.627 1035 HB2 GLU 129 HB2 GLU 129 -5.734 5.460 -19.596 1036 HB3 GLU 129 HB3 GLU 129 -6.765 4.240 -18.823 1037 HG2 GLU 129 HG2 GLU 129 -8.748 5.214 -19.768 1038 HG3 GLU 129 HG3 GLU 129 -7.833 6.598 -20.386 1039 H ALA 130 H ALA 130 -4.403 6.706 -17.422 1040 HA ALA 130 HA ALA 130 -3.862 4.668 -15.486 1041 HB1 ALA 130 HB1 ALA 130 -2.564 7.419 -15.774 1042 HB2 ALA 130 HB2 ALA 130 -1.882 6.008 -14.940 1043 HB3 ALA 130 HB3 ALA 130 -2.105 5.970 -16.703 1044 H GLU 131 H GLU 131 -5.125 8.013 -15.237 1045 HA GLU 131 HA GLU 131 -5.250 8.048 -12.367 1046 HB2 GLU 131 HB2 GLU 131 -6.684 9.581 -14.535 1047 HB3 GLU 131 HB3 GLU 131 -7.018 9.842 -12.815 1048 HG2 GLU 131 HG2 GLU 131 -4.639 10.344 -12.423 1049 HG3 GLU 131 HG3 GLU 131 -4.310 10.135 -14.144 1050 H LYS 132 H LYS 132 -7.499 6.783 -14.836 1051 HA LYS 132 HA LYS 132 -9.687 6.377 -12.975 1052 HB2 LYS 132 HB2 LYS 132 -9.046 5.596 -15.743 1053 HB3 LYS 132 HB3 LYS 132 -9.873 4.323 -14.852 1054 HG2 LYS 132 HG2 LYS 132 -11.736 5.377 -15.605 1055 HG3 LYS 132 HG3 LYS 132 -11.474 6.380 -14.170 1056 HD2 LYS 132 HD2 LYS 132 -11.835 7.929 -15.909 1057 HD3 LYS 132 HD3 LYS 132 -10.076 7.906 -15.700 1058 HE2 LYS 132 HE2 LYS 132 -9.976 6.204 -17.598 1059 HE3 LYS 132 HE3 LYS 132 -11.707 6.487 -17.859 1060 HZ1 LYS 132 HZ1 LYS 132 -11.196 8.805 -18.294 1061 HZ2 LYS 132 HZ2 LYS 132 -10.305 7.847 -19.303 1062 HZ3 LYS 132 HZ3 LYS 132 -9.590 8.556 -17.992 1063 H TYR 133 H TYR 133 -6.990 4.311 -14.144 1064 HA TYR 133 HA TYR 133 -7.789 2.084 -12.479 1065 HB2 TYR 133 HB2 TYR 133 -5.205 2.737 -13.898 1066 HB3 TYR 133 HB3 TYR 133 -5.509 1.214 -13.043 1067 HD1 TYR 133 HD1 TYR 133 -8.020 0.205 -13.752 1068 HD2 TYR 133 HD2 TYR 133 -5.434 2.600 -16.217 1069 HE1 TYR 133 HE1 TYR 133 -9.152 -0.667 -15.799 1070 HE2 TYR 133 HE2 TYR 133 -6.565 1.714 -18.259 1071 HH TYR 133 HH TYR 133 -8.198 0.359 -19.086 1072 H TYR 134 H TYR 134 -5.800 4.948 -11.957 1073 HA TYR 134 HA TYR 134 -4.606 4.101 -9.481 1074 HB2 TYR 134 HB2 TYR 134 -3.703 6.051 -10.418 1075 HB3 TYR 134 HB3 TYR 134 -5.285 6.741 -10.740 1076 HD1 TYR 134 HD1 TYR 134 -3.178 5.727 -7.791 1077 HD2 TYR 134 HD2 TYR 134 -6.114 8.439 -9.374 1078 HE1 TYR 134 HE1 TYR 134 -3.044 7.087 -5.706 1079 HE2 TYR 134 HE2 TYR 134 -5.998 9.777 -7.271 1080 HH TYR 134 HH TYR 134 -5.048 9.990 -5.196 1081 H GLY 135 H GLY 135 -7.719 5.805 -10.235 1082 HA2 GLY 135 HA2 GLY 135 -8.577 5.929 -7.522 1083 HA3 GLY 135 HA3 GLY 135 -9.641 5.917 -8.943 1084 H GLN 136 H GLN 136 -8.891 3.350 -9.968 1085 HA GLN 136 HA GLN 136 -10.583 1.666 -8.362 1086 HB2 GLN 136 HB2 GLN 136 -8.658 1.055 -10.626 1087 HB3 GLN 136 HB3 GLN 136 -9.718 -0.153 -9.895 1088 HG2 GLN 136 HG2 GLN 136 -11.684 0.977 -10.650 1089 HG3 GLN 136 HG3 GLN 136 -10.763 2.405 -11.129 1090 HE21 GLN 136 HE21 GLN 136 -11.062 2.510 -13.268 1091 HE22 GLN 136 HE22 GLN 136 -10.657 1.225 -14.385 1092 H THR 137 H THR 137 -6.995 1.855 -8.711 1093 HA THR 137 HA THR 137 -6.585 -0.446 -7.014 1094 HB THR 137 HB THR 137 -4.206 0.516 -6.766 1095 HG1 THR 137 HG1 THR 137 -5.086 2.200 -8.882 1096 HG21 THR 137 HG21 THR 137 -5.329 0.006 -9.550 1097 HG22 THR 137 HG22 THR 137 -4.706 -1.215 -8.409 1098 HG23 THR 137 HG23 THR 137 -3.606 -0.011 -9.114 1099 H VAL 138 H VAL 138 -6.803 3.083 -6.360 1100 HA VAL 138 HA VAL 138 -6.038 2.934 -3.609 1101 HB VAL 138 HB VAL 138 -8.036 4.773 -5.031 1102 HG11 VAL 138 HG11 VAL 138 -7.763 6.289 -3.034 1103 HG12 VAL 138 HG12 VAL 138 -8.648 4.795 -2.679 1104 HG13 VAL 138 HG13 VAL 138 -6.947 4.955 -2.187 1105 HG21 VAL 138 HG21 VAL 138 -5.261 5.472 -4.000 1106 HG22 VAL 138 HG22 VAL 138 -5.530 4.865 -5.638 1107 HG23 VAL 138 HG23 VAL 138 -6.282 6.385 -5.126 1108 H SER 139 H SER 139 -9.224 2.488 -5.206 1109 HA SER 139 HA SER 139 -10.671 2.011 -2.782 1110 HB2 SER 139 HB2 SER 139 -11.696 2.551 -4.992 1111 HB3 SER 139 HB3 SER 139 -11.231 0.941 -5.577 1112 HG SER 139 HG SER 139 -13.368 0.943 -4.809 1113 H ASN 140 H ASN 140 -8.972 -0.196 -5.038 1114 HA ASN 140 HA ASN 140 -9.808 -2.603 -3.731 1115 HB2 ASN 140 HB2 ASN 140 -8.614 -2.107 -6.052 1116 HB3 ASN 140 HB3 ASN 140 -7.147 -2.421 -5.117 1117 HD21 ASN 140 HD21 ASN 140 -8.801 -3.846 -7.295 1118 HD22 ASN 140 HD22 ASN 140 -8.928 -5.477 -6.688 1119 H ILE 141 H ILE 141 -7.005 -0.433 -3.215 1120 HA ILE 141 HA ILE 141 -5.659 -2.106 -1.306 1121 HB ILE 141 HB ILE 141 -5.684 0.935 -1.698 1122 HG12 ILE 141 HG12 ILE 141 -4.627 -0.548 -3.460 1123 HG13 ILE 141 HG13 ILE 141 -3.579 0.681 -2.767 1124 HG21 ILE 141 HG21 ILE 141 -4.169 -0.708 0.353 1125 HG22 ILE 141 HG22 ILE 141 -3.541 0.852 -0.227 1126 HG23 ILE 141 HG23 ILE 141 -5.117 0.771 0.594 1127 HD11 ILE 141 HD11 ILE 141 -2.595 -1.648 -3.170 1128 HD12 ILE 141 HD12 ILE 141 -2.306 -0.917 -1.589 1129 HD13 ILE 141 HD13 ILE 141 -3.535 -2.183 -1.763 1130 H ASN 142 H ASN 142 -8.197 0.419 -0.964 1131 HA ASN 142 HA ASN 142 -8.346 0.289 1.879 1132 HB2 ASN 142 HB2 ASN 142 -9.431 2.023 0.441 1133 HB3 ASN 142 HB3 ASN 142 -10.608 0.810 -0.081 1134 HD21 ASN 142 HD21 ASN 142 -12.404 0.555 1.071 1135 HD22 ASN 142 HD22 ASN 142 -12.656 1.207 2.671 1136 H GLU 143 H GLU 143 -10.062 -1.617 -0.641 1137 HA GLU 143 HA GLU 143 -11.723 -3.030 1.208 1138 HB2 GLU 143 HB2 GLU 143 -10.730 -3.617 -1.590 1139 HB3 GLU 143 HB3 GLU 143 -11.753 -4.758 -0.716 1140 HG2 GLU 143 HG2 GLU 143 -12.645 -1.907 -1.012 1141 HG3 GLU 143 HG3 GLU 143 -12.813 -3.044 -2.363 1142 H VAL 144 H VAL 144 -8.496 -3.796 -0.137 1143 HA VAL 144 HA VAL 144 -8.325 -6.375 1.142 1144 HB VAL 144 HB VAL 144 -6.196 -4.418 0.150 1145 HG11 VAL 144 HG11 VAL 144 -5.139 -5.707 1.933 1146 HG12 VAL 144 HG12 VAL 144 -5.802 -7.222 1.281 1147 HG13 VAL 144 HG13 VAL 144 -4.573 -6.319 0.368 1148 HG21 VAL 144 HG21 VAL 144 -7.192 -7.106 -0.907 1149 HG22 VAL 144 HG22 VAL 144 -7.586 -5.513 -1.590 1150 HG23 VAL 144 HG23 VAL 144 -5.919 -6.111 -1.644 1151 H LEU 145 H LEU 145 -7.615 -3.041 2.181 1152 HA LEU 145 HA LEU 145 -6.261 -3.801 4.599 1153 HB2 LEU 145 HB2 LEU 145 -7.246 -1.357 3.346 1154 HB3 LEU 145 HB3 LEU 145 -7.497 -1.344 5.086 1155 HG LEU 145 HG LEU 145 -5.103 -1.753 5.463 1156 HD11 LEU 145 HD11 LEU 145 -4.480 -2.984 3.444 1157 HD12 LEU 145 HD12 LEU 145 -3.494 -1.517 3.582 1158 HD13 LEU 145 HD13 LEU 145 -4.852 -1.570 2.437 1159 HD21 LEU 145 HD21 LEU 145 -5.688 0.574 3.585 1160 HD22 LEU 145 HD22 LEU 145 -4.320 0.469 4.718 1161 HD23 LEU 145 HD23 LEU 145 -5.985 0.546 5.340 1162 H ALA 146 H ALA 146 -9.712 -3.222 3.877 1163 HA ALA 146 HA ALA 146 -10.497 -3.409 6.661 1164 HB1 ALA 146 HB1 ALA 146 -12.099 -3.928 4.099 1165 HB2 ALA 146 HB2 ALA 146 -12.785 -3.681 5.724 1166 HB3 ALA 146 HB3 ALA 146 -11.926 -2.351 4.909 1167 H LYS 147 H LYS 147 -9.856 -5.758 4.127 1168 HA LYS 147 HA LYS 147 -11.014 -7.957 5.688 1169 HB2 LYS 147 HB2 LYS 147 -9.324 -7.864 3.197 1170 HB3 LYS 147 HB3 LYS 147 -9.976 -9.352 3.912 1171 HG2 LYS 147 HG2 LYS 147 -12.275 -8.450 3.675 1172 HG3 LYS 147 HG3 LYS 147 -11.613 -7.008 2.905 1173 HD2 LYS 147 HD2 LYS 147 -12.124 -8.197 1.044 1174 HD3 LYS 147 HD3 LYS 147 -10.469 -8.774 1.307 1175 HE2 LYS 147 HE2 LYS 147 -11.814 -10.688 0.852 1176 HE3 LYS 147 HE3 LYS 147 -11.477 -10.716 2.597 1177 HZ1 LYS 147 HZ1 LYS 147 -13.958 -9.630 1.387 1178 HZ2 LYS 147 HZ2 LYS 147 -13.661 -9.816 2.999 1179 HZ3 LYS 147 HZ3 LYS 147 -13.829 -11.144 2.028 1180 H LEU 148 H LEU 148 -8.092 -6.233 5.772 1181 HA LEU 148 HA LEU 148 -6.493 -8.419 6.912 1182 HB2 LEU 148 HB2 LEU 148 -6.076 -5.416 6.765 1183 HB3 LEU 148 HB3 LEU 148 -5.002 -6.474 7.652 1184 HG LEU 148 HG LEU 148 -5.497 -6.681 4.674 1185 HD11 LEU 148 HD11 LEU 148 -3.301 -5.625 4.423 1186 HD12 LEU 148 HD12 LEU 148 -3.138 -5.489 6.191 1187 HD13 LEU 148 HD13 LEU 148 -4.382 -4.555 5.335 1188 HD21 LEU 148 HD21 LEU 148 -4.773 -8.802 5.619 1189 HD22 LEU 148 HD22 LEU 148 -3.464 -7.991 6.511 1190 HD23 LEU 148 HD23 LEU 148 -3.430 -8.056 4.736 1191 H GLY 149 H GLY 149 -9.056 -6.397 8.010 1192 HA2 GLY 149 HA2 GLY 149 -8.265 -6.198 10.776 1193 HA3 GLY 149 HA3 GLY 149 -9.906 -6.069 10.130 Start of MODEL 11 1 H1 GLU 1 H1 GLU 1 -7.944 28.618 16.406 2 H2 GLU 1 H2 GLU 1 -7.924 28.569 14.757 3 H3 GLU 1 H3 GLU 1 -8.430 27.252 15.610 4 HA GLU 1 HA GLU 1 -5.699 28.357 15.643 5 HB2 GLU 1 HB2 GLU 1 -6.816 25.797 16.869 6 HB3 GLU 1 HB3 GLU 1 -5.130 26.334 16.914 7 HG2 GLU 1 HG2 GLU 1 -7.521 27.611 18.257 8 HG3 GLU 1 HG3 GLU 1 -6.116 26.855 19.034 9 H ALA 2 H ALA 2 -4.357 27.630 14.045 10 HA ALA 2 HA ALA 2 -5.531 25.732 12.093 11 HB1 ALA 2 HB1 ALA 2 -4.588 27.867 11.273 12 HB2 ALA 2 HB2 ALA 2 -3.001 27.437 11.956 13 HB3 ALA 2 HB3 ALA 2 -3.695 26.472 10.633 14 H ARG 3 H ARG 3 -3.110 25.858 14.605 15 HA ARG 3 HA ARG 3 -1.523 23.626 13.659 16 HB2 ARG 3 HB2 ARG 3 -0.551 23.616 15.889 17 HB3 ARG 3 HB3 ARG 3 -0.685 25.283 15.326 18 HG2 ARG 3 HG2 ARG 3 -2.712 25.587 16.715 19 HG3 ARG 3 HG3 ARG 3 -2.567 23.909 17.272 20 HD2 ARG 3 HD2 ARG 3 -0.379 24.397 18.251 21 HD3 ARG 3 HD3 ARG 3 -0.490 26.077 17.681 22 HE ARG 3 HE ARG 3 -2.809 25.573 19.190 23 HH11 ARG 3 HH11 ARG 3 0.662 25.758 19.808 24 HH12 ARG 3 HH12 ARG 3 0.434 26.260 21.460 25 HH21 ARG 3 HH21 ARG 3 -3.021 26.204 21.304 26 HH22 ARG 3 HH22 ARG 3 -1.618 26.496 22.293 27 HA PRO 4 HA PRO 4 -4.411 20.514 14.720 28 HB2 PRO 4 HB2 PRO 4 -2.898 18.332 15.356 29 HB3 PRO 4 HB3 PRO 4 -2.989 18.995 13.694 30 HG2 PRO 4 HG2 PRO 4 -0.890 19.468 15.797 31 HG3 PRO 4 HG3 PRO 4 -0.686 19.001 14.079 32 HD2 PRO 4 HD2 PRO 4 -0.448 21.570 14.915 33 HD3 PRO 4 HD3 PRO 4 -1.155 21.158 13.316 34 H ILE 5 H ILE 5 -5.444 21.373 16.510 35 HA ILE 5 HA ILE 5 -4.996 19.933 19.006 36 HB ILE 5 HB ILE 5 -3.424 21.927 19.210 37 HG12 ILE 5 HG12 ILE 5 -5.768 22.063 21.135 38 HG13 ILE 5 HG13 ILE 5 -4.569 20.766 21.137 39 HG21 ILE 5 HG21 ILE 5 -4.812 23.541 17.866 40 HG22 ILE 5 HG22 ILE 5 -5.972 23.610 19.203 41 HG23 ILE 5 HG23 ILE 5 -4.318 24.195 19.439 42 HD11 ILE 5 HD11 ILE 5 -3.980 22.367 22.852 43 HD12 ILE 5 HD12 ILE 5 -2.774 22.483 21.550 44 HD13 ILE 5 HD13 ILE 5 -4.053 23.715 21.700 45 H VAL 6 H VAL 6 -6.967 19.872 20.170 46 HA VAL 6 HA VAL 6 -9.274 21.014 18.683 47 HB VAL 6 HB VAL 6 -9.262 18.541 19.020 48 HG11 VAL 6 HG11 VAL 6 -9.558 17.544 21.212 49 HG12 VAL 6 HG12 VAL 6 -8.054 18.476 21.198 50 HG13 VAL 6 HG13 VAL 6 -9.500 19.137 21.999 51 HG21 VAL 6 HG21 VAL 6 -11.383 19.760 18.815 52 HG22 VAL 6 HG22 VAL 6 -11.545 18.338 19.861 53 HG23 VAL 6 HG23 VAL 6 -11.447 19.957 20.586 54 H VAL 7 H VAL 7 -10.537 22.538 19.633 55 HA VAL 7 HA VAL 7 -9.872 23.343 22.431 56 HB VAL 7 HB VAL 7 -10.117 25.298 20.082 57 HG11 VAL 7 HG11 VAL 7 -9.358 25.734 23.011 58 HG12 VAL 7 HG12 VAL 7 -9.300 26.978 21.737 59 HG13 VAL 7 HG13 VAL 7 -10.857 26.277 22.221 60 HG21 VAL 7 HG21 VAL 7 -7.671 25.725 20.503 61 HG22 VAL 7 HG22 VAL 7 -7.654 24.302 21.574 62 HG23 VAL 7 HG23 VAL 7 -8.022 24.118 19.841 63 H GLY 8 H GLY 8 -12.102 23.888 19.661 64 HA2 GLY 8 HA2 GLY 8 -14.132 24.959 21.464 65 HA3 GLY 8 HA3 GLY 8 -14.259 24.773 19.715 66 HA PRO 9 HA PRO 9 -16.704 21.246 20.462 67 HB2 PRO 9 HB2 PRO 9 -15.940 19.207 18.826 68 HB3 PRO 9 HB3 PRO 9 -16.615 20.732 18.165 69 HG2 PRO 9 HG2 PRO 9 -13.745 19.911 18.479 70 HG3 PRO 9 HG3 PRO 9 -14.582 20.546 17.027 71 HD2 PRO 9 HD2 PRO 9 -13.117 22.143 18.664 72 HD3 PRO 9 HD3 PRO 9 -14.615 22.732 17.859 73 HA PRO 10 HA PRO 10 -14.590 18.677 23.377 74 HB2 PRO 10 HB2 PRO 10 -16.052 16.368 23.528 75 HB3 PRO 10 HB3 PRO 10 -16.667 17.925 24.175 76 HG2 PRO 10 HG2 PRO 10 -17.213 16.641 21.506 77 HG3 PRO 10 HG3 PRO 10 -18.382 17.275 22.709 78 HD2 PRO 10 HD2 PRO 10 -17.611 18.749 20.585 79 HD3 PRO 10 HD3 PRO 10 -17.872 19.510 22.194 80 HA PRO 11 HA PRO 11 -12.052 16.152 20.807 81 HB2 PRO 11 HB2 PRO 11 -10.887 14.359 22.525 82 HB3 PRO 11 HB3 PRO 11 -10.469 16.100 22.541 83 HG2 PRO 11 HG2 PRO 11 -12.435 14.626 24.276 84 HG3 PRO 11 HG3 PRO 11 -11.095 15.714 24.766 85 HD2 PRO 11 HD2 PRO 11 -13.621 16.621 24.577 86 HD3 PRO 11 HD3 PRO 11 -12.239 17.636 24.032 87 HA PRO 12 HA PRO 12 -14.521 12.549 19.958 88 HB2 PRO 12 HB2 PRO 12 -12.905 11.013 18.406 89 HB3 PRO 12 HB3 PRO 12 -13.528 12.596 17.834 90 HG2 PRO 12 HG2 PRO 12 -10.883 11.962 19.107 91 HG3 PRO 12 HG3 PRO 12 -11.211 12.819 17.567 92 HD2 PRO 12 HD2 PRO 12 -10.741 14.167 19.862 93 HD3 PRO 12 HD3 PRO 12 -11.954 14.753 18.670 94 H LEU 13 H LEU 13 -11.843 12.514 21.926 95 HA LEU 13 HA LEU 13 -11.182 11.301 23.692 96 HB2 LEU 13 HB2 LEU 13 -13.753 11.013 23.832 97 HB3 LEU 13 HB3 LEU 13 -13.442 9.359 23.313 98 HG LEU 13 HG LEU 13 -11.954 9.066 25.319 99 HD11 LEU 13 HD11 LEU 13 -12.260 10.700 27.197 100 HD12 LEU 13 HD12 LEU 13 -13.094 11.797 26.072 101 HD13 LEU 13 HD13 LEU 13 -11.379 11.389 25.822 102 HD21 LEU 13 HD21 LEU 13 -14.838 9.894 25.849 103 HD22 LEU 13 HD22 LEU 13 -13.836 8.862 26.898 104 HD23 LEU 13 HD23 LEU 13 -14.292 8.299 25.278 105 H SER 14 H SER 14 -11.875 9.365 20.828 106 HA SER 14 HA SER 14 -10.358 7.053 21.606 107 HB2 SER 14 HB2 SER 14 -10.393 6.611 19.135 108 HB3 SER 14 HB3 SER 14 -11.993 6.974 19.821 109 HG SER 14 HG SER 14 -11.569 8.145 17.880 110 H GLY 15 H GLY 15 -9.399 10.206 20.475 111 HA2 GLY 15 HA2 GLY 15 -6.922 10.574 20.976 112 HA3 GLY 15 HA3 GLY 15 -6.653 9.186 19.902 113 H GLY 16 H GLY 16 -5.376 10.694 18.563 114 HA2 GLY 16 HA2 GLY 16 -7.074 11.806 16.470 115 HA3 GLY 16 HA3 GLY 16 -6.110 13.021 17.349 116 H LEU 17 H LEU 17 -5.769 12.261 14.551 117 HA LEU 17 HA LEU 17 -2.923 11.583 14.619 118 HB2 LEU 17 HB2 LEU 17 -3.053 9.669 13.180 119 HB3 LEU 17 HB3 LEU 17 -3.985 9.333 14.619 120 HG LEU 17 HG LEU 17 -5.299 10.163 12.019 121 HD11 LEU 17 HD11 LEU 17 -4.578 7.367 12.971 122 HD12 LEU 17 HD12 LEU 17 -3.869 8.228 11.580 123 HD13 LEU 17 HD13 LEU 17 -5.580 7.760 11.552 124 HD21 LEU 17 HD21 LEU 17 -6.287 8.652 14.481 125 HD22 LEU 17 HD22 LEU 17 -7.206 8.812 12.966 126 HD23 LEU 17 HD23 LEU 17 -6.821 10.252 13.917 127 HA PRO 18 HA PRO 18 -3.358 14.306 11.216 128 HB2 PRO 18 HB2 PRO 18 -1.363 13.664 9.463 129 HB3 PRO 18 HB3 PRO 18 -1.023 14.395 11.066 130 HG2 PRO 18 HG2 PRO 18 -0.981 11.490 10.273 131 HG3 PRO 18 HG3 PRO 18 0.289 12.448 11.102 132 HD2 PRO 18 HD2 PRO 18 -1.427 10.906 12.491 133 HD3 PRO 18 HD3 PRO 18 -0.921 12.513 13.118 134 H GLY 19 H GLY 19 -4.035 14.485 8.954 135 HA2 GLY 19 HA2 GLY 19 -4.930 13.649 6.964 136 HA3 GLY 19 HA3 GLY 19 -4.609 11.996 7.511 137 H THR 20 H THR 20 -6.279 14.140 9.690 138 HA THR 20 HA THR 20 -8.914 13.025 8.870 139 HB THR 20 HB THR 20 -9.528 12.762 11.261 140 HG1 THR 20 HG1 THR 20 -6.767 13.111 11.866 141 HG21 THR 20 HG21 THR 20 -8.302 10.749 11.747 142 HG22 THR 20 HG22 THR 20 -6.962 11.238 10.687 143 HG23 THR 20 HG23 THR 20 -8.546 10.825 9.990 144 H GLU 21 H GLU 21 -10.683 14.329 9.858 145 HA GLU 21 HA GLU 21 -11.777 16.309 9.973 146 HB2 GLU 21 HB2 GLU 21 -9.376 17.222 11.590 147 HB3 GLU 21 HB3 GLU 21 -10.983 17.964 11.562 148 HG2 GLU 21 HG2 GLU 21 -11.926 15.790 12.415 149 HG3 GLU 21 HG3 GLU 21 -10.264 15.215 12.626 150 H ASN 22 H ASN 22 -10.241 18.966 10.279 151 HA ASN 22 HA ASN 22 -10.206 19.500 7.375 152 HB2 ASN 22 HB2 ASN 22 -11.418 20.979 9.011 153 HB3 ASN 22 HB3 ASN 22 -9.854 21.379 9.742 154 HD21 ASN 22 HD21 ASN 22 -9.345 23.380 9.186 155 HD22 ASN 22 HD22 ASN 22 -9.456 24.037 7.571 156 H SER 23 H SER 23 -8.430 20.724 6.398 157 HA SER 23 HA SER 23 -5.867 19.656 6.899 158 HB2 SER 23 HB2 SER 23 -6.518 22.352 5.649 159 HB3 SER 23 HB3 SER 23 -5.066 21.363 5.368 160 HG SER 23 HG SER 23 -6.565 19.721 4.571 161 H ASP 24 H ASP 24 -4.233 20.141 8.224 162 HA ASP 24 HA ASP 24 -4.524 22.519 10.009 163 HB2 ASP 24 HB2 ASP 24 -3.558 21.252 11.754 164 HB3 ASP 24 HB3 ASP 24 -4.731 20.156 11.010 165 H GLN 25 H GLN 25 -2.069 22.628 11.110 166 HA GLN 25 HA GLN 25 -0.413 23.672 8.971 167 HB2 GLN 25 HB2 GLN 25 0.020 23.301 11.945 168 HB3 GLN 25 HB3 GLN 25 1.236 24.022 10.898 169 HG2 GLN 25 HG2 GLN 25 -1.576 25.107 11.236 170 HG3 GLN 25 HG3 GLN 25 -0.175 25.670 12.145 171 HE21 GLN 25 HE21 GLN 25 1.366 25.146 9.418 172 HE22 GLN 25 HE22 GLN 25 1.061 26.642 8.569 173 H ALA 26 H ALA 26 -0.852 20.512 9.616 174 HA ALA 26 HA ALA 26 0.323 18.607 9.324 175 HB1 ALA 26 HB1 ALA 26 0.470 19.587 7.060 176 HB2 ALA 26 HB2 ALA 26 2.019 20.352 7.491 177 HB3 ALA 26 HB3 ALA 26 1.889 18.580 7.436 178 H ARG 27 H ARG 27 0.992 19.143 11.705 179 HA ARG 27 HA ARG 27 3.749 19.762 12.246 180 HB2 ARG 27 HB2 ARG 27 2.129 19.845 14.034 181 HB3 ARG 27 HB3 ARG 27 1.658 18.172 13.770 182 HG2 ARG 27 HG2 ARG 27 2.939 18.319 15.811 183 HG3 ARG 27 HG3 ARG 27 3.856 17.390 14.628 184 HD2 ARG 27 HD2 ARG 27 4.405 20.348 14.911 185 HD3 ARG 27 HD3 ARG 27 5.033 19.216 16.128 186 HE ARG 27 HE ARG 27 5.589 18.293 13.448 187 HH11 ARG 27 HH11 ARG 27 6.809 20.546 15.893 188 HH12 ARG 27 HH12 ARG 27 8.411 20.545 15.207 189 HH21 ARG 27 HH21 ARG 27 7.598 18.339 12.655 190 HH22 ARG 27 HH22 ARG 27 8.859 19.293 13.399 191 H ASP 28 H ASP 28 2.083 16.638 11.802 192 HA ASP 28 HA ASP 28 2.822 14.551 11.297 193 HB2 ASP 28 HB2 ASP 28 3.603 16.120 9.338 194 HB3 ASP 28 HB3 ASP 28 5.227 15.726 9.922 195 H GLY 29 H GLY 29 5.098 13.153 10.997 196 HA2 GLY 29 HA2 GLY 29 7.113 13.768 12.992 197 HA3 GLY 29 HA3 GLY 29 5.985 12.516 13.555 198 H THR 30 H THR 30 8.768 12.035 13.101 199 HA THR 30 HA THR 30 8.791 10.534 10.520 200 HB THR 30 HB THR 30 11.284 10.594 10.797 201 HG1 THR 30 HG1 THR 30 11.364 10.829 13.049 202 HG21 THR 30 HG21 THR 30 11.568 12.947 10.267 203 HG22 THR 30 HG22 THR 30 10.010 13.354 11.016 204 HG23 THR 30 HG23 THR 30 10.054 12.382 9.525 205 H LEU 31 H LEU 31 7.375 9.025 11.993 206 HA LEU 31 HA LEU 31 9.221 7.104 13.372 207 HB2 LEU 31 HB2 LEU 31 6.316 7.721 13.970 208 HB3 LEU 31 HB3 LEU 31 7.279 6.474 14.762 209 HG LEU 31 HG LEU 31 7.849 9.460 14.898 210 HD11 LEU 31 HD11 LEU 31 5.744 8.847 16.018 211 HD12 LEU 31 HD12 LEU 31 6.992 9.298 17.198 212 HD13 LEU 31 HD13 LEU 31 6.593 7.583 16.940 213 HD21 LEU 31 HD21 LEU 31 9.352 8.812 16.784 214 HD22 LEU 31 HD22 LEU 31 9.896 8.163 15.226 215 HD23 LEU 31 HD23 LEU 31 9.073 7.099 16.393 216 HA PRO 32 HA PRO 32 7.239 4.801 9.940 217 HB2 PRO 32 HB2 PRO 32 9.361 3.262 9.200 218 HB3 PRO 32 HB3 PRO 32 9.197 4.966 8.659 219 HG2 PRO 32 HG2 PRO 32 10.768 3.861 10.972 220 HG3 PRO 32 HG3 PRO 32 11.318 4.942 9.654 221 HD2 PRO 32 HD2 PRO 32 10.573 5.913 12.069 222 HD3 PRO 32 HD3 PRO 32 10.188 6.796 10.551 223 H TYR 33 H TYR 33 6.667 2.534 9.829 224 HA TYR 33 HA TYR 33 6.255 1.351 12.399 225 HB2 TYR 33 HB2 TYR 33 5.867 0.458 9.540 226 HB3 TYR 33 HB3 TYR 33 5.679 -0.702 10.855 227 HD1 TYR 33 HD2 TYR 33 4.602 2.942 10.729 228 HD2 TYR 33 HD1 TYR 33 3.383 -1.194 10.945 229 HE1 TYR 33 HE2 TYR 33 2.254 3.648 11.090 230 HE2 TYR 33 HE1 TYR 33 1.031 -0.460 11.309 231 HH TYR 33 HH TYR 33 0.128 3.008 11.466 232 H THR 34 H THR 34 8.841 0.959 10.041 233 HA THR 34 HA THR 34 10.078 -1.062 11.842 234 HB THR 34 HB THR 34 10.929 -2.230 9.758 235 HG1 THR 34 HG1 THR 34 10.476 -0.505 8.299 236 HG21 THR 34 HG21 THR 34 7.897 -2.173 10.013 237 HG22 THR 34 HG22 THR 34 8.994 -3.142 11.025 238 HG23 THR 34 HG23 THR 34 8.877 -3.458 9.282 239 H LYS 35 H LYS 35 12.222 -1.049 11.969 240 HA LYS 35 HA LYS 35 13.920 0.451 10.092 241 HB2 LYS 35 HB2 LYS 35 13.908 1.014 13.104 242 HB3 LYS 35 HB3 LYS 35 15.254 1.409 12.024 243 HG2 LYS 35 HG2 LYS 35 13.709 2.873 10.719 244 HG3 LYS 35 HG3 LYS 35 12.489 2.618 11.990 245 HD2 LYS 35 HD2 LYS 35 14.090 3.475 13.680 246 HD3 LYS 35 HD3 LYS 35 15.301 3.719 12.403 247 HE2 LYS 35 HE2 LYS 35 13.745 5.304 11.271 248 HE3 LYS 35 HE3 LYS 35 12.605 5.113 12.621 249 HZ1 LYS 35 HZ1 LYS 35 14.329 5.969 14.102 250 HZ2 LYS 35 HZ2 LYS 35 13.996 7.065 12.914 251 HZ3 LYS 35 HZ3 LYS 35 15.373 6.159 12.840 252 H ASP 36 H ASP 36 15.527 -0.188 12.956 253 HA ASP 36 HA ASP 36 16.721 -2.660 12.135 254 HB2 ASP 36 HB2 ASP 36 16.656 -1.861 15.005 255 HB3 ASP 36 HB3 ASP 36 18.030 -2.355 14.007 256 H ARG 37 H ARG 37 13.672 -2.054 13.251 257 HA ARG 37 HA ARG 37 13.018 -4.024 15.133 258 HB2 ARG 37 HB2 ARG 37 11.565 -2.157 14.220 259 HB3 ARG 37 HB3 ARG 37 11.296 -3.150 12.782 260 HG2 ARG 37 HG2 ARG 37 10.247 -4.902 14.195 261 HG3 ARG 37 HG3 ARG 37 10.528 -3.900 15.632 262 HD2 ARG 37 HD2 ARG 37 9.091 -2.125 14.660 263 HD3 ARG 37 HD3 ARG 37 8.806 -3.147 13.237 264 HE ARG 37 HE ARG 37 8.121 -4.600 15.612 265 HH11 ARG 37 HH11 ARG 37 6.885 -1.878 13.697 266 HH12 ARG 37 HH12 ARG 37 5.235 -2.187 14.194 267 HH21 ARG 37 HH21 ARG 37 6.004 -4.943 16.137 268 HH22 ARG 37 HH22 ARG 37 4.746 -3.879 15.542 269 H PHE 38 H PHE 38 13.776 -4.465 11.710 270 HA PHE 38 HA PHE 38 12.505 -7.010 11.375 271 HB2 PHE 38 HB2 PHE 38 15.002 -5.863 10.074 272 HB3 PHE 38 HB3 PHE 38 14.157 -7.319 9.539 273 HD1 PHE 38 HD2 PHE 38 11.528 -6.975 9.109 274 HD2 PHE 38 HD1 PHE 38 14.503 -3.872 8.972 275 HE1 PHE 38 HE2 PHE 38 10.030 -5.609 7.654 276 HE2 PHE 38 HE1 PHE 38 13.015 -2.497 7.529 277 HZ PHE 38 HZ PHE 38 10.774 -3.365 6.862 278 H TYR 39 H TYR 39 15.406 -6.098 13.091 279 HA TYR 39 HA TYR 39 16.151 -8.988 13.327 280 HB2 TYR 39 HB2 TYR 39 17.836 -6.499 13.774 281 HB3 TYR 39 HB3 TYR 39 18.386 -8.173 13.930 282 HD1 TYR 39 HD2 TYR 39 18.326 -9.675 11.832 283 HD2 TYR 39 HD1 TYR 39 17.859 -5.399 11.649 284 HE1 TYR 39 HE2 TYR 39 18.893 -9.713 9.403 285 HE2 TYR 39 HE1 TYR 39 18.429 -5.449 9.215 286 HH TYR 39 HH TYR 39 19.206 -8.485 7.506 287 H LEU 40 H LEU 40 15.535 -5.956 15.083 288 HA LEU 40 HA LEU 40 16.194 -6.997 17.685 289 HB2 LEU 40 HB2 LEU 40 14.329 -4.755 16.842 290 HB3 LEU 40 HB3 LEU 40 14.805 -5.081 18.502 291 HG LEU 40 HG LEU 40 16.722 -4.273 16.290 292 HD11 LEU 40 HD11 LEU 40 15.491 -2.661 18.563 293 HD12 LEU 40 HD12 LEU 40 15.116 -2.494 16.829 294 HD13 LEU 40 HD13 LEU 40 16.735 -2.083 17.428 295 HD21 LEU 40 HD21 LEU 40 17.858 -5.544 18.044 296 HD22 LEU 40 HD22 LEU 40 17.103 -4.536 19.301 297 HD23 LEU 40 HD23 LEU 40 18.283 -3.827 18.173 298 H GLN 41 H GLN 41 13.258 -7.063 15.703 299 HA GLN 41 HA GLN 41 11.997 -8.734 17.830 300 HB2 GLN 41 HB2 GLN 41 10.645 -6.721 15.991 301 HB3 GLN 41 HB3 GLN 41 9.802 -7.870 17.034 302 HG2 GLN 41 HG2 GLN 41 11.025 -6.826 18.995 303 HG3 GLN 41 HG3 GLN 41 11.540 -5.546 17.885 304 HE21 GLN 41 HE21 GLN 41 9.469 -6.063 20.250 305 HE22 GLN 41 HE22 GLN 41 8.084 -5.152 19.696 306 HA PRO 42 HA PRO 42 11.649 -11.545 14.438 307 HB2 PRO 42 HB2 PRO 42 9.443 -13.029 15.053 308 HB3 PRO 42 HB3 PRO 42 10.962 -13.162 15.998 309 HG2 PRO 42 HG2 PRO 42 8.507 -11.523 16.596 310 HG3 PRO 42 HG3 PRO 42 9.375 -12.678 17.658 311 HD2 PRO 42 HD2 PRO 42 9.810 -10.016 17.792 312 HD3 PRO 42 HD3 PRO 42 11.149 -11.195 18.010 313 H LEU 43 H LEU 43 9.934 -12.260 12.749 314 HA LEU 43 HA LEU 43 8.047 -10.008 12.228 315 HB2 LEU 43 HB2 LEU 43 8.242 -10.989 9.796 316 HB3 LEU 43 HB3 LEU 43 9.286 -9.751 10.405 317 HG LEU 43 HG LEU 43 10.323 -11.393 8.896 318 HD11 LEU 43 HD11 LEU 43 12.452 -11.490 10.039 319 HD12 LEU 43 HD12 LEU 43 11.678 -11.235 11.613 320 HD13 LEU 43 HD13 LEU 43 11.662 -9.947 10.396 321 HD21 LEU 43 HD21 LEU 43 11.055 -13.560 9.643 322 HD22 LEU 43 HD22 LEU 43 9.286 -13.471 9.761 323 HD23 LEU 43 HD23 LEU 43 10.285 -13.338 11.224 324 HA PRO 44 HA PRO 44 5.690 -13.907 12.696 325 HB2 PRO 44 HB2 PRO 44 3.761 -13.133 14.452 326 HB3 PRO 44 HB3 PRO 44 5.402 -13.599 15.009 327 HG2 PRO 44 HG2 PRO 44 4.287 -10.864 14.487 328 HG3 PRO 44 HG3 PRO 44 5.141 -11.472 15.938 329 HD2 PRO 44 HD2 PRO 44 6.414 -10.076 13.990 330 HD3 PRO 44 HD3 PRO 44 7.216 -11.413 14.882 331 HA PRO 45 HA PRO 45 2.811 -12.498 9.702 332 HB2 PRO 45 HB2 PRO 45 0.661 -14.176 9.919 333 HB3 PRO 45 HB3 PRO 45 2.244 -14.703 9.272 334 HG2 PRO 45 HG2 PRO 45 1.188 -14.984 12.078 335 HG3 PRO 45 HG3 PRO 45 1.879 -16.244 11.002 336 HD2 PRO 45 HD2 PRO 45 3.398 -15.054 12.854 337 HD3 PRO 45 HD3 PRO 45 4.061 -15.383 11.213 338 H THR 46 H THR 46 1.818 -12.542 13.051 339 HA THR 46 HA THR 46 -0.683 -11.131 12.722 340 HB THR 46 HB THR 46 -0.165 -10.510 15.186 341 HG1 THR 46 HG1 THR 46 1.582 -11.571 16.081 342 HG21 THR 46 HG21 THR 46 -1.585 -12.451 14.538 343 HG22 THR 46 HG22 THR 46 -0.613 -12.788 15.986 344 HG23 THR 46 HG23 THR 46 -0.122 -13.460 14.415 345 H GLU 47 H GLU 47 2.702 -10.112 13.455 346 HA GLU 47 HA GLU 47 1.949 -7.294 13.389 347 HB2 GLU 47 HB2 GLU 47 4.650 -8.671 13.345 348 HB3 GLU 47 HB3 GLU 47 4.413 -6.919 13.311 349 HG2 GLU 47 HG2 GLU 47 3.095 -7.155 15.459 350 HG3 GLU 47 HG3 GLU 47 3.684 -8.826 15.543 351 H ALA 48 H ALA 48 2.910 -9.711 11.041 352 HA ALA 48 HA ALA 48 3.880 -7.942 9.032 353 HB1 ALA 48 HB1 ALA 48 4.071 -10.423 8.926 354 HB2 ALA 48 HB2 ALA 48 2.314 -10.524 8.644 355 HB3 ALA 48 HB3 ALA 48 3.362 -9.721 7.452 356 H ALA 49 H ALA 49 0.574 -8.695 10.137 357 HA ALA 49 HA ALA 49 -0.767 -7.462 7.919 358 HB1 ALA 49 HB1 ALA 49 -1.667 -7.686 10.829 359 HB2 ALA 49 HB2 ALA 49 -2.711 -7.350 9.427 360 HB3 ALA 49 HB3 ALA 49 -1.902 -8.928 9.578 361 H GLN 50 H GLN 50 0.558 -6.174 10.974 362 HA GLN 50 HA GLN 50 -0.480 -3.512 10.686 363 HB2 GLN 50 HB2 GLN 50 2.103 -4.393 12.028 364 HB3 GLN 50 HB3 GLN 50 1.259 -2.871 12.295 365 HG2 GLN 50 HG2 GLN 50 -0.633 -4.087 13.298 366 HG3 GLN 50 HG3 GLN 50 0.187 -5.628 12.996 367 HE21 GLN 50 HE21 GLN 50 -0.589 -4.974 15.544 368 HE22 GLN 50 HE22 GLN 50 0.826 -4.648 16.516 369 H ARG 51 H ARG 51 2.510 -5.132 9.644 370 HA ARG 51 HA ARG 51 3.743 -2.703 8.607 371 HB2 ARG 51 HB2 ARG 51 4.357 -5.643 8.083 372 HB3 ARG 51 HB3 ARG 51 5.412 -4.283 7.672 373 HG2 ARG 51 HG2 ARG 51 5.713 -3.742 10.062 374 HG3 ARG 51 HG3 ARG 51 4.546 -4.984 10.517 375 HD2 ARG 51 HD2 ARG 51 6.115 -6.658 9.326 376 HD3 ARG 51 HD3 ARG 51 7.325 -5.363 9.399 377 HE ARG 51 HE ARG 51 6.048 -5.916 11.971 378 HH11 ARG 51 HH21 ARG 51 8.692 -6.929 9.863 379 HH12 ARG 51 HH22 ARG 51 9.574 -7.662 11.180 380 HH21 ARG 51 HH11 ARG 51 7.229 -6.919 13.604 381 HH22 ARG 51 HH12 ARG 51 8.763 -7.674 13.231 382 H ALA 52 H ALA 52 1.731 -5.297 7.260 383 HA ALA 52 HA ALA 52 2.056 -4.664 4.524 384 HB1 ALA 52 HB1 ALA 52 0.017 -5.914 4.158 385 HB2 ALA 52 HB2 ALA 52 0.952 -6.720 5.436 386 HB3 ALA 52 HB3 ALA 52 -0.460 -5.729 5.866 387 H LYS 53 H LYS 53 0.112 -3.050 7.014 388 HA LYS 53 HA LYS 53 -1.651 -1.618 5.330 389 HB2 LYS 53 HB2 LYS 53 -0.232 -0.501 7.792 390 HB3 LYS 53 HB3 LYS 53 -1.746 0.067 7.087 391 HG2 LYS 53 HG2 LYS 53 -2.589 -2.360 7.634 392 HG3 LYS 53 HG3 LYS 53 -1.219 -2.403 8.728 393 HD2 LYS 53 HD2 LYS 53 -3.389 -0.275 8.724 394 HD3 LYS 53 HD3 LYS 53 -3.344 -1.676 9.813 395 HE2 LYS 53 HE2 LYS 53 -1.164 -0.894 10.710 396 HE3 LYS 53 HE3 LYS 53 -1.241 0.524 9.646 397 HZ1 LYS 53 HZ1 LYS 53 -3.189 -0.119 11.784 398 HZ2 LYS 53 HZ2 LYS 53 -3.278 1.184 10.776 399 HZ3 LYS 53 HZ3 LYS 53 -2.032 1.058 11.849 400 H VAL 54 H VAL 54 1.728 -1.037 6.304 401 HA VAL 54 HA VAL 54 1.954 1.503 4.915 402 HB VAL 54 HB VAL 54 4.119 -0.360 6.026 403 HG11 VAL 54 HG11 VAL 54 5.048 1.237 4.393 404 HG12 VAL 54 HG12 VAL 54 4.233 2.586 5.218 405 HG13 VAL 54 HG13 VAL 54 5.537 1.689 6.036 406 HG21 VAL 54 HG21 VAL 54 2.625 0.322 7.819 407 HG22 VAL 54 HG22 VAL 54 4.121 1.261 7.948 408 HG23 VAL 54 HG23 VAL 54 2.664 2.016 7.269 409 H SER 55 H SER 55 2.962 -1.894 4.272 410 HA SER 55 HA SER 55 4.332 -1.388 1.850 411 HB2 SER 55 HB2 SER 55 2.662 -3.839 2.507 412 HB3 SER 55 HB3 SER 55 4.071 -3.751 1.428 413 HG SER 55 HG SER 55 4.537 -4.566 3.587 414 H ALA 56 H ALA 56 0.863 -1.615 2.507 415 HA ALA 56 HA ALA 56 0.137 -1.717 -0.320 416 HB1 ALA 56 HB1 ALA 56 -1.207 -2.586 1.685 417 HB2 ALA 56 HB2 ALA 56 -1.644 -0.885 1.972 418 HB3 ALA 56 HB3 ALA 56 -2.073 -1.679 0.437 419 H SER 57 H SER 57 0.634 0.757 2.143 420 HA SER 57 HA SER 57 -0.638 2.877 0.657 421 HB2 SER 57 HB2 SER 57 1.437 2.991 2.889 422 HB3 SER 57 HB3 SER 57 0.460 4.355 2.308 423 HG SER 57 HG SER 57 -0.459 1.966 3.572 424 H GLU 58 H GLU 58 2.462 1.320 0.480 425 HA GLU 58 HA GLU 58 4.045 3.377 -0.701 426 HB2 GLU 58 HB2 GLU 58 3.921 0.369 -1.057 427 HB3 GLU 58 HB3 GLU 58 5.102 1.358 -1.893 428 HG2 GLU 58 HG2 GLU 58 4.930 1.679 1.060 429 HG3 GLU 58 HG3 GLU 58 5.608 0.165 0.432 430 H ILE 59 H ILE 59 1.565 1.201 -2.004 431 HA ILE 59 HA ILE 59 2.060 1.862 -4.775 432 HB ILE 59 HB ILE 59 -0.425 0.674 -3.454 433 HG12 ILE 59 HG12 ILE 59 1.887 -0.741 -4.834 434 HG13 ILE 59 HG13 ILE 59 1.721 -0.605 -3.085 435 HG21 ILE 59 HG21 ILE 59 -0.878 1.577 -5.744 436 HG22 ILE 59 HG22 ILE 59 0.473 0.617 -6.385 437 HG23 ILE 59 HG23 ILE 59 -0.970 -0.187 -5.724 438 HD11 ILE 59 HD11 ILE 59 -0.074 -2.147 -4.982 439 HD12 ILE 59 HD12 ILE 59 0.944 -2.773 -3.668 440 HD13 ILE 59 HD13 ILE 59 -0.503 -1.814 -3.285 441 H LEU 60 H LEU 60 0.086 3.270 -2.170 442 HA LEU 60 HA LEU 60 -1.567 4.901 -3.873 443 HB2 LEU 60 HB2 LEU 60 -0.587 5.487 -1.059 444 HB3 LEU 60 HB3 LEU 60 -1.916 6.291 -1.873 445 HG LEU 60 HG LEU 60 -1.909 3.348 -1.118 446 HD11 LEU 60 HD11 LEU 60 -3.377 4.004 0.730 447 HD12 LEU 60 HD12 LEU 60 -3.256 5.714 0.251 448 HD13 LEU 60 HD13 LEU 60 -1.823 4.855 0.861 449 HD21 LEU 60 HD21 LEU 60 -4.135 5.190 -2.027 450 HD22 LEU 60 HD22 LEU 60 -4.326 3.502 -1.495 451 HD23 LEU 60 HD23 LEU 60 -3.413 3.867 -2.972 452 H ASN 61 H ASN 61 1.700 5.255 -2.536 453 HA ASN 61 HA ASN 61 1.989 8.039 -3.256 454 HB2 ASN 61 HB2 ASN 61 3.292 6.750 -1.506 455 HB3 ASN 61 HB3 ASN 61 4.185 5.990 -2.832 456 HD21 ASN 61 HD21 ASN 61 6.153 6.860 -2.307 457 HD22 ASN 61 HD22 ASN 61 6.501 8.568 -2.451 458 H VAL 62 H VAL 62 1.990 5.200 -5.199 459 HA VAL 62 HA VAL 62 4.011 5.942 -7.081 460 HB VAL 62 HB VAL 62 2.630 3.686 -6.689 461 HG11 VAL 62 HG11 VAL 62 0.497 4.814 -7.604 462 HG12 VAL 62 HG12 VAL 62 1.258 4.715 -9.212 463 HG13 VAL 62 HG13 VAL 62 0.917 3.242 -8.282 464 HG21 VAL 62 HG21 VAL 62 4.685 3.896 -8.006 465 HG22 VAL 62 HG22 VAL 62 3.506 2.867 -8.837 466 HG23 VAL 62 HG23 VAL 62 3.755 4.538 -9.383 467 H LYS 63 H LYS 63 1.059 7.475 -6.450 468 HA LYS 63 HA LYS 63 0.131 8.213 -9.016 469 HB2 LYS 63 HB2 LYS 63 -0.796 8.693 -6.631 470 HB3 LYS 63 HB3 LYS 63 0.171 10.163 -6.703 471 HG2 LYS 63 HG2 LYS 63 -1.615 9.570 -9.042 472 HG3 LYS 63 HG3 LYS 63 -2.405 10.025 -7.524 473 HD2 LYS 63 HD2 LYS 63 -1.205 12.129 -7.445 474 HD3 LYS 63 HD3 LYS 63 -0.225 11.673 -8.844 475 HE2 LYS 63 HE2 LYS 63 -2.264 11.568 -10.249 476 HE3 LYS 63 HE3 LYS 63 -3.234 12.094 -8.857 477 HZ1 LYS 63 HZ1 LYS 63 -1.010 13.657 -10.063 478 HZ2 LYS 63 HZ2 LYS 63 -1.995 14.156 -8.837 479 HZ3 LYS 63 HZ3 LYS 63 -2.614 13.926 -10.350 480 H GLN 64 H GLN 64 2.976 9.314 -7.229 481 HA GLN 64 HA GLN 64 3.494 11.729 -8.635 482 HB2 GLN 64 HB2 GLN 64 5.446 9.655 -7.555 483 HB3 GLN 64 HB3 GLN 64 5.870 11.302 -8.033 484 HG2 GLN 64 HG2 GLN 64 3.997 10.531 -5.761 485 HG3 GLN 64 HG3 GLN 64 5.660 11.101 -5.596 486 HE21 GLN 64 HE21 GLN 64 2.870 12.135 -4.811 487 HE22 GLN 64 HE22 GLN 64 2.902 13.801 -5.342 488 H PHE 65 H PHE 65 4.083 8.337 -9.583 489 HA PHE 65 HA PHE 65 5.750 9.010 -11.862 490 HB2 PHE 65 HB2 PHE 65 4.159 6.551 -11.107 491 HB3 PHE 65 HB3 PHE 65 5.145 6.656 -12.566 492 HD1 PHE 65 HD2 PHE 65 5.256 6.631 -8.848 493 HD2 PHE 65 HD1 PHE 65 7.526 6.453 -12.498 494 HE1 PHE 65 HE2 PHE 65 7.258 5.924 -7.556 495 HE2 PHE 65 HE1 PHE 65 9.538 5.744 -11.210 496 HZ PHE 65 HZ PHE 65 9.407 5.482 -8.736 497 H ILE 66 H ILE 66 2.291 8.856 -11.276 498 HA ILE 66 HA ILE 66 1.477 8.622 -14.044 499 HB ILE 66 HB ILE 66 -0.057 9.975 -11.760 500 HG12 ILE 66 HG12 ILE 66 0.656 7.679 -11.105 501 HG13 ILE 66 HG13 ILE 66 -1.084 7.902 -11.189 502 HG21 ILE 66 HG21 ILE 66 -1.095 10.464 -13.862 503 HG22 ILE 66 HG22 ILE 66 -0.932 8.784 -14.423 504 HG23 ILE 66 HG23 ILE 66 -2.058 9.180 -13.107 505 HD11 ILE 66 HD11 ILE 66 -1.271 6.617 -13.176 506 HD12 ILE 66 HD12 ILE 66 0.490 6.626 -13.434 507 HD13 ILE 66 HD13 ILE 66 -0.205 5.726 -12.074 508 H ASP 67 H ASP 67 1.992 11.313 -11.735 509 HA ASP 67 HA ASP 67 1.328 13.399 -13.593 510 HB2 ASP 67 HB2 ASP 67 3.053 13.350 -11.095 511 HB3 ASP 67 HB3 ASP 67 2.691 14.829 -12.001 512 H ARG 68 H ARG 68 4.337 11.722 -12.758 513 HA ARG 68 HA ARG 68 6.077 13.308 -14.410 514 HB2 ARG 68 HB2 ARG 68 6.240 11.002 -12.727 515 HB3 ARG 68 HB3 ARG 68 6.938 10.559 -14.277 516 HG2 ARG 68 HG2 ARG 68 7.770 12.970 -12.628 517 HG3 ARG 68 HG3 ARG 68 8.591 11.400 -12.627 518 HD2 ARG 68 HD2 ARG 68 8.872 11.670 -15.144 519 HD3 ARG 68 HD3 ARG 68 8.332 13.345 -14.950 520 HE ARG 68 HE ARG 68 10.894 12.169 -14.112 521 HH11 ARG 68 HH11 ARG 68 8.782 14.989 -13.833 522 HH12 ARG 68 HH12 ARG 68 10.085 16.023 -13.313 523 HH21 ARG 68 HH21 ARG 68 12.494 13.548 -13.434 524 HH22 ARG 68 HH22 ARG 68 12.144 15.219 -13.092 525 H LYS 69 H LYS 69 3.774 10.815 -15.144 526 HA LYS 69 HA LYS 69 3.186 9.698 -17.054 527 HB2 LYS 69 HB2 LYS 69 4.427 12.144 -18.359 528 HB3 LYS 69 HB3 LYS 69 3.421 10.954 -19.200 529 HG2 LYS 69 HG2 LYS 69 1.508 11.481 -17.862 530 HG3 LYS 69 HG3 LYS 69 2.486 12.427 -16.739 531 HD2 LYS 69 HD2 LYS 69 2.939 14.085 -18.493 532 HD3 LYS 69 HD3 LYS 69 1.899 13.169 -19.609 533 HE2 LYS 69 HE2 LYS 69 0.654 15.038 -18.556 534 HE3 LYS 69 HE3 LYS 69 -0.022 13.468 -18.081 535 HZ1 LYS 69 HZ1 LYS 69 1.844 15.068 -16.407 536 HZ2 LYS 69 HZ2 LYS 69 1.152 13.640 -15.977 537 HZ3 LYS 69 HZ3 LYS 69 0.209 14.979 -16.182 538 H ALA 70 H ALA 70 5.628 9.038 -15.795 539 HA ALA 70 HA ALA 70 7.563 8.486 -17.940 540 HB1 ALA 70 HB1 ALA 70 7.586 7.776 -14.968 541 HB2 ALA 70 HB2 ALA 70 8.946 7.584 -16.102 542 HB3 ALA 70 HB3 ALA 70 8.344 9.207 -15.707 543 H TRP 71 H TRP 71 5.811 7.189 -19.077 544 HA TRP 71 HA TRP 71 4.580 4.892 -18.312 545 HB2 TRP 71 HB2 TRP 71 6.010 4.740 -20.912 546 HB3 TRP 71 HB3 TRP 71 4.348 4.358 -20.494 547 HD1 TRP 71 HD1 TRP 71 6.273 6.878 -22.307 548 HE1 TRP 71 HE1 TRP 71 4.985 9.020 -22.764 549 HE3 TRP 71 HE3 TRP 71 2.465 6.158 -18.963 550 HZ2 TRP 71 HZ2 TRP 71 2.563 10.232 -21.881 551 HZ3 TRP 71 HZ3 TRP 71 0.652 7.877 -18.817 552 HH2 TRP 71 HH2 TRP 71 0.708 9.890 -20.289 553 HA PRO 72 HA PRO 72 7.933 1.810 -18.848 554 HB2 PRO 72 HB2 PRO 72 10.585 2.312 -19.092 555 HB3 PRO 72 HB3 PRO 72 9.474 2.379 -20.500 556 HG2 PRO 72 HG2 PRO 72 10.480 4.636 -18.780 557 HG3 PRO 72 HG3 PRO 72 10.498 4.488 -20.565 558 HD2 PRO 72 HD2 PRO 72 8.552 5.851 -19.244 559 HD3 PRO 72 HD3 PRO 72 8.211 4.919 -20.741 560 H SER 73 H SER 73 8.837 4.609 -16.868 561 HA SER 73 HA SER 73 10.380 3.014 -14.962 562 HB2 SER 73 HB2 SER 73 10.761 5.465 -15.385 563 HB3 SER 73 HB3 SER 73 9.191 5.792 -14.619 564 HG SER 73 HG SER 73 11.033 5.938 -13.188 565 H LEU 74 H LEU 74 7.098 4.308 -15.291 566 HA LEU 74 HA LEU 74 6.145 3.621 -12.701 567 HB2 LEU 74 HB2 LEU 74 4.976 5.126 -14.210 568 HB3 LEU 74 HB3 LEU 74 4.804 3.859 -15.407 569 HG LEU 74 HG LEU 74 3.115 2.742 -14.164 570 HD11 LEU 74 HD11 LEU 74 3.360 4.793 -11.940 571 HD12 LEU 74 HD12 LEU 74 3.980 3.137 -11.830 572 HD13 LEU 74 HD13 LEU 74 2.243 3.423 -12.029 573 HD21 LEU 74 HD21 LEU 74 2.646 5.746 -14.023 574 HD22 LEU 74 HD22 LEU 74 1.423 4.473 -14.236 575 HD23 LEU 74 HD23 LEU 74 2.604 4.787 -15.515 576 H GLN 75 H GLN 75 6.218 1.767 -15.758 577 HA GLN 75 HA GLN 75 4.925 -0.584 -14.933 578 HB2 GLN 75 HB2 GLN 75 5.816 -0.135 -17.205 579 HB3 GLN 75 HB3 GLN 75 7.458 -0.239 -16.593 580 HG2 GLN 75 HG2 GLN 75 6.081 -2.659 -15.882 581 HG3 GLN 75 HG3 GLN 75 5.840 -2.340 -17.595 582 HE21 GLN 75 HE21 GLN 75 8.043 -3.362 -15.182 583 HE22 GLN 75 HE22 GLN 75 9.424 -3.577 -16.233 584 H ASN 76 H ASN 76 8.255 0.513 -14.277 585 HA ASN 76 HA ASN 76 9.032 -2.078 -13.180 586 HB2 ASN 76 HB2 ASN 76 10.628 -0.511 -14.304 587 HB3 ASN 76 HB3 ASN 76 10.417 0.624 -12.967 588 HD21 ASN 76 HD21 ASN 76 12.013 0.567 -11.560 589 HD22 ASN 76 HD22 ASN 76 12.915 -0.859 -11.112 590 H ASP 77 H ASP 77 8.519 1.206 -11.806 591 HA ASP 77 HA ASP 77 9.047 0.364 -9.137 592 HB2 ASP 77 HB2 ASP 77 9.086 2.712 -10.074 593 HB3 ASP 77 HB3 ASP 77 7.317 2.706 -9.990 594 H LEU 78 H LEU 78 5.961 0.738 -10.921 595 HA LEU 78 HA LEU 78 4.252 0.364 -8.693 596 HB2 LEU 78 HB2 LEU 78 3.636 1.152 -10.983 597 HB3 LEU 78 HB3 LEU 78 3.850 -0.484 -11.579 598 HG LEU 78 HG LEU 78 1.984 -1.189 -10.043 599 HD11 LEU 78 HD11 LEU 78 0.429 0.579 -9.314 600 HD12 LEU 78 HD12 LEU 78 1.601 1.807 -9.835 601 HD13 LEU 78 HD13 LEU 78 1.998 0.702 -8.496 602 HD21 LEU 78 HD21 LEU 78 0.262 -0.296 -11.589 603 HD22 LEU 78 HD22 LEU 78 1.702 -0.865 -12.450 604 HD23 LEU 78 HD23 LEU 78 1.449 0.877 -12.206 605 H ARG 79 H ARG 79 5.716 -2.022 -10.921 606 HA ARG 79 HA ARG 79 4.289 -4.234 -9.695 607 HB2 ARG 79 HB2 ARG 79 6.688 -4.132 -11.555 608 HB3 ARG 79 HB3 ARG 79 5.925 -5.634 -11.004 609 HG2 ARG 79 HG2 ARG 79 3.783 -4.956 -12.030 610 HG3 ARG 79 HG3 ARG 79 4.499 -3.425 -12.553 611 HD2 ARG 79 HD2 ARG 79 6.145 -4.707 -13.931 612 HD3 ARG 79 HD3 ARG 79 5.316 -6.207 -13.483 613 HE ARG 79 HE ARG 79 4.364 -4.102 -15.339 614 HH11 ARG 79 HH21 ARG 79 3.456 -7.079 -13.620 615 HH12 ARG 79 HH22 ARG 79 2.089 -7.339 -14.689 616 HH21 ARG 79 HH11 ARG 79 2.647 -4.547 -16.605 617 HH22 ARG 79 HH12 ARG 79 1.645 -5.975 -16.312 618 H LEU 80 H LEU 80 7.348 -2.573 -9.037 619 HA LEU 80 HA LEU 80 8.337 -4.638 -7.261 620 HB2 LEU 80 HB2 LEU 80 8.943 -1.695 -7.590 621 HB3 LEU 80 HB3 LEU 80 9.666 -2.645 -6.301 622 HG LEU 80 HG LEU 80 9.965 -3.333 -9.239 623 HD11 LEU 80 HD11 LEU 80 12.196 -2.315 -9.072 624 HD12 LEU 80 HD12 LEU 80 11.849 -1.798 -7.404 625 HD13 LEU 80 HD13 LEU 80 10.924 -1.117 -8.766 626 HD21 LEU 80 HD21 LEU 80 11.903 -4.662 -8.416 627 HD22 LEU 80 HD22 LEU 80 10.367 -5.236 -7.746 628 HD23 LEU 80 HD23 LEU 80 11.458 -4.253 -6.743 629 H ARG 81 H ARG 81 6.487 -1.568 -6.688 630 HA ARG 81 HA ARG 81 6.398 -1.903 -3.837 631 HB2 ARG 81 HB2 ARG 81 4.223 -0.647 -5.552 632 HB3 ARG 81 HB3 ARG 81 4.495 -0.380 -3.831 633 HG2 ARG 81 HG2 ARG 81 6.301 0.501 -6.092 634 HG3 ARG 81 HG3 ARG 81 5.220 1.534 -5.186 635 HD2 ARG 81 HD2 ARG 81 6.571 1.368 -3.228 636 HD3 ARG 81 HD3 ARG 81 7.517 0.024 -3.902 637 HE ARG 81 HE ARG 81 7.809 2.089 -5.741 638 HH11 ARG 81 HH21 ARG 81 8.503 1.835 -2.248 639 HH12 ARG 81 HH22 ARG 81 9.859 2.925 -2.385 640 HH21 ARG 81 HH11 ARG 81 9.545 3.398 -5.806 641 HH22 ARG 81 HH12 ARG 81 10.423 3.817 -4.344 642 H ALA 82 H ALA 82 4.266 -3.043 -6.447 643 HA ALA 82 HA ALA 82 2.324 -4.255 -4.753 644 HB1 ALA 82 HB1 ALA 82 3.182 -5.095 -7.560 645 HB2 ALA 82 HB2 ALA 82 1.641 -5.480 -6.761 646 HB3 ALA 82 HB3 ALA 82 2.018 -3.800 -7.192 647 H SER 83 H SER 83 5.430 -5.497 -6.071 648 HA SER 83 HA SER 83 5.017 -8.195 -5.245 649 HB2 SER 83 HB2 SER 83 7.609 -6.630 -5.540 650 HB3 SER 83 HB3 SER 83 7.490 -8.391 -5.359 651 HG SER 83 HG SER 83 6.489 -6.777 -7.482 652 H TYR 84 H TYR 84 6.425 -5.377 -3.508 653 HA TYR 84 HA TYR 84 7.264 -6.871 -1.227 654 HB2 TYR 84 HB2 TYR 84 6.254 -4.010 -1.213 655 HB3 TYR 84 HB3 TYR 84 7.359 -4.762 -0.059 656 HD1 TYR 84 HD1 TYR 84 9.198 -6.200 -2.099 657 HD2 TYR 84 HD2 TYR 84 7.601 -2.197 -1.979 658 HE1 TYR 84 HE1 TYR 84 11.098 -5.390 -3.495 659 HE2 TYR 84 HE2 TYR 84 9.519 -1.402 -3.361 660 HH TYR 84 HH TYR 84 11.443 -1.967 -4.441 661 H LEU 85 H LEU 85 4.191 -5.199 -1.974 662 HA LEU 85 HA LEU 85 2.905 -5.798 0.501 663 HB2 LEU 85 HB2 LEU 85 2.049 -4.153 -1.137 664 HB3 LEU 85 HB3 LEU 85 1.741 -5.455 -2.283 665 HG LEU 85 HG LEU 85 0.052 -6.421 -0.752 666 HD11 LEU 85 HD11 LEU 85 -0.764 -4.972 1.139 667 HD12 LEU 85 HD12 LEU 85 0.690 -3.978 0.927 668 HD13 LEU 85 HD13 LEU 85 0.842 -5.676 1.405 669 HD21 LEU 85 HD21 LEU 85 -0.623 -4.872 -2.525 670 HD22 LEU 85 HD22 LEU 85 -0.385 -3.495 -1.428 671 HD23 LEU 85 HD23 LEU 85 -1.658 -4.690 -1.093 672 H ARG 86 H ARG 86 3.228 -7.632 -2.512 673 HA ARG 86 HA ARG 86 1.316 -9.624 -1.794 674 HB2 ARG 86 HB2 ARG 86 2.393 -9.219 -4.099 675 HB3 ARG 86 HB3 ARG 86 3.747 -10.180 -3.514 676 HG2 ARG 86 HG2 ARG 86 2.306 -11.664 -4.756 677 HG3 ARG 86 HG3 ARG 86 2.085 -12.054 -3.041 678 HD2 ARG 86 HD2 ARG 86 0.047 -10.521 -3.054 679 HD3 ARG 86 HD3 ARG 86 0.233 -10.393 -4.802 680 HE ARG 86 HE ARG 86 -0.615 -12.532 -5.062 681 HH11 ARG 86 HH21 ARG 86 -0.032 -12.002 -1.610 682 HH12 ARG 86 HH22 ARG 86 -1.024 -13.364 -1.148 683 HH21 ARG 86 HH11 ARG 86 -1.845 -14.258 -4.377 684 HH22 ARG 86 HH12 ARG 86 -2.021 -14.618 -2.673 685 H TYR 87 H TYR 87 4.801 -9.338 -1.074 686 HA TYR 87 HA TYR 87 5.065 -12.007 -0.062 687 HB2 TYR 87 HB2 TYR 87 6.568 -9.527 0.850 688 HB3 TYR 87 HB3 TYR 87 7.073 -11.205 1.061 689 HD1 TYR 87 HD2 TYR 87 6.454 -12.288 -1.732 690 HD2 TYR 87 HD1 TYR 87 8.327 -8.625 -0.454 691 HE1 TYR 87 HE2 TYR 87 7.671 -12.142 -3.903 692 HE2 TYR 87 HE1 TYR 87 9.540 -8.499 -2.635 693 HH TYR 87 HH TYR 87 9.138 -10.945 -5.189 694 H ASP 88 H ASP 88 4.285 -8.891 1.569 695 HA ASP 88 HA ASP 88 4.035 -9.981 4.199 696 HB2 ASP 88 HB2 ASP 88 2.917 -7.568 2.771 697 HB3 ASP 88 HB3 ASP 88 2.218 -8.046 4.323 698 H LEU 89 H LEU 89 1.585 -9.436 1.628 699 HA LEU 89 HA LEU 89 -0.592 -10.429 3.180 700 HB2 LEU 89 HB2 LEU 89 -0.016 -9.800 0.333 701 HB3 LEU 89 HB3 LEU 89 -1.264 -11.012 0.551 702 HG LEU 89 HG LEU 89 -2.075 -8.665 0.248 703 HD11 LEU 89 HD11 LEU 89 -3.793 -8.861 2.007 704 HD12 LEU 89 HD12 LEU 89 -2.828 -10.127 2.797 705 HD13 LEU 89 HD13 LEU 89 -3.491 -10.393 1.165 706 HD21 LEU 89 HD21 LEU 89 -0.296 -7.639 1.750 707 HD22 LEU 89 HD22 LEU 89 -1.243 -8.227 3.134 708 HD23 LEU 89 HD23 LEU 89 -1.955 -7.065 1.989 709 H LYS 90 H LYS 90 1.639 -12.137 0.991 710 HA LYS 90 HA LYS 90 0.179 -14.572 0.940 711 HB2 LYS 90 HB2 LYS 90 2.125 -13.948 -0.520 712 HB3 LYS 90 HB3 LYS 90 3.198 -14.081 0.871 713 HG2 LYS 90 HG2 LYS 90 3.425 -16.029 -0.487 714 HG3 LYS 90 HG3 LYS 90 2.642 -16.499 1.030 715 HD2 LYS 90 HD2 LYS 90 0.665 -17.028 0.000 716 HD3 LYS 90 HD3 LYS 90 0.826 -15.728 -1.202 717 HE2 LYS 90 HE2 LYS 90 1.028 -17.881 -2.302 718 HE3 LYS 90 HE3 LYS 90 2.565 -16.996 -2.367 719 HZ1 LYS 90 HZ1 LYS 90 3.361 -18.359 -0.527 720 HZ2 LYS 90 HZ2 LYS 90 2.906 -19.323 -1.785 721 HZ3 LYS 90 HZ3 LYS 90 1.935 -19.183 -0.459 722 H THR 91 H THR 91 2.393 -13.094 3.264 723 HA THR 91 HA THR 91 2.663 -15.471 4.912 724 HB THR 91 HB THR 91 3.302 -12.561 5.589 725 HG1 THR 91 HG1 THR 91 4.545 -12.963 3.859 726 HG21 THR 91 HG21 THR 91 4.337 -15.210 6.667 727 HG22 THR 91 HG22 THR 91 3.366 -14.006 7.548 728 HG23 THR 91 HG23 THR 91 5.021 -13.613 7.047 729 H VAL 92 H VAL 92 0.699 -12.406 5.114 730 HA VAL 92 HA VAL 92 -0.289 -13.002 7.742 731 HB VAL 92 HB VAL 92 -1.577 -11.339 5.517 732 HG11 VAL 92 HG11 VAL 92 -2.219 -11.543 8.500 733 HG12 VAL 92 HG12 VAL 92 -2.799 -10.234 7.451 734 HG13 VAL 92 HG13 VAL 92 -3.307 -11.903 7.137 735 HG21 VAL 92 HG21 VAL 92 0.682 -10.563 6.314 736 HG22 VAL 92 HG22 VAL 92 -0.620 -9.420 6.661 737 HG23 VAL 92 HG23 VAL 92 0.024 -10.458 7.953 738 H ILE 93 H ILE 93 -1.629 -13.793 4.492 739 HA ILE 93 HA ILE 93 -4.055 -14.873 5.586 740 HB ILE 93 HB ILE 93 -4.423 -15.900 3.400 741 HG12 ILE 93 HG12 ILE 93 -2.476 -15.047 1.682 742 HG13 ILE 93 HG13 ILE 93 -1.513 -15.493 3.084 743 HG21 ILE 93 HG21 ILE 93 -4.891 -13.458 3.760 744 HG22 ILE 93 HG22 ILE 93 -3.285 -13.073 3.113 745 HG23 ILE 93 HG23 ILE 93 -4.505 -13.830 2.072 746 HD11 ILE 93 HD11 ILE 93 -3.507 -17.323 1.684 747 HD12 ILE 93 HD12 ILE 93 -1.742 -17.355 1.461 748 HD13 ILE 93 HD13 ILE 93 -2.445 -17.774 3.037 749 H SER 94 H SER 94 -0.880 -16.164 5.444 750 HA SER 94 HA SER 94 -1.611 -18.948 5.452 751 HB2 SER 94 HB2 SER 94 0.661 -17.946 4.874 752 HB3 SER 94 HB3 SER 94 0.918 -17.765 6.623 753 HG SER 94 HG SER 94 1.742 -19.736 6.041 754 H ALA 95 H ALA 95 -1.571 -16.467 7.905 755 HA ALA 95 HA ALA 95 -1.406 -18.323 10.152 756 HB1 ALA 95 HB1 ALA 95 -2.229 -15.395 10.054 757 HB2 ALA 95 HB2 ALA 95 -1.769 -16.325 11.505 758 HB3 ALA 95 HB3 ALA 95 -0.572 -16.005 10.237 759 H LYS 96 H LYS 96 -3.801 -18.161 8.009 760 HA LYS 96 HA LYS 96 -5.942 -18.602 10.058 761 HB2 LYS 96 HB2 LYS 96 -5.894 -16.677 7.730 762 HB3 LYS 96 HB3 LYS 96 -7.396 -17.536 8.076 763 HG2 LYS 96 HG2 LYS 96 -7.745 -15.660 9.346 764 HG3 LYS 96 HG3 LYS 96 -6.978 -16.710 10.542 765 HD2 LYS 96 HD2 LYS 96 -4.745 -15.568 9.709 766 HD3 LYS 96 HD3 LYS 96 -5.824 -14.333 9.059 767 HE2 LYS 96 HE2 LYS 96 -5.070 -13.661 11.272 768 HE3 LYS 96 HE3 LYS 96 -6.803 -14.037 11.347 769 HZ1 LYS 96 HZ1 LYS 96 -5.430 -14.992 13.192 770 HZ2 LYS 96 HZ2 LYS 96 -4.690 -15.990 12.096 771 HZ3 LYS 96 HZ3 LYS 96 -6.310 -16.119 12.370 772 HA PRO 97 HA PRO 97 -6.601 -22.082 7.426 773 HB2 PRO 97 HB2 PRO 97 -9.319 -22.278 7.032 774 HB3 PRO 97 HB3 PRO 97 -8.527 -22.744 8.572 775 HG2 PRO 97 HG2 PRO 97 -9.867 -20.166 7.841 776 HG3 PRO 97 HG3 PRO 97 -10.110 -21.192 9.288 777 HD2 PRO 97 HD2 PRO 97 -8.535 -19.021 9.369 778 HD3 PRO 97 HD3 PRO 97 -8.066 -20.526 10.234 779 H LYS 98 H LYS 98 -6.412 -22.284 5.249 780 HA LYS 98 HA LYS 98 -6.290 -19.816 3.810 781 HB2 LYS 98 HB2 LYS 98 -5.578 -22.648 3.366 782 HB3 LYS 98 HB3 LYS 98 -6.004 -21.776 1.895 783 HG2 LYS 98 HG2 LYS 98 -3.573 -21.690 2.298 784 HG3 LYS 98 HG3 LYS 98 -4.295 -20.079 2.331 785 HD2 LYS 98 HD2 LYS 98 -2.667 -20.198 4.101 786 HD3 LYS 98 HD3 LYS 98 -4.266 -20.141 4.842 787 HE2 LYS 98 HE2 LYS 98 -4.157 -22.661 5.084 788 HE3 LYS 98 HE3 LYS 98 -2.478 -22.587 4.512 789 HZ1 LYS 98 HZ1 LYS 98 -1.960 -21.165 6.407 790 HZ2 LYS 98 HZ2 LYS 98 -2.647 -22.562 6.950 791 HZ3 LYS 98 HZ3 LYS 98 -3.531 -21.165 6.904 792 H ASP 99 H ASP 99 -8.743 -22.311 3.965 793 HA ASP 99 HA ASP 99 -10.021 -21.683 1.496 794 HB2 ASP 99 HB2 ASP 99 -10.309 -23.756 2.927 795 HB3 ASP 99 HB3 ASP 99 -11.333 -22.784 3.996 796 H GLU 100 H GLU 100 -10.706 -20.528 4.866 797 HA GLU 100 HA GLU 100 -12.882 -18.839 3.980 798 HB2 GLU 100 HB2 GLU 100 -11.083 -18.645 6.427 799 HB3 GLU 100 HB3 GLU 100 -12.563 -17.711 6.178 800 HG2 GLU 100 HG2 GLU 100 -13.844 -19.844 6.114 801 HG3 GLU 100 HG3 GLU 100 -12.346 -20.712 6.510 802 H LYS 101 H LYS 101 -9.411 -18.398 4.574 803 HA LYS 101 HA LYS 101 -9.519 -15.561 4.204 804 HB2 LYS 101 HB2 LYS 101 -7.738 -17.151 5.370 805 HB3 LYS 101 HB3 LYS 101 -6.941 -16.980 3.792 806 HG2 LYS 101 HG2 LYS 101 -6.112 -15.211 5.069 807 HG3 LYS 101 HG3 LYS 101 -7.362 -14.498 4.044 808 HD2 LYS 101 HD2 LYS 101 -8.809 -15.179 6.332 809 HD3 LYS 101 HD3 LYS 101 -7.233 -14.730 7.006 810 HE2 LYS 101 HE2 LYS 101 -7.338 -12.585 5.729 811 HE3 LYS 101 HE3 LYS 101 -8.952 -13.025 5.163 812 HZ1 LYS 101 HZ1 LYS 101 -9.733 -12.907 7.464 813 HZ2 LYS 101 HZ2 LYS 101 -9.021 -11.475 7.044 814 HZ3 LYS 101 HZ3 LYS 101 -8.220 -12.541 8.008 815 H LYS 102 H LYS 102 -9.610 -18.049 1.987 816 HA LYS 102 HA LYS 102 -8.487 -17.051 -0.402 817 HB2 LYS 102 HB2 LYS 102 -9.641 -19.217 -0.240 818 HB3 LYS 102 HB3 LYS 102 -11.147 -18.394 0.141 819 HG2 LYS 102 HG2 LYS 102 -11.343 -19.183 -2.054 820 HG3 LYS 102 HG3 LYS 102 -11.215 -17.427 -2.142 821 HD2 LYS 102 HD2 LYS 102 -8.935 -17.569 -2.915 822 HD3 LYS 102 HD3 LYS 102 -8.891 -19.325 -2.617 823 HE2 LYS 102 HE2 LYS 102 -10.546 -19.746 -4.325 824 HE3 LYS 102 HE3 LYS 102 -10.909 -18.020 -4.481 825 HZ1 LYS 102 HZ1 LYS 102 -8.345 -19.265 -5.262 826 HZ2 LYS 102 HZ2 LYS 102 -8.733 -17.658 -5.403 827 HZ3 LYS 102 HZ3 LYS 102 -9.542 -18.783 -6.293 828 H SER 103 H SER 103 -11.505 -16.078 1.291 829 HA SER 103 HA SER 103 -12.557 -14.355 -0.667 830 HB2 SER 103 HB2 SER 103 -13.711 -14.942 1.425 831 HB3 SER 103 HB3 SER 103 -12.524 -14.008 2.357 832 HG SER 103 HG SER 103 -14.377 -13.020 0.438 833 H LEU 104 H LEU 104 -9.872 -13.711 1.599 834 HA LEU 104 HA LEU 104 -9.730 -10.882 0.806 835 HB2 LEU 104 HB2 LEU 104 -9.074 -11.963 3.064 836 HB3 LEU 104 HB3 LEU 104 -7.594 -12.467 2.258 837 HG LEU 104 HG LEU 104 -8.522 -9.586 2.530 838 HD11 LEU 104 HD11 LEU 104 -6.483 -11.123 4.163 839 HD12 LEU 104 HD12 LEU 104 -8.103 -10.609 4.705 840 HD13 LEU 104 HD13 LEU 104 -6.882 -9.396 4.320 841 HD21 LEU 104 HD21 LEU 104 -5.927 -10.787 1.579 842 HD22 LEU 104 HD22 LEU 104 -6.044 -9.128 2.211 843 HD23 LEU 104 HD23 LEU 104 -6.971 -9.585 0.782 844 H GLN 105 H GLN 105 -8.075 -13.974 0.087 845 HA GLN 105 HA GLN 105 -5.966 -12.813 -1.452 846 HB2 GLN 105 HB2 GLN 105 -7.204 -15.570 -1.504 847 HB3 GLN 105 HB3 GLN 105 -5.862 -15.089 -2.548 848 HG2 GLN 105 HG2 GLN 105 -4.944 -14.263 -0.111 849 HG3 GLN 105 HG3 GLN 105 -5.865 -15.710 0.332 850 HE21 GLN 105 HE21 GLN 105 -5.340 -17.716 -0.815 851 HE22 GLN 105 HE22 GLN 105 -3.709 -17.957 -1.390 852 H GLU 106 H GLU 106 -9.335 -13.573 -2.362 853 HA GLU 106 HA GLU 106 -8.772 -13.253 -5.181 854 HB2 GLU 106 HB2 GLU 106 -11.393 -12.893 -3.695 855 HB3 GLU 106 HB3 GLU 106 -11.194 -12.984 -5.449 856 HG2 GLU 106 HG2 GLU 106 -10.749 -15.174 -3.419 857 HG3 GLU 106 HG3 GLU 106 -11.924 -15.133 -4.725 858 H LEU 107 H LEU 107 -9.533 -10.962 -2.558 859 HA LEU 107 HA LEU 107 -9.804 -8.713 -4.400 860 HB2 LEU 107 HB2 LEU 107 -9.053 -8.745 -1.465 861 HB3 LEU 107 HB3 LEU 107 -9.397 -7.318 -2.422 862 HG LEU 107 HG LEU 107 -11.351 -9.404 -1.452 863 HD11 LEU 107 HD11 LEU 107 -11.031 -6.403 -1.159 864 HD12 LEU 107 HD12 LEU 107 -10.596 -7.613 0.058 865 HD13 LEU 107 HD13 LEU 107 -12.300 -7.380 -0.398 866 HD21 LEU 107 HD21 LEU 107 -12.088 -8.904 -3.706 867 HD22 LEU 107 HD22 LEU 107 -11.817 -7.157 -3.449 868 HD23 LEU 107 HD23 LEU 107 -13.109 -8.005 -2.568 869 H THR 108 H THR 108 -7.215 -10.301 -2.595 870 HA THR 108 HA THR 108 -5.126 -8.431 -3.147 871 HB THR 108 HB THR 108 -4.841 -11.480 -2.928 872 HG1 THR 108 HG1 THR 108 -6.051 -10.388 -1.182 873 HG21 THR 108 HG21 THR 108 -2.932 -9.229 -2.190 874 HG22 THR 108 HG22 THR 108 -2.747 -10.346 -3.562 875 HG23 THR 108 HG23 THR 108 -2.656 -10.966 -1.888 876 H SER 109 H SER 109 -6.519 -11.161 -5.001 877 HA SER 109 HA SER 109 -4.685 -10.920 -7.212 878 HB2 SER 109 HB2 SER 109 -6.080 -12.939 -6.679 879 HB3 SER 109 HB3 SER 109 -7.517 -12.037 -7.200 880 HG SER 109 HG SER 109 -6.779 -13.207 -8.936 881 H LYS 110 H LYS 110 -8.009 -9.620 -6.627 882 HA LYS 110 HA LYS 110 -8.358 -8.341 -9.150 883 HB2 LYS 110 HB2 LYS 110 -9.307 -7.640 -6.358 884 HB3 LYS 110 HB3 LYS 110 -9.709 -6.650 -7.755 885 HG2 LYS 110 HG2 LYS 110 -11.005 -8.388 -8.756 886 HG3 LYS 110 HG3 LYS 110 -10.416 -9.586 -7.588 887 HD2 LYS 110 HD2 LYS 110 -12.663 -8.904 -6.917 888 HD3 LYS 110 HD3 LYS 110 -11.488 -8.297 -5.746 889 HE2 LYS 110 HE2 LYS 110 -11.558 -6.052 -6.962 890 HE3 LYS 110 HE3 LYS 110 -12.908 -6.688 -7.911 891 HZ1 LYS 110 HZ1 LYS 110 -14.117 -6.974 -5.775 892 HZ2 LYS 110 HZ2 LYS 110 -13.711 -5.397 -6.037 893 HZ3 LYS 110 HZ3 LYS 110 -12.858 -6.288 -4.955 894 H LEU 111 H LEU 111 -6.766 -7.189 -6.176 895 HA LEU 111 HA LEU 111 -6.331 -4.516 -7.026 896 HB2 LEU 111 HB2 LEU 111 -6.065 -5.551 -4.732 897 HB3 LEU 111 HB3 LEU 111 -4.534 -6.214 -5.254 898 HG LEU 111 HG LEU 111 -5.096 -3.234 -5.201 899 HD11 LEU 111 HD11 LEU 111 -5.529 -4.109 -2.988 900 HD12 LEU 111 HD12 LEU 111 -3.960 -3.286 -2.974 901 HD13 LEU 111 HD13 LEU 111 -4.023 -5.060 -3.018 902 HD21 LEU 111 HD21 LEU 111 -2.498 -4.826 -5.144 903 HD22 LEU 111 HD22 LEU 111 -2.626 -3.067 -4.923 904 HD23 LEU 111 HD23 LEU 111 -3.088 -3.795 -6.465 905 H PHE 112 H PHE 112 -4.369 -7.483 -7.425 906 HA PHE 112 HA PHE 112 -2.249 -6.061 -8.779 907 HB2 PHE 112 HB2 PHE 112 -2.896 -8.968 -8.332 908 HB3 PHE 112 HB3 PHE 112 -1.566 -8.470 -9.385 909 HD1 PHE 112 HD1 PHE 112 -2.804 -7.302 -5.992 910 HD2 PHE 112 HD2 PHE 112 0.517 -8.651 -8.365 911 HE1 PHE 112 HE1 PHE 112 -1.338 -7.013 -4.047 912 HE2 PHE 112 HE2 PHE 112 2.014 -8.353 -6.388 913 HZ PHE 112 HZ PHE 112 1.057 -7.537 -4.222 914 H SER 113 H SER 113 -5.282 -7.455 -9.854 915 HA SER 113 HA SER 113 -4.559 -7.532 -12.664 916 HB2 SER 113 HB2 SER 113 -6.602 -8.639 -11.708 917 HB3 SER 113 HB3 SER 113 -7.295 -7.031 -11.419 918 HG SER 113 HG SER 113 -6.924 -6.697 -13.763 919 H SER 114 H SER 114 -5.923 -5.069 -10.420 920 HA SER 114 HA SER 114 -6.204 -3.041 -12.436 921 HB2 SER 114 HB2 SER 114 -5.751 -2.717 -9.442 922 HB3 SER 114 HB3 SER 114 -6.370 -1.477 -10.551 923 HG SER 114 HG SER 114 -8.152 -2.868 -10.964 924 H ILE 115 H ILE 115 -3.490 -4.096 -10.407 925 HA ILE 115 HA ILE 115 -1.714 -1.911 -10.968 926 HB ILE 115 HB ILE 115 -1.221 -4.863 -10.334 927 HG12 ILE 115 HG12 ILE 115 -2.178 -3.464 -8.537 928 HG13 ILE 115 HG13 ILE 115 -0.620 -4.162 -8.135 929 HG21 ILE 115 HG21 ILE 115 0.730 -4.354 -11.544 930 HG22 ILE 115 HG22 ILE 115 0.841 -2.729 -10.857 931 HG23 ILE 115 HG23 ILE 115 1.196 -4.143 -9.843 932 HD11 ILE 115 HD11 ILE 115 0.473 -2.005 -8.456 933 HD12 ILE 115 HD12 ILE 115 -1.061 -1.280 -9.000 934 HD13 ILE 115 HD13 ILE 115 -0.885 -1.846 -7.329 935 H ASP 116 H ASP 116 -2.303 -5.038 -12.645 936 HA ASP 116 HA ASP 116 -0.317 -4.538 -14.659 937 HB2 ASP 116 HB2 ASP 116 -1.326 -6.761 -13.976 938 HB3 ASP 116 HB3 ASP 116 -2.764 -6.311 -14.907 939 H ASN 117 H ASN 117 -3.830 -3.907 -14.482 940 HA ASN 117 HA ASN 117 -4.103 -2.990 -17.191 941 HB2 ASN 117 HB2 ASN 117 -5.638 -2.488 -14.625 942 HB3 ASN 117 HB3 ASN 117 -6.026 -1.601 -16.102 943 HD21 ASN 117 HD21 ASN 117 -6.028 -3.209 -18.109 944 HD22 ASN 117 HD22 ASN 117 -7.084 -4.577 -17.862 945 H LEU 118 H LEU 118 -3.181 -1.344 -14.164 946 HA LEU 118 HA LEU 118 -3.256 1.311 -15.225 947 HB2 LEU 118 HB2 LEU 118 -3.175 0.485 -12.815 948 HB3 LEU 118 HB3 LEU 118 -1.458 0.245 -13.030 949 HG LEU 118 HG LEU 118 -2.899 2.911 -13.165 950 HD11 LEU 118 HD11 LEU 118 -1.932 3.262 -10.925 951 HD12 LEU 118 HD12 LEU 118 -1.214 1.638 -10.967 952 HD13 LEU 118 HD13 LEU 118 -2.981 1.831 -10.941 953 HD21 LEU 118 HD21 LEU 118 0.029 2.165 -13.297 954 HD22 LEU 118 HD22 LEU 118 -0.516 3.760 -12.754 955 HD23 LEU 118 HD23 LEU 118 -0.906 3.208 -14.388 956 H ASP 119 H ASP 119 -0.640 -1.136 -14.964 957 HA ASP 119 HA ASP 119 1.421 0.528 -16.089 958 HB2 ASP 119 HB2 ASP 119 1.987 -1.512 -14.900 959 HB3 ASP 119 HB3 ASP 119 1.057 -2.492 -16.054 960 H HIS 120 H HIS 120 -0.856 -1.849 -17.661 961 HA HIS 120 HA HIS 120 0.210 -1.320 -20.267 962 HB2 HIS 120 HB2 HIS 120 -2.405 -2.452 -19.298 963 HB3 HIS 120 HB3 HIS 120 -2.096 -2.163 -21.017 964 HD1 HIS 120 HD1 HIS 120 -1.289 -4.579 -18.271 965 HD2 HIS 120 HD2 HIS 120 0.049 -3.662 -22.121 966 HE1 HIS 120 HE1 HIS 120 0.124 -6.519 -19.044 967 H ALA 121 H ALA 121 -2.360 0.358 -18.426 968 HA ALA 121 HA ALA 121 -3.213 2.032 -20.596 969 HB1 ALA 121 HB1 ALA 121 -4.000 3.538 -18.765 970 HB2 ALA 121 HB2 ALA 121 -4.514 1.848 -18.549 971 HB3 ALA 121 HB3 ALA 121 -3.167 2.501 -17.589 972 H ALA 122 H ALA 122 -0.538 2.231 -18.262 973 HA ALA 122 HA ALA 122 0.301 4.876 -19.069 974 HB1 ALA 122 HB1 ALA 122 0.894 3.782 -16.908 975 HB2 ALA 122 HB2 ALA 122 1.909 2.630 -17.802 976 HB3 ALA 122 HB3 ALA 122 2.316 4.356 -17.810 977 H LYS 123 H LYS 123 1.205 1.532 -20.039 978 HA LYS 123 HA LYS 123 3.397 2.309 -21.699 979 HB2 LYS 123 HB2 LYS 123 1.465 -0.044 -21.881 980 HB3 LYS 123 HB3 LYS 123 2.895 0.101 -22.899 981 HG2 LYS 123 HG2 LYS 123 3.081 0.117 -19.893 982 HG3 LYS 123 HG3 LYS 123 3.024 -1.384 -20.828 983 HD2 LYS 123 HD2 LYS 123 5.008 -0.584 -22.118 984 HD3 LYS 123 HD3 LYS 123 5.103 0.810 -21.010 985 HE2 LYS 123 HE2 LYS 123 5.229 -0.751 -19.101 986 HE3 LYS 123 HE3 LYS 123 5.184 -2.121 -20.217 987 HZ1 LYS 123 HZ1 LYS 123 7.313 -0.070 -20.118 988 HZ2 LYS 123 HZ2 LYS 123 7.273 -1.354 -21.154 989 HZ3 LYS 123 HZ3 LYS 123 7.436 -1.605 -19.530 990 H ILE 124 H ILE 124 -0.096 2.098 -22.273 991 HA ILE 124 HA ILE 124 0.250 2.659 -25.137 992 HB ILE 124 HB ILE 124 -1.574 1.139 -23.984 993 HG12 ILE 124 HG12 ILE 124 -3.182 1.740 -25.891 994 HG13 ILE 124 HG13 ILE 124 -2.018 2.989 -26.340 995 HG21 ILE 124 HG21 ILE 124 -3.048 3.804 -23.989 996 HG22 ILE 124 HG22 ILE 124 -3.723 2.208 -23.605 997 HG23 ILE 124 HG23 ILE 124 -2.515 2.929 -22.540 998 HD11 ILE 124 HD11 ILE 124 -1.404 0.003 -26.150 999 HD12 ILE 124 HD12 ILE 124 -1.724 0.896 -27.654 1000 HD13 ILE 124 HD13 ILE 124 -0.277 1.268 -26.693 1001 H LYS 125 H LYS 125 0.550 4.455 -22.465 1002 HA LYS 125 HA LYS 125 0.867 6.665 -22.120 1003 HB2 LYS 125 HB2 LYS 125 0.441 7.057 -25.091 1004 HB3 LYS 125 HB3 LYS 125 1.285 8.146 -23.989 1005 HG2 LYS 125 HG2 LYS 125 3.149 6.708 -23.808 1006 HG3 LYS 125 HG3 LYS 125 2.238 5.311 -24.372 1007 HD2 LYS 125 HD2 LYS 125 1.966 6.620 -26.590 1008 HD3 LYS 125 HD3 LYS 125 3.309 7.612 -25.985 1009 HE2 LYS 125 HE2 LYS 125 4.214 5.836 -27.368 1010 HE3 LYS 125 HE3 LYS 125 4.641 5.495 -25.676 1011 HZ1 LYS 125 HZ1 LYS 125 3.781 3.532 -26.886 1012 HZ2 LYS 125 HZ2 LYS 125 2.326 4.279 -27.089 1013 HZ3 LYS 125 HZ3 LYS 125 2.851 3.895 -25.571 1014 H SER 126 H SER 126 -1.797 5.608 -21.869 1015 HA SER 126 HA SER 126 -3.416 8.066 -22.434 1016 HB2 SER 126 HB2 SER 126 -4.221 5.251 -21.611 1017 HB3 SER 126 HB3 SER 126 -5.343 6.620 -21.804 1018 HG SER 126 HG SER 126 -3.581 5.833 -23.876 1019 HA PRO 127 HA PRO 127 -2.116 8.244 -18.089 1020 HB2 PRO 127 HB2 PRO 127 -2.367 10.930 -17.628 1021 HB3 PRO 127 HB3 PRO 127 -0.953 10.219 -18.473 1022 HG2 PRO 127 HG2 PRO 127 -3.427 11.457 -19.662 1023 HG3 PRO 127 HG3 PRO 127 -1.704 11.811 -20.019 1024 HD2 PRO 127 HD2 PRO 127 -3.133 10.143 -21.581 1025 HD3 PRO 127 HD3 PRO 127 -1.415 9.791 -21.186 1026 H THR 128 H THR 128 -5.039 9.598 -19.576 1027 HA THR 128 HA THR 128 -6.561 10.067 -17.220 1028 HB THR 128 HB THR 128 -8.418 9.228 -19.011 1029 HG1 THR 128 HG1 THR 128 -7.590 9.520 -21.092 1030 HG21 THR 128 HG21 THR 128 -8.142 11.556 -18.176 1031 HG22 THR 128 HG22 THR 128 -8.432 11.517 -19.930 1032 HG23 THR 128 HG23 THR 128 -6.788 11.790 -19.308 1033 H GLU 129 H GLU 129 -6.099 7.167 -19.247 1034 HA GLU 129 HA GLU 129 -7.901 5.518 -17.721 1035 HB2 GLU 129 HB2 GLU 129 -5.641 4.953 -19.650 1036 HB3 GLU 129 HB3 GLU 129 -6.561 3.661 -18.871 1037 HG2 GLU 129 HG2 GLU 129 -7.707 5.826 -20.655 1038 HG3 GLU 129 HG3 GLU 129 -7.391 4.147 -21.130 1039 H ALA 130 H ALA 130 -4.393 6.198 -17.602 1040 HA ALA 130 HA ALA 130 -3.799 4.228 -15.612 1041 HB1 ALA 130 HB1 ALA 130 -2.394 6.889 -16.114 1042 HB2 ALA 130 HB2 ALA 130 -1.720 5.464 -15.291 1043 HB3 ALA 130 HB3 ALA 130 -2.093 5.390 -17.028 1044 H GLU 131 H GLU 131 -4.843 7.661 -15.371 1045 HA GLU 131 HA GLU 131 -4.678 7.825 -12.504 1046 HB2 GLU 131 HB2 GLU 131 -6.343 9.274 -14.587 1047 HB3 GLU 131 HB3 GLU 131 -6.440 9.658 -12.864 1048 HG2 GLU 131 HG2 GLU 131 -4.124 10.301 -12.800 1049 HG3 GLU 131 HG3 GLU 131 -3.867 9.740 -14.454 1050 H LYS 132 H LYS 132 -7.267 6.826 -14.756 1051 HA LYS 132 HA LYS 132 -9.262 6.459 -12.726 1052 HB2 LYS 132 HB2 LYS 132 -9.753 6.659 -15.116 1053 HB3 LYS 132 HB3 LYS 132 -8.923 5.133 -15.439 1054 HG2 LYS 132 HG2 LYS 132 -10.611 3.847 -14.454 1055 HG3 LYS 132 HG3 LYS 132 -11.248 5.211 -13.521 1056 HD2 LYS 132 HD2 LYS 132 -12.755 4.615 -15.387 1057 HD3 LYS 132 HD3 LYS 132 -12.126 6.262 -15.540 1058 HE2 LYS 132 HE2 LYS 132 -12.119 5.172 -17.717 1059 HE3 LYS 132 HE3 LYS 132 -10.468 5.506 -17.200 1060 HZ1 LYS 132 HZ1 LYS 132 -11.814 2.879 -17.175 1061 HZ2 LYS 132 HZ2 LYS 132 -10.328 3.155 -16.510 1062 HZ3 LYS 132 HZ3 LYS 132 -10.549 3.353 -18.130 1063 H TYR 133 H TYR 133 -6.875 4.170 -14.168 1064 HA TYR 133 HA TYR 133 -7.812 1.966 -12.541 1065 HB2 TYR 133 HB2 TYR 133 -5.253 2.456 -14.082 1066 HB3 TYR 133 HB3 TYR 133 -5.528 0.992 -13.124 1067 HD1 TYR 133 HD1 TYR 133 -8.073 -0.031 -13.576 1068 HD2 TYR 133 HD2 TYR 133 -5.663 2.163 -16.387 1069 HE1 TYR 133 HE1 TYR 133 -9.332 -1.059 -15.462 1070 HE2 TYR 133 HE2 TYR 133 -6.944 1.140 -18.272 1071 HH TYR 133 HH TYR 133 -9.551 -1.236 -17.725 1072 H TYR 134 H TYR 134 -5.380 4.538 -12.054 1073 HA TYR 134 HA TYR 134 -4.270 3.450 -9.644 1074 HB2 TYR 134 HB2 TYR 134 -3.154 5.329 -10.654 1075 HB3 TYR 134 HB3 TYR 134 -4.631 6.294 -10.639 1076 HD1 TYR 134 HD1 TYR 134 -2.027 4.786 -8.413 1077 HD2 TYR 134 HD2 TYR 134 -5.260 7.610 -8.754 1078 HE1 TYR 134 HE1 TYR 134 -1.443 5.738 -6.180 1079 HE2 TYR 134 HE2 TYR 134 -4.669 8.548 -6.523 1080 HH TYR 134 HH TYR 134 -1.881 7.419 -4.642 1081 H GLY 135 H GLY 135 -7.117 5.599 -10.240 1082 HA2 GLY 135 HA2 GLY 135 -7.841 5.846 -7.504 1083 HA3 GLY 135 HA3 GLY 135 -8.944 5.996 -8.882 1084 H GLN 136 H GLN 136 -8.696 3.320 -9.898 1085 HA GLN 136 HA GLN 136 -10.523 1.929 -8.157 1086 HB2 GLN 136 HB2 GLN 136 -8.796 0.987 -10.472 1087 HB3 GLN 136 HB3 GLN 136 -9.972 -0.043 -9.647 1088 HG2 GLN 136 HG2 GLN 136 -11.797 1.410 -10.317 1089 HG3 GLN 136 HG3 GLN 136 -10.668 2.555 -11.045 1090 HE21 GLN 136 HE21 GLN 136 -12.176 2.118 -12.894 1091 HE22 GLN 136 HE22 GLN 136 -11.755 0.790 -13.953 1092 H THR 137 H THR 137 -6.996 1.789 -8.642 1093 HA THR 137 HA THR 137 -6.585 -0.515 -6.980 1094 HB THR 137 HB THR 137 -4.594 1.733 -7.554 1095 HG1 THR 137 HG1 THR 137 -5.425 0.904 -9.500 1096 HG21 THR 137 HG21 THR 137 -4.234 -1.225 -6.927 1097 HG22 THR 137 HG22 THR 137 -3.857 0.127 -5.831 1098 HG23 THR 137 HG23 THR 137 -2.938 -0.080 -7.336 1099 H VAL 138 H VAL 138 -6.644 3.021 -6.297 1100 HA VAL 138 HA VAL 138 -5.803 2.885 -3.572 1101 HB VAL 138 HB VAL 138 -7.815 4.771 -4.922 1102 HG11 VAL 138 HG11 VAL 138 -6.527 4.964 -2.167 1103 HG12 VAL 138 HG12 VAL 138 -7.343 6.316 -2.986 1104 HG13 VAL 138 HG13 VAL 138 -8.262 4.867 -2.544 1105 HG21 VAL 138 HG21 VAL 138 -5.415 4.813 -5.760 1106 HG22 VAL 138 HG22 VAL 138 -6.012 6.345 -5.114 1107 HG23 VAL 138 HG23 VAL 138 -4.931 5.331 -4.145 1108 H SER 139 H SER 139 -9.095 2.628 -5.019 1109 HA SER 139 HA SER 139 -10.415 2.228 -2.517 1110 HB2 SER 139 HB2 SER 139 -11.204 1.246 -5.286 1111 HB3 SER 139 HB3 SER 139 -12.283 1.403 -3.882 1112 HG SER 139 HG SER 139 -12.374 3.220 -5.306 1113 H ASN 140 H ASN 140 -8.924 -0.053 -4.829 1114 HA ASN 140 HA ASN 140 -9.900 -2.419 -3.529 1115 HB2 ASN 140 HB2 ASN 140 -8.710 -1.986 -5.861 1116 HB3 ASN 140 HB3 ASN 140 -7.251 -2.380 -4.947 1117 HD21 ASN 140 HD21 ASN 140 -9.223 -3.651 -7.036 1118 HD22 ASN 140 HD22 ASN 140 -9.320 -5.297 -6.461 1119 H ILE 141 H ILE 141 -6.964 -0.419 -3.065 1120 HA ILE 141 HA ILE 141 -5.684 -2.175 -1.189 1121 HB ILE 141 HB ILE 141 -5.507 0.870 -1.561 1122 HG12 ILE 141 HG12 ILE 141 -3.357 -1.195 -2.066 1123 HG13 ILE 141 HG13 ILE 141 -4.610 -0.906 -3.271 1124 HG21 ILE 141 HG21 ILE 141 -3.379 0.643 -0.135 1125 HG22 ILE 141 HG22 ILE 141 -4.923 0.555 0.739 1126 HG23 ILE 141 HG23 ILE 141 -4.021 -0.930 0.382 1127 HD11 ILE 141 HD11 ILE 141 -2.648 0.383 -3.817 1128 HD12 ILE 141 HD12 ILE 141 -3.966 1.481 -3.370 1129 HD13 ILE 141 HD13 ILE 141 -2.649 1.151 -2.217 1130 H ASN 142 H ASN 142 -8.165 0.382 -0.836 1131 HA ASN 142 HA ASN 142 -8.245 0.239 2.027 1132 HB2 ASN 142 HB2 ASN 142 -9.230 2.055 0.570 1133 HB3 ASN 142 HB3 ASN 142 -10.543 0.939 0.169 1134 HD21 ASN 142 HD21 ASN 142 -9.320 3.183 2.426 1135 HD22 ASN 142 HD22 ASN 142 -10.574 2.989 3.625 1136 H GLU 143 H GLU 143 -10.129 -1.523 -0.511 1137 HA GLU 143 HA GLU 143 -11.781 -2.929 1.341 1138 HB2 GLU 143 HB2 GLU 143 -10.748 -3.826 -1.384 1139 HB3 GLU 143 HB3 GLU 143 -11.997 -4.651 -0.460 1140 HG2 GLU 143 HG2 GLU 143 -13.436 -2.642 -0.654 1141 HG3 GLU 143 HG3 GLU 143 -12.223 -1.935 -1.737 1142 H VAL 144 H VAL 144 -8.624 -3.752 -0.067 1143 HA VAL 144 HA VAL 144 -8.461 -6.366 1.108 1144 HB VAL 144 HB VAL 144 -6.358 -4.386 0.100 1145 HG11 VAL 144 HG11 VAL 144 -5.893 -7.204 1.151 1146 HG12 VAL 144 HG12 VAL 144 -4.714 -6.275 0.199 1147 HG13 VAL 144 HG13 VAL 144 -5.215 -5.697 1.799 1148 HG21 VAL 144 HG21 VAL 144 -6.144 -6.006 -1.749 1149 HG22 VAL 144 HG22 VAL 144 -7.339 -7.066 -0.978 1150 HG23 VAL 144 HG23 VAL 144 -7.825 -5.472 -1.593 1151 H LEU 145 H LEU 145 -7.659 -3.089 2.287 1152 HA LEU 145 HA LEU 145 -6.229 -4.198 4.545 1153 HB2 LEU 145 HB2 LEU 145 -6.778 -1.515 3.513 1154 HB3 LEU 145 HB3 LEU 145 -6.853 -1.597 5.268 1155 HG LEU 145 HG LEU 145 -4.606 -0.954 4.559 1156 HD11 LEU 145 HD11 LEU 145 -4.771 -2.213 6.598 1157 HD12 LEU 145 HD12 LEU 145 -3.314 -2.702 5.712 1158 HD13 LEU 145 HD13 LEU 145 -4.721 -3.746 5.720 1159 HD21 LEU 145 HD21 LEU 145 -4.530 -1.978 2.353 1160 HD22 LEU 145 HD22 LEU 145 -4.516 -3.597 3.066 1161 HD23 LEU 145 HD23 LEU 145 -3.145 -2.503 3.331 1162 H ALA 146 H ALA 146 -9.557 -3.156 4.046 1163 HA ALA 146 HA ALA 146 -10.235 -3.188 6.847 1164 HB1 ALA 146 HB1 ALA 146 -11.667 -2.142 5.095 1165 HB2 ALA 146 HB2 ALA 146 -11.972 -3.747 4.387 1166 HB3 ALA 146 HB3 ALA 146 -12.570 -3.365 6.021 1167 H LYS 147 H LYS 147 -9.746 -5.712 4.464 1168 HA LYS 147 HA LYS 147 -10.940 -7.744 6.259 1169 HB2 LYS 147 HB2 LYS 147 -9.560 -7.937 3.575 1170 HB3 LYS 147 HB3 LYS 147 -10.265 -9.310 4.450 1171 HG2 LYS 147 HG2 LYS 147 -12.488 -8.164 4.377 1172 HG3 LYS 147 HG3 LYS 147 -11.754 -6.876 3.411 1173 HD2 LYS 147 HD2 LYS 147 -12.606 -8.175 1.734 1174 HD3 LYS 147 HD3 LYS 147 -10.983 -8.867 1.872 1175 HE2 LYS 147 HE2 LYS 147 -12.481 -10.703 1.729 1176 HE3 LYS 147 HE3 LYS 147 -11.993 -10.609 3.435 1177 HZ1 LYS 147 HZ1 LYS 147 -14.076 -9.469 3.907 1178 HZ2 LYS 147 HZ2 LYS 147 -14.395 -10.911 3.167 1179 HZ3 LYS 147 HZ3 LYS 147 -14.511 -9.502 2.316 1180 H LEU 148 H LEU 148 -7.914 -6.234 5.829 1181 HA LEU 148 HA LEU 148 -6.367 -8.444 7.006 1182 HB2 LEU 148 HB2 LEU 148 -5.706 -5.588 6.209 1183 HB3 LEU 148 HB3 LEU 148 -4.583 -6.556 7.156 1184 HG LEU 148 HG LEU 148 -5.693 -7.445 4.485 1185 HD11 LEU 148 HD11 LEU 148 -4.409 -5.398 4.194 1186 HD12 LEU 148 HD12 LEU 148 -3.518 -6.778 3.551 1187 HD13 LEU 148 HD13 LEU 148 -3.054 -6.079 5.120 1188 HD21 LEU 148 HD21 LEU 148 -4.834 -9.286 5.877 1189 HD22 LEU 148 HD22 LEU 148 -3.325 -8.391 6.161 1190 HD23 LEU 148 HD23 LEU 148 -3.724 -8.978 4.535 1191 H GLY 149 H GLY 149 -8.523 -6.056 8.129 1192 HA2 GLY 149 HA2 GLY 149 -7.291 -5.628 10.722 1193 HA3 GLY 149 HA3 GLY 149 -8.987 -5.343 10.283 Start of MODEL 12 1 H1 GLU 1 H1 GLU 1 0.736 19.993 7.281 2 H2 GLU 1 H2 GLU 1 1.219 18.870 8.393 3 H3 GLU 1 H3 GLU 1 1.131 18.466 6.796 4 HA GLU 1 HA GLU 1 -1.158 19.185 8.507 5 HB2 GLU 1 HB2 GLU 1 -1.101 19.697 5.923 6 HB3 GLU 1 HB3 GLU 1 -1.365 17.966 5.751 7 HG2 GLU 1 HG2 GLU 1 -3.260 18.892 7.683 8 HG3 GLU 1 HG3 GLU 1 -3.260 20.090 6.380 9 H ALA 2 H ALA 2 -2.609 16.756 7.377 10 HA ALA 2 HA ALA 2 -1.507 14.811 9.258 11 HB1 ALA 2 HB1 ALA 2 -3.940 14.963 8.815 12 HB2 ALA 2 HB2 ALA 2 -3.662 14.565 7.102 13 HB3 ALA 2 HB3 ALA 2 -3.316 13.359 8.364 14 H ARG 3 H ARG 3 -1.072 15.705 5.973 15 HA ARG 3 HA ARG 3 0.820 13.422 5.552 16 HB2 ARG 3 HB2 ARG 3 -1.153 14.682 3.599 17 HB3 ARG 3 HB3 ARG 3 0.214 13.688 3.082 18 HG2 ARG 3 HG2 ARG 3 -0.648 11.789 4.397 19 HG3 ARG 3 HG3 ARG 3 -2.047 12.762 4.889 20 HD2 ARG 3 HD2 ARG 3 -1.317 12.127 2.013 21 HD3 ARG 3 HD3 ARG 3 -2.493 11.213 2.978 22 HE ARG 3 HE ARG 3 -3.240 13.925 3.121 23 HH11 ARG 3 HH11 ARG 3 -3.030 11.436 0.628 24 HH12 ARG 3 HH12 ARG 3 -4.330 12.127 -0.306 25 HH21 ARG 3 HH21 ARG 3 -4.876 14.761 1.880 26 HH22 ARG 3 HH22 ARG 3 -5.347 13.993 0.388 27 HA PRO 4 HA PRO 4 3.535 16.799 4.964 28 HB2 PRO 4 HB2 PRO 4 5.495 15.874 3.343 29 HB3 PRO 4 HB3 PRO 4 5.147 15.109 4.921 30 HG2 PRO 4 HG2 PRO 4 4.196 14.301 2.191 31 HG3 PRO 4 HG3 PRO 4 5.013 13.309 3.440 32 HD2 PRO 4 HD2 PRO 4 2.309 13.345 3.128 33 HD3 PRO 4 HD3 PRO 4 3.083 13.136 4.731 34 H ILE 5 H ILE 5 1.336 17.488 3.525 35 HA ILE 5 HA ILE 5 2.526 18.839 1.151 36 HB ILE 5 HB ILE 5 1.123 16.908 0.342 37 HG12 ILE 5 HG12 ILE 5 -0.453 18.264 -1.110 38 HG13 ILE 5 HG13 ILE 5 0.032 19.696 -0.205 39 HG21 ILE 5 HG21 ILE 5 -0.493 16.814 2.245 40 HG22 ILE 5 HG22 ILE 5 -1.227 18.336 1.691 41 HG23 ILE 5 HG23 ILE 5 -1.314 16.880 0.673 42 HD11 ILE 5 HD11 ILE 5 1.252 19.469 -2.362 43 HD12 ILE 5 HD12 ILE 5 2.365 19.427 -0.978 44 HD13 ILE 5 HD13 ILE 5 1.924 17.918 -1.813 45 H VAL 6 H VAL 6 1.944 20.979 1.009 46 HA VAL 6 HA VAL 6 0.023 21.996 3.046 47 HB VAL 6 HB VAL 6 2.737 23.305 2.497 48 HG11 VAL 6 HG11 VAL 6 2.181 24.682 4.477 49 HG12 VAL 6 HG12 VAL 6 0.938 24.864 3.223 50 HG13 VAL 6 HG13 VAL 6 0.623 23.838 4.639 51 HG21 VAL 6 HG21 VAL 6 3.329 22.570 4.832 52 HG22 VAL 6 HG22 VAL 6 1.867 21.556 4.840 53 HG23 VAL 6 HG23 VAL 6 3.178 21.226 3.684 54 H VAL 7 H VAL 7 2.076 23.022 0.257 55 HA VAL 7 HA VAL 7 -0.243 24.687 -0.650 56 HB VAL 7 HB VAL 7 2.732 25.322 -1.011 57 HG11 VAL 7 HG11 VAL 7 0.222 26.940 -1.663 58 HG12 VAL 7 HG12 VAL 7 1.889 27.552 -1.770 59 HG13 VAL 7 HG13 VAL 7 1.358 26.240 -2.838 60 HG21 VAL 7 HG21 VAL 7 2.240 27.232 0.572 61 HG22 VAL 7 HG22 VAL 7 0.669 26.470 0.919 62 HG23 VAL 7 HG23 VAL 7 2.184 25.630 1.325 63 H GLY 8 H GLY 8 2.651 22.840 -1.761 64 HA2 GLY 8 HA2 GLY 8 1.302 21.802 -4.050 65 HA3 GLY 8 HA3 GLY 8 2.242 23.240 -4.498 66 HA PRO 9 HA PRO 9 5.061 19.575 -4.548 67 HB2 PRO 9 HB2 PRO 9 6.574 20.306 -6.717 68 HB3 PRO 9 HB3 PRO 9 4.980 19.500 -6.882 69 HG2 PRO 9 HG2 PRO 9 5.622 22.439 -6.982 70 HG3 PRO 9 HG3 PRO 9 4.707 21.443 -8.164 71 HD2 PRO 9 HD2 PRO 9 3.426 22.901 -6.309 72 HD3 PRO 9 HD3 PRO 9 2.850 21.247 -6.726 73 HA PRO 10 HA PRO 10 8.223 21.659 -2.356 74 HB2 PRO 10 HB2 PRO 10 10.380 19.988 -2.536 75 HB3 PRO 10 HB3 PRO 10 8.890 19.524 -1.650 76 HG2 PRO 10 HG2 PRO 10 9.681 18.878 -4.477 77 HG3 PRO 10 HG3 PRO 10 9.175 17.762 -3.166 78 HD2 PRO 10 HD2 PRO 10 7.416 18.627 -5.005 79 HD3 PRO 10 HD3 PRO 10 6.934 18.463 -3.280 80 HA PRO 11 HA PRO 11 10.827 23.968 -5.137 81 HB2 PRO 11 HB2 PRO 11 12.995 24.626 -3.596 82 HB3 PRO 11 HB3 PRO 11 11.373 25.318 -3.281 83 HG2 PRO 11 HG2 PRO 11 12.697 22.945 -1.994 84 HG3 PRO 11 HG3 PRO 11 11.962 24.386 -1.215 85 HD2 PRO 11 HD2 PRO 11 10.581 22.101 -1.475 86 HD3 PRO 11 HD3 PRO 11 9.778 23.688 -1.730 87 HA PRO 12 HA PRO 12 13.796 21.089 -6.728 88 HB2 PRO 12 HB2 PRO 12 15.758 22.558 -7.902 89 HB3 PRO 12 HB3 PRO 12 14.074 22.573 -8.516 90 HG2 PRO 12 HG2 PRO 12 15.408 24.510 -6.637 91 HG3 PRO 12 HG3 PRO 12 14.536 24.849 -8.166 92 HD2 PRO 12 HD2 PRO 12 13.301 25.058 -5.780 93 HD3 PRO 12 HD3 PRO 12 12.439 24.389 -7.209 94 H LEU 13 H LEU 13 14.458 22.645 -3.947 95 HA LEU 13 HA LEU 13 17.306 21.963 -3.651 96 HB2 LEU 13 HB2 LEU 13 15.191 22.796 -1.623 97 HB3 LEU 13 HB3 LEU 13 16.915 22.640 -1.292 98 HG LEU 13 HG LEU 13 15.696 24.653 -3.218 99 HD11 LEU 13 HD11 LEU 13 16.168 26.307 -1.458 100 HD12 LEU 13 HD12 LEU 13 16.735 25.011 -0.378 101 HD13 LEU 13 HD13 LEU 13 15.029 25.070 -0.883 102 HD21 LEU 13 HD21 LEU 13 18.018 24.125 -3.803 103 HD22 LEU 13 HD22 LEU 13 18.525 24.369 -2.114 104 HD23 LEU 13 HD23 LEU 13 17.930 25.740 -3.077 105 H SER 14 H SER 14 17.963 20.284 -2.082 106 HA SER 14 HA SER 14 16.503 17.855 -2.427 107 HB2 SER 14 HB2 SER 14 18.962 18.015 -2.012 108 HB3 SER 14 HB3 SER 14 18.615 18.483 -0.332 109 HG SER 14 HG SER 14 17.330 16.438 -0.314 110 H GLY 15 H GLY 15 16.208 20.382 -0.048 111 HA2 GLY 15 HA2 GLY 15 14.683 20.630 1.663 112 HA3 GLY 15 HA3 GLY 15 13.867 19.173 1.076 113 H GLY 16 H GLY 16 13.486 18.417 3.182 114 HA2 GLY 16 HA2 GLY 16 15.544 16.727 4.252 115 HA3 GLY 16 HA3 GLY 16 15.336 18.191 5.254 116 H LEU 17 H LEU 17 14.495 16.661 6.929 117 HA LEU 17 HA LEU 17 11.855 15.504 6.418 118 HB2 LEU 17 HB2 LEU 17 11.855 14.802 8.640 119 HB3 LEU 17 HB3 LEU 17 13.516 14.616 8.132 120 HG LEU 17 HG LEU 17 12.456 16.836 9.915 121 HD11 LEU 17 HD11 LEU 17 13.525 15.598 11.726 122 HD12 LEU 17 HD12 LEU 17 14.086 14.353 10.583 123 HD13 LEU 17 HD13 LEU 17 12.349 14.558 10.898 124 HD21 LEU 17 HD21 LEU 17 14.472 17.626 8.802 125 HD22 LEU 17 HD22 LEU 17 15.318 16.097 9.164 126 HD23 LEU 17 HD23 LEU 17 14.865 17.208 10.477 127 HA PRO 18 HA PRO 18 9.912 19.406 6.719 128 HB2 PRO 18 HB2 PRO 18 7.359 18.793 7.446 129 HB3 PRO 18 HB3 PRO 18 8.059 18.282 5.880 130 HG2 PRO 18 HG2 PRO 18 7.878 16.749 8.446 131 HG3 PRO 18 HG3 PRO 18 7.306 16.278 6.815 132 HD2 PRO 18 HD2 PRO 18 9.686 15.447 7.726 133 HD3 PRO 18 HD3 PRO 18 9.496 15.966 6.017 134 H GLY 19 H GLY 19 10.971 18.117 9.472 135 HA2 GLY 19 HA2 GLY 19 9.211 19.182 11.457 136 HA3 GLY 19 HA3 GLY 19 10.830 18.549 11.719 137 H THR 20 H THR 20 11.173 21.055 9.470 138 HA THR 20 HA THR 20 11.277 23.091 11.669 139 HB THR 20 HB THR 20 13.600 22.333 11.138 140 HG1 THR 20 HG1 THR 20 12.749 24.957 10.497 141 HG21 THR 20 HG21 THR 20 14.613 23.018 8.991 142 HG22 THR 20 HG22 THR 20 13.008 23.463 8.376 143 HG23 THR 20 HG23 THR 20 13.374 21.766 8.770 144 H GLU 21 H GLU 21 9.823 22.118 8.908 145 HA GLU 21 HA GLU 21 9.369 24.898 7.902 146 HB2 GLU 21 HB2 GLU 21 8.722 22.223 6.597 147 HB3 GLU 21 HB3 GLU 21 8.566 23.821 5.865 148 HG2 GLU 21 HG2 GLU 21 10.568 23.356 4.954 149 HG3 GLU 21 HG3 GLU 21 11.217 23.838 6.527 150 H ASN 22 H ASN 22 8.069 22.344 9.728 151 HA ASN 22 HA ASN 22 5.345 23.555 9.655 152 HB2 ASN 22 HB2 ASN 22 6.071 20.596 9.442 153 HB3 ASN 22 HB3 ASN 22 4.452 21.181 9.841 154 HD21 ASN 22 HD21 ASN 22 6.821 20.763 7.359 155 HD22 ASN 22 HD22 ASN 22 5.775 21.183 6.022 156 H SER 23 H SER 23 4.125 22.479 11.621 157 HA SER 23 HA SER 23 6.000 22.473 13.946 158 HB2 SER 23 HB2 SER 23 4.050 24.057 13.963 159 HB3 SER 23 HB3 SER 23 2.958 22.659 13.882 160 HG SER 23 HG SER 23 4.042 21.928 15.844 161 H ASP 24 H ASP 24 5.453 20.317 11.877 162 HA ASP 24 HA ASP 24 4.923 18.118 13.769 163 HB2 ASP 24 HB2 ASP 24 3.294 17.051 12.335 164 HB3 ASP 24 HB3 ASP 24 2.719 18.688 12.684 165 H GLN 25 H GLN 25 5.315 15.985 12.495 166 HA GLN 25 HA GLN 25 7.387 16.343 10.398 167 HB2 GLN 25 HB2 GLN 25 8.257 15.941 12.851 168 HB3 GLN 25 HB3 GLN 25 7.764 14.275 12.573 169 HG2 GLN 25 HG2 GLN 25 9.616 15.782 10.680 170 HG3 GLN 25 HG3 GLN 25 10.220 14.923 12.102 171 HE21 GLN 25 HE21 GLN 25 9.212 12.568 12.231 172 HE22 GLN 25 HE22 GLN 25 9.365 11.661 10.747 173 H ALA 26 H ALA 26 4.780 15.916 9.847 174 HA ALA 26 HA ALA 26 4.043 13.115 10.003 175 HB1 ALA 26 HB1 ALA 26 2.383 14.942 10.058 176 HB2 ALA 26 HB2 ALA 26 2.830 15.408 8.403 177 HB3 ALA 26 HB3 ALA 26 2.068 13.828 8.707 178 H ARG 27 H ARG 27 6.297 12.584 8.878 179 HA ARG 27 HA ARG 27 5.994 12.480 5.917 180 HB2 ARG 27 HB2 ARG 27 8.105 11.696 7.904 181 HB3 ARG 27 HB3 ARG 27 7.993 10.747 6.417 182 HG2 ARG 27 HG2 ARG 27 8.149 12.865 5.106 183 HG3 ARG 27 HG3 ARG 27 8.457 13.725 6.626 184 HD2 ARG 27 HD2 ARG 27 10.457 12.385 7.024 185 HD3 ARG 27 HD3 ARG 27 10.095 11.384 5.604 186 HE ARG 27 HE ARG 27 10.342 14.178 4.907 187 HH11 ARG 27 HH11 ARG 27 12.251 11.282 5.551 188 HH12 ARG 27 HH12 ARG 27 13.593 11.839 4.589 189 HH21 ARG 27 HH21 ARG 27 12.125 14.854 3.740 190 HH22 ARG 27 HH22 ARG 27 13.513 13.809 3.574 191 H ASP 28 H ASP 28 5.505 10.605 4.793 192 HA ASP 28 HA ASP 28 3.524 8.976 5.900 193 HB2 ASP 28 HB2 ASP 28 5.331 8.275 3.566 194 HB3 ASP 28 HB3 ASP 28 3.655 7.759 3.817 195 H GLY 29 H GLY 29 7.019 8.333 5.665 196 HA2 GLY 29 HA2 GLY 29 6.642 5.575 6.607 197 HA3 GLY 29 HA3 GLY 29 8.157 6.328 6.117 198 H THR 30 H THR 30 6.215 8.058 8.458 199 HA THR 30 HA THR 30 8.396 7.837 10.379 200 HB THR 30 HB THR 30 5.622 9.074 10.733 201 HG1 THR 30 HG1 THR 30 6.460 10.236 9.150 202 HG21 THR 30 HG21 THR 30 8.261 9.436 12.204 203 HG22 THR 30 HG22 THR 30 6.701 8.892 12.873 204 HG23 THR 30 HG23 THR 30 6.895 10.568 12.325 205 H LEU 31 H LEU 31 8.536 6.608 12.171 206 HA LEU 31 HA LEU 31 8.179 4.873 13.610 207 HB2 LEU 31 HB2 LEU 31 5.390 6.040 13.578 208 HB3 LEU 31 HB3 LEU 31 5.929 4.815 14.719 209 HG LEU 31 HG LEU 31 7.225 7.545 14.488 210 HD11 LEU 31 HD11 LEU 31 5.090 6.564 16.422 211 HD12 LEU 31 HD12 LEU 31 4.859 7.761 15.126 212 HD13 LEU 31 HD13 LEU 31 5.927 8.135 16.493 213 HD21 LEU 31 HD21 LEU 31 7.363 5.373 16.622 214 HD22 LEU 31 HD22 LEU 31 8.088 6.992 16.754 215 HD23 LEU 31 HD23 LEU 31 8.675 5.860 15.524 216 HA PRO 32 HA PRO 32 6.192 1.964 10.616 217 HB2 PRO 32 HB2 PRO 32 8.323 0.319 10.171 218 HB3 PRO 32 HB3 PRO 32 8.086 1.834 9.237 219 HG2 PRO 32 HG2 PRO 32 9.796 1.368 11.677 220 HG3 PRO 32 HG3 PRO 32 10.257 2.095 10.102 221 HD2 PRO 32 HD2 PRO 32 9.595 3.633 12.218 222 HD3 PRO 32 HD3 PRO 32 9.090 4.085 10.550 223 H TYR 33 H TYR 33 5.771 -0.329 11.053 224 HA TYR 33 HA TYR 33 5.470 -0.828 13.854 225 HB2 TYR 33 HB2 TYR 33 4.957 -2.581 11.433 226 HB3 TYR 33 HB3 TYR 33 4.430 -2.954 13.080 227 HD1 TYR 33 HD2 TYR 33 2.880 -1.292 14.284 228 HD2 TYR 33 HD1 TYR 33 3.597 -1.187 10.036 229 HE1 TYR 33 HE2 TYR 33 0.806 0.060 13.959 230 HE2 TYR 33 HE1 TYR 33 1.535 0.183 9.737 231 HH TYR 33 HH TYR 33 -0.177 1.292 10.765 232 H THR 34 H THR 34 8.325 -0.744 13.299 233 HA THR 34 HA THR 34 8.932 -3.212 14.725 234 HB THR 34 HB THR 34 9.237 -3.991 12.388 235 HG1 THR 34 HG1 THR 34 11.363 -4.736 12.713 236 HG21 THR 34 HG21 THR 34 10.963 -3.096 10.947 237 HG22 THR 34 HG22 THR 34 11.450 -1.910 12.175 238 HG23 THR 34 HG23 THR 34 9.865 -1.773 11.379 239 H LYS 35 H LYS 35 10.555 -2.989 16.114 240 HA LYS 35 HA LYS 35 12.602 -0.894 15.829 241 HB2 LYS 35 HB2 LYS 35 10.772 0.256 17.117 242 HB3 LYS 35 HB3 LYS 35 10.801 -1.069 18.289 243 HG2 LYS 35 HG2 LYS 35 13.258 -0.528 18.676 244 HG3 LYS 35 HG3 LYS 35 13.007 0.939 17.714 245 HD2 LYS 35 HD2 LYS 35 11.295 1.693 19.303 246 HD3 LYS 35 HD3 LYS 35 11.473 0.179 20.222 247 HE2 LYS 35 HE2 LYS 35 13.877 0.723 20.602 248 HE3 LYS 35 HE3 LYS 35 13.632 2.278 19.777 249 HZ1 LYS 35 HZ1 LYS 35 13.470 2.507 22.171 250 HZ2 LYS 35 HZ2 LYS 35 12.246 1.404 22.246 251 HZ3 LYS 35 HZ3 LYS 35 12.009 2.847 21.483 252 H ASP 36 H ASP 36 13.861 -2.742 15.495 253 HA ASP 36 HA ASP 36 15.062 -4.633 15.962 254 HB2 ASP 36 HB2 ASP 36 14.593 -3.981 18.880 255 HB3 ASP 36 HB3 ASP 36 15.913 -4.934 18.195 256 H ARG 37 H ARG 37 12.031 -4.537 15.972 257 HA ARG 37 HA ARG 37 11.009 -6.327 17.909 258 HB2 ARG 37 HB2 ARG 37 9.818 -4.558 16.550 259 HB3 ARG 37 HB3 ARG 37 9.802 -5.694 15.199 260 HG2 ARG 37 HG2 ARG 37 8.410 -7.230 16.457 261 HG3 ARG 37 HG3 ARG 37 8.554 -6.213 17.910 262 HD2 ARG 37 HD2 ARG 37 7.466 -4.351 16.734 263 HD3 ARG 37 HD3 ARG 37 7.353 -5.335 15.270 264 HE ARG 37 HE ARG 37 6.086 -6.670 17.481 265 HH11 ARG 37 HH11 ARG 37 5.532 -4.058 15.138 266 HH12 ARG 37 HH12 ARG 37 3.788 -4.223 15.250 267 HH21 ARG 37 HH21 ARG 37 3.887 -6.789 17.549 268 HH22 ARG 37 HH22 ARG 37 2.890 -5.692 16.608 269 H PHE 38 H PHE 38 12.415 -6.931 14.760 270 HA PHE 38 HA PHE 38 11.304 -9.576 14.463 271 HB2 PHE 38 HB2 PHE 38 13.823 -8.397 13.244 272 HB3 PHE 38 HB3 PHE 38 12.930 -9.808 12.664 273 HD1 PHE 38 HD2 PHE 38 10.185 -9.114 12.487 274 HD2 PHE 38 HD1 PHE 38 13.597 -6.569 11.841 275 HE1 PHE 38 HE2 PHE 38 8.807 -7.647 11.027 276 HE2 PHE 38 HE1 PHE 38 12.224 -5.094 10.376 277 HZ PHE 38 HZ PHE 38 9.820 -5.630 9.966 278 H TYR 39 H TYR 39 13.673 -8.351 16.565 279 HA TYR 39 HA TYR 39 14.958 -11.039 16.812 280 HB2 TYR 39 HB2 TYR 39 15.986 -8.494 18.066 281 HB3 TYR 39 HB3 TYR 39 16.873 -9.967 17.658 282 HD1 TYR 39 HD2 TYR 39 16.547 -10.499 14.892 283 HD2 TYR 39 HD1 TYR 39 16.587 -6.640 16.805 284 HE1 TYR 39 HE2 TYR 39 17.215 -9.426 12.737 285 HE2 TYR 39 HE1 TYR 39 17.259 -5.581 14.652 286 HH TYR 39 HH TYR 39 17.829 -5.921 12.466 287 H LEU 40 H LEU 40 13.474 -8.307 18.548 288 HA LEU 40 HA LEU 40 13.628 -9.569 21.145 289 HB2 LEU 40 HB2 LEU 40 11.933 -7.285 20.081 290 HB3 LEU 40 HB3 LEU 40 12.047 -7.732 21.781 291 HG LEU 40 HG LEU 40 14.430 -6.834 20.124 292 HD11 LEU 40 HD11 LEU 40 12.634 -5.226 21.979 293 HD12 LEU 40 HD12 LEU 40 12.767 -5.047 20.209 294 HD13 LEU 40 HD13 LEU 40 14.151 -4.653 21.242 295 HD21 LEU 40 HD21 LEU 40 15.451 -6.414 22.340 296 HD22 LEU 40 HD22 LEU 40 15.050 -8.125 22.113 297 HD23 LEU 40 HD23 LEU 40 14.010 -7.099 23.129 298 H GLN 41 H GLN 41 11.185 -9.489 18.562 299 HA GLN 41 HA GLN 41 9.496 -11.297 20.236 300 HB2 GLN 41 HB2 GLN 41 8.585 -9.163 18.261 301 HB3 GLN 41 HB3 GLN 41 7.531 -10.337 19.054 302 HG2 GLN 41 HG2 GLN 41 8.287 -9.388 21.266 303 HG3 GLN 41 HG3 GLN 41 9.084 -8.090 20.363 304 HE21 GLN 41 HE21 GLN 41 6.204 -9.181 21.765 305 HE22 GLN 41 HE22 GLN 41 5.139 -7.957 21.123 306 HA PRO 42 HA PRO 42 9.651 -13.725 16.471 307 HB2 PRO 42 HB2 PRO 42 7.309 -15.117 16.548 308 HB3 PRO 42 HB3 PRO 42 8.669 -15.527 17.646 309 HG2 PRO 42 HG2 PRO 42 6.234 -13.835 18.190 310 HG3 PRO 42 HG3 PRO 42 6.904 -15.187 19.157 311 HD2 PRO 42 HD2 PRO 42 7.417 -12.582 19.746 312 HD3 PRO 42 HD3 PRO 42 8.643 -13.873 20.000 313 H LEU 43 H LEU 43 8.414 -13.678 14.372 314 HA LEU 43 HA LEU 43 6.607 -11.300 14.247 315 HB2 LEU 43 HB2 LEU 43 7.299 -11.282 11.800 316 HB3 LEU 43 HB3 LEU 43 8.451 -10.719 12.997 317 HG LEU 43 HG LEU 43 8.740 -13.574 12.212 318 HD11 LEU 43 HD11 LEU 43 8.156 -12.566 10.056 319 HD12 LEU 43 HD12 LEU 43 9.880 -12.993 10.102 320 HD13 LEU 43 HD13 LEU 43 9.383 -11.295 10.296 321 HD21 LEU 43 HD21 LEU 43 10.330 -12.337 13.748 322 HD22 LEU 43 HD22 LEU 43 10.765 -11.296 12.379 323 HD23 LEU 43 HD23 LEU 43 11.111 -13.035 12.313 324 HA PRO 44 HA PRO 44 4.016 -14.917 13.067 325 HB2 PRO 44 HB2 PRO 44 1.724 -14.189 14.359 326 HB3 PRO 44 HB3 PRO 44 3.094 -14.949 15.229 327 HG2 PRO 44 HG2 PRO 44 2.425 -12.044 14.937 328 HG3 PRO 44 HG3 PRO 44 2.726 -12.983 16.433 329 HD2 PRO 44 HD2 PRO 44 4.666 -11.524 15.283 330 HD3 PRO 44 HD3 PRO 44 5.020 -13.125 16.017 331 HA PRO 45 HA PRO 45 2.063 -12.906 9.701 332 HB2 PRO 45 HB2 PRO 45 -0.360 -14.145 9.343 333 HB3 PRO 45 HB3 PRO 45 1.210 -14.927 8.983 334 HG2 PRO 45 HG2 PRO 45 -0.441 -15.125 11.484 335 HG3 PRO 45 HG3 PRO 45 0.215 -16.443 10.457 336 HD2 PRO 45 HD2 PRO 45 1.517 -15.685 12.652 337 HD3 PRO 45 HD3 PRO 45 2.434 -16.013 11.140 338 H THR 46 H THR 46 0.360 -12.804 12.758 339 HA THR 46 HA THR 46 -1.671 -10.900 11.973 340 HB THR 46 HB THR 46 -1.371 -10.372 14.568 341 HG1 THR 46 HG1 THR 46 -0.355 -12.051 15.629 342 HG21 THR 46 HG21 THR 46 -3.298 -11.578 13.576 343 HG22 THR 46 HG22 THR 46 -2.776 -12.327 15.101 344 HG23 THR 46 HG23 THR 46 -2.337 -13.079 13.550 345 H GLU 47 H GLU 47 1.694 -10.670 13.194 346 HA GLU 47 HA GLU 47 1.605 -7.753 13.304 347 HB2 GLU 47 HB2 GLU 47 3.934 -9.701 13.260 348 HB3 GLU 47 HB3 GLU 47 4.064 -7.949 13.449 349 HG2 GLU 47 HG2 GLU 47 2.643 -8.129 15.493 350 HG3 GLU 47 HG3 GLU 47 2.792 -9.888 15.368 351 H ALA 48 H ALA 48 2.302 -10.224 10.907 352 HA ALA 48 HA ALA 48 3.765 -8.583 9.078 353 HB1 ALA 48 HB1 ALA 48 3.193 -10.270 7.410 354 HB2 ALA 48 HB2 ALA 48 3.609 -11.077 8.937 355 HB3 ALA 48 HB3 ALA 48 1.906 -10.913 8.444 356 H ALA 49 H ALA 49 0.287 -8.993 9.734 357 HA ALA 49 HA ALA 49 -0.700 -7.617 7.460 358 HB1 ALA 49 HB1 ALA 49 -2.728 -7.270 8.805 359 HB2 ALA 49 HB2 ALA 49 -2.107 -8.917 9.044 360 HB3 ALA 49 HB3 ALA 49 -1.844 -7.671 10.288 361 H GLN 50 H GLN 50 0.614 -6.415 10.518 362 HA GLN 50 HA GLN 50 -0.191 -3.691 10.166 363 HB2 GLN 50 HB2 GLN 50 2.210 -4.753 11.689 364 HB3 GLN 50 HB3 GLN 50 1.432 -3.185 11.894 365 HG2 GLN 50 HG2 GLN 50 -0.663 -4.361 12.591 366 HG3 GLN 50 HG3 GLN 50 0.213 -5.895 12.513 367 HE21 GLN 50 HE21 GLN 50 -1.096 -4.592 14.776 368 HE22 GLN 50 HE22 GLN 50 0.140 -4.385 15.992 369 H ARG 51 H ARG 51 2.684 -5.531 9.080 370 HA ARG 51 HA ARG 51 3.969 -3.093 8.046 371 HB2 ARG 51 HB2 ARG 51 4.556 -6.052 7.671 372 HB3 ARG 51 HB3 ARG 51 5.540 -4.751 6.986 373 HG2 ARG 51 HG2 ARG 51 6.643 -4.473 8.918 374 HG3 ARG 51 HG3 ARG 51 5.123 -4.268 9.803 375 HD2 ARG 51 HD2 ARG 51 4.922 -6.829 9.702 376 HD3 ARG 51 HD3 ARG 51 6.640 -6.820 9.255 377 HE ARG 51 HE ARG 51 6.341 -5.169 11.528 378 HH11 ARG 51 HH21 ARG 51 5.942 -8.610 10.801 379 HH12 ARG 51 HH22 ARG 51 6.231 -9.068 12.465 380 HH21 ARG 51 HH11 ARG 51 6.700 -5.847 13.583 381 HH22 ARG 51 HH12 ARG 51 6.611 -7.551 14.010 382 H ALA 52 H ALA 52 1.975 -5.724 6.817 383 HA ALA 52 HA ALA 52 2.326 -5.266 4.063 384 HB1 ALA 52 HB1 ALA 52 1.228 -7.264 5.017 385 HB2 ALA 52 HB2 ALA 52 -0.160 -6.272 5.514 386 HB3 ALA 52 HB3 ALA 52 0.204 -6.488 3.787 387 H LYS 53 H LYS 53 -0.015 -3.688 6.318 388 HA LYS 53 HA LYS 53 -1.353 -2.275 4.205 389 HB2 LYS 53 HB2 LYS 53 -2.233 -0.823 5.977 390 HB3 LYS 53 HB3 LYS 53 -2.413 -2.542 6.335 391 HG2 LYS 53 HG2 LYS 53 -0.447 -2.409 7.827 392 HG3 LYS 53 HG3 LYS 53 -0.338 -0.674 7.517 393 HD2 LYS 53 HD2 LYS 53 -1.445 -0.932 9.610 394 HD3 LYS 53 HD3 LYS 53 -2.706 -0.485 8.445 395 HE2 LYS 53 HE2 LYS 53 -3.376 -2.857 8.251 396 HE3 LYS 53 HE3 LYS 53 -2.067 -3.331 9.339 397 HZ1 LYS 53 HZ1 LYS 53 -4.415 -1.685 10.065 398 HZ2 LYS 53 HZ2 LYS 53 -3.165 -2.022 11.086 399 HZ3 LYS 53 HZ3 LYS 53 -4.125 -3.243 10.533 400 H VAL 54 H VAL 54 1.729 -1.662 5.799 401 HA VAL 54 HA VAL 54 1.853 1.121 4.919 402 HB VAL 54 HB VAL 54 4.136 -0.758 5.715 403 HG11 VAL 54 HG11 VAL 54 4.931 1.201 4.446 404 HG12 VAL 54 HG12 VAL 54 4.010 2.287 5.514 405 HG13 VAL 54 HG13 VAL 54 5.381 1.352 6.157 406 HG21 VAL 54 HG21 VAL 54 2.525 1.227 7.378 407 HG22 VAL 54 HG22 VAL 54 2.549 -0.544 7.564 408 HG23 VAL 54 HG23 VAL 54 4.004 0.402 7.923 409 H SER 55 H SER 55 3.018 -2.065 3.730 410 HA SER 55 HA SER 55 4.349 -1.048 1.410 411 HB2 SER 55 HB2 SER 55 2.889 -3.699 1.617 412 HB3 SER 55 HB3 SER 55 4.330 -3.317 0.649 413 HG SER 55 HG SER 55 5.456 -3.020 2.629 414 H ALA 56 H ALA 56 0.970 -1.822 2.109 415 HA ALA 56 HA ALA 56 0.031 -1.548 -0.609 416 HB1 ALA 56 HB1 ALA 56 -1.123 -2.708 1.369 417 HB2 ALA 56 HB2 ALA 56 -1.589 -1.075 1.908 418 HB3 ALA 56 HB3 ALA 56 -2.130 -1.687 0.328 419 H SER 57 H SER 57 0.579 0.705 2.085 420 HA SER 57 HA SER 57 -0.832 2.903 0.871 421 HB2 SER 57 HB2 SER 57 1.347 2.896 2.991 422 HB3 SER 57 HB3 SER 57 0.295 4.268 2.583 423 HG SER 57 HG SER 57 -0.487 1.735 3.645 424 H GLU 58 H GLU 58 2.486 1.688 0.603 425 HA GLU 58 HA GLU 58 3.683 4.013 -0.545 426 HB2 GLU 58 HB2 GLU 58 4.187 1.060 -0.606 427 HB3 GLU 58 HB3 GLU 58 5.014 2.058 -1.796 428 HG2 GLU 58 HG2 GLU 58 5.135 2.524 1.194 429 HG3 GLU 58 HG3 GLU 58 6.338 1.611 0.265 430 H ILE 59 H ILE 59 1.592 1.527 -1.921 431 HA ILE 59 HA ILE 59 2.095 2.104 -4.684 432 HB ILE 59 HB ILE 59 -0.332 0.908 -3.284 433 HG12 ILE 59 HG12 ILE 59 1.845 -0.473 -4.889 434 HG13 ILE 59 HG13 ILE 59 1.950 -0.253 -3.143 435 HG21 ILE 59 HG21 ILE 59 -0.864 -0.031 -5.607 436 HG22 ILE 59 HG22 ILE 59 -1.130 1.708 -5.417 437 HG23 ILE 59 HG23 ILE 59 0.320 1.125 -6.250 438 HD11 ILE 59 HD11 ILE 59 -0.152 -1.860 -4.616 439 HD12 ILE 59 HD12 ILE 59 1.161 -2.474 -3.593 440 HD13 ILE 59 HD13 ILE 59 -0.166 -1.535 -2.870 441 H LEU 60 H LEU 60 0.069 3.654 -2.234 442 HA LEU 60 HA LEU 60 -1.625 5.086 -4.058 443 HB2 LEU 60 HB2 LEU 60 -0.712 5.878 -1.275 444 HB3 LEU 60 HB3 LEU 60 -2.095 6.543 -2.131 445 HG LEU 60 HG LEU 60 -1.900 3.622 -1.298 446 HD11 LEU 60 HD11 LEU 60 -1.793 5.122 0.671 447 HD12 LEU 60 HD12 LEU 60 -3.321 4.221 0.603 448 HD13 LEU 60 HD13 LEU 60 -3.276 5.936 0.124 449 HD21 LEU 60 HD21 LEU 60 -4.243 5.345 -2.122 450 HD22 LEU 60 HD22 LEU 60 -4.324 3.655 -1.572 451 HD23 LEU 60 HD23 LEU 60 -3.491 4.052 -3.087 452 H ASN 61 H ASN 61 1.688 5.586 -2.977 453 HA ASN 61 HA ASN 61 1.730 8.412 -3.736 454 HB2 ASN 61 HB2 ASN 61 3.125 7.278 -1.922 455 HB3 ASN 61 HB3 ASN 61 4.097 6.583 -3.227 456 HD21 ASN 61 HD21 ASN 61 5.858 7.743 -2.223 457 HD22 ASN 61 HD22 ASN 61 6.082 9.437 -2.587 458 H VAL 62 H VAL 62 1.986 5.449 -5.470 459 HA VAL 62 HA VAL 62 3.902 6.278 -7.445 460 HB VAL 62 HB VAL 62 1.730 4.140 -7.697 461 HG11 VAL 62 HG11 VAL 62 3.413 3.097 -9.262 462 HG12 VAL 62 HG12 VAL 62 2.714 4.599 -9.873 463 HG13 VAL 62 HG13 VAL 62 4.358 4.595 -9.183 464 HG21 VAL 62 HG21 VAL 62 4.621 3.931 -6.700 465 HG22 VAL 62 HG22 VAL 62 3.167 3.776 -5.689 466 HG23 VAL 62 HG23 VAL 62 3.503 2.568 -6.936 467 H LYS 63 H LYS 63 0.828 7.495 -6.836 468 HA LYS 63 HA LYS 63 -0.161 8.157 -9.431 469 HB2 LYS 63 HB2 LYS 63 -0.908 8.687 -6.870 470 HB3 LYS 63 HB3 LYS 63 -0.237 10.256 -7.301 471 HG2 LYS 63 HG2 LYS 63 -2.347 8.853 -8.994 472 HG3 LYS 63 HG3 LYS 63 -2.763 9.894 -7.626 473 HD2 LYS 63 HD2 LYS 63 -1.566 11.789 -8.717 474 HD3 LYS 63 HD3 LYS 63 -1.257 10.751 -10.119 475 HE2 LYS 63 HE2 LYS 63 -3.701 10.424 -10.408 476 HE3 LYS 63 HE3 LYS 63 -3.995 11.533 -9.056 477 HZ1 LYS 63 HZ1 LYS 63 -3.073 13.313 -10.314 478 HZ2 LYS 63 HZ2 LYS 63 -4.129 12.540 -11.330 479 HZ3 LYS 63 HZ3 LYS 63 -2.504 12.314 -11.495 480 H GLN 64 H GLN 64 2.682 9.259 -7.673 481 HA GLN 64 HA GLN 64 3.202 11.720 -8.981 482 HB2 GLN 64 HB2 GLN 64 5.036 9.527 -7.964 483 HB3 GLN 64 HB3 GLN 64 5.645 11.050 -8.613 484 HG2 GLN 64 HG2 GLN 64 3.781 10.830 -6.224 485 HG3 GLN 64 HG3 GLN 64 5.538 10.991 -6.127 486 HE21 GLN 64 HE21 GLN 64 2.969 12.700 -5.540 487 HE22 GLN 64 HE22 GLN 64 3.448 14.279 -6.117 488 H PHE 65 H PHE 65 3.602 8.373 -10.231 489 HA PHE 65 HA PHE 65 5.372 9.109 -12.351 490 HB2 PHE 65 HB2 PHE 65 5.321 6.917 -12.751 491 HB3 PHE 65 HB3 PHE 65 4.129 6.746 -11.461 492 HD1 PHE 65 HD1 PHE 65 4.596 7.100 -15.132 493 HD2 PHE 65 HD2 PHE 65 1.791 6.315 -11.975 494 HE1 PHE 65 HE1 PHE 65 2.921 6.386 -16.818 495 HE2 PHE 65 HE2 PHE 65 0.111 5.590 -13.657 496 HZ PHE 65 HZ PHE 65 0.662 5.637 -16.085 497 H ILE 66 H ILE 66 1.865 9.402 -12.022 498 HA ILE 66 HA ILE 66 1.319 9.651 -14.840 499 HB ILE 66 HB ILE 66 -0.320 10.711 -12.468 500 HG12 ILE 66 HG12 ILE 66 -0.489 8.057 -13.943 501 HG13 ILE 66 HG13 ILE 66 0.195 8.273 -12.334 502 HG21 ILE 66 HG21 ILE 66 -1.194 10.029 -15.328 503 HG22 ILE 66 HG22 ILE 66 -2.242 10.648 -14.034 504 HG23 ILE 66 HG23 ILE 66 -0.966 11.677 -14.703 505 HD11 ILE 66 HD11 ILE 66 -2.688 8.478 -13.167 506 HD12 ILE 66 HD12 ILE 66 -1.944 7.374 -11.999 507 HD13 ILE 66 HD13 ILE 66 -2.101 9.098 -11.607 508 H ASP 67 H ASP 67 1.924 11.933 -12.183 509 HA ASP 67 HA ASP 67 1.662 14.351 -13.710 510 HB2 ASP 67 HB2 ASP 67 1.642 14.456 -11.308 511 HB3 ASP 67 HB3 ASP 67 3.176 13.586 -11.190 512 H ARG 68 H ARG 68 4.434 12.253 -12.894 513 HA ARG 68 HA ARG 68 6.319 13.924 -14.294 514 HB2 ARG 68 HB2 ARG 68 6.547 11.098 -13.272 515 HB3 ARG 68 HB3 ARG 68 7.899 12.054 -13.896 516 HG2 ARG 68 HG2 ARG 68 6.166 12.913 -11.578 517 HG3 ARG 68 HG3 ARG 68 7.672 12.007 -11.393 518 HD2 ARG 68 HD2 ARG 68 8.740 13.956 -12.733 519 HD3 ARG 68 HD3 ARG 68 7.250 14.845 -12.348 520 HE ARG 68 HE ARG 68 9.401 14.057 -10.514 521 HH11 ARG 68 HH11 ARG 68 6.039 15.217 -10.679 522 HH12 ARG 68 HH12 ARG 68 6.068 15.695 -9.000 523 HH21 ARG 68 HH21 ARG 68 9.322 14.755 -8.415 524 HH22 ARG 68 HH22 ARG 68 7.869 15.462 -7.768 525 H LYS 69 H LYS 69 3.964 11.934 -15.523 526 HA LYS 69 HA LYS 69 3.562 10.948 -17.555 527 HB2 LYS 69 HB2 LYS 69 5.017 13.341 -17.979 528 HB3 LYS 69 HB3 LYS 69 5.662 12.188 -19.142 529 HG2 LYS 69 HG2 LYS 69 3.506 11.858 -20.116 530 HG3 LYS 69 HG3 LYS 69 2.704 12.716 -18.784 531 HD2 LYS 69 HD2 LYS 69 3.927 14.782 -19.414 532 HD3 LYS 69 HD3 LYS 69 4.629 13.923 -20.802 533 HE2 LYS 69 HE2 LYS 69 2.382 13.542 -21.722 534 HE3 LYS 69 HE3 LYS 69 1.652 14.317 -20.297 535 HZ1 LYS 69 HZ1 LYS 69 1.822 15.855 -22.160 536 HZ2 LYS 69 HZ2 LYS 69 3.461 15.664 -22.224 537 HZ3 LYS 69 HZ3 LYS 69 2.764 16.371 -20.907 538 H ALA 70 H ALA 70 5.429 9.656 -15.749 539 HA ALA 70 HA ALA 70 7.652 8.660 -17.345 540 HB1 ALA 70 HB1 ALA 70 6.745 7.872 -14.547 541 HB2 ALA 70 HB2 ALA 70 8.333 7.561 -15.285 542 HB3 ALA 70 HB3 ALA 70 7.834 9.228 -14.933 543 H TRP 71 H TRP 71 5.731 7.762 -18.887 544 HA TRP 71 HA TRP 71 4.353 5.409 -18.387 545 HB2 TRP 71 HB2 TRP 71 5.830 5.726 -20.979 546 HB3 TRP 71 HB3 TRP 71 4.227 5.079 -20.674 547 HD1 TRP 71 HD1 TRP 71 5.857 8.066 -21.973 548 HE1 TRP 71 HE1 TRP 71 4.320 10.076 -22.119 549 HE3 TRP 71 HE3 TRP 71 2.116 6.312 -18.961 550 HZ2 TRP 71 HZ2 TRP 71 1.742 10.811 -21.133 551 HZ3 TRP 71 HZ3 TRP 71 0.100 7.743 -18.595 552 HH2 TRP 71 HH2 TRP 71 -0.064 9.976 -19.687 553 HA PRO 72 HA PRO 72 7.697 2.454 -19.430 554 HB2 PRO 72 HB2 PRO 72 10.353 2.978 -19.536 555 HB3 PRO 72 HB3 PRO 72 9.269 3.308 -20.927 556 HG2 PRO 72 HG2 PRO 72 10.241 5.206 -18.801 557 HG3 PRO 72 HG3 PRO 72 10.303 5.385 -20.584 558 HD2 PRO 72 HD2 PRO 72 8.329 6.500 -19.095 559 HD3 PRO 72 HD3 PRO 72 8.016 5.837 -20.736 560 H SER 73 H SER 73 8.517 4.852 -16.962 561 HA SER 73 HA SER 73 10.123 3.011 -15.393 562 HB2 SER 73 HB2 SER 73 8.815 5.581 -14.465 563 HB3 SER 73 HB3 SER 73 10.282 4.805 -13.827 564 HG SER 73 HG SER 73 10.944 6.433 -15.183 565 H LEU 74 H LEU 74 6.743 3.811 -15.639 566 HA LEU 74 HA LEU 74 5.868 3.228 -13.027 567 HB2 LEU 74 HB2 LEU 74 4.562 4.285 -14.830 568 HB3 LEU 74 HB3 LEU 74 4.504 2.779 -15.707 569 HG LEU 74 HG LEU 74 2.401 3.525 -14.525 570 HD11 LEU 74 HD11 LEU 74 3.233 0.787 -13.658 571 HD12 LEU 74 HD12 LEU 74 2.921 1.225 -15.355 572 HD13 LEU 74 HD13 LEU 74 1.635 1.398 -14.148 573 HD21 LEU 74 HD21 LEU 74 3.780 2.472 -12.061 574 HD22 LEU 74 HD22 LEU 74 2.123 3.094 -12.194 575 HD23 LEU 74 HD23 LEU 74 3.506 4.184 -12.399 576 H GLN 75 H GLN 75 6.363 1.033 -15.803 577 HA GLN 75 HA GLN 75 5.185 -1.244 -14.633 578 HB2 GLN 75 HB2 GLN 75 6.161 -2.467 -16.387 579 HB3 GLN 75 HB3 GLN 75 5.999 -0.839 -17.047 580 HG2 GLN 75 HG2 GLN 75 8.428 -0.463 -16.438 581 HG3 GLN 75 HG3 GLN 75 8.528 -2.189 -16.076 582 HE21 GLN 75 HE21 GLN 75 9.166 0.045 -18.360 583 HE22 GLN 75 HE22 GLN 75 9.068 -0.967 -19.790 584 H ASN 76 H ASN 76 8.237 0.274 -13.897 585 HA ASN 76 HA ASN 76 9.233 -2.172 -12.529 586 HB2 ASN 76 HB2 ASN 76 10.825 -0.851 -13.900 587 HB3 ASN 76 HB3 ASN 76 10.512 0.565 -12.885 588 HD21 ASN 76 HD21 ASN 76 12.188 0.919 -11.602 589 HD22 ASN 76 HD22 ASN 76 13.062 -0.313 -10.724 590 H ASP 77 H ASP 77 8.580 1.301 -11.839 591 HA ASP 77 HA ASP 77 9.202 1.121 -9.091 592 HB2 ASP 77 HB2 ASP 77 8.997 3.199 -10.480 593 HB3 ASP 77 HB3 ASP 77 7.235 3.025 -10.409 594 H LEU 78 H LEU 78 6.007 0.849 -10.705 595 HA LEU 78 HA LEU 78 4.550 0.646 -8.215 596 HB2 LEU 78 HB2 LEU 78 3.570 1.288 -10.383 597 HB3 LEU 78 HB3 LEU 78 3.915 -0.298 -11.033 598 HG LEU 78 HG LEU 78 2.255 -1.304 -9.569 599 HD11 LEU 78 HD11 LEU 78 2.364 0.152 -7.624 600 HD12 LEU 78 HD12 LEU 78 0.714 0.123 -8.269 601 HD13 LEU 78 HD13 LEU 78 1.759 1.524 -8.585 602 HD21 LEU 78 HD21 LEU 78 1.252 1.156 -11.067 603 HD22 LEU 78 HD22 LEU 78 0.278 -0.269 -10.638 604 HD23 LEU 78 HD23 LEU 78 1.618 -0.429 -11.790 605 H ARG 79 H ARG 79 6.065 -1.613 -10.447 606 HA ARG 79 HA ARG 79 4.912 -3.980 -9.317 607 HB2 ARG 79 HB2 ARG 79 5.928 -3.569 -11.597 608 HB3 ARG 79 HB3 ARG 79 7.514 -3.771 -10.850 609 HG2 ARG 79 HG2 ARG 79 7.071 -6.066 -10.365 610 HG3 ARG 79 HG3 ARG 79 5.331 -5.863 -10.699 611 HD2 ARG 79 HD2 ARG 79 5.907 -5.218 -13.039 612 HD3 ARG 79 HD3 ARG 79 7.600 -5.613 -12.706 613 HE ARG 79 HE ARG 79 6.702 -7.958 -12.169 614 HH11 ARG 79 HH11 ARG 79 5.142 -5.871 -14.566 615 HH12 ARG 79 HH12 ARG 79 4.497 -7.222 -15.455 616 HH21 ARG 79 HH21 ARG 79 5.866 -9.626 -13.381 617 HH22 ARG 79 HH22 ARG 79 4.903 -9.303 -14.796 618 H LEU 80 H LEU 80 7.819 -2.092 -8.539 619 HA LEU 80 HA LEU 80 9.013 -4.092 -6.854 620 HB2 LEU 80 HB2 LEU 80 9.150 -1.067 -6.913 621 HB3 LEU 80 HB3 LEU 80 10.022 -2.012 -5.712 622 HG LEU 80 HG LEU 80 10.417 -2.367 -8.697 623 HD11 LEU 80 HD11 LEU 80 12.454 -1.011 -8.414 624 HD12 LEU 80 HD12 LEU 80 12.016 -0.695 -6.719 625 HD13 LEU 80 HD13 LEU 80 10.995 -0.071 -8.038 626 HD21 LEU 80 HD21 LEU 80 12.543 -3.429 -7.996 627 HD22 LEU 80 HD22 LEU 80 11.135 -4.297 -7.362 628 HD23 LEU 80 HD23 LEU 80 12.073 -3.230 -6.291 629 H ARG 81 H ARG 81 6.694 -1.416 -6.171 630 HA ARG 81 HA ARG 81 6.550 -1.989 -3.342 631 HB2 ARG 81 HB2 ARG 81 4.311 -0.835 -5.057 632 HB3 ARG 81 HB3 ARG 81 4.517 -0.671 -3.315 633 HG2 ARG 81 HG2 ARG 81 6.123 0.636 -5.514 634 HG3 ARG 81 HG3 ARG 81 5.084 1.405 -4.311 635 HD2 ARG 81 HD2 ARG 81 6.730 0.390 -2.566 636 HD3 ARG 81 HD3 ARG 81 7.827 0.182 -3.946 637 HE ARG 81 HE ARG 81 7.126 2.656 -2.580 638 HH11 ARG 81 HH11 ARG 81 8.129 1.437 -5.763 639 HH12 ARG 81 HH12 ARG 81 8.785 2.987 -6.237 640 HH21 ARG 81 HH21 ARG 81 7.979 4.526 -3.233 641 HH22 ARG 81 HH22 ARG 81 8.702 4.703 -4.823 642 H ALA 82 H ALA 82 4.680 -3.008 -6.172 643 HA ALA 82 HA ALA 82 2.722 -4.512 -4.797 644 HB1 ALA 82 HB1 ALA 82 3.867 -5.154 -7.548 645 HB2 ALA 82 HB2 ALA 82 2.223 -5.461 -6.949 646 HB3 ALA 82 HB3 ALA 82 2.757 -3.799 -7.251 647 H SER 83 H SER 83 5.994 -5.453 -5.965 648 HA SER 83 HA SER 83 5.653 -8.232 -5.439 649 HB2 SER 83 HB2 SER 83 8.189 -6.560 -5.367 650 HB3 SER 83 HB3 SER 83 8.118 -8.335 -5.427 651 HG SER 83 HG SER 83 7.223 -6.465 -7.381 652 H TYR 84 H TYR 84 6.985 -5.594 -3.361 653 HA TYR 84 HA TYR 84 7.597 -7.325 -1.173 654 HB2 TYR 84 HB2 TYR 84 8.323 -4.905 -1.464 655 HB3 TYR 84 HB3 TYR 84 6.693 -4.431 -0.964 656 HD1 TYR 84 HD1 TYR 84 5.861 -5.281 1.368 657 HD2 TYR 84 HD2 TYR 84 9.997 -5.376 0.173 658 HE1 TYR 84 HE1 TYR 84 6.537 -5.498 3.745 659 HE2 TYR 84 HE2 TYR 84 10.668 -5.582 2.575 660 HH TYR 84 HH TYR 84 8.239 -5.760 5.200 661 H LEU 85 H LEU 85 4.651 -5.434 -1.979 662 HA LEU 85 HA LEU 85 3.185 -6.145 0.339 663 HB2 LEU 85 HB2 LEU 85 2.484 -4.375 -1.232 664 HB3 LEU 85 HB3 LEU 85 2.215 -5.587 -2.481 665 HG LEU 85 HG LEU 85 0.383 -6.581 -1.139 666 HD11 LEU 85 HD11 LEU 85 -0.542 -5.285 0.770 667 HD12 LEU 85 HD12 LEU 85 0.881 -4.226 0.718 668 HD13 LEU 85 HD13 LEU 85 1.064 -5.946 1.120 669 HD21 LEU 85 HD21 LEU 85 -0.056 -4.864 -2.858 670 HD22 LEU 85 HD22 LEU 85 0.071 -3.604 -1.610 671 HD23 LEU 85 HD23 LEU 85 -1.234 -4.807 -1.530 672 H ARG 86 H ARG 86 3.653 -7.850 -2.725 673 HA ARG 86 HA ARG 86 1.614 -9.801 -2.221 674 HB2 ARG 86 HB2 ARG 86 2.835 -9.257 -4.428 675 HB3 ARG 86 HB3 ARG 86 4.120 -10.314 -3.854 676 HG2 ARG 86 HG2 ARG 86 2.675 -11.563 -5.336 677 HG3 ARG 86 HG3 ARG 86 2.423 -12.176 -3.690 678 HD2 ARG 86 HD2 ARG 86 0.365 -10.895 -3.468 679 HD3 ARG 86 HD3 ARG 86 0.647 -10.079 -5.006 680 HE ARG 86 HE ARG 86 -0.303 -12.838 -4.599 681 HH11 ARG 86 HH21 ARG 86 0.641 -10.354 -6.923 682 HH12 ARG 86 HH22 ARG 86 -0.124 -11.182 -8.255 683 HH21 ARG 86 HH11 ARG 86 -1.256 -13.828 -6.353 684 HH22 ARG 86 HH12 ARG 86 -1.170 -13.104 -7.935 685 H TYR 87 H TYR 87 5.105 -9.724 -1.441 686 HA TYR 87 HA TYR 87 5.144 -12.418 -0.405 687 HB2 TYR 87 HB2 TYR 87 6.923 -10.020 0.163 688 HB3 TYR 87 HB3 TYR 87 7.235 -11.658 0.748 689 HD1 TYR 87 HD2 TYR 87 6.922 -13.490 -1.372 690 HD2 TYR 87 HD1 TYR 87 8.298 -9.420 -1.634 691 HE1 TYR 87 HE2 TYR 87 8.115 -14.022 -3.501 692 HE2 TYR 87 HE1 TYR 87 9.484 -9.965 -3.762 693 HH TYR 87 HH TYR 87 9.467 -13.238 -5.173 694 H ASP 88 H ASP 88 4.521 -9.207 1.051 695 HA ASP 88 HA ASP 88 4.450 -10.209 3.737 696 HB2 ASP 88 HB2 ASP 88 4.481 -7.747 2.629 697 HB3 ASP 88 HB3 ASP 88 2.758 -7.857 3.012 698 H LEU 89 H LEU 89 1.821 -9.544 1.349 699 HA LEU 89 HA LEU 89 -0.310 -10.446 3.026 700 HB2 LEU 89 HB2 LEU 89 0.048 -9.665 0.268 701 HB3 LEU 89 HB3 LEU 89 -0.912 -11.129 0.324 702 HG LEU 89 HG LEU 89 -2.282 -9.096 0.234 703 HD11 LEU 89 HD11 LEU 89 -2.576 -10.553 2.894 704 HD12 LEU 89 HD12 LEU 89 -3.181 -11.128 1.322 705 HD13 LEU 89 HD13 LEU 89 -3.838 -9.643 2.036 706 HD21 LEU 89 HD21 LEU 89 -0.718 -7.636 1.528 707 HD22 LEU 89 HD22 LEU 89 -1.241 -8.454 3.016 708 HD23 LEU 89 HD23 LEU 89 -2.409 -7.527 2.051 709 H LYS 90 H LYS 90 1.875 -12.266 0.857 710 HA LYS 90 HA LYS 90 0.523 -14.705 0.821 711 HB2 LYS 90 HB2 LYS 90 2.501 -14.100 -0.522 712 HB3 LYS 90 HB3 LYS 90 3.481 -14.008 0.932 713 HG2 LYS 90 HG2 LYS 90 4.039 -15.981 -0.143 714 HG3 LYS 90 HG3 LYS 90 3.097 -16.421 1.288 715 HD2 LYS 90 HD2 LYS 90 1.089 -16.677 -0.143 716 HD3 LYS 90 HD3 LYS 90 2.094 -16.280 -1.569 717 HE2 LYS 90 HE2 LYS 90 3.630 -18.061 -0.912 718 HE3 LYS 90 HE3 LYS 90 2.550 -18.474 0.425 719 HZ1 LYS 90 HZ1 LYS 90 2.208 -19.930 -1.474 720 HZ2 LYS 90 HZ2 LYS 90 1.859 -18.649 -2.454 721 HZ3 LYS 90 HZ3 LYS 90 0.848 -19.034 -1.207 722 H THR 91 H THR 91 2.481 -13.155 3.351 723 HA THR 91 HA THR 91 2.609 -15.555 5.011 724 HB THR 91 HB THR 91 3.115 -12.645 5.798 725 HG1 THR 91 HG1 THR 91 4.574 -12.956 4.241 726 HG21 THR 91 HG21 THR 91 2.967 -14.179 7.710 727 HG22 THR 91 HG22 THR 91 4.648 -13.673 7.447 728 HG23 THR 91 HG23 THR 91 4.119 -15.288 6.927 729 H VAL 92 H VAL 92 0.760 -12.459 5.025 730 HA VAL 92 HA VAL 92 -0.622 -12.873 7.439 731 HB VAL 92 HB VAL 92 -1.647 -11.444 4.939 732 HG11 VAL 92 HG11 VAL 92 -2.507 -11.279 7.868 733 HG12 VAL 92 HG12 VAL 92 -2.995 -10.120 6.616 734 HG13 VAL 92 HG13 VAL 92 -3.498 -11.809 6.487 735 HG21 VAL 92 HG21 VAL 92 -0.128 -10.386 7.354 736 HG22 VAL 92 HG22 VAL 92 0.533 -10.569 5.722 737 HG23 VAL 92 HG23 VAL 92 -0.764 -9.409 6.012 738 H ILE 93 H ILE 93 -1.569 -13.992 4.153 739 HA ILE 93 HA ILE 93 -4.183 -14.837 4.905 740 HB ILE 93 HB ILE 93 -4.106 -16.329 2.945 741 HG12 ILE 93 HG12 ILE 93 -1.250 -15.416 2.574 742 HG13 ILE 93 HG13 ILE 93 -1.710 -17.008 3.170 743 HG21 ILE 93 HG21 ILE 93 -2.863 -13.652 2.210 744 HG22 ILE 93 HG22 ILE 93 -4.069 -14.587 1.299 745 HG23 ILE 93 HG23 ILE 93 -4.513 -13.806 2.821 746 HD11 ILE 93 HD11 ILE 93 -2.927 -17.410 1.001 747 HD12 ILE 93 HD12 ILE 93 -2.257 -15.870 0.403 748 HD13 ILE 93 HD13 ILE 93 -1.168 -17.206 0.834 749 H SER 94 H SER 94 -1.160 -16.261 5.733 750 HA SER 94 HA SER 94 -2.214 -18.967 5.940 751 HB2 SER 94 HB2 SER 94 0.322 -17.717 7.010 752 HB3 SER 94 HB3 SER 94 -0.025 -19.455 6.886 753 HG SER 94 HG SER 94 0.591 -17.587 4.895 754 H ALA 95 H ALA 95 -2.519 -16.161 7.878 755 HA ALA 95 HA ALA 95 -2.452 -17.352 10.493 756 HB1 ALA 95 HB1 ALA 95 -2.437 -14.886 10.066 757 HB2 ALA 95 HB2 ALA 95 -4.110 -14.985 9.484 758 HB3 ALA 95 HB3 ALA 95 -3.735 -15.361 11.183 759 H LYS 96 H LYS 96 -5.006 -16.987 8.053 760 HA LYS 96 HA LYS 96 -6.650 -18.996 9.525 761 HB2 LYS 96 HB2 LYS 96 -7.283 -16.228 9.085 762 HB3 LYS 96 HB3 LYS 96 -8.338 -17.184 8.064 763 HG2 LYS 96 HG2 LYS 96 -9.543 -16.933 10.029 764 HG3 LYS 96 HG3 LYS 96 -8.883 -18.577 10.127 765 HD2 LYS 96 HD2 LYS 96 -7.034 -17.706 11.558 766 HD3 LYS 96 HD3 LYS 96 -7.763 -16.088 11.483 767 HE2 LYS 96 HE2 LYS 96 -9.826 -17.008 12.486 768 HE3 LYS 96 HE3 LYS 96 -9.053 -18.603 12.582 769 HZ1 LYS 96 HZ1 LYS 96 -8.893 -17.429 14.684 770 HZ2 LYS 96 HZ2 LYS 96 -8.123 -16.156 13.973 771 HZ3 LYS 96 HZ3 LYS 96 -7.382 -17.627 14.050 772 HA PRO 97 HA PRO 97 -5.519 -20.008 5.182 773 HB2 PRO 97 HB2 PRO 97 -4.971 -22.659 5.472 774 HB3 PRO 97 HB3 PRO 97 -3.853 -21.375 6.029 775 HG2 PRO 97 HG2 PRO 97 -5.928 -22.867 7.611 776 HG3 PRO 97 HG3 PRO 97 -4.176 -22.673 7.949 777 HD2 PRO 97 HD2 PRO 97 -5.994 -21.067 9.107 778 HD3 PRO 97 HD3 PRO 97 -4.421 -20.413 8.535 779 H LYS 98 H LYS 98 -8.383 -20.161 6.399 780 HA LYS 98 HA LYS 98 -9.421 -22.236 4.534 781 HB2 LYS 98 HB2 LYS 98 -10.716 -21.065 7.012 782 HB3 LYS 98 HB3 LYS 98 -11.503 -22.208 5.911 783 HG2 LYS 98 HG2 LYS 98 -8.978 -22.821 7.506 784 HG3 LYS 98 HG3 LYS 98 -10.623 -23.274 7.979 785 HD2 LYS 98 HD2 LYS 98 -10.841 -24.571 5.836 786 HD3 LYS 98 HD3 LYS 98 -9.131 -24.225 5.495 787 HE2 LYS 98 HE2 LYS 98 -8.480 -25.358 7.599 788 HE3 LYS 98 HE3 LYS 98 -10.189 -25.690 7.952 789 HZ1 LYS 98 HZ1 LYS 98 -10.279 -27.046 5.942 790 HZ2 LYS 98 HZ2 LYS 98 -9.105 -27.606 6.956 791 HZ3 LYS 98 HZ3 LYS 98 -8.691 -26.742 5.613 792 H ASP 99 H ASP 99 -12.093 -20.518 5.269 793 HA ASP 99 HA ASP 99 -12.166 -19.492 2.612 794 HB2 ASP 99 HB2 ASP 99 -14.120 -20.214 4.070 795 HB3 ASP 99 HB3 ASP 99 -13.987 -18.635 4.864 796 H GLU 100 H GLU 100 -11.318 -17.978 5.705 797 HA GLU 100 HA GLU 100 -11.389 -15.284 4.776 798 HB2 GLU 100 HB2 GLU 100 -10.184 -16.779 7.018 799 HB3 GLU 100 HB3 GLU 100 -9.269 -15.344 6.532 800 HG2 GLU 100 HG2 GLU 100 -12.190 -15.434 7.326 801 HG3 GLU 100 HG3 GLU 100 -10.850 -14.798 8.300 802 H LYS 101 H LYS 101 -8.893 -17.852 4.512 803 HA LYS 101 HA LYS 101 -6.916 -16.115 3.313 804 HB2 LYS 101 HB2 LYS 101 -6.130 -18.114 4.230 805 HB3 LYS 101 HB3 LYS 101 -7.356 -19.074 3.455 806 HG2 LYS 101 HG2 LYS 101 -5.870 -18.005 1.313 807 HG3 LYS 101 HG3 LYS 101 -4.674 -18.386 2.555 808 HD2 LYS 101 HD2 LYS 101 -4.952 -20.335 1.175 809 HD3 LYS 101 HD3 LYS 101 -5.687 -20.661 2.754 810 HE2 LYS 101 HE2 LYS 101 -7.884 -19.768 1.590 811 HE3 LYS 101 HE3 LYS 101 -7.022 -20.159 0.093 812 HZ1 LYS 101 HZ1 LYS 101 -8.376 -22.004 0.933 813 HZ2 LYS 101 HZ2 LYS 101 -7.489 -22.052 2.328 814 HZ3 LYS 101 HZ3 LYS 101 -6.780 -22.417 0.880 815 H LYS 102 H LYS 102 -9.613 -18.060 2.055 816 HA LYS 102 HA LYS 102 -8.997 -17.655 -0.730 817 HB2 LYS 102 HB2 LYS 102 -10.472 -19.422 0.054 818 HB3 LYS 102 HB3 LYS 102 -11.589 -18.254 0.724 819 HG2 LYS 102 HG2 LYS 102 -11.027 -18.244 -2.240 820 HG3 LYS 102 HG3 LYS 102 -12.141 -19.427 -1.519 821 HD2 LYS 102 HD2 LYS 102 -13.142 -17.293 -0.329 822 HD3 LYS 102 HD3 LYS 102 -12.396 -16.446 -1.686 823 HE2 LYS 102 HE2 LYS 102 -14.347 -18.775 -1.938 824 HE3 LYS 102 HE3 LYS 102 -14.812 -17.069 -2.022 825 HZ1 LYS 102 HZ1 LYS 102 -14.519 -18.042 -4.213 826 HZ2 LYS 102 HZ2 LYS 102 -12.935 -18.369 -3.896 827 HZ3 LYS 102 HZ3 LYS 102 -13.456 -16.804 -3.971 828 H SER 103 H SER 103 -11.132 -15.850 1.532 829 HA SER 103 HA SER 103 -11.954 -13.897 -0.368 830 HB2 SER 103 HB2 SER 103 -13.022 -14.202 1.836 831 HB3 SER 103 HB3 SER 103 -11.541 -13.648 2.642 832 HG SER 103 HG SER 103 -13.218 -12.145 0.905 833 H LEU 104 H LEU 104 -9.198 -13.878 1.949 834 HA LEU 104 HA LEU 104 -8.231 -11.298 1.209 835 HB2 LEU 104 HB2 LEU 104 -7.005 -13.766 2.424 836 HB3 LEU 104 HB3 LEU 104 -5.976 -12.416 1.958 837 HG LEU 104 HG LEU 104 -8.310 -12.045 3.834 838 HD11 LEU 104 HD11 LEU 104 -5.427 -12.650 4.592 839 HD12 LEU 104 HD12 LEU 104 -6.805 -13.767 4.775 840 HD13 LEU 104 HD13 LEU 104 -6.758 -12.257 5.702 841 HD21 LEU 104 HD21 LEU 104 -6.930 -10.083 4.552 842 HD22 LEU 104 HD22 LEU 104 -7.400 -9.993 2.843 843 HD23 LEU 104 HD23 LEU 104 -5.748 -10.478 3.290 844 H GLN 105 H GLN 105 -7.531 -14.560 -0.144 845 HA GLN 105 HA GLN 105 -5.406 -13.644 -1.842 846 HB2 GLN 105 HB2 GLN 105 -7.232 -16.048 -1.853 847 HB3 GLN 105 HB3 GLN 105 -6.128 -15.750 -3.199 848 HG2 GLN 105 HG2 GLN 105 -4.215 -15.761 -1.669 849 HG3 GLN 105 HG3 GLN 105 -5.291 -16.052 -0.300 850 HE21 GLN 105 HE21 GLN 105 -3.262 -17.495 -2.459 851 HE22 GLN 105 HE22 GLN 105 -3.884 -19.126 -2.388 852 H GLU 106 H GLU 106 -8.952 -13.822 -2.320 853 HA GLU 106 HA GLU 106 -8.736 -13.154 -5.129 854 HB2 GLU 106 HB2 GLU 106 -11.022 -13.097 -3.154 855 HB3 GLU 106 HB3 GLU 106 -11.198 -12.632 -4.858 856 HG2 GLU 106 HG2 GLU 106 -10.327 -14.841 -5.542 857 HG3 GLU 106 HG3 GLU 106 -10.226 -15.320 -3.845 858 H LEU 107 H LEU 107 -9.149 -11.196 -2.138 859 HA LEU 107 HA LEU 107 -9.453 -8.730 -3.643 860 HB2 LEU 107 HB2 LEU 107 -8.448 -9.278 -0.831 861 HB3 LEU 107 HB3 LEU 107 -8.579 -7.670 -1.530 862 HG LEU 107 HG LEU 107 -10.868 -9.529 -0.899 863 HD11 LEU 107 HD11 LEU 107 -10.019 -6.836 0.212 864 HD12 LEU 107 HD12 LEU 107 -9.736 -8.405 0.986 865 HD13 LEU 107 HD13 LEU 107 -11.396 -7.818 0.756 866 HD21 LEU 107 HD21 LEU 107 -11.489 -8.288 -2.904 867 HD22 LEU 107 HD22 LEU 107 -10.881 -6.766 -2.201 868 HD23 LEU 107 HD23 LEU 107 -12.315 -7.562 -1.514 869 H THR 108 H THR 108 -6.688 -10.588 -2.397 870 HA THR 108 HA THR 108 -4.661 -8.686 -3.064 871 HB THR 108 HB THR 108 -4.433 -11.752 -3.016 872 HG1 THR 108 HG1 THR 108 -5.226 -10.918 -1.046 873 HG21 THR 108 HG21 THR 108 -2.428 -10.704 -3.991 874 HG22 THR 108 HG22 THR 108 -2.076 -11.326 -2.352 875 HG23 THR 108 HG23 THR 108 -2.335 -9.582 -2.613 876 H SER 109 H SER 109 -6.165 -11.365 -5.007 877 HA SER 109 HA SER 109 -4.415 -10.839 -7.250 878 HB2 SER 109 HB2 SER 109 -5.954 -12.269 -8.526 879 HB3 SER 109 HB3 SER 109 -5.512 -13.008 -6.971 880 HG SER 109 HG SER 109 -7.799 -13.063 -7.540 881 H LYS 110 H LYS 110 -7.667 -9.657 -6.318 882 HA LYS 110 HA LYS 110 -8.206 -8.327 -8.797 883 HB2 LYS 110 HB2 LYS 110 -9.796 -8.895 -6.910 884 HB3 LYS 110 HB3 LYS 110 -9.167 -7.476 -6.067 885 HG2 LYS 110 HG2 LYS 110 -9.937 -6.043 -7.950 886 HG3 LYS 110 HG3 LYS 110 -10.510 -7.485 -8.805 887 HD2 LYS 110 HD2 LYS 110 -12.433 -6.495 -7.776 888 HD3 LYS 110 HD3 LYS 110 -12.044 -7.944 -6.828 889 HE2 LYS 110 HE2 LYS 110 -10.867 -6.536 -5.174 890 HE3 LYS 110 HE3 LYS 110 -11.227 -5.101 -6.133 891 HZ1 LYS 110 HZ1 LYS 110 -12.752 -5.300 -4.300 892 HZ2 LYS 110 HZ2 LYS 110 -13.234 -6.805 -4.778 893 HZ3 LYS 110 HZ3 LYS 110 -13.587 -5.492 -5.710 894 H LEU 111 H LEU 111 -6.540 -7.261 -5.836 895 HA LEU 111 HA LEU 111 -6.188 -4.535 -6.595 896 HB2 LEU 111 HB2 LEU 111 -5.846 -5.658 -4.347 897 HB3 LEU 111 HB3 LEU 111 -4.311 -6.252 -4.926 898 HG LEU 111 HG LEU 111 -4.952 -3.295 -4.747 899 HD11 LEU 111 HD11 LEU 111 -3.773 -5.155 -2.645 900 HD12 LEU 111 HD12 LEU 111 -5.320 -4.278 -2.556 901 HD13 LEU 111 HD13 LEU 111 -3.793 -3.381 -2.541 902 HD21 LEU 111 HD21 LEU 111 -2.494 -3.073 -4.508 903 HD22 LEU 111 HD22 LEU 111 -2.962 -3.772 -6.065 904 HD23 LEU 111 HD23 LEU 111 -2.322 -4.822 -4.781 905 H PHE 112 H PHE 112 -4.142 -7.429 -7.082 906 HA PHE 112 HA PHE 112 -2.098 -5.903 -8.443 907 HB2 PHE 112 HB2 PHE 112 -2.624 -8.830 -8.008 908 HB3 PHE 112 HB3 PHE 112 -1.335 -8.282 -9.089 909 HD1 PHE 112 HD1 PHE 112 -2.569 -7.386 -5.615 910 HD2 PHE 112 HD2 PHE 112 0.788 -8.156 -8.183 911 HE1 PHE 112 HE1 PHE 112 -1.065 -7.066 -3.696 912 HE2 PHE 112 HE2 PHE 112 2.314 -7.835 -6.249 913 HZ PHE 112 HZ PHE 112 1.373 -7.285 -3.995 914 H SER 113 H SER 113 -5.051 -7.472 -9.498 915 HA SER 113 HA SER 113 -4.360 -7.569 -12.308 916 HB2 SER 113 HB2 SER 113 -6.288 -8.798 -11.298 917 HB3 SER 113 HB3 SER 113 -7.087 -7.245 -10.981 918 HG SER 113 HG SER 113 -7.810 -8.149 -12.933 919 H SER 114 H SER 114 -5.807 -5.153 -10.108 920 HA SER 114 HA SER 114 -6.328 -3.200 -12.144 921 HB2 SER 114 HB2 SER 114 -5.729 -2.747 -9.193 922 HB3 SER 114 HB3 SER 114 -6.555 -1.625 -10.293 923 HG SER 114 HG SER 114 -7.454 -4.148 -9.329 924 H ILE 115 H ILE 115 -3.499 -3.979 -10.148 925 HA ILE 115 HA ILE 115 -1.893 -1.730 -10.925 926 HB ILE 115 HB ILE 115 -1.363 -4.449 -9.729 927 HG12 ILE 115 HG12 ILE 115 -0.714 -1.620 -8.855 928 HG13 ILE 115 HG13 ILE 115 -2.165 -2.511 -8.406 929 HG21 ILE 115 HG21 ILE 115 0.537 -4.341 -11.227 930 HG22 ILE 115 HG22 ILE 115 0.825 -2.636 -10.843 931 HG23 ILE 115 HG23 ILE 115 1.131 -3.888 -9.626 932 HD11 ILE 115 HD11 ILE 115 0.688 -3.078 -7.577 933 HD12 ILE 115 HD12 ILE 115 -0.696 -2.654 -6.559 934 HD13 ILE 115 HD13 ILE 115 -0.633 -4.249 -7.337 935 H ASP 116 H ASP 116 -2.273 -5.022 -12.336 936 HA ASP 116 HA ASP 116 -0.246 -4.616 -14.334 937 HB2 ASP 116 HB2 ASP 116 -1.218 -6.836 -13.678 938 HB3 ASP 116 HB3 ASP 116 -2.716 -6.378 -14.505 939 H ASN 117 H ASN 117 -3.763 -3.964 -14.234 940 HA ASN 117 HA ASN 117 -3.909 -3.159 -16.988 941 HB2 ASN 117 HB2 ASN 117 -5.761 -3.672 -15.123 942 HB3 ASN 117 HB3 ASN 117 -5.722 -1.910 -14.961 943 HD21 ASN 117 HD21 ASN 117 -7.957 -3.343 -15.826 944 HD22 ASN 117 HD22 ASN 117 -8.250 -2.958 -17.503 945 H LEU 118 H LEU 118 -3.068 -1.467 -13.983 946 HA LEU 118 HA LEU 118 -3.059 1.186 -15.039 947 HB2 LEU 118 HB2 LEU 118 -2.699 0.088 -12.608 948 HB3 LEU 118 HB3 LEU 118 -1.018 0.380 -13.010 949 HG LEU 118 HG LEU 118 -3.182 2.508 -12.968 950 HD11 LEU 118 HD11 LEU 118 -1.099 1.765 -10.877 951 HD12 LEU 118 HD12 LEU 118 -2.856 1.510 -10.749 952 HD13 LEU 118 HD13 LEU 118 -2.197 3.158 -10.799 953 HD21 LEU 118 HD21 LEU 118 -1.291 3.162 -14.364 954 HD22 LEU 118 HD22 LEU 118 -0.155 2.729 -13.066 955 HD23 LEU 118 HD23 LEU 118 -1.289 4.084 -12.851 956 H ASP 119 H ASP 119 -0.518 -1.365 -14.930 957 HA ASP 119 HA ASP 119 1.488 0.213 -16.247 958 HB2 ASP 119 HB2 ASP 119 2.198 -1.767 -15.101 959 HB3 ASP 119 HB3 ASP 119 1.076 -2.776 -16.048 960 H HIS 120 H HIS 120 -1.104 -1.873 -17.549 961 HA HIS 120 HA HIS 120 -0.191 -1.605 -20.280 962 HB2 HIS 120 HB2 HIS 120 -2.902 -2.226 -19.069 963 HB3 HIS 120 HB3 HIS 120 -2.660 -2.075 -20.812 964 HD1 HIS 120 HD1 HIS 120 -1.442 -4.229 -17.859 965 HD2 HIS 120 HD2 HIS 120 -1.661 -4.317 -22.051 966 HE1 HIS 120 HE1 HIS 120 -0.755 -6.561 -18.581 967 H ALA 121 H ALA 121 -2.399 0.343 -18.231 968 HA ALA 121 HA ALA 121 -3.101 2.188 -20.313 969 HB1 ALA 121 HB1 ALA 121 -4.410 1.982 -18.276 970 HB2 ALA 121 HB2 ALA 121 -3.026 2.517 -17.294 971 HB3 ALA 121 HB3 ALA 121 -3.797 3.643 -18.433 972 H ALA 122 H ALA 122 -0.434 2.065 -17.968 973 HA ALA 122 HA ALA 122 0.606 4.665 -18.420 974 HB1 ALA 122 HB1 ALA 122 2.109 2.115 -17.737 975 HB2 ALA 122 HB2 ALA 122 2.692 3.778 -17.509 976 HB3 ALA 122 HB3 ALA 122 1.302 3.185 -16.570 977 H LYS 123 H LYS 123 1.464 1.496 -19.875 978 HA LYS 123 HA LYS 123 3.387 2.624 -21.667 979 HB2 LYS 123 HB2 LYS 123 1.849 0.012 -21.598 980 HB3 LYS 123 HB3 LYS 123 3.038 0.364 -22.864 981 HG2 LYS 123 HG2 LYS 123 4.815 0.520 -21.297 982 HG3 LYS 123 HG3 LYS 123 3.701 0.528 -19.917 983 HD2 LYS 123 HD2 LYS 123 3.040 -1.750 -20.356 984 HD3 LYS 123 HD3 LYS 123 4.035 -1.800 -21.833 985 HE2 LYS 123 HE2 LYS 123 6.052 -1.654 -20.607 986 HE3 LYS 123 HE3 LYS 123 5.213 -1.096 -19.149 987 HZ1 LYS 123 HZ1 LYS 123 4.904 -3.802 -20.270 988 HZ2 LYS 123 HZ2 LYS 123 4.280 -3.237 -18.843 989 HZ3 LYS 123 HZ3 LYS 123 5.918 -3.408 -19.026 990 H ILE 124 H ILE 124 -0.115 2.091 -22.029 991 HA ILE 124 HA ILE 124 0.025 2.643 -24.894 992 HB ILE 124 HB ILE 124 -1.717 1.157 -23.567 993 HG12 ILE 124 HG12 ILE 124 -3.447 1.685 -25.381 994 HG13 ILE 124 HG13 ILE 124 -2.322 2.918 -25.954 995 HG21 ILE 124 HG21 ILE 124 -2.524 3.094 -22.161 996 HG22 ILE 124 HG22 ILE 124 -3.243 3.787 -23.627 997 HG23 ILE 124 HG23 ILE 124 -3.801 2.214 -23.014 998 HD11 ILE 124 HD11 ILE 124 -2.112 0.782 -27.210 999 HD12 ILE 124 HD12 ILE 124 -0.602 1.191 -26.366 1000 HD13 ILE 124 HD13 ILE 124 -1.683 -0.058 -25.701 1001 H LYS 125 H LYS 125 0.536 4.556 -22.332 1002 HA LYS 125 HA LYS 125 0.857 6.796 -22.152 1003 HB2 LYS 125 HB2 LYS 125 1.320 6.311 -24.715 1004 HB3 LYS 125 HB3 LYS 125 -0.127 7.291 -24.943 1005 HG2 LYS 125 HG2 LYS 125 1.114 9.047 -23.468 1006 HG3 LYS 125 HG3 LYS 125 2.563 8.097 -23.854 1007 HD2 LYS 125 HD2 LYS 125 0.619 9.322 -25.863 1008 HD3 LYS 125 HD3 LYS 125 2.225 9.959 -25.465 1009 HE2 LYS 125 HE2 LYS 125 3.269 7.879 -26.342 1010 HE3 LYS 125 HE3 LYS 125 1.663 7.230 -26.723 1011 HZ1 LYS 125 HZ1 LYS 125 1.338 9.058 -28.264 1012 HZ2 LYS 125 HZ2 LYS 125 2.688 8.201 -28.667 1013 HZ3 LYS 125 HZ3 LYS 125 2.833 9.667 -27.927 1014 H SER 126 H SER 126 -1.845 5.608 -21.646 1015 HA SER 126 HA SER 126 -3.562 8.003 -22.109 1016 HB2 SER 126 HB2 SER 126 -4.211 5.193 -21.175 1017 HB3 SER 126 HB3 SER 126 -5.391 6.514 -21.316 1018 HG SER 126 HG SER 126 -5.311 5.181 -23.192 1019 HA PRO 127 HA PRO 127 -2.315 8.545 -17.785 1020 HB2 PRO 127 HB2 PRO 127 -2.993 11.182 -17.460 1021 HB3 PRO 127 HB3 PRO 127 -1.468 10.659 -18.237 1022 HG2 PRO 127 HG2 PRO 127 -4.063 11.463 -19.535 1023 HG3 PRO 127 HG3 PRO 127 -2.399 12.027 -19.892 1024 HD2 PRO 127 HD2 PRO 127 -3.574 10.101 -21.369 1025 HD3 PRO 127 HD3 PRO 127 -1.825 10.019 -20.962 1026 H THR 128 H THR 128 -5.390 9.587 -19.283 1027 HA THR 128 HA THR 128 -6.875 9.840 -16.879 1028 HB THR 128 HB THR 128 -7.948 8.865 -19.560 1029 HG1 THR 128 HG1 THR 128 -7.521 11.559 -18.759 1030 HG21 THR 128 HG21 THR 128 -9.609 8.942 -17.761 1031 HG22 THR 128 HG22 THR 128 -9.896 10.270 -18.906 1032 HG23 THR 128 HG23 THR 128 -9.114 10.602 -17.341 1033 H GLU 129 H GLU 129 -6.131 7.016 -18.938 1034 HA GLU 129 HA GLU 129 -7.849 5.260 -17.381 1035 HB2 GLU 129 HB2 GLU 129 -5.680 4.697 -19.425 1036 HB3 GLU 129 HB3 GLU 129 -6.683 3.455 -18.660 1037 HG2 GLU 129 HG2 GLU 129 -7.625 5.714 -20.447 1038 HG3 GLU 129 HG3 GLU 129 -7.597 3.985 -20.834 1039 H ALA 130 H ALA 130 -4.443 6.258 -17.316 1040 HA ALA 130 HA ALA 130 -3.591 4.247 -15.449 1041 HB1 ALA 130 HB1 ALA 130 -2.578 7.112 -15.777 1042 HB2 ALA 130 HB2 ALA 130 -1.729 5.773 -14.980 1043 HB3 ALA 130 HB3 ALA 130 -2.023 5.715 -16.732 1044 H GLU 131 H GLU 131 -5.079 7.497 -15.102 1045 HA GLU 131 HA GLU 131 -5.118 7.463 -12.218 1046 HB2 GLU 131 HB2 GLU 131 -6.776 8.941 -14.284 1047 HB3 GLU 131 HB3 GLU 131 -6.951 9.185 -12.541 1048 HG2 GLU 131 HG2 GLU 131 -4.595 9.846 -12.385 1049 HG3 GLU 131 HG3 GLU 131 -4.415 9.631 -14.128 1050 H LYS 132 H LYS 132 -7.367 6.299 -14.719 1051 HA LYS 132 HA LYS 132 -9.572 5.745 -13.004 1052 HB2 LYS 132 HB2 LYS 132 -9.481 5.743 -15.543 1053 HB3 LYS 132 HB3 LYS 132 -8.713 4.165 -15.457 1054 HG2 LYS 132 HG2 LYS 132 -10.765 3.301 -15.598 1055 HG3 LYS 132 HG3 LYS 132 -10.957 3.777 -13.905 1056 HD2 LYS 132 HD2 LYS 132 -12.873 4.581 -15.149 1057 HD3 LYS 132 HD3 LYS 132 -11.901 5.972 -14.653 1058 HE2 LYS 132 HE2 LYS 132 -12.703 6.238 -16.968 1059 HE3 LYS 132 HE3 LYS 132 -10.939 6.144 -16.924 1060 HZ1 LYS 132 HZ1 LYS 132 -11.792 4.831 -18.709 1061 HZ2 LYS 132 HZ2 LYS 132 -12.748 3.933 -17.696 1062 HZ3 LYS 132 HZ3 LYS 132 -11.096 3.832 -17.614 1063 H TYR 133 H TYR 133 -6.883 3.608 -14.100 1064 HA TYR 133 HA TYR 133 -7.822 1.448 -12.406 1065 HB2 TYR 133 HB2 TYR 133 -5.177 1.834 -13.833 1066 HB3 TYR 133 HB3 TYR 133 -5.734 0.329 -13.078 1067 HD1 TYR 133 HD1 TYR 133 -8.517 0.052 -13.854 1068 HD2 TYR 133 HD2 TYR 133 -5.250 1.605 -16.175 1069 HE1 TYR 133 HE1 TYR 133 -9.755 -0.469 -15.946 1070 HE2 TYR 133 HE2 TYR 133 -6.499 1.068 -18.270 1071 HH TYR 133 HH TYR 133 -8.456 0.300 -19.168 1072 H TYR 134 H TYR 134 -5.553 4.130 -11.992 1073 HA TYR 134 HA TYR 134 -4.372 3.200 -9.546 1074 HB2 TYR 134 HB2 TYR 134 -3.446 5.140 -10.643 1075 HB3 TYR 134 HB3 TYR 134 -4.999 5.970 -10.605 1076 HD1 TYR 134 HD1 TYR 134 -2.196 4.785 -8.432 1077 HD2 TYR 134 HD2 TYR 134 -5.706 7.261 -8.734 1078 HE1 TYR 134 HE1 TYR 134 -1.620 5.879 -6.266 1079 HE2 TYR 134 HE2 TYR 134 -5.122 8.346 -6.569 1080 HH TYR 134 HH TYR 134 -2.158 7.576 -4.769 1081 H GLY 135 H GLY 135 -7.383 5.088 -10.225 1082 HA2 GLY 135 HA2 GLY 135 -8.125 5.371 -7.497 1083 HA3 GLY 135 HA3 GLY 135 -9.231 5.410 -8.883 1084 H GLN 136 H GLN 136 -8.789 2.734 -9.828 1085 HA GLN 136 HA GLN 136 -10.519 1.285 -8.029 1086 HB2 GLN 136 HB2 GLN 136 -8.799 0.366 -10.361 1087 HB3 GLN 136 HB3 GLN 136 -9.932 -0.679 -9.491 1088 HG2 GLN 136 HG2 GLN 136 -11.791 0.836 -10.107 1089 HG3 GLN 136 HG3 GLN 136 -10.664 1.838 -11.025 1090 HE21 GLN 136 HE21 GLN 136 -12.971 0.570 -12.081 1091 HE22 GLN 136 HE22 GLN 136 -12.430 -0.599 -13.262 1092 H THR 137 H THR 137 -6.989 1.314 -8.585 1093 HA THR 137 HA THR 137 -6.427 -0.884 -6.834 1094 HB THR 137 HB THR 137 -4.584 1.471 -7.475 1095 HG1 THR 137 HG1 THR 137 -5.338 0.516 -9.396 1096 HG21 THR 137 HG21 THR 137 -3.755 -0.017 -5.692 1097 HG22 THR 137 HG22 THR 137 -2.812 -0.221 -7.181 1098 HG23 THR 137 HG23 THR 137 -4.036 -1.430 -6.738 1099 H VAL 138 H VAL 138 -6.652 2.671 -6.273 1100 HA VAL 138 HA VAL 138 -5.843 2.682 -3.529 1101 HB VAL 138 HB VAL 138 -7.927 4.407 -4.986 1102 HG11 VAL 138 HG11 VAL 138 -7.545 6.066 -3.125 1103 HG12 VAL 138 HG12 VAL 138 -8.397 4.596 -2.617 1104 HG13 VAL 138 HG13 VAL 138 -6.670 4.795 -2.237 1105 HG21 VAL 138 HG21 VAL 138 -5.170 5.339 -4.187 1106 HG22 VAL 138 HG22 VAL 138 -5.393 4.435 -5.684 1107 HG23 VAL 138 HG23 VAL 138 -6.253 5.963 -5.439 1108 H SER 139 H SER 139 -9.078 2.202 -5.042 1109 HA SER 139 HA SER 139 -10.485 1.906 -2.571 1110 HB2 SER 139 HB2 SER 139 -11.554 2.309 -4.790 1111 HB3 SER 139 HB3 SER 139 -11.120 0.658 -5.275 1112 HG SER 139 HG SER 139 -12.374 -0.068 -3.451 1113 H ASN 140 H ASN 140 -8.856 -0.457 -4.711 1114 HA ASN 140 HA ASN 140 -9.716 -2.746 -3.227 1115 HB2 ASN 140 HB2 ASN 140 -8.589 -2.426 -5.610 1116 HB3 ASN 140 HB3 ASN 140 -7.108 -2.729 -4.696 1117 HD21 ASN 140 HD21 ASN 140 -8.116 -4.586 -2.810 1118 HD22 ASN 140 HD22 ASN 140 -8.522 -6.040 -3.697 1119 H ILE 141 H ILE 141 -6.917 -0.572 -2.905 1120 HA ILE 141 HA ILE 141 -5.468 -2.183 -1.014 1121 HB ILE 141 HB ILE 141 -5.548 0.824 -1.542 1122 HG12 ILE 141 HG12 ILE 141 -3.206 -1.064 -1.865 1123 HG13 ILE 141 HG13 ILE 141 -4.458 -0.976 -3.103 1124 HG21 ILE 141 HG21 ILE 141 -3.393 0.840 -0.061 1125 HG22 ILE 141 HG22 ILE 141 -4.962 0.788 0.771 1126 HG23 ILE 141 HG23 ILE 141 -3.999 -0.693 0.598 1127 HD11 ILE 141 HD11 ILE 141 -4.028 1.430 -3.396 1128 HD12 ILE 141 HD12 ILE 141 -2.749 1.348 -2.164 1129 HD13 ILE 141 HD13 ILE 141 -2.580 0.449 -3.681 1130 H ASN 142 H ASN 142 -8.021 0.320 -0.686 1131 HA ASN 142 HA ASN 142 -8.137 0.251 2.160 1132 HB2 ASN 142 HB2 ASN 142 -9.222 1.937 0.639 1133 HB3 ASN 142 HB3 ASN 142 -10.451 0.723 0.258 1134 HD21 ASN 142 HD21 ASN 142 -12.263 1.165 1.288 1135 HD22 ASN 142 HD22 ASN 142 -12.376 1.698 2.948 1136 H GLU 143 H GLU 143 -9.824 -1.784 -0.288 1137 HA GLU 143 HA GLU 143 -11.507 -3.134 1.583 1138 HB2 GLU 143 HB2 GLU 143 -10.276 -4.089 -1.029 1139 HB3 GLU 143 HB3 GLU 143 -11.467 -5.014 -0.125 1140 HG2 GLU 143 HG2 GLU 143 -13.148 -3.309 -0.482 1141 HG3 GLU 143 HG3 GLU 143 -11.966 -2.282 -1.312 1142 H VAL 144 H VAL 144 -8.218 -3.855 0.433 1143 HA VAL 144 HA VAL 144 -8.036 -6.335 1.922 1144 HB VAL 144 HB VAL 144 -5.859 -4.475 0.806 1145 HG11 VAL 144 HG11 VAL 144 -4.355 -6.466 1.012 1146 HG12 VAL 144 HG12 VAL 144 -4.886 -5.828 2.573 1147 HG13 VAL 144 HG13 VAL 144 -5.635 -7.301 1.927 1148 HG21 VAL 144 HG21 VAL 144 -7.371 -5.554 -0.884 1149 HG22 VAL 144 HG22 VAL 144 -5.687 -6.085 -1.011 1150 HG23 VAL 144 HG23 VAL 144 -6.891 -7.137 -0.242 1151 H LEU 145 H LEU 145 -7.406 -2.898 2.573 1152 HA LEU 145 HA LEU 145 -5.738 -3.252 4.843 1153 HB2 LEU 145 HB2 LEU 145 -6.782 -1.110 3.412 1154 HB3 LEU 145 HB3 LEU 145 -7.460 -0.894 5.013 1155 HG LEU 145 HG LEU 145 -4.496 -1.271 4.461 1156 HD11 LEU 145 HD11 LEU 145 -5.336 0.764 3.363 1157 HD12 LEU 145 HD12 LEU 145 -4.298 1.162 4.747 1158 HD13 LEU 145 HD13 LEU 145 -6.068 1.299 4.894 1159 HD21 LEU 145 HD21 LEU 145 -6.062 -0.381 6.917 1160 HD22 LEU 145 HD22 LEU 145 -4.302 -0.202 6.742 1161 HD23 LEU 145 HD23 LEU 145 -5.029 -1.822 6.749 1162 H ALA 146 H ALA 146 -9.292 -3.086 4.619 1163 HA ALA 146 HA ALA 146 -9.699 -2.932 7.459 1164 HB1 ALA 146 HB1 ALA 146 -12.011 -3.662 6.918 1165 HB2 ALA 146 HB2 ALA 146 -11.462 -2.392 5.798 1166 HB3 ALA 146 HB3 ALA 146 -11.493 -4.092 5.269 1167 H LYS 147 H LYS 147 -8.964 -5.607 5.306 1168 HA LYS 147 HA LYS 147 -9.598 -7.609 7.385 1169 HB2 LYS 147 HB2 LYS 147 -8.289 -7.873 4.669 1170 HB3 LYS 147 HB3 LYS 147 -8.781 -9.211 5.720 1171 HG2 LYS 147 HG2 LYS 147 -11.154 -8.381 5.579 1172 HG3 LYS 147 HG3 LYS 147 -10.611 -7.157 4.421 1173 HD2 LYS 147 HD2 LYS 147 -11.460 -8.883 3.078 1174 HD3 LYS 147 HD3 LYS 147 -9.702 -9.084 3.017 1175 HE2 LYS 147 HE2 LYS 147 -10.684 -11.254 3.260 1176 HE3 LYS 147 HE3 LYS 147 -9.897 -10.844 4.794 1177 HZ1 LYS 147 HZ1 LYS 147 -12.123 -10.149 5.593 1178 HZ2 LYS 147 HZ2 LYS 147 -12.006 -11.762 5.275 1179 HZ3 LYS 147 HZ3 LYS 147 -12.792 -10.764 4.216 1180 H LEU 148 H LEU 148 -7.041 -5.550 6.584 1181 HA LEU 148 HA LEU 148 -5.003 -7.261 7.933 1182 HB2 LEU 148 HB2 LEU 148 -4.750 -4.564 6.558 1183 HB3 LEU 148 HB3 LEU 148 -3.430 -5.445 7.300 1184 HG LEU 148 HG LEU 148 -4.929 -6.326 4.835 1185 HD11 LEU 148 HD11 LEU 148 -3.585 -4.326 4.457 1186 HD12 LEU 148 HD12 LEU 148 -2.782 -5.722 3.715 1187 HD13 LEU 148 HD13 LEU 148 -2.191 -5.078 5.264 1188 HD21 LEU 148 HD21 LEU 148 -4.075 -8.239 6.076 1189 HD22 LEU 148 HD22 LEU 148 -2.467 -7.480 6.153 1190 HD23 LEU 148 HD23 LEU 148 -3.149 -7.978 4.588 1191 H GLY 149 H GLY 149 -7.438 -5.283 8.909 1192 HA2 GLY 149 HA2 GLY 149 -6.475 -3.178 10.350 1193 HA3 GLY 149 HA3 GLY 149 -7.804 -4.189 10.902 Start of MODEL 13 1 H1 GLU 1 H1 GLU 1 16.762 23.612 11.057 2 H2 GLU 1 H2 GLU 1 16.440 22.074 10.557 3 H3 GLU 1 H3 GLU 1 17.441 23.028 9.664 4 HA GLU 1 HA GLU 1 15.579 24.568 9.261 5 HB2 GLU 1 HB2 GLU 1 14.270 22.768 7.829 6 HB3 GLU 1 HB3 GLU 1 15.883 23.309 7.372 7 HG2 GLU 1 HG2 GLU 1 15.688 20.874 9.127 8 HG3 GLU 1 HG3 GLU 1 15.199 20.723 7.435 9 H ALA 2 H ALA 2 13.758 25.327 10.202 10 HA ALA 2 HA ALA 2 12.306 23.518 12.033 11 HB1 ALA 2 HB1 ALA 2 12.943 25.778 12.840 12 HB2 ALA 2 HB2 ALA 2 12.021 26.517 11.505 13 HB3 ALA 2 HB3 ALA 2 11.174 25.600 12.772 14 H ARG 3 H ARG 3 10.285 22.855 11.729 15 HA ARG 3 HA ARG 3 8.271 22.364 10.798 16 HB2 ARG 3 HB2 ARG 3 8.534 24.804 9.025 17 HB3 ARG 3 HB3 ARG 3 7.052 23.978 9.488 18 HG2 ARG 3 HG2 ARG 3 7.332 24.725 11.819 19 HG3 ARG 3 HG3 ARG 3 8.866 25.498 11.398 20 HD2 ARG 3 HD2 ARG 3 6.155 26.237 10.260 21 HD3 ARG 3 HD3 ARG 3 7.037 27.141 11.504 22 HE ARG 3 HE ARG 3 7.577 27.065 8.623 23 HH11 ARG 3 HH11 ARG 3 8.928 27.963 11.786 24 HH12 ARG 3 HH12 ARG 3 10.068 29.065 11.051 25 HH21 ARG 3 HH21 ARG 3 9.088 28.453 7.802 26 HH22 ARG 3 HH22 ARG 3 10.167 29.319 8.856 27 HA PRO 4 HA PRO 4 9.323 20.283 7.054 28 HB2 PRO 4 HB2 PRO 4 6.932 19.319 6.179 29 HB3 PRO 4 HB3 PRO 4 7.701 18.721 7.684 30 HG2 PRO 4 HG2 PRO 4 5.535 20.785 7.364 31 HG3 PRO 4 HG3 PRO 4 5.597 19.373 8.463 32 HD2 PRO 4 HD2 PRO 4 6.257 21.900 9.252 33 HD3 PRO 4 HD3 PRO 4 7.040 20.436 9.937 34 H ILE 5 H ILE 5 10.015 22.280 6.041 35 HA ILE 5 HA ILE 5 8.109 23.860 4.503 36 HB ILE 5 HB ILE 5 10.177 25.019 3.646 37 HG12 ILE 5 HG12 ILE 5 11.683 23.179 5.557 38 HG13 ILE 5 HG13 ILE 5 11.649 22.949 3.808 39 HG21 ILE 5 HG21 ILE 5 10.175 24.716 6.696 40 HG22 ILE 5 HG22 ILE 5 10.692 26.133 5.750 41 HG23 ILE 5 HG23 ILE 5 8.979 25.675 5.788 42 HD11 ILE 5 HD11 ILE 5 12.800 25.372 5.246 43 HD12 ILE 5 HD12 ILE 5 13.717 24.051 4.494 44 HD13 ILE 5 HD13 ILE 5 12.747 25.138 3.481 45 H VAL 6 H VAL 6 7.929 24.003 2.264 46 HA VAL 6 HA VAL 6 8.988 21.639 0.773 47 HB VAL 6 HB VAL 6 6.467 21.752 1.293 48 HG11 VAL 6 HG11 VAL 6 6.488 23.883 -0.894 49 HG12 VAL 6 HG12 VAL 6 5.059 23.161 -0.126 50 HG13 VAL 6 HG13 VAL 6 6.152 24.177 0.831 51 HG21 VAL 6 HG21 VAL 6 5.821 20.836 -0.869 52 HG22 VAL 6 HG22 VAL 6 7.250 21.560 -1.642 53 HG23 VAL 6 HG23 VAL 6 7.448 20.271 -0.433 54 H VAL 7 H VAL 7 9.168 24.972 1.076 55 HA VAL 7 HA VAL 7 10.385 25.219 -1.602 56 HB VAL 7 HB VAL 7 7.990 25.835 -1.891 57 HG11 VAL 7 HG11 VAL 7 7.475 26.662 0.367 58 HG12 VAL 7 HG12 VAL 7 8.527 28.071 0.112 59 HG13 VAL 7 HG13 VAL 7 7.056 27.868 -0.858 60 HG21 VAL 7 HG21 VAL 7 9.798 28.268 -2.132 61 HG22 VAL 7 HG22 VAL 7 9.740 26.913 -3.282 62 HG23 VAL 7 HG23 VAL 7 8.309 27.942 -3.051 63 H GLY 8 H GLY 8 10.070 26.326 1.709 64 HA2 GLY 8 HA2 GLY 8 12.255 27.059 2.665 65 HA3 GLY 8 HA3 GLY 8 12.401 28.141 1.275 66 HA PRO 9 HA PRO 9 10.234 31.129 3.668 67 HB2 PRO 9 HB2 PRO 9 8.623 32.487 1.921 68 HB3 PRO 9 HB3 PRO 9 10.412 32.623 1.866 69 HG2 PRO 9 HG2 PRO 9 8.605 30.840 0.245 70 HG3 PRO 9 HG3 PRO 9 9.877 31.972 -0.325 71 HD2 PRO 9 HD2 PRO 9 10.384 29.349 -0.033 72 HD3 PRO 9 HD3 PRO 9 11.614 30.575 0.428 73 HA PRO 10 HA PRO 10 6.391 29.260 4.704 74 HB2 PRO 10 HB2 PRO 10 4.997 31.196 6.031 75 HB3 PRO 10 HB3 PRO 10 6.482 30.456 6.717 76 HG2 PRO 10 HG2 PRO 10 6.191 33.030 5.180 77 HG3 PRO 10 HG3 PRO 10 6.988 32.749 6.763 78 HD2 PRO 10 HD2 PRO 10 8.403 32.835 4.462 79 HD3 PRO 10 HD3 PRO 10 8.830 31.683 5.775 80 HA PRO 11 HA PRO 11 3.559 30.510 1.516 81 HB2 PRO 11 HB2 PRO 11 1.222 29.315 2.246 82 HB3 PRO 11 HB3 PRO 11 2.640 28.346 1.733 83 HG2 PRO 11 HG2 PRO 11 1.730 29.042 4.515 84 HG3 PRO 11 HG3 PRO 11 2.131 27.435 3.832 85 HD2 PRO 11 HD2 PRO 11 3.918 28.876 5.276 86 HD3 PRO 11 HD3 PRO 11 4.431 27.862 3.882 87 HA PRO 12 HA PRO 12 1.383 33.959 3.285 88 HB2 PRO 12 HB2 PRO 12 -0.610 34.543 1.542 89 HB3 PRO 12 HB3 PRO 12 1.116 34.720 1.084 90 HG2 PRO 12 HG2 PRO 12 -0.755 32.427 0.543 91 HG3 PRO 12 HG3 PRO 12 0.279 33.330 -0.608 92 HD2 PRO 12 HD2 PRO 12 1.061 30.965 0.487 93 HD3 PRO 12 HD3 PRO 12 2.236 32.282 0.145 94 H LEU 13 H LEU 13 0.038 30.901 3.231 95 HA LEU 13 HA LEU 13 -2.552 31.692 4.446 96 HB2 LEU 13 HB2 LEU 13 -1.384 28.958 3.787 97 HB3 LEU 13 HB3 LEU 13 -2.956 29.239 4.502 98 HG LEU 13 HG LEU 13 -3.544 28.750 2.374 99 HD11 LEU 13 HD11 LEU 13 -4.262 30.730 1.173 100 HD12 LEU 13 HD12 LEU 13 -3.100 31.746 2.053 101 HD13 LEU 13 HD13 LEU 13 -4.466 30.995 2.915 102 HD21 LEU 13 HD21 LEU 13 -1.256 28.535 1.492 103 HD22 LEU 13 HD22 LEU 13 -1.178 30.298 1.271 104 HD23 LEU 13 HD23 LEU 13 -2.340 29.335 0.338 105 H SER 14 H SER 14 -2.885 31.529 6.621 106 HA SER 14 HA SER 14 -0.568 31.108 8.333 107 HB2 SER 14 HB2 SER 14 -2.237 31.576 10.140 108 HB3 SER 14 HB3 SER 14 -2.203 32.821 8.871 109 HG SER 14 HG SER 14 -4.342 32.032 9.528 110 H GLY 15 H GLY 15 -2.963 29.041 6.991 111 HA2 GLY 15 HA2 GLY 15 -2.999 27.187 9.251 112 HA3 GLY 15 HA3 GLY 15 -3.785 26.961 7.682 113 H GLY 16 H GLY 16 -1.670 25.517 9.599 114 HA2 GLY 16 HA2 GLY 16 -0.566 23.784 7.727 115 HA3 GLY 16 HA3 GLY 16 0.616 25.108 7.904 116 H LEU 17 H LEU 17 1.829 23.128 8.780 117 HA LEU 17 HA LEU 17 2.783 22.028 10.527 118 HB2 LEU 17 HB2 LEU 17 3.164 24.510 10.959 119 HB3 LEU 17 HB3 LEU 17 1.923 24.386 12.201 120 HG LEU 17 HG LEU 17 3.337 22.558 13.271 121 HD11 LEU 17 HD11 LEU 17 4.742 21.950 11.378 122 HD12 LEU 17 HD12 LEU 17 5.757 22.578 12.687 123 HD13 LEU 17 HD13 LEU 17 5.378 23.602 11.281 124 HD21 LEU 17 HD21 LEU 17 3.241 24.865 14.109 125 HD22 LEU 17 HD22 LEU 17 4.558 25.329 13.003 126 HD23 LEU 17 HD23 LEU 17 4.856 24.167 14.319 127 HA PRO 18 HA PRO 18 -0.987 20.382 12.590 128 HB2 PRO 18 HB2 PRO 18 -0.791 17.786 11.853 129 HB3 PRO 18 HB3 PRO 18 -1.368 19.032 10.701 130 HG2 PRO 18 HG2 PRO 18 1.398 17.902 11.030 131 HG3 PRO 18 HG3 PRO 18 0.401 18.016 9.545 132 HD2 PRO 18 HD2 PRO 18 2.292 19.864 10.170 133 HD3 PRO 18 HD3 PRO 18 0.761 20.311 9.338 134 H GLY 19 H GLY 19 2.075 20.573 13.392 135 HA2 GLY 19 HA2 GLY 19 1.850 18.745 15.708 136 HA3 GLY 19 HA3 GLY 19 3.300 18.625 14.681 137 H THR 20 H THR 20 4.461 19.331 16.687 138 HA THR 20 HA THR 20 4.126 22.273 17.144 139 HB THR 20 HB THR 20 5.318 21.841 19.323 140 HG1 THR 20 HG1 THR 20 5.199 19.226 18.275 141 HG21 THR 20 HG21 THR 20 3.375 20.899 20.455 142 HG22 THR 20 HG22 THR 20 2.762 20.231 18.927 143 HG23 THR 20 HG23 THR 20 2.828 21.995 19.166 144 H GLU 21 H GLU 21 5.742 23.641 16.829 145 HA GLU 21 HA GLU 21 7.784 22.851 15.017 146 HB2 GLU 21 HB2 GLU 21 6.757 25.124 15.176 147 HB3 GLU 21 HB3 GLU 21 7.621 25.382 16.695 148 HG2 GLU 21 HG2 GLU 21 9.768 25.214 15.542 149 HG3 GLU 21 HG3 GLU 21 8.950 24.796 14.028 150 H ASN 22 H ASN 22 9.862 22.379 15.215 151 HA ASN 22 HA ASN 22 11.837 21.711 16.106 152 HB2 ASN 22 HB2 ASN 22 11.644 24.244 16.760 153 HB3 ASN 22 HB3 ASN 22 11.469 23.620 18.405 154 HD21 ASN 22 HD21 ASN 22 13.305 23.551 19.487 155 HD22 ASN 22 HD22 ASN 22 14.888 23.305 18.791 156 H SER 23 H SER 23 9.304 20.432 17.114 157 HA SER 23 HA SER 23 10.512 19.178 19.537 158 HB2 SER 23 HB2 SER 23 7.590 19.850 19.138 159 HB3 SER 23 HB3 SER 23 8.309 19.083 20.566 160 HG SER 23 HG SER 23 8.818 21.711 19.569 161 H ASP 24 H ASP 24 8.213 18.861 16.784 162 HA ASP 24 HA ASP 24 9.083 16.047 16.607 163 HB2 ASP 24 HB2 ASP 24 6.905 15.120 16.449 164 HB3 ASP 24 HB3 ASP 24 6.938 16.076 17.938 165 H GLN 25 H GLN 25 7.985 15.098 14.499 166 HA GLN 25 HA GLN 25 9.138 16.721 12.404 167 HB2 GLN 25 HB2 GLN 25 7.684 14.059 12.372 168 HB3 GLN 25 HB3 GLN 25 8.514 14.764 10.978 169 HG2 GLN 25 HG2 GLN 25 10.651 14.569 12.021 170 HG3 GLN 25 HG3 GLN 25 9.932 14.188 13.592 171 HE21 GLN 25 HE21 GLN 25 10.581 12.948 10.348 172 HE22 GLN 25 HE22 GLN 25 10.374 11.269 10.783 173 H ALA 26 H ALA 26 6.012 16.755 13.681 174 HA ALA 26 HA ALA 26 3.990 17.478 12.934 175 HB1 ALA 26 HB1 ALA 26 5.751 19.251 11.207 176 HB2 ALA 26 HB2 ALA 26 4.058 19.567 11.647 177 HB3 ALA 26 HB3 ALA 26 5.317 19.550 12.904 178 H ARG 27 H ARG 27 4.007 15.246 11.958 179 HA ARG 27 HA ARG 27 2.727 13.991 10.492 180 HB2 ARG 27 HB2 ARG 27 1.745 16.083 9.505 181 HB3 ARG 27 HB3 ARG 27 3.084 16.107 8.368 182 HG2 ARG 27 HG2 ARG 27 2.246 13.676 7.760 183 HG3 ARG 27 HG3 ARG 27 0.729 14.250 8.481 184 HD2 ARG 27 HD2 ARG 27 0.687 14.720 6.100 185 HD3 ARG 27 HD3 ARG 27 0.880 16.261 6.969 186 HE ARG 27 HE ARG 27 3.395 14.950 6.167 187 HH11 ARG 27 HH11 ARG 27 0.959 17.342 5.215 188 HH12 ARG 27 HH12 ARG 27 2.059 18.154 4.135 189 HH21 ARG 27 HH21 ARG 27 4.706 16.010 4.797 190 HH22 ARG 27 HH22 ARG 27 4.160 17.406 3.896 191 H ASP 28 H ASP 28 5.666 15.561 9.238 192 HA ASP 28 HA ASP 28 7.375 14.743 7.926 193 HB2 ASP 28 HB2 ASP 28 7.438 13.151 9.946 194 HB3 ASP 28 HB3 ASP 28 6.647 11.965 8.912 195 H GLY 29 H GLY 29 7.313 11.893 6.769 196 HA2 GLY 29 HA2 GLY 29 4.971 11.753 5.085 197 HA3 GLY 29 HA3 GLY 29 6.357 12.427 4.216 198 H THR 30 H THR 30 7.141 10.103 6.716 199 HA THR 30 HA THR 30 7.480 8.021 4.590 200 HB THR 30 HB THR 30 9.583 7.337 5.680 201 HG1 THR 30 HG1 THR 30 9.271 9.649 7.337 202 HG21 THR 30 HG21 THR 30 9.642 9.143 3.914 203 HG22 THR 30 HG22 THR 30 10.999 9.190 5.062 204 HG23 THR 30 HG23 THR 30 9.662 10.345 5.229 205 H LEU 31 H LEU 31 7.665 5.797 5.441 206 HA LEU 31 HA LEU 31 6.236 5.432 8.046 207 HB2 LEU 31 HB2 LEU 31 5.823 3.890 5.464 208 HB3 LEU 31 HB3 LEU 31 5.103 3.474 7.016 209 HG LEU 31 HG LEU 31 4.538 6.043 5.496 210 HD11 LEU 31 HD11 LEU 31 2.395 4.997 4.910 211 HD12 LEU 31 HD12 LEU 31 2.883 3.497 5.733 212 HD13 LEU 31 HD13 LEU 31 3.752 4.041 4.278 213 HD21 LEU 31 HD21 LEU 31 4.148 6.298 7.899 214 HD22 LEU 31 HD22 LEU 31 3.207 4.785 7.935 215 HD23 LEU 31 HD23 LEU 31 2.597 6.200 7.047 216 HA PRO 32 HA PRO 32 10.130 2.941 7.750 217 HB2 PRO 32 HB2 PRO 32 11.449 3.771 9.966 218 HB3 PRO 32 HB3 PRO 32 11.344 4.801 8.507 219 HG2 PRO 32 HG2 PRO 32 9.619 4.853 10.975 220 HG3 PRO 32 HG3 PRO 32 10.521 6.200 10.208 221 HD2 PRO 32 HD2 PRO 32 7.881 5.758 9.712 222 HD3 PRO 32 HD3 PRO 32 8.999 6.375 8.446 223 H TYR 33 H TYR 33 7.498 2.103 8.915 224 HA TYR 33 HA TYR 33 7.725 1.026 11.523 225 HB2 TYR 33 HB2 TYR 33 5.587 1.140 10.399 226 HB3 TYR 33 HB3 TYR 33 6.165 0.108 9.086 227 HD1 TYR 33 HD2 TYR 33 5.770 -0.039 12.853 228 HD2 TYR 33 HD1 TYR 33 5.532 -2.170 9.105 229 HE1 TYR 33 HE2 TYR 33 4.975 -2.091 14.048 230 HE2 TYR 33 HE1 TYR 33 4.771 -4.197 10.332 231 HH TYR 33 HH TYR 33 4.184 -4.294 13.794 232 H THR 34 H THR 34 8.744 -0.376 8.403 233 HA THR 34 HA THR 34 9.396 -2.925 9.699 234 HB THR 34 HB THR 34 10.105 -3.548 7.385 235 HG1 THR 34 HG1 THR 34 9.668 -1.962 5.754 236 HG21 THR 34 HG21 THR 34 7.708 -3.678 8.174 237 HG22 THR 34 HG22 THR 34 7.930 -3.549 6.414 238 HG23 THR 34 HG23 THR 34 7.434 -2.123 7.351 239 H LYS 35 H LYS 35 11.089 0.004 9.030 240 HA LYS 35 HA LYS 35 13.496 -0.702 7.966 241 HB2 LYS 35 HB2 LYS 35 12.843 1.598 8.538 242 HB3 LYS 35 HB3 LYS 35 13.030 1.242 10.257 243 HG2 LYS 35 HG2 LYS 35 15.488 0.748 9.779 244 HG3 LYS 35 HG3 LYS 35 15.227 1.437 8.165 245 HD2 LYS 35 HD2 LYS 35 14.734 3.584 9.065 246 HD3 LYS 35 HD3 LYS 35 14.456 2.924 10.691 247 HE2 LYS 35 HE2 LYS 35 17.127 2.236 9.842 248 HE3 LYS 35 HE3 LYS 35 16.878 3.986 9.645 249 HZ1 LYS 35 HZ1 LYS 35 16.338 2.431 12.121 250 HZ2 LYS 35 HZ2 LYS 35 16.120 4.059 11.953 251 HZ3 LYS 35 HZ3 LYS 35 17.640 3.416 11.881 252 H ASP 36 H ASP 36 13.295 -0.385 11.540 253 HA ASP 36 HA ASP 36 15.738 -2.032 11.727 254 HB2 ASP 36 HB2 ASP 36 14.049 -0.685 13.869 255 HB3 ASP 36 HB3 ASP 36 15.666 -1.369 14.097 256 H ARG 37 H ARG 37 12.380 -2.373 11.759 257 HA ARG 37 HA ARG 37 12.134 -4.422 13.769 258 HB2 ARG 37 HB2 ARG 37 10.412 -2.724 12.793 259 HB3 ARG 37 HB3 ARG 37 10.115 -3.983 11.583 260 HG2 ARG 37 HG2 ARG 37 9.537 -5.562 13.349 261 HG3 ARG 37 HG3 ARG 37 9.999 -4.378 14.575 262 HD2 ARG 37 HD2 ARG 37 8.206 -2.867 13.685 263 HD3 ARG 37 HD3 ARG 37 7.670 -4.228 12.675 264 HE ARG 37 HE ARG 37 6.976 -5.416 14.591 265 HH11 ARG 37 HH11 ARG 37 8.517 -2.377 15.569 266 HH12 ARG 37 HH12 ARG 37 7.944 -2.512 17.208 267 HH21 ARG 37 HH21 ARG 37 6.301 -5.524 16.684 268 HH22 ARG 37 HH22 ARG 37 6.696 -4.249 17.823 269 H PHE 38 H PHE 38 13.464 -4.605 10.675 270 HA PHE 38 HA PHE 38 12.569 -7.349 10.138 271 HB2 PHE 38 HB2 PHE 38 14.723 -5.553 8.988 272 HB3 PHE 38 HB3 PHE 38 14.617 -7.267 8.572 273 HD1 PHE 38 HD2 PHE 38 11.966 -7.979 8.074 274 HD2 PHE 38 HD1 PHE 38 13.835 -4.172 7.329 275 HE1 PHE 38 HE2 PHE 38 10.276 -7.504 6.304 276 HE2 PHE 38 HE1 PHE 38 12.163 -3.698 5.544 277 HZ PHE 38 HZ PHE 38 10.370 -5.360 5.035 278 H TYR 39 H TYR 39 14.819 -5.834 12.255 279 HA TYR 39 HA TYR 39 16.257 -8.439 12.580 280 HB2 TYR 39 HB2 TYR 39 17.359 -5.647 13.018 281 HB3 TYR 39 HB3 TYR 39 18.251 -7.172 13.120 282 HD1 TYR 39 HD2 TYR 39 18.393 -8.614 10.948 283 HD2 TYR 39 HD1 TYR 39 17.168 -4.484 10.951 284 HE1 TYR 39 HE2 TYR 39 18.876 -8.462 8.506 285 HE2 TYR 39 HE1 TYR 39 17.653 -4.346 8.508 286 HH TYR 39 HH TYR 39 18.882 -7.137 6.651 287 H LEU 40 H LEU 40 15.126 -5.491 14.284 288 HA LEU 40 HA LEU 40 15.997 -6.455 16.868 289 HB2 LEU 40 HB2 LEU 40 14.316 -4.188 15.843 290 HB3 LEU 40 HB3 LEU 40 14.212 -4.613 17.544 291 HG LEU 40 HG LEU 40 16.613 -4.226 17.838 292 HD11 LEU 40 HD11 LEU 40 17.515 -4.670 15.619 293 HD12 LEU 40 HD12 LEU 40 17.895 -3.000 16.082 294 HD13 LEU 40 HD13 LEU 40 16.581 -3.323 14.930 295 HD21 LEU 40 HD21 LEU 40 14.971 -2.443 18.241 296 HD22 LEU 40 HD22 LEU 40 15.102 -1.921 16.544 297 HD23 LEU 40 HD23 LEU 40 16.498 -1.771 17.637 298 H GLN 41 H GLN 41 13.054 -6.849 14.990 299 HA GLN 41 HA GLN 41 11.923 -8.443 17.244 300 HB2 GLN 41 HB2 GLN 41 10.566 -6.485 15.386 301 HB3 GLN 41 HB3 GLN 41 9.675 -7.846 16.058 302 HG2 GLN 41 HG2 GLN 41 9.194 -6.103 17.523 303 HG3 GLN 41 HG3 GLN 41 10.426 -7.048 18.363 304 HE21 GLN 41 HE21 GLN 41 11.872 -5.837 19.373 305 HE22 GLN 41 HE22 GLN 41 12.408 -4.254 18.865 306 HA PRO 42 HA PRO 42 11.687 -11.535 14.036 307 HB2 PRO 42 HB2 PRO 42 9.695 -13.162 14.923 308 HB3 PRO 42 HB3 PRO 42 11.265 -13.070 15.786 309 HG2 PRO 42 HG2 PRO 42 8.689 -11.628 16.384 310 HG3 PRO 42 HG3 PRO 42 9.719 -12.594 17.486 311 HD2 PRO 42 HD2 PRO 42 9.879 -9.888 17.354 312 HD3 PRO 42 HD3 PRO 42 11.332 -10.909 17.641 313 H LEU 43 H LEU 43 9.851 -12.496 12.532 314 HA LEU 43 HA LEU 43 7.847 -10.336 12.042 315 HB2 LEU 43 HB2 LEU 43 9.770 -10.915 10.378 316 HB3 LEU 43 HB3 LEU 43 8.763 -12.278 9.927 317 HG LEU 43 HG LEU 43 7.900 -9.367 9.812 318 HD11 LEU 43 HD11 LEU 43 8.267 -9.547 7.379 319 HD12 LEU 43 HD12 LEU 43 8.892 -11.198 7.596 320 HD13 LEU 43 HD13 LEU 43 9.772 -9.815 8.288 321 HD21 LEU 43 HD21 LEU 43 6.609 -11.870 8.677 322 HD22 LEU 43 HD22 LEU 43 6.136 -10.207 8.252 323 HD23 LEU 43 HD23 LEU 43 5.945 -10.786 9.919 324 HA PRO 44 HA PRO 44 5.432 -14.128 12.948 325 HB2 PRO 44 HB2 PRO 44 3.539 -13.079 14.599 326 HB3 PRO 44 HB3 PRO 44 5.167 -13.520 15.209 327 HG2 PRO 44 HG2 PRO 44 4.130 -10.844 14.348 328 HG3 PRO 44 HG3 PRO 44 4.975 -11.287 15.861 329 HD2 PRO 44 HD2 PRO 44 6.267 -10.181 13.740 330 HD3 PRO 44 HD3 PRO 44 7.047 -11.405 14.800 331 HA PRO 45 HA PRO 45 2.615 -12.938 9.823 332 HB2 PRO 45 HB2 PRO 45 0.395 -14.474 10.130 333 HB3 PRO 45 HB3 PRO 45 1.975 -15.156 9.633 334 HG2 PRO 45 HG2 PRO 45 0.776 -15.032 12.395 335 HG3 PRO 45 HG3 PRO 45 1.432 -16.453 11.515 336 HD2 PRO 45 HD2 PRO 45 2.949 -15.108 13.288 337 HD3 PRO 45 HD3 PRO 45 3.659 -15.709 11.748 338 H THR 46 H THR 46 1.664 -12.443 13.122 339 HA THR 46 HA THR 46 -0.773 -10.963 12.591 340 HB THR 46 HB THR 46 -0.192 -10.002 14.928 341 HG1 THR 46 HG1 THR 46 1.500 -10.996 15.971 342 HG21 THR 46 HG21 THR 46 -0.344 -13.034 14.629 343 HG22 THR 46 HG22 THR 46 -1.738 -11.923 14.591 344 HG23 THR 46 HG23 THR 46 -0.775 -12.092 16.074 345 H GLU 47 H GLU 47 2.678 -10.075 13.159 346 HA GLU 47 HA GLU 47 2.168 -7.252 12.699 347 HB2 GLU 47 HB2 GLU 47 4.728 -8.877 12.691 348 HB3 GLU 47 HB3 GLU 47 4.647 -7.128 12.444 349 HG2 GLU 47 HG2 GLU 47 3.460 -6.969 14.670 350 HG3 GLU 47 HG3 GLU 47 3.882 -8.666 14.932 351 H ALA 48 H ALA 48 2.749 -10.044 10.687 352 HA ALA 48 HA ALA 48 3.738 -8.722 8.379 353 HB1 ALA 48 HB1 ALA 48 3.635 -11.191 8.641 354 HB2 ALA 48 HB2 ALA 48 1.868 -11.110 8.463 355 HB3 ALA 48 HB3 ALA 48 2.919 -10.621 7.118 356 H ALA 49 H ALA 49 0.475 -8.914 9.790 357 HA ALA 49 HA ALA 49 -0.881 -7.839 7.488 358 HB1 ALA 49 HB1 ALA 49 -1.629 -7.648 10.444 359 HB2 ALA 49 HB2 ALA 49 -2.715 -7.360 9.067 360 HB3 ALA 49 HB3 ALA 49 -2.060 -8.987 9.358 361 H GLN 50 H GLN 50 0.695 -6.370 10.332 362 HA GLN 50 HA GLN 50 -0.144 -3.697 9.750 363 HB2 GLN 50 HB2 GLN 50 2.268 -4.716 11.282 364 HB3 GLN 50 HB3 GLN 50 1.728 -3.036 11.251 365 HG2 GLN 50 HG2 GLN 50 -0.429 -3.725 12.247 366 HG3 GLN 50 HG3 GLN 50 0.147 -5.398 12.324 367 HE21 GLN 50 HE21 GLN 50 0.068 -2.355 13.875 368 HE22 GLN 50 HE22 GLN 50 1.152 -2.745 15.186 369 H ARG 51 H ARG 51 2.912 -5.474 8.923 370 HA ARG 51 HA ARG 51 3.882 -3.126 7.492 371 HB2 ARG 51 HB2 ARG 51 5.642 -4.659 6.570 372 HB3 ARG 51 HB3 ARG 51 5.604 -4.434 8.310 373 HG2 ARG 51 HG2 ARG 51 4.075 -6.754 7.716 374 HG3 ARG 51 HG3 ARG 51 5.604 -6.857 6.840 375 HD2 ARG 51 HD2 ARG 51 5.407 -6.186 9.810 376 HD3 ARG 51 HD3 ARG 51 5.634 -7.827 9.199 377 HE ARG 51 HE ARG 51 7.686 -6.339 8.051 378 HH11 ARG 51 HH11 ARG 51 6.699 -7.118 11.369 379 HH12 ARG 51 HH12 ARG 51 8.334 -7.090 11.961 380 HH21 ARG 51 HH21 ARG 51 9.763 -6.298 8.915 381 HH22 ARG 51 HH22 ARG 51 10.021 -6.626 10.613 382 H ALA 52 H ALA 52 1.930 -5.898 6.554 383 HA ALA 52 HA ALA 52 2.158 -5.510 3.728 384 HB1 ALA 52 HB1 ALA 52 -0.093 -6.593 3.612 385 HB2 ALA 52 HB2 ALA 52 1.025 -7.488 4.662 386 HB3 ALA 52 HB3 ALA 52 -0.231 -6.462 5.380 387 H LYS 53 H LYS 53 0.095 -3.927 6.210 388 HA LYS 53 HA LYS 53 -1.393 -2.344 4.318 389 HB2 LYS 53 HB2 LYS 53 -0.791 -1.945 7.264 390 HB3 LYS 53 HB3 LYS 53 -1.824 -0.858 6.322 391 HG2 LYS 53 HG2 LYS 53 -3.246 -2.831 5.704 392 HG3 LYS 53 HG3 LYS 53 -2.306 -3.823 6.801 393 HD2 LYS 53 HD2 LYS 53 -3.793 -1.334 7.713 394 HD3 LYS 53 HD3 LYS 53 -4.526 -2.944 7.666 395 HE2 LYS 53 HE2 LYS 53 -2.568 -3.740 9.112 396 HE3 LYS 53 HE3 LYS 53 -2.210 -2.019 9.386 397 HZ1 LYS 53 HZ1 LYS 53 -4.578 -1.829 10.173 398 HZ2 LYS 53 HZ2 LYS 53 -3.656 -2.808 11.130 399 HZ3 LYS 53 HZ3 LYS 53 -4.721 -3.474 10.066 400 H VAL 54 H VAL 54 1.785 -1.888 5.848 401 HA VAL 54 HA VAL 54 2.103 0.840 4.925 402 HB VAL 54 HB VAL 54 4.180 -1.260 5.721 403 HG11 VAL 54 HG11 VAL 54 5.293 0.343 4.290 404 HG12 VAL 54 HG12 VAL 54 4.516 1.704 5.128 405 HG13 VAL 54 HG13 VAL 54 5.729 0.714 5.970 406 HG21 VAL 54 HG21 VAL 54 3.040 1.124 7.241 407 HG22 VAL 54 HG22 VAL 54 2.672 -0.585 7.561 408 HG23 VAL 54 HG23 VAL 54 4.310 0.027 7.824 409 H SER 55 H SER 55 3.245 -2.354 3.665 410 HA SER 55 HA SER 55 4.523 -1.314 1.363 411 HB2 SER 55 HB2 SER 55 3.102 -3.987 1.685 412 HB3 SER 55 HB3 SER 55 4.392 -3.607 0.520 413 HG SER 55 HG SER 55 4.969 -4.678 2.652 414 H ALA 56 H ALA 56 1.111 -2.155 1.934 415 HA ALA 56 HA ALA 56 0.261 -1.811 -0.800 416 HB1 ALA 56 HB1 ALA 56 -1.941 -1.878 0.077 417 HB2 ALA 56 HB2 ALA 56 -0.985 -2.995 1.061 418 HB3 ALA 56 HB3 ALA 56 -1.389 -1.389 1.696 419 H SER 57 H SER 57 0.828 0.426 1.885 420 HA SER 57 HA SER 57 -0.609 2.620 0.653 421 HB2 SER 57 HB2 SER 57 1.527 2.632 2.820 422 HB3 SER 57 HB3 SER 57 0.485 3.999 2.377 423 HG SER 57 HG SER 57 -0.300 1.487 3.475 424 H GLU 58 H GLU 58 2.651 1.299 0.354 425 HA GLU 58 HA GLU 58 3.874 3.636 -0.802 426 HB2 GLU 58 HB2 GLU 58 4.421 0.688 -1.292 427 HB3 GLU 58 HB3 GLU 58 5.453 2.017 -1.817 428 HG2 GLU 58 HG2 GLU 58 5.883 2.647 0.496 429 HG3 GLU 58 HG3 GLU 58 4.805 1.360 1.061 430 H ILE 59 H ILE 59 1.772 1.088 -2.044 431 HA ILE 59 HA ILE 59 2.197 1.643 -4.834 432 HB ILE 59 HB ILE 59 -0.214 0.379 -3.451 433 HG12 ILE 59 HG12 ILE 59 2.189 -0.955 -4.758 434 HG13 ILE 59 HG13 ILE 59 2.024 -0.721 -3.020 435 HG21 ILE 59 HG21 ILE 59 -0.683 -0.649 -5.665 436 HG22 ILE 59 HG22 ILE 59 -0.720 1.116 -5.781 437 HG23 ILE 59 HG23 ILE 59 0.699 0.223 -6.361 438 HD11 ILE 59 HD11 ILE 59 1.391 -2.952 -3.422 439 HD12 ILE 59 HD12 ILE 59 -0.129 -2.073 -3.145 440 HD13 ILE 59 HD13 ILE 59 0.362 -2.509 -4.799 441 H LEU 60 H LEU 60 0.153 3.117 -2.328 442 HA LEU 60 HA LEU 60 -1.579 4.550 -4.136 443 HB2 LEU 60 HB2 LEU 60 -0.659 5.312 -1.347 444 HB3 LEU 60 HB3 LEU 60 -2.019 6.018 -2.199 445 HG LEU 60 HG LEU 60 -1.911 3.096 -1.387 446 HD11 LEU 60 HD11 LEU 60 -3.312 3.725 0.517 447 HD12 LEU 60 HD12 LEU 60 -3.231 5.438 0.045 448 HD13 LEU 60 HD13 LEU 60 -1.766 4.592 0.592 449 HD21 LEU 60 HD21 LEU 60 -4.335 3.205 -1.687 450 HD22 LEU 60 HD22 LEU 60 -3.491 3.628 -3.189 451 HD23 LEU 60 HD23 LEU 60 -4.207 4.908 -2.181 452 H ASN 61 H ASN 61 1.733 5.043 -3.116 453 HA ASN 61 HA ASN 61 1.760 7.903 -3.627 454 HB2 ASN 61 HB2 ASN 61 3.232 7.017 -1.970 455 HB3 ASN 61 HB3 ASN 61 3.889 5.823 -3.084 456 HD21 ASN 61 HD21 ASN 61 3.902 9.190 -2.165 457 HD22 ASN 61 HD22 ASN 61 5.354 9.599 -3.046 458 H VAL 62 H VAL 62 1.984 5.180 -5.770 459 HA VAL 62 HA VAL 62 3.906 6.200 -7.608 460 HB VAL 62 HB VAL 62 3.107 4.575 -9.188 461 HG11 VAL 62 HG11 VAL 62 3.209 2.534 -7.875 462 HG12 VAL 62 HG12 VAL 62 4.323 3.731 -7.190 463 HG13 VAL 62 HG13 VAL 62 2.765 3.406 -6.397 464 HG21 VAL 62 HG21 VAL 62 0.755 4.917 -9.277 465 HG22 VAL 62 HG22 VAL 62 0.957 3.267 -8.677 466 HG23 VAL 62 HG23 VAL 62 0.547 4.565 -7.548 467 H LYS 63 H LYS 63 0.871 7.546 -7.005 468 HA LYS 63 HA LYS 63 -0.071 8.257 -9.587 469 HB2 LYS 63 HB2 LYS 63 -0.866 8.712 -7.028 470 HB3 LYS 63 HB3 LYS 63 -0.219 10.308 -7.407 471 HG2 LYS 63 HG2 LYS 63 -2.297 8.880 -9.126 472 HG3 LYS 63 HG3 LYS 63 -2.711 9.973 -7.798 473 HD2 LYS 63 HD2 LYS 63 -1.450 11.800 -8.935 474 HD3 LYS 63 HD3 LYS 63 -1.165 10.705 -10.300 475 HE2 LYS 63 HE2 LYS 63 -3.588 10.462 -10.637 476 HE3 LYS 63 HE3 LYS 63 -3.882 11.597 -9.301 477 HZ1 LYS 63 HZ1 LYS 63 -2.248 12.303 -11.663 478 HZ2 LYS 63 HZ2 LYS 63 -2.873 13.329 -10.534 479 HZ3 LYS 63 HZ3 LYS 63 -3.873 12.567 -11.615 480 H GLN 64 H GLN 64 2.713 9.430 -7.733 481 HA GLN 64 HA GLN 64 3.104 11.938 -9.022 482 HB2 GLN 64 HB2 GLN 64 5.136 9.971 -7.908 483 HB3 GLN 64 HB3 GLN 64 5.482 11.643 -8.367 484 HG2 GLN 64 HG2 GLN 64 3.807 12.410 -6.678 485 HG3 GLN 64 HG3 GLN 64 3.614 10.730 -6.155 486 HE21 GLN 64 HE21 GLN 64 4.279 11.917 -4.097 487 HE22 GLN 64 HE22 GLN 64 5.994 11.973 -3.761 488 H PHE 65 H PHE 65 3.640 8.688 -10.303 489 HA PHE 65 HA PHE 65 5.517 9.666 -12.329 490 HB2 PHE 65 HB2 PHE 65 3.988 7.067 -12.092 491 HB3 PHE 65 HB3 PHE 65 5.215 7.416 -13.312 492 HD1 PHE 65 HD1 PHE 65 7.552 8.247 -12.352 493 HD2 PHE 65 HD2 PHE 65 4.663 5.964 -10.137 494 HE1 PHE 65 HE1 PHE 65 9.343 7.503 -10.794 495 HE2 PHE 65 HE2 PHE 65 6.442 5.221 -8.567 496 HZ PHE 65 HZ PHE 65 8.788 5.996 -8.892 497 H ILE 66 H ILE 66 2.091 9.723 -11.955 498 HA ILE 66 HA ILE 66 1.368 9.449 -14.743 499 HB ILE 66 HB ILE 66 -0.093 10.890 -12.469 500 HG12 ILE 66 HG12 ILE 66 0.297 8.479 -12.013 501 HG13 ILE 66 HG13 ILE 66 -1.405 8.896 -12.159 502 HG21 ILE 66 HG21 ILE 66 -0.953 11.689 -14.604 503 HG22 ILE 66 HG22 ILE 66 -1.097 10.030 -15.223 504 HG23 ILE 66 HG23 ILE 66 -2.138 10.585 -13.896 505 HD11 ILE 66 HD11 ILE 66 -1.535 7.879 -14.375 506 HD12 ILE 66 HD12 ILE 66 0.218 7.570 -14.375 507 HD13 ILE 66 HD13 ILE 66 -0.837 6.720 -13.227 508 H ASP 67 H ASP 67 1.871 12.334 -12.605 509 HA ASP 67 HA ASP 67 1.361 14.163 -14.807 510 HB2 ASP 67 HB2 ASP 67 2.211 15.891 -13.245 511 HB3 ASP 67 HB3 ASP 67 0.958 14.870 -12.518 512 H ARG 68 H ARG 68 4.178 12.550 -13.463 513 HA ARG 68 HA ARG 68 6.090 14.111 -14.998 514 HB2 ARG 68 HB2 ARG 68 6.291 11.403 -13.645 515 HB3 ARG 68 HB3 ARG 68 7.656 12.243 -14.391 516 HG2 ARG 68 HG2 ARG 68 5.988 13.480 -12.198 517 HG3 ARG 68 HG3 ARG 68 7.412 12.480 -11.869 518 HD2 ARG 68 HD2 ARG 68 8.820 14.020 -13.135 519 HD3 ARG 68 HD3 ARG 68 7.400 14.998 -13.569 520 HE ARG 68 HE ARG 68 7.358 14.857 -10.798 521 HH11 ARG 68 HH21 ARG 68 9.627 16.106 -13.198 522 HH12 ARG 68 HH22 ARG 68 10.247 17.324 -12.117 523 HH21 ARG 68 HH11 ARG 68 8.189 16.436 -9.481 524 HH22 ARG 68 HH12 ARG 68 9.444 17.505 -10.046 525 H LYS 69 H LYS 69 3.837 11.707 -15.792 526 HA LYS 69 HA LYS 69 3.456 10.396 -17.635 527 HB2 LYS 69 HB2 LYS 69 5.230 12.472 -18.972 528 HB3 LYS 69 HB3 LYS 69 4.163 11.343 -19.813 529 HG2 LYS 69 HG2 LYS 69 2.199 12.338 -18.767 530 HG3 LYS 69 HG3 LYS 69 3.222 13.384 -17.774 531 HD2 LYS 69 HD2 LYS 69 4.108 14.437 -19.838 532 HD3 LYS 69 HD3 LYS 69 2.927 13.493 -20.779 533 HE2 LYS 69 HE2 LYS 69 1.084 14.502 -19.479 534 HE3 LYS 69 HE3 LYS 69 2.257 15.395 -18.491 535 HZ1 LYS 69 HZ1 LYS 69 1.333 16.781 -20.231 536 HZ2 LYS 69 HZ2 LYS 69 1.860 15.750 -21.407 537 HZ3 LYS 69 HZ3 LYS 69 2.949 16.575 -20.481 538 H ALA 70 H ALA 70 5.532 9.656 -15.877 539 HA ALA 70 HA ALA 70 7.800 8.759 -17.511 540 HB1 ALA 70 HB1 ALA 70 8.120 9.690 -15.230 541 HB2 ALA 70 HB2 ALA 70 7.179 8.336 -14.558 542 HB3 ALA 70 HB3 ALA 70 8.733 8.029 -15.369 543 H TRP 71 H TRP 71 6.105 7.471 -18.825 544 HA TRP 71 HA TRP 71 4.715 5.268 -17.936 545 HB2 TRP 71 HB2 TRP 71 6.262 4.959 -20.470 546 HB3 TRP 71 HB3 TRP 71 4.581 4.590 -20.112 547 HD1 TRP 71 HD1 TRP 71 6.588 7.017 -21.951 548 HE1 TRP 71 HE1 TRP 71 5.329 9.133 -22.562 549 HE3 TRP 71 HE3 TRP 71 2.630 6.437 -18.759 550 HZ2 TRP 71 HZ2 TRP 71 2.870 10.384 -21.843 551 HZ3 TRP 71 HZ3 TRP 71 0.826 8.169 -18.763 552 HH2 TRP 71 HH2 TRP 71 0.959 10.123 -20.306 553 HA PRO 72 HA PRO 72 8.110 2.175 -18.202 554 HB2 PRO 72 HB2 PRO 72 10.770 2.729 -18.133 555 HB3 PRO 72 HB3 PRO 72 9.838 2.722 -19.666 556 HG2 PRO 72 HG2 PRO 72 10.592 5.059 -17.925 557 HG3 PRO 72 HG3 PRO 72 10.805 4.853 -19.693 558 HD2 PRO 72 HD2 PRO 72 8.706 6.213 -18.639 559 HD3 PRO 72 HD3 PRO 72 8.540 5.221 -20.128 560 H SER 73 H SER 73 8.953 5.047 -16.244 561 HA SER 73 HA SER 73 10.165 3.551 -14.103 562 HB2 SER 73 HB2 SER 73 8.792 6.256 -13.954 563 HB3 SER 73 HB3 SER 73 10.057 5.630 -12.876 564 HG SER 73 HG SER 73 11.540 5.916 -14.437 565 H LEU 74 H LEU 74 6.888 4.627 -14.910 566 HA LEU 74 HA LEU 74 5.739 3.998 -12.387 567 HB2 LEU 74 HB2 LEU 74 4.682 5.412 -14.122 568 HB3 LEU 74 HB3 LEU 74 4.508 4.018 -15.161 569 HG LEU 74 HG LEU 74 2.720 3.146 -13.950 570 HD11 LEU 74 HD11 LEU 74 1.923 3.960 -11.764 571 HD12 LEU 74 HD12 LEU 74 3.325 5.040 -11.646 572 HD13 LEU 74 HD13 LEU 74 3.551 3.281 -11.639 573 HD21 LEU 74 HD21 LEU 74 2.422 6.164 -13.652 574 HD22 LEU 74 HD22 LEU 74 1.134 4.967 -13.916 575 HD23 LEU 74 HD23 LEU 74 2.309 5.302 -15.198 576 H GLN 75 H GLN 75 5.995 2.026 -15.395 577 HA GLN 75 HA GLN 75 4.695 -0.261 -14.317 578 HB2 GLN 75 HB2 GLN 75 5.298 -0.063 -16.701 579 HB3 GLN 75 HB3 GLN 75 7.017 -0.118 -16.283 580 HG2 GLN 75 HG2 GLN 75 6.737 -2.416 -15.395 581 HG3 GLN 75 HG3 GLN 75 5.020 -2.366 -15.795 582 HE21 GLN 75 HE21 GLN 75 4.412 -3.103 -17.723 583 HE22 GLN 75 HE22 GLN 75 5.515 -3.466 -19.040 584 H ASN 76 H ASN 76 7.998 0.962 -13.924 585 HA ASN 76 HA ASN 76 9.035 -1.522 -12.855 586 HB2 ASN 76 HB2 ASN 76 10.494 0.197 -13.868 587 HB3 ASN 76 HB3 ASN 76 10.059 1.331 -12.586 588 HD21 ASN 76 HD21 ASN 76 11.542 1.536 -11.072 589 HD22 ASN 76 HD22 ASN 76 12.609 0.266 -10.527 590 H ASP 77 H ASP 77 8.361 1.637 -11.256 591 HA ASP 77 HA ASP 77 8.877 0.550 -8.671 592 HB2 ASP 77 HB2 ASP 77 8.472 3.057 -9.793 593 HB3 ASP 77 HB3 ASP 77 7.076 2.866 -8.719 594 H LEU 78 H LEU 78 5.873 0.933 -10.543 595 HA LEU 78 HA LEU 78 4.074 0.379 -8.402 596 HB2 LEU 78 HB2 LEU 78 3.423 1.276 -10.597 597 HB3 LEU 78 HB3 LEU 78 3.876 -0.239 -11.364 598 HG LEU 78 HG LEU 78 2.053 -1.391 -10.241 599 HD11 LEU 78 HD11 LEU 78 0.298 0.020 -9.108 600 HD12 LEU 78 HD12 LEU 78 1.494 1.324 -9.051 601 HD13 LEU 78 HD13 LEU 78 1.803 -0.201 -8.198 602 HD21 LEU 78 HD21 LEU 78 1.236 1.173 -11.661 603 HD22 LEU 78 HD22 LEU 78 0.235 -0.290 -11.499 604 HD23 LEU 78 HD23 LEU 78 1.733 -0.344 -12.444 605 H ARG 79 H ARG 79 5.628 -1.839 -10.794 606 HA ARG 79 HA ARG 79 4.323 -4.137 -9.598 607 HB2 ARG 79 HB2 ARG 79 6.631 -3.896 -11.554 608 HB3 ARG 79 HB3 ARG 79 5.958 -5.437 -11.010 609 HG2 ARG 79 HG2 ARG 79 3.701 -4.707 -11.878 610 HG3 ARG 79 HG3 ARG 79 4.478 -3.274 -12.579 611 HD2 ARG 79 HD2 ARG 79 5.931 -4.721 -13.951 612 HD3 ARG 79 HD3 ARG 79 5.222 -6.160 -13.197 613 HE ARG 79 HE ARG 79 3.250 -4.436 -14.516 614 HH11 ARG 79 HH11 ARG 79 5.493 -7.123 -15.040 615 HH12 ARG 79 HH12 ARG 79 4.592 -7.708 -16.413 616 HH21 ARG 79 HH21 ARG 79 2.189 -5.224 -16.266 617 HH22 ARG 79 HH22 ARG 79 2.748 -6.666 -17.085 618 H LEU 80 H LEU 80 7.398 -2.467 -8.994 619 HA LEU 80 HA LEU 80 8.548 -4.585 -7.409 620 HB2 LEU 80 HB2 LEU 80 8.922 -1.587 -7.503 621 HB3 LEU 80 HB3 LEU 80 9.736 -2.563 -6.287 622 HG LEU 80 HG LEU 80 10.065 -2.998 -9.270 623 HD11 LEU 80 HD11 LEU 80 11.850 -1.499 -7.312 624 HD12 LEU 80 HD12 LEU 80 10.853 -0.759 -8.587 625 HD13 LEU 80 HD13 LEU 80 12.203 -1.824 -9.026 626 HD21 LEU 80 HD21 LEU 80 12.103 -4.238 -8.555 627 HD22 LEU 80 HD22 LEU 80 10.615 -4.985 -7.948 628 HD23 LEU 80 HD23 LEU 80 11.627 -4.011 -6.855 629 H ARG 81 H ARG 81 6.646 -1.661 -6.493 630 HA ARG 81 HA ARG 81 6.616 -2.299 -3.692 631 HB2 ARG 81 HB2 ARG 81 4.710 -0.646 -5.377 632 HB3 ARG 81 HB3 ARG 81 4.725 -0.671 -3.604 633 HG2 ARG 81 HG2 ARG 81 6.914 0.324 -3.520 634 HG3 ARG 81 HG3 ARG 81 7.160 0.083 -5.253 635 HD2 ARG 81 HD2 ARG 81 5.139 1.596 -5.616 636 HD3 ARG 81 HD3 ARG 81 5.300 2.026 -3.905 637 HE ARG 81 HE ARG 81 7.757 2.244 -5.525 638 HH11 ARG 81 HH21 ARG 81 4.974 4.009 -4.215 639 HH12 ARG 81 HH22 ARG 81 5.752 5.565 -4.466 640 HH21 ARG 81 HH11 ARG 81 8.640 4.249 -5.817 641 HH22 ARG 81 HH12 ARG 81 7.775 5.687 -5.314 642 H ALA 82 H ALA 82 4.503 -3.178 -6.387 643 HA ALA 82 HA ALA 82 2.470 -4.442 -4.840 644 HB1 ALA 82 HB1 ALA 82 2.433 -3.859 -7.323 645 HB2 ALA 82 HB2 ALA 82 3.432 -5.302 -7.596 646 HB3 ALA 82 HB3 ALA 82 1.803 -5.457 -6.904 647 H SER 83 H SER 83 5.644 -5.598 -6.039 648 HA SER 83 HA SER 83 5.188 -8.340 -5.334 649 HB2 SER 83 HB2 SER 83 7.806 -6.810 -5.543 650 HB3 SER 83 HB3 SER 83 7.634 -8.575 -5.491 651 HG SER 83 HG SER 83 6.691 -6.779 -7.496 652 H TYR 84 H TYR 84 6.565 -5.561 -3.519 653 HA TYR 84 HA TYR 84 7.385 -7.099 -1.257 654 HB2 TYR 84 HB2 TYR 84 6.360 -4.246 -1.170 655 HB3 TYR 84 HB3 TYR 84 7.478 -5.021 -0.050 656 HD1 TYR 84 HD1 TYR 84 9.251 -6.382 -2.294 657 HD2 TYR 84 HD2 TYR 84 7.763 -2.370 -1.735 658 HE1 TYR 84 HE1 TYR 84 11.128 -5.482 -3.665 659 HE2 TYR 84 HE2 TYR 84 9.644 -1.495 -3.109 660 HH TYR 84 HH TYR 84 11.510 -1.991 -4.309 661 H LEU 85 H LEU 85 4.319 -5.419 -2.025 662 HA LEU 85 HA LEU 85 2.968 -6.054 0.396 663 HB2 LEU 85 HB2 LEU 85 2.047 -4.451 -1.190 664 HB3 LEU 85 HB3 LEU 85 1.946 -5.689 -2.436 665 HG LEU 85 HG LEU 85 0.190 -6.868 -1.198 666 HD11 LEU 85 HD11 LEU 85 0.695 -6.365 1.098 667 HD12 LEU 85 HD12 LEU 85 -0.904 -5.685 0.745 668 HD13 LEU 85 HD13 LEU 85 0.519 -4.623 0.813 669 HD21 LEU 85 HD21 LEU 85 -0.407 -3.912 -1.533 670 HD22 LEU 85 HD22 LEU 85 -1.591 -5.237 -1.534 671 HD23 LEU 85 HD23 LEU 85 -0.391 -5.117 -2.838 672 H ARG 86 H ARG 86 3.346 -7.876 -2.621 673 HA ARG 86 HA ARG 86 1.546 -9.974 -1.913 674 HB2 ARG 86 HB2 ARG 86 3.581 -9.481 -3.950 675 HB3 ARG 86 HB3 ARG 86 3.532 -11.177 -3.468 676 HG2 ARG 86 HG2 ARG 86 1.015 -9.664 -4.163 677 HG3 ARG 86 HG3 ARG 86 2.021 -10.386 -5.425 678 HD2 ARG 86 HD2 ARG 86 0.813 -11.906 -3.087 679 HD3 ARG 86 HD3 ARG 86 0.094 -11.820 -4.709 680 HE ARG 86 HE ARG 86 2.500 -13.318 -3.885 681 HH11 ARG 86 HH11 ARG 86 0.575 -12.182 -6.627 682 HH12 ARG 86 HH12 ARG 86 1.288 -13.336 -7.720 683 HH21 ARG 86 HH21 ARG 86 3.363 -14.755 -5.346 684 HH22 ARG 86 HH22 ARG 86 2.833 -14.763 -7.006 685 H TYR 87 H TYR 87 5.059 -9.587 -1.215 686 HA TYR 87 HA TYR 87 5.317 -12.242 -0.161 687 HB2 TYR 87 HB2 TYR 87 6.886 -9.747 0.583 688 HB3 TYR 87 HB3 TYR 87 7.362 -11.415 0.919 689 HD1 TYR 87 HD2 TYR 87 6.823 -12.821 -1.639 690 HD2 TYR 87 HD1 TYR 87 8.452 -8.893 -0.953 691 HE1 TYR 87 HE2 TYR 87 7.971 -12.900 -3.853 692 HE2 TYR 87 HE1 TYR 87 9.590 -8.987 -3.173 693 HH TYR 87 HH TYR 87 9.335 -11.812 -5.332 694 H ASP 88 H ASP 88 4.694 -9.091 1.492 695 HA ASP 88 HA ASP 88 4.558 -10.226 4.112 696 HB2 ASP 88 HB2 ASP 88 3.258 -7.754 2.900 697 HB3 ASP 88 HB3 ASP 88 3.109 -8.190 4.610 698 H LEU 89 H LEU 89 1.982 -9.518 1.715 699 HA LEU 89 HA LEU 89 -0.125 -10.277 3.474 700 HB2 LEU 89 HB2 LEU 89 -0.222 -8.811 1.457 701 HB3 LEU 89 HB3 LEU 89 -0.117 -10.237 0.444 702 HG LEU 89 HG LEU 89 -2.320 -10.902 0.954 703 HD11 LEU 89 HD11 LEU 89 -2.419 -10.700 3.361 704 HD12 LEU 89 HD12 LEU 89 -3.723 -9.713 2.679 705 HD13 LEU 89 HD13 LEU 89 -2.241 -8.931 3.271 706 HD21 LEU 89 HD21 LEU 89 -3.618 -8.906 0.378 707 HD22 LEU 89 HD22 LEU 89 -2.068 -8.871 -0.486 708 HD23 LEU 89 HD23 LEU 89 -2.306 -7.850 0.948 709 H LYS 90 H LYS 90 1.790 -12.242 1.190 710 HA LYS 90 HA LYS 90 0.008 -14.537 1.427 711 HB2 LYS 90 HB2 LYS 90 2.910 -14.287 0.594 712 HB3 LYS 90 HB3 LYS 90 2.048 -15.825 0.627 713 HG2 LYS 90 HG2 LYS 90 1.240 -13.417 -1.061 714 HG3 LYS 90 HG3 LYS 90 2.155 -14.803 -1.654 715 HD2 LYS 90 HD2 LYS 90 -0.689 -14.914 -0.554 716 HD3 LYS 90 HD3 LYS 90 -0.253 -14.854 -2.265 717 HE2 LYS 90 HE2 LYS 90 1.056 -16.987 -1.943 718 HE3 LYS 90 HE3 LYS 90 0.389 -17.077 -0.297 719 HZ1 LYS 90 HZ1 LYS 90 -1.123 -17.142 -2.845 720 HZ2 LYS 90 HZ2 LYS 90 -1.858 -16.954 -1.384 721 HZ3 LYS 90 HZ3 LYS 90 -1.018 -18.342 -1.719 722 H THR 91 H THR 91 2.378 -13.113 3.531 723 HA THR 91 HA THR 91 2.741 -15.559 5.098 724 HB THR 91 HB THR 91 3.313 -12.667 5.900 725 HG1 THR 91 HG1 THR 91 4.584 -13.013 4.155 726 HG21 THR 91 HG21 THR 91 3.328 -14.243 7.792 727 HG22 THR 91 HG22 THR 91 4.974 -13.710 7.398 728 HG23 THR 91 HG23 THR 91 4.422 -15.321 6.890 729 H VAL 92 H VAL 92 0.743 -12.562 5.275 730 HA VAL 92 HA VAL 92 -0.380 -13.001 7.830 731 HB VAL 92 HB VAL 92 -1.851 -11.809 5.419 732 HG11 VAL 92 HG11 VAL 92 -3.023 -10.469 7.211 733 HG12 VAL 92 HG12 VAL 92 -3.368 -12.200 7.297 734 HG13 VAL 92 HG13 VAL 92 -2.213 -11.465 8.434 735 HG21 VAL 92 HG21 VAL 92 -1.024 -9.638 6.211 736 HG22 VAL 92 HG22 VAL 92 -0.034 -10.476 7.425 737 HG23 VAL 92 HG23 VAL 92 0.289 -10.696 5.700 738 H ILE 93 H ILE 93 -1.503 -14.196 4.647 739 HA ILE 93 HA ILE 93 -3.988 -15.162 5.631 740 HB ILE 93 HB ILE 93 -4.088 -16.528 3.597 741 HG12 ILE 93 HG12 ILE 93 -1.344 -15.507 2.887 742 HG13 ILE 93 HG13 ILE 93 -1.606 -17.084 3.622 743 HG21 ILE 93 HG21 ILE 93 -4.585 -13.993 3.596 744 HG22 ILE 93 HG22 ILE 93 -2.969 -13.753 2.906 745 HG23 ILE 93 HG23 ILE 93 -4.192 -14.671 2.008 746 HD11 ILE 93 HD11 ILE 93 -3.128 -17.646 1.694 747 HD12 ILE 93 HD12 ILE 93 -2.562 -16.143 0.926 748 HD13 ILE 93 HD13 ILE 93 -1.407 -17.438 1.296 749 H SER 94 H SER 94 -0.903 -16.445 6.166 750 HA SER 94 HA SER 94 -1.802 -19.218 6.332 751 HB2 SER 94 HB2 SER 94 0.801 -17.881 7.070 752 HB3 SER 94 HB3 SER 94 0.513 -19.637 7.030 753 HG SER 94 HG SER 94 0.956 -17.871 4.971 754 H ALA 95 H ALA 95 -2.040 -16.539 8.387 755 HA ALA 95 HA ALA 95 -1.645 -17.948 10.898 756 HB1 ALA 95 HB1 ALA 95 -2.592 -15.910 11.895 757 HB2 ALA 95 HB2 ALA 95 -1.378 -15.501 10.668 758 HB3 ALA 95 HB3 ALA 95 -3.104 -15.341 10.287 759 H LYS 96 H LYS 96 -4.153 -18.111 8.596 760 HA LYS 96 HA LYS 96 -6.044 -19.163 10.659 761 HB2 LYS 96 HB2 LYS 96 -6.299 -16.690 9.153 762 HB3 LYS 96 HB3 LYS 96 -7.572 -17.819 8.677 763 HG2 LYS 96 HG2 LYS 96 -8.657 -16.906 10.429 764 HG3 LYS 96 HG3 LYS 96 -7.745 -18.102 11.351 765 HD2 LYS 96 HD2 LYS 96 -5.972 -16.320 11.704 766 HD3 LYS 96 HD3 LYS 96 -7.110 -15.158 10.990 767 HE2 LYS 96 HE2 LYS 96 -7.570 -16.885 13.460 768 HE3 LYS 96 HE3 LYS 96 -7.280 -15.135 13.445 769 HZ1 LYS 96 HZ1 LYS 96 -9.627 -16.469 12.190 770 HZ2 LYS 96 HZ2 LYS 96 -9.375 -14.842 12.279 771 HZ3 LYS 96 HZ3 LYS 96 -9.650 -15.707 13.654 772 HA PRO 97 HA PRO 97 -6.670 -22.248 7.630 773 HB2 PRO 97 HB2 PRO 97 -9.391 -22.625 7.354 774 HB3 PRO 97 HB3 PRO 97 -8.447 -23.221 8.757 775 HG2 PRO 97 HG2 PRO 97 -10.063 -20.717 8.499 776 HG3 PRO 97 HG3 PRO 97 -10.077 -21.944 9.800 777 HD2 PRO 97 HD2 PRO 97 -8.706 -19.659 10.063 778 HD3 PRO 97 HD3 PRO 97 -8.027 -21.207 10.672 779 H LYS 98 H LYS 98 -6.886 -22.442 5.427 780 HA LYS 98 HA LYS 98 -6.728 -19.908 4.142 781 HB2 LYS 98 HB2 LYS 98 -6.802 -22.691 2.932 782 HB3 LYS 98 HB3 LYS 98 -6.256 -21.225 2.107 783 HG2 LYS 98 HG2 LYS 98 -4.952 -22.365 4.621 784 HG3 LYS 98 HG3 LYS 98 -4.392 -22.685 2.975 785 HD2 LYS 98 HD2 LYS 98 -3.781 -20.393 2.623 786 HD3 LYS 98 HD3 LYS 98 -4.646 -19.858 4.074 787 HE2 LYS 98 HE2 LYS 98 -2.247 -19.885 4.475 788 HE3 LYS 98 HE3 LYS 98 -3.092 -21.035 5.520 789 HZ1 LYS 98 HZ1 LYS 98 -1.061 -21.960 4.623 790 HZ2 LYS 98 HZ2 LYS 98 -1.581 -21.744 3.073 791 HZ3 LYS 98 HZ3 LYS 98 -2.357 -22.813 4.063 792 H ASP 99 H ASP 99 -9.464 -22.037 4.479 793 HA ASP 99 HA ASP 99 -10.791 -21.256 2.078 794 HB2 ASP 99 HB2 ASP 99 -11.303 -23.240 3.568 795 HB3 ASP 99 HB3 ASP 99 -12.125 -22.109 4.656 796 H GLU 100 H GLU 100 -11.253 -20.030 5.472 797 HA GLU 100 HA GLU 100 -13.123 -17.999 4.673 798 HB2 GLU 100 HB2 GLU 100 -12.678 -16.953 6.838 799 HB3 GLU 100 HB3 GLU 100 -12.839 -18.698 7.056 800 HG2 GLU 100 HG2 GLU 100 -10.486 -18.968 7.417 801 HG3 GLU 100 HG3 GLU 100 -10.122 -17.362 6.806 802 H LYS 101 H LYS 101 -9.662 -18.264 4.578 803 HA LYS 101 HA LYS 101 -9.327 -15.392 4.369 804 HB2 LYS 101 HB2 LYS 101 -7.853 -17.230 5.538 805 HB3 LYS 101 HB3 LYS 101 -7.104 -17.350 3.947 806 HG2 LYS 101 HG2 LYS 101 -5.909 -15.825 5.388 807 HG3 LYS 101 HG3 LYS 101 -6.584 -15.016 3.969 808 HD2 LYS 101 HD2 LYS 101 -6.774 -13.621 6.056 809 HD3 LYS 101 HD3 LYS 101 -8.333 -13.960 5.312 810 HE2 LYS 101 HE2 LYS 101 -8.508 -15.931 6.993 811 HE3 LYS 101 HE3 LYS 101 -7.175 -15.142 7.849 812 HZ1 LYS 101 HZ1 LYS 101 -8.544 -13.265 8.247 813 HZ2 LYS 101 HZ2 LYS 101 -9.521 -14.573 8.552 814 HZ3 LYS 101 HZ3 LYS 101 -9.682 -13.732 7.146 815 H LYS 102 H LYS 102 -9.856 -17.888 2.235 816 HA LYS 102 HA LYS 102 -8.602 -16.989 -0.142 817 HB2 LYS 102 HB2 LYS 102 -10.392 -18.975 0.554 818 HB3 LYS 102 HB3 LYS 102 -11.396 -17.918 -0.434 819 HG2 LYS 102 HG2 LYS 102 -8.739 -19.133 -1.296 820 HG3 LYS 102 HG3 LYS 102 -10.339 -19.787 -1.683 821 HD2 LYS 102 HD2 LYS 102 -10.871 -17.577 -2.810 822 HD3 LYS 102 HD3 LYS 102 -9.157 -17.149 -2.612 823 HE2 LYS 102 HE2 LYS 102 -8.537 -19.233 -3.856 824 HE3 LYS 102 HE3 LYS 102 -10.263 -19.572 -4.095 825 HZ1 LYS 102 HZ1 LYS 102 -10.365 -17.344 -5.227 826 HZ2 LYS 102 HZ2 LYS 102 -9.500 -18.500 -6.035 827 HZ3 LYS 102 HZ3 LYS 102 -8.722 -17.308 -5.204 828 H SER 103 H SER 103 -11.450 -15.806 1.646 829 HA SER 103 HA SER 103 -12.470 -14.024 -0.314 830 HB2 SER 103 HB2 SER 103 -13.601 -14.522 1.823 831 HB3 SER 103 HB3 SER 103 -12.313 -13.680 2.707 832 HG SER 103 HG SER 103 -14.260 -12.607 0.959 833 H LEU 104 H LEU 104 -9.766 -13.556 2.007 834 HA LEU 104 HA LEU 104 -9.345 -10.787 1.228 835 HB2 LEU 104 HB2 LEU 104 -8.486 -12.407 3.288 836 HB3 LEU 104 HB3 LEU 104 -7.036 -12.307 2.293 837 HG LEU 104 HG LEU 104 -8.579 -9.925 3.386 838 HD11 LEU 104 HD11 LEU 104 -7.529 -11.251 5.170 839 HD12 LEU 104 HD12 LEU 104 -6.711 -9.692 4.969 840 HD13 LEU 104 HD13 LEU 104 -5.964 -11.174 4.323 841 HD21 LEU 104 HD21 LEU 104 -7.376 -9.259 1.393 842 HD22 LEU 104 HD22 LEU 104 -5.903 -10.085 1.948 843 HD23 LEU 104 HD23 LEU 104 -6.503 -8.648 2.809 844 H GLN 105 H GLN 105 -8.181 -13.968 0.182 845 HA GLN 105 HA GLN 105 -6.067 -12.937 -1.486 846 HB2 GLN 105 HB2 GLN 105 -7.518 -15.585 -1.464 847 HB3 GLN 105 HB3 GLN 105 -6.197 -15.215 -2.573 848 HG2 GLN 105 HG2 GLN 105 -5.881 -14.961 0.427 849 HG3 GLN 105 HG3 GLN 105 -5.613 -16.487 -0.427 850 HE21 GLN 105 HE21 GLN 105 -4.465 -13.163 -0.028 851 HE22 GLN 105 HE22 GLN 105 -2.885 -13.446 -0.709 852 H GLU 106 H GLU 106 -9.543 -13.258 -1.960 853 HA GLU 106 HA GLU 106 -9.519 -13.080 -4.834 854 HB2 GLU 106 HB2 GLU 106 -11.505 -12.101 -2.745 855 HB3 GLU 106 HB3 GLU 106 -11.766 -11.914 -4.474 856 HG2 GLU 106 HG2 GLU 106 -11.455 -14.537 -3.004 857 HG3 GLU 106 HG3 GLU 106 -12.963 -13.846 -3.621 858 H LEU 107 H LEU 107 -9.633 -10.596 -2.230 859 HA LEU 107 HA LEU 107 -9.501 -8.393 -4.080 860 HB2 LEU 107 HB2 LEU 107 -8.603 -8.547 -1.192 861 HB3 LEU 107 HB3 LEU 107 -8.778 -7.082 -2.145 862 HG LEU 107 HG LEU 107 -10.976 -8.869 -1.120 863 HD11 LEU 107 HD11 LEU 107 -11.527 -6.771 0.037 864 HD12 LEU 107 HD12 LEU 107 -10.102 -6.009 -0.692 865 HD13 LEU 107 HD13 LEU 107 -9.899 -7.366 0.439 866 HD21 LEU 107 HD21 LEU 107 -11.717 -8.132 -3.330 867 HD22 LEU 107 HD22 LEU 107 -11.159 -6.472 -3.008 868 HD23 LEU 107 HD23 LEU 107 -12.535 -7.143 -2.103 869 H THR 108 H THR 108 -7.065 -10.328 -2.372 870 HA THR 108 HA THR 108 -4.804 -8.710 -2.968 871 HB THR 108 HB THR 108 -4.893 -11.775 -2.851 872 HG1 THR 108 HG1 THR 108 -5.752 -10.549 -0.988 873 HG21 THR 108 HG21 THR 108 -2.761 -11.054 -3.713 874 HG22 THR 108 HG22 THR 108 -2.536 -11.442 -1.991 875 HG23 THR 108 HG23 THR 108 -2.653 -9.746 -2.512 876 H SER 109 H SER 109 -6.554 -11.154 -4.913 877 HA SER 109 HA SER 109 -4.649 -10.963 -7.098 878 HB2 SER 109 HB2 SER 109 -7.521 -11.981 -7.127 879 HB3 SER 109 HB3 SER 109 -6.244 -12.345 -8.308 880 HG SER 109 HG SER 109 -6.426 -13.125 -5.577 881 H LYS 110 H LYS 110 -7.892 -9.553 -6.410 882 HA LYS 110 HA LYS 110 -8.221 -8.333 -8.987 883 HB2 LYS 110 HB2 LYS 110 -9.429 -7.773 -6.274 884 HB3 LYS 110 HB3 LYS 110 -9.925 -6.913 -7.742 885 HG2 LYS 110 HG2 LYS 110 -10.665 -8.942 -8.783 886 HG3 LYS 110 HG3 LYS 110 -9.960 -9.927 -7.495 887 HD2 LYS 110 HD2 LYS 110 -11.516 -8.897 -5.870 888 HD3 LYS 110 HD3 LYS 110 -12.286 -8.015 -7.213 889 HE2 LYS 110 HE2 LYS 110 -12.745 -10.173 -8.336 890 HE3 LYS 110 HE3 LYS 110 -11.995 -11.036 -6.980 891 HZ1 LYS 110 HZ1 LYS 110 -13.715 -10.114 -5.536 892 HZ2 LYS 110 HZ2 LYS 110 -14.385 -10.997 -6.755 893 HZ3 LYS 110 HZ3 LYS 110 -14.427 -9.347 -6.812 894 H LEU 111 H LEU 111 -6.749 -7.144 -5.988 895 HA LEU 111 HA LEU 111 -6.467 -4.409 -6.725 896 HB2 LEU 111 HB2 LEU 111 -6.082 -5.542 -4.500 897 HB3 LEU 111 HB3 LEU 111 -4.570 -6.162 -5.110 898 HG LEU 111 HG LEU 111 -5.155 -3.205 -4.768 899 HD11 LEU 111 HD11 LEU 111 -3.907 -5.243 -2.877 900 HD12 LEU 111 HD12 LEU 111 -5.412 -4.319 -2.635 901 HD13 LEU 111 HD13 LEU 111 -3.851 -3.483 -2.639 902 HD21 LEU 111 HD21 LEU 111 -3.252 -3.586 -6.218 903 HD22 LEU 111 HD22 LEU 111 -2.551 -4.738 -5.060 904 HD23 LEU 111 HD23 LEU 111 -2.688 -3.015 -4.643 905 H PHE 112 H PHE 112 -4.529 -7.314 -7.387 906 HA PHE 112 HA PHE 112 -2.465 -5.814 -8.751 907 HB2 PHE 112 HB2 PHE 112 -3.038 -8.741 -8.356 908 HB3 PHE 112 HB3 PHE 112 -1.753 -8.183 -9.437 909 HD1 PHE 112 HD1 PHE 112 -2.937 -7.247 -5.960 910 HD2 PHE 112 HD2 PHE 112 0.374 -8.248 -8.511 911 HE1 PHE 112 HE1 PHE 112 -1.413 -6.945 -4.057 912 HE2 PHE 112 HE2 PHE 112 1.922 -7.955 -6.580 913 HZ PHE 112 HZ PHE 112 1.008 -7.287 -4.347 914 H SER 113 H SER 113 -5.500 -7.301 -9.726 915 HA SER 113 HA SER 113 -4.907 -7.347 -12.550 916 HB2 SER 113 HB2 SER 113 -7.595 -6.891 -11.192 917 HB3 SER 113 HB3 SER 113 -7.322 -7.441 -12.856 918 HG SER 113 HG SER 113 -6.190 -9.267 -11.850 919 H SER 114 H SER 114 -6.177 -4.871 -10.282 920 HA SER 114 HA SER 114 -6.613 -2.900 -12.352 921 HB2 SER 114 HB2 SER 114 -6.114 -2.543 -9.368 922 HB3 SER 114 HB3 SER 114 -6.713 -1.291 -10.475 923 HG SER 114 HG SER 114 -8.539 -2.600 -10.862 924 H ILE 115 H ILE 115 -3.855 -3.823 -10.316 925 HA ILE 115 HA ILE 115 -2.169 -1.602 -10.972 926 HB ILE 115 HB ILE 115 -1.723 -4.401 -9.938 927 HG12 ILE 115 HG12 ILE 115 -1.033 -1.642 -8.905 928 HG13 ILE 115 HG13 ILE 115 -2.464 -2.567 -8.473 929 HG21 ILE 115 HG21 ILE 115 0.791 -3.885 -9.796 930 HG22 ILE 115 HG22 ILE 115 0.171 -4.297 -11.399 931 HG23 ILE 115 HG23 ILE 115 0.488 -2.605 -10.986 932 HD11 ILE 115 HD11 ILE 115 -0.933 -2.791 -6.673 933 HD12 ILE 115 HD12 ILE 115 -0.906 -4.347 -7.533 934 HD13 ILE 115 HD13 ILE 115 0.412 -3.168 -7.757 935 H ASP 116 H ASP 116 -2.560 -4.837 -12.500 936 HA ASP 116 HA ASP 116 -0.483 -4.438 -14.419 937 HB2 ASP 116 HB2 ASP 116 -1.599 -6.617 -13.810 938 HB3 ASP 116 HB3 ASP 116 -3.015 -6.092 -14.735 939 H ASN 117 H ASN 117 -3.983 -3.721 -14.478 940 HA ASN 117 HA ASN 117 -4.002 -2.811 -17.199 941 HB2 ASN 117 HB2 ASN 117 -5.903 -3.339 -15.340 942 HB3 ASN 117 HB3 ASN 117 -5.889 -1.574 -15.253 943 HD21 ASN 117 HD21 ASN 117 -7.942 -3.427 -16.228 944 HD22 ASN 117 HD22 ASN 117 -8.238 -2.973 -17.889 945 H LEU 118 H LEU 118 -3.354 -1.180 -14.102 946 HA LEU 118 HA LEU 118 -3.363 1.507 -15.070 947 HB2 LEU 118 HB2 LEU 118 -3.313 0.554 -12.680 948 HB3 LEU 118 HB3 LEU 118 -1.595 0.358 -12.890 949 HG LEU 118 HG LEU 118 -3.106 2.975 -12.789 950 HD11 LEU 118 HD11 LEU 118 -1.238 1.591 -10.815 951 HD12 LEU 118 HD12 LEU 118 -3.007 1.687 -10.675 952 HD13 LEU 118 HD13 LEU 118 -2.027 3.165 -10.579 953 HD21 LEU 118 HD21 LEU 118 -0.848 4.012 -12.499 954 HD22 LEU 118 HD22 LEU 118 -1.136 3.369 -14.123 955 HD23 LEU 118 HD23 LEU 118 -0.119 2.462 -12.987 956 H ASP 119 H ASP 119 -0.772 -0.945 -14.769 957 HA ASP 119 HA ASP 119 1.264 0.865 -15.712 958 HB2 ASP 119 HB2 ASP 119 2.566 -0.702 -14.837 959 HB3 ASP 119 HB3 ASP 119 1.114 -1.649 -14.488 960 H HIS 120 H HIS 120 -0.729 -1.647 -17.320 961 HA HIS 120 HA HIS 120 0.559 -1.312 -19.879 962 HB2 HIS 120 HB2 HIS 120 -2.164 -2.317 -19.044 963 HB3 HIS 120 HB3 HIS 120 -1.737 -2.113 -20.747 964 HD1 HIS 120 HD1 HIS 120 -1.045 -4.343 -17.796 965 HD2 HIS 120 HD2 HIS 120 0.220 -3.848 -21.739 966 HE1 HIS 120 HE1 HIS 120 0.231 -6.427 -18.424 967 H ALA 121 H ALA 121 -2.184 0.414 -18.325 968 HA ALA 121 HA ALA 121 -2.827 2.032 -20.603 969 HB1 ALA 121 HB1 ALA 121 -3.846 3.544 -18.924 970 HB2 ALA 121 HB2 ALA 121 -4.318 1.842 -18.703 971 HB3 ALA 121 HB3 ALA 121 -3.104 2.574 -17.631 972 H ALA 122 H ALA 122 -0.383 2.323 -18.037 973 HA ALA 122 HA ALA 122 0.450 4.985 -18.776 974 HB1 ALA 122 HB1 ALA 122 2.405 4.511 -17.416 975 HB2 ALA 122 HB2 ALA 122 0.959 3.872 -16.597 976 HB3 ALA 122 HB3 ALA 122 2.059 2.770 -17.456 977 H LYS 123 H LYS 123 1.524 1.673 -19.687 978 HA LYS 123 HA LYS 123 3.723 2.583 -21.293 979 HB2 LYS 123 HB2 LYS 123 2.066 0.044 -21.248 980 HB3 LYS 123 HB3 LYS 123 3.380 0.268 -22.406 981 HG2 LYS 123 HG2 LYS 123 3.773 0.507 -19.413 982 HG3 LYS 123 HG3 LYS 123 3.957 -1.010 -20.314 983 HD2 LYS 123 HD2 LYS 123 5.654 0.098 -21.775 984 HD3 LYS 123 HD3 LYS 123 5.555 1.548 -20.744 985 HE2 LYS 123 HE2 LYS 123 6.219 0.252 -18.806 986 HE3 LYS 123 HE3 LYS 123 6.187 -1.234 -19.761 987 HZ1 LYS 123 HZ1 LYS 123 8.082 0.989 -20.139 988 HZ2 LYS 123 HZ2 LYS 123 8.020 -0.377 -21.063 989 HZ3 LYS 123 HZ3 LYS 123 8.410 -0.485 -19.464 990 H ILE 124 H ILE 124 0.285 2.150 -22.004 991 HA ILE 124 HA ILE 124 0.765 2.582 -24.871 992 HB ILE 124 HB ILE 124 -1.127 1.126 -23.723 993 HG12 ILE 124 HG12 ILE 124 -2.632 1.624 -25.740 994 HG13 ILE 124 HG13 ILE 124 -1.437 2.840 -26.201 995 HG21 ILE 124 HG21 ILE 124 -2.128 3.015 -22.444 996 HG22 ILE 124 HG22 ILE 124 -2.586 3.791 -23.973 997 HG23 ILE 124 HG23 ILE 124 -3.284 2.221 -23.515 998 HD11 ILE 124 HD11 ILE 124 0.305 1.093 -26.368 999 HD12 ILE 124 HD12 ILE 124 -0.857 -0.134 -25.812 1000 HD13 ILE 124 HD13 ILE 124 -1.096 0.673 -27.378 1001 H LYS 125 H LYS 125 0.977 4.501 -22.303 1002 HA LYS 125 HA LYS 125 1.250 6.722 -22.021 1003 HB2 LYS 125 HB2 LYS 125 0.867 6.975 -25.015 1004 HB3 LYS 125 HB3 LYS 125 1.580 8.181 -23.947 1005 HG2 LYS 125 HG2 LYS 125 3.562 6.966 -23.670 1006 HG3 LYS 125 HG3 LYS 125 2.811 5.430 -24.108 1007 HD2 LYS 125 HD2 LYS 125 4.224 6.095 -25.927 1008 HD3 LYS 125 HD3 LYS 125 2.533 6.245 -26.440 1009 HE2 LYS 125 HE2 LYS 125 2.632 8.696 -25.963 1010 HE3 LYS 125 HE3 LYS 125 4.348 8.519 -25.532 1011 HZ1 LYS 125 HZ1 LYS 125 4.069 9.218 -27.835 1012 HZ2 LYS 125 HZ2 LYS 125 3.159 7.885 -28.177 1013 HZ3 LYS 125 HZ3 LYS 125 4.753 7.717 -27.789 1014 H SER 126 H SER 126 -1.418 5.595 -21.811 1015 HA SER 126 HA SER 126 -3.059 8.038 -22.380 1016 HB2 SER 126 HB2 SER 126 -3.866 5.208 -21.609 1017 HB3 SER 126 HB3 SER 126 -4.986 6.570 -21.847 1018 HG SER 126 HG SER 126 -4.713 5.219 -23.721 1019 HA PRO 127 HA PRO 127 -1.872 8.099 -17.985 1020 HB2 PRO 127 HB2 PRO 127 -2.041 10.788 -17.485 1021 HB3 PRO 127 HB3 PRO 127 -0.625 10.033 -18.285 1022 HG2 PRO 127 HG2 PRO 127 -2.995 11.392 -19.548 1023 HG3 PRO 127 HG3 PRO 127 -1.246 11.673 -19.836 1024 HD2 PRO 127 HD2 PRO 127 -2.688 10.093 -21.473 1025 HD3 PRO 127 HD3 PRO 127 -1.004 9.658 -21.022 1026 H THR 128 H THR 128 -4.680 9.742 -19.463 1027 HA THR 128 HA THR 128 -6.126 10.097 -17.031 1028 HB THR 128 HB THR 128 -7.338 9.585 -19.776 1029 HG1 THR 128 HG1 THR 128 -6.323 12.029 -18.725 1030 HG21 THR 128 HG21 THR 128 -8.940 9.843 -17.915 1031 HG22 THR 128 HG22 THR 128 -8.990 11.257 -18.990 1032 HG23 THR 128 HG23 THR 128 -8.144 11.358 -17.428 1033 H GLU 129 H GLU 129 -5.870 7.373 -19.326 1034 HA GLU 129 HA GLU 129 -7.925 5.820 -18.028 1035 HB2 GLU 129 HB2 GLU 129 -6.442 5.649 -20.375 1036 HB3 GLU 129 HB3 GLU 129 -5.832 4.298 -19.417 1037 HG2 GLU 129 HG2 GLU 129 -7.681 3.572 -20.829 1038 HG3 GLU 129 HG3 GLU 129 -8.134 3.465 -19.120 1039 H ALA 130 H ALA 130 -4.388 6.102 -17.744 1040 HA ALA 130 HA ALA 130 -4.049 3.996 -15.849 1041 HB1 ALA 130 HB1 ALA 130 -2.459 6.576 -16.180 1042 HB2 ALA 130 HB2 ALA 130 -1.927 5.123 -15.309 1043 HB3 ALA 130 HB3 ALA 130 -2.176 5.059 -17.067 1044 H GLU 131 H GLU 131 -5.031 7.425 -15.468 1045 HA GLU 131 HA GLU 131 -4.947 7.413 -12.592 1046 HB2 GLU 131 HB2 GLU 131 -6.489 9.050 -14.610 1047 HB3 GLU 131 HB3 GLU 131 -6.666 9.290 -12.868 1048 HG2 GLU 131 HG2 GLU 131 -4.311 9.784 -12.650 1049 HG3 GLU 131 HG3 GLU 131 -4.048 9.459 -14.362 1050 H LYS 132 H LYS 132 -7.462 6.428 -14.935 1051 HA LYS 132 HA LYS 132 -9.545 6.092 -12.963 1052 HB2 LYS 132 HB2 LYS 132 -9.081 4.663 -15.609 1053 HB3 LYS 132 HB3 LYS 132 -10.563 4.548 -14.659 1054 HG2 LYS 132 HG2 LYS 132 -11.074 6.874 -15.029 1055 HG3 LYS 132 HG3 LYS 132 -9.477 7.164 -15.724 1056 HD2 LYS 132 HD2 LYS 132 -10.033 5.494 -17.522 1057 HD3 LYS 132 HD3 LYS 132 -11.698 5.486 -16.914 1058 HE2 LYS 132 HE2 LYS 132 -11.864 7.913 -17.338 1059 HE3 LYS 132 HE3 LYS 132 -10.169 7.942 -17.871 1060 HZ1 LYS 132 HZ1 LYS 132 -12.340 6.424 -19.202 1061 HZ2 LYS 132 HZ2 LYS 132 -10.762 6.442 -19.678 1062 HZ3 LYS 132 HZ3 LYS 132 -11.664 7.824 -19.761 1063 H TYR 133 H TYR 133 -7.055 3.891 -14.314 1064 HA TYR 133 HA TYR 133 -7.927 1.667 -12.686 1065 HB2 TYR 133 HB2 TYR 133 -5.287 2.171 -14.076 1066 HB3 TYR 133 HB3 TYR 133 -5.803 0.627 -13.377 1067 HD1 TYR 133 HD1 TYR 133 -8.520 0.194 -14.204 1068 HD2 TYR 133 HD2 TYR 133 -5.355 2.089 -16.417 1069 HE1 TYR 133 HE1 TYR 133 -9.697 -0.319 -16.341 1070 HE2 TYR 133 HE2 TYR 133 -6.541 1.560 -18.547 1071 HH TYR 133 HH TYR 133 -9.665 -0.136 -18.624 1072 H TYR 134 H TYR 134 -5.589 4.309 -12.210 1073 HA TYR 134 HA TYR 134 -4.416 3.288 -9.802 1074 HB2 TYR 134 HB2 TYR 134 -3.401 5.223 -10.846 1075 HB3 TYR 134 HB3 TYR 134 -4.921 6.114 -10.787 1076 HD1 TYR 134 HD1 TYR 134 -2.180 4.738 -8.650 1077 HD2 TYR 134 HD2 TYR 134 -5.580 7.373 -8.867 1078 HE1 TYR 134 HE1 TYR 134 -1.565 5.727 -6.444 1079 HE2 TYR 134 HE2 TYR 134 -4.954 8.354 -6.663 1080 HH TYR 134 HH TYR 134 -2.058 7.340 -4.862 1081 H GLY 135 H GLY 135 -7.393 5.240 -10.406 1082 HA2 GLY 135 HA2 GLY 135 -8.114 5.483 -7.667 1083 HA3 GLY 135 HA3 GLY 135 -9.234 5.527 -9.039 1084 H GLN 136 H GLN 136 -8.855 2.893 -10.034 1085 HA GLN 136 HA GLN 136 -10.549 1.380 -8.270 1086 HB2 GLN 136 HB2 GLN 136 -8.764 0.530 -10.578 1087 HB3 GLN 136 HB3 GLN 136 -9.921 -0.538 -9.782 1088 HG2 GLN 136 HG2 GLN 136 -11.780 0.742 -10.556 1089 HG3 GLN 136 HG3 GLN 136 -10.738 2.066 -11.085 1090 HE21 GLN 136 HE21 GLN 136 -11.483 2.015 -13.196 1091 HE22 GLN 136 HE22 GLN 136 -11.048 0.726 -14.294 1092 H THR 137 H THR 137 -7.033 1.471 -8.807 1093 HA THR 137 HA THR 137 -6.429 -0.803 -7.166 1094 HB THR 137 HB THR 137 -4.629 1.605 -7.733 1095 HG1 THR 137 HG1 THR 137 -5.399 0.720 -9.683 1096 HG21 THR 137 HG21 THR 137 -2.830 -0.048 -7.523 1097 HG22 THR 137 HG22 THR 137 -4.021 -1.313 -7.151 1098 HG23 THR 137 HG23 THR 137 -3.779 0.041 -6.027 1099 H VAL 138 H VAL 138 -6.661 2.729 -6.487 1100 HA VAL 138 HA VAL 138 -5.860 2.626 -3.751 1101 HB VAL 138 HB VAL 138 -7.873 4.467 -5.155 1102 HG11 VAL 138 HG11 VAL 138 -6.650 4.702 -2.372 1103 HG12 VAL 138 HG12 VAL 138 -7.474 6.033 -3.219 1104 HG13 VAL 138 HG13 VAL 138 -8.375 4.570 -2.784 1105 HG21 VAL 138 HG21 VAL 138 -5.042 5.136 -4.284 1106 HG22 VAL 138 HG22 VAL 138 -5.406 4.501 -5.890 1107 HG23 VAL 138 HG23 VAL 138 -6.103 6.043 -5.373 1108 H SER 139 H SER 139 -9.124 2.200 -5.250 1109 HA SER 139 HA SER 139 -10.494 1.882 -2.766 1110 HB2 SER 139 HB2 SER 139 -11.140 0.640 -5.468 1111 HB3 SER 139 HB3 SER 139 -12.268 0.841 -4.110 1112 HG SER 139 HG SER 139 -12.003 3.094 -4.319 1113 H ASN 140 H ASN 140 -8.909 -0.516 -4.906 1114 HA ASN 140 HA ASN 140 -9.720 -2.804 -3.354 1115 HB2 ASN 140 HB2 ASN 140 -7.619 -2.236 -5.426 1116 HB3 ASN 140 HB3 ASN 140 -7.480 -3.700 -4.446 1117 HD21 ASN 140 HD21 ASN 140 -9.271 -2.090 -6.941 1118 HD22 ASN 140 HD22 ASN 140 -10.250 -3.472 -7.374 1119 H ILE 141 H ILE 141 -6.863 -0.634 -3.205 1120 HA ILE 141 HA ILE 141 -5.466 -2.149 -1.199 1121 HB ILE 141 HB ILE 141 -5.375 0.830 -1.920 1122 HG12 ILE 141 HG12 ILE 141 -3.230 -1.280 -2.295 1123 HG13 ILE 141 HG13 ILE 141 -4.506 -1.057 -3.488 1124 HG21 ILE 141 HG21 ILE 141 -3.209 0.864 -0.566 1125 HG22 ILE 141 HG22 ILE 141 -4.679 0.711 0.413 1126 HG23 ILE 141 HG23 ILE 141 -3.673 -0.715 0.090 1127 HD11 ILE 141 HD11 ILE 141 -2.487 1.037 -2.635 1128 HD12 ILE 141 HD12 ILE 141 -2.525 0.142 -4.164 1129 HD13 ILE 141 HD13 ILE 141 -3.817 1.297 -3.790 1130 H ASN 142 H ASN 142 -7.849 0.542 -1.000 1131 HA ASN 142 HA ASN 142 -7.822 0.765 1.828 1132 HB2 ASN 142 HB2 ASN 142 -8.941 2.350 0.277 1133 HB3 ASN 142 HB3 ASN 142 -10.176 1.130 -0.063 1134 HD21 ASN 142 HD21 ASN 142 -9.022 3.493 2.182 1135 HD22 ASN 142 HD22 ASN 142 -10.356 3.363 3.302 1136 H GLU 143 H GLU 143 -9.832 -1.359 -0.282 1137 HA GLU 143 HA GLU 143 -11.278 -2.494 1.900 1138 HB2 GLU 143 HB2 GLU 143 -10.696 -3.333 -0.932 1139 HB3 GLU 143 HB3 GLU 143 -11.386 -4.484 0.200 1140 HG2 GLU 143 HG2 GLU 143 -13.133 -2.586 0.642 1141 HG3 GLU 143 HG3 GLU 143 -12.635 -2.075 -0.985 1142 H VAL 144 H VAL 144 -8.208 -3.462 0.370 1143 HA VAL 144 HA VAL 144 -7.996 -5.945 1.845 1144 HB VAL 144 HB VAL 144 -5.950 -4.156 0.435 1145 HG11 VAL 144 HG11 VAL 144 -4.696 -5.181 2.234 1146 HG12 VAL 144 HG12 VAL 144 -5.425 -6.770 1.910 1147 HG13 VAL 144 HG13 VAL 144 -4.309 -6.038 0.732 1148 HG21 VAL 144 HG21 VAL 144 -5.826 -6.066 -1.132 1149 HG22 VAL 144 HG22 VAL 144 -7.008 -6.956 -0.148 1150 HG23 VAL 144 HG23 VAL 144 -7.487 -5.466 -0.991 1151 H LEU 145 H LEU 145 -7.083 -2.545 2.437 1152 HA LEU 145 HA LEU 145 -5.469 -3.046 4.760 1153 HB2 LEU 145 HB2 LEU 145 -6.658 -0.743 3.392 1154 HB3 LEU 145 HB3 LEU 145 -6.671 -0.550 5.135 1155 HG LEU 145 HG LEU 145 -4.252 -0.800 5.236 1156 HD11 LEU 145 HD11 LEU 145 -3.805 -2.325 3.408 1157 HD12 LEU 145 HD12 LEU 145 -2.904 -0.818 3.156 1158 HD13 LEU 145 HD13 LEU 145 -4.385 -1.133 2.229 1159 HD21 LEU 145 HD21 LEU 145 -3.649 1.283 4.076 1160 HD22 LEU 145 HD22 LEU 145 -5.238 1.427 4.858 1161 HD23 LEU 145 HD23 LEU 145 -5.133 1.177 3.099 1162 H ALA 146 H ALA 146 -8.952 -2.397 4.350 1163 HA ALA 146 HA ALA 146 -9.516 -2.286 7.163 1164 HB1 ALA 146 HB1 ALA 146 -11.867 -2.586 6.449 1165 HB2 ALA 146 HB2 ALA 146 -11.037 -1.397 5.415 1166 HB3 ALA 146 HB3 ALA 146 -11.321 -3.050 4.818 1167 H LYS 147 H LYS 147 -9.184 -4.974 4.890 1168 HA LYS 147 HA LYS 147 -10.301 -6.904 6.817 1169 HB2 LYS 147 HB2 LYS 147 -9.009 -7.172 4.112 1170 HB3 LYS 147 HB3 LYS 147 -9.593 -8.553 5.070 1171 HG2 LYS 147 HG2 LYS 147 -11.855 -7.616 5.114 1172 HG3 LYS 147 HG3 LYS 147 -11.293 -6.190 4.231 1173 HD2 LYS 147 HD2 LYS 147 -10.633 -7.679 2.360 1174 HD3 LYS 147 HD3 LYS 147 -11.379 -9.036 3.215 1175 HE2 LYS 147 HE2 LYS 147 -12.931 -8.088 1.550 1176 HE3 LYS 147 HE3 LYS 147 -13.557 -7.848 3.196 1177 HZ1 LYS 147 HZ1 LYS 147 -13.531 -5.879 1.487 1178 HZ2 LYS 147 HZ2 LYS 147 -11.960 -5.713 1.960 1179 HZ3 LYS 147 HZ3 LYS 147 -13.163 -5.591 3.075 1180 H LEU 148 H LEU 148 -7.359 -5.381 6.326 1181 HA LEU 148 HA LEU 148 -5.890 -7.430 7.933 1182 HB2 LEU 148 HB2 LEU 148 -4.947 -4.952 6.448 1183 HB3 LEU 148 HB3 LEU 148 -3.907 -5.984 7.425 1184 HG LEU 148 HG LEU 148 -5.376 -6.913 4.947 1185 HD11 LEU 148 HD11 LEU 148 -3.722 -5.179 4.412 1186 HD12 LEU 148 HD12 LEU 148 -3.147 -6.764 3.866 1187 HD13 LEU 148 HD13 LEU 148 -2.485 -6.042 5.353 1188 HD21 LEU 148 HD21 LEU 148 -3.837 -8.819 5.074 1189 HD22 LEU 148 HD22 LEU 148 -4.836 -8.717 6.528 1190 HD23 LEU 148 HD23 LEU 148 -3.142 -8.172 6.574 1191 H GLY 149 H GLY 149 -8.081 -5.225 8.586 1192 HA2 GLY 149 HA2 GLY 149 -6.829 -3.296 10.257 1193 HA3 GLY 149 HA3 GLY 149 -8.514 -3.823 10.344 Start of MODEL 14 1 H1 GLU 1 H1 GLU 1 10.707 19.627 7.842 2 H2 GLU 1 H2 GLU 1 10.388 20.930 8.803 3 H3 GLU 1 H3 GLU 1 11.115 19.595 9.439 4 HA GLU 1 HA GLU 1 9.179 18.260 9.110 5 HB2 GLU 1 HB2 GLU 1 9.502 19.722 11.167 6 HB3 GLU 1 HB3 GLU 1 8.370 20.862 10.424 7 HG2 GLU 1 HG2 GLU 1 6.673 19.028 10.333 8 HG3 GLU 1 HG3 GLU 1 7.817 17.972 11.174 9 H ALA 2 H ALA 2 8.599 21.689 8.199 10 HA ALA 2 HA ALA 2 7.383 22.667 6.609 11 HB1 ALA 2 HB1 ALA 2 6.782 21.522 4.557 12 HB2 ALA 2 HB2 ALA 2 8.401 21.003 5.073 13 HB3 ALA 2 HB3 ALA 2 6.999 19.934 5.321 14 H ARG 3 H ARG 3 5.661 19.700 7.648 15 HA ARG 3 HA ARG 3 3.438 19.330 8.131 16 HB2 ARG 3 HB2 ARG 3 3.556 22.232 9.005 17 HB3 ARG 3 HB3 ARG 3 2.223 21.119 9.338 18 HG2 ARG 3 HG2 ARG 3 3.807 19.633 10.533 19 HG3 ARG 3 HG3 ARG 3 5.070 20.863 10.309 20 HD2 ARG 3 HD2 ARG 3 3.668 22.507 11.502 21 HD3 ARG 3 HD3 ARG 3 2.420 21.259 11.742 22 HE ARG 3 HE ARG 3 4.871 20.224 12.717 23 HH11 ARG 3 HH11 ARG 3 2.603 22.783 13.615 24 HH12 ARG 3 HH12 ARG 3 3.040 22.682 15.296 25 HH21 ARG 3 HH21 ARG 3 5.377 20.163 14.795 26 HH22 ARG 3 HH22 ARG 3 4.592 21.199 15.968 27 HA PRO 4 HA PRO 4 1.631 21.336 4.402 28 HB2 PRO 4 HB2 PRO 4 0.686 19.043 3.222 29 HB3 PRO 4 HB3 PRO 4 2.339 19.666 2.912 30 HG2 PRO 4 HG2 PRO 4 1.458 17.531 4.846 31 HG3 PRO 4 HG3 PRO 4 2.782 17.480 3.641 32 HD2 PRO 4 HD2 PRO 4 3.256 18.027 6.244 33 HD3 PRO 4 HD3 PRO 4 4.165 18.864 4.937 34 H ILE 5 H ILE 5 -0.676 21.669 4.310 35 HA ILE 5 HA ILE 5 -2.247 20.153 6.335 36 HB ILE 5 HB ILE 5 -3.361 22.274 7.003 37 HG12 ILE 5 HG12 ILE 5 -1.157 23.697 5.464 38 HG13 ILE 5 HG13 ILE 5 -2.813 23.522 4.881 39 HG21 ILE 5 HG21 ILE 5 -1.647 23.040 8.522 40 HG22 ILE 5 HG22 ILE 5 -1.377 21.304 8.270 41 HG23 ILE 5 HG23 ILE 5 -0.351 22.490 7.438 42 HD11 ILE 5 HD11 ILE 5 -3.625 24.782 6.896 43 HD12 ILE 5 HD12 ILE 5 -1.926 25.062 7.352 44 HD13 ILE 5 HD13 ILE 5 -2.562 25.727 5.835 45 H VAL 6 H VAL 6 -4.529 20.255 6.056 46 HA VAL 6 HA VAL 6 -5.379 20.898 3.264 47 HB VAL 6 HB VAL 6 -5.282 18.416 3.876 48 HG11 VAL 6 HG11 VAL 6 -7.622 19.112 5.712 49 HG12 VAL 6 HG12 VAL 6 -7.048 17.482 5.320 50 HG13 VAL 6 HG13 VAL 6 -6.006 18.579 6.237 51 HG21 VAL 6 HG21 VAL 6 -6.707 19.269 2.044 52 HG22 VAL 6 HG22 VAL 6 -7.420 17.854 2.843 53 HG23 VAL 6 HG23 VAL 6 -8.050 19.477 3.191 54 H VAL 7 H VAL 7 -5.570 21.690 6.527 55 HA VAL 7 HA VAL 7 -8.374 22.419 6.599 56 HB VAL 7 HB VAL 7 -7.160 21.649 8.634 57 HG11 VAL 7 HG11 VAL 7 -5.613 24.266 8.429 58 HG12 VAL 7 HG12 VAL 7 -5.612 23.174 9.830 59 HG13 VAL 7 HG13 VAL 7 -4.957 22.621 8.287 60 HG21 VAL 7 HG21 VAL 7 -8.094 24.508 8.970 61 HG22 VAL 7 HG22 VAL 7 -9.177 23.101 8.805 62 HG23 VAL 7 HG23 VAL 7 -8.079 23.225 10.194 63 H GLY 8 H GLY 8 -9.290 24.381 6.268 64 HA2 GLY 8 HA2 GLY 8 -7.813 26.318 4.710 65 HA3 GLY 8 HA3 GLY 8 -9.496 26.443 5.236 66 HA PRO 9 HA PRO 9 -8.162 29.277 8.381 67 HB2 PRO 9 HB2 PRO 9 -8.971 28.396 10.849 68 HB3 PRO 9 HB3 PRO 9 -10.140 28.982 9.621 69 HG2 PRO 9 HG2 PRO 9 -9.301 26.168 10.239 70 HG3 PRO 9 HG3 PRO 9 -10.955 26.857 10.141 71 HD2 PRO 9 HD2 PRO 9 -9.882 25.552 8.058 72 HD3 PRO 9 HD3 PRO 9 -10.865 27.031 7.799 73 HA PRO 10 HA PRO 10 -4.276 27.890 9.699 74 HB2 PRO 10 HB2 PRO 10 -3.726 28.988 12.179 75 HB3 PRO 10 HB3 PRO 10 -3.703 29.924 10.649 76 HG2 PRO 10 HG2 PRO 10 -5.949 29.637 12.641 77 HG3 PRO 10 HG3 PRO 10 -5.235 31.135 11.953 78 HD2 PRO 10 HD2 PRO 10 -7.470 30.128 10.910 79 HD3 PRO 10 HD3 PRO 10 -6.170 30.722 9.816 80 HA PRO 11 HA PRO 11 -5.019 24.241 11.935 81 HB2 PRO 11 HB2 PRO 11 -2.501 23.323 12.535 82 HB3 PRO 11 HB3 PRO 11 -3.153 23.350 10.864 83 HG2 PRO 11 HG2 PRO 11 -1.410 25.383 12.235 84 HG3 PRO 11 HG3 PRO 11 -1.161 24.565 10.657 85 HD2 PRO 11 HD2 PRO 11 -2.242 27.015 10.771 86 HD3 PRO 11 HD3 PRO 11 -2.892 25.788 9.626 87 HA PRO 12 HA PRO 12 -5.021 25.254 16.198 88 HB2 PRO 12 HB2 PRO 12 -5.533 22.877 17.410 89 HB3 PRO 12 HB3 PRO 12 -6.727 23.647 16.316 90 HG2 PRO 12 HG2 PRO 12 -4.695 21.516 15.689 91 HG3 PRO 12 HG3 PRO 12 -6.466 21.506 15.393 92 HD2 PRO 12 HD2 PRO 12 -4.714 22.208 13.459 93 HD3 PRO 12 HD3 PRO 12 -6.298 23.044 13.632 94 H LEU 13 H LEU 13 -4.103 24.709 18.361 95 HA LEU 13 HA LEU 13 -1.267 24.533 18.351 96 HB2 LEU 13 HB2 LEU 13 -2.681 25.538 20.153 97 HB3 LEU 13 HB3 LEU 13 -3.255 23.927 20.572 98 HG LEU 13 HG LEU 13 -0.923 23.297 21.215 99 HD11 LEU 13 HD11 LEU 13 0.725 25.118 21.596 100 HD12 LEU 13 HD12 LEU 13 -0.364 26.265 20.781 101 HD13 LEU 13 HD13 LEU 13 0.358 24.916 19.875 102 HD21 LEU 13 HD21 LEU 13 -0.939 24.569 23.320 103 HD22 LEU 13 HD22 LEU 13 -2.577 24.050 22.872 104 HD23 LEU 13 HD23 LEU 13 -2.079 25.740 22.614 105 H SER 14 H SER 14 0.103 22.854 18.629 106 HA SER 14 HA SER 14 0.952 20.768 18.648 107 HB2 SER 14 HB2 SER 14 -1.674 19.894 19.888 108 HB3 SER 14 HB3 SER 14 -0.149 18.986 19.883 109 HG SER 14 HG SER 14 -0.579 20.254 21.816 110 H GLY 15 H GLY 15 -1.094 21.667 16.399 111 HA2 GLY 15 HA2 GLY 15 -1.819 19.130 15.201 112 HA3 GLY 15 HA3 GLY 15 -1.728 20.705 14.382 113 H GLY 16 H GLY 16 -0.796 18.326 13.135 114 HA2 GLY 16 HA2 GLY 16 2.065 19.028 12.857 115 HA3 GLY 16 HA3 GLY 16 1.682 17.376 13.352 116 H LEU 17 H LEU 17 1.147 15.895 11.834 117 HA LEU 17 HA LEU 17 1.353 16.647 9.021 118 HB2 LEU 17 HB2 LEU 17 1.310 14.362 8.552 119 HB3 LEU 17 HB3 LEU 17 2.195 14.473 10.056 120 HG LEU 17 HG LEU 17 -0.698 13.581 9.804 121 HD11 LEU 17 HD11 LEU 17 0.214 11.316 10.145 122 HD12 LEU 17 HD12 LEU 17 1.866 11.976 10.108 123 HD13 LEU 17 HD13 LEU 17 0.832 12.060 8.659 124 HD21 LEU 17 HD21 LEU 17 -0.301 14.390 12.056 125 HD22 LEU 17 HD22 LEU 17 1.230 13.474 12.160 126 HD23 LEU 17 HD23 LEU 17 -0.330 12.620 12.083 127 HA PRO 18 HA PRO 18 -2.894 17.401 8.526 128 HB2 PRO 18 HB2 PRO 18 -3.497 16.774 5.972 129 HB3 PRO 18 HB3 PRO 18 -2.290 18.028 6.362 130 HG2 PRO 18 HG2 PRO 18 -1.833 15.138 5.687 131 HG3 PRO 18 HG3 PRO 18 -1.103 16.597 4.941 132 HD2 PRO 18 HD2 PRO 18 0.160 15.202 6.899 133 HD3 PRO 18 HD3 PRO 18 0.286 16.988 6.789 134 H GLY 19 H GLY 19 -2.002 14.143 8.644 135 HA2 GLY 19 HA2 GLY 19 -3.308 12.444 9.551 136 HA3 GLY 19 HA3 GLY 19 -4.747 13.446 9.336 137 H THR 20 H THR 20 -5.292 10.993 8.823 138 HA THR 20 HA THR 20 -4.656 10.256 6.050 139 HB THR 20 HB THR 20 -6.109 8.252 6.596 140 HG1 THR 20 HG1 THR 20 -7.414 8.939 8.205 141 HG21 THR 20 HG21 THR 20 -4.534 7.245 8.188 142 HG22 THR 20 HG22 THR 20 -3.861 8.846 8.560 143 HG23 THR 20 HG23 THR 20 -3.676 8.155 6.926 144 H GLU 21 H GLU 21 -6.778 12.365 7.391 145 HA GLU 21 HA GLU 21 -9.281 11.610 6.205 146 HB2 GLU 21 HB2 GLU 21 -9.982 13.843 6.888 147 HB3 GLU 21 HB3 GLU 21 -9.034 13.066 8.159 148 HG2 GLU 21 HG2 GLU 21 -7.011 14.357 7.227 149 HG3 GLU 21 HG3 GLU 21 -8.187 15.315 6.318 150 H ASN 22 H ASN 22 -6.477 12.762 4.736 151 HA ASN 22 HA ASN 22 -8.057 13.760 2.398 152 HB2 ASN 22 HB2 ASN 22 -6.262 15.363 1.945 153 HB3 ASN 22 HB3 ASN 22 -6.952 15.626 3.555 154 HD21 ASN 22 HD21 ASN 22 -5.753 15.086 5.395 155 HD22 ASN 22 HD22 ASN 22 -4.034 14.795 5.310 156 H SER 23 H SER 23 -5.485 11.695 3.554 157 HA SER 23 HA SER 23 -5.261 10.446 0.919 158 HB2 SER 23 HB2 SER 23 -3.635 12.297 0.705 159 HB3 SER 23 HB3 SER 23 -2.881 11.825 2.243 160 HG SER 23 HG SER 23 -1.989 11.034 0.097 161 H ASP 24 H ASP 24 -4.572 8.265 1.201 162 HA ASP 24 HA ASP 24 -4.736 7.273 3.914 163 HB2 ASP 24 HB2 ASP 24 -4.553 5.121 2.984 164 HB3 ASP 24 HB3 ASP 24 -5.420 6.054 1.752 165 H GLN 25 H GLN 25 -2.224 8.507 1.986 166 HA GLN 25 HA GLN 25 0.035 7.063 3.030 167 HB2 GLN 25 HB2 GLN 25 -0.111 9.927 2.007 168 HB3 GLN 25 HB3 GLN 25 1.336 8.923 2.099 169 HG2 GLN 25 HG2 GLN 25 -1.066 8.396 0.299 170 HG3 GLN 25 HG3 GLN 25 0.436 9.170 -0.205 171 HE21 GLN 25 HE21 GLN 25 -1.219 6.354 -0.273 172 HE22 GLN 25 HE22 GLN 25 0.146 5.263 -0.484 173 H ALA 26 H ALA 26 -1.875 9.793 4.083 174 HA ALA 26 HA ALA 26 -1.953 11.101 5.914 175 HB1 ALA 26 HB1 ALA 26 -1.099 10.416 8.021 176 HB2 ALA 26 HB2 ALA 26 -1.520 8.917 7.164 177 HB3 ALA 26 HB3 ALA 26 0.179 9.423 7.282 178 H ARG 27 H ARG 27 1.424 10.256 5.059 179 HA ARG 27 HA ARG 27 2.011 13.044 4.463 180 HB2 ARG 27 HB2 ARG 27 2.346 12.666 7.075 181 HB3 ARG 27 HB3 ARG 27 3.806 11.824 6.551 182 HG2 ARG 27 HG2 ARG 27 4.403 13.940 5.263 183 HG3 ARG 27 HG3 ARG 27 3.045 14.730 6.067 184 HD2 ARG 27 HD2 ARG 27 5.176 15.211 7.202 185 HD3 ARG 27 HD3 ARG 27 4.078 14.301 8.255 186 HE ARG 27 HE ARG 27 5.568 12.549 8.292 187 HH11 ARG 27 HH11 ARG 27 6.473 14.575 5.535 188 HH12 ARG 27 HH12 ARG 27 7.917 13.660 5.223 189 HH21 ARG 27 HH21 ARG 27 7.461 11.475 7.852 190 HH22 ARG 27 HH22 ARG 27 8.461 11.959 6.507 191 H ASP 28 H ASP 28 4.306 13.095 3.514 192 HA ASP 28 HA ASP 28 4.724 10.833 1.831 193 HB2 ASP 28 HB2 ASP 28 6.892 12.001 1.283 194 HB3 ASP 28 HB3 ASP 28 5.436 12.986 1.079 195 H GLY 29 H GLY 29 5.453 8.912 2.351 196 HA2 GLY 29 HA2 GLY 29 6.970 7.326 3.023 197 HA3 GLY 29 HA3 GLY 29 8.020 8.610 3.618 198 H THR 30 H THR 30 6.956 9.735 5.648 199 HA THR 30 HA THR 30 6.764 9.532 7.908 200 HB THR 30 HB THR 30 4.705 7.345 7.492 201 HG1 THR 30 HG1 THR 30 4.005 8.696 5.975 202 HG21 THR 30 HG21 THR 30 3.452 8.758 9.139 203 HG22 THR 30 HG22 THR 30 4.851 9.846 9.249 204 HG23 THR 30 HG23 THR 30 4.982 8.161 9.808 205 H LEU 31 H LEU 31 8.626 7.590 6.510 206 HA LEU 31 HA LEU 31 10.308 6.204 7.140 207 HB2 LEU 31 HB2 LEU 31 9.260 6.397 9.979 208 HB3 LEU 31 HB3 LEU 31 10.829 5.796 9.491 209 HG LEU 31 HG LEU 31 9.913 8.666 9.122 210 HD11 LEU 31 HD11 LEU 31 10.093 8.036 11.499 211 HD12 LEU 31 HD12 LEU 31 11.383 9.161 11.027 212 HD13 LEU 31 HD13 LEU 31 11.746 7.431 11.219 213 HD21 LEU 31 HD21 LEU 31 12.336 9.100 8.754 214 HD22 LEU 31 HD22 LEU 31 11.657 8.035 7.510 215 HD23 LEU 31 HD23 LEU 31 12.651 7.351 8.818 216 HA PRO 32 HA PRO 32 8.512 2.255 6.949 217 HB2 PRO 32 HB2 PRO 32 10.410 0.509 7.898 218 HB3 PRO 32 HB3 PRO 32 10.561 1.339 6.314 219 HG2 PRO 32 HG2 PRO 32 11.737 2.129 8.974 220 HG3 PRO 32 HG3 PRO 32 12.561 1.938 7.391 221 HD2 PRO 32 HD2 PRO 32 11.793 4.359 8.243 222 HD3 PRO 32 HD3 PRO 32 11.581 3.898 6.520 223 H TYR 33 H TYR 33 7.355 0.750 8.196 224 HA TYR 33 HA TYR 33 6.386 1.714 10.615 225 HB2 TYR 33 HB2 TYR 33 5.503 -0.081 8.920 226 HB3 TYR 33 HB3 TYR 33 6.317 -1.243 9.962 227 HD1 TYR 33 HD2 TYR 33 5.708 -0.278 12.720 228 HD2 TYR 33 HD1 TYR 33 3.204 -0.320 9.215 229 HE1 TYR 33 HE2 TYR 33 3.682 -0.303 14.156 230 HE2 TYR 33 HE1 TYR 33 1.189 -0.345 10.671 231 HH TYR 33 HH TYR 33 0.390 -0.508 12.823 232 H THR 34 H THR 34 8.569 -1.151 10.259 233 HA THR 34 HA THR 34 9.403 -0.667 13.089 234 HB THR 34 HB THR 34 9.670 -3.124 13.326 235 HG1 THR 34 HG1 THR 34 9.885 -3.521 11.033 236 HG21 THR 34 HG21 THR 34 7.487 -1.966 13.937 237 HG22 THR 34 HG22 THR 34 7.341 -3.695 13.563 238 HG23 THR 34 HG23 THR 34 6.856 -2.488 12.356 239 H LYS 35 H LYS 35 11.516 -1.318 13.619 240 HA LYS 35 HA LYS 35 13.351 -2.011 11.421 241 HB2 LYS 35 HB2 LYS 35 14.899 -0.102 12.440 242 HB3 LYS 35 HB3 LYS 35 13.790 0.213 11.112 243 HG2 LYS 35 HG2 LYS 35 12.670 0.698 13.852 244 HG3 LYS 35 HG3 LYS 35 13.972 1.775 13.341 245 HD2 LYS 35 HD2 LYS 35 12.735 2.487 11.377 246 HD3 LYS 35 HD3 LYS 35 11.478 1.268 11.659 247 HE2 LYS 35 HE2 LYS 35 10.879 2.369 13.796 248 HE3 LYS 35 HE3 LYS 35 12.127 3.597 13.517 249 HZ1 LYS 35 HZ1 LYS 35 9.805 3.137 11.717 250 HZ2 LYS 35 HZ2 LYS 35 10.912 4.351 11.594 251 HZ3 LYS 35 HZ3 LYS 35 9.871 4.316 12.872 252 H ASP 36 H ASP 36 13.781 -0.680 14.729 253 HA ASP 36 HA ASP 36 15.688 -2.611 15.537 254 HB2 ASP 36 HB2 ASP 36 15.237 -0.388 16.581 255 HB3 ASP 36 HB3 ASP 36 13.709 -1.023 17.210 256 H ARG 37 H ARG 37 12.168 -2.691 15.640 257 HA ARG 37 HA ARG 37 11.806 -4.674 17.594 258 HB2 ARG 37 HB2 ARG 37 10.057 -3.202 16.496 259 HB3 ARG 37 HB3 ARG 37 10.072 -4.323 15.127 260 HG2 ARG 37 HG2 ARG 37 9.302 -6.141 16.540 261 HG3 ARG 37 HG3 ARG 37 9.463 -5.133 17.988 262 HD2 ARG 37 HD2 ARG 37 7.715 -3.620 17.120 263 HD3 ARG 37 HD3 ARG 37 7.559 -4.647 15.681 264 HE ARG 37 HE ARG 37 6.482 -6.313 16.929 265 HH11 ARG 37 HH11 ARG 37 7.506 -3.713 19.129 266 HH12 ARG 37 HH12 ARG 37 6.508 -4.315 20.422 267 HH21 ARG 37 HH21 ARG 37 5.258 -6.977 18.582 268 HH22 ARG 37 HH22 ARG 37 5.252 -6.134 20.126 269 H PHE 38 H PHE 38 13.046 -5.104 14.349 270 HA PHE 38 HA PHE 38 12.225 -7.821 13.978 271 HB2 PHE 38 HB2 PHE 38 14.664 -6.335 12.937 272 HB3 PHE 38 HB3 PHE 38 14.128 -7.922 12.376 273 HD1 PHE 38 HD2 PHE 38 11.267 -7.720 12.019 274 HD2 PHE 38 HD1 PHE 38 14.293 -4.770 11.239 275 HE1 PHE 38 HE2 PHE 38 9.788 -6.665 10.325 276 HE2 PHE 38 HE1 PHE 38 12.815 -3.695 9.548 277 HZ PHE 38 HZ PHE 38 10.559 -4.643 9.081 278 H TYR 39 H TYR 39 14.723 -6.399 15.986 279 HA TYR 39 HA TYR 39 16.015 -9.055 16.310 280 HB2 TYR 39 HB2 TYR 39 16.794 -6.430 17.601 281 HB3 TYR 39 HB3 TYR 39 17.800 -7.863 17.345 282 HD1 TYR 39 HD2 TYR 39 18.084 -8.563 14.762 283 HD2 TYR 39 HD1 TYR 39 16.978 -4.627 16.120 284 HE1 TYR 39 HE2 TYR 39 18.834 -7.594 12.588 285 HE2 TYR 39 HE1 TYR 39 17.707 -3.676 13.930 286 HH TYR 39 HH TYR 39 19.080 -5.705 11.334 287 H LEU 40 H LEU 40 13.942 -6.771 17.946 288 HA LEU 40 HA LEU 40 14.440 -7.927 20.589 289 HB2 LEU 40 HB2 LEU 40 12.897 -5.625 19.463 290 HB3 LEU 40 HB3 LEU 40 12.401 -6.276 21.019 291 HG LEU 40 HG LEU 40 14.617 -5.839 21.961 292 HD11 LEU 40 HD11 LEU 40 16.062 -5.936 20.000 293 HD12 LEU 40 HD12 LEU 40 16.190 -4.334 20.745 294 HD13 LEU 40 HD13 LEU 40 15.227 -4.543 19.273 295 HD21 LEU 40 HD21 LEU 40 13.322 -3.436 20.607 296 HD22 LEU 40 HD22 LEU 40 14.361 -3.394 22.045 297 HD23 LEU 40 HD23 LEU 40 12.780 -4.199 22.128 298 H GLN 41 H GLN 41 11.859 -8.164 18.136 299 HA GLN 41 HA GLN 41 10.395 -9.930 20.061 300 HB2 GLN 41 HB2 GLN 41 9.465 -7.608 18.484 301 HB3 GLN 41 HB3 GLN 41 8.476 -9.045 18.309 302 HG2 GLN 41 HG2 GLN 41 7.453 -7.921 20.067 303 HG3 GLN 41 HG3 GLN 41 8.392 -9.179 20.863 304 HE21 GLN 41 HE21 GLN 41 9.892 -6.264 19.562 305 HE22 GLN 41 HE22 GLN 41 10.231 -5.532 21.112 306 HA PRO 42 HA PRO 42 10.298 -12.797 16.619 307 HB2 PRO 42 HB2 PRO 42 8.043 -14.235 17.170 308 HB3 PRO 42 HB3 PRO 42 9.547 -14.449 18.125 309 HG2 PRO 42 HG2 PRO 42 7.133 -12.759 18.746 310 HG3 PRO 42 HG3 PRO 42 7.961 -13.963 19.784 311 HD2 PRO 42 HD2 PRO 42 8.462 -11.318 20.000 312 HD3 PRO 42 HD3 PRO 42 9.771 -12.534 20.194 313 H LEU 43 H LEU 43 8.846 -13.120 14.697 314 HA LEU 43 HA LEU 43 7.153 -10.692 14.351 315 HB2 LEU 43 HB2 LEU 43 8.612 -12.333 12.267 316 HB3 LEU 43 HB3 LEU 43 7.749 -10.818 11.997 317 HG LEU 43 HG LEU 43 10.248 -11.160 13.706 318 HD11 LEU 43 HD11 LEU 43 11.408 -10.009 11.900 319 HD12 LEU 43 HD12 LEU 43 9.896 -9.888 10.966 320 HD13 LEU 43 HD13 LEU 43 10.629 -11.477 11.285 321 HD21 LEU 43 HD21 LEU 43 10.331 -8.722 13.780 322 HD22 LEU 43 HD22 LEU 43 8.821 -9.289 14.496 323 HD23 LEU 43 HD23 LEU 43 8.824 -8.617 12.847 324 HA PRO 44 HA PRO 44 4.165 -14.094 13.741 325 HB2 PRO 44 HB2 PRO 44 1.982 -12.958 14.907 326 HB3 PRO 44 HB3 PRO 44 3.283 -13.711 15.888 327 HG2 PRO 44 HG2 PRO 44 2.890 -10.824 15.169 328 HG3 PRO 44 HG3 PRO 44 3.136 -11.555 16.786 329 HD2 PRO 44 HD2 PRO 44 5.177 -10.468 15.385 330 HD3 PRO 44 HD3 PRO 44 5.405 -11.940 16.391 331 HA PRO 45 HA PRO 45 2.445 -12.321 10.111 332 HB2 PRO 45 HB2 PRO 45 -0.010 -13.507 9.806 333 HB3 PRO 45 HB3 PRO 45 1.539 -14.381 9.576 334 HG2 PRO 45 HG2 PRO 45 -0.193 -14.257 12.032 335 HG3 PRO 45 HG3 PRO 45 0.449 -15.698 11.176 336 HD2 PRO 45 HD2 PRO 45 1.689 -14.734 13.334 337 HD3 PRO 45 HD3 PRO 45 2.647 -15.286 11.914 338 H THR 46 H THR 46 0.698 -11.859 13.108 339 HA THR 46 HA THR 46 -1.278 -10.002 12.122 340 HB THR 46 HB THR 46 -0.980 -9.194 14.631 341 HG1 THR 46 HG1 THR 46 -0.021 -10.828 15.881 342 HG21 THR 46 HG21 THR 46 -2.902 -10.523 13.785 343 HG22 THR 46 HG22 THR 46 -2.382 -11.072 15.393 344 HG23 THR 46 HG23 THR 46 -1.934 -12.010 13.949 345 H GLU 47 H GLU 47 2.092 -9.689 13.317 346 HA GLU 47 HA GLU 47 2.054 -6.783 13.086 347 HB2 GLU 47 HB2 GLU 47 4.354 -8.766 13.202 348 HB3 GLU 47 HB3 GLU 47 4.530 -7.007 13.152 349 HG2 GLU 47 HG2 GLU 47 3.197 -6.858 15.243 350 HG3 GLU 47 HG3 GLU 47 3.236 -8.627 15.337 351 H ALA 48 H ALA 48 2.768 -9.530 10.970 352 HA ALA 48 HA ALA 48 4.032 -8.000 8.892 353 HB1 ALA 48 HB1 ALA 48 3.570 -9.908 7.451 354 HB2 ALA 48 HB2 ALA 48 4.087 -10.511 9.043 355 HB3 ALA 48 HB3 ALA 48 2.365 -10.537 8.592 356 H ALA 49 H ALA 49 0.645 -8.625 9.791 357 HA ALA 49 HA ALA 49 -0.533 -7.549 7.421 358 HB1 ALA 49 HB1 ALA 49 -1.713 -8.919 9.178 359 HB2 ALA 49 HB2 ALA 49 -1.663 -7.504 10.252 360 HB3 ALA 49 HB3 ALA 49 -2.571 -7.432 8.736 361 H GLN 50 H GLN 50 0.508 -6.053 10.485 362 HA GLN 50 HA GLN 50 -0.491 -3.450 9.875 363 HB2 GLN 50 HB2 GLN 50 1.669 -4.475 11.702 364 HB3 GLN 50 HB3 GLN 50 1.331 -2.753 11.538 365 HG2 GLN 50 HG2 GLN 50 -0.727 -4.830 12.263 366 HG3 GLN 50 HG3 GLN 50 0.134 -3.818 13.438 367 HE21 GLN 50 HE21 GLN 50 -2.771 -4.133 12.225 368 HE22 GLN 50 HE22 GLN 50 -3.251 -2.468 12.013 369 H ARG 51 H ARG 51 2.631 -5.057 9.185 370 HA ARG 51 HA ARG 51 3.852 -2.705 8.003 371 HB2 ARG 51 HB2 ARG 51 4.418 -5.669 7.600 372 HB3 ARG 51 HB3 ARG 51 5.436 -4.355 6.996 373 HG2 ARG 51 HG2 ARG 51 5.854 -3.601 9.291 374 HG3 ARG 51 HG3 ARG 51 4.804 -4.878 9.914 375 HD2 ARG 51 HD2 ARG 51 6.322 -6.576 8.869 376 HD3 ARG 51 HD3 ARG 51 7.412 -5.249 8.414 377 HE ARG 51 HE ARG 51 7.870 -4.822 10.722 378 HH11 ARG 51 HH21 ARG 51 5.848 -7.699 10.323 379 HH12 ARG 51 HH22 ARG 51 6.120 -8.212 11.970 380 HH21 ARG 51 HH11 ARG 51 8.145 -5.547 12.776 381 HH22 ARG 51 HH12 ARG 51 7.348 -6.997 13.354 382 H ALA 52 H ALA 52 1.894 -5.389 6.763 383 HA ALA 52 HA ALA 52 2.252 -4.891 4.014 384 HB1 ALA 52 HB1 ALA 52 0.215 -6.208 3.704 385 HB2 ALA 52 HB2 ALA 52 1.213 -6.935 4.982 386 HB3 ALA 52 HB3 ALA 52 -0.224 -5.984 5.409 387 H LYS 53 H LYS 53 0.089 -3.223 6.350 388 HA LYS 53 HA LYS 53 -1.496 -1.990 4.301 389 HB2 LYS 53 HB2 LYS 53 -2.570 -0.885 5.928 390 HB3 LYS 53 HB3 LYS 53 -1.776 -2.066 6.940 391 HG2 LYS 53 HG2 LYS 53 -1.586 -0.029 8.117 392 HG3 LYS 53 HG3 LYS 53 0.017 -0.301 7.452 393 HD2 LYS 53 HD2 LYS 53 -0.651 2.100 7.340 394 HD3 LYS 53 HD3 LYS 53 -0.348 1.449 5.741 395 HE2 LYS 53 HE2 LYS 53 -2.855 1.134 5.479 396 HE3 LYS 53 HE3 LYS 53 -3.051 2.048 6.987 397 HZ1 LYS 53 HZ1 LYS 53 -3.219 3.499 5.036 398 HZ2 LYS 53 HZ2 LYS 53 -1.731 3.041 4.493 399 HZ3 LYS 53 HZ3 LYS 53 -1.873 3.912 5.888 400 H VAL 54 H VAL 54 1.690 -1.212 5.628 401 HA VAL 54 HA VAL 54 1.769 1.402 4.338 402 HB VAL 54 HB VAL 54 4.048 -0.285 5.482 403 HG11 VAL 54 HG11 VAL 54 4.892 1.432 3.939 404 HG12 VAL 54 HG12 VAL 54 3.903 2.675 4.737 405 HG13 VAL 54 HG13 VAL 54 5.249 1.908 5.609 406 HG21 VAL 54 HG21 VAL 54 3.831 1.236 7.457 407 HG22 VAL 54 HG22 VAL 54 2.370 1.938 6.730 408 HG23 VAL 54 HG23 VAL 54 2.394 0.226 7.217 409 H SER 55 H SER 55 2.994 -1.896 3.638 410 HA SER 55 HA SER 55 4.362 -1.228 1.233 411 HB2 SER 55 HB2 SER 55 2.846 -3.786 1.885 412 HB3 SER 55 HB3 SER 55 4.160 -3.604 0.701 413 HG SER 55 HG SER 55 4.803 -4.454 2.810 414 H ALA 56 H ALA 56 0.953 -1.853 1.949 415 HA ALA 56 HA ALA 56 0.041 -1.860 -0.780 416 HB1 ALA 56 HB1 ALA 56 -2.115 -1.849 0.157 417 HB2 ALA 56 HB2 ALA 56 -1.132 -2.757 1.308 418 HB3 ALA 56 HB3 ALA 56 -1.569 -1.066 1.652 419 H SER 57 H SER 57 0.368 0.728 1.697 420 HA SER 57 HA SER 57 -0.842 2.761 0.069 421 HB2 SER 57 HB2 SER 57 1.154 2.907 2.366 422 HB3 SER 57 HB3 SER 57 0.388 4.325 1.625 423 HG SER 57 HG SER 57 -1.632 3.522 2.202 424 H GLU 58 H GLU 58 2.495 1.500 0.300 425 HA GLU 58 HA GLU 58 3.740 3.590 -1.215 426 HB2 GLU 58 HB2 GLU 58 4.385 0.681 -0.752 427 HB3 GLU 58 HB3 GLU 58 5.407 1.707 -1.757 428 HG2 GLU 58 HG2 GLU 58 4.708 2.659 1.014 429 HG3 GLU 58 HG3 GLU 58 5.916 1.378 0.831 430 H ILE 59 H ILE 59 1.843 0.786 -2.198 431 HA ILE 59 HA ILE 59 2.561 0.851 -4.996 432 HB ILE 59 HB ILE 59 -0.046 -0.035 -3.659 433 HG12 ILE 59 HG12 ILE 59 2.248 -1.683 -4.777 434 HG13 ILE 59 HG13 ILE 59 2.069 -1.291 -3.070 435 HG21 ILE 59 HG21 ILE 59 0.921 -0.548 -6.513 436 HG22 ILE 59 HG22 ILE 59 -0.554 -1.208 -5.769 437 HG23 ILE 59 HG23 ILE 59 -0.422 0.526 -6.054 438 HD11 ILE 59 HD11 ILE 59 0.263 -3.030 -4.762 439 HD12 ILE 59 HD12 ILE 59 1.257 -3.493 -3.368 440 HD13 ILE 59 HD13 ILE 59 -0.168 -2.460 -3.129 441 H LEU 60 H LEU 60 0.178 2.643 -3.015 442 HA LEU 60 HA LEU 60 -1.027 3.895 -5.354 443 HB2 LEU 60 HB2 LEU 60 -1.173 4.588 -2.401 444 HB3 LEU 60 HB3 LEU 60 -2.189 5.287 -3.657 445 HG LEU 60 HG LEU 60 -2.129 2.340 -2.901 446 HD11 LEU 60 HD11 LEU 60 -3.057 3.695 -1.106 447 HD12 LEU 60 HD12 LEU 60 -4.357 2.805 -1.920 448 HD13 LEU 60 HD13 LEU 60 -4.123 4.539 -2.247 449 HD21 LEU 60 HD21 LEU 60 -3.860 3.923 -4.849 450 HD22 LEU 60 HD22 LEU 60 -4.260 2.293 -4.270 451 HD23 LEU 60 HD23 LEU 60 -2.786 2.554 -5.215 452 H ASN 61 H ASN 61 1.724 4.545 -3.354 453 HA ASN 61 HA ASN 61 1.931 7.366 -3.709 454 HB2 ASN 61 HB2 ASN 61 3.157 5.793 -2.096 455 HB3 ASN 61 HB3 ASN 61 4.239 5.412 -3.443 456 HD21 ASN 61 HD21 ASN 61 5.787 6.238 -1.813 457 HD22 ASN 61 HD22 ASN 61 6.100 7.962 -1.821 458 H VAL 62 H VAL 62 2.356 4.806 -6.002 459 HA VAL 62 HA VAL 62 4.339 6.035 -7.680 460 HB VAL 62 HB VAL 62 3.663 4.469 -9.391 461 HG11 VAL 62 HG11 VAL 62 3.883 2.346 -8.202 462 HG12 VAL 62 HG12 VAL 62 4.945 3.567 -7.474 463 HG13 VAL 62 HG13 VAL 62 3.425 3.117 -6.670 464 HG21 VAL 62 HG21 VAL 62 1.619 2.970 -8.901 465 HG22 VAL 62 HG22 VAL 62 1.103 4.246 -7.795 466 HG23 VAL 62 HG23 VAL 62 1.326 4.598 -9.520 467 H LYS 63 H LYS 63 1.218 7.154 -7.032 468 HA LYS 63 HA LYS 63 0.225 7.934 -9.562 469 HB2 LYS 63 HB2 LYS 63 -0.754 8.190 -7.154 470 HB3 LYS 63 HB3 LYS 63 0.073 9.749 -7.136 471 HG2 LYS 63 HG2 LYS 63 -1.745 9.054 -9.440 472 HG3 LYS 63 HG3 LYS 63 -2.465 9.508 -7.898 473 HD2 LYS 63 HD2 LYS 63 -1.718 11.710 -8.022 474 HD3 LYS 63 HD3 LYS 63 -0.359 11.310 -9.085 475 HE2 LYS 63 HE2 LYS 63 -1.923 10.823 -10.926 476 HE3 LYS 63 HE3 LYS 63 -3.290 11.221 -9.878 477 HZ1 LYS 63 HZ1 LYS 63 -1.183 13.143 -10.707 478 HZ2 LYS 63 HZ2 LYS 63 -2.527 13.491 -9.813 479 HZ3 LYS 63 HZ3 LYS 63 -2.689 13.020 -11.387 480 H GLN 64 H GLN 64 2.862 9.245 -7.642 481 HA GLN 64 HA GLN 64 3.215 11.752 -8.900 482 HB2 GLN 64 HB2 GLN 64 5.317 9.803 -7.871 483 HB3 GLN 64 HB3 GLN 64 5.582 11.520 -8.192 484 HG2 GLN 64 HG2 GLN 64 3.701 10.372 -6.092 485 HG3 GLN 64 HG3 GLN 64 5.293 11.073 -5.792 486 HE21 GLN 64 HE21 GLN 64 2.259 11.737 -5.260 487 HE22 GLN 64 HE22 GLN 64 2.213 13.458 -5.568 488 H PHE 65 H PHE 65 4.130 8.495 -10.071 489 HA PHE 65 HA PHE 65 5.881 9.523 -12.135 490 HB2 PHE 65 HB2 PHE 65 4.481 6.860 -11.873 491 HB3 PHE 65 HB3 PHE 65 5.689 7.252 -13.096 492 HD1 PHE 65 HD1 PHE 65 7.993 8.182 -12.160 493 HD2 PHE 65 HD2 PHE 65 5.191 5.829 -9.915 494 HE1 PHE 65 HE1 PHE 65 9.821 7.486 -10.617 495 HE2 PHE 65 HE2 PHE 65 7.001 5.136 -8.358 496 HZ PHE 65 HZ PHE 65 9.323 5.958 -8.709 497 H ILE 66 H ILE 66 2.399 9.125 -11.890 498 HA ILE 66 HA ILE 66 1.906 9.032 -14.752 499 HB ILE 66 HB ILE 66 0.056 10.060 -12.524 500 HG12 ILE 66 HG12 ILE 66 0.125 7.304 -13.803 501 HG13 ILE 66 HG13 ILE 66 0.844 7.673 -12.234 502 HG21 ILE 66 HG21 ILE 66 -1.769 9.597 -14.176 503 HG22 ILE 66 HG22 ILE 66 -0.641 10.813 -14.780 504 HG23 ILE 66 HG23 ILE 66 -0.549 9.143 -15.384 505 HD11 ILE 66 HD11 ILE 66 -1.469 8.397 -11.457 506 HD12 ILE 66 HD12 ILE 66 -2.103 7.708 -12.966 507 HD13 ILE 66 HD13 ILE 66 -1.272 6.664 -11.795 508 H ASP 67 H ASP 67 1.986 11.569 -12.231 509 HA ASP 67 HA ASP 67 1.468 13.776 -13.981 510 HB2 ASP 67 HB2 ASP 67 2.970 13.604 -11.342 511 HB3 ASP 67 HB3 ASP 67 2.485 15.119 -12.121 512 H ARG 68 H ARG 68 4.415 12.096 -12.966 513 HA ARG 68 HA ARG 68 6.223 13.930 -14.307 514 HB2 ARG 68 HB2 ARG 68 6.368 11.458 -12.747 515 HB3 ARG 68 HB3 ARG 68 7.517 11.455 -14.076 516 HG2 ARG 68 HG2 ARG 68 7.291 13.733 -12.096 517 HG3 ARG 68 HG3 ARG 68 8.368 12.338 -11.873 518 HD2 ARG 68 HD2 ARG 68 9.417 12.833 -14.079 519 HD3 ARG 68 HD3 ARG 68 8.411 14.290 -14.207 520 HE ARG 68 HE ARG 68 9.783 14.373 -11.729 521 HH11 ARG 68 HH21 ARG 68 10.554 14.578 -15.166 522 HH12 ARG 68 HH22 ARG 68 11.974 15.551 -14.887 523 HH21 ARG 68 HH11 ARG 68 11.599 15.628 -11.449 524 HH22 ARG 68 HH12 ARG 68 12.553 16.133 -12.815 525 H LYS 69 H LYS 69 4.039 11.711 -15.545 526 HA LYS 69 HA LYS 69 3.737 10.709 -17.575 527 HB2 LYS 69 HB2 LYS 69 4.830 13.232 -18.028 528 HB3 LYS 69 HB3 LYS 69 5.796 12.191 -19.074 529 HG2 LYS 69 HG2 LYS 69 3.868 11.471 -20.268 530 HG3 LYS 69 HG3 LYS 69 2.775 12.140 -19.037 531 HD2 LYS 69 HD2 LYS 69 3.627 14.415 -19.569 532 HD3 LYS 69 HD3 LYS 69 4.583 13.718 -20.894 533 HE2 LYS 69 HE2 LYS 69 2.529 12.903 -21.969 534 HE3 LYS 69 HE3 LYS 69 1.559 13.500 -20.602 535 HZ1 LYS 69 HZ1 LYS 69 3.181 15.203 -22.411 536 HZ2 LYS 69 HZ2 LYS 69 2.277 15.743 -21.142 537 HZ3 LYS 69 HZ3 LYS 69 1.536 15.061 -22.448 538 H ALA 70 H ALA 70 5.725 9.673 -15.718 539 HA ALA 70 HA ALA 70 7.925 8.687 -17.414 540 HB1 ALA 70 HB1 ALA 70 7.375 8.356 -14.434 541 HB2 ALA 70 HB2 ALA 70 8.867 7.882 -15.282 542 HB3 ALA 70 HB3 ALA 70 8.416 9.596 -15.176 543 H TRP 71 H TRP 71 6.118 7.469 -18.655 544 HA TRP 71 HA TRP 71 4.771 5.229 -17.721 545 HB2 TRP 71 HB2 TRP 71 6.186 5.191 -20.360 546 HB3 TRP 71 HB3 TRP 71 4.611 4.525 -19.915 547 HD1 TRP 71 HD1 TRP 71 5.786 7.119 -21.980 548 HE1 TRP 71 HE1 TRP 71 4.245 9.117 -22.206 549 HE3 TRP 71 HE3 TRP 71 2.893 6.269 -17.842 550 HZ2 TRP 71 HZ2 TRP 71 1.969 10.172 -20.841 551 HZ3 TRP 71 HZ3 TRP 71 1.016 7.842 -17.348 552 HH2 TRP 71 HH2 TRP 71 0.569 9.771 -18.853 553 HA PRO 72 HA PRO 72 8.236 2.227 -18.311 554 HB2 PRO 72 HB2 PRO 72 10.877 2.877 -18.238 555 HB3 PRO 72 HB3 PRO 72 9.919 2.929 -19.754 556 HG2 PRO 72 HG2 PRO 72 10.583 5.177 -17.868 557 HG3 PRO 72 HG3 PRO 72 10.821 5.087 -19.644 558 HD2 PRO 72 HD2 PRO 72 8.664 6.301 -18.577 559 HD3 PRO 72 HD3 PRO 72 8.529 5.324 -20.080 560 H SER 73 H SER 73 8.806 4.959 -16.108 561 HA SER 73 HA SER 73 10.059 3.275 -14.070 562 HB2 SER 73 HB2 SER 73 8.802 6.032 -13.804 563 HB3 SER 73 HB3 SER 73 9.934 5.264 -12.671 564 HG SER 73 HG SER 73 11.549 5.471 -14.147 565 H LEU 74 H LEU 74 6.873 4.711 -14.760 566 HA LEU 74 HA LEU 74 5.572 4.002 -12.362 567 HB2 LEU 74 HB2 LEU 74 4.699 5.509 -14.108 568 HB3 LEU 74 HB3 LEU 74 4.518 4.164 -15.209 569 HG LEU 74 HG LEU 74 2.621 3.336 -14.114 570 HD11 LEU 74 HD11 LEU 74 3.145 5.226 -11.789 571 HD12 LEU 74 HD12 LEU 74 3.311 3.459 -11.756 572 HD13 LEU 74 HD13 LEU 74 1.719 4.192 -11.997 573 HD21 LEU 74 HD21 LEU 74 1.137 5.243 -14.192 574 HD22 LEU 74 HD22 LEU 74 2.411 5.493 -15.401 575 HD23 LEU 74 HD23 LEU 74 2.476 6.366 -13.858 576 H GLN 75 H GLN 75 5.853 2.124 -15.429 577 HA GLN 75 HA GLN 75 4.350 -0.078 -14.345 578 HB2 GLN 75 HB2 GLN 75 4.972 -1.266 -16.319 579 HB3 GLN 75 HB3 GLN 75 4.566 0.392 -16.741 580 HG2 GLN 75 HG2 GLN 75 6.400 -0.009 -18.071 581 HG3 GLN 75 HG3 GLN 75 7.127 0.803 -16.687 582 HE21 GLN 75 HE21 GLN 75 9.112 -0.040 -16.525 583 HE22 GLN 75 HE22 GLN 75 9.467 -1.758 -16.482 584 H ASN 76 H ASN 76 7.631 0.893 -13.828 585 HA ASN 76 HA ASN 76 8.518 -1.851 -13.197 586 HB2 ASN 76 HB2 ASN 76 10.015 -0.052 -14.214 587 HB3 ASN 76 HB3 ASN 76 9.960 0.771 -12.652 588 HD21 ASN 76 HD21 ASN 76 11.433 -1.653 -14.520 589 HD22 ASN 76 HD22 ASN 76 12.426 -2.340 -13.259 590 H ASP 77 H ASP 77 8.093 1.283 -11.473 591 HA ASP 77 HA ASP 77 8.514 0.247 -8.870 592 HB2 ASP 77 HB2 ASP 77 7.037 2.652 -9.957 593 HB3 ASP 77 HB3 ASP 77 7.053 2.287 -8.223 594 H LEU 78 H LEU 78 5.531 0.449 -10.841 595 HA LEU 78 HA LEU 78 3.702 -0.229 -8.774 596 HB2 LEU 78 HB2 LEU 78 3.798 -0.576 -11.750 597 HB3 LEU 78 HB3 LEU 78 2.618 -1.523 -10.869 598 HG LEU 78 HG LEU 78 2.774 1.494 -10.714 599 HD11 LEU 78 HD11 LEU 78 0.850 1.449 -12.256 600 HD12 LEU 78 HD12 LEU 78 0.995 -0.313 -12.408 601 HD13 LEU 78 HD13 LEU 78 2.294 0.750 -13.005 602 HD21 LEU 78 HD21 LEU 78 1.643 0.404 -8.786 603 HD22 LEU 78 HD22 LEU 78 0.570 -0.452 -9.916 604 HD23 LEU 78 HD23 LEU 78 0.505 1.309 -9.792 605 H ARG 79 H ARG 79 5.659 -2.318 -10.921 606 HA ARG 79 HA ARG 79 4.507 -4.727 -9.784 607 HB2 ARG 79 HB2 ARG 79 6.945 -4.269 -11.534 608 HB3 ARG 79 HB3 ARG 79 6.357 -5.866 -11.038 609 HG2 ARG 79 HG2 ARG 79 4.151 -5.337 -12.104 610 HG3 ARG 79 HG3 ARG 79 4.845 -3.823 -12.705 611 HD2 ARG 79 HD2 ARG 79 6.674 -5.858 -13.423 612 HD3 ARG 79 HD3 ARG 79 5.066 -6.508 -13.781 613 HE ARG 79 HE ARG 79 6.421 -4.244 -15.075 614 HH11 ARG 79 HH21 ARG 79 3.268 -5.841 -14.665 615 HH12 ARG 79 HH22 ARG 79 2.629 -5.091 -16.112 616 HH21 ARG 79 HH11 ARG 79 5.536 -3.403 -16.881 617 HH22 ARG 79 HH12 ARG 79 3.865 -3.754 -17.312 618 H LEU 80 H LEU 80 7.419 -2.771 -9.115 619 HA LEU 80 HA LEU 80 8.623 -4.717 -7.373 620 HB2 LEU 80 HB2 LEU 80 8.776 -1.690 -7.461 621 HB3 LEU 80 HB3 LEU 80 9.683 -2.653 -6.304 622 HG LEU 80 HG LEU 80 10.000 -2.833 -9.314 623 HD11 LEU 80 HD11 LEU 80 12.113 -1.634 -8.914 624 HD12 LEU 80 HD12 LEU 80 11.720 -1.500 -7.183 625 HD13 LEU 80 HD13 LEU 80 10.724 -0.664 -8.400 626 HD21 LEU 80 HD21 LEU 80 10.619 -4.942 -8.245 627 HD22 LEU 80 HD22 LEU 80 11.586 -4.077 -7.025 628 HD23 LEU 80 HD23 LEU 80 12.087 -4.076 -8.732 629 H ARG 81 H ARG 81 6.477 -1.894 -6.657 630 HA ARG 81 HA ARG 81 6.407 -2.457 -3.845 631 HB2 ARG 81 HB2 ARG 81 4.378 -1.003 -5.581 632 HB3 ARG 81 HB3 ARG 81 4.446 -0.957 -3.815 633 HG2 ARG 81 HG2 ARG 81 6.539 0.156 -5.717 634 HG3 ARG 81 HG3 ARG 81 5.391 1.075 -4.738 635 HD2 ARG 81 HD2 ARG 81 6.450 -0.041 -2.713 636 HD3 ARG 81 HD3 ARG 81 7.736 -0.593 -3.808 637 HE ARG 81 HE ARG 81 7.515 2.124 -4.299 638 HH11 ARG 81 HH21 ARG 81 8.146 0.217 -1.400 639 HH12 ARG 81 HH22 ARG 81 8.971 1.535 -0.608 640 HH21 ARG 81 HH11 ARG 81 8.645 3.723 -3.248 641 HH22 ARG 81 HH12 ARG 81 9.252 3.462 -1.635 642 H ALA 82 H ALA 82 4.322 -3.488 -6.551 643 HA ALA 82 HA ALA 82 2.406 -4.824 -4.912 644 HB1 ALA 82 HB1 ALA 82 1.809 -6.046 -6.963 645 HB2 ALA 82 HB2 ALA 82 2.047 -4.321 -7.313 646 HB3 ALA 82 HB3 ALA 82 3.310 -5.500 -7.747 647 H SER 83 H SER 83 5.582 -5.878 -6.235 648 HA SER 83 HA SER 83 5.272 -8.616 -5.460 649 HB2 SER 83 HB2 SER 83 7.805 -6.958 -5.750 650 HB3 SER 83 HB3 SER 83 7.741 -8.727 -5.609 651 HG SER 83 HG SER 83 6.698 -7.083 -7.685 652 H TYR 84 H TYR 84 6.606 -5.773 -3.685 653 HA TYR 84 HA TYR 84 7.448 -7.321 -1.424 654 HB2 TYR 84 HB2 TYR 84 6.501 -4.428 -1.525 655 HB3 TYR 84 HB3 TYR 84 7.353 -5.184 -0.174 656 HD1 TYR 84 HD1 TYR 84 9.560 -6.671 -1.373 657 HD2 TYR 84 HD2 TYR 84 7.927 -2.865 -2.543 658 HE1 TYR 84 HE1 TYR 84 11.732 -6.054 -2.432 659 HE2 TYR 84 HE2 TYR 84 10.105 -2.263 -3.606 660 HH TYR 84 HH TYR 84 12.246 -2.929 -4.066 661 H LEU 85 H LEU 85 4.361 -5.629 -2.170 662 HA LEU 85 HA LEU 85 3.104 -6.355 0.287 663 HB2 LEU 85 HB2 LEU 85 2.212 -4.617 -1.238 664 HB3 LEU 85 HB3 LEU 85 1.851 -5.865 -2.435 665 HG LEU 85 HG LEU 85 0.262 -6.915 -0.839 666 HD11 LEU 85 HD11 LEU 85 1.155 -6.167 1.298 667 HD12 LEU 85 HD12 LEU 85 -0.516 -5.604 1.125 668 HD13 LEU 85 HD13 LEU 85 0.829 -4.471 0.872 669 HD21 LEU 85 HD21 LEU 85 -0.526 -5.318 -2.537 670 HD22 LEU 85 HD22 LEU 85 -0.337 -3.999 -1.359 671 HD23 LEU 85 HD23 LEU 85 -1.521 -5.292 -1.067 672 H ARG 86 H ARG 86 3.470 -8.074 -2.789 673 HA ARG 86 HA ARG 86 1.579 -10.128 -2.247 674 HB2 ARG 86 HB2 ARG 86 2.799 -9.696 -4.449 675 HB3 ARG 86 HB3 ARG 86 4.191 -10.520 -3.753 676 HG2 ARG 86 HG2 ARG 86 3.037 -12.130 -5.089 677 HG3 ARG 86 HG3 ARG 86 2.685 -12.546 -3.401 678 HD2 ARG 86 HD2 ARG 86 0.524 -11.304 -3.579 679 HD3 ARG 86 HD3 ARG 86 0.885 -10.967 -5.273 680 HE ARG 86 HE ARG 86 0.363 -13.154 -5.847 681 HH11 ARG 86 HH21 ARG 86 0.303 -12.886 -2.314 682 HH12 ARG 86 HH22 ARG 86 -0.602 -14.375 -2.142 683 HH21 ARG 86 HH11 ARG 86 -0.768 -15.044 -5.509 684 HH22 ARG 86 HH12 ARG 86 -1.173 -15.557 -3.883 685 H TYR 87 H TYR 87 5.059 -9.887 -1.413 686 HA TYR 87 HA TYR 87 5.077 -12.523 -0.213 687 HB2 TYR 87 HB2 TYR 87 6.984 -10.176 -0.055 688 HB3 TYR 87 HB3 TYR 87 7.256 -11.713 0.787 689 HD1 TYR 87 HD2 TYR 87 6.958 -13.895 -0.785 690 HD2 TYR 87 HD1 TYR 87 7.965 -9.956 -2.197 691 HE1 TYR 87 HE2 TYR 87 7.917 -14.881 -2.870 692 HE2 TYR 87 HE1 TYR 87 8.910 -10.954 -4.283 693 HH TYR 87 HH TYR 87 8.963 -14.472 -4.863 694 H ASP 88 H ASP 88 4.579 -9.208 1.061 695 HA ASP 88 HA ASP 88 4.513 -9.954 3.829 696 HB2 ASP 88 HB2 ASP 88 3.146 -7.763 2.226 697 HB3 ASP 88 HB3 ASP 88 2.812 -7.994 3.946 698 H LEU 89 H LEU 89 1.869 -9.627 1.409 699 HA LEU 89 HA LEU 89 -0.205 -10.555 3.114 700 HB2 LEU 89 HB2 LEU 89 0.198 -10.341 0.153 701 HB3 LEU 89 HB3 LEU 89 -1.144 -11.324 0.728 702 HG LEU 89 HG LEU 89 -0.754 -8.441 1.581 703 HD11 LEU 89 HD11 LEU 89 -2.598 -9.490 -0.591 704 HD12 LEU 89 HD12 LEU 89 -1.039 -8.696 -0.909 705 HD13 LEU 89 HD13 LEU 89 -2.340 -7.803 -0.105 706 HD21 LEU 89 HD21 LEU 89 -3.132 -10.356 1.668 707 HD22 LEU 89 HD22 LEU 89 -3.179 -8.641 2.130 708 HD23 LEU 89 HD23 LEU 89 -2.193 -9.776 3.065 709 H LYS 90 H LYS 90 2.052 -12.337 1.021 710 HA LYS 90 HA LYS 90 0.766 -14.845 1.092 711 HB2 LYS 90 HB2 LYS 90 3.537 -13.848 0.722 712 HB3 LYS 90 HB3 LYS 90 3.441 -15.512 1.263 713 HG2 LYS 90 HG2 LYS 90 1.907 -14.476 -1.139 714 HG3 LYS 90 HG3 LYS 90 3.557 -15.097 -1.263 715 HD2 LYS 90 HD2 LYS 90 1.248 -16.716 -0.114 716 HD3 LYS 90 HD3 LYS 90 1.737 -16.763 -1.818 717 HE2 LYS 90 HE2 LYS 90 4.030 -17.463 -1.127 718 HE3 LYS 90 HE3 LYS 90 3.496 -17.491 0.567 719 HZ1 LYS 90 HZ1 LYS 90 1.896 -19.196 -0.026 720 HZ2 LYS 90 HZ2 LYS 90 3.422 -19.683 -0.420 721 HZ3 LYS 90 HZ3 LYS 90 2.390 -19.174 -1.601 722 H THR 91 H THR 91 2.644 -13.155 3.558 723 HA THR 91 HA THR 91 2.763 -15.495 5.336 724 HB THR 91 HB THR 91 3.418 -12.567 5.930 725 HG1 THR 91 HG1 THR 91 4.809 -13.060 4.348 726 HG21 THR 91 HG21 THR 91 4.328 -15.179 7.206 727 HG22 THR 91 HG22 THR 91 3.238 -13.975 7.938 728 HG23 THR 91 HG23 THR 91 4.935 -13.559 7.617 729 H VAL 92 H VAL 92 1.037 -12.342 5.145 730 HA VAL 92 HA VAL 92 -0.330 -12.511 7.616 731 HB VAL 92 HB VAL 92 -1.243 -11.213 5.002 732 HG11 VAL 92 HG11 VAL 92 -2.607 -9.730 6.557 733 HG12 VAL 92 HG12 VAL 92 -3.190 -11.396 6.440 734 HG13 VAL 92 HG13 VAL 92 -2.256 -10.877 7.865 735 HG21 VAL 92 HG21 VAL 92 0.932 -10.393 5.870 736 HG22 VAL 92 HG22 VAL 92 -0.328 -9.162 5.957 737 HG23 VAL 92 HG23 VAL 92 0.164 -10.046 7.420 738 H ILE 93 H ILE 93 -1.335 -13.776 4.398 739 HA ILE 93 HA ILE 93 -3.981 -14.427 5.193 740 HB ILE 93 HB ILE 93 -4.043 -16.031 3.320 741 HG12 ILE 93 HG12 ILE 93 -1.063 -15.508 3.019 742 HG13 ILE 93 HG13 ILE 93 -1.766 -16.994 3.650 743 HG21 ILE 93 HG21 ILE 93 -4.064 -13.438 3.019 744 HG22 ILE 93 HG22 ILE 93 -2.477 -13.656 2.282 745 HG23 ILE 93 HG23 ILE 93 -3.890 -14.460 1.585 746 HD11 ILE 93 HD11 ILE 93 -1.144 -17.377 1.374 747 HD12 ILE 93 HD12 ILE 93 -2.920 -17.323 1.444 748 HD13 ILE 93 HD13 ILE 93 -2.004 -15.926 0.824 749 H SER 94 H SER 94 -0.984 -16.009 6.028 750 HA SER 94 HA SER 94 -1.997 -18.625 6.443 751 HB2 SER 94 HB2 SER 94 0.415 -17.950 6.379 752 HB3 SER 94 HB3 SER 94 0.220 -17.283 8.014 753 HG SER 94 HG SER 94 -0.159 -19.301 8.795 754 H ALA 95 H ALA 95 -2.289 -15.717 8.406 755 HA ALA 95 HA ALA 95 -2.915 -17.092 10.877 756 HB1 ALA 95 HB1 ALA 95 -3.597 -14.854 11.644 757 HB2 ALA 95 HB2 ALA 95 -2.055 -14.765 10.769 758 HB3 ALA 95 HB3 ALA 95 -3.551 -14.246 9.971 759 H LYS 96 H LYS 96 -4.792 -16.090 8.077 760 HA LYS 96 HA LYS 96 -7.324 -16.051 9.497 761 HB2 LYS 96 HB2 LYS 96 -6.306 -15.507 6.784 762 HB3 LYS 96 HB3 LYS 96 -7.900 -16.260 6.794 763 HG2 LYS 96 HG2 LYS 96 -8.234 -13.881 6.780 764 HG3 LYS 96 HG3 LYS 96 -8.693 -14.477 8.379 765 HD2 LYS 96 HD2 LYS 96 -6.452 -13.739 9.249 766 HD3 LYS 96 HD3 LYS 96 -6.102 -13.053 7.647 767 HE2 LYS 96 HE2 LYS 96 -8.156 -11.637 7.851 768 HE3 LYS 96 HE3 LYS 96 -8.414 -12.284 9.479 769 HZ1 LYS 96 HZ1 LYS 96 -6.223 -11.328 10.071 770 HZ2 LYS 96 HZ2 LYS 96 -7.337 -10.196 9.641 771 HZ3 LYS 96 HZ3 LYS 96 -6.147 -10.612 8.583 772 HA PRO 97 HA PRO 97 -8.326 -20.315 9.260 773 HB2 PRO 97 HB2 PRO 97 -11.045 -20.343 8.909 774 HB3 PRO 97 HB3 PRO 97 -10.272 -19.832 10.445 775 HG2 PRO 97 HG2 PRO 97 -11.237 -18.133 8.168 776 HG3 PRO 97 HG3 PRO 97 -11.614 -17.996 9.915 777 HD2 PRO 97 HD2 PRO 97 -9.705 -16.476 8.801 778 HD3 PRO 97 HD3 PRO 97 -9.461 -17.191 10.433 779 H LYS 98 H LYS 98 -9.407 -22.001 7.834 780 HA LYS 98 HA LYS 98 -8.166 -22.103 5.424 781 HB2 LYS 98 HB2 LYS 98 -9.303 -23.981 6.557 782 HB3 LYS 98 HB3 LYS 98 -10.867 -23.326 6.074 783 HG2 LYS 98 HG2 LYS 98 -10.390 -25.133 4.605 784 HG3 LYS 98 HG3 LYS 98 -10.193 -23.655 3.659 785 HD2 LYS 98 HD2 LYS 98 -7.730 -23.813 3.939 786 HD3 LYS 98 HD3 LYS 98 -7.947 -25.289 4.908 787 HE2 LYS 98 HE2 LYS 98 -9.100 -26.351 2.956 788 HE3 LYS 98 HE3 LYS 98 -8.758 -24.901 1.995 789 HZ1 LYS 98 HZ1 LYS 98 -7.122 -26.639 1.611 790 HZ2 LYS 98 HZ2 LYS 98 -6.713 -26.678 3.207 791 HZ3 LYS 98 HZ3 LYS 98 -6.393 -25.333 2.305 792 H ASP 99 H ASP 99 -11.624 -21.014 5.613 793 HA ASP 99 HA ASP 99 -11.684 -20.668 2.747 794 HB2 ASP 99 HB2 ASP 99 -13.673 -21.137 4.222 795 HB3 ASP 99 HB3 ASP 99 -13.570 -19.458 4.784 796 H GLU 100 H GLU 100 -11.310 -18.396 5.499 797 HA GLU 100 HA GLU 100 -11.352 -16.038 3.876 798 HB2 GLU 100 HB2 GLU 100 -10.423 -16.741 6.627 799 HB3 GLU 100 HB3 GLU 100 -9.894 -15.216 5.920 800 HG2 GLU 100 HG2 GLU 100 -12.795 -16.008 6.029 801 HG3 GLU 100 HG3 GLU 100 -11.982 -15.136 7.343 802 H LYS 101 H LYS 101 -8.840 -18.355 4.705 803 HA LYS 101 HA LYS 101 -6.567 -16.855 3.827 804 HB2 LYS 101 HB2 LYS 101 -6.682 -19.043 5.099 805 HB3 LYS 101 HB3 LYS 101 -7.014 -19.855 3.573 806 HG2 LYS 101 HG2 LYS 101 -4.850 -19.274 2.694 807 HG3 LYS 101 HG3 LYS 101 -4.537 -18.176 4.038 808 HD2 LYS 101 HD2 LYS 101 -4.796 -21.212 4.274 809 HD3 LYS 101 HD3 LYS 101 -3.282 -20.288 4.300 810 HE2 LYS 101 HE2 LYS 101 -4.269 -19.028 6.312 811 HE3 LYS 101 HE3 LYS 101 -5.517 -20.260 6.367 812 HZ1 LYS 101 HZ1 LYS 101 -3.870 -21.882 6.879 813 HZ2 LYS 101 HZ2 LYS 101 -3.639 -20.597 7.893 814 HZ3 LYS 101 HZ3 LYS 101 -2.627 -20.826 6.614 815 H LYS 102 H LYS 102 -9.045 -18.719 2.118 816 HA LYS 102 HA LYS 102 -7.744 -18.441 -0.500 817 HB2 LYS 102 HB2 LYS 102 -9.231 -20.356 0.131 818 HB3 LYS 102 HB3 LYS 102 -10.594 -19.244 0.207 819 HG2 LYS 102 HG2 LYS 102 -9.021 -19.316 -2.339 820 HG3 LYS 102 HG3 LYS 102 -10.049 -20.712 -1.955 821 HD2 LYS 102 HD2 LYS 102 -11.998 -19.213 -1.678 822 HD3 LYS 102 HD3 LYS 102 -10.970 -17.821 -2.050 823 HE2 LYS 102 HE2 LYS 102 -12.128 -18.336 -4.057 824 HE3 LYS 102 HE3 LYS 102 -10.459 -18.877 -4.278 825 HZ1 LYS 102 HZ1 LYS 102 -11.189 -21.123 -3.810 826 HZ2 LYS 102 HZ2 LYS 102 -12.033 -20.496 -5.080 827 HZ3 LYS 102 HZ3 LYS 102 -12.746 -20.617 -3.595 828 H SER 103 H SER 103 -10.513 -16.951 1.240 829 HA SER 103 HA SER 103 -11.371 -15.219 -0.801 830 HB2 SER 103 HB2 SER 103 -12.545 -15.650 1.343 831 HB3 SER 103 HB3 SER 103 -11.313 -14.700 2.196 832 HG SER 103 HG SER 103 -13.301 -13.586 1.606 833 H LEU 104 H LEU 104 -8.863 -14.614 1.706 834 HA LEU 104 HA LEU 104 -8.283 -11.939 0.891 835 HB2 LEU 104 HB2 LEU 104 -7.084 -14.018 2.578 836 HB3 LEU 104 HB3 LEU 104 -5.880 -13.017 1.778 837 HG LEU 104 HG LEU 104 -8.166 -11.796 3.325 838 HD11 LEU 104 HD11 LEU 104 -5.405 -12.451 4.411 839 HD12 LEU 104 HD12 LEU 104 -6.894 -13.350 4.800 840 HD13 LEU 104 HD13 LEU 104 -6.734 -11.645 5.268 841 HD21 LEU 104 HD21 LEU 104 -6.536 -9.893 3.496 842 HD22 LEU 104 HD22 LEU 104 -6.978 -10.271 1.819 843 HD23 LEU 104 HD23 LEU 104 -5.408 -10.802 2.467 844 H GLN 105 H GLN 105 -7.008 -15.096 -0.238 845 HA GLN 105 HA GLN 105 -4.999 -13.926 -1.938 846 HB2 GLN 105 HB2 GLN 105 -6.332 -16.624 -1.813 847 HB3 GLN 105 HB3 GLN 105 -5.279 -16.194 -3.163 848 HG2 GLN 105 HG2 GLN 105 -3.948 -15.477 -0.729 849 HG3 GLN 105 HG3 GLN 105 -4.542 -17.137 -0.579 850 HE21 GLN 105 HE21 GLN 105 -4.211 -18.417 -2.760 851 HE22 GLN 105 HE22 GLN 105 -2.594 -18.310 -3.409 852 H GLU 106 H GLU 106 -8.472 -14.622 -2.415 853 HA GLU 106 HA GLU 106 -8.393 -14.220 -5.270 854 HB2 GLU 106 HB2 GLU 106 -10.636 -13.795 -3.265 855 HB3 GLU 106 HB3 GLU 106 -10.827 -13.656 -5.011 856 HG2 GLU 106 HG2 GLU 106 -10.045 -16.138 -3.477 857 HG3 GLU 106 HG3 GLU 106 -11.598 -15.819 -4.256 858 H LEU 107 H LEU 107 -8.875 -11.978 -2.485 859 HA LEU 107 HA LEU 107 -9.205 -9.672 -4.213 860 HB2 LEU 107 HB2 LEU 107 -8.301 -9.912 -1.328 861 HB3 LEU 107 HB3 LEU 107 -8.453 -8.387 -2.180 862 HG LEU 107 HG LEU 107 -10.669 -10.230 -1.304 863 HD11 LEU 107 HD11 LEU 107 -11.353 -8.211 -0.095 864 HD12 LEU 107 HD12 LEU 107 -10.057 -7.275 -0.868 865 HD13 LEU 107 HD13 LEU 107 -9.654 -8.575 0.270 866 HD21 LEU 107 HD21 LEU 107 -12.234 -8.562 -2.361 867 HD22 LEU 107 HD22 LEU 107 -11.340 -9.540 -3.538 868 HD23 LEU 107 HD23 LEU 107 -10.843 -7.857 -3.217 869 H THR 108 H THR 108 -6.412 -11.262 -2.700 870 HA THR 108 HA THR 108 -4.460 -9.309 -3.378 871 HB THR 108 HB THR 108 -4.073 -12.354 -3.301 872 HG1 THR 108 HG1 THR 108 -5.050 -11.456 -1.378 873 HG21 THR 108 HG21 THR 108 -2.175 -10.013 -2.960 874 HG22 THR 108 HG22 THR 108 -2.074 -11.345 -4.135 875 HG23 THR 108 HG23 THR 108 -1.802 -11.662 -2.395 876 H SER 109 H SER 109 -5.789 -12.075 -5.253 877 HA SER 109 HA SER 109 -4.120 -11.600 -7.565 878 HB2 SER 109 HB2 SER 109 -5.285 -13.750 -7.046 879 HB3 SER 109 HB3 SER 109 -6.840 -12.959 -7.373 880 HG SER 109 HG SER 109 -6.176 -13.992 -9.230 881 H LYS 110 H LYS 110 -7.454 -10.650 -6.678 882 HA LYS 110 HA LYS 110 -8.163 -9.420 -9.133 883 HB2 LYS 110 HB2 LYS 110 -9.615 -10.041 -7.154 884 HB3 LYS 110 HB3 LYS 110 -9.035 -8.584 -6.343 885 HG2 LYS 110 HG2 LYS 110 -9.959 -7.237 -8.255 886 HG3 LYS 110 HG3 LYS 110 -10.653 -8.730 -8.907 887 HD2 LYS 110 HD2 LYS 110 -11.255 -7.511 -6.171 888 HD3 LYS 110 HD3 LYS 110 -12.307 -7.422 -7.591 889 HE2 LYS 110 HE2 LYS 110 -11.518 -9.959 -6.083 890 HE3 LYS 110 HE3 LYS 110 -13.092 -9.152 -6.025 891 HZ1 LYS 110 HZ1 LYS 110 -13.117 -11.044 -7.523 892 HZ2 LYS 110 HZ2 LYS 110 -11.899 -10.405 -8.434 893 HZ3 LYS 110 HZ3 LYS 110 -13.367 -9.657 -8.381 894 H LEU 111 H LEU 111 -6.527 -8.094 -6.262 895 HA LEU 111 HA LEU 111 -6.552 -5.377 -7.103 896 HB2 LEU 111 HB2 LEU 111 -6.059 -6.307 -4.826 897 HB3 LEU 111 HB3 LEU 111 -4.475 -6.802 -5.407 898 HG LEU 111 HG LEU 111 -5.224 -3.930 -5.764 899 HD11 LEU 111 HD11 LEU 111 -4.800 -3.388 -3.473 900 HD12 LEU 111 HD12 LEU 111 -4.435 -5.077 -3.071 901 HD13 LEU 111 HD13 LEU 111 -6.090 -4.590 -3.515 902 HD21 LEU 111 HD21 LEU 111 -2.679 -5.312 -4.794 903 HD22 LEU 111 HD22 LEU 111 -2.868 -3.571 -5.106 904 HD23 LEU 111 HD23 LEU 111 -2.981 -4.724 -6.445 905 H PHE 112 H PHE 112 -4.283 -8.049 -7.720 906 HA PHE 112 HA PHE 112 -2.309 -6.348 -8.941 907 HB2 PHE 112 HB2 PHE 112 -2.763 -9.321 -8.833 908 HB3 PHE 112 HB3 PHE 112 -1.508 -8.628 -9.865 909 HD1 PHE 112 HD1 PHE 112 -2.592 -7.627 -6.363 910 HD2 PHE 112 HD2 PHE 112 0.557 -9.126 -8.888 911 HE1 PHE 112 HE1 PHE 112 -1.043 -7.517 -4.460 912 HE2 PHE 112 HE2 PHE 112 2.128 -9.020 -6.950 913 HZ PHE 112 HZ PHE 112 1.301 -8.228 -4.727 914 H SER 113 H SER 113 -5.285 -7.751 -10.109 915 HA SER 113 HA SER 113 -4.637 -7.523 -12.924 916 HB2 SER 113 HB2 SER 113 -6.573 -8.831 -12.075 917 HB3 SER 113 HB3 SER 113 -7.338 -7.325 -11.534 918 HG SER 113 HG SER 113 -6.582 -7.886 -14.217 919 H SER 114 H SER 114 -5.848 -5.274 -10.412 920 HA SER 114 HA SER 114 -6.399 -3.129 -12.272 921 HB2 SER 114 HB2 SER 114 -5.704 -2.956 -9.313 922 HB3 SER 114 HB3 SER 114 -6.497 -1.706 -10.291 923 HG SER 114 HG SER 114 -8.172 -3.331 -10.672 924 H ILE 115 H ILE 115 -3.534 -4.273 -10.546 925 HA ILE 115 HA ILE 115 -1.883 -1.971 -11.019 926 HB ILE 115 HB ILE 115 -1.082 -4.919 -10.726 927 HG12 ILE 115 HG12 ILE 115 -2.302 -4.161 -8.778 928 HG13 ILE 115 HG13 ILE 115 -0.610 -4.395 -8.382 929 HG21 ILE 115 HG21 ILE 115 1.148 -3.954 -9.978 930 HG22 ILE 115 HG22 ILE 115 0.780 -3.793 -11.709 931 HG23 ILE 115 HG23 ILE 115 0.595 -2.400 -10.633 932 HD11 ILE 115 HD11 ILE 115 -1.581 -2.409 -7.301 933 HD12 ILE 115 HD12 ILE 115 -0.250 -1.971 -8.387 934 HD13 ILE 115 HD13 ILE 115 -1.940 -1.698 -8.883 935 H ASP 116 H ASP 116 -2.417 -5.008 -12.856 936 HA ASP 116 HA ASP 116 -0.560 -4.354 -14.936 937 HB2 ASP 116 HB2 ASP 116 -1.504 -6.624 -14.439 938 HB3 ASP 116 HB3 ASP 116 -3.044 -6.083 -15.128 939 H ASN 117 H ASN 117 -4.012 -3.623 -14.480 940 HA ASN 117 HA ASN 117 -4.417 -2.573 -17.137 941 HB2 ASN 117 HB2 ASN 117 -5.852 -2.464 -14.516 942 HB3 ASN 117 HB3 ASN 117 -6.238 -1.224 -15.711 943 HD21 ASN 117 HD21 ASN 117 -6.366 -4.628 -14.960 944 HD22 ASN 117 HD22 ASN 117 -7.451 -5.049 -16.268 945 H LEU 118 H LEU 118 -3.416 -1.091 -14.032 946 HA LEU 118 HA LEU 118 -3.367 1.611 -14.997 947 HB2 LEU 118 HB2 LEU 118 -3.117 0.486 -12.589 948 HB3 LEU 118 HB3 LEU 118 -1.407 0.618 -12.946 949 HG LEU 118 HG LEU 118 -3.381 2.920 -12.822 950 HD11 LEU 118 HD11 LEU 118 -1.251 1.973 -10.879 951 HD12 LEU 118 HD12 LEU 118 -3.011 1.862 -10.654 952 HD13 LEU 118 HD13 LEU 118 -2.220 3.450 -10.704 953 HD21 LEU 118 HD21 LEU 118 -1.557 3.532 -14.303 954 HD22 LEU 118 HD22 LEU 118 -0.359 2.968 -13.123 955 HD23 LEU 118 HD23 LEU 118 -1.376 4.379 -12.760 956 H ASP 119 H ASP 119 -0.972 -1.025 -14.890 957 HA ASP 119 HA ASP 119 1.237 0.426 -15.970 958 HB2 ASP 119 HB2 ASP 119 1.829 -1.618 -15.039 959 HB3 ASP 119 HB3 ASP 119 0.421 -2.446 -15.709 960 H HIS 120 H HIS 120 -1.363 -1.494 -17.629 961 HA HIS 120 HA HIS 120 -0.238 -0.973 -20.221 962 HB2 HIS 120 HB2 HIS 120 -2.922 -1.889 -19.255 963 HB3 HIS 120 HB3 HIS 120 -2.682 -1.443 -20.950 964 HD1 HIS 120 HD1 HIS 120 -1.634 -4.079 -18.417 965 HD2 HIS 120 HD2 HIS 120 -1.109 -3.143 -22.457 966 HE1 HIS 120 HE1 HIS 120 -0.546 -6.078 -19.503 967 H ALA 121 H ALA 121 -2.647 0.852 -18.295 968 HA ALA 121 HA ALA 121 -3.204 2.758 -20.365 969 HB1 ALA 121 HB1 ALA 121 -4.586 2.557 -18.357 970 HB2 ALA 121 HB2 ALA 121 -3.222 3.071 -17.339 971 HB3 ALA 121 HB3 ALA 121 -3.944 4.209 -18.501 972 H ALA 122 H ALA 122 -0.640 2.516 -17.906 973 HA ALA 122 HA ALA 122 0.505 5.089 -18.399 974 HB1 ALA 122 HB1 ALA 122 1.829 2.521 -17.413 975 HB2 ALA 122 HB2 ALA 122 2.484 4.160 -17.255 976 HB3 ALA 122 HB3 ALA 122 0.991 3.708 -16.397 977 H LYS 123 H LYS 123 1.370 1.812 -19.673 978 HA LYS 123 HA LYS 123 3.556 2.802 -21.222 979 HB2 LYS 123 HB2 LYS 123 1.767 0.370 -21.712 980 HB3 LYS 123 HB3 LYS 123 3.273 0.692 -22.575 981 HG2 LYS 123 HG2 LYS 123 4.456 0.635 -20.332 982 HG3 LYS 123 HG3 LYS 123 2.951 0.031 -19.644 983 HD2 LYS 123 HD2 LYS 123 4.550 -1.287 -21.876 984 HD3 LYS 123 HD3 LYS 123 4.517 -1.815 -20.190 985 HE2 LYS 123 HE2 LYS 123 2.119 -1.816 -22.090 986 HE3 LYS 123 HE3 LYS 123 3.098 -3.227 -21.676 987 HZ1 LYS 123 HZ1 LYS 123 1.463 -1.678 -19.764 988 HZ2 LYS 123 HZ2 LYS 123 2.373 -2.987 -19.377 989 HZ3 LYS 123 HZ3 LYS 123 1.077 -3.163 -20.384 990 H ILE 124 H ILE 124 0.080 2.530 -21.946 991 HA ILE 124 HA ILE 124 0.530 3.178 -24.757 992 HB ILE 124 HB ILE 124 -1.308 1.624 -23.697 993 HG12 ILE 124 HG12 ILE 124 -2.886 2.232 -25.618 994 HG13 ILE 124 HG13 ILE 124 -1.743 3.514 -26.022 995 HG21 ILE 124 HG21 ILE 124 -2.266 3.435 -22.241 996 HG22 ILE 124 HG22 ILE 124 -2.859 4.240 -23.706 997 HG23 ILE 124 HG23 ILE 124 -3.453 2.623 -23.271 998 HD11 ILE 124 HD11 ILE 124 -1.062 0.540 -25.886 999 HD12 ILE 124 HD12 ILE 124 -1.381 1.458 -27.375 1000 HD13 ILE 124 HD13 ILE 124 0.043 1.845 -26.385 1001 H LYS 125 H LYS 125 0.889 5.048 -22.186 1002 HA LYS 125 HA LYS 125 1.143 7.302 -21.960 1003 HB2 LYS 125 HB2 LYS 125 1.935 6.933 -24.361 1004 HB3 LYS 125 HB3 LYS 125 0.373 7.548 -24.872 1005 HG2 LYS 125 HG2 LYS 125 0.910 9.740 -23.783 1006 HG3 LYS 125 HG3 LYS 125 2.498 9.090 -23.353 1007 HD2 LYS 125 HD2 LYS 125 2.789 10.336 -25.387 1008 HD3 LYS 125 HD3 LYS 125 2.874 8.616 -25.812 1009 HE2 LYS 125 HE2 LYS 125 0.436 8.716 -26.479 1010 HE3 LYS 125 HE3 LYS 125 0.465 10.461 -26.173 1011 HZ1 LYS 125 HZ1 LYS 125 2.128 9.023 -28.163 1012 HZ2 LYS 125 HZ2 LYS 125 2.167 10.651 -27.896 1013 HZ3 LYS 125 HZ3 LYS 125 0.806 9.945 -28.506 1014 H SER 126 H SER 126 -1.424 6.121 -21.362 1015 HA SER 126 HA SER 126 -3.257 8.431 -21.899 1016 HB2 SER 126 HB2 SER 126 -3.829 5.563 -21.098 1017 HB3 SER 126 HB3 SER 126 -5.041 6.846 -21.252 1018 HG SER 126 HG SER 126 -5.013 5.835 -23.188 1019 HA PRO 127 HA PRO 127 -2.060 8.746 -17.497 1020 HB2 PRO 127 HB2 PRO 127 -2.455 11.438 -17.152 1021 HB3 PRO 127 HB3 PRO 127 -0.968 10.754 -17.874 1022 HG2 PRO 127 HG2 PRO 127 -3.398 11.851 -19.264 1023 HG3 PRO 127 HG3 PRO 127 -1.671 12.244 -19.535 1024 HD2 PRO 127 HD2 PRO 127 -2.954 10.475 -21.104 1025 HD3 PRO 127 HD3 PRO 127 -1.254 10.187 -20.597 1026 H THR 128 H THR 128 -4.997 10.088 -19.051 1027 HA THR 128 HA THR 128 -6.432 10.589 -16.646 1028 HB THR 128 HB THR 128 -7.609 9.694 -19.314 1029 HG1 THR 128 HG1 THR 128 -7.491 11.882 -19.875 1030 HG21 THR 128 HG21 THR 128 -9.443 11.223 -18.679 1031 HG22 THR 128 HG22 THR 128 -8.625 11.559 -17.134 1032 HG23 THR 128 HG23 THR 128 -9.239 9.924 -17.488 1033 H GLU 129 H GLU 129 -6.174 7.744 -18.766 1034 HA GLU 129 HA GLU 129 -7.992 6.128 -17.210 1035 HB2 GLU 129 HB2 GLU 129 -5.956 5.563 -19.376 1036 HB3 GLU 129 HB3 GLU 129 -6.900 4.276 -18.616 1037 HG2 GLU 129 HG2 GLU 129 -7.928 4.991 -20.736 1038 HG3 GLU 129 HG3 GLU 129 -8.993 5.316 -19.357 1039 H ALA 130 H ALA 130 -4.492 6.721 -17.195 1040 HA ALA 130 HA ALA 130 -3.818 4.549 -15.450 1041 HB1 ALA 130 HB1 ALA 130 -2.134 5.867 -16.735 1042 HB2 ALA 130 HB2 ALA 130 -2.487 7.284 -15.717 1043 HB3 ALA 130 HB3 ALA 130 -1.766 5.832 -14.997 1044 H GLU 131 H GLU 131 -4.853 7.951 -14.857 1045 HA GLU 131 HA GLU 131 -4.756 7.669 -11.984 1046 HB2 GLU 131 HB2 GLU 131 -6.204 9.622 -13.789 1047 HB3 GLU 131 HB3 GLU 131 -6.285 9.668 -12.021 1048 HG2 GLU 131 HG2 GLU 131 -3.727 9.686 -12.065 1049 HG3 GLU 131 HG3 GLU 131 -3.870 10.069 -13.783 1050 H LYS 132 H LYS 132 -7.194 6.940 -14.442 1051 HA LYS 132 HA LYS 132 -9.386 6.621 -12.623 1052 HB2 LYS 132 HB2 LYS 132 -9.336 6.660 -15.238 1053 HB3 LYS 132 HB3 LYS 132 -8.992 4.943 -15.114 1054 HG2 LYS 132 HG2 LYS 132 -11.335 5.124 -15.447 1055 HG3 LYS 132 HG3 LYS 132 -11.108 4.695 -13.745 1056 HD2 LYS 132 HD2 LYS 132 -12.815 6.398 -13.868 1057 HD3 LYS 132 HD3 LYS 132 -11.374 7.138 -13.156 1058 HE2 LYS 132 HE2 LYS 132 -10.785 8.086 -15.400 1059 HE3 LYS 132 HE3 LYS 132 -12.275 7.384 -16.062 1060 HZ1 LYS 132 HZ1 LYS 132 -12.570 9.698 -15.456 1061 HZ2 LYS 132 HZ2 LYS 132 -12.130 9.398 -13.895 1062 HZ3 LYS 132 HZ3 LYS 132 -13.523 8.751 -14.498 1063 H TYR 133 H TYR 133 -7.020 4.276 -13.965 1064 HA TYR 133 HA TYR 133 -8.026 2.091 -12.392 1065 HB2 TYR 133 HB2 TYR 133 -5.360 2.556 -13.753 1066 HB3 TYR 133 HB3 TYR 133 -5.799 1.045 -12.945 1067 HD1 TYR 133 HD1 TYR 133 -8.533 0.482 -13.717 1068 HD2 TYR 133 HD2 TYR 133 -5.396 2.241 -16.081 1069 HE1 TYR 133 HE1 TYR 133 -9.665 -0.281 -15.801 1070 HE2 TYR 133 HE2 TYR 133 -6.525 1.437 -18.156 1071 HH TYR 133 HH TYR 133 -8.278 0.254 -19.032 1072 H TYR 134 H TYR 134 -5.594 4.622 -11.779 1073 HA TYR 134 HA TYR 134 -4.546 3.497 -9.363 1074 HB2 TYR 134 HB2 TYR 134 -3.360 5.346 -10.166 1075 HB3 TYR 134 HB3 TYR 134 -4.822 6.263 -10.494 1076 HD1 TYR 134 HD1 TYR 134 -2.654 5.052 -7.690 1077 HD2 TYR 134 HD2 TYR 134 -5.732 7.801 -8.929 1078 HE1 TYR 134 HE1 TYR 134 -2.459 6.275 -5.526 1079 HE2 TYR 134 HE2 TYR 134 -5.531 8.997 -6.751 1080 HH TYR 134 HH TYR 134 -4.495 9.077 -4.711 1081 H GLY 135 H GLY 135 -7.389 5.663 -9.943 1082 HA2 GLY 135 HA2 GLY 135 -8.120 5.837 -7.195 1083 HA3 GLY 135 HA3 GLY 135 -9.206 6.073 -8.575 1084 H GLN 136 H GLN 136 -8.995 3.466 -9.715 1085 HA GLN 136 HA GLN 136 -10.868 2.000 -8.079 1086 HB2 GLN 136 HB2 GLN 136 -9.145 1.209 -10.454 1087 HB3 GLN 136 HB3 GLN 136 -10.352 0.144 -9.725 1088 HG2 GLN 136 HG2 GLN 136 -12.146 1.625 -10.323 1089 HG3 GLN 136 HG3 GLN 136 -11.019 2.893 -10.818 1090 HE21 GLN 136 HE21 GLN 136 -12.130 -0.385 -11.604 1091 HE22 GLN 136 HE22 GLN 136 -11.752 -0.272 -13.306 1092 H THR 137 H THR 137 -7.336 1.886 -8.506 1093 HA THR 137 HA THR 137 -6.941 -0.516 -6.984 1094 HB THR 137 HB THR 137 -4.965 1.781 -7.398 1095 HG1 THR 137 HG1 THR 137 -5.700 0.967 -9.386 1096 HG21 THR 137 HG21 THR 137 -3.278 -0.029 -7.170 1097 HG22 THR 137 HG22 THR 137 -4.576 -1.176 -6.766 1098 HG23 THR 137 HG23 THR 137 -4.218 0.190 -5.681 1099 H VAL 138 H VAL 138 -7.198 2.963 -6.038 1100 HA VAL 138 HA VAL 138 -6.355 2.629 -3.337 1101 HB VAL 138 HB VAL 138 -8.557 4.492 -4.391 1102 HG11 VAL 138 HG11 VAL 138 -7.003 4.545 -1.761 1103 HG12 VAL 138 HG12 VAL 138 -8.065 5.849 -2.343 1104 HG13 VAL 138 HG13 VAL 138 -8.749 4.260 -1.958 1105 HG21 VAL 138 HG21 VAL 138 -6.335 4.889 -5.449 1106 HG22 VAL 138 HG22 VAL 138 -6.832 6.234 -4.419 1107 HG23 VAL 138 HG23 VAL 138 -5.616 5.076 -3.843 1108 H SER 139 H SER 139 -9.605 2.187 -4.824 1109 HA SER 139 HA SER 139 -10.882 1.448 -2.370 1110 HB2 SER 139 HB2 SER 139 -11.583 0.567 -5.194 1111 HB3 SER 139 HB3 SER 139 -12.669 0.601 -3.789 1112 HG SER 139 HG SER 139 -12.322 2.895 -3.735 1113 H ASN 140 H ASN 140 -9.166 -0.449 -4.857 1114 HA ASN 140 HA ASN 140 -9.862 -3.027 -3.800 1115 HB2 ASN 140 HB2 ASN 140 -8.532 -2.068 -6.014 1116 HB3 ASN 140 HB3 ASN 140 -7.202 -2.751 -5.076 1117 HD21 ASN 140 HD21 ASN 140 -8.747 -3.496 -7.610 1118 HD22 ASN 140 HD22 ASN 140 -9.110 -5.185 -7.371 1119 H ILE 141 H ILE 141 -7.166 -0.777 -3.173 1120 HA ILE 141 HA ILE 141 -5.679 -2.503 -1.422 1121 HB ILE 141 HB ILE 141 -5.809 0.555 -1.673 1122 HG12 ILE 141 HG12 ILE 141 -4.853 -0.906 -3.565 1123 HG13 ILE 141 HG13 ILE 141 -3.887 0.440 -2.990 1124 HG21 ILE 141 HG21 ILE 141 -4.059 -1.140 0.130 1125 HG22 ILE 141 HG22 ILE 141 -3.577 0.493 -0.386 1126 HG23 ILE 141 HG23 ILE 141 -5.067 0.258 0.557 1127 HD11 ILE 141 HD11 ILE 141 -3.408 -2.394 -2.014 1128 HD12 ILE 141 HD12 ILE 141 -2.657 -1.736 -3.485 1129 HD13 ILE 141 HD13 ILE 141 -2.328 -0.985 -1.918 1130 H ASN 142 H ASN 142 -8.279 -0.073 -0.856 1131 HA ASN 142 HA ASN 142 -8.317 -0.252 1.967 1132 HB2 ASN 142 HB2 ASN 142 -9.613 1.378 0.587 1133 HB3 ASN 142 HB3 ASN 142 -10.711 0.068 0.128 1134 HD21 ASN 142 HD21 ASN 142 -12.403 -0.399 1.406 1135 HD22 ASN 142 HD22 ASN 142 -12.623 0.266 3.006 1136 H GLU 143 H GLU 143 -10.044 -2.308 -0.436 1137 HA GLU 143 HA GLU 143 -11.493 -3.776 1.542 1138 HB2 GLU 143 HB2 GLU 143 -10.618 -4.520 -1.274 1139 HB3 GLU 143 HB3 GLU 143 -11.707 -5.505 -0.291 1140 HG2 GLU 143 HG2 GLU 143 -12.225 -2.668 -1.213 1141 HG3 GLU 143 HG3 GLU 143 -12.952 -4.134 -1.885 1142 H VAL 144 H VAL 144 -8.305 -4.314 0.046 1143 HA VAL 144 HA VAL 144 -7.881 -6.864 1.344 1144 HB VAL 144 HB VAL 144 -5.918 -4.789 0.243 1145 HG11 VAL 144 HG11 VAL 144 -4.225 -6.625 0.322 1146 HG12 VAL 144 HG12 VAL 144 -4.738 -6.103 1.935 1147 HG13 VAL 144 HG13 VAL 144 -5.375 -7.617 1.251 1148 HG21 VAL 144 HG21 VAL 144 -5.681 -6.416 -1.609 1149 HG22 VAL 144 HG22 VAL 144 -6.879 -7.474 -0.837 1150 HG23 VAL 144 HG23 VAL 144 -7.361 -5.877 -1.450 1151 H LEU 145 H LEU 145 -7.338 -3.460 2.240 1152 HA LEU 145 HA LEU 145 -5.709 -3.977 4.524 1153 HB2 LEU 145 HB2 LEU 145 -7.116 -1.723 3.338 1154 HB3 LEU 145 HB3 LEU 145 -7.176 -1.668 5.090 1155 HG LEU 145 HG LEU 145 -4.730 -1.685 5.218 1156 HD11 LEU 145 HD11 LEU 145 -3.369 -1.388 3.165 1157 HD12 LEU 145 HD12 LEU 145 -4.808 -1.730 2.187 1158 HD13 LEU 145 HD13 LEU 145 -4.137 -2.983 3.239 1159 HD21 LEU 145 HD21 LEU 145 -5.893 0.455 5.064 1160 HD22 LEU 145 HD22 LEU 145 -5.916 0.355 3.288 1161 HD23 LEU 145 HD23 LEU 145 -4.375 0.549 4.144 1162 H ALA 146 H ALA 146 -9.266 -3.794 4.206 1163 HA ALA 146 HA ALA 146 -9.673 -3.950 7.067 1164 HB1 ALA 146 HB1 ALA 146 -12.018 -4.500 6.442 1165 HB2 ALA 146 HB2 ALA 146 -11.418 -3.121 5.491 1166 HB3 ALA 146 HB3 ALA 146 -11.518 -4.737 4.749 1167 H LYS 147 H LYS 147 -9.096 -6.345 4.557 1168 HA LYS 147 HA LYS 147 -9.772 -8.553 6.397 1169 HB2 LYS 147 HB2 LYS 147 -8.529 -8.528 3.638 1170 HB3 LYS 147 HB3 LYS 147 -9.011 -9.974 4.541 1171 HG2 LYS 147 HG2 LYS 147 -11.364 -8.984 4.621 1172 HG3 LYS 147 HG3 LYS 147 -10.799 -7.791 3.448 1173 HD2 LYS 147 HD2 LYS 147 -11.747 -9.421 2.086 1174 HD3 LYS 147 HD3 LYS 147 -10.025 -9.835 2.048 1175 HE2 LYS 147 HE2 LYS 147 -11.306 -11.862 2.332 1176 HE3 LYS 147 HE3 LYS 147 -10.443 -11.527 3.846 1177 HZ1 LYS 147 HZ1 LYS 147 -12.715 -12.155 4.268 1178 HZ2 LYS 147 HZ2 LYS 147 -13.294 -10.916 3.330 1179 HZ3 LYS 147 HZ3 LYS 147 -12.483 -10.590 4.732 1180 H LEU 148 H LEU 148 -7.062 -6.562 5.825 1181 HA LEU 148 HA LEU 148 -5.006 -8.481 6.560 1182 HB2 LEU 148 HB2 LEU 148 -5.138 -5.462 6.839 1183 HB3 LEU 148 HB3 LEU 148 -3.776 -6.403 7.365 1184 HG LEU 148 HG LEU 148 -4.682 -6.172 4.495 1185 HD11 LEU 148 HD11 LEU 148 -2.712 -4.763 4.219 1186 HD12 LEU 148 HD12 LEU 148 -2.312 -4.952 5.940 1187 HD13 LEU 148 HD13 LEU 148 -3.777 -4.077 5.463 1188 HD21 LEU 148 HD21 LEU 148 -2.466 -7.187 4.008 1189 HD22 LEU 148 HD22 LEU 148 -3.571 -8.291 4.847 1190 HD23 LEU 148 HD23 LEU 148 -2.259 -7.491 5.747 1191 H GLY 149 H GLY 149 -7.330 -6.380 8.286 1192 HA2 GLY 149 HA2 GLY 149 -6.195 -6.791 10.899 1193 HA3 GLY 149 HA3 GLY 149 -7.858 -6.291 10.538 Start of MODEL 15 1 H1 GLU 1 H1 GLU 1 8.744 7.025 24.072 2 H2 GLU 1 H2 GLU 1 7.583 6.262 23.181 3 H3 GLU 1 H3 GLU 1 7.832 5.819 24.744 4 HA GLU 1 HA GLU 1 9.994 4.970 24.269 5 HB2 GLU 1 HB2 GLU 1 7.995 3.914 22.230 6 HB3 GLU 1 HB3 GLU 1 9.408 3.067 22.869 7 HG2 GLU 1 HG2 GLU 1 7.928 2.127 24.259 8 HG3 GLU 1 HG3 GLU 1 8.060 3.642 25.172 9 H ALA 2 H ALA 2 9.396 4.185 21.034 10 HA ALA 2 HA ALA 2 11.770 5.468 20.172 11 HB1 ALA 2 HB1 ALA 2 9.470 4.355 18.494 12 HB2 ALA 2 HB2 ALA 2 11.129 4.664 17.936 13 HB3 ALA 2 HB3 ALA 2 10.827 3.407 19.153 14 H ARG 3 H ARG 3 8.332 6.436 19.684 15 HA ARG 3 HA ARG 3 8.979 8.669 17.975 16 HB2 ARG 3 HB2 ARG 3 6.569 8.081 19.732 17 HB3 ARG 3 HB3 ARG 3 6.705 9.529 18.728 18 HG2 ARG 3 HG2 ARG 3 6.924 8.114 16.711 19 HG3 ARG 3 HG3 ARG 3 6.693 6.666 17.712 20 HD2 ARG 3 HD2 ARG 3 4.697 8.959 17.550 21 HD3 ARG 3 HD3 ARG 3 4.620 7.520 16.524 22 HE ARG 3 HE ARG 3 4.406 7.466 19.511 23 HH11 ARG 3 HH11 ARG 3 3.407 6.167 16.365 24 HH12 ARG 3 HH12 ARG 3 2.325 5.017 17.095 25 HH21 ARG 3 HH21 ARG 3 3.017 5.954 20.350 26 HH22 ARG 3 HH22 ARG 3 2.103 4.906 19.300 27 HA PRO 4 HA PRO 4 10.647 10.937 21.385 28 HB2 PRO 4 HB2 PRO 4 11.276 13.308 20.179 29 HB3 PRO 4 HB3 PRO 4 12.219 11.807 19.899 30 HG2 PRO 4 HG2 PRO 4 10.010 12.985 18.237 31 HG3 PRO 4 HG3 PRO 4 11.637 12.441 17.722 32 HD2 PRO 4 HD2 PRO 4 9.466 10.859 17.457 33 HD3 PRO 4 HD3 PRO 4 11.066 10.179 17.914 34 H ILE 5 H ILE 5 9.773 12.144 22.951 35 HA ILE 5 HA ILE 5 7.803 14.247 22.332 36 HB ILE 5 HB ILE 5 6.257 13.477 24.148 37 HG12 ILE 5 HG12 ILE 5 7.781 10.838 24.087 38 HG13 ILE 5 HG13 ILE 5 7.987 12.066 25.340 39 HG21 ILE 5 HG21 ILE 5 6.524 11.273 22.046 40 HG22 ILE 5 HG22 ILE 5 5.042 11.809 22.878 41 HG23 ILE 5 HG23 ILE 5 5.843 12.877 21.707 42 HD11 ILE 5 HD11 ILE 5 5.452 10.483 24.757 43 HD12 ILE 5 HD12 ILE 5 6.493 10.376 26.191 44 HD13 ILE 5 HD13 ILE 5 5.540 11.847 25.899 45 H VAL 6 H VAL 6 7.580 15.622 24.286 46 HA VAL 6 HA VAL 6 9.692 15.228 26.350 47 HB VAL 6 HB VAL 6 9.162 17.895 24.918 48 HG11 VAL 6 HG11 VAL 6 9.621 18.207 27.322 49 HG12 VAL 6 HG12 VAL 6 11.079 17.195 27.191 50 HG13 VAL 6 HG13 VAL 6 11.001 18.763 26.354 51 HG21 VAL 6 HG21 VAL 6 10.553 16.455 23.511 52 HG22 VAL 6 HG22 VAL 6 11.559 17.734 24.216 53 HG23 VAL 6 HG23 VAL 6 11.619 16.086 24.885 54 H VAL 7 H VAL 7 6.977 17.208 25.156 55 HA VAL 7 HA VAL 7 5.808 17.404 27.850 56 HB VAL 7 HB VAL 7 4.727 18.251 25.101 57 HG11 VAL 7 HG11 VAL 7 3.771 18.924 27.918 58 HG12 VAL 7 HG12 VAL 7 3.160 19.667 26.421 59 HG13 VAL 7 HG13 VAL 7 2.917 17.939 26.705 60 HG21 VAL 7 HG21 VAL 7 6.751 19.530 25.647 61 HG22 VAL 7 HG22 VAL 7 5.326 20.569 25.827 62 HG23 VAL 7 HG23 VAL 7 6.119 19.893 27.270 63 H GLY 8 H GLY 8 4.333 15.908 28.568 64 HA2 GLY 8 HA2 GLY 8 4.050 13.435 27.182 65 HA3 GLY 8 HA3 GLY 8 3.143 13.933 28.618 66 HA PRO 9 HA PRO 9 -0.362 14.482 26.003 67 HB2 PRO 9 HB2 PRO 9 -1.422 16.982 26.341 68 HB3 PRO 9 HB3 PRO 9 -1.497 15.739 27.633 69 HG2 PRO 9 HG2 PRO 9 0.489 17.967 27.265 70 HG3 PRO 9 HG3 PRO 9 -0.475 17.545 28.717 71 HD2 PRO 9 HD2 PRO 9 2.071 16.718 28.453 72 HD3 PRO 9 HD3 PRO 9 0.825 15.639 29.168 73 HA PRO 10 HA PRO 10 1.240 16.215 22.352 74 HB2 PRO 10 HB2 PRO 10 -0.906 16.840 20.777 75 HB3 PRO 10 HB3 PRO 10 -0.426 15.149 21.128 76 HG2 PRO 10 HG2 PRO 10 -2.509 16.841 22.492 77 HG3 PRO 10 HG3 PRO 10 -2.670 15.189 21.807 78 HD2 PRO 10 HD2 PRO 10 -2.232 15.557 24.431 79 HD3 PRO 10 HD3 PRO 10 -1.403 14.228 23.544 80 HA PRO 11 HA PRO 11 1.240 20.544 22.993 81 HB2 PRO 11 HB2 PRO 11 2.358 21.549 20.714 82 HB3 PRO 11 HB3 PRO 11 3.300 20.602 21.904 83 HG2 PRO 11 HG2 PRO 11 1.986 19.676 19.363 84 HG3 PRO 11 HG3 PRO 11 3.671 19.421 19.915 85 HD2 PRO 11 HD2 PRO 11 1.767 17.536 20.255 86 HD3 PRO 11 HD3 PRO 11 3.026 17.826 21.508 87 HA PRO 12 HA PRO 12 -2.583 21.731 21.240 88 HB2 PRO 12 HB2 PRO 12 -2.773 24.381 21.840 89 HB3 PRO 12 HB3 PRO 12 -2.789 23.107 23.104 90 HG2 PRO 12 HG2 PRO 12 -0.461 24.747 22.120 91 HG3 PRO 12 HG3 PRO 12 -1.043 24.512 23.802 92 HD2 PRO 12 HD2 PRO 12 0.978 23.030 22.816 93 HD3 PRO 12 HD3 PRO 12 -0.270 22.289 23.879 94 H LEU 13 H LEU 13 0.295 23.167 19.935 95 HA LEU 13 HA LEU 13 -1.135 24.713 17.920 96 HB2 LEU 13 HB2 LEU 13 1.089 25.140 16.966 97 HB3 LEU 13 HB3 LEU 13 0.880 25.666 18.609 98 HG LEU 13 HG LEU 13 3.138 24.784 17.854 99 HD11 LEU 13 HD11 LEU 13 2.583 25.345 20.167 100 HD12 LEU 13 HD12 LEU 13 3.659 23.937 20.088 101 HD13 LEU 13 HD13 LEU 13 1.931 23.717 20.427 102 HD21 LEU 13 HD21 LEU 13 1.893 22.072 18.414 103 HD22 LEU 13 HD22 LEU 13 3.613 22.423 18.121 104 HD23 LEU 13 HD23 LEU 13 2.423 22.666 16.825 105 H SER 14 H SER 14 -0.903 21.494 18.227 106 HA SER 14 HA SER 14 -1.355 21.163 15.342 107 HB2 SER 14 HB2 SER 14 0.182 19.268 15.117 108 HB3 SER 14 HB3 SER 14 1.058 20.756 15.532 109 HG SER 14 HG SER 14 1.702 18.883 16.741 110 H GLY 15 H GLY 15 -1.446 19.831 18.641 111 HA2 GLY 15 HA2 GLY 15 -3.188 18.505 19.499 112 HA3 GLY 15 HA3 GLY 15 -3.792 18.223 17.852 113 H GLY 16 H GLY 16 -0.538 17.812 17.631 114 HA2 GLY 16 HA2 GLY 16 0.880 15.929 18.000 115 HA3 GLY 16 HA3 GLY 16 -0.523 14.997 18.578 116 H LEU 17 H LEU 17 -0.102 13.299 17.132 117 HA LEU 17 HA LEU 17 -0.368 12.057 15.259 118 HB2 LEU 17 HB2 LEU 17 -2.029 14.396 14.286 119 HB3 LEU 17 HB3 LEU 17 -2.014 12.798 13.574 120 HG LEU 17 HG LEU 17 -2.953 13.378 16.398 121 HD11 LEU 17 HD11 LEU 17 -4.362 14.487 14.717 122 HD12 LEU 17 HD12 LEU 17 -5.218 13.116 15.452 123 HD13 LEU 17 HD13 LEU 17 -4.521 12.959 13.819 124 HD21 LEU 17 HD21 LEU 17 -3.985 11.118 16.199 125 HD22 LEU 17 HD22 LEU 17 -2.216 11.047 16.096 126 HD23 LEU 17 HD23 LEU 17 -3.199 10.908 14.617 127 HA PRO 18 HA PRO 18 2.657 13.283 12.306 128 HB2 PRO 18 HB2 PRO 18 2.208 11.636 10.192 129 HB3 PRO 18 HB3 PRO 18 2.765 10.994 11.769 130 HG2 PRO 18 HG2 PRO 18 -0.035 11.155 10.687 131 HG3 PRO 18 HG3 PRO 18 0.830 9.742 11.365 132 HD2 PRO 18 HD2 PRO 18 -0.855 11.199 12.852 133 HD3 PRO 18 HD3 PRO 18 0.658 10.515 13.543 134 H GLY 19 H GLY 19 -0.699 13.659 11.676 135 HA2 GLY 19 HA2 GLY 19 -0.465 15.960 10.055 136 HA3 GLY 19 HA3 GLY 19 -0.770 14.543 9.001 137 H THR 20 H THR 20 -2.981 15.542 8.663 138 HA THR 20 HA THR 20 -4.752 15.322 11.052 139 HB THR 20 HB THR 20 -5.026 17.300 9.529 140 HG1 THR 20 HG1 THR 20 -7.120 15.397 9.763 141 HG21 THR 20 HG21 THR 20 -5.967 15.235 7.494 142 HG22 THR 20 HG22 THR 20 -4.496 16.226 7.364 143 HG23 THR 20 HG23 THR 20 -6.092 16.998 7.339 144 H GLU 21 H GLU 21 -3.396 13.380 8.755 145 HA GLU 21 HA GLU 21 -5.647 11.428 8.866 146 HB2 GLU 21 HB2 GLU 21 -5.126 10.806 6.551 147 HB3 GLU 21 HB3 GLU 21 -5.630 12.492 6.661 148 HG2 GLU 21 HG2 GLU 21 -2.687 11.750 6.617 149 HG3 GLU 21 HG3 GLU 21 -3.625 11.873 5.125 150 H ASN 22 H ASN 22 -4.890 9.243 8.191 151 HA ASN 22 HA ASN 22 -3.727 7.388 8.829 152 HB2 ASN 22 HB2 ASN 22 -2.810 8.130 6.640 153 HB3 ASN 22 HB3 ASN 22 -1.451 8.868 7.504 154 HD21 ASN 22 HD21 ASN 22 0.098 7.493 6.619 155 HD22 ASN 22 HD22 ASN 22 0.195 5.801 7.093 156 H SER 23 H SER 23 -3.795 7.855 11.191 157 HA SER 23 HA SER 23 -1.533 8.819 12.585 158 HB2 SER 23 HB2 SER 23 -3.397 6.673 13.601 159 HB3 SER 23 HB3 SER 23 -2.601 7.977 14.511 160 HG SER 23 HG SER 23 -4.744 8.545 14.128 161 H ASP 24 H ASP 24 -1.456 6.091 10.642 162 HA ASP 24 HA ASP 24 0.124 4.370 12.417 163 HB2 ASP 24 HB2 ASP 24 -0.493 2.863 10.884 164 HB3 ASP 24 HB3 ASP 24 -1.200 4.130 9.879 165 H GLN 25 H GLN 25 0.620 6.962 10.130 166 HA GLN 25 HA GLN 25 3.365 6.463 9.522 167 HB2 GLN 25 HB2 GLN 25 1.782 7.897 8.248 168 HB3 GLN 25 HB3 GLN 25 1.807 9.067 9.555 169 HG2 GLN 25 HG2 GLN 25 4.188 9.488 9.173 170 HG3 GLN 25 HG3 GLN 25 4.204 8.263 7.892 171 HE21 GLN 25 HE21 GLN 25 4.880 11.075 7.670 172 HE22 GLN 25 HE22 GLN 25 3.760 11.754 6.512 173 H ALA 26 H ALA 26 5.252 7.303 10.394 174 HA ALA 26 HA ALA 26 5.328 7.634 13.216 175 HB1 ALA 26 HB1 ALA 26 7.698 8.285 12.828 176 HB2 ALA 26 HB2 ALA 26 7.260 6.828 11.910 177 HB3 ALA 26 HB3 ALA 26 7.375 8.403 11.088 178 H ARG 27 H ARG 27 5.032 9.369 14.469 179 HA ARG 27 HA ARG 27 3.939 11.777 13.410 180 HB2 ARG 27 HB2 ARG 27 3.559 10.783 15.722 181 HB3 ARG 27 HB3 ARG 27 5.155 11.402 16.172 182 HG2 ARG 27 HG2 ARG 27 4.343 13.719 15.563 183 HG3 ARG 27 HG3 ARG 27 2.746 13.017 15.302 184 HD2 ARG 27 HD2 ARG 27 2.380 13.540 17.450 185 HD3 ARG 27 HD3 ARG 27 3.323 12.078 17.806 186 HE ARG 27 HE ARG 27 5.151 14.206 17.478 187 HH11 ARG 27 HH11 ARG 27 2.574 13.361 19.750 188 HH12 ARG 27 HH12 ARG 27 3.317 14.238 21.061 189 HH21 ARG 27 HH21 ARG 27 6.037 15.294 19.197 190 HH22 ARG 27 HH22 ARG 27 5.237 15.318 20.746 191 H ASP 28 H ASP 28 7.188 10.958 14.518 192 HA ASP 28 HA ASP 28 8.236 13.459 13.356 193 HB2 ASP 28 HB2 ASP 28 7.524 13.972 15.709 194 HB3 ASP 28 HB3 ASP 28 8.633 12.723 16.282 195 H GLY 29 H GLY 29 9.401 12.176 11.911 196 HA2 GLY 29 HA2 GLY 29 11.161 10.888 11.175 197 HA3 GLY 29 HA3 GLY 29 11.972 11.408 12.656 198 H THR 30 H THR 30 12.532 9.983 14.054 199 HA THR 30 HA THR 30 13.015 7.998 14.987 200 HB THR 30 HB THR 30 10.921 8.764 16.143 201 HG1 THR 30 HG1 THR 30 11.483 7.215 17.397 202 HG21 THR 30 HG21 THR 30 9.610 6.727 14.317 203 HG22 THR 30 HG22 THR 30 9.119 8.399 14.671 204 HG23 THR 30 HG23 THR 30 8.951 7.140 15.912 205 H LEU 31 H LEU 31 11.771 5.522 15.166 206 HA LEU 31 HA LEU 31 13.098 4.296 12.911 207 HB2 LEU 31 HB2 LEU 31 11.349 3.072 15.071 208 HB3 LEU 31 HB3 LEU 31 12.442 2.187 14.012 209 HG LEU 31 HG LEU 31 13.311 4.235 16.088 210 HD11 LEU 31 HD11 LEU 31 14.013 2.289 17.413 211 HD12 LEU 31 HD12 LEU 31 13.358 1.194 16.178 212 HD13 LEU 31 HD13 LEU 31 12.264 2.250 17.105 213 HD21 LEU 31 HD21 LEU 31 14.933 2.220 14.489 214 HD22 LEU 31 HD22 LEU 31 15.558 3.293 15.756 215 HD23 LEU 31 HD23 LEU 31 14.936 3.985 14.243 216 HA PRO 32 HA PRO 32 9.355 3.872 10.532 217 HB2 PRO 32 HB2 PRO 32 10.130 2.098 8.612 218 HB3 PRO 32 HB3 PRO 32 10.707 3.796 8.635 219 HG2 PRO 32 HG2 PRO 32 12.059 1.323 9.616 220 HG3 PRO 32 HG3 PRO 32 12.704 2.637 8.597 221 HD2 PRO 32 HD2 PRO 32 13.143 2.501 11.296 222 HD3 PRO 32 HD3 PRO 32 13.014 4.061 10.411 223 H TYR 33 H TYR 33 7.904 2.026 9.763 224 HA TYR 33 HA TYR 33 6.951 0.702 11.946 225 HB2 TYR 33 HB2 TYR 33 5.573 -0.619 10.445 226 HB3 TYR 33 HB3 TYR 33 5.698 1.047 9.873 227 HD1 TYR 33 HD2 TYR 33 7.375 1.538 7.925 228 HD2 TYR 33 HD1 TYR 33 6.111 -2.442 8.997 229 HE1 TYR 33 HE2 TYR 33 8.105 0.698 5.698 230 HE2 TYR 33 HE1 TYR 33 6.858 -3.258 6.754 231 HH TYR 33 HH TYR 33 8.240 -1.093 4.294 232 H THR 34 H THR 34 7.445 -0.847 13.182 233 HA THR 34 HA THR 34 8.483 -2.618 14.134 234 HB THR 34 HB THR 34 8.245 -4.796 12.803 235 HG1 THR 34 HG1 THR 34 8.230 -3.238 10.757 236 HG21 THR 34 HG21 THR 34 5.773 -3.025 12.821 237 HG22 THR 34 HG22 THR 34 6.449 -3.793 14.279 238 HG23 THR 34 HG23 THR 34 5.842 -4.796 12.946 239 H LYS 35 H LYS 35 10.420 -0.955 12.331 240 HA LYS 35 HA LYS 35 12.265 -2.545 11.054 241 HB2 LYS 35 HB2 LYS 35 12.243 -0.108 11.086 242 HB3 LYS 35 HB3 LYS 35 12.788 -0.088 12.756 243 HG2 LYS 35 HG2 LYS 35 14.643 -1.636 11.160 244 HG3 LYS 35 HG3 LYS 35 14.380 -0.048 10.410 245 HD2 LYS 35 HD2 LYS 35 14.968 1.097 12.441 246 HD3 LYS 35 HD3 LYS 35 14.939 -0.414 13.357 247 HE2 LYS 35 HE2 LYS 35 16.846 -1.235 11.926 248 HE3 LYS 35 HE3 LYS 35 16.970 0.417 11.272 249 HZ1 LYS 35 HZ1 LYS 35 17.185 -0.362 14.139 250 HZ2 LYS 35 HZ2 LYS 35 17.271 1.190 13.580 251 HZ3 LYS 35 HZ3 LYS 35 18.444 0.101 13.173 252 H ASP 36 H ASP 36 12.688 -1.662 14.545 253 HA ASP 36 HA ASP 36 14.881 -3.645 14.641 254 HB2 ASP 36 HB2 ASP 36 13.799 -1.624 16.619 255 HB3 ASP 36 HB3 ASP 36 15.014 -2.836 17.062 256 H ARG 37 H ARG 37 11.524 -3.550 15.137 257 HA ARG 37 HA ARG 37 11.300 -5.359 17.355 258 HB2 ARG 37 HB2 ARG 37 9.438 -3.926 16.498 259 HB3 ARG 37 HB3 ARG 37 9.340 -4.963 15.065 260 HG2 ARG 37 HG2 ARG 37 8.726 -6.878 16.413 261 HG3 ARG 37 HG3 ARG 37 9.000 -5.966 17.906 262 HD2 ARG 37 HD2 ARG 37 7.145 -4.477 17.374 263 HD3 ARG 37 HD3 ARG 37 6.918 -5.295 15.818 264 HE ARG 37 HE ARG 37 5.883 -7.094 16.853 265 HH11 ARG 37 HH11 ARG 37 7.272 -5.029 19.390 266 HH12 ARG 37 HH12 ARG 37 6.370 -5.830 20.643 267 HH21 ARG 37 HH21 ARG 37 4.813 -8.069 18.496 268 HH22 ARG 37 HH22 ARG 37 5.030 -7.538 20.153 269 H PHE 38 H PHE 38 11.931 -5.811 13.918 270 HA PHE 38 HA PHE 38 11.218 -8.536 13.674 271 HB2 PHE 38 HB2 PHE 38 13.586 -7.115 12.397 272 HB3 PHE 38 HB3 PHE 38 12.826 -8.601 11.823 273 HD1 PHE 38 HD2 PHE 38 9.903 -7.879 12.083 274 HD2 PHE 38 HD1 PHE 38 13.263 -5.611 10.631 275 HE1 PHE 38 HE2 PHE 38 8.380 -6.535 10.658 276 HE2 PHE 38 HE1 PHE 38 11.737 -4.260 9.203 277 HZ PHE 38 HZ PHE 38 9.290 -4.725 9.205 278 H TYR 39 H TYR 39 13.894 -7.117 15.404 279 HA TYR 39 HA TYR 39 15.216 -9.785 15.588 280 HB2 TYR 39 HB2 TYR 39 16.300 -7.091 16.458 281 HB3 TYR 39 HB3 TYR 39 17.200 -8.594 16.202 282 HD1 TYR 39 HD2 TYR 39 17.267 -9.533 13.763 283 HD2 TYR 39 HD1 TYR 39 16.018 -5.522 14.704 284 HE1 TYR 39 HE2 TYR 39 17.649 -8.850 11.393 285 HE2 TYR 39 HE1 TYR 39 16.385 -4.854 12.330 286 HH TYR 39 HH TYR 39 17.582 -7.152 9.873 287 H LEU 40 H LEU 40 13.678 -7.198 17.414 288 HA LEU 40 HA LEU 40 14.524 -8.219 19.999 289 HB2 LEU 40 HB2 LEU 40 12.889 -5.979 18.927 290 HB3 LEU 40 HB3 LEU 40 12.452 -6.538 20.527 291 HG LEU 40 HG LEU 40 13.931 -4.590 20.579 292 HD11 LEU 40 HD11 LEU 40 15.259 -7.081 21.719 293 HD12 LEU 40 HD12 LEU 40 13.886 -6.220 22.452 294 HD13 LEU 40 HD13 LEU 40 15.456 -5.409 22.290 295 HD21 LEU 40 HD21 LEU 40 16.092 -6.411 19.447 296 HD22 LEU 40 HD22 LEU 40 16.290 -4.735 20.004 297 HD23 LEU 40 HD23 LEU 40 15.304 -5.079 18.571 298 H GLN 41 H GLN 41 11.536 -8.433 18.044 299 HA GLN 41 HA GLN 41 10.509 -10.410 20.044 300 HB2 GLN 41 HB2 GLN 41 9.075 -8.146 18.646 301 HB3 GLN 41 HB3 GLN 41 8.207 -9.606 19.107 302 HG2 GLN 41 HG2 GLN 41 7.825 -8.201 20.909 303 HG3 GLN 41 HG3 GLN 41 9.138 -9.237 21.474 304 HE21 GLN 41 HE21 GLN 41 10.599 -8.162 22.604 305 HE22 GLN 41 HE22 GLN 41 11.066 -6.498 22.347 306 HA PRO 42 HA PRO 42 10.055 -12.899 16.399 307 HB2 PRO 42 HB2 PRO 42 7.843 -14.424 16.901 308 HB3 PRO 42 HB3 PRO 42 9.398 -14.705 17.751 309 HG2 PRO 42 HG2 PRO 42 6.995 -13.130 18.670 310 HG3 PRO 42 HG3 PRO 42 7.894 -14.419 19.536 311 HD2 PRO 42 HD2 PRO 42 8.375 -11.801 19.997 312 HD3 PRO 42 HD3 PRO 42 9.711 -13.005 19.988 313 H LEU 43 H LEU 43 8.721 -12.948 14.478 314 HA LEU 43 HA LEU 43 6.636 -10.825 14.452 315 HB2 LEU 43 HB2 LEU 43 7.249 -10.271 12.249 316 HB3 LEU 43 HB3 LEU 43 8.647 -10.222 13.289 317 HG LEU 43 HG LEU 43 8.119 -12.207 11.065 318 HD11 LEU 43 HD11 LEU 43 9.989 -11.092 9.998 319 HD12 LEU 43 HD12 LEU 43 10.263 -10.083 11.433 320 HD13 LEU 43 HD13 LEU 43 8.787 -9.874 10.464 321 HD21 LEU 43 HD21 LEU 43 9.348 -13.464 12.720 322 HD22 LEU 43 HD22 LEU 43 10.460 -12.099 13.012 323 HD23 LEU 43 HD23 LEU 43 10.485 -12.968 11.458 324 HA PRO 44 HA PRO 44 4.362 -14.670 13.424 325 HB2 PRO 44 HB2 PRO 44 2.002 -14.024 14.641 326 HB3 PRO 44 HB3 PRO 44 3.421 -14.607 15.570 327 HG2 PRO 44 HG2 PRO 44 2.531 -11.798 15.052 328 HG3 PRO 44 HG3 PRO 44 2.890 -12.593 16.618 329 HD2 PRO 44 HD2 PRO 44 4.724 -11.075 15.372 330 HD3 PRO 44 HD3 PRO 44 5.198 -12.590 16.214 331 HA PRO 45 HA PRO 45 2.300 -13.139 9.890 332 HB2 PRO 45 HB2 PRO 45 0.007 -14.609 9.585 333 HB3 PRO 45 HB3 PRO 45 1.646 -15.292 9.339 334 HG2 PRO 45 HG2 PRO 45 -0.073 -15.396 11.802 335 HG3 PRO 45 HG3 PRO 45 0.721 -16.744 10.920 336 HD2 PRO 45 HD2 PRO 45 1.884 -15.676 13.077 337 HD3 PRO 45 HD3 PRO 45 2.877 -16.082 11.633 338 H THR 46 H THR 46 0.496 -12.958 12.891 339 HA THR 46 HA THR 46 -1.653 -11.295 11.895 340 HB THR 46 HB THR 46 -1.620 -10.568 14.408 341 HG1 THR 46 HG1 THR 46 -0.326 -11.802 15.706 342 HG21 THR 46 HG21 THR 46 -3.191 -12.253 13.477 343 HG22 THR 46 HG22 THR 46 -2.649 -12.690 15.111 344 HG23 THR 46 HG23 THR 46 -1.955 -13.516 13.698 345 H GLU 47 H GLU 47 1.578 -10.686 13.338 346 HA GLU 47 HA GLU 47 1.281 -7.803 13.169 347 HB2 GLU 47 HB2 GLU 47 3.719 -9.564 13.574 348 HB3 GLU 47 HB3 GLU 47 3.715 -7.795 13.657 349 HG2 GLU 47 HG2 GLU 47 2.021 -7.931 15.490 350 HG3 GLU 47 HG3 GLU 47 2.181 -9.689 15.465 351 H ALA 48 H ALA 48 1.963 -10.243 10.856 352 HA ALA 48 HA ALA 48 3.659 -8.700 9.125 353 HB1 ALA 48 HB1 ALA 48 3.004 -10.264 7.376 354 HB2 ALA 48 HB2 ALA 48 3.340 -11.148 8.885 355 HB3 ALA 48 HB3 ALA 48 1.663 -10.860 8.373 356 H ALA 49 H ALA 49 0.226 -8.615 9.883 357 HA ALA 49 HA ALA 49 -0.632 -7.168 7.556 358 HB1 ALA 49 HB1 ALA 49 -1.742 -7.131 10.398 359 HB2 ALA 49 HB2 ALA 49 -2.581 -6.557 8.941 360 HB3 ALA 49 HB3 ALA 49 -2.196 -8.282 9.120 361 H GLN 50 H GLN 50 1.059 -6.231 10.511 362 HA GLN 50 HA GLN 50 0.527 -3.407 10.243 363 HB2 GLN 50 HB2 GLN 50 2.768 -4.828 11.714 364 HB3 GLN 50 HB3 GLN 50 2.333 -3.128 11.888 365 HG2 GLN 50 HG2 GLN 50 0.105 -3.779 12.739 366 HG3 GLN 50 HG3 GLN 50 0.532 -5.487 12.559 367 HE21 GLN 50 HE21 GLN 50 2.058 -2.566 13.984 368 HE22 GLN 50 HE22 GLN 50 2.466 -3.348 15.491 369 H ARG 51 H ARG 51 2.763 -5.600 8.717 370 HA ARG 51 HA ARG 51 4.439 -3.380 7.656 371 HB2 ARG 51 HB2 ARG 51 4.320 -6.362 7.092 372 HB3 ARG 51 HB3 ARG 51 5.432 -5.256 6.290 373 HG2 ARG 51 HG2 ARG 51 6.900 -5.354 7.964 374 HG3 ARG 51 HG3 ARG 51 5.662 -4.993 9.179 375 HD2 ARG 51 HD2 ARG 51 6.842 -7.217 9.453 376 HD3 ARG 51 HD3 ARG 51 5.075 -7.288 9.412 377 HE ARG 51 HE ARG 51 5.893 -7.676 6.759 378 HH11 ARG 51 HH11 ARG 51 6.358 -9.397 9.821 379 HH12 ARG 51 HH12 ARG 51 6.483 -10.943 9.028 380 HH21 ARG 51 HH21 ARG 51 6.026 -9.624 5.839 381 HH22 ARG 51 HH22 ARG 51 6.311 -11.077 6.786 382 H ALA 52 H ALA 52 1.966 -5.723 6.688 383 HA ALA 52 HA ALA 52 1.895 -5.182 3.946 384 HB1 ALA 52 HB1 ALA 52 -0.450 -5.950 5.713 385 HB2 ALA 52 HB2 ALA 52 -0.293 -6.227 3.964 386 HB3 ALA 52 HB3 ALA 52 0.774 -7.085 5.102 387 H LYS 53 H LYS 53 0.123 -3.471 6.584 388 HA LYS 53 HA LYS 53 -1.472 -1.890 4.864 389 HB2 LYS 53 HB2 LYS 53 -1.620 -0.268 6.705 390 HB3 LYS 53 HB3 LYS 53 -1.914 -1.924 7.232 391 HG2 LYS 53 HG2 LYS 53 0.206 -2.068 8.299 392 HG3 LYS 53 HG3 LYS 53 0.721 -0.514 7.623 393 HD2 LYS 53 HD2 LYS 53 -0.878 0.698 8.909 394 HD3 LYS 53 HD3 LYS 53 -1.708 -0.788 9.409 395 HE2 LYS 53 HE2 LYS 53 -0.263 0.209 11.192 396 HE3 LYS 53 HE3 LYS 53 0.146 -1.464 10.782 397 HZ1 LYS 53 HZ1 LYS 53 1.998 -0.695 9.504 398 HZ2 LYS 53 HZ2 LYS 53 2.091 0.003 10.997 399 HZ3 LYS 53 HZ3 LYS 53 1.575 0.895 9.711 400 H VAL 54 H VAL 54 1.959 -1.530 5.759 401 HA VAL 54 HA VAL 54 2.067 1.175 4.653 402 HB VAL 54 HB VAL 54 4.388 -0.621 5.500 403 HG11 VAL 54 HG11 VAL 54 4.131 2.395 5.046 404 HG12 VAL 54 HG12 VAL 54 5.545 1.607 5.774 405 HG13 VAL 54 HG13 VAL 54 5.110 1.254 4.093 406 HG21 VAL 54 HG21 VAL 54 2.702 1.361 7.094 407 HG22 VAL 54 HG22 VAL 54 2.978 -0.371 7.426 408 HG23 VAL 54 HG23 VAL 54 4.301 0.785 7.614 409 H SER 55 H SER 55 3.200 -2.118 3.678 410 HA SER 55 HA SER 55 4.456 -1.164 1.274 411 HB2 SER 55 HB2 SER 55 4.180 -3.585 0.531 412 HB3 SER 55 HB3 SER 55 5.084 -3.311 2.032 413 HG SER 55 HG SER 55 3.748 -4.759 2.757 414 H ALA 56 H ALA 56 1.106 -1.898 2.107 415 HA ALA 56 HA ALA 56 0.120 -1.733 -0.616 416 HB1 ALA 56 HB1 ALA 56 -1.066 -2.781 1.370 417 HB2 ALA 56 HB2 ALA 56 -1.407 -1.128 1.931 418 HB3 ALA 56 HB3 ALA 56 -2.036 -1.696 0.366 419 H SER 57 H SER 57 0.698 0.627 1.994 420 HA SER 57 HA SER 57 -0.672 2.785 0.663 421 HB2 SER 57 HB2 SER 57 1.437 2.817 2.850 422 HB3 SER 57 HB3 SER 57 0.465 4.212 2.333 423 HG SER 57 HG SER 57 -0.405 1.810 3.584 424 H GLU 58 H GLU 58 2.616 1.503 0.475 425 HA GLU 58 HA GLU 58 3.839 3.789 -0.754 426 HB2 GLU 58 HB2 GLU 58 4.357 0.809 -0.927 427 HB3 GLU 58 HB3 GLU 58 5.340 1.984 -1.796 428 HG2 GLU 58 HG2 GLU 58 4.955 1.997 1.213 429 HG3 GLU 58 HG3 GLU 58 6.310 1.218 0.383 430 H ILE 59 H ILE 59 1.713 1.274 -1.998 431 HA ILE 59 HA ILE 59 2.249 1.704 -4.789 432 HB ILE 59 HB ILE 59 -0.256 0.642 -3.408 433 HG12 ILE 59 HG12 ILE 59 2.010 -0.913 -4.711 434 HG13 ILE 59 HG13 ILE 59 1.969 -0.555 -2.987 435 HG21 ILE 59 HG21 ILE 59 0.634 0.273 -6.309 436 HG22 ILE 59 HG22 ILE 59 -0.840 -0.380 -5.562 437 HG23 ILE 59 HG23 ILE 59 -0.667 1.364 -5.785 438 HD11 ILE 59 HD11 ILE 59 0.036 -2.288 -4.526 439 HD12 ILE 59 HD12 ILE 59 1.165 -2.765 -3.247 440 HD13 ILE 59 HD13 ILE 59 -0.243 -1.753 -2.855 441 H LEU 60 H LEU 60 0.164 3.317 -2.410 442 HA LEU 60 HA LEU 60 -1.408 4.826 -4.290 443 HB2 LEU 60 HB2 LEU 60 -0.551 5.571 -1.474 444 HB3 LEU 60 HB3 LEU 60 -1.842 6.332 -2.381 445 HG LEU 60 HG LEU 60 -1.908 3.414 -1.551 446 HD11 LEU 60 HD11 LEU 60 -3.333 4.126 0.312 447 HD12 LEU 60 HD12 LEU 60 -3.119 5.832 -0.152 448 HD13 LEU 60 HD13 LEU 60 -1.732 4.884 0.434 449 HD21 LEU 60 HD21 LEU 60 -4.076 5.354 -2.414 450 HD22 LEU 60 HD22 LEU 60 -4.319 3.663 -1.916 451 HD23 LEU 60 HD23 LEU 60 -3.411 4.026 -3.397 452 H ASN 61 H ASN 61 1.782 5.284 -2.819 453 HA ASN 61 HA ASN 61 2.074 8.052 -3.530 454 HB2 ASN 61 HB2 ASN 61 3.365 6.806 -1.768 455 HB3 ASN 61 HB3 ASN 61 4.241 5.975 -3.060 456 HD21 ASN 61 HD21 ASN 61 6.236 6.755 -2.838 457 HD22 ASN 61 HD22 ASN 61 6.644 8.452 -2.944 458 H VAL 62 H VAL 62 2.436 5.120 -5.414 459 HA VAL 62 HA VAL 62 4.301 6.205 -7.315 460 HB VAL 62 HB VAL 62 2.343 3.980 -7.982 461 HG11 VAL 62 HG11 VAL 62 5.266 4.512 -8.717 462 HG12 VAL 62 HG12 VAL 62 4.286 3.140 -9.280 463 HG13 VAL 62 HG13 VAL 62 3.870 4.790 -9.781 464 HG21 VAL 62 HG21 VAL 62 4.050 2.412 -7.002 465 HG22 VAL 62 HG22 VAL 62 4.890 3.810 -6.298 466 HG23 VAL 62 HG23 VAL 62 3.242 3.398 -5.781 467 H LYS 63 H LYS 63 1.147 7.159 -6.699 468 HA LYS 63 HA LYS 63 0.040 7.762 -9.249 469 HB2 LYS 63 HB2 LYS 63 -0.925 8.214 -6.923 470 HB3 LYS 63 HB3 LYS 63 0.117 9.632 -6.854 471 HG2 LYS 63 HG2 LYS 63 -1.000 10.445 -8.973 472 HG3 LYS 63 HG3 LYS 63 -2.142 9.099 -8.809 473 HD2 LYS 63 HD2 LYS 63 -2.810 9.957 -6.591 474 HD3 LYS 63 HD3 LYS 63 -1.626 11.269 -6.745 475 HE2 LYS 63 HE2 LYS 63 -3.811 12.140 -7.329 476 HE3 LYS 63 HE3 LYS 63 -2.815 12.060 -8.795 477 HZ1 LYS 63 HZ1 LYS 63 -3.934 9.978 -9.356 478 HZ2 LYS 63 HZ2 LYS 63 -4.998 11.220 -9.246 479 HZ3 LYS 63 HZ3 LYS 63 -4.901 10.111 -8.020 480 H GLN 64 H GLN 64 2.820 9.116 -7.567 481 HA GLN 64 HA GLN 64 3.115 11.564 -8.956 482 HB2 GLN 64 HB2 GLN 64 5.201 9.654 -7.862 483 HB3 GLN 64 HB3 GLN 64 5.519 11.319 -8.365 484 HG2 GLN 64 HG2 GLN 64 4.037 12.179 -6.629 485 HG3 GLN 64 HG3 GLN 64 3.597 10.540 -6.146 486 HE21 GLN 64 HE21 GLN 64 4.495 12.115 -4.211 487 HE22 GLN 64 HE22 GLN 64 6.123 11.694 -3.749 488 H PHE 65 H PHE 65 3.424 8.354 -10.310 489 HA PHE 65 HA PHE 65 5.354 9.015 -12.350 490 HB2 PHE 65 HB2 PHE 65 5.064 6.820 -12.685 491 HB3 PHE 65 HB3 PHE 65 3.587 6.812 -11.722 492 HD1 PHE 65 HD1 PHE 65 4.938 7.301 -15.147 493 HD2 PHE 65 HD2 PHE 65 1.410 6.757 -12.759 494 HE1 PHE 65 HE1 PHE 65 3.593 6.997 -17.217 495 HE2 PHE 65 HE2 PHE 65 0.070 6.425 -14.820 496 HZ PHE 65 HZ PHE 65 1.147 6.569 -17.055 497 H ILE 66 H ILE 66 1.914 9.686 -11.914 498 HA ILE 66 HA ILE 66 1.202 10.138 -14.625 499 HB ILE 66 HB ILE 66 0.107 11.458 -12.081 500 HG12 ILE 66 HG12 ILE 66 -0.063 8.946 -12.208 501 HG13 ILE 66 HG13 ILE 66 -1.598 9.792 -12.066 502 HG21 ILE 66 HG21 ILE 66 -1.004 11.474 -14.932 503 HG22 ILE 66 HG22 ILE 66 -1.999 11.833 -13.497 504 HG23 ILE 66 HG23 ILE 66 -0.612 12.868 -13.901 505 HD11 ILE 66 HD11 ILE 66 -0.511 8.735 -14.710 506 HD12 ILE 66 HD12 ILE 66 -1.642 7.858 -13.658 507 HD13 ILE 66 HD13 ILE 66 -2.131 9.389 -14.402 508 H ASP 67 H ASP 67 2.343 12.572 -12.185 509 HA ASP 67 HA ASP 67 2.270 14.684 -14.184 510 HB2 ASP 67 HB2 ASP 67 3.433 16.026 -12.456 511 HB3 ASP 67 HB3 ASP 67 1.973 15.232 -11.843 512 H ARG 68 H ARG 68 4.648 12.340 -13.118 513 HA ARG 68 HA ARG 68 6.871 13.729 -14.422 514 HB2 ARG 68 HB2 ARG 68 6.560 10.933 -13.284 515 HB3 ARG 68 HB3 ARG 68 8.074 11.555 -13.966 516 HG2 ARG 68 HG2 ARG 68 8.234 13.257 -12.293 517 HG3 ARG 68 HG3 ARG 68 6.592 12.939 -11.727 518 HD2 ARG 68 HD2 ARG 68 7.301 10.661 -11.042 519 HD3 ARG 68 HD3 ARG 68 8.979 11.113 -11.436 520 HE ARG 68 HE ARG 68 8.088 13.163 -9.824 521 HH11 ARG 68 HH21 ARG 68 8.160 9.661 -9.338 522 HH12 ARG 68 HH22 ARG 68 8.240 9.825 -7.601 523 HH21 ARG 68 HH11 ARG 68 8.258 13.272 -7.628 524 HH22 ARG 68 HH12 ARG 68 8.288 11.815 -6.661 525 H LYS 69 H LYS 69 4.264 11.925 -15.557 526 HA LYS 69 HA LYS 69 3.736 11.024 -17.601 527 HB2 LYS 69 HB2 LYS 69 4.746 13.432 -17.990 528 HB3 LYS 69 HB3 LYS 69 6.034 12.558 -18.816 529 HG2 LYS 69 HG2 LYS 69 4.435 11.654 -20.409 530 HG3 LYS 69 HG3 LYS 69 3.085 12.378 -19.499 531 HD2 LYS 69 HD2 LYS 69 4.103 14.623 -19.852 532 HD3 LYS 69 HD3 LYS 69 5.358 13.873 -20.858 533 HE2 LYS 69 HE2 LYS 69 3.642 13.090 -22.434 534 HE3 LYS 69 HE3 LYS 69 2.367 13.781 -21.401 535 HZ1 LYS 69 HZ1 LYS 69 2.953 15.284 -23.209 536 HZ2 LYS 69 HZ2 LYS 69 4.528 15.335 -22.715 537 HZ3 LYS 69 HZ3 LYS 69 3.343 15.966 -21.759 538 H ALA 70 H ALA 70 5.690 9.614 -15.956 539 HA ALA 70 HA ALA 70 7.762 8.670 -17.802 540 HB1 ALA 70 HB1 ALA 70 8.770 7.698 -15.824 541 HB2 ALA 70 HB2 ALA 70 8.271 9.365 -15.479 542 HB3 ALA 70 HB3 ALA 70 7.296 8.003 -14.871 543 H TRP 71 H TRP 71 6.008 7.596 -19.164 544 HA TRP 71 HA TRP 71 4.492 5.404 -18.523 545 HB2 TRP 71 HB2 TRP 71 6.138 5.354 -21.029 546 HB3 TRP 71 HB3 TRP 71 4.468 4.864 -20.767 547 HD1 TRP 71 HD1 TRP 71 6.431 7.642 -22.141 548 HE1 TRP 71 HE1 TRP 71 5.076 9.757 -22.496 549 HE3 TRP 71 HE3 TRP 71 2.355 6.352 -19.333 550 HZ2 TRP 71 HZ2 TRP 71 2.511 10.753 -21.724 551 HZ3 TRP 71 HZ3 TRP 71 0.446 7.962 -19.175 552 HH2 TRP 71 HH2 TRP 71 0.544 10.149 -20.365 553 HA PRO 72 HA PRO 72 7.619 2.078 -18.897 554 HB2 PRO 72 HB2 PRO 72 10.307 2.370 -18.957 555 HB3 PRO 72 HB3 PRO 72 9.308 2.571 -20.434 556 HG2 PRO 72 HG2 PRO 72 10.368 4.683 -18.567 557 HG3 PRO 72 HG3 PRO 72 10.506 4.587 -20.352 558 HD2 PRO 72 HD2 PRO 72 8.583 6.067 -19.123 559 HD3 PRO 72 HD3 PRO 72 8.282 5.216 -20.675 560 H SER 73 H SER 73 8.414 4.768 -16.780 561 HA SER 73 HA SER 73 9.956 3.218 -14.884 562 HB2 SER 73 HB2 SER 73 10.071 5.715 -15.148 563 HB3 SER 73 HB3 SER 73 8.456 5.817 -14.416 564 HG SER 73 HG SER 73 10.077 6.082 -12.849 565 H LEU 74 H LEU 74 6.517 4.022 -15.292 566 HA LEU 74 HA LEU 74 5.669 3.225 -12.693 567 HB2 LEU 74 HB2 LEU 74 4.223 4.419 -14.362 568 HB3 LEU 74 HB3 LEU 74 4.180 2.946 -15.335 569 HG LEU 74 HG LEU 74 3.175 1.777 -13.300 570 HD11 LEU 74 HD11 LEU 74 2.778 4.642 -12.398 571 HD12 LEU 74 HD12 LEU 74 3.782 3.419 -11.604 572 HD13 LEU 74 HD13 LEU 74 2.027 3.217 -11.664 573 HD21 LEU 74 HD21 LEU 74 0.967 2.478 -13.743 574 HD22 LEU 74 HD22 LEU 74 1.891 2.443 -15.242 575 HD23 LEU 74 HD23 LEU 74 1.541 3.999 -14.463 576 H GLN 75 H GLN 75 6.119 1.384 -15.707 577 HA GLN 75 HA GLN 75 5.026 -1.061 -14.866 578 HB2 GLN 75 HB2 GLN 75 5.829 -0.408 -17.175 579 HB3 GLN 75 HB3 GLN 75 7.489 -0.619 -16.629 580 HG2 GLN 75 HG2 GLN 75 5.502 -2.887 -16.423 581 HG3 GLN 75 HG3 GLN 75 6.308 -2.529 -17.954 582 HE21 GLN 75 HE21 GLN 75 6.439 -4.768 -15.851 583 HE22 GLN 75 HE22 GLN 75 8.158 -4.993 -15.638 584 H ASN 76 H ASN 76 8.186 0.399 -14.180 585 HA ASN 76 HA ASN 76 9.194 -2.038 -12.907 586 HB2 ASN 76 HB2 ASN 76 10.724 -0.460 -14.006 587 HB3 ASN 76 HB3 ASN 76 10.222 0.823 -12.900 588 HD21 ASN 76 HD21 ASN 76 11.801 1.231 -11.530 589 HD22 ASN 76 HD22 ASN 76 12.749 0.024 -10.696 590 H ASP 77 H ASP 77 8.545 1.294 -11.612 591 HA ASP 77 HA ASP 77 8.920 0.398 -8.939 592 HB2 ASP 77 HB2 ASP 77 9.116 2.762 -9.756 593 HB3 ASP 77 HB3 ASP 77 7.346 2.835 -9.819 594 H LEU 78 H LEU 78 5.843 0.762 -10.796 595 HA LEU 78 HA LEU 78 4.197 0.557 -8.457 596 HB2 LEU 78 HB2 LEU 78 3.495 1.282 -10.765 597 HB3 LEU 78 HB3 LEU 78 3.567 -0.398 -11.266 598 HG LEU 78 HG LEU 78 1.786 -0.914 -9.574 599 HD11 LEU 78 HD11 LEU 78 1.612 2.122 -9.390 600 HD12 LEU 78 HD12 LEU 78 2.049 1.011 -8.073 601 HD13 LEU 78 HD13 LEU 78 0.411 0.978 -8.751 602 HD21 LEU 78 HD21 LEU 78 1.091 1.175 -11.671 603 HD22 LEU 78 HD22 LEU 78 -0.005 -0.037 -10.978 604 HD23 LEU 78 HD23 LEU 78 1.354 -0.551 -11.993 605 H ARG 79 H ARG 79 5.629 -1.829 -10.644 606 HA ARG 79 HA ARG 79 4.268 -4.042 -9.321 607 HB2 ARG 79 HB2 ARG 79 6.541 -4.048 -11.332 608 HB3 ARG 79 HB3 ARG 79 5.578 -5.452 -10.835 609 HG2 ARG 79 HG2 ARG 79 3.511 -4.223 -11.684 610 HG3 ARG 79 HG3 ARG 79 4.595 -2.983 -12.335 611 HD2 ARG 79 HD2 ARG 79 4.363 -4.290 -14.200 612 HD3 ARG 79 HD3 ARG 79 5.774 -5.070 -13.468 613 HE ARG 79 HE ARG 79 4.364 -6.858 -12.696 614 HH11 ARG 79 HH11 ARG 79 2.631 -4.642 -14.886 615 HH12 ARG 79 HH12 ARG 79 1.339 -5.810 -15.116 616 HH21 ARG 79 HH21 ARG 79 2.662 -8.239 -13.118 617 HH22 ARG 79 HH22 ARG 79 1.357 -7.735 -14.184 618 H LEU 80 H LEU 80 7.343 -2.346 -8.920 619 HA LEU 80 HA LEU 80 8.565 -4.391 -7.277 620 HB2 LEU 80 HB2 LEU 80 8.940 -1.401 -7.532 621 HB3 LEU 80 HB3 LEU 80 9.761 -2.309 -6.274 622 HG LEU 80 HG LEU 80 10.092 -2.855 -9.238 623 HD11 LEU 80 HD11 LEU 80 10.914 -0.615 -8.606 624 HD12 LEU 80 HD12 LEU 80 12.254 -1.713 -8.992 625 HD13 LEU 80 HD13 LEU 80 11.877 -1.335 -7.294 626 HD21 LEU 80 HD21 LEU 80 10.606 -4.821 -7.871 627 HD22 LEU 80 HD22 LEU 80 11.628 -3.837 -6.796 628 HD23 LEU 80 HD23 LEU 80 12.105 -4.108 -8.488 629 H ARG 81 H ARG 81 6.583 -1.460 -6.503 630 HA ARG 81 HA ARG 81 6.614 -1.951 -3.664 631 HB2 ARG 81 HB2 ARG 81 4.408 -0.614 -5.283 632 HB3 ARG 81 HB3 ARG 81 4.664 -0.474 -3.542 633 HG2 ARG 81 HG2 ARG 81 6.434 0.619 -5.742 634 HG3 ARG 81 HG3 ARG 81 5.430 1.540 -4.636 635 HD2 ARG 81 HD2 ARG 81 6.846 0.841 -2.762 636 HD3 ARG 81 HD3 ARG 81 7.840 -0.140 -3.860 637 HE ARG 81 HE ARG 81 8.083 2.175 -5.113 638 HH11 ARG 81 HH21 ARG 81 8.199 1.659 -1.607 639 HH12 ARG 81 HH22 ARG 81 9.190 3.060 -1.344 640 HH21 ARG 81 HH11 ARG 81 9.328 3.921 -4.696 641 HH22 ARG 81 HH12 ARG 81 9.840 4.313 -3.072 642 H ALA 82 H ALA 82 4.484 -3.016 -6.285 643 HA ALA 82 HA ALA 82 2.579 -4.363 -4.672 644 HB1 ALA 82 HB1 ALA 82 3.495 -5.260 -7.429 645 HB2 ALA 82 HB2 ALA 82 1.886 -5.419 -6.691 646 HB3 ALA 82 HB3 ALA 82 2.478 -3.825 -7.175 647 H SER 83 H SER 83 5.811 -5.386 -5.840 648 HA SER 83 HA SER 83 5.469 -8.149 -5.185 649 HB2 SER 83 HB2 SER 83 8.005 -6.478 -5.294 650 HB3 SER 83 HB3 SER 83 7.939 -8.250 -5.232 651 HG SER 83 HG SER 83 6.900 -6.550 -7.276 652 H TYR 84 H TYR 84 6.551 -5.351 -3.219 653 HA TYR 84 HA TYR 84 7.337 -6.943 -0.959 654 HB2 TYR 84 HB2 TYR 84 6.380 -4.072 -1.180 655 HB3 TYR 84 HB3 TYR 84 6.868 -4.812 0.347 656 HD1 TYR 84 HD1 TYR 84 9.234 -5.556 0.702 657 HD2 TYR 84 HD2 TYR 84 8.057 -3.330 -2.779 658 HE1 TYR 84 HE1 TYR 84 11.623 -5.015 0.238 659 HE2 TYR 84 HE2 TYR 84 10.451 -2.805 -3.250 660 HH TYR 84 HH TYR 84 13.096 -3.952 -1.145 661 H LEU 85 H LEU 85 4.281 -5.335 -1.880 662 HA LEU 85 HA LEU 85 2.861 -6.118 0.462 663 HB2 LEU 85 HB2 LEU 85 2.080 -4.373 -1.113 664 HB3 LEU 85 HB3 LEU 85 1.822 -5.609 -2.348 665 HG LEU 85 HG LEU 85 0.089 -6.672 -0.927 666 HD11 LEU 85 HD11 LEU 85 -0.799 -5.312 1.019 667 HD12 LEU 85 HD12 LEU 85 0.686 -4.345 0.932 668 HD13 LEU 85 HD13 LEU 85 0.775 -6.078 1.300 669 HD21 LEU 85 HD21 LEU 85 -0.382 -3.715 -1.382 670 HD22 LEU 85 HD22 LEU 85 -1.624 -4.975 -1.230 671 HD23 LEU 85 HD23 LEU 85 -0.516 -4.983 -2.618 672 H ARG 86 H ARG 86 3.459 -7.757 -2.616 673 HA ARG 86 HA ARG 86 1.491 -9.765 -2.316 674 HB2 ARG 86 HB2 ARG 86 2.940 -9.227 -4.367 675 HB3 ARG 86 HB3 ARG 86 4.186 -10.231 -3.625 676 HG2 ARG 86 HG2 ARG 86 3.038 -11.627 -5.181 677 HG3 ARG 86 HG3 ARG 86 2.446 -12.127 -3.584 678 HD2 ARG 86 HD2 ARG 86 0.399 -10.813 -3.891 679 HD3 ARG 86 HD3 ARG 86 1.030 -10.143 -5.395 680 HE ARG 86 HE ARG 86 0.929 -12.980 -5.590 681 HH11 ARG 86 HH11 ARG 86 -1.184 -10.147 -5.665 682 HH12 ARG 86 HH12 ARG 86 -2.382 -10.951 -6.643 683 HH21 ARG 86 HH21 ARG 86 -0.652 -13.935 -6.853 684 HH22 ARG 86 HH22 ARG 86 -2.080 -13.046 -7.307 685 H TYR 87 H TYR 87 4.930 -9.793 -1.157 686 HA TYR 87 HA TYR 87 4.486 -12.486 -0.127 687 HB2 TYR 87 HB2 TYR 87 6.679 -12.488 0.688 688 HB3 TYR 87 HB3 TYR 87 6.731 -11.684 -0.876 689 HD1 TYR 87 HD2 TYR 87 6.609 -10.934 2.831 690 HD2 TYR 87 HD1 TYR 87 7.881 -9.626 -1.073 691 HE1 TYR 87 HE2 TYR 87 7.836 -9.030 3.861 692 HE2 TYR 87 HE1 TYR 87 9.147 -7.756 -0.013 693 HH TYR 87 HH TYR 87 9.093 -7.165 3.501 694 H ASP 88 H ASP 88 4.250 -9.198 1.202 695 HA ASP 88 HA ASP 88 4.099 -9.999 3.953 696 HB2 ASP 88 HB2 ASP 88 3.230 -7.621 2.341 697 HB3 ASP 88 HB3 ASP 88 2.447 -7.868 3.906 698 H LEU 89 H LEU 89 1.555 -9.501 1.452 699 HA LEU 89 HA LEU 89 -0.595 -10.308 3.166 700 HB2 LEU 89 HB2 LEU 89 -0.239 -9.527 0.437 701 HB3 LEU 89 HB3 LEU 89 -1.092 -11.061 0.424 702 HG LEU 89 HG LEU 89 -2.620 -9.161 0.334 703 HD11 LEU 89 HD11 LEU 89 -2.811 -10.639 2.988 704 HD12 LEU 89 HD12 LEU 89 -3.374 -11.241 1.410 705 HD13 LEU 89 HD13 LEU 89 -4.126 -9.811 2.136 706 HD21 LEU 89 HD21 LEU 89 -1.685 -8.427 3.130 707 HD22 LEU 89 HD22 LEU 89 -2.881 -7.589 2.120 708 HD23 LEU 89 HD23 LEU 89 -1.173 -7.591 1.647 709 H LYS 90 H LYS 90 1.582 -12.154 1.034 710 HA LYS 90 HA LYS 90 0.167 -14.604 1.212 711 HB2 LYS 90 HB2 LYS 90 2.233 -13.887 -0.246 712 HB3 LYS 90 HB3 LYS 90 3.186 -14.462 1.122 713 HG2 LYS 90 HG2 LYS 90 3.080 -16.282 -0.346 714 HG3 LYS 90 HG3 LYS 90 1.851 -16.647 0.882 715 HD2 LYS 90 HD2 LYS 90 0.152 -15.543 -0.694 716 HD3 LYS 90 HD3 LYS 90 1.426 -15.556 -1.926 717 HE2 LYS 90 HE2 LYS 90 0.319 -17.952 -0.440 718 HE3 LYS 90 HE3 LYS 90 -0.073 -17.494 -2.108 719 HZ1 LYS 90 HZ1 LYS 90 1.625 -19.220 -2.035 720 HZ2 LYS 90 HZ2 LYS 90 2.619 -18.270 -1.124 721 HZ3 LYS 90 HZ3 LYS 90 2.265 -17.840 -2.676 722 H THR 91 H THR 91 2.210 -12.902 3.492 723 HA THR 91 HA THR 91 2.586 -15.240 5.212 724 HB THR 91 HB THR 91 3.007 -12.293 5.897 725 HG1 THR 91 HG1 THR 91 4.256 -12.868 4.077 726 HG21 THR 91 HG21 THR 91 4.646 -13.210 7.501 727 HG22 THR 91 HG22 THR 91 4.192 -14.861 7.023 728 HG23 THR 91 HG23 THR 91 3.010 -13.809 7.839 729 H VAL 92 H VAL 92 0.533 -12.247 5.213 730 HA VAL 92 HA VAL 92 -0.647 -12.708 7.748 731 HB VAL 92 HB VAL 92 -1.945 -11.346 5.330 732 HG11 VAL 92 HG11 VAL 92 -3.668 -11.772 6.973 733 HG12 VAL 92 HG12 VAL 92 -2.592 -11.314 8.317 734 HG13 VAL 92 HG13 VAL 92 -3.189 -10.081 7.193 735 HG21 VAL 92 HG21 VAL 92 0.228 -10.329 5.959 736 HG22 VAL 92 HG22 VAL 92 -1.128 -9.254 6.311 737 HG23 VAL 92 HG23 VAL 92 -0.347 -10.159 7.624 738 H ILE 93 H ILE 93 -1.693 -13.910 4.534 739 HA ILE 93 HA ILE 93 -4.206 -14.930 5.409 740 HB ILE 93 HB ILE 93 -4.065 -16.458 3.472 741 HG12 ILE 93 HG12 ILE 93 -1.316 -15.285 3.028 742 HG13 ILE 93 HG13 ILE 93 -1.618 -16.903 3.643 743 HG21 ILE 93 HG21 ILE 93 -3.188 -13.618 2.796 744 HG22 ILE 93 HG22 ILE 93 -4.137 -14.713 1.767 745 HG23 ILE 93 HG23 ILE 93 -4.833 -14.088 3.269 746 HD11 ILE 93 HD11 ILE 93 -1.092 -17.134 1.354 747 HD12 ILE 93 HD12 ILE 93 -2.845 -17.389 1.481 748 HD13 ILE 93 HD13 ILE 93 -2.209 -15.841 0.886 749 H SER 94 H SER 94 -1.066 -16.104 6.168 750 HA SER 94 HA SER 94 -1.869 -18.891 6.431 751 HB2 SER 94 HB2 SER 94 0.541 -17.391 7.478 752 HB3 SER 94 HB3 SER 94 0.350 -19.157 7.414 753 HG SER 94 HG SER 94 0.760 -17.307 5.339 754 H ALA 95 H ALA 95 -2.376 -16.060 8.294 755 HA ALA 95 HA ALA 95 -2.378 -17.295 10.918 756 HB1 ALA 95 HB1 ALA 95 -3.887 -14.844 9.884 757 HB2 ALA 95 HB2 ALA 95 -3.634 -15.279 11.591 758 HB3 ALA 95 HB3 ALA 95 -2.247 -14.829 10.571 759 H LYS 96 H LYS 96 -4.615 -17.157 8.208 760 HA LYS 96 HA LYS 96 -6.407 -19.013 9.676 761 HB2 LYS 96 HB2 LYS 96 -7.067 -16.396 9.580 762 HB3 LYS 96 HB3 LYS 96 -7.792 -16.911 8.064 763 HG2 LYS 96 HG2 LYS 96 -9.560 -17.626 9.242 764 HG3 LYS 96 HG3 LYS 96 -8.533 -18.890 9.926 765 HD2 LYS 96 HD2 LYS 96 -9.497 -17.762 11.794 766 HD3 LYS 96 HD3 LYS 96 -7.820 -17.184 11.706 767 HE2 LYS 96 HE2 LYS 96 -8.613 -15.136 10.520 768 HE3 LYS 96 HE3 LYS 96 -10.267 -15.739 10.612 769 HZ1 LYS 96 HZ1 LYS 96 -10.165 -15.584 12.991 770 HZ2 LYS 96 HZ2 LYS 96 -9.828 -14.124 12.306 771 HZ3 LYS 96 HZ3 LYS 96 -8.609 -15.039 12.939 772 HA PRO 97 HA PRO 97 -5.061 -19.966 5.378 773 HB2 PRO 97 HB2 PRO 97 -4.105 -22.484 5.703 774 HB3 PRO 97 HB3 PRO 97 -3.237 -21.046 6.315 775 HG2 PRO 97 HG2 PRO 97 -5.127 -22.858 7.788 776 HG3 PRO 97 HG3 PRO 97 -3.444 -22.401 8.212 777 HD2 PRO 97 HD2 PRO 97 -5.556 -21.104 9.273 778 HD3 PRO 97 HD3 PRO 97 -4.061 -20.223 8.812 779 H LYS 98 H LYS 98 -7.931 -20.397 6.308 780 HA LYS 98 HA LYS 98 -8.530 -22.733 4.535 781 HB2 LYS 98 HB2 LYS 98 -10.118 -21.756 6.929 782 HB3 LYS 98 HB3 LYS 98 -10.621 -23.051 5.833 783 HG2 LYS 98 HG2 LYS 98 -8.116 -23.125 7.572 784 HG3 LYS 98 HG3 LYS 98 -9.657 -23.905 7.956 785 HD2 LYS 98 HD2 LYS 98 -9.461 -25.273 5.861 786 HD3 LYS 98 HD3 LYS 98 -7.879 -24.531 5.556 787 HE2 LYS 98 HE2 LYS 98 -7.472 -26.663 6.565 788 HE3 LYS 98 HE3 LYS 98 -7.089 -25.422 7.771 789 HZ1 LYS 98 HZ1 LYS 98 -8.361 -27.241 8.732 790 HZ2 LYS 98 HZ2 LYS 98 -9.600 -27.006 7.670 791 HZ3 LYS 98 HZ3 LYS 98 -9.251 -25.855 8.797 792 H ASP 99 H ASP 99 -11.447 -21.304 5.292 793 HA ASP 99 HA ASP 99 -11.815 -20.534 2.570 794 HB2 ASP 99 HB2 ASP 99 -13.626 -21.237 4.140 795 HB3 ASP 99 HB3 ASP 99 -13.446 -19.688 4.983 796 H GLU 100 H GLU 100 -11.177 -18.607 5.513 797 HA GLU 100 HA GLU 100 -11.487 -16.075 4.274 798 HB2 GLU 100 HB2 GLU 100 -9.791 -16.966 6.620 799 HB3 GLU 100 HB3 GLU 100 -10.059 -15.272 6.167 800 HG2 GLU 100 HG2 GLU 100 -12.481 -15.558 6.477 801 HG3 GLU 100 HG3 GLU 100 -12.235 -17.263 6.899 802 H LYS 101 H LYS 101 -8.742 -18.331 4.350 803 HA LYS 101 HA LYS 101 -6.799 -16.533 3.227 804 HB2 LYS 101 HB2 LYS 101 -6.191 -18.625 4.275 805 HB3 LYS 101 HB3 LYS 101 -7.098 -19.531 3.096 806 HG2 LYS 101 HG2 LYS 101 -5.281 -18.095 1.542 807 HG3 LYS 101 HG3 LYS 101 -4.370 -18.527 2.997 808 HD2 LYS 101 HD2 LYS 101 -4.067 -20.313 1.453 809 HD3 LYS 101 HD3 LYS 101 -5.191 -20.895 2.698 810 HE2 LYS 101 HE2 LYS 101 -7.098 -20.278 1.168 811 HE3 LYS 101 HE3 LYS 101 -5.906 -19.881 -0.086 812 HZ1 LYS 101 HZ1 LYS 101 -6.229 -22.536 1.204 813 HZ2 LYS 101 HZ2 LYS 101 -5.128 -22.179 0.029 814 HZ3 LYS 101 HZ3 LYS 101 -6.742 -22.148 -0.314 815 H LYS 102 H LYS 102 -9.361 -18.569 1.772 816 HA LYS 102 HA LYS 102 -8.472 -18.062 -0.958 817 HB2 LYS 102 HB2 LYS 102 -9.982 -19.963 -0.421 818 HB3 LYS 102 HB3 LYS 102 -11.200 -18.835 0.162 819 HG2 LYS 102 HG2 LYS 102 -12.075 -19.174 -1.887 820 HG3 LYS 102 HG3 LYS 102 -10.986 -17.851 -2.310 821 HD2 LYS 102 HD2 LYS 102 -9.259 -19.610 -2.933 822 HD3 LYS 102 HD3 LYS 102 -10.543 -20.820 -2.725 823 HE2 LYS 102 HE2 LYS 102 -10.454 -18.513 -4.713 824 HE3 LYS 102 HE3 LYS 102 -10.418 -20.247 -5.078 825 HZ1 LYS 102 HZ1 LYS 102 -12.729 -20.267 -4.023 826 HZ2 LYS 102 HZ2 LYS 102 -12.602 -19.524 -5.494 827 HZ3 LYS 102 HZ3 LYS 102 -12.690 -18.612 -4.125 828 H SER 103 H SER 103 -11.022 -16.658 1.153 829 HA SER 103 HA SER 103 -11.949 -14.725 -0.669 830 HB2 SER 103 HB2 SER 103 -13.036 -15.258 1.487 831 HB3 SER 103 HB3 SER 103 -11.688 -14.503 2.358 832 HG SER 103 HG SER 103 -13.437 -13.205 0.525 833 H LEU 104 H LEU 104 -9.292 -14.409 1.755 834 HA LEU 104 HA LEU 104 -8.715 -11.708 1.038 835 HB2 LEU 104 HB2 LEU 104 -7.528 -13.770 2.722 836 HB3 LEU 104 HB3 LEU 104 -6.294 -12.857 1.861 837 HG LEU 104 HG LEU 104 -8.463 -11.635 3.590 838 HD11 LEU 104 HD11 LEU 104 -5.489 -11.940 4.143 839 HD12 LEU 104 HD12 LEU 104 -6.778 -12.927 4.879 840 HD13 LEU 104 HD13 LEU 104 -6.702 -11.183 5.202 841 HD21 LEU 104 HD21 LEU 104 -6.937 -9.584 3.385 842 HD22 LEU 104 HD22 LEU 104 -7.844 -10.016 1.928 843 HD23 LEU 104 HD23 LEU 104 -6.127 -10.438 2.054 844 H GLN 105 H GLN 105 -7.430 -14.817 -0.271 845 HA GLN 105 HA GLN 105 -5.408 -13.436 -1.809 846 HB2 GLN 105 HB2 GLN 105 -6.591 -16.205 -1.992 847 HB3 GLN 105 HB3 GLN 105 -5.381 -15.617 -3.139 848 HG2 GLN 105 HG2 GLN 105 -4.928 -15.611 -0.140 849 HG3 GLN 105 HG3 GLN 105 -4.495 -16.973 -1.177 850 HE21 GLN 105 HE21 GLN 105 -3.786 -13.599 -0.391 851 HE22 GLN 105 HE22 GLN 105 -2.212 -13.577 -1.142 852 H GLU 106 H GLU 106 -8.817 -14.232 -2.461 853 HA GLU 106 HA GLU 106 -8.667 -13.570 -5.273 854 HB2 GLU 106 HB2 GLU 106 -10.929 -13.490 -3.251 855 HB3 GLU 106 HB3 GLU 106 -11.138 -13.062 -4.955 856 HG2 GLU 106 HG2 GLU 106 -10.411 -15.301 -5.633 857 HG3 GLU 106 HG3 GLU 106 -10.154 -15.746 -3.941 858 H LEU 107 H LEU 107 -9.321 -11.669 -2.297 859 HA LEU 107 HA LEU 107 -9.710 -9.192 -3.699 860 HB2 LEU 107 HB2 LEU 107 -9.650 -10.136 -0.989 861 HB3 LEU 107 HB3 LEU 107 -8.607 -8.722 -1.102 862 HG LEU 107 HG LEU 107 -11.493 -8.823 -2.031 863 HD11 LEU 107 HD11 LEU 107 -10.275 -7.594 0.477 864 HD12 LEU 107 HD12 LEU 107 -11.300 -9.049 0.413 865 HD13 LEU 107 HD13 LEU 107 -11.973 -7.465 -0.031 866 HD21 LEU 107 HD21 LEU 107 -9.666 -6.419 -1.646 867 HD22 LEU 107 HD22 LEU 107 -11.344 -6.406 -2.221 868 HD23 LEU 107 HD23 LEU 107 -10.074 -7.127 -3.222 869 H THR 108 H THR 108 -6.854 -10.764 -2.297 870 HA THR 108 HA THR 108 -4.962 -8.672 -2.738 871 HB THR 108 HB THR 108 -4.466 -11.701 -2.928 872 HG1 THR 108 HG1 THR 108 -5.508 -10.987 -0.948 873 HG21 THR 108 HG21 THR 108 -2.207 -11.130 -2.054 874 HG22 THR 108 HG22 THR 108 -2.616 -9.401 -2.174 875 HG23 THR 108 HG23 THR 108 -2.514 -10.393 -3.648 876 H SER 109 H SER 109 -6.274 -11.253 -4.862 877 HA SER 109 HA SER 109 -4.504 -10.585 -7.047 878 HB2 SER 109 HB2 SER 109 -5.749 -12.775 -6.714 879 HB3 SER 109 HB3 SER 109 -7.216 -11.933 -7.257 880 HG SER 109 HG SER 109 -6.083 -11.435 -9.206 881 H LYS 110 H LYS 110 -7.822 -9.561 -6.123 882 HA LYS 110 HA LYS 110 -8.469 -8.180 -8.518 883 HB2 LYS 110 HB2 LYS 110 -9.919 -8.702 -6.423 884 HB3 LYS 110 HB3 LYS 110 -9.247 -7.214 -5.748 885 HG2 LYS 110 HG2 LYS 110 -10.088 -6.126 -7.988 886 HG3 LYS 110 HG3 LYS 110 -11.098 -7.572 -8.115 887 HD2 LYS 110 HD2 LYS 110 -11.101 -5.580 -5.797 888 HD3 LYS 110 HD3 LYS 110 -12.304 -5.662 -7.080 889 HE2 LYS 110 HE2 LYS 110 -12.929 -7.944 -6.301 890 HE3 LYS 110 HE3 LYS 110 -11.753 -7.782 -4.972 891 HZ1 LYS 110 HZ1 LYS 110 -13.976 -7.120 -4.256 892 HZ2 LYS 110 HZ2 LYS 110 -14.064 -5.970 -5.433 893 HZ3 LYS 110 HZ3 LYS 110 -12.976 -5.814 -4.208 894 H LEU 111 H LEU 111 -6.695 -7.099 -5.627 895 HA LEU 111 HA LEU 111 -6.343 -4.385 -6.401 896 HB2 LEU 111 HB2 LEU 111 -5.954 -5.449 -4.164 897 HB3 LEU 111 HB3 LEU 111 -4.476 -6.151 -4.780 898 HG LEU 111 HG LEU 111 -4.936 -3.158 -4.587 899 HD11 LEU 111 HD11 LEU 111 -5.201 -4.110 -2.389 900 HD12 LEU 111 HD12 LEU 111 -3.607 -3.344 -2.473 901 HD13 LEU 111 HD13 LEU 111 -3.743 -5.112 -2.588 902 HD21 LEU 111 HD21 LEU 111 -2.394 -4.808 -4.818 903 HD22 LEU 111 HD22 LEU 111 -2.454 -3.062 -4.491 904 HD23 LEU 111 HD23 LEU 111 -3.056 -3.690 -6.029 905 H PHE 112 H PHE 112 -4.315 -7.272 -6.981 906 HA PHE 112 HA PHE 112 -2.287 -5.745 -8.346 907 HB2 PHE 112 HB2 PHE 112 -2.864 -8.683 -8.037 908 HB3 PHE 112 HB3 PHE 112 -1.588 -8.104 -9.119 909 HD1 PHE 112 HD1 PHE 112 -2.713 -7.258 -5.596 910 HD2 PHE 112 HD2 PHE 112 0.550 -8.177 -8.236 911 HE1 PHE 112 HE1 PHE 112 -1.164 -7.072 -3.697 912 HE2 PHE 112 HE2 PHE 112 2.129 -7.961 -6.320 913 HZ PHE 112 HZ PHE 112 1.252 -7.425 -4.038 914 H SER 113 H SER 113 -5.269 -7.316 -9.446 915 HA SER 113 HA SER 113 -4.587 -7.221 -12.252 916 HB2 SER 113 HB2 SER 113 -7.305 -7.033 -10.887 917 HB3 SER 113 HB3 SER 113 -7.028 -7.346 -12.614 918 HG SER 113 HG SER 113 -7.304 -9.303 -11.595 919 H SER 114 H SER 114 -5.924 -4.880 -9.919 920 HA SER 114 HA SER 114 -6.586 -2.896 -11.910 921 HB2 SER 114 HB2 SER 114 -5.906 -2.495 -8.970 922 HB3 SER 114 HB3 SER 114 -6.780 -1.363 -10.021 923 HG SER 114 HG SER 114 -7.609 -3.937 -9.122 924 H ILE 115 H ILE 115 -3.720 -3.671 -9.983 925 HA ILE 115 HA ILE 115 -2.115 -1.428 -10.771 926 HB ILE 115 HB ILE 115 -1.642 -4.151 -9.579 927 HG12 ILE 115 HG12 ILE 115 -0.782 -1.354 -8.787 928 HG13 ILE 115 HG13 ILE 115 -2.267 -2.153 -8.263 929 HG21 ILE 115 HG21 ILE 115 0.195 -4.170 -11.164 930 HG22 ILE 115 HG22 ILE 115 0.614 -2.490 -10.786 931 HG23 ILE 115 HG23 ILE 115 0.873 -3.765 -9.583 932 HD11 ILE 115 HD11 ILE 115 0.577 -2.800 -7.519 933 HD12 ILE 115 HD12 ILE 115 -0.803 -2.432 -6.474 934 HD13 ILE 115 HD13 ILE 115 -0.729 -3.995 -7.308 935 H ASP 116 H ASP 116 -2.606 -4.683 -12.191 936 HA ASP 116 HA ASP 116 -0.573 -4.376 -14.170 937 HB2 ASP 116 HB2 ASP 116 -1.768 -6.498 -13.379 938 HB3 ASP 116 HB3 ASP 116 -3.079 -6.048 -14.482 939 H ASN 117 H ASN 117 -4.040 -3.575 -14.131 940 HA ASN 117 HA ASN 117 -4.167 -2.743 -16.887 941 HB2 ASN 117 HB2 ASN 117 -5.813 -2.003 -14.439 942 HB3 ASN 117 HB3 ASN 117 -6.153 -1.395 -16.061 943 HD21 ASN 117 HD21 ASN 117 -7.599 -3.234 -14.151 944 HD22 ASN 117 HD22 ASN 117 -8.007 -4.604 -15.155 945 H LEU 118 H LEU 118 -3.286 -1.088 -13.855 946 HA LEU 118 HA LEU 118 -3.213 1.573 -14.915 947 HB2 LEU 118 HB2 LEU 118 -2.870 0.362 -12.476 948 HB3 LEU 118 HB3 LEU 118 -1.225 0.820 -12.851 949 HG LEU 118 HG LEU 118 -3.578 2.710 -12.629 950 HD11 LEU 118 HD11 LEU 118 -1.279 2.065 -10.737 951 HD12 LEU 118 HD12 LEU 118 -2.995 1.658 -10.501 952 HD13 LEU 118 HD13 LEU 118 -2.473 3.353 -10.495 953 HD21 LEU 118 HD21 LEU 118 -1.709 3.526 -14.123 954 HD22 LEU 118 HD22 LEU 118 -0.637 3.428 -12.709 955 HD23 LEU 118 HD23 LEU 118 -2.031 4.526 -12.692 956 H ASP 119 H ASP 119 -0.760 -1.006 -14.611 957 HA ASP 119 HA ASP 119 1.422 0.495 -15.718 958 HB2 ASP 119 HB2 ASP 119 1.986 -1.444 -14.480 959 HB3 ASP 119 HB3 ASP 119 0.818 -2.448 -15.363 960 H HIS 120 H HIS 120 -0.980 -1.735 -17.252 961 HA HIS 120 HA HIS 120 0.142 -1.357 -19.865 962 HB2 HIS 120 HB2 HIS 120 -2.515 -2.333 -18.878 963 HB3 HIS 120 HB3 HIS 120 -2.216 -2.067 -20.601 964 HD1 HIS 120 HD1 HIS 120 -1.453 -4.487 -17.837 965 HD2 HIS 120 HD2 HIS 120 -0.193 -3.684 -21.742 966 HE1 HIS 120 HE1 HIS 120 -0.125 -6.486 -18.612 967 H ALA 121 H ALA 121 -2.301 0.538 -18.088 968 HA ALA 121 HA ALA 121 -3.030 2.159 -20.332 969 HB1 ALA 121 HB1 ALA 121 -4.330 2.105 -18.288 970 HB2 ALA 121 HB2 ALA 121 -2.973 2.795 -17.371 971 HB3 ALA 121 HB3 ALA 121 -3.783 3.763 -18.624 972 H ALA 122 H ALA 122 -0.330 2.340 -17.992 973 HA ALA 122 HA ALA 122 0.577 4.923 -18.909 974 HB1 ALA 122 HB1 ALA 122 2.080 2.640 -17.588 975 HB2 ALA 122 HB2 ALA 122 2.679 4.300 -17.785 976 HB3 ALA 122 HB3 ALA 122 1.258 3.987 -16.772 977 H LYS 123 H LYS 123 1.451 1.539 -19.753 978 HA LYS 123 HA LYS 123 3.532 2.339 -21.558 979 HB2 LYS 123 HB2 LYS 123 1.848 -0.191 -21.412 980 HB3 LYS 123 HB3 LYS 123 3.243 -0.008 -22.484 981 HG2 LYS 123 HG2 LYS 123 4.729 0.341 -20.556 982 HG3 LYS 123 HG3 LYS 123 3.359 0.233 -19.450 983 HD2 LYS 123 HD2 LYS 123 4.310 -2.034 -21.254 984 HD3 LYS 123 HD3 LYS 123 4.683 -1.856 -19.527 985 HE2 LYS 123 HE2 LYS 123 2.124 -1.749 -19.187 986 HE3 LYS 123 HE3 LYS 123 2.006 -2.414 -20.824 987 HZ1 LYS 123 HZ1 LYS 123 1.941 -4.221 -19.367 988 HZ2 LYS 123 HZ2 LYS 123 3.162 -3.654 -18.410 989 HZ3 LYS 123 HZ3 LYS 123 3.494 -4.243 -19.924 990 H ILE 124 H ILE 124 0.024 1.937 -21.980 991 HA ILE 124 HA ILE 124 0.245 2.280 -24.887 992 HB ILE 124 HB ILE 124 -1.588 0.932 -23.508 993 HG12 ILE 124 HG12 ILE 124 -3.240 1.398 -25.415 994 HG13 ILE 124 HG13 ILE 124 -2.050 2.547 -26.027 995 HG21 ILE 124 HG21 ILE 124 -2.406 2.947 -22.251 996 HG22 ILE 124 HG22 ILE 124 -3.004 3.625 -23.778 997 HG23 ILE 124 HG23 ILE 124 -3.675 2.106 -23.143 998 HD11 ILE 124 HD11 ILE 124 -1.880 0.326 -27.132 999 HD12 ILE 124 HD12 ILE 124 -0.385 0.732 -26.260 1000 HD13 ILE 124 HD13 ILE 124 -1.540 -0.427 -25.557 1001 H LYS 125 H LYS 125 0.758 4.290 -22.421 1002 HA LYS 125 HA LYS 125 1.165 6.506 -22.327 1003 HB2 LYS 125 HB2 LYS 125 1.553 5.849 -24.901 1004 HB3 LYS 125 HB3 LYS 125 0.295 7.067 -25.119 1005 HG2 LYS 125 HG2 LYS 125 1.708 8.671 -23.815 1006 HG3 LYS 125 HG3 LYS 125 2.982 7.438 -23.758 1007 HD2 LYS 125 HD2 LYS 125 1.771 8.581 -26.308 1008 HD3 LYS 125 HD3 LYS 125 3.305 9.107 -25.594 1009 HE2 LYS 125 HE2 LYS 125 4.203 6.792 -25.847 1010 HE3 LYS 125 HE3 LYS 125 2.677 6.294 -26.603 1011 HZ1 LYS 125 HZ1 LYS 125 4.339 6.809 -28.257 1012 HZ2 LYS 125 HZ2 LYS 125 4.518 8.344 -27.681 1013 HZ3 LYS 125 HZ3 LYS 125 3.092 7.882 -28.370 1014 H SER 126 H SER 126 -1.589 5.502 -21.775 1015 HA SER 126 HA SER 126 -3.090 8.037 -22.301 1016 HB2 SER 126 HB2 SER 126 -4.249 6.050 -23.089 1017 HB3 SER 126 HB3 SER 126 -4.129 5.321 -21.466 1018 HG SER 126 HG SER 126 -6.154 6.467 -21.869 1019 HA PRO 127 HA PRO 127 -2.215 8.367 -17.891 1020 HB2 PRO 127 HB2 PRO 127 -2.579 11.039 -17.556 1021 HB3 PRO 127 HB3 PRO 127 -1.094 10.369 -18.308 1022 HG2 PRO 127 HG2 PRO 127 -3.553 11.475 -19.648 1023 HG3 PRO 127 HG3 PRO 127 -1.831 11.879 -19.941 1024 HD2 PRO 127 HD2 PRO 127 -3.183 10.096 -21.487 1025 HD3 PRO 127 HD3 PRO 127 -1.442 9.881 -21.098 1026 H THR 128 H THR 128 -5.068 9.335 -19.731 1027 HA THR 128 HA THR 128 -6.762 9.962 -17.483 1028 HB THR 128 HB THR 128 -8.556 9.193 -19.295 1029 HG1 THR 128 HG1 THR 128 -7.481 8.284 -20.912 1030 HG21 THR 128 HG21 THR 128 -8.093 11.552 -18.695 1031 HG22 THR 128 HG22 THR 128 -8.323 11.360 -20.446 1032 HG23 THR 128 HG23 THR 128 -6.684 11.550 -19.786 1033 H GLU 129 H GLU 129 -6.134 7.021 -19.417 1034 HA GLU 129 HA GLU 129 -7.955 5.401 -17.865 1035 HB2 GLU 129 HB2 GLU 129 -5.866 4.962 -19.951 1036 HB3 GLU 129 HB3 GLU 129 -6.320 3.578 -18.952 1037 HG2 GLU 129 HG2 GLU 129 -7.603 3.767 -21.101 1038 HG3 GLU 129 HG3 GLU 129 -8.596 3.688 -19.637 1039 H ALA 130 H ALA 130 -4.504 6.242 -17.654 1040 HA ALA 130 HA ALA 130 -3.850 4.296 -15.672 1041 HB1 ALA 130 HB1 ALA 130 -1.925 5.720 -15.194 1042 HB2 ALA 130 HB2 ALA 130 -2.172 5.603 -16.951 1043 HB3 ALA 130 HB3 ALA 130 -2.668 7.072 -16.073 1044 H GLU 131 H GLU 131 -5.088 7.681 -15.374 1045 HA GLU 131 HA GLU 131 -5.123 7.653 -12.503 1046 HB2 GLU 131 HB2 GLU 131 -6.551 9.250 -14.618 1047 HB3 GLU 131 HB3 GLU 131 -7.016 9.405 -12.919 1048 HG2 GLU 131 HG2 GLU 131 -4.167 9.745 -13.841 1049 HG3 GLU 131 HG3 GLU 131 -5.323 11.082 -13.804 1050 H LYS 132 H LYS 132 -7.456 6.588 -14.971 1051 HA LYS 132 HA LYS 132 -9.678 6.165 -13.234 1052 HB2 LYS 132 HB2 LYS 132 -9.555 6.086 -15.802 1053 HB3 LYS 132 HB3 LYS 132 -8.909 4.456 -15.618 1054 HG2 LYS 132 HG2 LYS 132 -11.139 4.196 -14.129 1055 HG3 LYS 132 HG3 LYS 132 -11.675 5.467 -15.239 1056 HD2 LYS 132 HD2 LYS 132 -10.591 2.711 -15.953 1057 HD3 LYS 132 HD3 LYS 132 -12.252 3.285 -16.166 1058 HE2 LYS 132 HE2 LYS 132 -9.768 4.220 -17.664 1059 HE3 LYS 132 HE3 LYS 132 -11.091 3.257 -18.317 1060 HZ1 LYS 132 HZ1 LYS 132 -12.530 5.147 -18.154 1061 HZ2 LYS 132 HZ2 LYS 132 -11.150 5.618 -18.944 1062 HZ3 LYS 132 HZ3 LYS 132 -11.389 6.043 -17.366 1063 H TYR 133 H TYR 133 -7.021 3.981 -14.269 1064 HA TYR 133 HA TYR 133 -7.992 1.807 -12.617 1065 HB2 TYR 133 HB2 TYR 133 -5.333 2.265 -13.991 1066 HB3 TYR 133 HB3 TYR 133 -5.805 0.764 -13.181 1067 HD1 TYR 133 HD1 TYR 133 -8.520 0.217 -13.982 1068 HD2 TYR 133 HD2 TYR 133 -5.375 1.981 -16.316 1069 HE1 TYR 133 HE1 TYR 133 -9.657 -0.522 -16.070 1070 HE2 TYR 133 HE2 TYR 133 -6.521 1.238 -18.409 1071 HH TYR 133 HH TYR 133 -9.553 -0.627 -18.357 1072 H TYR 134 H TYR 134 -5.737 4.507 -12.121 1073 HA TYR 134 HA TYR 134 -4.612 3.514 -9.679 1074 HB2 TYR 134 HB2 TYR 134 -3.651 5.472 -10.784 1075 HB3 TYR 134 HB3 TYR 134 -5.166 6.362 -10.585 1076 HD1 TYR 134 HD1 TYR 134 -2.342 4.806 -8.679 1077 HD2 TYR 134 HD2 TYR 134 -5.673 7.528 -8.561 1078 HE1 TYR 134 HE1 TYR 134 -1.602 5.618 -6.445 1079 HE2 TYR 134 HE2 TYR 134 -4.927 8.329 -6.315 1080 HH TYR 134 HH TYR 134 -1.926 7.194 -4.786 1081 H GLY 135 H GLY 135 -7.579 5.447 -10.372 1082 HA2 GLY 135 HA2 GLY 135 -8.367 5.729 -7.660 1083 HA3 GLY 135 HA3 GLY 135 -9.463 5.723 -9.056 1084 H GLN 136 H GLN 136 -8.974 3.064 -9.976 1085 HA GLN 136 HA GLN 136 -10.660 1.578 -8.161 1086 HB2 GLN 136 HB2 GLN 136 -8.951 0.680 -10.512 1087 HB3 GLN 136 HB3 GLN 136 -10.092 -0.358 -9.644 1088 HG2 GLN 136 HG2 GLN 136 -11.929 1.217 -10.241 1089 HG3 GLN 136 HG3 GLN 136 -10.783 2.152 -11.205 1090 HE21 GLN 136 HE21 GLN 136 -13.239 0.630 -11.933 1091 HE22 GLN 136 HE22 GLN 136 -12.721 -0.476 -13.183 1092 H THR 137 H THR 137 -7.143 1.712 -8.723 1093 HA THR 137 HA THR 137 -6.496 -0.521 -7.045 1094 HB THR 137 HB THR 137 -4.755 1.911 -7.676 1095 HG1 THR 137 HG1 THR 137 -5.476 0.928 -9.588 1096 HG21 THR 137 HG21 THR 137 -3.818 0.498 -5.908 1097 HG22 THR 137 HG22 THR 137 -2.910 0.277 -7.417 1098 HG23 THR 137 HG23 THR 137 -4.084 -0.955 -6.901 1099 H VAL 138 H VAL 138 -6.888 2.999 -6.356 1100 HA VAL 138 HA VAL 138 -6.005 2.912 -3.639 1101 HB VAL 138 HB VAL 138 -8.195 4.643 -4.920 1102 HG11 VAL 138 HG11 VAL 138 -7.784 6.206 -2.993 1103 HG12 VAL 138 HG12 VAL 138 -8.521 4.669 -2.505 1104 HG13 VAL 138 HG13 VAL 138 -6.785 4.946 -2.230 1105 HG21 VAL 138 HG21 VAL 138 -5.822 4.864 -5.836 1106 HG22 VAL 138 HG22 VAL 138 -6.544 6.344 -5.195 1107 HG23 VAL 138 HG23 VAL 138 -5.349 5.450 -4.243 1108 H SER 139 H SER 139 -9.287 2.443 -5.061 1109 HA SER 139 HA SER 139 -10.569 1.929 -2.566 1110 HB2 SER 139 HB2 SER 139 -11.273 0.861 -5.328 1111 HB3 SER 139 HB3 SER 139 -12.361 0.946 -3.924 1112 HG SER 139 HG SER 139 -12.645 2.735 -5.311 1113 H ASN 140 H ASN 140 -8.904 -0.204 -4.878 1114 HA ASN 140 HA ASN 140 -9.632 -2.671 -3.625 1115 HB2 ASN 140 HB2 ASN 140 -7.644 -1.712 -5.596 1116 HB3 ASN 140 HB3 ASN 140 -7.175 -3.151 -4.694 1117 HD21 ASN 140 HD21 ASN 140 -9.424 -1.798 -6.970 1118 HD22 ASN 140 HD22 ASN 140 -10.096 -3.336 -7.467 1119 H ILE 141 H ILE 141 -6.891 -0.431 -3.090 1120 HA ILE 141 HA ILE 141 -5.509 -2.148 -1.238 1121 HB ILE 141 HB ILE 141 -5.498 0.880 -1.646 1122 HG12 ILE 141 HG12 ILE 141 -3.250 -1.094 -2.131 1123 HG13 ILE 141 HG13 ILE 141 -4.513 -0.856 -3.337 1124 HG21 ILE 141 HG21 ILE 141 -3.925 -0.814 0.346 1125 HG22 ILE 141 HG22 ILE 141 -3.329 0.763 -0.213 1126 HG23 ILE 141 HG23 ILE 141 -4.871 0.655 0.662 1127 HD11 ILE 141 HD11 ILE 141 -3.949 1.544 -3.462 1128 HD12 ILE 141 HD12 ILE 141 -2.637 1.281 -2.288 1129 HD13 ILE 141 HD13 ILE 141 -2.579 0.494 -3.877 1130 H ASN 142 H ASN 142 -8.063 0.337 -0.883 1131 HA ASN 142 HA ASN 142 -8.168 0.167 1.977 1132 HB2 ASN 142 HB2 ASN 142 -9.186 1.986 0.604 1133 HB3 ASN 142 HB3 ASN 142 -10.413 0.841 0.042 1134 HD21 ASN 142 HD21 ASN 142 -9.216 2.678 2.764 1135 HD22 ASN 142 HD22 ASN 142 -10.640 2.474 3.754 1136 H GLU 143 H GLU 143 -9.960 -1.643 -0.585 1137 HA GLU 143 HA GLU 143 -11.612 -3.077 1.239 1138 HB2 GLU 143 HB2 GLU 143 -10.505 -3.867 -1.480 1139 HB3 GLU 143 HB3 GLU 143 -11.654 -4.846 -0.577 1140 HG2 GLU 143 HG2 GLU 143 -13.304 -3.010 -0.710 1141 HG3 GLU 143 HG3 GLU 143 -12.166 -2.101 -1.717 1142 H VAL 144 H VAL 144 -8.394 -3.862 -0.090 1143 HA VAL 144 HA VAL 144 -8.285 -6.455 1.165 1144 HB VAL 144 HB VAL 144 -6.070 -4.569 0.202 1145 HG11 VAL 144 HG11 VAL 144 -4.556 -6.571 0.356 1146 HG12 VAL 144 HG12 VAL 144 -5.090 -5.983 1.940 1147 HG13 VAL 144 HG13 VAL 144 -5.838 -7.436 1.236 1148 HG21 VAL 144 HG21 VAL 144 -7.204 -7.159 -0.941 1149 HG22 VAL 144 HG22 VAL 144 -7.499 -5.532 -1.579 1150 HG23 VAL 144 HG23 VAL 144 -5.871 -6.226 -1.639 1151 H LEU 145 H LEU 145 -7.498 -3.131 2.228 1152 HA LEU 145 HA LEU 145 -6.123 -4.146 4.573 1153 HB2 LEU 145 HB2 LEU 145 -6.635 -1.527 3.395 1154 HB3 LEU 145 HB3 LEU 145 -6.807 -1.508 5.146 1155 HG LEU 145 HG LEU 145 -4.502 -0.932 4.398 1156 HD11 LEU 145 HD11 LEU 145 -3.354 -2.677 5.883 1157 HD12 LEU 145 HD12 LEU 145 -4.949 -3.387 6.112 1158 HD13 LEU 145 HD13 LEU 145 -4.653 -1.713 6.606 1159 HD21 LEU 145 HD21 LEU 145 -3.013 -2.575 3.445 1160 HD22 LEU 145 HD22 LEU 145 -4.438 -2.441 2.396 1161 HD23 LEU 145 HD23 LEU 145 -4.267 -3.831 3.492 1162 H ALA 146 H ALA 146 -9.451 -3.157 3.941 1163 HA ALA 146 HA ALA 146 -10.226 -3.205 6.734 1164 HB1 ALA 146 HB1 ALA 146 -12.523 -3.408 5.820 1165 HB2 ALA 146 HB2 ALA 146 -11.613 -2.153 4.945 1166 HB3 ALA 146 HB3 ALA 146 -11.860 -3.751 4.202 1167 H LYS 147 H LYS 147 -9.462 -5.610 4.357 1168 HA LYS 147 HA LYS 147 -10.723 -7.786 5.888 1169 HB2 LYS 147 HB2 LYS 147 -10.403 -7.480 3.285 1170 HB3 LYS 147 HB3 LYS 147 -8.794 -8.119 3.612 1171 HG2 LYS 147 HG2 LYS 147 -10.189 -9.939 2.909 1172 HG3 LYS 147 HG3 LYS 147 -9.887 -10.145 4.641 1173 HD2 LYS 147 HD2 LYS 147 -12.108 -9.154 5.131 1174 HD3 LYS 147 HD3 LYS 147 -12.398 -8.977 3.385 1175 HE2 LYS 147 HE2 LYS 147 -12.193 -11.417 3.100 1176 HE3 LYS 147 HE3 LYS 147 -11.855 -11.597 4.837 1177 HZ1 LYS 147 HZ1 LYS 147 -14.366 -10.515 3.698 1178 HZ2 LYS 147 HZ2 LYS 147 -14.045 -10.708 5.304 1179 HZ3 LYS 147 HZ3 LYS 147 -14.177 -12.030 4.325 1180 H LEU 148 H LEU 148 -7.827 -6.035 6.002 1181 HA LEU 148 HA LEU 148 -6.318 -8.266 7.269 1182 HB2 LEU 148 HB2 LEU 148 -5.446 -5.396 6.737 1183 HB3 LEU 148 HB3 LEU 148 -4.453 -6.663 7.419 1184 HG LEU 148 HG LEU 148 -5.375 -6.370 4.583 1185 HD11 LEU 148 HD11 LEU 148 -2.648 -6.694 5.852 1186 HD12 LEU 148 HD12 LEU 148 -3.383 -5.143 5.399 1187 HD13 LEU 148 HD13 LEU 148 -2.997 -6.332 4.145 1188 HD21 LEU 148 HD21 LEU 148 -4.257 -8.484 4.057 1189 HD22 LEU 148 HD22 LEU 148 -5.650 -8.747 5.115 1190 HD23 LEU 148 HD23 LEU 148 -4.009 -8.783 5.787 1191 H GLY 149 H GLY 149 -8.640 -6.058 8.186 1192 HA2 GLY 149 HA2 GLY 149 -7.428 -5.331 10.762 1193 HA3 GLY 149 HA3 GLY 149 -9.055 -4.925 10.192 Start of MODEL 16 1 H1 GLU 1 H1 GLU 1 -9.604 17.088 3.807 2 H2 GLU 1 H2 GLU 1 -8.532 15.975 3.225 3 H3 GLU 1 H3 GLU 1 -9.681 15.519 4.317 4 HA GLU 1 HA GLU 1 -7.525 17.433 4.857 5 HB2 GLU 1 HB2 GLU 1 -9.507 16.096 6.720 6 HB3 GLU 1 HB3 GLU 1 -8.202 17.191 7.211 7 HG2 GLU 1 HG2 GLU 1 -9.242 18.985 5.830 8 HG3 GLU 1 HG3 GLU 1 -10.609 17.899 5.516 9 H ALA 2 H ALA 2 -7.250 15.691 7.413 10 HA ALA 2 HA ALA 2 -4.968 14.264 6.498 11 HB1 ALA 2 HB1 ALA 2 -4.849 13.455 8.793 12 HB2 ALA 2 HB2 ALA 2 -5.354 15.157 8.823 13 HB3 ALA 2 HB3 ALA 2 -6.553 13.869 9.076 14 H ARG 3 H ARG 3 -4.488 12.065 6.460 15 HA ARG 3 HA ARG 3 -4.815 9.905 5.739 16 HB2 ARG 3 HB2 ARG 3 -7.097 10.008 7.738 17 HB3 ARG 3 HB3 ARG 3 -6.305 8.551 7.121 18 HG2 ARG 3 HG2 ARG 3 -4.155 9.394 8.095 19 HG3 ARG 3 HG3 ARG 3 -5.081 10.707 8.855 20 HD2 ARG 3 HD2 ARG 3 -6.521 9.001 9.959 21 HD3 ARG 3 HD3 ARG 3 -5.503 7.725 9.267 22 HE ARG 3 HE ARG 3 -4.883 9.480 11.522 23 HH11 ARG 3 HH11 ARG 3 -3.464 7.328 9.099 24 HH12 ARG 3 HH12 ARG 3 -2.034 7.050 10.053 25 HH21 ARG 3 HH21 ARG 3 -3.034 9.069 12.679 26 HH22 ARG 3 HH22 ARG 3 -1.796 8.025 12.040 27 HA PRO 4 HA PRO 4 -8.546 10.745 3.105 28 HB2 PRO 4 HB2 PRO 4 -7.426 11.195 0.686 29 HB3 PRO 4 HB3 PRO 4 -7.420 12.453 1.952 30 HG2 PRO 4 HG2 PRO 4 -5.276 10.469 1.269 31 HG3 PRO 4 HG3 PRO 4 -5.163 12.255 1.366 32 HD2 PRO 4 HD2 PRO 4 -4.461 10.658 3.445 33 HD3 PRO 4 HD3 PRO 4 -5.258 12.251 3.703 34 H ILE 5 H ILE 5 -7.562 8.176 3.962 35 HA ILE 5 HA ILE 5 -7.220 6.492 1.592 36 HB ILE 5 HB ILE 5 -7.920 5.699 4.475 37 HG12 ILE 5 HG12 ILE 5 -5.194 5.689 3.119 38 HG13 ILE 5 HG13 ILE 5 -5.744 6.966 4.202 39 HG21 ILE 5 HG21 ILE 5 -8.458 3.922 2.787 40 HG22 ILE 5 HG22 ILE 5 -6.790 4.012 2.171 41 HG23 ILE 5 HG23 ILE 5 -7.110 3.433 3.823 42 HD11 ILE 5 HD11 ILE 5 -6.010 5.239 6.028 43 HD12 ILE 5 HD12 ILE 5 -5.243 4.057 4.937 44 HD13 ILE 5 HD13 ILE 5 -4.340 5.487 5.472 45 H VAL 6 H VAL 6 -9.801 7.210 3.949 46 HA VAL 6 HA VAL 6 -11.821 6.313 1.984 47 HB VAL 6 HB VAL 6 -11.146 4.297 3.289 48 HG11 VAL 6 HG11 VAL 6 -10.561 5.395 5.433 49 HG12 VAL 6 HG12 VAL 6 -12.288 5.732 5.726 50 HG13 VAL 6 HG13 VAL 6 -11.700 4.058 5.655 51 HG21 VAL 6 HG21 VAL 6 -13.382 3.512 3.842 52 HG22 VAL 6 HG22 VAL 6 -13.993 5.182 3.897 53 HG23 VAL 6 HG23 VAL 6 -13.429 4.489 2.358 54 H VAL 7 H VAL 7 -11.072 8.126 4.939 55 HA VAL 7 HA VAL 7 -13.789 8.895 5.475 56 HB VAL 7 HB VAL 7 -11.772 8.959 7.081 57 HG11 VAL 7 HG11 VAL 7 -10.411 10.967 7.175 58 HG12 VAL 7 HG12 VAL 7 -10.262 10.267 5.554 59 HG13 VAL 7 HG13 VAL 7 -11.293 11.693 5.815 60 HG21 VAL 7 HG21 VAL 7 -12.676 10.827 8.381 61 HG22 VAL 7 HG22 VAL 7 -13.534 11.439 6.948 62 HG23 VAL 7 HG23 VAL 7 -13.990 9.873 7.660 63 H GLY 8 H GLY 8 -11.537 9.797 3.089 64 HA2 GLY 8 HA2 GLY 8 -13.370 11.479 1.716 65 HA3 GLY 8 HA3 GLY 8 -12.153 12.484 2.542 66 HA PRO 9 HA PRO 9 -9.677 9.505 -0.206 67 HB2 PRO 9 HB2 PRO 9 -10.840 8.392 -2.420 68 HB3 PRO 9 HB3 PRO 9 -10.885 7.618 -0.803 69 HG2 PRO 9 HG2 PRO 9 -12.955 9.372 -2.108 70 HG3 PRO 9 HG3 PRO 9 -13.157 7.749 -1.366 71 HD2 PRO 9 HD2 PRO 9 -13.733 9.976 0.020 72 HD3 PRO 9 HD3 PRO 9 -12.901 8.594 0.817 73 HA PRO 10 HA PRO 10 -9.014 12.851 -2.913 74 HB2 PRO 10 HB2 PRO 10 -6.813 12.122 -4.334 75 HB3 PRO 10 HB3 PRO 10 -6.724 12.396 -2.565 76 HG2 PRO 10 HG2 PRO 10 -7.052 9.813 -4.073 77 HG3 PRO 10 HG3 PRO 10 -5.855 10.231 -2.803 78 HD2 PRO 10 HD2 PRO 10 -8.138 8.895 -2.226 79 HD3 PRO 10 HD3 PRO 10 -7.442 10.110 -1.102 80 HA PRO 11 HA PRO 11 -10.716 11.707 -6.898 81 HB2 PRO 11 HB2 PRO 11 -9.729 13.608 -8.605 82 HB3 PRO 11 HB3 PRO 11 -11.001 13.998 -7.401 83 HG2 PRO 11 HG2 PRO 11 -8.024 14.398 -7.210 84 HG3 PRO 11 HG3 PRO 11 -9.339 15.577 -6.906 85 HD2 PRO 11 HD2 PRO 11 -8.149 14.230 -4.887 86 HD3 PRO 11 HD3 PRO 11 -9.910 14.587 -4.859 87 HA PRO 12 HA PRO 12 -7.326 9.383 -8.495 88 HB2 PRO 12 HB2 PRO 12 -7.774 9.089 -11.175 89 HB3 PRO 12 HB3 PRO 12 -8.774 8.275 -9.932 90 HG2 PRO 12 HG2 PRO 12 -9.306 10.849 -11.388 91 HG3 PRO 12 HG3 PRO 12 -10.371 9.419 -11.199 92 HD2 PRO 12 HD2 PRO 12 -10.631 11.554 -9.589 93 HD3 PRO 12 HD3 PRO 12 -10.783 9.888 -8.927 94 H LEU 13 H LEU 13 -7.818 12.580 -9.512 95 HA LEU 13 HA LEU 13 -5.386 12.861 -11.115 96 HB2 LEU 13 HB2 LEU 13 -7.516 14.702 -10.031 97 HB3 LEU 13 HB3 LEU 13 -5.992 15.366 -10.595 98 HG LEU 13 HG LEU 13 -6.383 14.386 -12.837 99 HD11 LEU 13 HD11 LEU 13 -7.907 12.555 -12.379 100 HD12 LEU 13 HD12 LEU 13 -8.710 13.715 -13.444 101 HD13 LEU 13 HD13 LEU 13 -9.125 13.674 -11.713 102 HD21 LEU 13 HD21 LEU 13 -6.946 16.718 -12.280 103 HD22 LEU 13 HD22 LEU 13 -8.576 16.214 -11.768 104 HD23 LEU 13 HD23 LEU 13 -8.080 16.054 -13.471 105 H SER 14 H SER 14 -5.933 12.366 -7.835 106 HA SER 14 HA SER 14 -3.442 13.850 -7.098 107 HB2 SER 14 HB2 SER 14 -5.991 13.692 -5.456 108 HB3 SER 14 HB3 SER 14 -4.487 14.512 -4.991 109 HG SER 14 HG SER 14 -4.894 15.643 -7.157 110 H GLY 15 H GLY 15 -2.851 13.044 -4.703 111 HA2 GLY 15 HA2 GLY 15 -3.188 10.077 -4.664 112 HA3 GLY 15 HA3 GLY 15 -1.616 10.846 -4.412 113 H GLY 16 H GLY 16 -2.008 9.395 -2.345 114 HA2 GLY 16 HA2 GLY 16 -3.813 10.514 -0.370 115 HA3 GLY 16 HA3 GLY 16 -2.618 9.239 -0.120 116 H LEU 17 H LEU 17 -1.816 12.394 -1.424 117 HA LEU 17 HA LEU 17 -0.407 13.091 1.119 118 HB2 LEU 17 HB2 LEU 17 0.509 13.511 -1.743 119 HB3 LEU 17 HB3 LEU 17 1.316 14.168 -0.322 120 HG LEU 17 HG LEU 17 1.000 11.208 -0.889 121 HD11 LEU 17 HD11 LEU 17 2.403 12.307 -2.584 122 HD12 LEU 17 HD12 LEU 17 3.378 11.278 -1.518 123 HD13 LEU 17 HD13 LEU 17 3.391 13.043 -1.302 124 HD21 LEU 17 HD21 LEU 17 2.631 12.737 1.173 125 HD22 LEU 17 HD22 LEU 17 2.803 11.000 0.832 126 HD23 LEU 17 HD23 LEU 17 1.279 11.617 1.481 127 HA PRO 18 HA PRO 18 -3.039 16.703 -0.054 128 HB2 PRO 18 HB2 PRO 18 -3.933 17.301 2.454 129 HB3 PRO 18 HB3 PRO 18 -4.728 16.044 1.455 130 HG2 PRO 18 HG2 PRO 18 -2.629 15.706 3.591 131 HG3 PRO 18 HG3 PRO 18 -4.214 14.881 3.436 132 HD2 PRO 18 HD2 PRO 18 -1.940 13.726 2.571 133 HD3 PRO 18 HD3 PRO 18 -3.472 13.552 1.655 134 H GLY 19 H GLY 19 -2.589 19.016 0.790 135 HA2 GLY 19 HA2 GLY 19 -0.249 19.261 2.522 136 HA3 GLY 19 HA3 GLY 19 0.065 19.636 0.828 137 H THR 20 H THR 20 -2.987 20.374 2.450 138 HA THR 20 HA THR 20 -2.283 23.163 2.936 139 HB THR 20 HB THR 20 -2.519 23.161 0.427 140 HG1 THR 20 HG1 THR 20 -4.509 24.505 1.949 141 HG21 THR 20 HG21 THR 20 -4.209 21.350 0.206 142 HG22 THR 20 HG22 THR 20 -4.723 22.846 -0.599 143 HG23 THR 20 HG23 THR 20 -5.427 22.401 0.969 144 H GLU 21 H GLU 21 -3.881 20.511 3.818 145 HA GLU 21 HA GLU 21 -6.503 21.813 4.359 146 HB2 GLU 21 HB2 GLU 21 -5.568 18.945 4.524 147 HB3 GLU 21 HB3 GLU 21 -7.197 19.484 4.885 148 HG2 GLU 21 HG2 GLU 21 -5.830 19.787 2.187 149 HG3 GLU 21 HG3 GLU 21 -6.871 18.429 2.637 150 H ASN 22 H ASN 22 -7.482 21.404 6.503 151 HA ASN 22 HA ASN 22 -5.783 22.336 8.569 152 HB2 ASN 22 HB2 ASN 22 -8.218 22.650 8.576 153 HB3 ASN 22 HB3 ASN 22 -8.449 20.904 8.731 154 HD21 ASN 22 HD21 ASN 22 -9.578 21.064 10.622 155 HD22 ASN 22 HD22 ASN 22 -8.798 21.476 12.136 156 H SER 23 H SER 23 -4.303 21.397 9.697 157 HA SER 23 HA SER 23 -2.984 19.823 10.692 158 HB2 SER 23 HB2 SER 23 -5.675 18.657 11.478 159 HB3 SER 23 HB3 SER 23 -4.130 18.431 12.327 160 HG SER 23 HG SER 23 -5.551 20.879 11.943 161 H ASP 24 H ASP 24 -3.428 19.218 7.927 162 HA ASP 24 HA ASP 24 -4.046 16.391 7.734 163 HB2 ASP 24 HB2 ASP 24 -3.754 16.660 5.385 164 HB3 ASP 24 HB3 ASP 24 -4.639 18.040 6.025 165 H GLN 25 H GLN 25 -1.739 17.068 9.407 166 HA GLN 25 HA GLN 25 0.719 16.434 8.118 167 HB2 GLN 25 HB2 GLN 25 0.357 17.437 10.413 168 HB3 GLN 25 HB3 GLN 25 -0.090 15.825 10.982 169 HG2 GLN 25 HG2 GLN 25 2.162 14.997 10.346 170 HG3 GLN 25 HG3 GLN 25 2.594 16.628 9.810 171 HE21 GLN 25 HE21 GLN 25 3.676 17.803 11.243 172 HE22 GLN 25 HE22 GLN 25 3.596 17.611 12.977 173 H ALA 26 H ALA 26 -1.861 14.367 9.405 174 HA ALA 26 HA ALA 26 -0.253 11.934 9.163 175 HB1 ALA 26 HB1 ALA 26 -3.243 12.324 9.590 176 HB2 ALA 26 HB2 ALA 26 -2.373 10.781 9.703 177 HB3 ALA 26 HB3 ALA 26 -2.028 12.084 10.864 178 H ARG 27 H ARG 27 0.409 11.499 7.152 179 HA ARG 27 HA ARG 27 -1.616 11.387 4.941 180 HB2 ARG 27 HB2 ARG 27 1.331 12.133 4.746 181 HB3 ARG 27 HB3 ARG 27 0.156 12.119 3.420 182 HG2 ARG 27 HG2 ARG 27 -1.081 13.945 4.496 183 HG3 ARG 27 HG3 ARG 27 0.043 13.919 5.851 184 HD2 ARG 27 HD2 ARG 27 1.894 14.486 4.309 185 HD3 ARG 27 HD3 ARG 27 0.693 14.682 3.008 186 HE ARG 27 HE ARG 27 -0.231 16.194 5.197 187 HH11 ARG 27 HH11 ARG 27 2.567 16.292 3.043 188 HH12 ARG 27 HH12 ARG 27 2.745 18.018 3.203 189 HH21 ARG 27 HH21 ARG 27 0.020 18.394 5.317 190 HH22 ARG 27 HH22 ARG 27 1.338 19.181 4.476 191 H ASP 28 H ASP 28 -0.935 9.818 3.224 192 HA ASP 28 HA ASP 28 -0.030 7.341 4.493 193 HB2 ASP 28 HB2 ASP 28 -0.783 8.058 1.634 194 HB3 ASP 28 HB3 ASP 28 -0.417 6.417 2.198 195 H GLY 29 H GLY 29 1.921 6.151 3.897 196 HA2 GLY 29 HA2 GLY 29 3.758 7.209 1.983 197 HA3 GLY 29 HA3 GLY 29 4.198 7.774 3.592 198 H THR 30 H THR 30 5.964 6.364 2.131 199 HA THR 30 HA THR 30 5.934 3.527 2.679 200 HB THR 30 HB THR 30 8.323 5.318 2.027 201 HG1 THR 30 HG1 THR 30 7.148 4.079 -0.104 202 HG21 THR 30 HG21 THR 30 9.040 3.074 2.508 203 HG22 THR 30 HG22 THR 30 9.027 3.240 0.739 204 HG23 THR 30 HG23 THR 30 7.711 2.373 1.557 205 H LEU 31 H LEU 31 6.935 2.401 4.336 206 HA LEU 31 HA LEU 31 8.558 3.982 6.290 207 HB2 LEU 31 HB2 LEU 31 6.624 1.710 6.882 208 HB3 LEU 31 HB3 LEU 31 7.712 2.441 8.054 209 HG LEU 31 HG LEU 31 5.424 3.885 6.670 210 HD11 LEU 31 HD11 LEU 31 5.689 2.843 9.519 211 HD12 LEU 31 HD12 LEU 31 4.676 2.134 8.242 212 HD13 LEU 31 HD13 LEU 31 4.316 3.759 8.853 213 HD21 LEU 31 HD21 LEU 31 7.289 4.760 8.923 214 HD22 LEU 31 HD22 LEU 31 5.828 5.634 8.404 215 HD23 LEU 31 HD23 LEU 31 7.191 5.461 7.287 216 HA PRO 32 HA PRO 32 11.487 0.880 5.246 217 HB2 PRO 32 HB2 PRO 32 13.093 0.696 7.449 218 HB3 PRO 32 HB3 PRO 32 13.061 2.150 6.399 219 HG2 PRO 32 HG2 PRO 32 11.605 1.668 8.992 220 HG3 PRO 32 HG3 PRO 32 12.603 3.072 8.503 221 HD2 PRO 32 HD2 PRO 32 9.898 3.093 8.322 222 HD3 PRO 32 HD3 PRO 32 10.933 3.922 7.108 223 H TYR 33 H TYR 33 10.332 -0.983 4.963 224 HA TYR 33 HA TYR 33 8.952 -2.426 6.906 225 HB2 TYR 33 HB2 TYR 33 10.319 -3.529 4.427 226 HB3 TYR 33 HB3 TYR 33 8.951 -4.249 5.278 227 HD1 TYR 33 HD1 TYR 33 6.722 -2.994 5.303 228 HD2 TYR 33 HD2 TYR 33 9.992 -1.846 2.750 229 HE1 TYR 33 HE1 TYR 33 5.169 -1.676 3.886 230 HE2 TYR 33 HE2 TYR 33 8.413 -0.511 1.349 231 HH TYR 33 HH TYR 33 6.241 0.092 0.987 232 H THR 34 H THR 34 12.354 -2.916 5.867 233 HA THR 34 HA THR 34 12.823 -4.448 8.327 234 HB THR 34 HB THR 34 11.958 -6.134 6.622 235 HG1 THR 34 HG1 THR 34 13.372 -7.585 7.331 236 HG21 THR 34 HG21 THR 34 13.011 -5.104 4.598 237 HG22 THR 34 HG22 THR 34 13.393 -6.825 4.794 238 HG23 THR 34 HG23 THR 34 14.606 -5.599 5.216 239 H LYS 35 H LYS 35 15.145 -5.043 8.486 240 HA LYS 35 HA LYS 35 16.966 -3.347 6.845 241 HB2 LYS 35 HB2 LYS 35 16.824 -3.430 9.888 242 HB3 LYS 35 HB3 LYS 35 18.221 -2.829 8.983 243 HG2 LYS 35 HG2 LYS 35 16.761 -1.123 7.916 244 HG3 LYS 35 HG3 LYS 35 15.415 -1.673 8.934 245 HD2 LYS 35 HD2 LYS 35 16.727 -1.138 10.960 246 HD3 LYS 35 HD3 LYS 35 18.069 -0.575 9.944 247 HE2 LYS 35 HE2 LYS 35 15.258 0.602 9.917 248 HE3 LYS 35 HE3 LYS 35 16.627 1.278 10.822 249 HZ1 LYS 35 HZ1 LYS 35 16.351 2.378 8.689 250 HZ2 LYS 35 HZ2 LYS 35 16.522 0.952 7.876 251 HZ3 LYS 35 HZ3 LYS 35 17.793 1.578 8.719 252 H ASP 36 H ASP 36 17.282 -5.410 5.862 253 HA ASP 36 HA ASP 36 18.454 -7.284 5.412 254 HB2 ASP 36 HB2 ASP 36 20.232 -5.804 6.609 255 HB3 ASP 36 HB3 ASP 36 20.117 -7.029 7.885 256 H ARG 37 H ARG 37 17.307 -7.169 8.729 257 HA ARG 37 HA ARG 37 17.687 -9.628 9.768 258 HB2 ARG 37 HB2 ARG 37 16.308 -7.732 10.708 259 HB3 ARG 37 HB3 ARG 37 14.957 -8.300 9.720 260 HG2 ARG 37 HG2 ARG 37 15.217 -10.557 10.927 261 HG3 ARG 37 HG3 ARG 37 16.283 -9.714 12.059 262 HD2 ARG 37 HD2 ARG 37 14.437 -8.149 12.595 263 HD3 ARG 37 HD3 ARG 37 13.397 -8.990 11.423 264 HE ARG 37 HE ARG 37 14.519 -10.798 13.406 265 HH11 ARG 37 HH21 ARG 37 11.828 -8.542 12.874 266 HH12 ARG 37 HH22 ARG 37 10.819 -9.335 14.051 267 HH21 ARG 37 HH11 ARG 37 13.208 -11.727 14.864 268 HH22 ARG 37 HH12 ARG 37 11.596 -11.115 15.168 269 H PHE 38 H PHE 38 15.343 -9.106 7.128 270 HA PHE 38 HA PHE 38 13.912 -11.533 7.441 271 HB2 PHE 38 HB2 PHE 38 14.482 -9.765 5.049 272 HB3 PHE 38 HB3 PHE 38 13.517 -11.237 4.915 273 HD1 PHE 38 HD2 PHE 38 12.898 -9.820 8.180 274 HD2 PHE 38 HD1 PHE 38 11.922 -9.389 3.993 275 HE1 PHE 38 HE2 PHE 38 10.833 -8.599 8.778 276 HE2 PHE 38 HE1 PHE 38 9.847 -8.178 4.613 277 HZ PHE 38 HZ PHE 38 9.309 -7.784 6.989 278 H TYR 39 H TYR 39 17.113 -11.027 6.012 279 HA TYR 39 HA TYR 39 17.016 -13.527 4.520 280 HB2 TYR 39 HB2 TYR 39 19.420 -11.897 5.405 281 HB3 TYR 39 HB3 TYR 39 19.373 -13.109 4.117 282 HD1 TYR 39 HD2 TYR 39 17.006 -12.445 2.527 283 HD2 TYR 39 HD1 TYR 39 19.788 -9.790 4.467 284 HE1 TYR 39 HE2 TYR 39 16.416 -10.632 0.914 285 HE2 TYR 39 HE1 TYR 39 19.203 -7.998 2.847 286 HH TYR 39 HH TYR 39 17.993 -7.428 1.004 287 H LEU 40 H LEU 40 17.620 -12.623 7.797 288 HA LEU 40 HA LEU 40 19.058 -15.181 8.341 289 HB2 LEU 40 HB2 LEU 40 18.692 -12.714 10.087 290 HB3 LEU 40 HB3 LEU 40 19.658 -14.133 10.477 291 HG LEU 40 HG LEU 40 20.804 -13.374 8.106 292 HD11 LEU 40 HD11 LEU 40 20.034 -10.800 9.566 293 HD12 LEU 40 HD12 LEU 40 19.450 -11.295 7.963 294 HD13 LEU 40 HD13 LEU 40 21.162 -10.925 8.196 295 HD21 LEU 40 HD21 LEU 40 21.966 -13.960 10.185 296 HD22 LEU 40 HD22 LEU 40 21.501 -12.398 10.903 297 HD23 LEU 40 HD23 LEU 40 22.607 -12.449 9.510 298 H GLN 41 H GLN 41 16.294 -13.185 9.434 299 HA GLN 41 HA GLN 41 15.207 -15.599 10.813 300 HB2 GLN 41 HB2 GLN 41 14.960 -12.699 11.666 301 HB3 GLN 41 HB3 GLN 41 14.163 -14.070 12.444 302 HG2 GLN 41 HG2 GLN 41 16.407 -15.020 12.975 303 HG3 GLN 41 HG3 GLN 41 17.154 -13.567 12.292 304 HE21 GLN 41 HE21 GLN 41 17.497 -14.457 14.952 305 HE22 GLN 41 HE22 GLN 41 16.798 -13.255 16.010 306 HA PRO 42 HA PRO 42 11.814 -14.595 8.117 307 HB2 PRO 42 HB2 PRO 42 9.875 -16.258 9.060 308 HB3 PRO 42 HB3 PRO 42 11.289 -16.881 8.148 309 HG2 PRO 42 HG2 PRO 42 10.879 -16.734 11.130 310 HG3 PRO 42 HG3 PRO 42 11.377 -18.137 10.130 311 HD2 PRO 42 HD2 PRO 42 13.185 -16.598 11.439 312 HD3 PRO 42 HD3 PRO 42 13.541 -17.294 9.818 313 H LEU 43 H LEU 43 9.830 -13.407 8.213 314 HA LEU 43 HA LEU 43 9.469 -11.920 10.714 315 HB2 LEU 43 HB2 LEU 43 8.017 -10.490 9.492 316 HB3 LEU 43 HB3 LEU 43 9.455 -10.755 8.530 317 HG LEU 43 HG LEU 43 6.863 -12.225 7.974 318 HD11 LEU 43 HD11 LEU 43 6.379 -10.483 6.312 319 HD12 LEU 43 HD12 LEU 43 7.770 -9.549 6.890 320 HD13 LEU 43 HD13 LEU 43 6.384 -9.851 7.966 321 HD21 LEU 43 HD21 LEU 43 7.800 -12.239 5.625 322 HD22 LEU 43 HD22 LEU 43 8.726 -13.203 6.781 323 HD23 LEU 43 HD23 LEU 43 9.324 -11.599 6.284 324 HA PRO 44 HA PRO 44 5.957 -14.427 11.734 325 HB2 PRO 44 HB2 PRO 44 4.668 -12.929 13.599 326 HB3 PRO 44 HB3 PRO 44 6.256 -13.687 13.948 327 HG2 PRO 44 HG2 PRO 44 5.633 -10.893 13.084 328 HG3 PRO 44 HG3 PRO 44 6.658 -11.446 14.441 329 HD2 PRO 44 HD2 PRO 44 7.679 -10.716 12.012 330 HD3 PRO 44 HD3 PRO 44 8.428 -12.000 13.022 331 HA PRO 45 HA PRO 45 2.940 -12.775 9.011 332 HB2 PRO 45 HB2 PRO 45 0.606 -13.972 9.727 333 HB3 PRO 45 HB3 PRO 45 1.966 -14.886 9.009 334 HG2 PRO 45 HG2 PRO 45 1.274 -14.557 11.916 335 HG3 PRO 45 HG3 PRO 45 1.559 -16.067 10.988 336 HD2 PRO 45 HD2 PRO 45 3.525 -14.951 12.443 337 HD3 PRO 45 HD3 PRO 45 3.874 -15.663 10.826 338 H THR 46 H THR 46 2.537 -12.216 12.425 339 HA THR 46 HA THR 46 0.216 -10.527 12.262 340 HB THR 46 HB THR 46 1.236 -9.635 14.488 341 HG1 THR 46 HG1 THR 46 2.976 -10.800 15.252 342 HG21 THR 46 HG21 THR 46 0.785 -12.638 14.203 343 HG22 THR 46 HG22 THR 46 -0.500 -11.418 14.387 344 HG23 THR 46 HG23 THR 46 0.664 -11.689 15.702 345 H GLU 47 H GLU 47 3.766 -9.914 12.276 346 HA GLU 47 HA GLU 47 3.545 -7.047 12.005 347 HB2 GLU 47 HB2 GLU 47 5.742 -8.986 11.197 348 HB3 GLU 47 HB3 GLU 47 5.872 -7.228 11.111 349 HG2 GLU 47 HG2 GLU 47 5.723 -7.034 13.520 350 HG3 GLU 47 HG3 GLU 47 5.486 -8.784 13.669 351 H ALA 48 H ALA 48 3.526 -9.791 9.768 352 HA ALA 48 HA ALA 48 4.063 -8.350 7.379 353 HB1 ALA 48 HB1 ALA 48 4.089 -10.853 7.648 354 HB2 ALA 48 HB2 ALA 48 2.310 -10.818 7.661 355 HB3 ALA 48 HB3 ALA 48 3.201 -10.277 6.223 356 H ALA 49 H ALA 49 1.048 -8.759 9.239 357 HA ALA 49 HA ALA 49 -0.696 -7.792 7.173 358 HB1 ALA 49 HB1 ALA 49 -2.291 -7.370 9.020 359 HB2 ALA 49 HB2 ALA 49 -1.524 -8.966 9.193 360 HB3 ALA 49 HB3 ALA 49 -0.987 -7.607 10.209 361 H GLN 50 H GLN 50 1.212 -6.198 9.708 362 HA GLN 50 HA GLN 50 0.191 -3.558 9.234 363 HB2 GLN 50 HB2 GLN 50 2.914 -4.410 10.285 364 HB3 GLN 50 HB3 GLN 50 2.191 -2.811 10.460 365 HG2 GLN 50 HG2 GLN 50 0.408 -3.750 11.866 366 HG3 GLN 50 HG3 GLN 50 1.060 -5.379 11.639 367 HE21 GLN 50 HE21 GLN 50 0.818 -3.106 13.881 368 HE22 GLN 50 HE22 GLN 50 2.334 -3.320 14.720 369 H ARG 51 H ARG 51 3.055 -5.355 8.019 370 HA ARG 51 HA ARG 51 4.065 -3.190 6.423 371 HB2 ARG 51 HB2 ARG 51 4.398 -6.195 6.164 372 HB3 ARG 51 HB3 ARG 51 5.281 -5.004 5.199 373 HG2 ARG 51 HG2 ARG 51 6.164 -4.028 7.310 374 HG3 ARG 51 HG3 ARG 51 5.419 -5.375 8.190 375 HD2 ARG 51 HD2 ARG 51 6.729 -6.976 6.848 376 HD3 ARG 51 HD3 ARG 51 7.452 -5.628 5.952 377 HE ARG 51 HE ARG 51 8.707 -4.993 7.858 378 HH11 ARG 51 HH21 ARG 51 6.763 -7.852 8.557 379 HH12 ARG 51 HH22 ARG 51 7.601 -8.138 10.076 380 HH21 ARG 51 HH11 ARG 51 9.708 -5.453 9.770 381 HH22 ARG 51 HH12 ARG 51 9.193 -6.831 10.740 382 H ALA 52 H ALA 52 1.782 -5.828 5.661 383 HA ALA 52 HA ALA 52 1.676 -5.329 2.866 384 HB1 ALA 52 HB1 ALA 52 0.712 -7.349 3.809 385 HB2 ALA 52 HB2 ALA 52 -0.419 -6.408 4.801 386 HB3 ALA 52 HB3 ALA 52 -0.590 -6.427 3.030 387 H LYS 53 H LYS 53 -0.191 -3.891 5.591 388 HA LYS 53 HA LYS 53 -1.880 -2.298 3.903 389 HB2 LYS 53 HB2 LYS 53 -0.999 -1.956 6.786 390 HB3 LYS 53 HB3 LYS 53 -2.151 -0.875 5.979 391 HG2 LYS 53 HG2 LYS 53 -3.561 -2.878 5.432 392 HG3 LYS 53 HG3 LYS 53 -2.493 -3.863 6.426 393 HD2 LYS 53 HD2 LYS 53 -3.964 -1.433 7.503 394 HD3 LYS 53 HD3 LYS 53 -4.649 -3.067 7.503 395 HE2 LYS 53 HE2 LYS 53 -2.549 -3.823 8.743 396 HE3 LYS 53 HE3 LYS 53 -2.190 -2.098 8.992 397 HZ1 LYS 53 HZ1 LYS 53 -4.616 -3.574 9.891 398 HZ2 LYS 53 HZ2 LYS 53 -4.447 -1.939 10.026 399 HZ3 LYS 53 HZ3 LYS 53 -3.448 -2.948 10.859 400 H VAL 54 H VAL 54 1.347 -1.648 5.318 401 HA VAL 54 HA VAL 54 1.445 1.072 4.340 402 HB VAL 54 HB VAL 54 3.696 -0.844 5.108 403 HG11 VAL 54 HG11 VAL 54 4.557 0.977 3.670 404 HG12 VAL 54 HG12 VAL 54 3.759 2.185 4.704 405 HG13 VAL 54 HG13 VAL 54 5.089 1.191 5.345 406 HG21 VAL 54 HG21 VAL 54 2.410 1.426 6.687 407 HG22 VAL 54 HG22 VAL 54 2.085 -0.300 6.947 408 HG23 VAL 54 HG23 VAL 54 3.705 0.341 7.243 409 H SER 55 H SER 55 2.528 -2.075 2.971 410 HA SER 55 HA SER 55 3.847 -0.967 0.691 411 HB2 SER 55 HB2 SER 55 2.393 -3.626 0.962 412 HB3 SER 55 HB3 SER 55 3.562 -3.201 -0.306 413 HG SER 55 HG SER 55 4.025 -3.480 2.488 414 H ALA 56 H ALA 56 0.456 -1.848 1.296 415 HA ALA 56 HA ALA 56 -0.422 -1.273 -1.400 416 HB1 ALA 56 HB1 ALA 56 -1.580 -2.718 0.334 417 HB2 ALA 56 HB2 ALA 56 -2.075 -1.203 1.124 418 HB3 ALA 56 HB3 ALA 56 -2.600 -1.561 -0.538 419 H SER 57 H SER 57 0.112 0.663 1.519 420 HA SER 57 HA SER 57 -1.346 2.969 0.577 421 HB2 SER 57 HB2 SER 57 0.895 2.790 2.623 422 HB3 SER 57 HB3 SER 57 -0.191 4.171 2.380 423 HG SER 57 HG SER 57 -0.944 1.529 3.163 424 H GLU 58 H GLU 58 1.924 1.742 -0.037 425 HA GLU 58 HA GLU 58 2.999 4.233 -1.027 426 HB2 GLU 58 HB2 GLU 58 3.623 1.356 -1.809 427 HB3 GLU 58 HB3 GLU 58 4.494 2.766 -2.404 428 HG2 GLU 58 HG2 GLU 58 4.854 3.315 0.110 429 HG3 GLU 58 HG3 GLU 58 4.463 1.603 0.357 430 H ILE 59 H ILE 59 0.887 1.745 -2.350 431 HA ILE 59 HA ILE 59 1.100 2.652 -5.078 432 HB ILE 59 HB ILE 59 -1.057 0.939 -3.779 433 HG12 ILE 59 HG12 ILE 59 1.416 0.093 -5.340 434 HG13 ILE 59 HG13 ILE 59 1.323 0.089 -3.581 435 HG21 ILE 59 HG21 ILE 59 -0.298 1.335 -6.722 436 HG22 ILE 59 HG22 ILE 59 -1.488 0.153 -6.129 437 HG23 ILE 59 HG23 ILE 59 -1.799 1.887 -5.956 438 HD11 ILE 59 HD11 ILE 59 0.956 -2.150 -4.306 439 HD12 ILE 59 HD12 ILE 59 -0.610 -1.525 -3.742 440 HD13 ILE 59 HD13 ILE 59 -0.268 -1.642 -5.484 441 H LEU 60 H LEU 60 -0.903 3.568 -2.288 442 HA LEU 60 HA LEU 60 -2.841 5.119 -3.757 443 HB2 LEU 60 HB2 LEU 60 -1.704 5.584 -0.975 444 HB3 LEU 60 HB3 LEU 60 -3.106 6.397 -1.636 445 HG LEU 60 HG LEU 60 -2.977 3.411 -1.130 446 HD11 LEU 60 HD11 LEU 60 -4.331 3.884 0.872 447 HD12 LEU 60 HD12 LEU 60 -4.219 5.631 0.551 448 HD13 LEU 60 HD13 LEU 60 -2.762 4.707 0.970 449 HD21 LEU 60 HD21 LEU 60 -5.440 3.565 -1.318 450 HD22 LEU 60 HD22 LEU 60 -4.642 4.069 -2.817 451 HD23 LEU 60 HD23 LEU 60 -5.300 5.294 -1.709 452 H ASN 61 H ASN 61 0.509 5.625 -2.878 453 HA ASN 61 HA ASN 61 0.343 8.488 -3.657 454 HB2 ASN 61 HB2 ASN 61 2.504 6.839 -2.337 455 HB3 ASN 61 HB3 ASN 61 2.724 8.516 -2.855 456 HD21 ASN 61 HD21 ASN 61 2.979 7.658 -0.209 457 HD22 ASN 61 HD22 ASN 61 1.734 8.461 0.721 458 H VAL 62 H VAL 62 0.733 5.630 -5.304 459 HA VAL 62 HA VAL 62 3.099 6.206 -6.820 460 HB VAL 62 HB VAL 62 1.673 3.980 -6.516 461 HG11 VAL 62 HG11 VAL 62 -0.309 4.900 -7.802 462 HG12 VAL 62 HG12 VAL 62 0.704 4.869 -9.269 463 HG13 VAL 62 HG13 VAL 62 0.318 3.362 -8.413 464 HG21 VAL 62 HG21 VAL 62 2.872 3.018 -8.450 465 HG22 VAL 62 HG22 VAL 62 3.248 4.663 -9.014 466 HG23 VAL 62 HG23 VAL 62 3.901 4.079 -7.468 467 H LYS 63 H LYS 63 0.050 7.684 -6.881 468 HA LYS 63 HA LYS 63 -0.288 8.290 -9.619 469 HB2 LYS 63 HB2 LYS 63 -1.757 8.741 -7.486 470 HB3 LYS 63 HB3 LYS 63 -0.938 10.306 -7.468 471 HG2 LYS 63 HG2 LYS 63 -2.125 9.371 -10.055 472 HG3 LYS 63 HG3 LYS 63 -3.245 9.853 -8.777 473 HD2 LYS 63 HD2 LYS 63 -2.556 12.071 -8.804 474 HD3 LYS 63 HD3 LYS 63 -0.968 11.693 -9.485 475 HE2 LYS 63 HE2 LYS 63 -2.025 11.056 -11.614 476 HE3 LYS 63 HE3 LYS 63 -3.607 11.435 -10.938 477 HZ1 LYS 63 HZ1 LYS 63 -1.439 13.372 -11.444 478 HZ2 LYS 63 HZ2 LYS 63 -2.878 13.742 -10.717 479 HZ3 LYS 63 HZ3 LYS 63 -2.856 13.216 -12.288 480 H GLN 64 H GLN 64 2.112 9.472 -7.375 481 HA GLN 64 HA GLN 64 2.783 11.953 -8.594 482 HB2 GLN 64 HB2 GLN 64 4.543 9.860 -7.271 483 HB3 GLN 64 HB3 GLN 64 5.063 11.504 -7.660 484 HG2 GLN 64 HG2 GLN 64 3.416 12.435 -6.123 485 HG3 GLN 64 HG3 GLN 64 2.772 10.822 -5.791 486 HE21 GLN 64 HE21 GLN 64 3.842 9.437 -4.434 487 HE22 GLN 64 HE22 GLN 64 5.230 9.937 -3.484 488 H PHE 65 H PHE 65 3.505 8.617 -9.601 489 HA PHE 65 HA PHE 65 5.603 9.262 -11.457 490 HB2 PHE 65 HB2 PHE 65 3.639 6.969 -11.232 491 HB3 PHE 65 HB3 PHE 65 4.830 7.063 -12.529 492 HD1 PHE 65 HD2 PHE 65 4.617 7.103 -8.758 493 HD2 PHE 65 HD1 PHE 65 6.957 6.159 -12.244 494 HE1 PHE 65 HE2 PHE 65 6.331 6.038 -7.310 495 HE2 PHE 65 HE1 PHE 65 8.673 5.073 -10.799 496 HZ PHE 65 HZ PHE 65 8.369 5.025 -8.329 497 H ILE 66 H ILE 66 2.114 9.608 -11.633 498 HA ILE 66 HA ILE 66 1.912 9.540 -14.519 499 HB ILE 66 HB ILE 66 0.079 10.942 -12.504 500 HG12 ILE 66 HG12 ILE 66 0.274 8.599 -11.889 501 HG13 ILE 66 HG13 ILE 66 -1.318 8.922 -12.566 502 HG21 ILE 66 HG21 ILE 66 -0.378 11.733 -14.757 503 HG22 ILE 66 HG22 ILE 66 -0.385 10.075 -15.397 504 HG23 ILE 66 HG23 ILE 66 -1.674 10.615 -14.296 505 HD11 ILE 66 HD11 ILE 66 -0.590 7.907 -14.715 506 HD12 ILE 66 HD12 ILE 66 0.988 7.538 -13.986 507 HD13 ILE 66 HD13 ILE 66 -0.485 6.781 -13.347 508 H ASP 67 H ASP 67 2.207 12.150 -12.078 509 HA ASP 67 HA ASP 67 2.165 14.309 -13.992 510 HB2 ASP 67 HB2 ASP 67 1.774 14.605 -11.554 511 HB3 ASP 67 HB3 ASP 67 3.459 14.151 -11.245 512 H ARG 68 H ARG 68 4.689 12.327 -12.504 513 HA ARG 68 HA ARG 68 6.904 13.696 -13.723 514 HB2 ARG 68 HB2 ARG 68 6.428 11.421 -12.013 515 HB3 ARG 68 HB3 ARG 68 7.540 10.947 -13.292 516 HG2 ARG 68 HG2 ARG 68 7.944 13.400 -11.563 517 HG3 ARG 68 HG3 ARG 68 8.604 11.798 -11.176 518 HD2 ARG 68 HD2 ARG 68 9.758 11.778 -13.390 519 HD3 ARG 68 HD3 ARG 68 9.188 13.437 -13.671 520 HE ARG 68 HE ARG 68 10.509 13.368 -11.165 521 HH11 ARG 68 HH21 ARG 68 11.330 13.078 -14.584 522 HH12 ARG 68 HH22 ARG 68 12.958 13.652 -14.340 523 HH21 ARG 68 HH11 ARG 68 12.595 14.103 -10.927 524 HH22 ARG 68 HH12 ARG 68 13.659 14.222 -12.303 525 H LYS 69 H LYS 69 4.515 11.672 -15.040 526 HA LYS 69 HA LYS 69 4.252 10.521 -17.005 527 HB2 LYS 69 HB2 LYS 69 6.317 12.534 -17.959 528 HB3 LYS 69 HB3 LYS 69 5.294 11.545 -19.013 529 HG2 LYS 69 HG2 LYS 69 3.283 12.600 -18.154 530 HG3 LYS 69 HG3 LYS 69 4.218 13.477 -16.940 531 HD2 LYS 69 HD2 LYS 69 5.437 14.647 -18.756 532 HD3 LYS 69 HD3 LYS 69 4.336 13.878 -19.929 533 HE2 LYS 69 HE2 LYS 69 2.400 14.887 -18.767 534 HE3 LYS 69 HE3 LYS 69 3.485 15.601 -17.558 535 HZ1 LYS 69 HZ1 LYS 69 3.479 16.257 -20.447 536 HZ2 LYS 69 HZ2 LYS 69 4.488 16.914 -19.317 537 HZ3 LYS 69 HZ3 LYS 69 2.867 17.202 -19.242 538 H ALA 70 H ALA 70 5.970 9.420 -15.120 539 HA ALA 70 HA ALA 70 8.395 8.508 -16.478 540 HB1 ALA 70 HB1 ALA 70 8.871 7.414 -14.338 541 HB2 ALA 70 HB2 ALA 70 8.399 9.098 -14.083 542 HB3 ALA 70 HB3 ALA 70 7.234 7.795 -13.754 543 H TRP 71 H TRP 71 6.657 7.601 -18.162 544 HA TRP 71 HA TRP 71 5.215 5.242 -17.768 545 HB2 TRP 71 HB2 TRP 71 6.864 5.726 -20.235 546 HB3 TRP 71 HB3 TRP 71 5.272 4.981 -20.081 547 HD1 TRP 71 HD1 TRP 71 6.675 8.053 -21.294 548 HE1 TRP 71 HE1 TRP 71 5.118 10.056 -21.213 549 HE3 TRP 71 HE3 TRP 71 3.210 6.133 -18.050 550 HZ2 TRP 71 HZ2 TRP 71 2.669 10.754 -19.926 551 HZ3 TRP 71 HZ3 TRP 71 1.249 7.552 -17.411 552 HH2 TRP 71 HH2 TRP 71 1.008 9.852 -18.338 553 HA PRO 72 HA PRO 72 8.742 2.346 -18.499 554 HB2 PRO 72 HB2 PRO 72 11.368 2.983 -18.275 555 HB3 PRO 72 HB3 PRO 72 10.455 3.251 -19.797 556 HG2 PRO 72 HG2 PRO 72 11.054 5.206 -17.589 557 HG3 PRO 72 HG3 PRO 72 11.357 5.368 -19.349 558 HD2 PRO 72 HD2 PRO 72 9.157 6.420 -18.193 559 HD3 PRO 72 HD3 PRO 72 9.088 5.684 -19.830 560 H SER 73 H SER 73 8.968 4.742 -15.947 561 HA SER 73 HA SER 73 10.291 2.836 -14.122 562 HB2 SER 73 HB2 SER 73 9.136 5.544 -13.439 563 HB3 SER 73 HB3 SER 73 10.390 4.637 -12.572 564 HG SER 73 HG SER 73 11.792 5.005 -14.273 565 H LEU 74 H LEU 74 7.080 4.294 -14.699 566 HA LEU 74 HA LEU 74 5.917 3.377 -12.259 567 HB2 LEU 74 HB2 LEU 74 4.966 5.120 -13.714 568 HB3 LEU 74 HB3 LEU 74 4.643 3.927 -14.958 569 HG LEU 74 HG LEU 74 2.885 2.926 -13.706 570 HD11 LEU 74 HD11 LEU 74 3.681 4.678 -11.352 571 HD12 LEU 74 HD12 LEU 74 3.817 2.915 -11.446 572 HD13 LEU 74 HD13 LEU 74 2.219 3.673 -11.443 573 HD21 LEU 74 HD21 LEU 74 2.457 5.140 -14.826 574 HD22 LEU 74 HD22 LEU 74 2.684 5.927 -13.254 575 HD23 LEU 74 HD23 LEU 74 1.350 4.779 -13.489 576 H GLN 75 H GLN 75 6.187 1.866 -15.491 577 HA GLN 75 HA GLN 75 4.632 -0.451 -14.872 578 HB2 GLN 75 HB2 GLN 75 5.696 -1.442 -16.821 579 HB3 GLN 75 HB3 GLN 75 5.254 0.234 -17.164 580 HG2 GLN 75 HG2 GLN 75 7.586 0.912 -16.810 581 HG3 GLN 75 HG3 GLN 75 8.031 -0.757 -16.451 582 HE21 GLN 75 HE21 GLN 75 8.535 -2.099 -18.069 583 HE22 GLN 75 HE22 GLN 75 8.415 -1.685 -19.761 584 H ASN 76 H ASN 76 7.771 0.512 -13.793 585 HA ASN 76 HA ASN 76 8.554 -2.268 -13.085 586 HB2 ASN 76 HB2 ASN 76 10.333 -0.913 -14.007 587 HB3 ASN 76 HB3 ASN 76 9.952 0.429 -12.929 588 HD21 ASN 76 HD21 ASN 76 11.251 0.681 -11.265 589 HD22 ASN 76 HD22 ASN 76 12.148 -0.608 -10.498 590 H ASP 77 H ASP 77 8.379 0.947 -11.468 591 HA ASP 77 HA ASP 77 8.724 -0.094 -8.877 592 HB2 ASP 77 HB2 ASP 77 7.631 2.483 -9.985 593 HB3 ASP 77 HB3 ASP 77 7.596 2.167 -8.245 594 H LEU 78 H LEU 78 5.678 0.519 -10.651 595 HA LEU 78 HA LEU 78 3.967 0.175 -8.381 596 HB2 LEU 78 HB2 LEU 78 3.243 1.062 -10.573 597 HB3 LEU 78 HB3 LEU 78 3.527 -0.509 -11.307 598 HG LEU 78 HG LEU 78 1.721 -1.472 -9.926 599 HD11 LEU 78 HD11 LEU 78 1.703 0.039 -8.019 600 HD12 LEU 78 HD12 LEU 78 0.123 0.072 -8.821 601 HD13 LEU 78 HD13 LEU 78 1.269 1.405 -9.074 602 HD21 LEU 78 HD21 LEU 78 -0.095 -0.398 -11.200 603 HD22 LEU 78 HD22 LEU 78 1.336 -0.668 -12.213 604 HD23 LEU 78 HD23 LEU 78 0.983 0.963 -11.592 605 H ARG 79 H ARG 79 5.374 -2.104 -10.739 606 HA ARG 79 HA ARG 79 4.032 -4.391 -9.567 607 HB2 ARG 79 HB2 ARG 79 6.372 -4.178 -11.490 608 HB3 ARG 79 HB3 ARG 79 5.610 -5.699 -11.000 609 HG2 ARG 79 HG2 ARG 79 3.423 -4.822 -11.867 610 HG3 ARG 79 HG3 ARG 79 4.288 -3.408 -12.501 611 HD2 ARG 79 HD2 ARG 79 5.693 -4.885 -13.881 612 HD3 ARG 79 HD3 ARG 79 4.836 -6.305 -13.252 613 HE ARG 79 HE ARG 79 3.831 -4.282 -15.175 614 HH11 ARG 79 HH11 ARG 79 2.998 -7.126 -13.210 615 HH12 ARG 79 HH12 ARG 79 1.536 -7.430 -14.135 616 HH21 ARG 79 HH21 ARG 79 1.980 -4.801 -16.302 617 HH22 ARG 79 HH22 ARG 79 1.007 -6.191 -15.844 618 H LEU 80 H LEU 80 7.094 -2.718 -8.944 619 HA LEU 80 HA LEU 80 8.202 -4.862 -7.349 620 HB2 LEU 80 HB2 LEU 80 8.679 -1.869 -7.343 621 HB3 LEU 80 HB3 LEU 80 9.518 -2.974 -6.266 622 HG LEU 80 HG LEU 80 9.690 -3.052 -9.293 623 HD11 LEU 80 HD11 LEU 80 11.640 -2.036 -7.187 624 HD12 LEU 80 HD12 LEU 80 10.721 -1.034 -8.338 625 HD13 LEU 80 HD13 LEU 80 11.960 -2.157 -8.932 626 HD21 LEU 80 HD21 LEU 80 11.624 -4.561 -8.880 627 HD22 LEU 80 HD22 LEU 80 10.091 -5.268 -8.347 628 HD23 LEU 80 HD23 LEU 80 11.216 -4.584 -7.148 629 H ARG 81 H ARG 81 6.174 -1.973 -6.528 630 HA ARG 81 HA ARG 81 6.170 -2.603 -3.697 631 HB2 ARG 81 HB2 ARG 81 4.003 -1.138 -5.268 632 HB3 ARG 81 HB3 ARG 81 4.228 -1.133 -3.519 633 HG2 ARG 81 HG2 ARG 81 5.913 0.220 -5.623 634 HG3 ARG 81 HG3 ARG 81 5.043 0.945 -4.277 635 HD2 ARG 81 HD2 ARG 81 6.631 -0.280 -2.723 636 HD3 ARG 81 HD3 ARG 81 7.565 -0.754 -4.153 637 HE ARG 81 HE ARG 81 7.447 1.871 -2.873 638 HH11 ARG 81 HH11 ARG 81 8.252 0.217 -5.914 639 HH12 ARG 81 HH12 ARG 81 9.296 1.525 -6.447 640 HH21 ARG 81 HH21 ARG 81 8.771 3.457 -3.638 641 HH22 ARG 81 HH22 ARG 81 9.576 3.302 -5.187 642 H ALA 82 H ALA 82 4.105 -3.471 -6.448 643 HA ALA 82 HA ALA 82 2.154 -4.902 -4.960 644 HB1 ALA 82 HB1 ALA 82 2.047 -4.210 -7.407 645 HB2 ALA 82 HB2 ALA 82 3.130 -5.574 -7.767 646 HB3 ALA 82 HB3 ALA 82 1.523 -5.869 -7.071 647 H SER 83 H SER 83 5.357 -5.920 -6.261 648 HA SER 83 HA SER 83 4.989 -8.689 -5.638 649 HB2 SER 83 HB2 SER 83 7.554 -7.059 -5.786 650 HB3 SER 83 HB3 SER 83 7.456 -8.833 -5.762 651 HG SER 83 HG SER 83 6.418 -7.058 -7.739 652 H TYR 84 H TYR 84 6.432 -5.983 -3.745 653 HA TYR 84 HA TYR 84 7.187 -7.619 -1.530 654 HB2 TYR 84 HB2 TYR 84 7.727 -5.117 -2.141 655 HB3 TYR 84 HB3 TYR 84 6.292 -4.762 -1.170 656 HD1 TYR 84 HD1 TYR 84 6.287 -5.351 1.301 657 HD2 TYR 84 HD2 TYR 84 9.786 -5.903 -1.151 658 HE1 TYR 84 HE1 TYR 84 7.694 -5.583 3.344 659 HE2 TYR 84 HE2 TYR 84 11.183 -6.127 0.900 660 HH TYR 84 HH TYR 84 11.226 -6.212 3.142 661 H LEU 85 H LEU 85 4.233 -5.763 -2.255 662 HA LEU 85 HA LEU 85 2.789 -6.325 0.110 663 HB2 LEU 85 HB2 LEU 85 2.068 -4.671 -1.528 664 HB3 LEU 85 HB3 LEU 85 1.922 -5.906 -2.760 665 HG LEU 85 HG LEU 85 -0.017 -6.881 -1.634 666 HD11 LEU 85 HD11 LEU 85 -1.120 -5.642 0.201 667 HD12 LEU 85 HD12 LEU 85 0.300 -4.579 0.314 668 HD13 LEU 85 HD13 LEU 85 0.450 -6.310 0.687 669 HD21 LEU 85 HD21 LEU 85 -0.202 -3.876 -2.092 670 HD22 LEU 85 HD22 LEU 85 -1.560 -5.022 -2.117 671 HD23 LEU 85 HD23 LEU 85 -0.286 -5.134 -3.348 672 H ARG 86 H ARG 86 3.136 -8.169 -2.889 673 HA ARG 86 HA ARG 86 1.176 -10.145 -2.260 674 HB2 ARG 86 HB2 ARG 86 2.373 -9.673 -4.498 675 HB3 ARG 86 HB3 ARG 86 3.690 -10.664 -3.881 676 HG2 ARG 86 HG2 ARG 86 2.342 -12.049 -5.278 677 HG3 ARG 86 HG3 ARG 86 2.007 -12.553 -3.611 678 HD2 ARG 86 HD2 ARG 86 -0.094 -11.397 -3.589 679 HD3 ARG 86 HD3 ARG 86 0.290 -10.516 -5.067 680 HE ARG 86 HE ARG 86 -0.710 -13.256 -4.854 681 HH11 ARG 86 HH21 ARG 86 0.687 -10.829 -7.005 682 HH12 ARG 86 HH22 ARG 86 0.115 -11.639 -8.440 683 HH21 ARG 86 HH11 ARG 86 -1.411 -14.224 -6.741 684 HH22 ARG 86 HH12 ARG 86 -1.048 -13.513 -8.289 685 H TYR 87 H TYR 87 4.680 -9.967 -1.540 686 HA TYR 87 HA TYR 87 4.811 -12.626 -0.461 687 HB2 TYR 87 HB2 TYR 87 6.543 -10.232 0.245 688 HB3 TYR 87 HB3 TYR 87 6.936 -11.933 0.510 689 HD1 TYR 87 HD2 TYR 87 6.065 -13.099 -2.173 690 HD2 TYR 87 HD1 TYR 87 8.269 -9.522 -1.217 691 HE1 TYR 87 HE2 TYR 87 7.137 -13.148 -4.422 692 HE2 TYR 87 HE1 TYR 87 9.333 -9.588 -3.475 693 HH TYR 87 HH TYR 87 9.496 -10.696 -5.471 694 H ASP 88 H ASP 88 4.349 -9.399 1.088 695 HA ASP 88 HA ASP 88 4.225 -10.436 3.751 696 HB2 ASP 88 HB2 ASP 88 3.243 -7.930 2.398 697 HB3 ASP 88 HB3 ASP 88 2.674 -8.316 4.029 698 H LEU 89 H LEU 89 1.620 -9.813 1.332 699 HA LEU 89 HA LEU 89 -0.499 -10.611 3.075 700 HB2 LEU 89 HB2 LEU 89 -0.288 -9.641 0.497 701 HB3 LEU 89 HB3 LEU 89 -0.810 -11.281 0.203 702 HG LEU 89 HG LEU 89 -2.689 -9.814 0.166 703 HD11 LEU 89 HD11 LEU 89 -2.825 -11.258 2.836 704 HD12 LEU 89 HD12 LEU 89 -3.027 -12.044 1.251 705 HD13 LEU 89 HD13 LEU 89 -4.174 -10.798 1.772 706 HD21 LEU 89 HD21 LEU 89 -1.735 -7.986 1.471 707 HD22 LEU 89 HD22 LEU 89 -1.939 -8.933 2.962 708 HD23 LEU 89 HD23 LEU 89 -3.363 -8.422 2.028 709 H LYS 90 H LYS 90 1.590 -12.514 0.891 710 HA LYS 90 HA LYS 90 0.077 -14.937 1.173 711 HB2 LYS 90 HB2 LYS 90 2.887 -14.253 0.344 712 HB3 LYS 90 HB3 LYS 90 2.520 -15.932 0.738 713 HG2 LYS 90 HG2 LYS 90 0.961 -14.331 -1.319 714 HG3 LYS 90 HG3 LYS 90 2.349 -15.370 -1.702 715 HD2 LYS 90 HD2 LYS 90 1.127 -17.287 -0.597 716 HD3 LYS 90 HD3 LYS 90 -0.293 -16.233 -0.462 717 HE2 LYS 90 HE2 LYS 90 -0.314 -15.952 -2.918 718 HE3 LYS 90 HE3 LYS 90 1.096 -17.029 -3.040 719 HZ1 LYS 90 HZ1 LYS 90 -1.597 -17.765 -2.023 720 HZ2 LYS 90 HZ2 LYS 90 -0.279 -18.760 -1.964 721 HZ3 LYS 90 HZ3 LYS 90 -0.892 -18.290 -3.419 722 H THR 91 H THR 91 2.375 -13.280 3.234 723 HA THR 91 HA THR 91 2.800 -15.595 4.959 724 HB THR 91 HB THR 91 3.343 -12.659 5.592 725 HG1 THR 91 HG1 THR 91 4.434 -13.145 3.695 726 HG21 THR 91 HG21 THR 91 5.058 -13.550 7.063 727 HG22 THR 91 HG22 THR 91 4.710 -15.208 6.528 728 HG23 THR 91 HG23 THR 91 3.509 -14.307 7.478 729 H VAL 92 H VAL 92 0.738 -12.610 4.996 730 HA VAL 92 HA VAL 92 -0.317 -12.975 7.608 731 HB VAL 92 HB VAL 92 -1.731 -11.802 5.156 732 HG11 VAL 92 HG11 VAL 92 -3.402 -12.276 6.867 733 HG12 VAL 92 HG12 VAL 92 -2.360 -11.598 8.141 734 HG13 VAL 92 HG13 VAL 92 -3.069 -10.541 6.906 735 HG21 VAL 92 HG21 VAL 92 0.374 -10.660 5.705 736 HG22 VAL 92 HG22 VAL 92 -1.021 -9.643 6.053 737 HG23 VAL 92 HG23 VAL 92 -0.162 -10.468 7.377 738 H ILE 93 H ILE 93 -1.515 -14.294 4.488 739 HA ILE 93 HA ILE 93 -3.932 -15.343 5.594 740 HB ILE 93 HB ILE 93 -3.990 -16.810 3.629 741 HG12 ILE 93 HG12 ILE 93 -1.336 -15.633 2.828 742 HG13 ILE 93 HG13 ILE 93 -1.505 -17.222 3.564 743 HG21 ILE 93 HG21 ILE 93 -4.785 -14.466 3.499 744 HG22 ILE 93 HG22 ILE 93 -3.175 -13.946 2.968 745 HG23 ILE 93 HG23 ILE 93 -4.152 -15.007 1.941 746 HD11 ILE 93 HD11 ILE 93 -2.527 -16.325 0.868 747 HD12 ILE 93 HD12 ILE 93 -1.316 -17.571 1.235 748 HD13 ILE 93 HD13 ILE 93 -3.021 -17.853 1.641 749 H SER 94 H SER 94 -0.721 -16.442 6.043 750 HA SER 94 HA SER 94 -1.493 -19.242 6.390 751 HB2 SER 94 HB2 SER 94 1.062 -17.742 6.992 752 HB3 SER 94 HB3 SER 94 0.858 -19.507 7.030 753 HG SER 94 HG SER 94 0.928 -17.743 4.841 754 H ALA 95 H ALA 95 -1.530 -16.363 8.321 755 HA ALA 95 HA ALA 95 -1.184 -17.615 10.913 756 HB1 ALA 95 HB1 ALA 95 -1.011 -15.134 10.572 757 HB2 ALA 95 HB2 ALA 95 -2.728 -15.074 10.137 758 HB3 ALA 95 HB3 ALA 95 -2.237 -15.533 11.784 759 H LYS 96 H LYS 96 -3.851 -17.143 8.671 760 HA LYS 96 HA LYS 96 -5.559 -18.927 10.310 761 HB2 LYS 96 HB2 LYS 96 -5.921 -16.192 10.185 762 HB3 LYS 96 HB3 LYS 96 -6.968 -16.751 8.891 763 HG2 LYS 96 HG2 LYS 96 -8.360 -16.743 10.748 764 HG3 LYS 96 HG3 LYS 96 -7.864 -18.442 10.613 765 HD2 LYS 96 HD2 LYS 96 -5.985 -17.868 12.258 766 HD3 LYS 96 HD3 LYS 96 -6.826 -16.325 12.521 767 HE2 LYS 96 HE2 LYS 96 -8.870 -17.601 13.086 768 HE3 LYS 96 HE3 LYS 96 -7.946 -19.105 12.881 769 HZ1 LYS 96 HZ1 LYS 96 -6.479 -18.366 14.669 770 HZ2 LYS 96 HZ2 LYS 96 -8.039 -18.445 15.205 771 HZ3 LYS 96 HZ3 LYS 96 -7.356 -16.983 14.866 772 HA PRO 97 HA PRO 97 -5.136 -20.110 5.919 773 HB2 PRO 97 HB2 PRO 97 -4.540 -22.729 6.167 774 HB3 PRO 97 HB3 PRO 97 -3.380 -21.458 6.653 775 HG2 PRO 97 HG2 PRO 97 -5.335 -22.970 8.370 776 HG3 PRO 97 HG3 PRO 97 -3.566 -22.782 8.583 777 HD2 PRO 97 HD2 PRO 97 -5.371 -21.182 9.857 778 HD3 PRO 97 HD3 PRO 97 -3.765 -20.579 9.316 779 H LYS 98 H LYS 98 -7.899 -19.944 7.170 780 HA LYS 98 HA LYS 98 -9.102 -22.396 5.961 781 HB2 LYS 98 HB2 LYS 98 -10.244 -20.579 8.094 782 HB3 LYS 98 HB3 LYS 98 -11.047 -22.004 7.429 783 HG2 LYS 98 HG2 LYS 98 -8.423 -22.060 8.978 784 HG3 LYS 98 HG3 LYS 98 -10.023 -22.399 9.656 785 HD2 LYS 98 HD2 LYS 98 -10.288 -24.272 8.012 786 HD3 LYS 98 HD3 LYS 98 -8.617 -23.993 7.471 787 HE2 LYS 98 HE2 LYS 98 -7.799 -24.429 9.760 788 HE3 LYS 98 HE3 LYS 98 -9.465 -24.687 10.313 789 HZ1 LYS 98 HZ1 LYS 98 -9.613 -26.579 8.804 790 HZ2 LYS 98 HZ2 LYS 98 -8.354 -26.784 9.850 791 HZ3 LYS 98 HZ3 LYS 98 -8.064 -26.344 8.287 792 H ASP 99 H ASP 99 -11.693 -20.421 6.436 793 HA ASP 99 HA ASP 99 -11.870 -20.068 3.549 794 HB2 ASP 99 HB2 ASP 99 -13.837 -20.595 5.013 795 HB3 ASP 99 HB3 ASP 99 -13.721 -18.951 5.666 796 H GLU 100 H GLU 100 -11.164 -17.996 6.342 797 HA GLU 100 HA GLU 100 -11.359 -15.544 4.841 798 HB2 GLU 100 HB2 GLU 100 -10.307 -14.461 6.674 799 HB3 GLU 100 HB3 GLU 100 -11.442 -15.642 7.321 800 HG2 GLU 100 HG2 GLU 100 -8.436 -16.006 7.150 801 HG3 GLU 100 HG3 GLU 100 -9.334 -15.518 8.594 802 H LYS 101 H LYS 101 -8.883 -18.066 5.134 803 HA LYS 101 HA LYS 101 -6.737 -16.572 3.889 804 HB2 LYS 101 HB2 LYS 101 -6.357 -18.672 4.968 805 HB3 LYS 101 HB3 LYS 101 -7.446 -19.476 3.898 806 HG2 LYS 101 HG2 LYS 101 -5.583 -18.467 2.132 807 HG3 LYS 101 HG3 LYS 101 -4.610 -18.817 3.564 808 HD2 LYS 101 HD2 LYS 101 -4.634 -20.758 2.115 809 HD3 LYS 101 HD3 LYS 101 -5.532 -21.122 3.601 810 HE2 LYS 101 HE2 LYS 101 -7.349 -19.972 1.697 811 HE3 LYS 101 HE3 LYS 101 -6.440 -21.279 0.889 812 HZ1 LYS 101 HZ1 LYS 101 -8.068 -21.486 3.365 813 HZ2 LYS 101 HZ2 LYS 101 -7.037 -22.682 2.881 814 HZ3 LYS 101 HZ3 LYS 101 -8.325 -22.263 1.935 815 H LYS 102 H LYS 102 -9.634 -18.175 2.583 816 HA LYS 102 HA LYS 102 -8.719 -17.793 -0.174 817 HB2 LYS 102 HB2 LYS 102 -10.260 -19.348 -0.567 818 HB3 LYS 102 HB3 LYS 102 -10.643 -19.365 1.144 819 HG2 LYS 102 HG2 LYS 102 -12.712 -19.165 0.108 820 HG3 LYS 102 HG3 LYS 102 -12.379 -17.514 0.624 821 HD2 LYS 102 HD2 LYS 102 -11.779 -16.874 -1.638 822 HD3 LYS 102 HD3 LYS 102 -11.781 -18.564 -2.165 823 HE2 LYS 102 HE2 LYS 102 -13.822 -17.484 -2.927 824 HE3 LYS 102 HE3 LYS 102 -14.217 -18.698 -1.693 825 HZ1 LYS 102 HZ1 LYS 102 -15.436 -16.677 -1.307 826 HZ2 LYS 102 HZ2 LYS 102 -14.067 -15.760 -1.282 827 HZ3 LYS 102 HZ3 LYS 102 -14.353 -16.866 -0.078 828 H SER 103 H SER 103 -10.915 -16.159 2.136 829 HA SER 103 HA SER 103 -11.850 -14.266 0.222 830 HB2 SER 103 HB2 SER 103 -12.904 -14.890 2.434 831 HB3 SER 103 HB3 SER 103 -11.719 -13.813 3.206 832 HG SER 103 HG SER 103 -13.466 -13.044 1.085 833 H LEU 104 H LEU 104 -9.024 -14.174 2.396 834 HA LEU 104 HA LEU 104 -8.389 -11.413 1.779 835 HB2 LEU 104 HB2 LEU 104 -7.005 -13.768 2.989 836 HB3 LEU 104 HB3 LEU 104 -5.974 -12.508 2.318 837 HG LEU 104 HG LEU 104 -8.159 -11.827 4.286 838 HD11 LEU 104 HD11 LEU 104 -6.773 -13.578 5.331 839 HD12 LEU 104 HD12 LEU 104 -6.508 -11.996 6.094 840 HD13 LEU 104 HD13 LEU 104 -5.303 -12.642 4.957 841 HD21 LEU 104 HD21 LEU 104 -6.727 -9.891 4.737 842 HD22 LEU 104 HD22 LEU 104 -7.033 -9.993 2.991 843 HD23 LEU 104 HD23 LEU 104 -5.471 -10.524 3.655 844 H GLN 105 H GLN 105 -7.499 -14.590 0.365 845 HA GLN 105 HA GLN 105 -5.607 -13.454 -1.464 846 HB2 GLN 105 HB2 GLN 105 -7.018 -16.108 -1.326 847 HB3 GLN 105 HB3 GLN 105 -5.986 -15.677 -2.699 848 HG2 GLN 105 HG2 GLN 105 -4.114 -15.224 -1.143 849 HG3 GLN 105 HG3 GLN 105 -5.128 -15.765 0.198 850 HE21 GLN 105 HE21 GLN 105 -6.153 -17.979 -0.179 851 HE22 GLN 105 HE22 GLN 105 -5.081 -19.204 -0.832 852 H GLU 106 H GLU 106 -9.142 -14.007 -1.815 853 HA GLU 106 HA GLU 106 -8.986 -13.567 -4.668 854 HB2 GLU 106 HB2 GLU 106 -11.385 -13.415 -4.657 855 HB3 GLU 106 HB3 GLU 106 -10.841 -14.760 -3.651 856 HG2 GLU 106 HG2 GLU 106 -11.142 -13.211 -1.667 857 HG3 GLU 106 HG3 GLU 106 -12.014 -12.127 -2.756 858 H LEU 107 H LEU 107 -9.335 -11.357 -1.863 859 HA LEU 107 HA LEU 107 -9.681 -9.008 -3.554 860 HB2 LEU 107 HB2 LEU 107 -8.648 -9.325 -0.719 861 HB3 LEU 107 HB3 LEU 107 -8.821 -7.783 -1.537 862 HG LEU 107 HG LEU 107 -11.075 -9.625 -0.762 863 HD11 LEU 107 HD11 LEU 107 -10.009 -8.446 1.090 864 HD12 LEU 107 HD12 LEU 107 -11.625 -7.781 0.773 865 HD13 LEU 107 HD13 LEU 107 -10.182 -6.903 0.229 866 HD21 LEU 107 HD21 LEU 107 -11.111 -6.931 -2.202 867 HD22 LEU 107 HD22 LEU 107 -12.539 -7.698 -1.474 868 HD23 LEU 107 HD23 LEU 107 -11.712 -8.487 -2.827 869 H THR 108 H THR 108 -6.934 -10.776 -2.184 870 HA THR 108 HA THR 108 -4.868 -8.952 -2.918 871 HB THR 108 HB THR 108 -4.703 -12.020 -2.856 872 HG1 THR 108 HG1 THR 108 -5.519 -11.056 -0.896 873 HG21 THR 108 HG21 THR 108 -2.686 -11.009 -3.825 874 HG22 THR 108 HG22 THR 108 -2.345 -11.626 -2.182 875 HG23 THR 108 HG23 THR 108 -2.579 -9.880 -2.452 876 H SER 109 H SER 109 -6.568 -11.537 -4.743 877 HA SER 109 HA SER 109 -4.940 -11.200 -7.104 878 HB2 SER 109 HB2 SER 109 -6.344 -13.216 -6.570 879 HB3 SER 109 HB3 SER 109 -7.790 -12.249 -6.923 880 HG SER 109 HG SER 109 -6.844 -11.883 -9.035 881 H LYS 110 H LYS 110 -8.087 -9.828 -6.048 882 HA LYS 110 HA LYS 110 -8.784 -8.534 -8.465 883 HB2 LYS 110 HB2 LYS 110 -9.309 -7.861 -5.562 884 HB3 LYS 110 HB3 LYS 110 -9.965 -6.892 -6.873 885 HG2 LYS 110 HG2 LYS 110 -10.490 -9.816 -7.010 886 HG3 LYS 110 HG3 LYS 110 -11.306 -8.893 -5.730 887 HD2 LYS 110 HD2 LYS 110 -12.069 -7.257 -7.461 888 HD3 LYS 110 HD3 LYS 110 -11.398 -8.327 -8.712 889 HE2 LYS 110 HE2 LYS 110 -12.888 -10.139 -7.983 890 HE3 LYS 110 HE3 LYS 110 -13.504 -9.121 -6.661 891 HZ1 LYS 110 HZ1 LYS 110 -13.788 -8.517 -9.549 892 HZ2 LYS 110 HZ2 LYS 110 -14.353 -7.579 -8.315 893 HZ3 LYS 110 HZ3 LYS 110 -14.987 -9.082 -8.564 894 H LEU 111 H LEU 111 -6.857 -7.281 -5.741 895 HA LEU 111 HA LEU 111 -6.581 -4.648 -6.768 896 HB2 LEU 111 HB2 LEU 111 -5.779 -5.974 -4.498 897 HB3 LEU 111 HB3 LEU 111 -4.247 -5.787 -5.329 898 HG LEU 111 HG LEU 111 -6.062 -3.648 -4.229 899 HD11 LEU 111 HD11 LEU 111 -4.050 -3.014 -3.016 900 HD12 LEU 111 HD12 LEU 111 -3.092 -4.214 -3.909 901 HD13 LEU 111 HD13 LEU 111 -4.362 -4.740 -2.781 902 HD21 LEU 111 HD21 LEU 111 -4.459 -1.963 -5.182 903 HD22 LEU 111 HD22 LEU 111 -5.474 -2.751 -6.398 904 HD23 LEU 111 HD23 LEU 111 -3.786 -3.249 -6.194 905 H PHE 112 H PHE 112 -4.676 -7.602 -7.323 906 HA PHE 112 HA PHE 112 -2.606 -6.167 -8.722 907 HB2 PHE 112 HB2 PHE 112 -3.249 -9.078 -8.347 908 HB3 PHE 112 HB3 PHE 112 -1.958 -8.546 -9.433 909 HD1 PHE 112 HD1 PHE 112 -3.082 -7.567 -5.943 910 HD2 PHE 112 HD2 PHE 112 0.175 -8.675 -8.519 911 HE1 PHE 112 HE1 PHE 112 -1.551 -7.382 -4.034 912 HE2 PHE 112 HE2 PHE 112 1.738 -8.488 -6.580 913 HZ PHE 112 HZ PHE 112 0.848 -7.846 -4.327 914 H SER 113 H SER 113 -5.690 -7.541 -9.692 915 HA SER 113 HA SER 113 -5.074 -7.626 -12.511 916 HB2 SER 113 HB2 SER 113 -7.749 -7.191 -11.122 917 HB3 SER 113 HB3 SER 113 -7.512 -7.663 -12.816 918 HG SER 113 HG SER 113 -6.352 -9.529 -11.927 919 H SER 114 H SER 114 -6.423 -5.076 -10.336 920 HA SER 114 HA SER 114 -6.787 -3.229 -12.556 921 HB2 SER 114 HB2 SER 114 -6.942 -1.561 -10.553 922 HB3 SER 114 HB3 SER 114 -8.205 -2.790 -10.771 923 HG SER 114 HG SER 114 -7.718 -3.166 -8.744 924 H ILE 115 H ILE 115 -4.194 -3.993 -10.284 925 HA ILE 115 HA ILE 115 -2.479 -1.768 -10.863 926 HB ILE 115 HB ILE 115 -2.087 -4.580 -9.837 927 HG12 ILE 115 HG12 ILE 115 -1.241 -1.910 -8.680 928 HG13 ILE 115 HG13 ILE 115 -2.841 -2.615 -8.432 929 HG21 ILE 115 HG21 ILE 115 -0.127 -4.452 -11.220 930 HG22 ILE 115 HG22 ILE 115 0.187 -2.776 -10.735 931 HG23 ILE 115 HG23 ILE 115 0.412 -4.096 -9.574 932 HD11 ILE 115 HD11 ILE 115 -0.179 -3.720 -7.459 933 HD12 ILE 115 HD12 ILE 115 -1.540 -3.137 -6.487 934 HD13 ILE 115 HD13 ILE 115 -1.696 -4.646 -7.405 935 H ASP 116 H ASP 116 -2.910 -4.964 -12.467 936 HA ASP 116 HA ASP 116 -0.745 -4.594 -14.287 937 HB2 ASP 116 HB2 ASP 116 -2.463 -6.633 -13.668 938 HB3 ASP 116 HB3 ASP 116 -3.044 -6.170 -15.273 939 H ASN 117 H ASN 117 -4.171 -3.650 -14.441 940 HA ASN 117 HA ASN 117 -4.075 -2.764 -17.187 941 HB2 ASN 117 HB2 ASN 117 -5.865 -1.954 -14.863 942 HB3 ASN 117 HB3 ASN 117 -6.080 -1.395 -16.525 943 HD21 ASN 117 HD21 ASN 117 -7.740 -3.092 -14.694 944 HD22 ASN 117 HD22 ASN 117 -8.084 -4.514 -15.646 945 H LEU 118 H LEU 118 -3.417 -1.196 -14.052 946 HA LEU 118 HA LEU 118 -3.141 1.472 -15.061 947 HB2 LEU 118 HB2 LEU 118 -3.306 0.452 -12.641 948 HB3 LEU 118 HB3 LEU 118 -1.565 0.366 -12.742 949 HG LEU 118 HG LEU 118 -3.243 2.889 -12.856 950 HD11 LEU 118 HD11 LEU 118 -3.240 1.774 -10.667 951 HD12 LEU 118 HD12 LEU 118 -2.294 3.273 -10.600 952 HD13 LEU 118 HD13 LEU 118 -1.461 1.706 -10.684 953 HD21 LEU 118 HD21 LEU 118 -1.080 4.086 -12.502 954 HD22 LEU 118 HD22 LEU 118 -1.206 3.316 -14.091 955 HD23 LEU 118 HD23 LEU 118 -0.219 2.561 -12.819 956 H ASP 119 H ASP 119 -0.857 -1.228 -14.595 957 HA ASP 119 HA ASP 119 1.523 0.177 -15.355 958 HB2 ASP 119 HB2 ASP 119 1.976 -1.827 -14.316 959 HB3 ASP 119 HB3 ASP 119 0.624 -2.663 -15.090 960 H HIS 120 H HIS 120 -0.870 -1.678 -17.325 961 HA HIS 120 HA HIS 120 0.684 -1.249 -19.730 962 HB2 HIS 120 HB2 HIS 120 -2.113 -2.227 -19.209 963 HB3 HIS 120 HB3 HIS 120 -1.505 -1.937 -20.847 964 HD1 HIS 120 HD1 HIS 120 -1.102 -4.319 -17.936 965 HD2 HIS 120 HD2 HIS 120 0.493 -3.660 -21.738 966 HE1 HIS 120 HE1 HIS 120 0.240 -6.373 -18.542 967 H ALA 121 H ALA 121 -1.926 0.542 -18.130 968 HA ALA 121 HA ALA 121 -2.364 2.372 -20.301 969 HB1 ALA 121 HB1 ALA 121 -3.906 2.165 -18.429 970 HB2 ALA 121 HB2 ALA 121 -2.654 2.746 -17.307 971 HB3 ALA 121 HB3 ALA 121 -3.299 3.831 -18.558 972 H ALA 122 H ALA 122 0.026 2.172 -17.681 973 HA ALA 122 HA ALA 122 1.192 4.764 -18.160 974 HB1 ALA 122 HB1 ALA 122 1.494 3.383 -16.087 975 HB2 ALA 122 HB2 ALA 122 2.509 2.269 -17.026 976 HB3 ALA 122 HB3 ALA 122 3.023 3.951 -16.801 977 H LYS 123 H LYS 123 1.907 1.451 -19.359 978 HA LYS 123 HA LYS 123 4.254 2.207 -20.822 979 HB2 LYS 123 HB2 LYS 123 2.195 -0.013 -21.234 980 HB3 LYS 123 HB3 LYS 123 3.649 0.121 -22.222 981 HG2 LYS 123 HG2 LYS 123 5.069 -0.396 -20.426 982 HG3 LYS 123 HG3 LYS 123 3.799 -0.123 -19.216 983 HD2 LYS 123 HD2 LYS 123 2.528 -2.028 -20.108 984 HD3 LYS 123 HD3 LYS 123 3.779 -2.312 -21.329 985 HE2 LYS 123 HE2 LYS 123 5.371 -2.953 -19.677 986 HE3 LYS 123 HE3 LYS 123 4.351 -2.330 -18.359 987 HZ1 LYS 123 HZ1 LYS 123 2.767 -4.019 -18.731 988 HZ2 LYS 123 HZ2 LYS 123 4.233 -4.775 -18.655 989 HZ3 LYS 123 HZ3 LYS 123 3.497 -4.550 -20.117 990 H ILE 124 H ILE 124 0.792 2.302 -21.602 991 HA ILE 124 HA ILE 124 1.379 3.038 -24.393 992 HB ILE 124 HB ILE 124 -0.604 1.527 -23.499 993 HG12 ILE 124 HG12 ILE 124 -2.018 2.353 -25.475 994 HG13 ILE 124 HG13 ILE 124 -0.760 3.563 -25.735 995 HG21 ILE 124 HG21 ILE 124 -1.548 3.327 -22.014 996 HG22 ILE 124 HG22 ILE 124 -1.991 4.242 -23.467 997 HG23 ILE 124 HG23 ILE 124 -2.711 2.647 -23.157 998 HD11 ILE 124 HD11 ILE 124 -0.460 1.567 -27.185 999 HD12 ILE 124 HD12 ILE 124 0.915 1.770 -26.079 1000 HD13 ILE 124 HD13 ILE 124 -0.325 0.539 -25.740 1001 H LYS 125 H LYS 125 1.730 4.603 -21.651 1002 HA LYS 125 HA LYS 125 1.643 6.719 -20.888 1003 HB2 LYS 125 HB2 LYS 125 2.572 8.446 -22.414 1004 HB3 LYS 125 HB3 LYS 125 3.524 6.994 -22.212 1005 HG2 LYS 125 HG2 LYS 125 1.769 7.142 -24.628 1006 HG3 LYS 125 HG3 LYS 125 3.210 8.161 -24.571 1007 HD2 LYS 125 HD2 LYS 125 4.663 6.401 -24.663 1008 HD3 LYS 125 HD3 LYS 125 3.612 5.350 -23.707 1009 HE2 LYS 125 HE2 LYS 125 2.087 5.206 -25.737 1010 HE3 LYS 125 HE3 LYS 125 3.399 5.973 -26.664 1011 HZ1 LYS 125 HZ1 LYS 125 3.471 3.512 -26.689 1012 HZ2 LYS 125 HZ2 LYS 125 3.694 3.492 -25.049 1013 HZ3 LYS 125 HZ3 LYS 125 4.841 4.157 -26.034 1014 H SER 126 H SER 126 -0.891 5.945 -21.233 1015 HA SER 126 HA SER 126 -2.224 8.471 -22.141 1016 HB2 SER 126 HB2 SER 126 -3.239 6.447 -23.071 1017 HB3 SER 126 HB3 SER 126 -3.381 5.748 -21.443 1018 HG SER 126 HG SER 126 -5.311 6.821 -22.298 1019 HA PRO 127 HA PRO 127 -1.732 8.835 -17.682 1020 HB2 PRO 127 HB2 PRO 127 -2.430 11.477 -17.373 1021 HB3 PRO 127 HB3 PRO 127 -0.811 10.951 -17.927 1022 HG2 PRO 127 HG2 PRO 127 -3.169 11.823 -19.581 1023 HG3 PRO 127 HG3 PRO 127 -1.467 12.385 -19.656 1024 HD2 PRO 127 HD2 PRO 127 -2.374 10.520 -21.363 1025 HD3 PRO 127 HD3 PRO 127 -0.731 10.378 -20.644 1026 H THR 128 H THR 128 -4.568 9.966 -19.554 1027 HA THR 128 HA THR 128 -6.343 10.164 -17.347 1028 HB THR 128 HB THR 128 -7.078 9.342 -20.188 1029 HG1 THR 128 HG1 THR 128 -6.731 11.979 -19.184 1030 HG21 THR 128 HG21 THR 128 -8.507 10.979 -18.048 1031 HG22 THR 128 HG22 THR 128 -8.956 9.348 -18.604 1032 HG23 THR 128 HG23 THR 128 -9.088 10.731 -19.712 1033 H GLU 129 H GLU 129 -5.537 7.407 -19.511 1034 HA GLU 129 HA GLU 129 -7.442 5.611 -18.296 1035 HB2 GLU 129 HB2 GLU 129 -4.932 5.241 -19.945 1036 HB3 GLU 129 HB3 GLU 129 -5.785 3.859 -19.259 1037 HG2 GLU 129 HG2 GLU 129 -7.089 5.905 -21.067 1038 HG3 GLU 129 HG3 GLU 129 -6.380 4.382 -21.633 1039 H ALA 130 H ALA 130 -4.000 6.390 -17.698 1040 HA ALA 130 HA ALA 130 -3.613 4.320 -15.770 1041 HB1 ALA 130 HB1 ALA 130 -1.781 5.533 -16.901 1042 HB2 ALA 130 HB2 ALA 130 -2.224 7.010 -16.011 1043 HB3 ALA 130 HB3 ALA 130 -1.626 5.583 -15.130 1044 H GLU 131 H GLU 131 -4.712 7.724 -15.448 1045 HA GLU 131 HA GLU 131 -4.912 7.671 -12.576 1046 HB2 GLU 131 HB2 GLU 131 -6.236 9.317 -14.744 1047 HB3 GLU 131 HB3 GLU 131 -6.582 9.563 -13.025 1048 HG2 GLU 131 HG2 GLU 131 -4.222 10.023 -12.584 1049 HG3 GLU 131 HG3 GLU 131 -3.826 9.744 -14.277 1050 H LYS 132 H LYS 132 -7.162 6.789 -15.215 1051 HA LYS 132 HA LYS 132 -9.460 6.360 -13.581 1052 HB2 LYS 132 HB2 LYS 132 -9.403 6.421 -16.084 1053 HB3 LYS 132 HB3 LYS 132 -8.597 4.857 -16.071 1054 HG2 LYS 132 HG2 LYS 132 -10.610 3.885 -14.921 1055 HG3 LYS 132 HG3 LYS 132 -11.409 5.458 -15.119 1056 HD2 LYS 132 HD2 LYS 132 -12.143 4.148 -16.961 1057 HD3 LYS 132 HD3 LYS 132 -10.899 5.226 -17.630 1058 HE2 LYS 132 HE2 LYS 132 -9.225 3.377 -17.389 1059 HE3 LYS 132 HE3 LYS 132 -10.517 2.313 -16.807 1060 HZ1 LYS 132 HZ1 LYS 132 -10.347 3.587 -19.476 1061 HZ2 LYS 132 HZ2 LYS 132 -11.617 2.650 -18.963 1062 HZ3 LYS 132 HZ3 LYS 132 -10.108 1.994 -19.144 1063 H TYR 133 H TYR 133 -6.830 4.089 -14.552 1064 HA TYR 133 HA TYR 133 -7.999 1.932 -12.984 1065 HB2 TYR 133 HB2 TYR 133 -5.224 2.260 -14.163 1066 HB3 TYR 133 HB3 TYR 133 -5.849 0.774 -13.429 1067 HD1 TYR 133 HD1 TYR 133 -8.417 0.233 -14.434 1068 HD2 TYR 133 HD2 TYR 133 -5.212 2.214 -16.499 1069 HE1 TYR 133 HE1 TYR 133 -9.459 -0.353 -16.625 1070 HE2 TYR 133 HE2 TYR 133 -6.266 1.637 -18.683 1071 HH TYR 133 HH TYR 133 -8.097 0.799 -19.724 1072 H TYR 134 H TYR 134 -5.645 4.503 -12.326 1073 HA TYR 134 HA TYR 134 -4.736 3.466 -9.813 1074 HB2 TYR 134 HB2 TYR 134 -3.547 5.322 -10.691 1075 HB3 TYR 134 HB3 TYR 134 -5.026 6.247 -10.948 1076 HD1 TYR 134 HD1 TYR 134 -2.876 4.839 -8.206 1077 HD2 TYR 134 HD2 TYR 134 -5.851 7.740 -9.330 1078 HE1 TYR 134 HE1 TYR 134 -2.690 5.917 -5.968 1079 HE2 TYR 134 HE2 TYR 134 -5.663 8.798 -7.084 1080 HH TYR 134 HH TYR 134 -3.363 7.674 -4.630 1081 H GLY 135 H GLY 135 -7.581 5.490 -10.721 1082 HA2 GLY 135 HA2 GLY 135 -8.574 5.798 -8.078 1083 HA3 GLY 135 HA3 GLY 135 -9.553 5.819 -9.557 1084 H GLN 136 H GLN 136 -8.936 3.102 -10.395 1085 HA GLN 136 HA GLN 136 -10.842 1.683 -8.741 1086 HB2 GLN 136 HB2 GLN 136 -8.930 0.673 -10.880 1087 HB3 GLN 136 HB3 GLN 136 -10.189 -0.298 -10.108 1088 HG2 GLN 136 HG2 GLN 136 -11.896 1.309 -10.953 1089 HG3 GLN 136 HG3 GLN 136 -10.619 2.161 -11.828 1090 HE21 GLN 136 HE21 GLN 136 -12.968 0.854 -12.902 1091 HE22 GLN 136 HE22 GLN 136 -12.388 -0.395 -13.979 1092 H THR 137 H THR 137 -7.243 1.657 -9.001 1093 HA THR 137 HA THR 137 -6.992 -0.518 -7.133 1094 HB THR 137 HB THR 137 -4.634 0.216 -6.764 1095 HG1 THR 137 HG1 THR 137 -5.589 2.532 -7.848 1096 HG21 THR 137 HG21 THR 137 -5.489 0.140 -9.674 1097 HG22 THR 137 HG22 THR 137 -5.118 -1.259 -8.638 1098 HG23 THR 137 HG23 THR 137 -3.841 -0.104 -9.069 1099 H VAL 138 H VAL 138 -7.347 3.025 -6.618 1100 HA VAL 138 HA VAL 138 -6.596 3.027 -3.872 1101 HB VAL 138 HB VAL 138 -8.674 4.715 -5.353 1102 HG11 VAL 138 HG11 VAL 138 -9.301 4.793 -3.001 1103 HG12 VAL 138 HG12 VAL 138 -7.611 5.045 -2.509 1104 HG13 VAL 138 HG13 VAL 138 -8.482 6.310 -3.406 1105 HG21 VAL 138 HG21 VAL 138 -5.875 5.414 -4.376 1106 HG22 VAL 138 HG22 VAL 138 -6.279 4.979 -6.044 1107 HG23 VAL 138 HG23 VAL 138 -6.961 6.447 -5.330 1108 H SER 139 H SER 139 -9.822 2.435 -5.362 1109 HA SER 139 HA SER 139 -11.142 1.986 -2.875 1110 HB2 SER 139 HB2 SER 139 -11.759 0.793 -5.606 1111 HB3 SER 139 HB3 SER 139 -12.884 0.923 -4.236 1112 HG SER 139 HG SER 139 -13.095 2.638 -5.787 1113 H ASN 140 H ASN 140 -9.435 -0.216 -5.105 1114 HA ASN 140 HA ASN 140 -10.173 -2.602 -3.687 1115 HB2 ASN 140 HB2 ASN 140 -9.139 -2.114 -6.099 1116 HB3 ASN 140 HB3 ASN 140 -7.625 -2.439 -5.251 1117 HD21 ASN 140 HD21 ASN 140 -8.624 -4.403 -3.422 1118 HD22 ASN 140 HD22 ASN 140 -9.032 -5.816 -4.369 1119 H ILE 141 H ILE 141 -7.477 -0.297 -3.344 1120 HA ILE 141 HA ILE 141 -5.876 -1.916 -1.566 1121 HB ILE 141 HB ILE 141 -6.076 1.111 -2.008 1122 HG12 ILE 141 HG12 ILE 141 -3.679 -0.658 -2.506 1123 HG13 ILE 141 HG13 ILE 141 -5.005 -0.625 -3.660 1124 HG21 ILE 141 HG21 ILE 141 -4.284 -0.408 -0.076 1125 HG22 ILE 141 HG22 ILE 141 -3.891 1.216 -0.659 1126 HG23 ILE 141 HG23 ILE 141 -5.369 0.949 0.286 1127 HD11 ILE 141 HD11 ILE 141 -3.375 0.910 -4.435 1128 HD12 ILE 141 HD12 ILE 141 -4.728 1.871 -3.820 1129 HD13 ILE 141 HD13 ILE 141 -3.249 1.697 -2.848 1130 H ASN 142 H ASN 142 -8.468 0.528 -1.093 1131 HA ASN 142 HA ASN 142 -8.476 0.444 1.740 1132 HB2 ASN 142 HB2 ASN 142 -9.720 2.069 0.309 1133 HB3 ASN 142 HB3 ASN 142 -10.867 0.785 -0.092 1134 HD21 ASN 142 HD21 ASN 142 -12.693 1.191 0.923 1135 HD22 ASN 142 HD22 ASN 142 -12.832 1.604 2.615 1136 H GLU 143 H GLU 143 -10.145 -1.712 -0.623 1137 HA GLU 143 HA GLU 143 -11.621 -3.161 1.341 1138 HB2 GLU 143 HB2 GLU 143 -10.478 -4.060 -1.327 1139 HB3 GLU 143 HB3 GLU 143 -11.562 -5.044 -0.352 1140 HG2 GLU 143 HG2 GLU 143 -13.335 -3.382 -0.605 1141 HG3 GLU 143 HG3 GLU 143 -12.253 -2.374 -1.581 1142 H VAL 144 H VAL 144 -8.393 -3.740 -0.039 1143 HA VAL 144 HA VAL 144 -7.966 -6.199 1.424 1144 HB VAL 144 HB VAL 144 -6.009 -4.201 0.143 1145 HG11 VAL 144 HG11 VAL 144 -5.483 -6.979 1.287 1146 HG12 VAL 144 HG12 VAL 144 -4.353 -6.091 0.232 1147 HG13 VAL 144 HG13 VAL 144 -4.773 -5.438 1.826 1148 HG21 VAL 144 HG21 VAL 144 -7.581 -5.398 -1.412 1149 HG22 VAL 144 HG22 VAL 144 -5.885 -5.830 -1.677 1150 HG23 VAL 144 HG23 VAL 144 -6.951 -6.942 -0.802 1151 H LEU 145 H LEU 145 -7.492 -2.730 2.104 1152 HA LEU 145 HA LEU 145 -5.776 -3.134 4.398 1153 HB2 LEU 145 HB2 LEU 145 -7.126 -0.902 3.079 1154 HB3 LEU 145 HB3 LEU 145 -7.192 -0.759 4.830 1155 HG LEU 145 HG LEU 145 -4.748 -0.881 4.973 1156 HD11 LEU 145 HD11 LEU 145 -4.856 -1.085 1.955 1157 HD12 LEU 145 HD12 LEU 145 -4.170 -2.265 3.087 1158 HD13 LEU 145 HD13 LEU 145 -3.396 -0.681 2.881 1159 HD21 LEU 145 HD21 LEU 145 -4.265 1.300 3.932 1160 HD22 LEU 145 HD22 LEU 145 -5.863 1.301 4.707 1161 HD23 LEU 145 HD23 LEU 145 -5.736 1.158 2.940 1162 H ALA 146 H ALA 146 -9.307 -2.745 4.022 1163 HA ALA 146 HA ALA 146 -9.860 -2.815 6.844 1164 HB1 ALA 146 HB1 ALA 146 -12.175 -3.337 6.119 1165 HB2 ALA 146 HB2 ALA 146 -11.487 -2.013 5.148 1166 HB3 ALA 146 HB3 ALA 146 -11.591 -3.653 4.465 1167 H LYS 147 H LYS 147 -9.362 -5.302 4.378 1168 HA LYS 147 HA LYS 147 -10.223 -7.524 6.006 1169 HB2 LYS 147 HB2 LYS 147 -9.588 -7.155 3.379 1170 HB3 LYS 147 HB3 LYS 147 -8.118 -7.937 3.949 1171 HG2 LYS 147 HG2 LYS 147 -9.516 -9.655 3.125 1172 HG3 LYS 147 HG3 LYS 147 -9.606 -9.780 4.891 1173 HD2 LYS 147 HD2 LYS 147 -11.770 -8.635 4.891 1174 HD3 LYS 147 HD3 LYS 147 -11.638 -8.340 3.146 1175 HE2 LYS 147 HE2 LYS 147 -11.564 -10.793 2.759 1176 HE3 LYS 147 HE3 LYS 147 -11.804 -11.053 4.499 1177 HZ1 LYS 147 HZ1 LYS 147 -13.697 -9.617 2.731 1178 HZ2 LYS 147 HZ2 LYS 147 -13.936 -9.967 4.325 1179 HZ3 LYS 147 HZ3 LYS 147 -13.866 -11.185 3.210 1180 H LEU 148 H LEU 148 -7.403 -5.572 6.039 1181 HA LEU 148 HA LEU 148 -5.890 -7.584 7.659 1182 HB2 LEU 148 HB2 LEU 148 -4.993 -5.094 6.182 1183 HB3 LEU 148 HB3 LEU 148 -3.933 -6.142 7.114 1184 HG LEU 148 HG LEU 148 -5.411 -7.069 4.649 1185 HD11 LEU 148 HD11 LEU 148 -3.250 -6.648 3.503 1186 HD12 LEU 148 HD12 LEU 148 -2.620 -5.907 4.987 1187 HD13 LEU 148 HD13 LEU 148 -3.979 -5.160 4.118 1188 HD21 LEU 148 HD21 LEU 148 -4.638 -8.857 6.138 1189 HD22 LEU 148 HD22 LEU 148 -3.002 -8.154 6.147 1190 HD23 LEU 148 HD23 LEU 148 -3.685 -8.819 4.644 1191 H GLY 149 H GLY 149 -8.106 -5.482 8.424 1192 HA2 GLY 149 HA2 GLY 149 -7.029 -3.241 9.619 1193 HA3 GLY 149 HA3 GLY 149 -8.475 -4.062 10.199 Start of MODEL 17 1 H1 GLU 1 H1 GLU 1 -12.571 8.276 21.478 2 H2 GLU 1 H2 GLU 1 -13.035 7.322 20.214 3 H3 GLU 1 H3 GLU 1 -13.882 7.284 21.628 4 HA GLU 1 HA GLU 1 -12.012 6.369 22.806 5 HB2 GLU 1 HB2 GLU 1 -12.866 4.888 20.300 6 HB3 GLU 1 HB3 GLU 1 -11.948 4.156 21.627 7 HG2 GLU 1 HG2 GLU 1 -13.781 4.671 23.180 8 HG3 GLU 1 HG3 GLU 1 -14.694 5.415 21.851 9 H ALA 2 H ALA 2 -11.187 5.447 19.435 10 HA ALA 2 HA ALA 2 -8.401 5.609 20.111 11 HB1 ALA 2 HB1 ALA 2 -9.349 3.864 18.641 12 HB2 ALA 2 HB2 ALA 2 -9.745 5.103 17.422 13 HB3 ALA 2 HB3 ALA 2 -8.048 4.766 17.831 14 H ARG 3 H ARG 3 -8.786 8.092 20.627 15 HA ARG 3 HA ARG 3 -7.103 9.421 18.599 16 HB2 ARG 3 HB2 ARG 3 -9.731 10.648 19.577 17 HB3 ARG 3 HB3 ARG 3 -8.394 11.583 18.908 18 HG2 ARG 3 HG2 ARG 3 -8.639 10.171 16.779 19 HG3 ARG 3 HG3 ARG 3 -10.191 9.630 17.462 20 HD2 ARG 3 HD2 ARG 3 -10.756 12.094 17.785 21 HD3 ARG 3 HD3 ARG 3 -9.326 12.482 16.825 22 HE ARG 3 HE ARG 3 -11.888 11.393 15.885 23 HH11 ARG 3 HH11 ARG 3 -8.524 12.102 14.980 24 HH12 ARG 3 HH12 ARG 3 -8.931 12.147 13.286 25 HH21 ARG 3 HH21 ARG 3 -12.280 11.443 13.708 26 HH22 ARG 3 HH22 ARG 3 -10.991 11.760 12.585 27 HA PRO 4 HA PRO 4 -5.519 10.238 22.646 28 HB2 PRO 4 HB2 PRO 4 -3.805 12.322 22.251 29 HB3 PRO 4 HB3 PRO 4 -3.490 10.680 21.606 30 HG2 PRO 4 HG2 PRO 4 -4.689 13.051 20.213 31 HG3 PRO 4 HG3 PRO 4 -3.349 11.988 19.684 32 HD2 PRO 4 HD2 PRO 4 -5.893 11.648 18.815 33 HD3 PRO 4 HD3 PRO 4 -4.800 10.253 19.112 34 H ILE 5 H ILE 5 -7.315 10.860 23.828 35 HA ILE 5 HA ILE 5 -7.401 13.749 24.444 36 HB ILE 5 HB ILE 5 -9.278 13.398 22.833 37 HG12 ILE 5 HG12 ILE 5 -10.307 13.787 25.668 38 HG13 ILE 5 HG13 ILE 5 -9.373 14.997 24.787 39 HG21 ILE 5 HG21 ILE 5 -9.692 10.965 23.311 40 HG22 ILE 5 HG22 ILE 5 -10.425 11.416 24.868 41 HG23 ILE 5 HG23 ILE 5 -11.179 11.931 23.341 42 HD11 ILE 5 HD11 ILE 5 -11.161 15.055 23.036 43 HD12 ILE 5 HD12 ILE 5 -12.122 13.936 24.032 44 HD13 ILE 5 HD13 ILE 5 -11.721 15.552 24.646 45 H VAL 6 H VAL 6 -7.595 14.087 26.602 46 HA VAL 6 HA VAL 6 -7.768 11.634 28.312 47 HB VAL 6 HB VAL 6 -6.381 14.302 28.890 48 HG11 VAL 6 HG11 VAL 6 -7.182 13.223 30.953 49 HG12 VAL 6 HG12 VAL 6 -6.433 11.684 30.463 50 HG13 VAL 6 HG13 VAL 6 -5.414 13.092 30.846 51 HG21 VAL 6 HG21 VAL 6 -5.226 11.578 28.133 52 HG22 VAL 6 HG22 VAL 6 -5.147 13.072 27.170 53 HG23 VAL 6 HG23 VAL 6 -4.269 12.964 28.706 54 H VAL 7 H VAL 7 -8.653 15.086 28.015 55 HA VAL 7 HA VAL 7 -11.134 14.566 29.501 56 HB VAL 7 HB VAL 7 -9.412 15.208 31.248 57 HG11 VAL 7 HG11 VAL 7 -9.271 17.865 29.756 58 HG12 VAL 7 HG12 VAL 7 -8.513 17.494 31.321 59 HG13 VAL 7 HG13 VAL 7 -7.973 16.653 29.857 60 HG21 VAL 7 HG21 VAL 7 -10.746 16.881 32.380 61 HG22 VAL 7 HG22 VAL 7 -11.521 17.370 30.858 62 HG23 VAL 7 HG23 VAL 7 -11.829 15.752 31.542 63 H GLY 8 H GLY 8 -12.702 16.215 29.003 64 HA2 GLY 8 HA2 GLY 8 -13.057 18.434 27.892 65 HA3 GLY 8 HA3 GLY 8 -11.958 17.865 26.621 66 HA PRO 9 HA PRO 9 -16.347 16.412 25.850 67 HB2 PRO 9 HB2 PRO 9 -17.048 17.882 23.654 68 HB3 PRO 9 HB3 PRO 9 -17.286 18.497 25.323 69 HG2 PRO 9 HG2 PRO 9 -15.020 19.039 23.412 70 HG3 PRO 9 HG3 PRO 9 -16.008 20.208 24.348 71 HD2 PRO 9 HD2 PRO 9 -13.571 19.378 25.208 72 HD3 PRO 9 HD3 PRO 9 -14.919 19.693 26.360 73 HA PRO 10 HA PRO 10 -14.375 13.903 22.841 74 HB2 PRO 10 HB2 PRO 10 -16.426 12.561 21.605 75 HB3 PRO 10 HB3 PRO 10 -15.904 12.200 23.283 76 HG2 PRO 10 HG2 PRO 10 -18.162 13.968 22.350 77 HG3 PRO 10 HG3 PRO 10 -18.194 12.649 23.566 78 HD2 PRO 10 HD2 PRO 10 -17.969 15.229 24.310 79 HD3 PRO 10 HD3 PRO 10 -17.046 13.941 25.162 80 HA PRO 11 HA PRO 11 -14.734 16.488 19.288 81 HB2 PRO 11 HB2 PRO 11 -13.210 15.194 17.425 82 HB3 PRO 11 HB3 PRO 11 -12.482 16.001 18.853 83 HG2 PRO 11 HG2 PRO 11 -13.183 13.099 18.474 84 HG3 PRO 11 HG3 PRO 11 -11.641 13.823 19.034 85 HD2 PRO 11 HD2 PRO 11 -13.484 12.866 20.772 86 HD3 PRO 11 HD3 PRO 11 -12.514 14.334 21.145 87 HA PRO 12 HA PRO 12 -17.945 14.509 16.939 88 HB2 PRO 12 HB2 PRO 12 -18.031 15.945 14.617 89 HB3 PRO 12 HB3 PRO 12 -18.566 16.641 16.181 90 HG2 PRO 12 HG2 PRO 12 -15.915 16.927 14.795 91 HG3 PRO 12 HG3 PRO 12 -16.981 18.201 15.464 92 HD2 PRO 12 HD2 PRO 12 -14.864 17.238 16.851 93 HD3 PRO 12 HD3 PRO 12 -16.399 17.691 17.674 94 H LEU 13 H LEU 13 -18.260 13.317 14.794 95 HA LEU 13 HA LEU 13 -16.067 11.573 14.323 96 HB2 LEU 13 HB2 LEU 13 -18.459 12.161 12.545 97 HB3 LEU 13 HB3 LEU 13 -17.400 10.761 12.407 98 HG LEU 13 HG LEU 13 -19.178 11.359 14.801 99 HD11 LEU 13 HD11 LEU 13 -19.534 9.378 12.516 100 HD12 LEU 13 HD12 LEU 13 -20.478 10.867 12.769 101 HD13 LEU 13 HD13 LEU 13 -20.589 9.537 13.940 102 HD21 LEU 13 HD21 LEU 13 -18.707 8.988 15.407 103 HD22 LEU 13 HD22 LEU 13 -17.250 9.998 15.445 104 HD23 LEU 13 HD23 LEU 13 -17.532 8.898 14.073 105 H SER 14 H SER 14 -17.005 14.587 12.786 106 HA SER 14 HA SER 14 -15.079 14.276 10.582 107 HB2 SER 14 HB2 SER 14 -15.962 16.586 10.029 108 HB3 SER 14 HB3 SER 14 -17.195 15.307 10.079 109 HG SER 14 HG SER 14 -17.624 17.369 11.259 110 H GLY 15 H GLY 15 -14.579 14.860 13.757 111 HA2 GLY 15 HA2 GLY 15 -13.135 17.386 13.587 112 HA3 GLY 15 HA3 GLY 15 -13.230 16.298 14.979 113 H GLY 16 H GLY 16 -11.209 17.593 12.655 114 HA2 GLY 16 HA2 GLY 16 -8.906 16.216 13.547 115 HA3 GLY 16 HA3 GLY 16 -9.456 15.455 12.026 116 H LEU 17 H LEU 17 -7.232 16.538 11.431 117 HA LEU 17 HA LEU 17 -6.077 18.164 10.288 118 HB2 LEU 17 HB2 LEU 17 -8.852 18.805 9.248 119 HB3 LEU 17 HB3 LEU 17 -7.337 19.306 8.505 120 HG LEU 17 HG LEU 17 -8.222 16.417 8.824 121 HD11 LEU 17 HD11 LEU 17 -9.703 17.681 7.318 122 HD12 LEU 17 HD12 LEU 17 -8.707 16.523 6.413 123 HD13 LEU 17 HD13 LEU 17 -8.293 18.254 6.397 124 HD21 LEU 17 HD21 LEU 17 -5.931 17.681 7.252 125 HD22 LEU 17 HD22 LEU 17 -6.429 15.976 7.147 126 HD23 LEU 17 HD23 LEU 17 -5.781 16.615 8.669 127 HA PRO 18 HA PRO 18 -7.461 21.711 12.936 128 HB2 PRO 18 HB2 PRO 18 -5.274 22.035 14.535 129 HB3 PRO 18 HB3 PRO 18 -6.566 20.854 14.927 130 HG2 PRO 18 HG2 PRO 18 -3.941 20.388 13.527 131 HG3 PRO 18 HG3 PRO 18 -4.638 19.518 14.930 132 HD2 PRO 18 HD2 PRO 18 -4.871 18.565 12.403 133 HD3 PRO 18 HD3 PRO 18 -6.208 18.393 13.591 134 H GLY 19 H GLY 19 -6.773 23.888 12.672 135 HA2 GLY 19 HA2 GLY 19 -4.886 24.273 10.441 136 HA3 GLY 19 HA3 GLY 19 -5.970 25.485 11.142 137 H THR 20 H THR 20 -4.301 23.720 13.506 138 HA THR 20 HA THR 20 -2.059 25.661 13.698 139 HB THR 20 HB THR 20 -2.492 25.879 16.155 140 HG1 THR 20 HG1 THR 20 -4.632 25.199 16.856 141 HG21 THR 20 HG21 THR 20 -4.341 27.427 16.084 142 HG22 THR 20 HG22 THR 20 -4.982 26.681 14.602 143 HG23 THR 20 HG23 THR 20 -3.447 27.579 14.554 144 H GLU 21 H GLU 21 -0.485 24.779 15.400 145 HA GLU 21 HA GLU 21 0.112 22.029 14.857 146 HB2 GLU 21 HB2 GLU 21 1.076 23.881 17.061 147 HB3 GLU 21 HB3 GLU 21 1.845 22.357 16.612 148 HG2 GLU 21 HG2 GLU 21 2.812 23.228 14.728 149 HG3 GLU 21 HG3 GLU 21 1.484 24.358 14.425 150 H ASN 22 H ASN 22 -2.027 23.483 17.075 151 HA ASN 22 HA ASN 22 -3.314 22.756 18.794 152 HB2 ASN 22 HB2 ASN 22 -3.473 20.741 17.102 153 HB3 ASN 22 HB3 ASN 22 -2.566 19.884 18.354 154 HD21 ASN 22 HD21 ASN 22 -3.613 19.165 20.114 155 HD22 ASN 22 HD22 ASN 22 -5.320 19.443 20.429 156 H SER 23 H SER 23 -0.371 23.226 19.061 157 HA SER 23 HA SER 23 1.167 23.349 20.724 158 HB2 SER 23 HB2 SER 23 -0.996 24.071 21.919 159 HB3 SER 23 HB3 SER 23 -0.961 22.477 22.694 160 HG SER 23 HG SER 23 1.050 24.496 22.787 161 H ASP 24 H ASP 24 0.865 21.593 23.277 162 HA ASP 24 HA ASP 24 2.708 19.565 22.340 163 HB2 ASP 24 HB2 ASP 24 2.793 18.882 24.655 164 HB3 ASP 24 HB3 ASP 24 2.787 20.651 24.602 165 H GLN 25 H GLN 25 -0.726 19.739 22.686 166 HA GLN 25 HA GLN 25 -1.104 16.850 22.910 167 HB2 GLN 25 HB2 GLN 25 -2.732 18.516 23.821 168 HB3 GLN 25 HB3 GLN 25 -3.079 19.043 22.175 169 HG2 GLN 25 HG2 GLN 25 -3.831 16.686 21.649 170 HG3 GLN 25 HG3 GLN 25 -3.629 16.299 23.364 171 HE21 GLN 25 HE21 GLN 25 -4.834 17.772 24.893 172 HE22 GLN 25 HE22 GLN 25 -6.437 18.267 24.403 173 H ALA 26 H ALA 26 0.050 15.988 21.159 174 HA ALA 26 HA ALA 26 -0.291 16.726 18.432 175 HB1 ALA 26 HB1 ALA 26 0.404 14.389 17.932 176 HB2 ALA 26 HB2 ALA 26 1.423 15.083 19.213 177 HB3 ALA 26 HB3 ALA 26 0.125 13.936 19.630 178 H ARG 27 H ARG 27 -2.071 16.592 17.137 179 HA ARG 27 HA ARG 27 -4.533 16.146 18.428 180 HB2 ARG 27 HB2 ARG 27 -3.990 17.629 16.394 181 HB3 ARG 27 HB3 ARG 27 -4.219 16.171 15.416 182 HG2 ARG 27 HG2 ARG 27 -6.320 17.268 15.368 183 HG3 ARG 27 HG3 ARG 27 -6.526 15.980 16.562 184 HD2 ARG 27 HD2 ARG 27 -5.723 17.835 18.264 185 HD3 ARG 27 HD3 ARG 27 -6.217 18.949 16.986 186 HE ARG 27 HE ARG 27 -8.448 18.411 17.384 187 HH11 ARG 27 HH11 ARG 27 -6.409 16.224 19.280 188 HH12 ARG 27 HH12 ARG 27 -7.736 15.697 20.268 189 HH21 ARG 27 HH21 ARG 27 -10.094 17.662 18.672 190 HH22 ARG 27 HH22 ARG 27 -9.783 16.483 19.917 191 H ASP 28 H ASP 28 -2.734 13.975 16.325 192 HA ASP 28 HA ASP 28 -4.611 11.801 17.051 193 HB2 ASP 28 HB2 ASP 28 -3.946 12.675 14.233 194 HB3 ASP 28 HB3 ASP 28 -4.472 11.026 14.609 195 H GLY 29 H GLY 29 -1.830 12.342 14.832 196 HA2 GLY 29 HA2 GLY 29 0.392 11.680 15.238 197 HA3 GLY 29 HA3 GLY 29 -0.144 10.697 16.601 198 H THR 30 H THR 30 1.707 9.603 15.051 199 HA THR 30 HA THR 30 0.262 7.421 13.644 200 HB THR 30 HB THR 30 2.007 7.441 11.834 201 HG1 THR 30 HG1 THR 30 3.193 9.491 11.673 202 HG21 THR 30 HG21 THR 30 -0.193 8.640 11.504 203 HG22 THR 30 HG22 THR 30 1.147 9.273 10.522 204 HG23 THR 30 HG23 THR 30 0.625 10.146 11.981 205 H LEU 31 H LEU 31 1.902 5.563 13.293 206 HA LEU 31 HA LEU 31 4.016 5.598 15.402 207 HB2 LEU 31 HB2 LEU 31 2.043 3.374 14.772 208 HB3 LEU 31 HB3 LEU 31 3.434 3.203 15.834 209 HG LEU 31 HG LEU 31 1.101 5.078 16.355 210 HD11 LEU 31 HD11 LEU 31 1.751 2.347 17.535 211 HD12 LEU 31 HD12 LEU 31 0.421 2.712 16.410 212 HD13 LEU 31 HD13 LEU 31 0.422 3.416 18.039 213 HD21 LEU 31 HD21 LEU 31 3.441 4.206 18.109 214 HD22 LEU 31 HD22 LEU 31 2.039 5.149 18.664 215 HD23 LEU 31 HD23 LEU 31 3.145 5.842 17.466 216 HA PRO 32 HA PRO 32 6.343 3.942 12.011 217 HB2 PRO 32 HB2 PRO 32 8.484 2.807 13.243 218 HB3 PRO 32 HB3 PRO 32 8.237 4.585 13.241 219 HG2 PRO 32 HG2 PRO 32 7.531 2.576 15.372 220 HG3 PRO 32 HG3 PRO 32 8.430 4.116 15.532 221 HD2 PRO 32 HD2 PRO 32 5.770 3.909 16.082 222 HD3 PRO 32 HD3 PRO 32 6.487 5.401 15.379 223 H TYR 33 H TYR 33 6.757 1.952 10.912 224 HA TYR 33 HA TYR 33 5.464 -0.416 12.205 225 HB2 TYR 33 HB2 TYR 33 5.609 0.536 9.345 226 HB3 TYR 33 HB3 TYR 33 5.160 -1.119 9.764 227 HD1 TYR 33 HD2 TYR 33 4.118 2.464 10.207 228 HD2 TYR 33 HD1 TYR 33 2.980 -1.673 10.510 229 HE1 TYR 33 HE2 TYR 33 1.747 3.137 10.551 230 HE2 TYR 33 HE1 TYR 33 0.604 -0.989 10.834 231 HH TYR 33 HH TYR 33 -0.405 2.426 10.894 232 H THR 34 H THR 34 8.385 0.588 10.462 233 HA THR 34 HA THR 34 9.313 -2.261 10.539 234 HB THR 34 HB THR 34 10.539 -1.707 8.411 235 HG1 THR 34 HG1 THR 34 9.990 0.221 7.378 236 HG21 THR 34 HG21 THR 34 8.277 -2.804 8.386 237 HG22 THR 34 HG22 THR 34 8.625 -1.836 6.938 238 HG23 THR 34 HG23 THR 34 7.546 -1.193 8.194 239 H LYS 35 H LYS 35 9.990 0.743 11.820 240 HA LYS 35 HA LYS 35 12.733 1.116 11.245 241 HB2 LYS 35 HB2 LYS 35 11.086 2.735 12.290 242 HB3 LYS 35 HB3 LYS 35 11.317 1.896 13.824 243 HG2 LYS 35 HG2 LYS 35 13.772 2.860 12.400 244 HG3 LYS 35 HG3 LYS 35 12.703 4.089 13.094 245 HD2 LYS 35 HD2 LYS 35 12.840 2.965 15.299 246 HD3 LYS 35 HD3 LYS 35 13.948 1.769 14.605 247 HE2 LYS 35 HE2 LYS 35 15.509 3.619 13.990 248 HE3 LYS 35 HE3 LYS 35 14.430 4.766 14.818 249 HZ1 LYS 35 HZ1 LYS 35 14.782 3.413 16.850 250 HZ2 LYS 35 HZ2 LYS 35 16.186 4.079 16.289 251 HZ3 LYS 35 HZ3 LYS 35 15.875 2.477 16.032 252 H ASP 36 H ASP 36 14.282 -0.259 11.544 253 HA ASP 36 HA ASP 36 15.724 -1.778 12.392 254 HB2 ASP 36 HB2 ASP 36 14.723 -0.905 15.118 255 HB3 ASP 36 HB3 ASP 36 16.235 -1.752 14.773 256 H ARG 37 H ARG 37 12.553 -2.369 12.424 257 HA ARG 37 HA ARG 37 12.157 -4.283 14.463 258 HB2 ARG 37 HB2 ARG 37 10.500 -2.985 12.961 259 HB3 ARG 37 HB3 ARG 37 10.668 -4.337 11.834 260 HG2 ARG 37 HG2 ARG 37 9.808 -5.888 13.505 261 HG3 ARG 37 HG3 ARG 37 9.864 -4.616 14.746 262 HD2 ARG 37 HD2 ARG 37 8.301 -3.282 13.248 263 HD3 ARG 37 HD3 ARG 37 8.044 -4.784 12.338 264 HE ARG 37 HE ARG 37 7.619 -5.407 15.050 265 HH11 ARG 37 HH11 ARG 37 6.135 -3.214 12.686 266 HH12 ARG 37 HH12 ARG 37 4.572 -3.297 13.488 267 HH21 ARG 37 HH21 ARG 37 5.603 -5.432 15.983 268 HH22 ARG 37 HH22 ARG 37 4.295 -4.483 15.289 269 H PHE 38 H PHE 38 13.520 -4.676 11.274 270 HA PHE 38 HA PHE 38 13.175 -7.512 11.077 271 HB2 PHE 38 HB2 PHE 38 15.279 -5.715 9.826 272 HB3 PHE 38 HB3 PHE 38 14.843 -7.344 9.289 273 HD1 PHE 38 HD2 PHE 38 12.560 -7.764 8.314 274 HD2 PHE 38 HD1 PHE 38 13.998 -3.798 9.164 275 HE1 PHE 38 HE2 PHE 38 10.795 -6.813 6.837 276 HE2 PHE 38 HE1 PHE 38 12.233 -2.835 7.700 277 HZ PHE 38 HZ PHE 38 10.622 -4.339 6.531 278 H TYR 39 H TYR 39 15.226 -5.662 13.091 279 HA TYR 39 HA TYR 39 17.085 -7.984 13.403 280 HB2 TYR 39 HB2 TYR 39 17.538 -5.098 14.224 281 HB3 TYR 39 HB3 TYR 39 18.726 -6.410 14.197 282 HD1 TYR 39 HD2 TYR 39 19.054 -7.561 11.792 283 HD2 TYR 39 HD1 TYR 39 17.425 -3.622 12.403 284 HE1 TYR 39 HE2 TYR 39 19.605 -6.961 9.434 285 HE2 TYR 39 HE1 TYR 39 17.995 -3.029 10.044 286 HH TYR 39 HH TYR 39 19.569 -5.342 7.828 287 H LEU 40 H LEU 40 15.069 -5.566 15.058 288 HA LEU 40 HA LEU 40 15.737 -6.529 17.710 289 HB2 LEU 40 HB2 LEU 40 13.447 -4.820 16.678 290 HB3 LEU 40 HB3 LEU 40 13.789 -5.109 18.382 291 HG LEU 40 HG LEU 40 15.689 -3.703 16.474 292 HD11 LEU 40 HD11 LEU 40 13.601 -2.441 16.784 293 HD12 LEU 40 HD12 LEU 40 14.958 -1.642 17.603 294 HD13 LEU 40 HD13 LEU 40 13.775 -2.572 18.554 295 HD21 LEU 40 HD21 LEU 40 16.800 -2.954 18.565 296 HD22 LEU 40 HD22 LEU 40 16.861 -4.716 18.372 297 HD23 LEU 40 HD23 LEU 40 15.700 -3.988 19.508 298 H GLN 41 H GLN 41 13.143 -7.243 15.370 299 HA GLN 41 HA GLN 41 12.036 -9.166 17.366 300 HB2 GLN 41 HB2 GLN 41 10.545 -7.476 15.329 301 HB3 GLN 41 HB3 GLN 41 9.823 -8.745 16.318 302 HG2 GLN 41 HG2 GLN 41 10.537 -7.456 18.358 303 HG3 GLN 41 HG3 GLN 41 10.993 -6.125 17.278 304 HE21 GLN 41 HE21 GLN 41 8.315 -8.168 18.348 305 HE22 GLN 41 HE22 GLN 41 7.039 -7.062 17.884 306 HA PRO 42 HA PRO 42 12.078 -12.012 13.868 307 HB2 PRO 42 HB2 PRO 42 10.140 -13.777 14.596 308 HB3 PRO 42 HB3 PRO 42 11.732 -13.767 15.424 309 HG2 PRO 42 HG2 PRO 42 9.144 -12.478 16.269 310 HG3 PRO 42 HG3 PRO 42 10.237 -13.533 17.219 311 HD2 PRO 42 HD2 PRO 42 10.305 -10.817 17.395 312 HD3 PRO 42 HD3 PRO 42 11.789 -11.821 17.549 313 H LEU 43 H LEU 43 10.262 -12.665 12.210 314 HA LEU 43 HA LEU 43 8.205 -10.489 12.176 315 HB2 LEU 43 HB2 LEU 43 9.907 -11.733 10.076 316 HB3 LEU 43 HB3 LEU 43 8.255 -11.333 9.623 317 HG LEU 43 HG LEU 43 8.605 -8.988 10.262 318 HD11 LEU 43 HD11 LEU 43 11.505 -9.806 10.729 319 HD12 LEU 43 HD12 LEU 43 10.383 -9.131 11.933 320 HD13 LEU 43 HD13 LEU 43 10.926 -8.131 10.576 321 HD21 LEU 43 HD21 LEU 43 10.667 -10.091 8.313 322 HD22 LEU 43 HD22 LEU 43 10.007 -8.440 8.333 323 HD23 LEU 43 HD23 LEU 43 8.947 -9.812 7.955 324 HA PRO 44 HA PRO 44 5.786 -14.373 12.445 325 HB2 PRO 44 HB2 PRO 44 3.880 -13.563 14.214 326 HB3 PRO 44 HB3 PRO 44 5.511 -14.064 14.767 327 HG2 PRO 44 HG2 PRO 44 4.458 -11.309 14.233 328 HG3 PRO 44 HG3 PRO 44 5.279 -11.934 15.697 329 HD2 PRO 44 HD2 PRO 44 6.608 -10.571 13.775 330 HD3 PRO 44 HD3 PRO 44 7.364 -11.939 14.660 331 HA PRO 45 HA PRO 45 2.830 -12.966 9.491 332 HB2 PRO 45 HB2 PRO 45 0.537 -14.384 9.975 333 HB3 PRO 45 HB3 PRO 45 2.010 -15.115 9.268 334 HG2 PRO 45 HG2 PRO 45 1.136 -15.094 12.149 335 HG3 PRO 45 HG3 PRO 45 1.623 -16.487 11.127 336 HD2 PRO 45 HD2 PRO 45 3.384 -15.356 12.776 337 HD3 PRO 45 HD3 PRO 45 3.888 -15.825 11.114 338 H THR 46 H THR 46 1.933 -12.697 12.885 339 HA THR 46 HA THR 46 -0.408 -11.064 12.505 340 HB THR 46 HB THR 46 0.235 -10.340 14.919 341 HG1 THR 46 HG1 THR 46 1.869 -11.563 15.845 342 HG21 THR 46 HG21 THR 46 -0.435 -12.506 15.863 343 HG22 THR 46 HG22 THR 46 -0.063 -13.319 14.328 344 HG23 THR 46 HG23 THR 46 -1.403 -12.149 14.417 345 H GLU 47 H GLU 47 3.070 -10.319 13.095 346 HA GLU 47 HA GLU 47 2.539 -7.452 12.896 347 HB2 GLU 47 HB2 GLU 47 5.148 -8.990 12.976 348 HB3 GLU 47 HB3 GLU 47 4.979 -7.226 13.045 349 HG2 GLU 47 HG2 GLU 47 3.475 -7.583 15.072 350 HG3 GLU 47 HG3 GLU 47 4.043 -9.259 15.087 351 H ALA 48 H ALA 48 3.341 -10.062 10.728 352 HA ALA 48 HA ALA 48 4.328 -8.458 8.568 353 HB1 ALA 48 HB1 ALA 48 4.452 -10.963 8.644 354 HB2 ALA 48 HB2 ALA 48 2.687 -11.019 8.408 355 HB3 ALA 48 HB3 ALA 48 3.729 -10.344 7.139 356 H ALA 49 H ALA 49 1.081 -9.082 9.872 357 HA ALA 49 HA ALA 49 -0.345 -8.007 7.624 358 HB1 ALA 49 HB1 ALA 49 -1.204 -7.988 10.549 359 HB2 ALA 49 HB2 ALA 49 -2.251 -7.901 9.118 360 HB3 ALA 49 HB3 ALA 49 -1.357 -9.395 9.472 361 H GLN 50 H GLN 50 1.037 -6.556 10.563 362 HA GLN 50 HA GLN 50 -0.009 -3.922 10.145 363 HB2 GLN 50 HB2 GLN 50 2.595 -4.769 11.470 364 HB3 GLN 50 HB3 GLN 50 1.808 -3.202 11.650 365 HG2 GLN 50 HG2 GLN 50 -0.084 -4.242 12.792 366 HG3 GLN 50 HG3 GLN 50 0.603 -5.852 12.523 367 HE21 GLN 50 HE21 GLN 50 0.340 -5.936 14.910 368 HE22 GLN 50 HE22 GLN 50 1.668 -5.348 15.882 369 H ARG 51 H ARG 51 3.043 -5.528 9.194 370 HA ARG 51 HA ARG 51 4.184 -3.245 7.876 371 HB2 ARG 51 HB2 ARG 51 4.612 -6.232 7.574 372 HB3 ARG 51 HB3 ARG 51 5.577 -5.025 6.716 373 HG2 ARG 51 HG2 ARG 51 6.472 -4.148 8.773 374 HG3 ARG 51 HG3 ARG 51 5.347 -5.093 9.754 375 HD2 ARG 51 HD2 ARG 51 7.657 -6.047 9.726 376 HD3 ARG 51 HD3 ARG 51 6.430 -7.173 9.130 377 HE ARG 51 HE ARG 51 8.444 -5.730 7.476 378 HH11 ARG 51 HH11 ARG 51 6.020 -8.291 7.700 379 HH12 ARG 51 HH12 ARG 51 6.397 -8.893 6.096 380 HH21 ARG 51 HH21 ARG 51 8.863 -6.616 5.453 381 HH22 ARG 51 HH22 ARG 51 7.932 -7.986 4.892 382 H ALA 52 H ALA 52 2.097 -5.891 6.700 383 HA ALA 52 HA ALA 52 2.299 -5.285 3.942 384 HB1 ALA 52 HB1 ALA 52 0.179 -6.560 3.749 385 HB2 ALA 52 HB2 ALA 52 1.359 -7.379 4.793 386 HB3 ALA 52 HB3 ALA 52 -0.005 -6.500 5.515 387 H LYS 53 H LYS 53 0.347 -3.741 6.484 388 HA LYS 53 HA LYS 53 -1.472 -2.368 4.720 389 HB2 LYS 53 HB2 LYS 53 -0.399 -1.635 7.468 390 HB3 LYS 53 HB3 LYS 53 -1.689 -0.749 6.647 391 HG2 LYS 53 HG2 LYS 53 -3.155 -2.660 6.702 392 HG3 LYS 53 HG3 LYS 53 -1.850 -3.716 7.225 393 HD2 LYS 53 HD2 LYS 53 -1.695 -2.436 9.367 394 HD3 LYS 53 HD3 LYS 53 -3.131 -1.509 8.867 395 HE2 LYS 53 HE2 LYS 53 -4.428 -3.607 8.691 396 HE3 LYS 53 HE3 LYS 53 -2.991 -4.547 9.101 397 HZ1 LYS 53 HZ1 LYS 53 -4.463 -2.736 10.915 398 HZ2 LYS 53 HZ2 LYS 53 -3.038 -3.467 11.303 399 HZ3 LYS 53 HZ3 LYS 53 -4.377 -4.384 11.010 400 H VAL 54 H VAL 54 1.845 -1.682 5.817 401 HA VAL 54 HA VAL 54 1.934 0.937 4.557 402 HB VAL 54 HB VAL 54 4.236 -0.878 5.414 403 HG11 VAL 54 HG11 VAL 54 4.978 0.894 3.874 404 HG12 VAL 54 HG12 VAL 54 4.132 2.122 4.846 405 HG13 VAL 54 HG13 VAL 54 5.531 1.250 5.521 406 HG21 VAL 54 HG21 VAL 54 2.837 -0.447 7.338 407 HG22 VAL 54 HG22 VAL 54 4.257 0.606 7.445 408 HG23 VAL 54 HG23 VAL 54 2.701 1.279 6.916 409 H SER 55 H SER 55 2.949 -2.394 3.646 410 HA SER 55 HA SER 55 4.206 -1.666 1.195 411 HB2 SER 55 HB2 SER 55 2.632 -4.203 1.748 412 HB3 SER 55 HB3 SER 55 3.976 -3.993 0.603 413 HG SER 55 HG SER 55 5.376 -3.835 2.287 414 H ALA 56 H ALA 56 0.792 -2.255 2.016 415 HA ALA 56 HA ALA 56 -0.138 -2.084 -0.725 416 HB1 ALA 56 HB1 ALA 56 -1.336 -3.166 1.236 417 HB2 ALA 56 HB2 ALA 56 -1.703 -1.523 1.804 418 HB3 ALA 56 HB3 ALA 56 -2.316 -2.085 0.232 419 H SER 57 H SER 57 0.526 0.241 1.859 420 HA SER 57 HA SER 57 -0.809 2.455 0.565 421 HB2 SER 57 HB2 SER 57 1.389 2.440 2.665 422 HB3 SER 57 HB3 SER 57 0.408 3.841 2.195 423 HG SER 57 HG SER 57 -0.485 1.419 3.412 424 H GLU 58 H GLU 58 2.382 0.971 0.252 425 HA GLU 58 HA GLU 58 3.651 3.184 -1.087 426 HB2 GLU 58 HB2 GLU 58 4.084 0.245 -0.835 427 HB3 GLU 58 HB3 GLU 58 4.851 1.059 -2.195 428 HG2 GLU 58 HG2 GLU 58 5.157 2.125 0.601 429 HG3 GLU 58 HG3 GLU 58 6.182 0.811 -0.007 430 H ILE 59 H ILE 59 1.441 0.650 -2.117 431 HA ILE 59 HA ILE 59 1.784 1.066 -4.950 432 HB ILE 59 HB ILE 59 -0.611 -0.064 -3.426 433 HG12 ILE 59 HG12 ILE 59 1.709 -1.527 -4.749 434 HG13 ILE 59 HG13 ILE 59 1.618 -1.198 -3.021 435 HG21 ILE 59 HG21 ILE 59 -1.076 0.596 -5.840 436 HG22 ILE 59 HG22 ILE 59 0.191 -0.544 -6.330 437 HG23 ILE 59 HG23 ILE 59 -1.270 -1.130 -5.516 438 HD11 ILE 59 HD11 ILE 59 0.920 -3.433 -3.302 439 HD12 ILE 59 HD12 ILE 59 -0.555 -2.496 -2.973 440 HD13 ILE 59 HD13 ILE 59 -0.175 -3.015 -4.629 441 H LEU 60 H LEU 60 0.001 2.752 -2.412 442 HA LEU 60 HA LEU 60 -1.648 4.333 -4.233 443 HB2 LEU 60 HB2 LEU 60 -0.748 4.980 -1.413 444 HB3 LEU 60 HB3 LEU 60 -1.997 5.811 -2.303 445 HG LEU 60 HG LEU 60 -2.217 2.903 -1.475 446 HD11 LEU 60 HD11 LEU 60 -3.297 5.386 -0.075 447 HD12 LEU 60 HD12 LEU 60 -1.946 4.386 0.503 448 HD13 LEU 60 HD13 LEU 60 -3.576 3.694 0.403 449 HD21 LEU 60 HD21 LEU 60 -3.702 3.623 -3.311 450 HD22 LEU 60 HD22 LEU 60 -4.298 4.957 -2.297 451 HD23 LEU 60 HD23 LEU 60 -4.608 3.270 -1.827 452 H ASN 61 H ASN 61 1.548 4.629 -2.688 453 HA ASN 61 HA ASN 61 2.023 7.364 -3.172 454 HB2 ASN 61 HB2 ASN 61 3.401 5.801 -1.758 455 HB3 ASN 61 HB3 ASN 61 4.087 5.128 -3.240 456 HD21 ASN 61 HD21 ASN 61 4.225 7.640 -0.943 457 HD22 ASN 61 HD22 ASN 61 5.500 8.562 -1.701 458 H VAL 62 H VAL 62 2.594 4.583 -5.352 459 HA VAL 62 HA VAL 62 4.064 6.096 -7.257 460 HB VAL 62 HB VAL 62 2.490 3.837 -8.371 461 HG11 VAL 62 HG11 VAL 62 4.743 3.248 -9.228 462 HG12 VAL 62 HG12 VAL 62 4.338 4.949 -9.577 463 HG13 VAL 62 HG13 VAL 62 5.460 4.545 -8.249 464 HG21 VAL 62 HG21 VAL 62 2.751 2.897 -6.173 465 HG22 VAL 62 HG22 VAL 62 3.986 2.168 -7.209 466 HG23 VAL 62 HG23 VAL 62 4.445 3.452 -6.071 467 H LYS 63 H LYS 63 0.783 6.559 -6.594 468 HA LYS 63 HA LYS 63 -0.171 6.914 -9.305 469 HB2 LYS 63 HB2 LYS 63 -1.053 7.870 -6.598 470 HB3 LYS 63 HB3 LYS 63 -1.651 8.715 -8.031 471 HG2 LYS 63 HG2 LYS 63 -3.276 7.087 -7.567 472 HG3 LYS 63 HG3 LYS 63 -2.370 6.463 -8.950 473 HD2 LYS 63 HD2 LYS 63 -1.026 5.064 -7.321 474 HD3 LYS 63 HD3 LYS 63 -2.138 5.602 -6.050 475 HE2 LYS 63 HE2 LYS 63 -4.026 4.630 -7.315 476 HE3 LYS 63 HE3 LYS 63 -2.889 4.087 -8.566 477 HZ1 LYS 63 HZ1 LYS 63 -3.293 2.300 -7.080 478 HZ2 LYS 63 HZ2 LYS 63 -2.964 3.214 -5.745 479 HZ3 LYS 63 HZ3 LYS 63 -1.745 2.821 -6.783 480 H GLN 64 H GLN 64 1.961 8.752 -7.242 481 HA GLN 64 HA GLN 64 1.824 11.256 -8.579 482 HB2 GLN 64 HB2 GLN 64 3.486 9.899 -6.646 483 HB3 GLN 64 HB3 GLN 64 4.495 10.800 -7.777 484 HG2 GLN 64 HG2 GLN 64 2.091 12.112 -6.543 485 HG3 GLN 64 HG3 GLN 64 3.575 11.929 -5.597 486 HE21 GLN 64 HE21 GLN 64 1.938 14.020 -7.556 487 HE22 GLN 64 HE22 GLN 64 3.284 14.986 -8.101 488 H PHE 65 H PHE 65 2.924 8.240 -9.875 489 HA PHE 65 HA PHE 65 4.990 9.261 -11.596 490 HB2 PHE 65 HB2 PHE 65 5.058 7.169 -12.424 491 HB3 PHE 65 HB3 PHE 65 3.940 6.756 -11.134 492 HD1 PHE 65 HD2 PHE 65 1.476 6.551 -11.637 493 HD2 PHE 65 HD1 PHE 65 4.374 7.268 -14.731 494 HE1 PHE 65 HE2 PHE 65 -0.221 5.985 -13.361 495 HE2 PHE 65 HE1 PHE 65 2.688 6.713 -16.452 496 HZ PHE 65 HZ PHE 65 0.371 6.089 -15.779 497 H ILE 66 H ILE 66 1.474 9.403 -11.626 498 HA ILE 66 HA ILE 66 1.099 9.901 -14.430 499 HB ILE 66 HB ILE 66 -0.607 10.915 -12.077 500 HG12 ILE 66 HG12 ILE 66 -1.033 8.487 -13.866 501 HG13 ILE 66 HG13 ILE 66 -0.319 8.410 -12.256 502 HG21 ILE 66 HG21 ILE 66 -1.323 10.648 -15.057 503 HG22 ILE 66 HG22 ILE 66 -2.435 11.159 -13.766 504 HG23 ILE 66 HG23 ILE 66 -1.058 12.181 -14.193 505 HD11 ILE 66 HD11 ILE 66 -2.455 9.357 -11.305 506 HD12 ILE 66 HD12 ILE 66 -3.177 9.220 -12.927 507 HD13 ILE 66 HD13 ILE 66 -2.634 7.762 -12.071 508 H ASP 67 H ASP 67 1.555 12.118 -11.648 509 HA ASP 67 HA ASP 67 1.347 14.557 -13.070 510 HB2 ASP 67 HB2 ASP 67 3.193 13.929 -10.724 511 HB3 ASP 67 HB3 ASP 67 2.576 15.523 -11.181 512 H ARG 68 H ARG 68 4.026 12.362 -12.482 513 HA ARG 68 HA ARG 68 6.028 14.110 -13.716 514 HB2 ARG 68 HB2 ARG 68 6.157 11.202 -12.833 515 HB3 ARG 68 HB3 ARG 68 7.549 12.218 -13.233 516 HG2 ARG 68 HG2 ARG 68 7.161 13.626 -11.292 517 HG3 ARG 68 HG3 ARG 68 5.605 12.846 -10.977 518 HD2 ARG 68 HD2 ARG 68 6.906 10.657 -10.736 519 HD3 ARG 68 HD3 ARG 68 8.366 11.668 -10.652 520 HE ARG 68 HE ARG 68 6.396 12.667 -8.825 521 HH11 ARG 68 HH21 ARG 68 8.546 9.874 -9.139 522 HH12 ARG 68 HH22 ARG 68 8.602 9.617 -7.417 523 HH21 ARG 68 HH11 ARG 68 6.517 12.287 -6.679 524 HH22 ARG 68 HH12 ARG 68 7.476 10.966 -6.040 525 H LYS 69 H LYS 69 3.665 12.064 -14.927 526 HA LYS 69 HA LYS 69 3.329 10.874 -16.857 527 HB2 LYS 69 HB2 LYS 69 5.204 12.993 -17.956 528 HB3 LYS 69 HB3 LYS 69 4.166 11.939 -18.931 529 HG2 LYS 69 HG2 LYS 69 2.165 12.850 -17.824 530 HG3 LYS 69 HG3 LYS 69 3.188 13.901 -16.827 531 HD2 LYS 69 HD2 LYS 69 4.027 15.005 -18.874 532 HD3 LYS 69 HD3 LYS 69 2.918 14.003 -19.843 533 HE2 LYS 69 HE2 LYS 69 0.996 14.912 -18.573 534 HE3 LYS 69 HE3 LYS 69 2.102 15.898 -17.597 535 HZ1 LYS 69 HZ1 LYS 69 1.719 16.155 -20.525 536 HZ2 LYS 69 HZ2 LYS 69 2.742 17.071 -19.609 537 HZ3 LYS 69 HZ3 LYS 69 1.112 17.179 -19.382 538 H ALA 70 H ALA 70 5.151 9.742 -15.159 539 HA ALA 70 HA ALA 70 7.599 9.050 -16.572 540 HB1 ALA 70 HB1 ALA 70 7.457 9.380 -14.103 541 HB2 ALA 70 HB2 ALA 70 6.469 7.905 -13.988 542 HB3 ALA 70 HB3 ALA 70 8.150 7.811 -14.559 543 H TRP 71 H TRP 71 5.878 8.244 -18.361 544 HA TRP 71 HA TRP 71 4.633 5.763 -18.293 545 HB2 TRP 71 HB2 TRP 71 6.284 6.639 -20.658 546 HB3 TRP 71 HB3 TRP 71 4.765 5.760 -20.637 547 HD1 TRP 71 HD1 TRP 71 5.939 9.009 -21.537 548 HE1 TRP 71 HE1 TRP 71 4.197 10.852 -21.411 549 HE3 TRP 71 HE3 TRP 71 2.540 6.570 -18.606 550 HZ2 TRP 71 HZ2 TRP 71 1.627 11.221 -20.228 551 HZ3 TRP 71 HZ3 TRP 71 0.413 7.742 -17.994 552 HH2 TRP 71 HH2 TRP 71 -0.015 10.061 -18.796 553 HA PRO 72 HA PRO 72 8.286 3.210 -19.400 554 HB2 PRO 72 HB2 PRO 72 10.880 3.944 -19.286 555 HB3 PRO 72 HB3 PRO 72 9.842 4.413 -20.672 556 HG2 PRO 72 HG2 PRO 72 10.551 6.007 -18.219 557 HG3 PRO 72 HG3 PRO 72 10.706 6.470 -19.944 558 HD2 PRO 72 HD2 PRO 72 8.564 7.194 -18.435 559 HD3 PRO 72 HD3 PRO 72 8.409 6.803 -20.182 560 H SER 73 H SER 73 8.336 5.149 -16.542 561 HA SER 73 HA SER 73 10.216 3.359 -15.128 562 HB2 SER 73 HB2 SER 73 10.272 5.823 -14.791 563 HB3 SER 73 HB3 SER 73 8.633 5.742 -14.110 564 HG SER 73 HG SER 73 10.278 5.682 -12.497 565 H LEU 74 H LEU 74 6.732 4.143 -15.156 566 HA LEU 74 HA LEU 74 6.043 2.967 -12.711 567 HB2 LEU 74 HB2 LEU 74 4.541 4.325 -14.211 568 HB3 LEU 74 HB3 LEU 74 4.379 2.905 -15.252 569 HG LEU 74 HG LEU 74 3.512 1.652 -13.197 570 HD11 LEU 74 HD11 LEU 74 2.506 3.172 -11.442 571 HD12 LEU 74 HD12 LEU 74 3.471 4.484 -12.130 572 HD13 LEU 74 HD13 LEU 74 4.273 3.067 -11.430 573 HD21 LEU 74 HD21 LEU 74 2.039 2.364 -14.941 574 HD22 LEU 74 HD22 LEU 74 1.923 3.975 -14.217 575 HD23 LEU 74 HD23 LEU 74 1.274 2.567 -13.365 576 H GLN 75 H GLN 75 6.377 1.390 -15.877 577 HA GLN 75 HA GLN 75 5.215 -1.064 -15.217 578 HB2 GLN 75 HB2 GLN 75 6.557 -1.993 -17.086 579 HB3 GLN 75 HB3 GLN 75 5.724 -0.496 -17.476 580 HG2 GLN 75 HG2 GLN 75 7.783 -0.246 -18.515 581 HG3 GLN 75 HG3 GLN 75 7.944 0.713 -17.045 582 HE21 GLN 75 HE21 GLN 75 10.192 0.600 -17.096 583 HE22 GLN 75 HE22 GLN 75 11.050 -0.885 -16.724 584 H ASN 76 H ASN 76 8.367 0.148 -14.260 585 HA ASN 76 HA ASN 76 9.072 -2.525 -13.170 586 HB2 ASN 76 HB2 ASN 76 10.817 -1.253 -14.368 587 HB3 ASN 76 HB3 ASN 76 10.614 0.100 -13.247 588 HD21 ASN 76 HD21 ASN 76 10.902 -3.447 -12.850 589 HD22 ASN 76 HD22 ASN 76 12.223 -3.350 -11.714 590 H ASP 77 H ASP 77 8.699 0.890 -12.119 591 HA ASP 77 HA ASP 77 9.232 0.411 -9.400 592 HB2 ASP 77 HB2 ASP 77 9.217 2.599 -10.656 593 HB3 ASP 77 HB3 ASP 77 7.450 2.587 -10.550 594 H LEU 78 H LEU 78 6.001 0.458 -11.030 595 HA LEU 78 HA LEU 78 4.564 0.443 -8.553 596 HB2 LEU 78 HB2 LEU 78 3.868 0.582 -11.210 597 HB3 LEU 78 HB3 LEU 78 3.320 -1.035 -10.803 598 HG LEU 78 HG LEU 78 2.463 1.565 -9.490 599 HD11 LEU 78 HD11 LEU 78 0.289 1.105 -10.488 600 HD12 LEU 78 HD12 LEU 78 0.878 -0.429 -11.159 601 HD13 LEU 78 HD13 LEU 78 1.527 1.099 -11.753 602 HD21 LEU 78 HD21 LEU 78 0.771 0.151 -8.317 603 HD22 LEU 78 HD22 LEU 78 2.435 -0.106 -7.766 604 HD23 LEU 78 HD23 LEU 78 1.666 -1.288 -8.851 605 H ARG 79 H ARG 79 5.642 -2.198 -10.705 606 HA ARG 79 HA ARG 79 4.443 -4.217 -9.009 607 HB2 ARG 79 HB2 ARG 79 6.262 -4.282 -11.406 608 HB3 ARG 79 HB3 ARG 79 5.949 -5.750 -10.461 609 HG2 ARG 79 HG2 ARG 79 3.519 -5.471 -10.790 610 HG3 ARG 79 HG3 ARG 79 3.804 -4.017 -11.764 611 HD2 ARG 79 HD2 ARG 79 5.028 -6.694 -12.475 612 HD3 ARG 79 HD3 ARG 79 3.397 -6.243 -12.996 613 HE ARG 79 HE ARG 79 5.918 -4.837 -13.769 614 HH11 ARG 79 HH21 ARG 79 2.464 -5.456 -14.410 615 HH12 ARG 79 HH22 ARG 79 2.545 -4.587 -15.936 616 HH21 ARG 79 HH11 ARG 79 5.885 -3.778 -15.669 617 HH22 ARG 79 HH12 ARG 79 4.413 -3.644 -16.611 618 H LEU 80 H LEU 80 7.641 -2.676 -9.081 619 HA LEU 80 HA LEU 80 8.963 -4.655 -7.482 620 HB2 LEU 80 HB2 LEU 80 9.309 -1.691 -7.905 621 HB3 LEU 80 HB3 LEU 80 10.181 -2.479 -6.600 622 HG LEU 80 HG LEU 80 10.435 -3.239 -9.525 623 HD11 LEU 80 HD11 LEU 80 11.268 -0.974 -9.066 624 HD12 LEU 80 HD12 LEU 80 12.617 -2.085 -9.362 625 HD13 LEU 80 HD13 LEU 80 12.229 -1.587 -7.699 626 HD21 LEU 80 HD21 LEU 80 12.012 -4.083 -7.055 627 HD22 LEU 80 HD22 LEU 80 12.477 -4.440 -8.734 628 HD23 LEU 80 HD23 LEU 80 10.985 -5.126 -8.066 629 H ARG 81 H ARG 81 7.177 -1.663 -6.548 630 HA ARG 81 HA ARG 81 7.482 -2.183 -3.725 631 HB2 ARG 81 HB2 ARG 81 5.377 -0.541 -5.183 632 HB3 ARG 81 HB3 ARG 81 5.720 -0.478 -3.451 633 HG2 ARG 81 HG2 ARG 81 7.993 0.363 -3.919 634 HG3 ARG 81 HG3 ARG 81 7.662 0.270 -5.659 635 HD2 ARG 81 HD2 ARG 81 5.619 1.765 -5.126 636 HD3 ARG 81 HD3 ARG 81 6.464 2.116 -3.613 637 HE ARG 81 HE ARG 81 7.750 2.511 -6.299 638 HH11 ARG 81 HH21 ARG 81 6.994 3.834 -3.066 639 HH12 ARG 81 HH22 ARG 81 7.817 5.323 -3.434 640 HH21 ARG 81 HH11 ARG 81 8.727 4.395 -6.645 641 HH22 ARG 81 HH12 ARG 81 8.826 5.619 -5.394 642 H ALA 82 H ALA 82 4.948 -2.957 -6.089 643 HA ALA 82 HA ALA 82 3.070 -3.954 -4.201 644 HB1 ALA 82 HB1 ALA 82 3.463 -4.874 -7.070 645 HB2 ALA 82 HB2 ALA 82 1.974 -4.946 -6.100 646 HB3 ALA 82 HB3 ALA 82 2.625 -3.376 -6.601 647 H SER 83 H SER 83 5.943 -5.468 -5.667 648 HA SER 83 HA SER 83 5.273 -8.167 -5.150 649 HB2 SER 83 HB2 SER 83 7.987 -6.804 -5.072 650 HB3 SER 83 HB3 SER 83 7.729 -8.561 -5.069 651 HG SER 83 HG SER 83 6.950 -6.711 -7.098 652 H TYR 84 H TYR 84 6.615 -5.676 -2.935 653 HA TYR 84 HA TYR 84 7.185 -7.521 -0.819 654 HB2 TYR 84 HB2 TYR 84 6.441 -4.578 -0.715 655 HB3 TYR 84 HB3 TYR 84 7.071 -5.518 0.647 656 HD1 TYR 84 HD1 TYR 84 9.399 -6.601 0.420 657 HD2 TYR 84 HD2 TYR 84 7.939 -3.628 -2.322 658 HE1 TYR 84 HE1 TYR 84 11.733 -6.164 -0.364 659 HE2 TYR 84 HE2 TYR 84 10.266 -3.205 -3.106 660 HH TYR 84 HH TYR 84 12.474 -3.760 -2.894 661 H LEU 85 H LEU 85 4.203 -5.704 -1.667 662 HA LEU 85 HA LEU 85 2.727 -6.575 0.629 663 HB2 LEU 85 HB2 LEU 85 1.898 -4.750 -0.816 664 HB3 LEU 85 HB3 LEU 85 1.745 -5.880 -2.160 665 HG LEU 85 HG LEU 85 0.020 -7.152 -0.901 666 HD11 LEU 85 HD11 LEU 85 0.295 -4.901 1.120 667 HD12 LEU 85 HD12 LEU 85 0.599 -6.631 1.394 668 HD13 LEU 85 HD13 LEU 85 -1.048 -6.062 1.075 669 HD21 LEU 85 HD21 LEU 85 -1.780 -5.535 -1.166 670 HD22 LEU 85 HD22 LEU 85 -0.623 -5.421 -2.509 671 HD23 LEU 85 HD23 LEU 85 -0.600 -4.208 -1.212 672 H ARG 86 H ARG 86 3.233 -7.949 -2.591 673 HA ARG 86 HA ARG 86 1.367 -10.085 -2.324 674 HB2 ARG 86 HB2 ARG 86 3.379 -9.261 -4.177 675 HB3 ARG 86 HB3 ARG 86 3.639 -10.974 -3.841 676 HG2 ARG 86 HG2 ARG 86 0.875 -9.932 -4.505 677 HG3 ARG 86 HG3 ARG 86 2.045 -10.248 -5.794 678 HD2 ARG 86 HD2 ARG 86 1.183 -12.304 -3.736 679 HD3 ARG 86 HD3 ARG 86 0.461 -12.127 -5.356 680 HE ARG 86 HE ARG 86 3.273 -12.322 -5.665 681 HH11 ARG 86 HH11 ARG 86 0.613 -14.408 -4.661 682 HH12 ARG 86 HH12 ARG 86 1.420 -15.854 -5.203 683 HH21 ARG 86 HH21 ARG 86 4.246 -14.203 -6.323 684 HH22 ARG 86 HH22 ARG 86 3.446 -15.737 -6.127 685 H TYR 87 H TYR 87 4.823 -9.904 -1.363 686 HA TYR 87 HA TYR 87 4.862 -12.672 -0.507 687 HB2 TYR 87 HB2 TYR 87 6.670 -10.348 0.249 688 HB3 TYR 87 HB3 TYR 87 6.988 -12.051 0.597 689 HD1 TYR 87 HD2 TYR 87 6.353 -13.463 -1.893 690 HD2 TYR 87 HD1 TYR 87 8.223 -9.618 -1.360 691 HE1 TYR 87 HE2 TYR 87 7.459 -13.680 -4.118 692 HE2 TYR 87 HE1 TYR 87 9.328 -9.856 -3.582 693 HH TYR 87 HH TYR 87 9.610 -11.169 -5.439 694 H ASP 88 H ASP 88 4.501 -9.545 1.265 695 HA ASP 88 HA ASP 88 4.434 -10.809 3.839 696 HB2 ASP 88 HB2 ASP 88 3.424 -8.137 2.815 697 HB3 ASP 88 HB3 ASP 88 3.201 -8.647 4.496 698 H LEU 89 H LEU 89 1.810 -9.828 1.588 699 HA LEU 89 HA LEU 89 -0.290 -10.581 3.380 700 HB2 LEU 89 HB2 LEU 89 -0.491 -9.078 1.421 701 HB3 LEU 89 HB3 LEU 89 -0.291 -10.456 0.350 702 HG LEU 89 HG LEU 89 -2.434 -11.335 0.914 703 HD11 LEU 89 HD11 LEU 89 -2.635 -9.174 3.040 704 HD12 LEU 89 HD12 LEU 89 -2.496 -10.921 3.339 705 HD13 LEU 89 HD13 LEU 89 -3.936 -10.271 2.555 706 HD21 LEU 89 HD21 LEU 89 -2.341 -9.430 -0.662 707 HD22 LEU 89 HD22 LEU 89 -2.582 -8.295 0.686 708 HD23 LEU 89 HD23 LEU 89 -3.866 -9.443 0.241 709 H LYS 90 H LYS 90 1.576 -12.414 0.954 710 HA LYS 90 HA LYS 90 -0.034 -14.778 0.995 711 HB2 LYS 90 HB2 LYS 90 1.680 -14.498 -0.685 712 HB3 LYS 90 HB3 LYS 90 2.934 -14.319 0.541 713 HG2 LYS 90 HG2 LYS 90 3.166 -16.486 -0.459 714 HG3 LYS 90 HG3 LYS 90 2.621 -16.690 1.206 715 HD2 LYS 90 HD2 LYS 90 0.221 -16.607 -0.218 716 HD3 LYS 90 HD3 LYS 90 1.313 -17.458 -1.323 717 HE2 LYS 90 HE2 LYS 90 0.726 -18.176 1.580 718 HE3 LYS 90 HE3 LYS 90 0.158 -19.051 0.149 719 HZ1 LYS 90 HZ1 LYS 90 2.471 -19.587 -0.354 720 HZ2 LYS 90 HZ2 LYS 90 2.076 -20.121 1.155 721 HZ3 LYS 90 HZ3 LYS 90 2.992 -18.762 0.977 722 H THR 91 H THR 91 2.353 -13.469 3.263 723 HA THR 91 HA THR 91 2.510 -15.928 4.829 724 HB THR 91 HB THR 91 3.266 -13.085 5.657 725 HG1 THR 91 HG1 THR 91 4.445 -13.504 3.843 726 HG21 THR 91 HG21 THR 91 4.243 -15.818 6.566 727 HG22 THR 91 HG22 THR 91 3.227 -14.703 7.508 728 HG23 THR 91 HG23 THR 91 4.892 -14.252 7.097 729 H VAL 92 H VAL 92 0.796 -12.777 5.091 730 HA VAL 92 HA VAL 92 -0.411 -13.271 7.620 731 HB VAL 92 HB VAL 92 -1.391 -11.549 5.289 732 HG11 VAL 92 HG11 VAL 92 -2.239 -11.598 8.222 733 HG12 VAL 92 HG12 VAL 92 -2.608 -10.264 7.108 734 HG13 VAL 92 HG13 VAL 92 -3.269 -11.878 6.797 735 HG21 VAL 92 HG21 VAL 92 0.118 -10.743 7.792 736 HG22 VAL 92 HG22 VAL 92 0.891 -11.025 6.229 737 HG23 VAL 92 HG23 VAL 92 -0.290 -9.725 6.390 738 H ILE 93 H ILE 93 -1.668 -13.972 4.300 739 HA ILE 93 HA ILE 93 -4.277 -14.732 5.185 740 HB ILE 93 HB ILE 93 -4.454 -16.039 3.071 741 HG12 ILE 93 HG12 ILE 93 -2.210 -15.232 1.609 742 HG13 ILE 93 HG13 ILE 93 -1.562 -15.838 3.127 743 HG21 ILE 93 HG21 ILE 93 -3.252 -13.270 2.674 744 HG22 ILE 93 HG22 ILE 93 -4.320 -14.128 1.541 745 HG23 ILE 93 HG23 ILE 93 -4.931 -13.615 3.126 746 HD11 ILE 93 HD11 ILE 93 -1.683 -17.587 1.400 747 HD12 ILE 93 HD12 ILE 93 -2.694 -17.983 2.806 748 HD13 ILE 93 HD13 ILE 93 -3.441 -17.371 1.308 749 H SER 94 H SER 94 -1.256 -16.429 5.442 750 HA SER 94 HA SER 94 -2.473 -19.056 5.550 751 HB2 SER 94 HB2 SER 94 0.220 -18.063 6.520 752 HB3 SER 94 HB3 SER 94 -0.253 -19.762 6.303 753 HG SER 94 HG SER 94 0.207 -17.754 4.362 754 H ALA 95 H ALA 95 -1.960 -16.440 7.814 755 HA ALA 95 HA ALA 95 -2.514 -18.182 10.150 756 HB1 ALA 95 HB1 ALA 95 -2.095 -16.126 11.454 757 HB2 ALA 95 HB2 ALA 95 -0.753 -16.496 10.351 758 HB3 ALA 95 HB3 ALA 95 -1.906 -15.203 9.942 759 H LYS 96 H LYS 96 -4.050 -15.690 8.154 760 HA LYS 96 HA LYS 96 -6.305 -15.139 9.847 761 HB2 LYS 96 HB2 LYS 96 -5.356 -14.379 7.286 762 HB3 LYS 96 HB3 LYS 96 -6.899 -15.167 6.969 763 HG2 LYS 96 HG2 LYS 96 -7.341 -12.822 7.162 764 HG3 LYS 96 HG3 LYS 96 -7.971 -13.566 8.622 765 HD2 LYS 96 HD2 LYS 96 -5.842 -12.848 9.819 766 HD3 LYS 96 HD3 LYS 96 -5.409 -11.958 8.343 767 HE2 LYS 96 HE2 LYS 96 -7.659 -10.767 8.527 768 HE3 LYS 96 HE3 LYS 96 -7.867 -11.525 10.108 769 HZ1 LYS 96 HZ1 LYS 96 -5.829 -10.337 10.832 770 HZ2 LYS 96 HZ2 LYS 96 -7.003 -9.287 10.359 771 HZ3 LYS 96 HZ3 LYS 96 -5.734 -9.591 9.366 772 HA PRO 97 HA PRO 97 -8.367 -19.000 9.570 773 HB2 PRO 97 HB2 PRO 97 -11.052 -18.407 9.258 774 HB3 PRO 97 HB3 PRO 97 -10.173 -18.277 10.816 775 HG2 PRO 97 HG2 PRO 97 -10.769 -16.138 8.809 776 HG3 PRO 97 HG3 PRO 97 -11.038 -16.138 10.581 777 HD2 PRO 97 HD2 PRO 97 -8.892 -14.954 9.550 778 HD3 PRO 97 HD3 PRO 97 -8.730 -15.936 11.039 779 H LYS 98 H LYS 98 -9.294 -20.478 8.085 780 HA LYS 98 HA LYS 98 -8.073 -19.992 5.602 781 HB2 LYS 98 HB2 LYS 98 -9.564 -22.182 6.894 782 HB3 LYS 98 HB3 LYS 98 -9.423 -22.271 5.137 783 HG2 LYS 98 HG2 LYS 98 -7.548 -23.496 6.223 784 HG3 LYS 98 HG3 LYS 98 -6.957 -22.127 5.272 785 HD2 LYS 98 HD2 LYS 98 -6.735 -20.770 7.367 786 HD3 LYS 98 HD3 LYS 98 -7.260 -22.174 8.317 787 HE2 LYS 98 HE2 LYS 98 -5.283 -23.425 7.601 788 HE3 LYS 98 HE3 LYS 98 -4.809 -22.106 6.507 789 HZ1 LYS 98 HZ1 LYS 98 -4.460 -20.671 8.397 790 HZ2 LYS 98 HZ2 LYS 98 -3.604 -22.055 8.643 791 HZ3 LYS 98 HZ3 LYS 98 -5.017 -21.811 9.457 792 H ASP 99 H ASP 99 -11.412 -19.465 6.383 793 HA ASP 99 HA ASP 99 -12.229 -19.352 3.577 794 HB2 ASP 99 HB2 ASP 99 -13.836 -19.674 5.477 795 HB3 ASP 99 HB3 ASP 99 -13.521 -17.999 5.961 796 H GLU 100 H GLU 100 -11.233 -16.943 6.072 797 HA GLU 100 HA GLU 100 -11.430 -14.658 4.346 798 HB2 GLU 100 HB2 GLU 100 -10.056 -15.290 6.927 799 HB3 GLU 100 HB3 GLU 100 -9.458 -13.909 6.014 800 HG2 GLU 100 HG2 GLU 100 -12.358 -14.266 6.823 801 HG3 GLU 100 HG3 GLU 100 -11.163 -13.358 7.765 802 H LYS 101 H LYS 101 -8.932 -17.074 4.937 803 HA LYS 101 HA LYS 101 -6.777 -15.932 3.481 804 HB2 LYS 101 HB2 LYS 101 -6.542 -17.960 4.791 805 HB3 LYS 101 HB3 LYS 101 -7.753 -18.762 3.837 806 HG2 LYS 101 HG2 LYS 101 -5.754 -18.082 1.971 807 HG3 LYS 101 HG3 LYS 101 -4.908 -18.652 3.413 808 HD2 LYS 101 HD2 LYS 101 -5.305 -20.595 2.088 809 HD3 LYS 101 HD3 LYS 101 -6.482 -20.658 3.413 810 HE2 LYS 101 HE2 LYS 101 -8.163 -19.583 1.852 811 HE3 LYS 101 HE3 LYS 101 -6.987 -19.766 0.541 812 HZ1 LYS 101 HZ1 LYS 101 -8.215 -21.953 2.121 813 HZ2 LYS 101 HZ2 LYS 101 -7.071 -22.178 0.952 814 HZ3 LYS 101 HZ3 LYS 101 -8.555 -21.579 0.555 815 H LYS 102 H LYS 102 -9.733 -17.603 2.355 816 HA LYS 102 HA LYS 102 -8.785 -17.696 -0.395 817 HB2 LYS 102 HB2 LYS 102 -10.309 -19.324 -0.426 818 HB3 LYS 102 HB3 LYS 102 -10.788 -18.912 1.208 819 HG2 LYS 102 HG2 LYS 102 -12.789 -18.935 0.083 820 HG3 LYS 102 HG3 LYS 102 -12.422 -17.211 0.106 821 HD2 LYS 102 HD2 LYS 102 -11.598 -17.336 -2.192 822 HD3 LYS 102 HD3 LYS 102 -11.823 -19.099 -2.195 823 HE2 LYS 102 HE2 LYS 102 -14.261 -18.773 -1.797 824 HE3 LYS 102 HE3 LYS 102 -14.022 -17.015 -1.860 825 HZ1 LYS 102 HZ1 LYS 102 -13.437 -18.847 -4.111 826 HZ2 LYS 102 HZ2 LYS 102 -13.344 -17.197 -4.141 827 HZ3 LYS 102 HZ3 LYS 102 -14.806 -17.938 -3.968 828 H SER 103 H SER 103 -11.055 -15.662 1.506 829 HA SER 103 HA SER 103 -11.860 -14.039 -0.698 830 HB2 SER 103 HB2 SER 103 -12.987 -14.101 1.521 831 HB3 SER 103 HB3 SER 103 -11.592 -13.267 2.238 832 HG SER 103 HG SER 103 -13.263 -12.278 0.155 833 H LEU 104 H LEU 104 -9.223 -13.557 1.713 834 HA LEU 104 HA LEU 104 -8.322 -11.090 0.597 835 HB2 LEU 104 HB2 LEU 104 -7.244 -13.138 2.460 836 HB3 LEU 104 HB3 LEU 104 -6.053 -12.141 1.637 837 HG LEU 104 HG LEU 104 -8.331 -11.014 3.275 838 HD11 LEU 104 HD11 LEU 104 -6.648 -10.583 5.010 839 HD12 LEU 104 HD12 LEU 104 -5.412 -11.412 4.035 840 HD13 LEU 104 HD13 LEU 104 -6.799 -12.322 4.687 841 HD21 LEU 104 HD21 LEU 104 -5.907 -9.807 1.885 842 HD22 LEU 104 HD22 LEU 104 -6.735 -8.972 3.216 843 HD23 LEU 104 HD23 LEU 104 -7.612 -9.351 1.725 844 H GLN 105 H GLN 105 -7.463 -14.492 -0.202 845 HA GLN 105 HA GLN 105 -5.258 -13.741 -1.881 846 HB2 GLN 105 HB2 GLN 105 -7.006 -16.163 -1.615 847 HB3 GLN 105 HB3 GLN 105 -6.020 -16.009 -3.063 848 HG2 GLN 105 HG2 GLN 105 -4.870 -15.798 -0.256 849 HG3 GLN 105 HG3 GLN 105 -5.015 -17.331 -1.120 850 HE21 GLN 105 HE21 GLN 105 -4.410 -15.188 -3.551 851 HE22 GLN 105 HE22 GLN 105 -2.667 -15.289 -3.586 852 H GLU 106 H GLU 106 -8.776 -14.013 -2.487 853 HA GLU 106 HA GLU 106 -8.484 -13.597 -5.334 854 HB2 GLU 106 HB2 GLU 106 -10.808 -13.291 -3.423 855 HB3 GLU 106 HB3 GLU 106 -10.941 -13.014 -5.169 856 HG2 GLU 106 HG2 GLU 106 -10.192 -15.295 -5.619 857 HG3 GLU 106 HG3 GLU 106 -9.997 -15.596 -3.889 858 H LEU 107 H LEU 107 -8.964 -11.425 -2.522 859 HA LEU 107 HA LEU 107 -9.199 -9.019 -4.100 860 HB2 LEU 107 HB2 LEU 107 -8.054 -9.437 -1.317 861 HB3 LEU 107 HB3 LEU 107 -8.288 -7.880 -2.076 862 HG LEU 107 HG LEU 107 -10.396 -9.747 -1.035 863 HD11 LEU 107 HD11 LEU 107 -10.898 -7.775 0.337 864 HD12 LEU 107 HD12 LEU 107 -9.591 -6.884 -0.471 865 HD13 LEU 107 HD13 LEU 107 -9.213 -8.299 0.530 866 HD21 LEU 107 HD21 LEU 107 -10.776 -7.238 -2.724 867 HD22 LEU 107 HD22 LEU 107 -12.058 -8.033 -1.783 868 HD23 LEU 107 HD23 LEU 107 -11.303 -8.893 -3.136 869 H THR 108 H THR 108 -6.450 -10.911 -2.892 870 HA THR 108 HA THR 108 -4.400 -9.034 -3.513 871 HB THR 108 HB THR 108 -4.173 -12.097 -3.644 872 HG1 THR 108 HG1 THR 108 -5.041 -11.274 -1.636 873 HG21 THR 108 HG21 THR 108 -2.166 -11.020 -4.513 874 HG22 THR 108 HG22 THR 108 -1.831 -11.653 -2.877 875 HG23 THR 108 HG23 THR 108 -2.121 -9.913 -3.119 876 H SER 109 H SER 109 -5.872 -11.691 -5.508 877 HA SER 109 HA SER 109 -4.210 -11.060 -7.774 878 HB2 SER 109 HB2 SER 109 -6.338 -12.226 -8.943 879 HB3 SER 109 HB3 SER 109 -5.108 -13.139 -8.044 880 HG SER 109 HG SER 109 -7.590 -12.193 -7.011 881 H LYS 110 H LYS 110 -7.449 -9.898 -6.723 882 HA LYS 110 HA LYS 110 -8.112 -8.573 -9.172 883 HB2 LYS 110 HB2 LYS 110 -9.540 -9.107 -7.040 884 HB3 LYS 110 HB3 LYS 110 -8.943 -7.561 -6.449 885 HG2 LYS 110 HG2 LYS 110 -9.837 -6.785 -8.897 886 HG3 LYS 110 HG3 LYS 110 -10.893 -8.178 -8.636 887 HD2 LYS 110 HD2 LYS 110 -10.654 -5.685 -6.900 888 HD3 LYS 110 HD3 LYS 110 -12.034 -6.168 -7.875 889 HE2 LYS 110 HE2 LYS 110 -12.425 -8.106 -6.389 890 HE3 LYS 110 HE3 LYS 110 -10.997 -7.665 -5.427 891 HZ1 LYS 110 HZ1 LYS 110 -13.352 -5.892 -5.765 892 HZ2 LYS 110 HZ2 LYS 110 -12.059 -5.621 -4.775 893 HZ3 LYS 110 HZ3 LYS 110 -13.100 -6.849 -4.449 894 H LEU 111 H LEU 111 -6.367 -7.497 -6.266 895 HA LEU 111 HA LEU 111 -6.102 -4.760 -7.011 896 HB2 LEU 111 HB2 LEU 111 -5.719 -5.987 -4.779 897 HB3 LEU 111 HB3 LEU 111 -4.114 -6.351 -5.359 898 HG LEU 111 HG LEU 111 -5.171 -3.527 -5.037 899 HD11 LEU 111 HD11 LEU 111 -5.329 -4.646 -2.899 900 HD12 LEU 111 HD12 LEU 111 -3.942 -3.546 -2.864 901 HD13 LEU 111 HD13 LEU 111 -3.678 -5.292 -3.063 902 HD21 LEU 111 HD21 LEU 111 -2.365 -4.644 -5.247 903 HD22 LEU 111 HD22 LEU 111 -2.766 -2.964 -4.813 904 HD23 LEU 111 HD23 LEU 111 -3.201 -3.589 -6.410 905 H PHE 112 H PHE 112 -4.023 -7.621 -7.587 906 HA PHE 112 HA PHE 112 -2.009 -5.984 -8.869 907 HB2 PHE 112 HB2 PHE 112 -2.380 -8.932 -8.475 908 HB3 PHE 112 HB3 PHE 112 -1.113 -8.299 -9.536 909 HD1 PHE 112 HD1 PHE 112 -2.448 -7.551 -6.073 910 HD2 PHE 112 HD2 PHE 112 0.995 -8.004 -8.602 911 HE1 PHE 112 HE1 PHE 112 -1.008 -7.124 -4.133 912 HE2 PHE 112 HE2 PHE 112 2.468 -7.565 -6.634 913 HZ PHE 112 HZ PHE 112 1.439 -7.129 -4.394 914 H SER 113 H SER 113 -4.845 -7.736 -10.021 915 HA SER 113 HA SER 113 -4.117 -7.688 -12.802 916 HB2 SER 113 HB2 SER 113 -6.050 -8.973 -11.890 917 HB3 SER 113 HB3 SER 113 -6.879 -7.443 -11.535 918 HG SER 113 HG SER 113 -6.655 -6.988 -13.845 919 H SER 114 H SER 114 -5.845 -5.358 -10.671 920 HA SER 114 HA SER 114 -6.162 -3.433 -12.804 921 HB2 SER 114 HB2 SER 114 -6.725 -1.870 -10.883 922 HB3 SER 114 HB3 SER 114 -7.739 -3.312 -11.067 923 HG SER 114 HG SER 114 -6.824 -4.230 -9.327 924 H ILE 115 H ILE 115 -3.554 -4.144 -10.550 925 HA ILE 115 HA ILE 115 -2.070 -1.692 -10.942 926 HB ILE 115 HB ILE 115 -1.384 -4.500 -10.066 927 HG12 ILE 115 HG12 ILE 115 -0.794 -1.788 -8.855 928 HG13 ILE 115 HG13 ILE 115 -2.243 -2.735 -8.521 929 HG21 ILE 115 HG21 ILE 115 1.070 -3.908 -9.905 930 HG22 ILE 115 HG22 ILE 115 0.506 -4.080 -11.565 931 HG23 ILE 115 HG23 ILE 115 0.745 -2.462 -10.876 932 HD11 ILE 115 HD11 ILE 115 -0.773 -4.581 -7.641 933 HD12 ILE 115 HD12 ILE 115 0.619 -3.489 -7.838 934 HD13 ILE 115 HD13 ILE 115 -0.684 -3.069 -6.722 935 H ASP 116 H ASP 116 -2.144 -4.861 -12.655 936 HA ASP 116 HA ASP 116 -0.130 -4.052 -14.540 937 HB2 ASP 116 HB2 ASP 116 -2.191 -6.268 -14.536 938 HB3 ASP 116 HB3 ASP 116 -1.058 -6.020 -15.873 939 H ASN 117 H ASN 117 -3.652 -3.664 -14.426 940 HA ASN 117 HA ASN 117 -3.890 -2.788 -17.173 941 HB2 ASN 117 HB2 ASN 117 -5.563 -2.110 -14.718 942 HB3 ASN 117 HB3 ASN 117 -5.969 -1.639 -16.370 943 HD21 ASN 117 HD21 ASN 117 -5.417 -3.860 -17.837 944 HD22 ASN 117 HD22 ASN 117 -6.451 -5.168 -17.320 945 H LEU 118 H LEU 118 -3.174 -1.125 -14.091 946 HA LEU 118 HA LEU 118 -3.110 1.536 -15.181 947 HB2 LEU 118 HB2 LEU 118 -2.979 0.402 -12.702 948 HB3 LEU 118 HB3 LEU 118 -1.296 0.855 -12.920 949 HG LEU 118 HG LEU 118 -3.598 2.811 -13.204 950 HD11 LEU 118 HD11 LEU 118 -3.645 1.812 -10.966 951 HD12 LEU 118 HD12 LEU 118 -3.103 3.501 -10.895 952 HD13 LEU 118 HD13 LEU 118 -1.916 2.181 -10.750 953 HD21 LEU 118 HD21 LEU 118 -1.457 3.534 -14.200 954 HD22 LEU 118 HD22 LEU 118 -0.664 3.288 -12.626 955 HD23 LEU 118 HD23 LEU 118 -1.934 4.520 -12.806 956 H ASP 119 H ASP 119 -0.698 -1.051 -14.844 957 HA ASP 119 HA ASP 119 1.587 0.459 -15.686 958 HB2 ASP 119 HB2 ASP 119 2.240 -1.535 -14.789 959 HB3 ASP 119 HB3 ASP 119 0.818 -2.388 -15.392 960 H HIS 120 H HIS 120 -0.755 -1.553 -17.558 961 HA HIS 120 HA HIS 120 0.542 -0.999 -20.072 962 HB2 HIS 120 HB2 HIS 120 -2.214 -1.972 -19.322 963 HB3 HIS 120 HB3 HIS 120 -1.761 -1.645 -21.001 964 HD1 HIS 120 HD1 HIS 120 -0.805 -3.955 -18.109 965 HD2 HIS 120 HD2 HIS 120 -0.222 -3.531 -22.223 966 HE1 HIS 120 HE1 HIS 120 0.333 -6.067 -18.920 967 H ALA 121 H ALA 121 -1.988 0.683 -18.222 968 HA ALA 121 HA ALA 121 -2.711 2.554 -20.246 969 HB1 ALA 121 HB1 ALA 121 -2.596 2.865 -17.228 970 HB2 ALA 121 HB2 ALA 121 -3.425 3.957 -18.346 971 HB3 ALA 121 HB3 ALA 121 -3.977 2.274 -18.178 972 H ALA 122 H ALA 122 -0.021 2.488 -17.904 973 HA ALA 122 HA ALA 122 0.920 5.133 -18.564 974 HB1 ALA 122 HB1 ALA 122 2.398 2.753 -17.421 975 HB2 ALA 122 HB2 ALA 122 2.946 4.442 -17.399 976 HB3 ALA 122 HB3 ALA 122 1.491 3.970 -16.496 977 H LYS 123 H LYS 123 1.705 1.840 -19.736 978 HA LYS 123 HA LYS 123 3.911 2.686 -21.368 979 HB2 LYS 123 HB2 LYS 123 2.091 0.293 -21.246 980 HB3 LYS 123 HB3 LYS 123 3.054 0.515 -22.709 981 HG2 LYS 123 HG2 LYS 123 4.939 -0.178 -21.724 982 HG3 LYS 123 HG3 LYS 123 4.680 0.850 -20.307 983 HD2 LYS 123 HD2 LYS 123 4.759 -1.481 -19.631 984 HD3 LYS 123 HD3 LYS 123 3.146 -0.823 -19.363 985 HE2 LYS 123 HE2 LYS 123 2.326 -1.925 -21.412 986 HE3 LYS 123 HE3 LYS 123 3.953 -2.581 -21.708 987 HZ1 LYS 123 HZ1 LYS 123 3.790 -3.881 -19.744 988 HZ2 LYS 123 HZ2 LYS 123 2.350 -4.103 -20.526 989 HZ3 LYS 123 HZ3 LYS 123 2.438 -3.111 -19.208 990 H ILE 124 H ILE 124 0.409 2.586 -21.913 991 HA ILE 124 HA ILE 124 0.771 3.312 -24.743 992 HB ILE 124 HB ILE 124 -1.113 1.781 -23.684 993 HG12 ILE 124 HG12 ILE 124 -2.686 2.551 -25.554 994 HG13 ILE 124 HG13 ILE 124 -1.480 3.787 -25.923 995 HG21 ILE 124 HG21 ILE 124 -2.485 4.501 -23.531 996 HG22 ILE 124 HG22 ILE 124 -3.228 2.911 -23.255 997 HG23 ILE 124 HG23 ILE 124 -2.002 3.514 -22.135 998 HD11 ILE 124 HD11 ILE 124 -0.962 0.777 -25.917 999 HD12 ILE 124 HD12 ILE 124 -1.250 1.770 -27.364 1000 HD13 ILE 124 HD13 ILE 124 0.206 2.038 -26.380 1001 H LYS 125 H LYS 125 1.056 4.896 -21.919 1002 HA LYS 125 HA LYS 125 1.364 7.056 -21.363 1003 HB2 LYS 125 HB2 LYS 125 1.137 7.700 -24.312 1004 HB3 LYS 125 HB3 LYS 125 1.950 8.658 -23.072 1005 HG2 LYS 125 HG2 LYS 125 3.642 6.911 -22.785 1006 HG3 LYS 125 HG3 LYS 125 2.779 5.858 -23.916 1007 HD2 LYS 125 HD2 LYS 125 3.064 7.579 -25.683 1008 HD3 LYS 125 HD3 LYS 125 4.109 8.491 -24.566 1009 HE2 LYS 125 HE2 LYS 125 5.636 6.576 -24.403 1010 HE3 LYS 125 HE3 LYS 125 4.549 5.594 -25.408 1011 HZ1 LYS 125 HZ1 LYS 125 6.366 6.500 -26.711 1012 HZ2 LYS 125 HZ2 LYS 125 5.951 8.046 -26.310 1013 HZ3 LYS 125 HZ3 LYS 125 4.935 7.132 -27.232 1014 H SER 126 H SER 126 -1.395 6.054 -21.474 1015 HA SER 126 HA SER 126 -2.871 8.574 -22.065 1016 HB2 SER 126 HB2 SER 126 -3.832 6.574 -23.043 1017 HB3 SER 126 HB3 SER 126 -3.861 5.784 -21.453 1018 HG SER 126 HG SER 126 -5.875 6.830 -22.178 1019 HA PRO 127 HA PRO 127 -2.513 8.908 -17.605 1020 HB2 PRO 127 HB2 PRO 127 -3.514 11.437 -17.269 1021 HB3 PRO 127 HB3 PRO 127 -1.835 11.124 -17.815 1022 HG2 PRO 127 HG2 PRO 127 -4.269 11.741 -19.475 1023 HG3 PRO 127 HG3 PRO 127 -2.647 12.504 -19.523 1024 HD2 PRO 127 HD2 PRO 127 -3.332 10.567 -21.271 1025 HD3 PRO 127 HD3 PRO 127 -1.673 10.643 -20.575 1026 H THR 128 H THR 128 -5.382 9.739 -19.586 1027 HA THR 128 HA THR 128 -7.282 9.679 -17.490 1028 HB THR 128 HB THR 128 -7.759 8.773 -20.358 1029 HG1 THR 128 HG1 THR 128 -7.571 11.405 -19.278 1030 HG21 THR 128 HG21 THR 128 -9.472 10.256 -18.317 1031 HG22 THR 128 HG22 THR 128 -9.705 8.578 -18.867 1032 HG23 THR 128 HG23 THR 128 -9.933 9.925 -20.003 1033 H GLU 129 H GLU 129 -5.920 7.055 -19.511 1034 HA GLU 129 HA GLU 129 -7.648 5.017 -18.385 1035 HB2 GLU 129 HB2 GLU 129 -4.985 4.943 -19.829 1036 HB3 GLU 129 HB3 GLU 129 -5.774 3.485 -19.219 1037 HG2 GLU 129 HG2 GLU 129 -6.925 5.397 -21.264 1038 HG3 GLU 129 HG3 GLU 129 -6.217 3.808 -21.597 1039 H ALA 130 H ALA 130 -4.427 6.366 -17.563 1040 HA ALA 130 HA ALA 130 -3.841 4.451 -15.521 1041 HB1 ALA 130 HB1 ALA 130 -2.201 6.097 -14.730 1042 HB2 ALA 130 HB2 ALA 130 -2.162 6.017 -16.506 1043 HB3 ALA 130 HB3 ALA 130 -2.972 7.374 -15.690 1044 H GLU 131 H GLU 131 -5.596 7.565 -15.487 1045 HA GLU 131 HA GLU 131 -6.082 7.658 -12.673 1046 HB2 GLU 131 HB2 GLU 131 -7.575 8.776 -15.057 1047 HB3 GLU 131 HB3 GLU 131 -8.033 9.126 -13.387 1048 HG2 GLU 131 HG2 GLU 131 -6.015 10.307 -12.966 1049 HG3 GLU 131 HG3 GLU 131 -5.248 9.686 -14.430 1050 H LYS 132 H LYS 132 -7.869 6.160 -15.379 1051 HA LYS 132 HA LYS 132 -10.217 5.433 -13.964 1052 HB2 LYS 132 HB2 LYS 132 -9.798 5.257 -16.444 1053 HB3 LYS 132 HB3 LYS 132 -8.796 3.839 -16.129 1054 HG2 LYS 132 HG2 LYS 132 -10.863 2.810 -15.015 1055 HG3 LYS 132 HG3 LYS 132 -11.786 4.117 -15.780 1056 HD2 LYS 132 HD2 LYS 132 -9.966 2.159 -17.241 1057 HD3 LYS 132 HD3 LYS 132 -11.725 1.988 -17.115 1058 HE2 LYS 132 HE2 LYS 132 -12.027 4.124 -18.318 1059 HE3 LYS 132 HE3 LYS 132 -10.264 4.322 -18.419 1060 HZ1 LYS 132 HZ1 LYS 132 -11.120 3.389 -20.440 1061 HZ2 LYS 132 HZ2 LYS 132 -11.787 2.100 -19.640 1062 HZ3 LYS 132 HZ3 LYS 132 -10.141 2.302 -19.699 1063 H TYR 133 H TYR 133 -7.110 3.659 -14.310 1064 HA TYR 133 HA TYR 133 -8.156 1.539 -12.562 1065 HB2 TYR 133 HB2 TYR 133 -5.382 1.873 -13.712 1066 HB3 TYR 133 HB3 TYR 133 -6.055 0.408 -12.983 1067 HD1 TYR 133 HD1 TYR 133 -8.454 -0.299 -14.133 1068 HD2 TYR 133 HD2 TYR 133 -5.345 1.982 -16.038 1069 HE1 TYR 133 HE1 TYR 133 -9.404 -0.860 -16.378 1070 HE2 TYR 133 HE2 TYR 133 -6.307 1.427 -18.266 1071 HH TYR 133 HH TYR 133 -8.072 0.552 -19.384 1072 H TYR 134 H TYR 134 -6.534 4.550 -12.113 1073 HA TYR 134 HA TYR 134 -5.149 3.878 -9.680 1074 HB2 TYR 134 HB2 TYR 134 -4.409 5.951 -10.005 1075 HB3 TYR 134 HB3 TYR 134 -5.625 6.236 -11.230 1076 HD1 TYR 134 HD1 TYR 134 -5.279 6.260 -7.464 1077 HD2 TYR 134 HD2 TYR 134 -7.176 7.996 -10.905 1078 HE1 TYR 134 HE1 TYR 134 -6.329 8.005 -6.022 1079 HE2 TYR 134 HE2 TYR 134 -8.239 9.704 -9.457 1080 HH TYR 134 HH TYR 134 -8.467 10.524 -7.337 1081 H GLY 135 H GLY 135 -8.460 5.140 -10.368 1082 HA2 GLY 135 HA2 GLY 135 -9.239 5.243 -7.631 1083 HA3 GLY 135 HA3 GLY 135 -10.340 5.064 -9.013 1084 H GLN 136 H GLN 136 -9.368 2.599 -10.015 1085 HA GLN 136 HA GLN 136 -10.816 0.767 -8.375 1086 HB2 GLN 136 HB2 GLN 136 -8.798 0.294 -10.595 1087 HB3 GLN 136 HB3 GLN 136 -9.815 -0.966 -9.883 1088 HG2 GLN 136 HG2 GLN 136 -11.827 0.135 -10.670 1089 HG3 GLN 136 HG3 GLN 136 -10.895 1.522 -11.244 1090 HE21 GLN 136 HE21 GLN 136 -11.461 1.374 -13.370 1091 HE22 GLN 136 HE22 GLN 136 -10.963 0.045 -14.393 1092 H THR 137 H THR 137 -7.256 1.200 -8.834 1093 HA THR 137 HA THR 137 -6.627 -0.957 -7.040 1094 HB THR 137 HB THR 137 -4.336 0.181 -6.876 1095 HG1 THR 137 HG1 THR 137 -5.417 1.812 -8.950 1096 HG21 THR 137 HG21 THR 137 -5.447 -0.367 -9.650 1097 HG22 THR 137 HG22 THR 137 -4.770 -1.572 -8.530 1098 HG23 THR 137 HG23 THR 137 -3.728 -0.305 -9.211 1099 H VAL 138 H VAL 138 -7.135 2.567 -6.480 1100 HA VAL 138 HA VAL 138 -6.220 2.532 -3.753 1101 HB VAL 138 HB VAL 138 -8.311 4.277 -5.150 1102 HG11 VAL 138 HG11 VAL 138 -8.847 4.331 -2.773 1103 HG12 VAL 138 HG12 VAL 138 -7.133 4.558 -2.345 1104 HG13 VAL 138 HG13 VAL 138 -8.025 5.843 -3.196 1105 HG21 VAL 138 HG21 VAL 138 -6.597 5.936 -5.273 1106 HG22 VAL 138 HG22 VAL 138 -5.515 5.019 -4.217 1107 HG23 VAL 138 HG23 VAL 138 -5.861 4.436 -5.851 1108 H SER 139 H SER 139 -9.459 1.946 -5.212 1109 HA SER 139 HA SER 139 -10.805 1.549 -2.730 1110 HB2 SER 139 HB2 SER 139 -11.916 1.856 -4.949 1111 HB3 SER 139 HB3 SER 139 -11.384 0.226 -5.411 1112 HG SER 139 HG SER 139 -12.560 -0.513 -3.506 1113 H ASN 140 H ASN 140 -9.083 -0.736 -4.895 1114 HA ASN 140 HA ASN 140 -9.748 -3.056 -3.370 1115 HB2 ASN 140 HB2 ASN 140 -8.723 -2.725 -5.769 1116 HB3 ASN 140 HB3 ASN 140 -7.182 -2.815 -4.913 1117 HD21 ASN 140 HD21 ASN 140 -7.969 -4.733 -2.915 1118 HD22 ASN 140 HD22 ASN 140 -8.197 -6.248 -3.763 1119 H ILE 141 H ILE 141 -7.046 -0.739 -3.142 1120 HA ILE 141 HA ILE 141 -5.507 -2.262 -1.247 1121 HB ILE 141 HB ILE 141 -5.637 0.712 -1.915 1122 HG12 ILE 141 HG12 ILE 141 -3.304 -1.187 -2.271 1123 HG13 ILE 141 HG13 ILE 141 -4.630 -1.185 -3.431 1124 HG21 ILE 141 HG21 ILE 141 -3.853 -0.679 0.128 1125 HG22 ILE 141 HG22 ILE 141 -3.478 0.910 -0.564 1126 HG23 ILE 141 HG23 ILE 141 -4.947 0.688 0.407 1127 HD11 ILE 141 HD11 ILE 141 -4.236 1.306 -3.725 1128 HD12 ILE 141 HD12 ILE 141 -2.726 1.072 -2.809 1129 HD13 ILE 141 HD13 ILE 141 -2.984 0.219 -4.344 1130 H ASN 142 H ASN 142 -8.218 0.054 -0.937 1131 HA ASN 142 HA ASN 142 -8.152 0.141 1.933 1132 HB2 ASN 142 HB2 ASN 142 -9.401 1.717 0.421 1133 HB3 ASN 142 HB3 ASN 142 -10.575 0.429 0.120 1134 HD21 ASN 142 HD21 ASN 142 -9.576 2.921 2.232 1135 HD22 ASN 142 HD22 ASN 142 -10.783 2.651 3.466 1136 H GLU 143 H GLU 143 -9.879 -2.043 -0.364 1137 HA GLU 143 HA GLU 143 -11.339 -3.457 1.625 1138 HB2 GLU 143 HB2 GLU 143 -10.145 -4.502 -0.975 1139 HB3 GLU 143 HB3 GLU 143 -11.336 -5.361 -0.012 1140 HG2 GLU 143 HG2 GLU 143 -13.024 -3.713 -0.519 1141 HG3 GLU 143 HG3 GLU 143 -11.840 -2.726 -1.392 1142 H VAL 144 H VAL 144 -8.107 -4.008 0.273 1143 HA VAL 144 HA VAL 144 -7.659 -6.444 1.755 1144 HB VAL 144 HB VAL 144 -5.755 -4.457 0.404 1145 HG11 VAL 144 HG11 VAL 144 -4.028 -6.265 0.584 1146 HG12 VAL 144 HG12 VAL 144 -4.469 -5.552 2.143 1147 HG13 VAL 144 HG13 VAL 144 -5.112 -7.146 1.688 1148 HG21 VAL 144 HG21 VAL 144 -6.685 -7.261 -0.354 1149 HG22 VAL 144 HG22 VAL 144 -7.240 -5.748 -1.100 1150 HG23 VAL 144 HG23 VAL 144 -5.551 -6.257 -1.282 1151 H LEU 145 H LEU 145 -7.223 -2.966 2.434 1152 HA LEU 145 HA LEU 145 -5.447 -3.359 4.673 1153 HB2 LEU 145 HB2 LEU 145 -6.726 -1.139 3.371 1154 HB3 LEU 145 HB3 LEU 145 -7.016 -1.022 5.100 1155 HG LEU 145 HG LEU 145 -4.549 -1.222 5.496 1156 HD11 LEU 145 HD11 LEU 145 -4.419 -0.963 2.472 1157 HD12 LEU 145 HD12 LEU 145 -3.848 -2.332 3.447 1158 HD13 LEU 145 HD13 LEU 145 -3.040 -0.758 3.577 1159 HD21 LEU 145 HD21 LEU 145 -5.444 1.057 3.684 1160 HD22 LEU 145 HD22 LEU 145 -4.049 1.086 4.788 1161 HD23 LEU 145 HD23 LEU 145 -5.695 0.958 5.444 1162 H ALA 146 H ALA 146 -8.989 -3.124 4.411 1163 HA ALA 146 HA ALA 146 -9.426 -3.117 7.253 1164 HB1 ALA 146 HB1 ALA 146 -11.756 -3.739 6.643 1165 HB2 ALA 146 HB2 ALA 146 -11.156 -2.419 5.609 1166 HB3 ALA 146 HB3 ALA 146 -11.231 -4.082 4.975 1167 H LYS 147 H LYS 147 -9.133 -5.729 4.832 1168 HA LYS 147 HA LYS 147 -9.716 -7.792 6.804 1169 HB2 LYS 147 HB2 LYS 147 -8.595 -7.835 4.012 1170 HB3 LYS 147 HB3 LYS 147 -8.756 -9.296 5.004 1171 HG2 LYS 147 HG2 LYS 147 -11.161 -8.858 5.260 1172 HG3 LYS 147 HG3 LYS 147 -11.004 -7.428 4.217 1173 HD2 LYS 147 HD2 LYS 147 -10.180 -8.851 2.405 1174 HD3 LYS 147 HD3 LYS 147 -10.353 -10.277 3.430 1175 HE2 LYS 147 HE2 LYS 147 -12.652 -8.424 2.833 1176 HE3 LYS 147 HE3 LYS 147 -12.233 -9.802 1.786 1177 HZ1 LYS 147 HZ1 LYS 147 -12.412 -11.208 3.827 1178 HZ2 LYS 147 HZ2 LYS 147 -13.850 -10.538 3.358 1179 HZ3 LYS 147 HZ3 LYS 147 -13.017 -9.925 4.645 1180 H LEU 148 H LEU 148 -6.828 -6.050 5.834 1181 HA LEU 148 HA LEU 148 -4.976 -7.908 7.087 1182 HB2 LEU 148 HB2 LEU 148 -4.850 -5.041 6.159 1183 HB3 LEU 148 HB3 LEU 148 -3.550 -5.717 7.124 1184 HG LEU 148 HG LEU 148 -4.449 -6.871 4.482 1185 HD11 LEU 148 HD11 LEU 148 -3.541 -4.594 4.215 1186 HD12 LEU 148 HD12 LEU 148 -2.404 -5.799 3.581 1187 HD13 LEU 148 HD13 LEU 148 -2.105 -5.044 5.163 1188 HD21 LEU 148 HD21 LEU 148 -2.108 -7.915 4.674 1189 HD22 LEU 148 HD22 LEU 148 -3.350 -8.561 5.759 1190 HD23 LEU 148 HD23 LEU 148 -2.134 -7.417 6.375 1191 H GLY 149 H GLY 149 -7.351 -5.810 8.331 1192 HA2 GLY 149 HA2 GLY 149 -6.461 -4.458 10.457 1193 HA3 GLY 149 HA3 GLY 149 -7.876 -5.495 10.562 Start of MODEL 18 1 H1 GLU 1 H1 GLU 1 -4.012 29.098 17.807 2 H2 GLU 1 H2 GLU 1 -4.727 28.693 19.243 3 H3 GLU 1 H3 GLU 1 -3.115 29.047 19.186 4 HA GLU 1 HA GLU 1 -3.479 26.675 19.394 5 HB2 GLU 1 HB2 GLU 1 -4.799 27.016 16.667 6 HB3 GLU 1 HB3 GLU 1 -4.459 25.480 17.479 7 HG2 GLU 1 HG2 GLU 1 -6.433 27.620 18.258 8 HG3 GLU 1 HG3 GLU 1 -6.744 25.910 17.895 9 H ALA 2 H ALA 2 -2.101 25.108 18.283 10 HA ALA 2 HA ALA 2 -0.282 26.295 16.262 11 HB1 ALA 2 HB1 ALA 2 0.644 25.069 18.906 12 HB2 ALA 2 HB2 ALA 2 1.700 25.562 17.564 13 HB3 ALA 2 HB3 ALA 2 0.766 26.787 18.451 14 H ARG 3 H ARG 3 -1.996 24.657 15.315 15 HA ARG 3 HA ARG 3 -0.516 22.110 14.926 16 HB2 ARG 3 HB2 ARG 3 -3.473 22.347 15.639 17 HB3 ARG 3 HB3 ARG 3 -2.781 20.950 14.811 18 HG2 ARG 3 HG2 ARG 3 -1.180 20.711 16.776 19 HG3 ARG 3 HG3 ARG 3 -2.188 21.907 17.619 20 HD2 ARG 3 HD2 ARG 3 -2.967 19.734 18.262 21 HD3 ARG 3 HD3 ARG 3 -4.174 20.420 17.156 22 HE ARG 3 HE ARG 3 -2.218 18.832 15.724 23 HH11 ARG 3 HH11 ARG 3 -5.124 18.504 17.711 24 HH12 ARG 3 HH12 ARG 3 -5.527 16.957 17.016 25 HH21 ARG 3 HH21 ARG 3 -2.766 16.880 14.910 26 HH22 ARG 3 HH22 ARG 3 -4.219 16.052 15.449 27 HA PRO 4 HA PRO 4 -1.513 23.374 10.835 28 HB2 PRO 4 HB2 PRO 4 -1.791 21.027 9.448 29 HB3 PRO 4 HB3 PRO 4 -0.208 21.636 10.021 30 HG2 PRO 4 HG2 PRO 4 -2.019 19.618 11.307 31 HG3 PRO 4 HG3 PRO 4 -0.267 19.496 10.942 32 HD2 PRO 4 HD2 PRO 4 -1.132 20.180 13.390 33 HD3 PRO 4 HD3 PRO 4 0.310 20.974 12.669 34 H ILE 5 H ILE 5 -3.383 24.165 10.043 35 HA ILE 5 HA ILE 5 -5.756 22.522 9.754 36 HB ILE 5 HB ILE 5 -5.885 23.115 12.213 37 HG12 ILE 5 HG12 ILE 5 -8.176 24.148 12.176 38 HG13 ILE 5 HG13 ILE 5 -7.996 24.407 10.444 39 HG21 ILE 5 HG21 ILE 5 -6.095 26.017 11.282 40 HG22 ILE 5 HG22 ILE 5 -6.265 25.423 12.949 41 HG23 ILE 5 HG23 ILE 5 -4.700 25.301 12.121 42 HD11 ILE 5 HD11 ILE 5 -9.330 22.370 10.998 43 HD12 ILE 5 HD12 ILE 5 -7.878 21.979 10.053 44 HD13 ILE 5 HD13 ILE 5 -7.906 21.676 11.808 45 H VAL 6 H VAL 6 -7.148 23.426 8.244 46 HA VAL 6 HA VAL 6 -6.575 26.215 7.358 47 HB VAL 6 HB VAL 6 -7.283 23.862 5.529 48 HG11 VAL 6 HG11 VAL 6 -6.725 26.811 4.937 49 HG12 VAL 6 HG12 VAL 6 -6.891 25.543 3.700 50 HG13 VAL 6 HG13 VAL 6 -8.274 25.957 4.732 51 HG21 VAL 6 HG21 VAL 6 -4.669 25.393 5.866 52 HG22 VAL 6 HG22 VAL 6 -4.952 23.671 6.199 53 HG23 VAL 6 HG23 VAL 6 -5.019 24.269 4.533 54 H VAL 7 H VAL 7 -8.370 27.371 7.823 55 HA VAL 7 HA VAL 7 -11.011 26.181 7.310 56 HB VAL 7 HB VAL 7 -10.600 25.489 9.646 57 HG11 VAL 7 HG11 VAL 7 -10.241 27.101 11.465 58 HG12 VAL 7 HG12 VAL 7 -8.915 27.172 10.294 59 HG13 VAL 7 HG13 VAL 7 -10.166 28.436 10.295 60 HG21 VAL 7 HG21 VAL 7 -12.566 26.465 10.710 61 HG22 VAL 7 HG22 VAL 7 -12.556 27.824 9.563 62 HG23 VAL 7 HG23 VAL 7 -12.892 26.170 8.990 63 H GLY 8 H GLY 8 -12.383 27.732 6.542 64 HA2 GLY 8 HA2 GLY 8 -13.095 29.853 5.908 65 HA3 GLY 8 HA3 GLY 8 -11.996 30.540 7.118 66 HA PRO 9 HA PRO 9 -9.871 31.545 3.259 67 HB2 PRO 9 HB2 PRO 9 -7.943 33.217 4.218 68 HB3 PRO 9 HB3 PRO 9 -9.659 33.728 4.119 69 HG2 PRO 9 HG2 PRO 9 -8.153 32.608 6.470 70 HG3 PRO 9 HG3 PRO 9 -9.126 34.112 6.371 71 HD2 PRO 9 HD2 PRO 9 -10.162 31.816 7.352 72 HD3 PRO 9 HD3 PRO 9 -11.154 32.935 6.350 73 HA PRO 10 HA PRO 10 -6.414 28.762 3.502 74 HB2 PRO 10 HB2 PRO 10 -4.554 29.769 1.764 75 HB3 PRO 10 HB3 PRO 10 -6.091 29.042 1.193 76 HG2 PRO 10 HG2 PRO 10 -5.434 31.941 1.662 77 HG3 PRO 10 HG3 PRO 10 -6.124 31.165 0.199 78 HD2 PRO 10 HD2 PRO 10 -7.706 32.371 2.008 79 HD3 PRO 10 HD3 PRO 10 -8.214 30.835 1.225 80 HA PRO 11 HA PRO 11 -3.764 30.546 6.484 81 HB2 PRO 11 HB2 PRO 11 -1.361 29.233 6.274 82 HB3 PRO 11 HB3 PRO 11 -2.845 28.446 6.904 83 HG2 PRO 11 HG2 PRO 11 -1.726 28.389 4.116 84 HG3 PRO 11 HG3 PRO 11 -2.212 27.018 5.164 85 HD2 PRO 11 HD2 PRO 11 -3.878 27.970 3.296 86 HD3 PRO 11 HD3 PRO 11 -4.502 27.498 4.916 87 HA PRO 12 HA PRO 12 -1.530 33.697 4.399 88 HB2 PRO 12 HB2 PRO 12 0.016 34.812 6.346 89 HB3 PRO 12 HB3 PRO 12 -1.774 34.935 6.378 90 HG2 PRO 12 HG2 PRO 12 0.008 32.966 7.799 91 HG3 PRO 12 HG3 PRO 12 -1.285 34.006 8.479 92 HD2 PRO 12 HD2 PRO 12 -1.743 31.422 7.817 93 HD3 PRO 12 HD3 PRO 12 -2.992 32.689 7.549 94 H LEU 13 H LEU 13 0.582 34.349 3.618 95 HA LEU 13 HA LEU 13 2.396 32.217 3.097 96 HB2 LEU 13 HB2 LEU 13 2.072 34.292 1.742 97 HB3 LEU 13 HB3 LEU 13 2.888 35.222 2.994 98 HG LEU 13 HG LEU 13 4.372 32.910 1.792 99 HD11 LEU 13 HD11 LEU 13 5.067 34.298 -0.129 100 HD12 LEU 13 HD12 LEU 13 3.914 35.562 0.364 101 HD13 LEU 13 HD13 LEU 13 3.324 33.965 -0.160 102 HD21 LEU 13 HD21 LEU 13 5.174 35.749 2.591 103 HD22 LEU 13 HD22 LEU 13 6.279 34.492 1.988 104 HD23 LEU 13 HD23 LEU 13 5.457 34.269 3.541 105 H SER 14 H SER 14 2.298 34.725 5.587 106 HA SER 14 HA SER 14 4.868 33.895 6.746 107 HB2 SER 14 HB2 SER 14 2.772 35.832 7.800 108 HB3 SER 14 HB3 SER 14 4.465 35.695 8.327 109 HG SER 14 HG SER 14 5.085 36.329 6.221 110 H GLY 15 H GLY 15 3.100 31.744 6.619 111 HA2 GLY 15 HA2 GLY 15 1.868 31.495 9.305 112 HA3 GLY 15 HA3 GLY 15 1.657 30.404 7.927 113 H GLY 16 H GLY 16 2.025 28.713 9.557 114 HA2 GLY 16 HA2 GLY 16 4.758 27.794 9.393 115 HA3 GLY 16 HA3 GLY 16 4.285 28.233 11.060 116 H LEU 17 H LEU 17 4.810 25.558 10.107 117 HA LEU 17 HA LEU 17 3.996 23.427 10.246 118 HB2 LEU 17 HB2 LEU 17 1.359 24.614 11.176 119 HB3 LEU 17 HB3 LEU 17 1.827 22.929 11.261 120 HG LEU 17 HG LEU 17 3.267 25.150 12.750 121 HD11 LEU 17 HD11 LEU 17 0.929 24.907 13.473 122 HD12 LEU 17 HD12 LEU 17 2.077 24.374 14.721 123 HD13 LEU 17 HD13 LEU 17 1.207 23.170 13.747 124 HD21 LEU 17 HD21 LEU 17 4.680 23.172 12.396 125 HD22 LEU 17 HD22 LEU 17 3.383 22.109 12.993 126 HD23 LEU 17 HD23 LEU 17 4.177 23.258 14.095 127 HA PRO 18 HA PRO 18 2.415 23.125 6.324 128 HB2 PRO 18 HB2 PRO 18 1.163 20.725 6.024 129 HB3 PRO 18 HB3 PRO 18 2.929 20.868 6.277 130 HG2 PRO 18 HG2 PRO 18 0.773 20.320 8.288 131 HG3 PRO 18 HG3 PRO 18 2.296 19.424 7.991 132 HD2 PRO 18 HD2 PRO 18 2.102 21.250 9.960 133 HD3 PRO 18 HD3 PRO 18 3.607 21.084 8.991 134 H GLY 19 H GLY 19 0.644 23.352 4.903 135 HA2 GLY 19 HA2 GLY 19 -2.078 23.091 5.508 136 HA3 GLY 19 HA3 GLY 19 -1.603 24.659 6.165 137 H THR 20 H THR 20 0.461 24.963 3.920 138 HA THR 20 HA THR 20 -1.532 25.949 1.921 139 HB THR 20 HB THR 20 0.096 27.580 3.000 140 HG1 THR 20 HG1 THR 20 0.651 28.501 0.923 141 HG21 THR 20 HG21 THR 20 2.395 27.656 2.201 142 HG22 THR 20 HG22 THR 20 2.150 26.185 1.237 143 HG23 THR 20 HG23 THR 20 2.111 26.108 3.014 144 H GLU 21 H GLU 21 0.902 23.603 2.464 145 HA GLU 21 HA GLU 21 1.101 22.925 -0.434 146 HB2 GLU 21 HB2 GLU 21 2.915 21.383 0.350 147 HB3 GLU 21 HB3 GLU 21 3.255 23.090 0.614 148 HG2 GLU 21 HG2 GLU 21 2.107 21.374 2.826 149 HG3 GLU 21 HG3 GLU 21 3.846 21.410 2.485 150 H ASN 22 H ASN 22 1.286 20.329 -0.587 151 HA ASN 22 HA ASN 22 -1.133 19.288 0.832 152 HB2 ASN 22 HB2 ASN 22 -0.222 18.673 -2.003 153 HB3 ASN 22 HB3 ASN 22 -1.667 18.033 -1.209 154 HD21 ASN 22 HD21 ASN 22 -2.752 20.269 -0.004 155 HD22 ASN 22 HD22 ASN 22 -3.179 21.420 -1.246 156 H SER 23 H SER 23 -1.212 16.818 0.535 157 HA SER 23 HA SER 23 -0.404 14.722 0.831 158 HB2 SER 23 HB2 SER 23 2.462 15.621 0.556 159 HB3 SER 23 HB3 SER 23 1.755 14.025 0.243 160 HG SER 23 HG SER 23 1.619 16.388 -1.275 161 H ASP 24 H ASP 24 1.403 17.256 2.614 162 HA ASP 24 HA ASP 24 1.236 15.446 4.995 163 HB2 ASP 24 HB2 ASP 24 3.178 16.515 5.893 164 HB3 ASP 24 HB3 ASP 24 3.562 15.996 4.246 165 H GLN 25 H GLN 25 -0.383 17.737 3.582 166 HA GLN 25 HA GLN 25 -0.512 20.063 4.968 167 HB2 GLN 25 HB2 GLN 25 -1.723 19.220 2.905 168 HB3 GLN 25 HB3 GLN 25 -2.972 18.603 3.987 169 HG2 GLN 25 HG2 GLN 25 -3.523 20.827 4.721 170 HG3 GLN 25 HG3 GLN 25 -2.087 21.495 3.925 171 HE21 GLN 25 HE21 GLN 25 -3.600 22.964 2.878 172 HE22 GLN 25 HE22 GLN 25 -4.447 22.410 1.452 173 H ALA 26 H ALA 26 -1.969 17.050 6.121 174 HA ALA 26 HA ALA 26 -2.443 18.375 8.727 175 HB1 ALA 26 HB1 ALA 26 -4.668 17.292 8.945 176 HB2 ALA 26 HB2 ALA 26 -4.648 18.434 7.581 177 HB3 ALA 26 HB3 ALA 26 -4.542 16.681 7.278 178 H ARG 27 H ARG 27 -0.250 16.989 8.247 179 HA ARG 27 HA ARG 27 -0.811 14.167 9.103 180 HB2 ARG 27 HB2 ARG 27 -0.148 14.641 6.705 181 HB3 ARG 27 HB3 ARG 27 1.436 15.116 7.311 182 HG2 ARG 27 HG2 ARG 27 1.863 12.866 8.096 183 HG3 ARG 27 HG3 ARG 27 0.185 12.384 7.725 184 HD2 ARG 27 HD2 ARG 27 0.564 13.030 5.356 185 HD3 ARG 27 HD3 ARG 27 2.260 13.370 5.735 186 HE ARG 27 HE ARG 27 1.860 10.752 6.547 187 HH11 ARG 27 HH11 ARG 27 1.455 12.490 3.493 188 HH12 ARG 27 HH12 ARG 27 1.839 11.078 2.535 189 HH21 ARG 27 HH21 ARG 27 2.322 8.989 5.249 190 HH22 ARG 27 HH22 ARG 27 2.303 9.134 3.513 191 H ASP 28 H ASP 28 -0.561 15.116 11.278 192 HA ASP 28 HA ASP 28 2.003 16.010 12.214 193 HB2 ASP 28 HB2 ASP 28 -0.436 14.840 13.606 194 HB3 ASP 28 HB3 ASP 28 1.025 15.316 14.486 195 H GLY 29 H GLY 29 3.563 14.531 11.394 196 HA2 GLY 29 HA2 GLY 29 5.152 13.008 12.248 197 HA3 GLY 29 HA3 GLY 29 3.916 12.263 13.252 198 H THR 30 H THR 30 5.375 10.446 12.333 199 HA THR 30 HA THR 30 3.918 9.253 10.030 200 HB THR 30 HB THR 30 6.052 8.315 9.143 201 HG1 THR 30 HG1 THR 30 7.367 10.119 10.901 202 HG21 THR 30 HG21 THR 30 6.973 10.317 8.125 203 HG22 THR 30 HG22 THR 30 6.255 11.345 9.383 204 HG23 THR 30 HG23 THR 30 5.207 10.491 8.227 205 H LEU 31 H LEU 31 4.129 6.889 10.005 206 HA LEU 31 HA LEU 31 4.884 5.732 12.659 207 HB2 LEU 31 HB2 LEU 31 2.490 5.047 10.921 208 HB3 LEU 31 HB3 LEU 31 2.975 4.170 12.370 209 HG LEU 31 HG LEU 31 2.089 7.080 12.330 210 HD11 LEU 31 HD11 LEU 31 -0.013 6.238 13.286 211 HD12 LEU 31 HD12 LEU 31 0.572 4.565 13.125 212 HD13 LEU 31 HD13 LEU 31 0.275 5.552 11.674 213 HD21 LEU 31 HD21 LEU 31 3.532 6.599 14.248 214 HD22 LEU 31 HD22 LEU 31 2.584 5.140 14.631 215 HD23 LEU 31 HD23 LEU 31 1.851 6.755 14.788 216 HA PRO 32 HA PRO 32 6.893 3.570 9.159 217 HB2 PRO 32 HB2 PRO 32 9.388 3.189 10.193 218 HB3 PRO 32 HB3 PRO 32 8.874 4.759 9.489 219 HG2 PRO 32 HG2 PRO 32 8.905 3.906 12.384 220 HG3 PRO 32 HG3 PRO 32 9.588 5.388 11.640 221 HD2 PRO 32 HD2 PRO 32 7.154 5.371 12.840 222 HD3 PRO 32 HD3 PRO 32 7.480 6.367 11.379 223 H TYR 33 H TYR 33 7.126 1.403 8.803 224 HA TYR 33 HA TYR 33 7.404 -0.429 11.138 225 HB2 TYR 33 HB2 TYR 33 4.972 -0.014 10.010 226 HB3 TYR 33 HB3 TYR 33 5.577 -1.282 8.940 227 HD1 TYR 33 HD2 TYR 33 4.598 -0.435 12.416 228 HD2 TYR 33 HD1 TYR 33 5.928 -3.559 9.787 229 HE1 TYR 33 HE2 TYR 33 4.001 -2.144 14.136 230 HE2 TYR 33 HE1 TYR 33 5.356 -5.264 11.524 231 HH TYR 33 HH TYR 33 4.745 -5.592 13.715 232 H THR 34 H THR 34 9.207 0.664 9.128 233 HA THR 34 HA THR 34 10.075 -1.836 7.764 234 HB THR 34 HB THR 34 8.858 -0.356 6.107 235 HG1 THR 34 HG1 THR 34 10.445 -0.589 4.586 236 HG21 THR 34 HG21 THR 34 11.149 1.596 6.612 237 HG22 THR 34 HG22 THR 34 9.460 1.852 7.113 238 HG23 THR 34 HG23 THR 34 9.871 1.746 5.389 239 H LYS 35 H LYS 35 12.427 -1.086 6.807 240 HA LYS 35 HA LYS 35 14.615 -0.741 7.377 241 HB2 LYS 35 HB2 LYS 35 14.231 1.579 7.343 242 HB3 LYS 35 HB3 LYS 35 13.396 1.571 8.888 243 HG2 LYS 35 HG2 LYS 35 15.587 2.602 9.107 244 HG3 LYS 35 HG3 LYS 35 15.494 1.135 10.083 245 HD2 LYS 35 HD2 LYS 35 16.782 -0.104 8.410 246 HD3 LYS 35 HD3 LYS 35 16.843 1.333 7.362 247 HE2 LYS 35 HE2 LYS 35 18.176 2.540 8.960 248 HE3 LYS 35 HE3 LYS 35 17.851 1.338 10.229 249 HZ1 LYS 35 HZ1 LYS 35 20.071 1.133 9.201 250 HZ2 LYS 35 HZ2 LYS 35 19.364 0.690 7.776 251 HZ3 LYS 35 HZ3 LYS 35 19.171 -0.250 9.128 252 H ASP 36 H ASP 36 15.197 -2.547 8.234 253 HA ASP 36 HA ASP 36 15.890 -4.096 9.700 254 HB2 ASP 36 HB2 ASP 36 16.172 -1.637 11.413 255 HB3 ASP 36 HB3 ASP 36 16.602 -3.242 12.013 256 H ARG 37 H ARG 37 12.861 -2.924 10.032 257 HA ARG 37 HA ARG 37 11.918 -4.047 12.459 258 HB2 ARG 37 HB2 ARG 37 10.604 -2.646 10.786 259 HB3 ARG 37 HB3 ARG 37 10.501 -4.078 9.758 260 HG2 ARG 37 HG2 ARG 37 8.434 -4.049 10.885 261 HG3 ARG 37 HG3 ARG 37 9.380 -5.235 11.794 262 HD2 ARG 37 HD2 ARG 37 10.023 -3.316 13.355 263 HD3 ARG 37 HD3 ARG 37 8.761 -2.369 12.543 264 HE ARG 37 HE ARG 37 7.708 -4.906 13.421 265 HH11 ARG 37 HH11 ARG 37 8.691 -1.776 14.739 266 HH12 ARG 37 HH12 ARG 37 7.655 -1.944 16.129 267 HH21 ARG 37 HH21 ARG 37 6.460 -5.063 15.197 268 HH22 ARG 37 HH22 ARG 37 6.404 -3.777 16.384 269 H PHE 38 H PHE 38 12.942 -5.536 9.465 270 HA PHE 38 HA PHE 38 11.766 -8.124 9.911 271 HB2 PHE 38 HB2 PHE 38 13.927 -7.028 8.105 272 HB3 PHE 38 HB3 PHE 38 13.575 -8.758 8.168 273 HD1 PHE 38 HD1 PHE 38 11.878 -5.441 7.577 274 HD2 PHE 38 HD2 PHE 38 11.891 -9.686 6.852 275 HE1 PHE 38 HE1 PHE 38 9.981 -5.167 5.987 276 HE2 PHE 38 HE2 PHE 38 10.002 -9.419 5.246 277 HZ PHE 38 HZ PHE 38 9.030 -7.160 4.826 278 H TYR 39 H TYR 39 14.520 -6.615 11.355 279 HA TYR 39 HA TYR 39 15.564 -9.312 12.140 280 HB2 TYR 39 HB2 TYR 39 16.962 -6.615 12.052 281 HB3 TYR 39 HB3 TYR 39 17.667 -8.107 12.686 282 HD1 TYR 39 HD2 TYR 39 17.428 -10.205 10.940 283 HD2 TYR 39 HD1 TYR 39 17.585 -6.039 9.863 284 HE1 TYR 39 HE2 TYR 39 18.235 -10.820 8.663 285 HE2 TYR 39 HE1 TYR 39 18.389 -6.667 7.586 286 HH TYR 39 HH TYR 39 18.920 -10.066 6.625 287 H LEU 40 H LEU 40 14.696 -6.046 13.279 288 HA LEU 40 HA LEU 40 15.252 -6.598 16.053 289 HB2 LEU 40 HB2 LEU 40 13.849 -4.501 14.459 290 HB3 LEU 40 HB3 LEU 40 13.347 -4.664 16.129 291 HG LEU 40 HG LEU 40 15.013 -2.882 15.767 292 HD11 LEU 40 HD11 LEU 40 16.404 -3.419 17.701 293 HD12 LEU 40 HD12 LEU 40 16.006 -5.144 17.547 294 HD13 LEU 40 HD13 LEU 40 14.739 -3.971 17.971 295 HD21 LEU 40 HD21 LEU 40 17.337 -3.366 15.333 296 HD22 LEU 40 HD22 LEU 40 16.365 -4.043 14.012 297 HD23 LEU 40 HD23 LEU 40 17.021 -5.115 15.269 298 H GLN 41 H GLN 41 12.440 -7.040 13.940 299 HA GLN 41 HA GLN 41 11.094 -8.400 16.221 300 HB2 GLN 41 HB2 GLN 41 10.014 -6.443 14.214 301 HB3 GLN 41 HB3 GLN 41 8.980 -7.739 14.804 302 HG2 GLN 41 HG2 GLN 41 8.514 -5.963 16.241 303 HG3 GLN 41 HG3 GLN 41 9.600 -6.997 17.165 304 HE21 GLN 41 HE21 GLN 41 10.947 -5.830 18.347 305 HE22 GLN 41 HE22 GLN 41 11.693 -4.328 17.862 306 HA PRO 42 HA PRO 42 10.950 -11.824 13.443 307 HB2 PRO 42 HB2 PRO 42 8.910 -13.302 14.487 308 HB3 PRO 42 HB3 PRO 42 10.460 -13.087 15.363 309 HG2 PRO 42 HG2 PRO 42 7.884 -11.558 15.688 310 HG3 PRO 42 HG3 PRO 42 8.879 -12.366 16.940 311 HD2 PRO 42 HD2 PRO 42 9.071 -9.720 16.441 312 HD3 PRO 42 HD3 PRO 42 10.515 -10.703 16.871 313 H LEU 43 H LEU 43 9.198 -13.065 12.068 314 HA LEU 43 HA LEU 43 7.271 -11.031 11.044 315 HB2 LEU 43 HB2 LEU 43 7.479 -12.178 8.863 316 HB3 LEU 43 HB3 LEU 43 8.953 -11.417 9.429 317 HG LEU 43 HG LEU 43 8.803 -14.272 10.134 318 HD11 LEU 43 HD11 LEU 43 8.907 -13.438 7.205 319 HD12 LEU 43 HD12 LEU 43 7.604 -14.363 7.990 320 HD13 LEU 43 HD13 LEU 43 9.226 -15.070 7.838 321 HD21 LEU 43 HD21 LEU 43 10.855 -12.622 8.587 322 HD22 LEU 43 HD22 LEU 43 11.101 -14.239 9.281 323 HD23 LEU 43 HD23 LEU 43 10.845 -12.846 10.351 324 HA PRO 44 HA PRO 44 4.685 -14.737 12.090 325 HB2 PRO 44 HB2 PRO 44 2.979 -13.665 13.934 326 HB3 PRO 44 HB3 PRO 44 4.548 -14.387 14.421 327 HG2 PRO 44 HG2 PRO 44 3.865 -11.509 13.913 328 HG3 PRO 44 HG3 PRO 44 4.656 -12.244 15.343 329 HD2 PRO 44 HD2 PRO 44 6.084 -11.090 13.376 330 HD3 PRO 44 HD3 PRO 44 6.663 -12.576 14.199 331 HA PRO 45 HA PRO 45 1.949 -12.932 9.232 332 HB2 PRO 45 HB2 PRO 45 -0.539 -13.969 9.675 333 HB3 PRO 45 HB3 PRO 45 0.817 -14.928 9.012 334 HG2 PRO 45 HG2 PRO 45 -0.097 -14.737 11.872 335 HG3 PRO 45 HG3 PRO 45 0.171 -16.202 10.869 336 HD2 PRO 45 HD2 PRO 45 2.078 -15.347 12.532 337 HD3 PRO 45 HD3 PRO 45 2.515 -15.917 10.882 338 H THR 46 H THR 46 1.143 -12.456 12.608 339 HA THR 46 HA THR 46 -0.872 -10.430 12.215 340 HB THR 46 HB THR 46 -0.030 -9.770 14.595 341 HG1 THR 46 HG1 THR 46 1.301 -11.328 15.536 342 HG21 THR 46 HG21 THR 46 -2.027 -11.193 14.175 343 HG22 THR 46 HG22 THR 46 -1.128 -11.716 15.616 344 HG23 THR 46 HG23 THR 46 -0.973 -12.627 14.096 345 H GLU 47 H GLU 47 2.709 -10.332 12.706 346 HA GLU 47 HA GLU 47 2.767 -7.429 12.451 347 HB2 GLU 47 HB2 GLU 47 4.919 -9.558 12.398 348 HB3 GLU 47 HB3 GLU 47 5.253 -7.860 12.054 349 HG2 GLU 47 HG2 GLU 47 3.873 -7.561 14.345 350 HG3 GLU 47 HG3 GLU 47 4.550 -9.169 14.634 351 H ALA 48 H ALA 48 2.904 -10.187 10.264 352 HA ALA 48 HA ALA 48 3.907 -8.743 8.000 353 HB1 ALA 48 HB1 ALA 48 1.960 -11.077 8.009 354 HB2 ALA 48 HB2 ALA 48 3.004 -10.552 6.672 355 HB3 ALA 48 HB3 ALA 48 3.730 -11.235 8.147 356 H ALA 49 H ALA 49 0.677 -8.970 9.512 357 HA ALA 49 HA ALA 49 -0.718 -7.710 7.324 358 HB1 ALA 49 HB1 ALA 49 -1.842 -9.021 9.128 359 HB2 ALA 49 HB2 ALA 49 -1.428 -7.739 10.290 360 HB3 ALA 49 HB3 ALA 49 -2.529 -7.392 8.943 361 H GLN 50 H GLN 50 1.100 -6.527 10.108 362 HA GLN 50 HA GLN 50 0.297 -3.763 9.782 363 HB2 GLN 50 HB2 GLN 50 2.612 -5.062 11.214 364 HB3 GLN 50 HB3 GLN 50 2.278 -3.330 11.259 365 HG2 GLN 50 HG2 GLN 50 0.125 -5.270 12.034 366 HG3 GLN 50 HG3 GLN 50 1.435 -4.909 13.171 367 HE21 GLN 50 HE21 GLN 50 0.647 -3.572 14.656 368 HE22 GLN 50 HE22 GLN 50 -0.274 -2.126 14.321 369 H ARG 51 H ARG 51 2.985 -5.799 8.602 370 HA ARG 51 HA ARG 51 4.382 -3.589 7.317 371 HB2 ARG 51 HB2 ARG 51 4.441 -6.597 6.831 372 HB3 ARG 51 HB3 ARG 51 5.531 -5.440 6.049 373 HG2 ARG 51 HG2 ARG 51 6.495 -4.811 8.177 374 HG3 ARG 51 HG3 ARG 51 5.299 -5.767 9.053 375 HD2 ARG 51 HD2 ARG 51 6.241 -7.816 7.886 376 HD3 ARG 51 HD3 ARG 51 7.581 -6.772 7.355 377 HE ARG 51 HE ARG 51 7.100 -6.504 10.189 378 HH11 ARG 51 HH21 ARG 51 8.650 -8.677 7.886 379 HH12 ARG 51 HH22 ARG 51 9.719 -9.336 9.099 380 HH21 ARG 51 HH11 ARG 51 8.479 -7.398 11.676 381 HH22 ARG 51 HH12 ARG 51 9.630 -8.616 11.213 382 H ALA 52 H ALA 52 1.931 -5.962 6.344 383 HA ALA 52 HA ALA 52 1.852 -5.369 3.600 384 HB1 ALA 52 HB1 ALA 52 -0.434 -6.323 3.646 385 HB2 ALA 52 HB2 ALA 52 0.692 -7.303 4.603 386 HB3 ALA 52 HB3 ALA 52 -0.446 -6.217 5.420 387 H LYS 53 H LYS 53 -0.016 -3.751 6.261 388 HA LYS 53 HA LYS 53 -1.487 -2.144 4.389 389 HB2 LYS 53 HB2 LYS 53 -2.032 -0.689 6.295 390 HB3 LYS 53 HB3 LYS 53 -2.342 -2.398 6.608 391 HG2 LYS 53 HG2 LYS 53 -0.440 -2.572 8.042 392 HG3 LYS 53 HG3 LYS 53 0.161 -0.984 7.554 393 HD2 LYS 53 HD2 LYS 53 -0.818 -0.816 9.758 394 HD3 LYS 53 HD3 LYS 53 -1.797 0.091 8.598 395 HE2 LYS 53 HE2 LYS 53 -3.273 -1.082 10.095 396 HE3 LYS 53 HE3 LYS 53 -3.406 -1.818 8.501 397 HZ1 LYS 53 HZ1 LYS 53 -1.818 -2.924 10.731 398 HZ2 LYS 53 HZ2 LYS 53 -2.075 -3.643 9.261 399 HZ3 LYS 53 HZ3 LYS 53 -3.342 -3.418 10.306 400 H VAL 54 H VAL 54 1.771 -1.789 5.697 401 HA VAL 54 HA VAL 54 1.989 0.988 4.799 402 HB VAL 54 HB VAL 54 4.150 -1.024 5.602 403 HG11 VAL 54 HG11 VAL 54 4.319 1.990 5.131 404 HG12 VAL 54 HG12 VAL 54 5.609 0.987 5.838 405 HG13 VAL 54 HG13 VAL 54 5.106 0.722 4.159 406 HG21 VAL 54 HG21 VAL 54 4.213 0.336 7.705 407 HG22 VAL 54 HG22 VAL 54 2.801 1.246 7.136 408 HG23 VAL 54 HG23 VAL 54 2.668 -0.493 7.477 409 H SER 55 H SER 55 3.058 -2.244 3.601 410 HA SER 55 HA SER 55 4.311 -1.293 1.233 411 HB2 SER 55 HB2 SER 55 2.820 -3.907 1.707 412 HB3 SER 55 HB3 SER 55 4.000 -3.600 0.414 413 HG SER 55 HG SER 55 4.671 -4.635 2.583 414 H ALA 56 H ALA 56 0.905 -2.073 1.940 415 HA ALA 56 HA ALA 56 -0.043 -1.721 -0.758 416 HB1 ALA 56 HB1 ALA 56 -2.212 -1.813 0.197 417 HB2 ALA 56 HB2 ALA 56 -1.220 -2.903 1.174 418 HB3 ALA 56 HB3 ALA 56 -1.627 -1.289 1.795 419 H SER 57 H SER 57 0.554 0.490 1.945 420 HA SER 57 HA SER 57 -0.916 2.685 0.807 421 HB2 SER 57 HB2 SER 57 -0.304 2.442 3.225 422 HB3 SER 57 HB3 SER 57 1.386 2.766 2.796 423 HG SER 57 HG SER 57 0.184 4.631 3.493 424 H GLU 58 H GLU 58 2.429 1.497 0.431 425 HA GLU 58 HA GLU 58 3.454 3.871 -0.824 426 HB2 GLU 58 HB2 GLU 58 4.232 0.959 -1.227 427 HB3 GLU 58 HB3 GLU 58 5.103 2.348 -1.877 428 HG2 GLU 58 HG2 GLU 58 5.286 3.148 0.565 429 HG3 GLU 58 HG3 GLU 58 4.859 1.482 0.993 430 H ILE 59 H ILE 59 1.478 1.201 -2.006 431 HA ILE 59 HA ILE 59 1.883 1.717 -4.810 432 HB ILE 59 HB ILE 59 -0.439 0.356 -3.366 433 HG12 ILE 59 HG12 ILE 59 1.953 -0.873 -4.786 434 HG13 ILE 59 HG13 ILE 59 1.894 -0.607 -3.047 435 HG21 ILE 59 HG21 ILE 59 0.355 0.196 -6.316 436 HG22 ILE 59 HG22 ILE 59 -0.975 -0.691 -5.539 437 HG23 ILE 59 HG23 ILE 59 -1.061 1.067 -5.690 438 HD11 ILE 59 HD11 ILE 59 1.351 -2.870 -3.357 439 HD12 ILE 59 HD12 ILE 59 -0.190 -2.060 -3.001 440 HD13 ILE 59 HD13 ILE 59 0.216 -2.512 -4.671 441 H LEU 60 H LEU 60 -0.205 3.180 -2.343 442 HA LEU 60 HA LEU 60 -2.045 4.456 -4.154 443 HB2 LEU 60 HB2 LEU 60 -1.066 5.378 -1.431 444 HB3 LEU 60 HB3 LEU 60 -2.474 6.005 -2.270 445 HG LEU 60 HG LEU 60 -2.247 3.117 -1.363 446 HD11 LEU 60 HD11 LEU 60 -3.602 3.768 0.572 447 HD12 LEU 60 HD12 LEU 60 -3.565 5.470 0.050 448 HD13 LEU 60 HD13 LEU 60 -2.067 4.660 0.565 449 HD21 LEU 60 HD21 LEU 60 -4.682 3.137 -1.588 450 HD22 LEU 60 HD22 LEU 60 -3.919 3.576 -3.128 451 HD23 LEU 60 HD23 LEU 60 -4.638 4.839 -2.102 452 H ASN 61 H ASN 61 1.275 5.106 -3.317 453 HA ASN 61 HA ASN 61 1.291 7.921 -3.960 454 HB2 ASN 61 HB2 ASN 61 2.982 6.639 -2.566 455 HB3 ASN 61 HB3 ASN 61 3.604 5.965 -4.079 456 HD21 ASN 61 HD21 ASN 61 5.456 6.905 -4.539 457 HD22 ASN 61 HD22 ASN 61 5.772 8.619 -4.439 458 H VAL 62 H VAL 62 0.803 5.263 -5.983 459 HA VAL 62 HA VAL 62 2.456 5.875 -8.202 460 HB VAL 62 HB VAL 62 1.093 3.767 -7.792 461 HG11 VAL 62 HG11 VAL 62 -1.164 5.340 -9.098 462 HG12 VAL 62 HG12 VAL 62 -1.180 3.634 -8.597 463 HG13 VAL 62 HG13 VAL 62 -1.089 4.907 -7.370 464 HG21 VAL 62 HG21 VAL 62 0.826 3.267 -10.134 465 HG22 VAL 62 HG22 VAL 62 0.837 4.996 -10.546 466 HG23 VAL 62 HG23 VAL 62 2.297 4.229 -9.871 467 H LYS 63 H LYS 63 -0.329 7.611 -7.030 468 HA LYS 63 HA LYS 63 -1.187 8.811 -9.473 469 HB2 LYS 63 HB2 LYS 63 -1.899 8.983 -6.831 470 HB3 LYS 63 HB3 LYS 63 -1.124 10.551 -7.068 471 HG2 LYS 63 HG2 LYS 63 -3.395 9.459 -8.789 472 HG3 LYS 63 HG3 LYS 63 -3.605 10.555 -7.412 473 HD2 LYS 63 HD2 LYS 63 -2.075 12.193 -8.622 474 HD3 LYS 63 HD3 LYS 63 -2.213 11.137 -10.043 475 HE2 LYS 63 HE2 LYS 63 -4.696 11.377 -9.936 476 HE3 LYS 63 HE3 LYS 63 -4.496 12.509 -8.582 477 HZ1 LYS 63 HZ1 LYS 63 -2.997 13.754 -10.261 478 HZ2 LYS 63 HZ2 LYS 63 -4.636 13.879 -10.418 479 HZ3 LYS 63 HZ3 LYS 63 -3.803 12.874 -11.415 480 H GLN 64 H GLN 64 1.691 9.361 -7.489 481 HA GLN 64 HA GLN 64 2.256 11.952 -8.650 482 HB2 GLN 64 HB2 GLN 64 4.135 10.021 -7.255 483 HB3 GLN 64 HB3 GLN 64 4.420 11.741 -7.551 484 HG2 GLN 64 HG2 GLN 64 2.305 10.528 -5.718 485 HG3 GLN 64 HG3 GLN 64 3.759 11.398 -5.229 486 HE21 GLN 64 HE21 GLN 64 3.766 13.628 -5.227 487 HE22 GLN 64 HE22 GLN 64 2.343 14.580 -5.564 488 H PHE 65 H PHE 65 2.574 8.754 -9.921 489 HA PHE 65 HA PHE 65 4.867 9.393 -11.629 490 HB2 PHE 65 HB2 PHE 65 4.856 7.175 -11.869 491 HB3 PHE 65 HB3 PHE 65 3.325 7.053 -11.005 492 HD1 PHE 65 HD1 PHE 65 4.912 7.300 -14.346 493 HD2 PHE 65 HD2 PHE 65 1.217 6.779 -12.211 494 HE1 PHE 65 HE1 PHE 65 3.780 6.685 -16.471 495 HE2 PHE 65 HE2 PHE 65 0.089 6.146 -14.327 496 HZ PHE 65 HZ PHE 65 1.351 6.131 -16.464 497 H ILE 66 H ILE 66 1.396 9.854 -11.692 498 HA ILE 66 HA ILE 66 0.967 10.055 -14.494 499 HB ILE 66 HB ILE 66 -0.419 11.646 -12.260 500 HG12 ILE 66 HG12 ILE 66 -0.474 9.194 -11.843 501 HG13 ILE 66 HG13 ILE 66 -2.061 9.904 -12.100 502 HG21 ILE 66 HG21 ILE 66 -1.293 11.013 -15.117 503 HG22 ILE 66 HG22 ILE 66 -2.390 11.644 -13.867 504 HG23 ILE 66 HG23 ILE 66 -1.000 12.613 -14.403 505 HD11 ILE 66 HD11 ILE 66 -2.222 8.951 -14.310 506 HD12 ILE 66 HD12 ILE 66 -0.539 8.406 -14.252 507 HD13 ILE 66 HD13 ILE 66 -1.748 7.676 -13.175 508 H ASP 67 H ASP 67 1.869 12.489 -12.056 509 HA ASP 67 HA ASP 67 2.044 14.741 -13.810 510 HB2 ASP 67 HB2 ASP 67 1.975 15.097 -11.443 511 HB3 ASP 67 HB3 ASP 67 3.322 13.983 -11.164 512 H ARG 68 H ARG 68 4.463 12.391 -12.665 513 HA ARG 68 HA ARG 68 6.654 13.637 -14.037 514 HB2 ARG 68 HB2 ARG 68 6.294 10.855 -12.876 515 HB3 ARG 68 HB3 ARG 68 7.833 11.485 -13.480 516 HG2 ARG 68 HG2 ARG 68 7.847 13.237 -11.811 517 HG3 ARG 68 HG3 ARG 68 6.226 12.788 -11.256 518 HD2 ARG 68 HD2 ARG 68 7.068 10.570 -10.582 519 HD3 ARG 68 HD3 ARG 68 8.699 11.031 -11.099 520 HE ARG 68 HE ARG 68 7.234 11.967 -8.719 521 HH11 ARG 68 HH21 ARG 68 10.098 12.420 -10.740 522 HH12 ARG 68 HH22 ARG 68 10.948 13.297 -9.497 523 HH21 ARG 68 HH11 ARG 68 8.387 13.093 -7.186 524 HH22 ARG 68 HH12 ARG 68 9.995 13.668 -7.526 525 H LYS 69 H LYS 69 4.128 11.755 -15.304 526 HA LYS 69 HA LYS 69 3.798 10.668 -17.311 527 HB2 LYS 69 HB2 LYS 69 5.542 12.995 -17.846 528 HB3 LYS 69 HB3 LYS 69 5.524 11.801 -19.141 529 HG2 LYS 69 HG2 LYS 69 3.159 11.967 -19.384 530 HG3 LYS 69 HG3 LYS 69 3.018 12.961 -17.923 531 HD2 LYS 69 HD2 LYS 69 4.295 14.747 -18.971 532 HD3 LYS 69 HD3 LYS 69 4.538 13.758 -20.430 533 HE2 LYS 69 HE2 LYS 69 2.137 13.732 -20.863 534 HE3 LYS 69 HE3 LYS 69 1.824 14.590 -19.338 535 HZ1 LYS 69 HZ1 LYS 69 1.813 16.086 -21.248 536 HZ2 LYS 69 HZ2 LYS 69 3.377 15.698 -21.606 537 HZ3 LYS 69 HZ3 LYS 69 3.022 16.484 -20.199 538 H ALA 70 H ALA 70 5.710 9.451 -15.499 539 HA ALA 70 HA ALA 70 7.965 8.546 -17.082 540 HB1 ALA 70 HB1 ALA 70 8.040 9.030 -14.623 541 HB2 ALA 70 HB2 ALA 70 7.055 7.573 -14.344 542 HB3 ALA 70 HB3 ALA 70 8.674 7.437 -15.065 543 H TRP 71 H TRP 71 6.143 7.703 -18.703 544 HA TRP 71 HA TRP 71 4.688 5.383 -18.368 545 HB2 TRP 71 HB2 TRP 71 6.297 5.884 -20.861 546 HB3 TRP 71 HB3 TRP 71 4.735 5.108 -20.698 547 HD1 TRP 71 HD1 TRP 71 6.078 8.183 -21.932 548 HE1 TRP 71 HE1 TRP 71 4.435 10.115 -21.965 549 HE3 TRP 71 HE3 TRP 71 2.636 6.246 -18.688 550 HZ2 TRP 71 HZ2 TRP 71 1.892 10.715 -20.819 551 HZ3 TRP 71 HZ3 TRP 71 0.573 7.570 -18.190 552 HH2 TRP 71 HH2 TRP 71 0.219 9.784 -19.268 553 HA PRO 72 HA PRO 72 7.869 2.277 -19.303 554 HB2 PRO 72 HB2 PRO 72 10.544 2.632 -19.495 555 HB3 PRO 72 HB3 PRO 72 9.445 2.996 -20.867 556 HG2 PRO 72 HG2 PRO 72 10.612 4.881 -18.826 557 HG3 PRO 72 HG3 PRO 72 10.609 5.017 -20.613 558 HD2 PRO 72 HD2 PRO 72 8.767 6.277 -19.044 559 HD3 PRO 72 HD3 PRO 72 8.371 5.651 -20.680 560 H SER 73 H SER 73 8.917 4.711 -16.970 561 HA SER 73 HA SER 73 10.491 2.870 -15.377 562 HB2 SER 73 HB2 SER 73 10.839 5.358 -15.461 563 HB3 SER 73 HB3 SER 73 9.318 5.546 -14.565 564 HG SER 73 HG SER 73 10.301 4.142 -12.946 565 H LEU 74 H LEU 74 7.109 3.789 -15.529 566 HA LEU 74 HA LEU 74 6.390 3.138 -12.862 567 HB2 LEU 74 HB2 LEU 74 4.889 4.297 -14.492 568 HB3 LEU 74 HB3 LEU 74 4.751 2.785 -15.406 569 HG LEU 74 HG LEU 74 3.824 1.693 -13.339 570 HD11 LEU 74 HD11 LEU 74 2.960 3.139 -11.566 571 HD12 LEU 74 HD12 LEU 74 3.728 4.547 -12.319 572 HD13 LEU 74 HD13 LEU 74 4.715 3.229 -11.649 573 HD21 LEU 74 HD21 LEU 74 2.280 4.044 -14.331 574 HD22 LEU 74 HD22 LEU 74 1.633 2.628 -13.483 575 HD23 LEU 74 HD23 LEU 74 2.370 2.438 -15.071 576 H GLN 75 H GLN 75 6.700 1.152 -15.777 577 HA GLN 75 HA GLN 75 5.562 -1.234 -14.894 578 HB2 GLN 75 HB2 GLN 75 6.520 -0.626 -17.172 579 HB3 GLN 75 HB3 GLN 75 8.126 -0.938 -16.536 580 HG2 GLN 75 HG2 GLN 75 5.927 -3.037 -16.521 581 HG3 GLN 75 HG3 GLN 75 6.969 -2.783 -17.922 582 HE21 GLN 75 HE21 GLN 75 9.426 -2.295 -16.536 583 HE22 GLN 75 HE22 GLN 75 9.902 -3.812 -15.810 584 H ASN 76 H ASN 76 8.776 0.127 -14.184 585 HA ASN 76 HA ASN 76 9.649 -2.280 -12.778 586 HB2 ASN 76 HB2 ASN 76 11.245 -0.738 -13.900 587 HB3 ASN 76 HB3 ASN 76 10.788 0.542 -12.771 588 HD21 ASN 76 HD21 ASN 76 12.307 0.845 -11.305 589 HD22 ASN 76 HD22 ASN 76 13.227 -0.418 -10.528 590 H ASP 77 H ASP 77 8.866 1.097 -11.715 591 HA ASP 77 HA ASP 77 9.273 0.460 -8.975 592 HB2 ASP 77 HB2 ASP 77 9.238 2.770 -9.989 593 HB3 ASP 77 HB3 ASP 77 7.467 2.655 -10.053 594 H LEU 78 H LEU 78 6.179 0.647 -10.827 595 HA LEU 78 HA LEU 78 4.582 0.345 -8.481 596 HB2 LEU 78 HB2 LEU 78 3.805 1.190 -10.677 597 HB3 LEU 78 HB3 LEU 78 3.936 -0.431 -11.344 598 HG LEU 78 HG LEU 78 2.174 -1.209 -9.822 599 HD11 LEU 78 HD11 LEU 78 2.386 0.193 -7.898 600 HD12 LEU 78 HD12 LEU 78 0.800 0.545 -8.611 601 HD13 LEU 78 HD13 LEU 78 2.154 1.669 -8.861 602 HD21 LEU 78 HD21 LEU 78 0.317 -0.014 -10.904 603 HD22 LEU 78 HD22 LEU 78 1.616 -0.343 -12.065 604 HD23 LEU 78 HD23 LEU 78 1.425 1.290 -11.388 605 H ARG 79 H ARG 79 5.976 -2.031 -10.741 606 HA ARG 79 HA ARG 79 4.559 -4.236 -9.486 607 HB2 ARG 79 HB2 ARG 79 6.938 -4.176 -11.366 608 HB3 ARG 79 HB3 ARG 79 6.137 -5.655 -10.807 609 HG2 ARG 79 HG2 ARG 79 3.994 -4.860 -11.782 610 HG3 ARG 79 HG3 ARG 79 4.815 -3.411 -12.385 611 HD2 ARG 79 HD2 ARG 79 6.329 -4.862 -13.719 612 HD3 ARG 79 HD3 ARG 79 5.417 -6.282 -13.183 613 HE ARG 79 HE ARG 79 4.563 -4.210 -15.107 614 HH11 ARG 79 HH21 ARG 79 3.554 -7.048 -13.246 615 HH12 ARG 79 HH22 ARG 79 2.123 -7.289 -14.237 616 HH21 ARG 79 HH11 ARG 79 2.752 -4.580 -16.284 617 HH22 ARG 79 HH12 ARG 79 1.694 -5.945 -15.928 618 H LEU 80 H LEU 80 7.605 -2.550 -8.852 619 HA LEU 80 HA LEU 80 8.614 -4.592 -7.062 620 HB2 LEU 80 HB2 LEU 80 9.144 -1.640 -7.404 621 HB3 LEU 80 HB3 LEU 80 9.816 -2.520 -6.040 622 HG LEU 80 HG LEU 80 10.312 -3.306 -8.928 623 HD11 LEU 80 HD11 LEU 80 11.161 -1.040 -8.491 624 HD12 LEU 80 HD12 LEU 80 12.492 -2.200 -8.677 625 HD13 LEU 80 HD13 LEU 80 12.030 -1.632 -7.052 626 HD21 LEU 80 HD21 LEU 80 11.692 -4.070 -6.318 627 HD22 LEU 80 HD22 LEU 80 12.238 -4.535 -7.945 628 HD23 LEU 80 HD23 LEU 80 10.688 -5.133 -7.330 629 H ARG 81 H ARG 81 6.654 -1.590 -6.554 630 HA ARG 81 HA ARG 81 6.403 -1.940 -3.717 631 HB2 ARG 81 HB2 ARG 81 4.299 -0.772 -5.583 632 HB3 ARG 81 HB3 ARG 81 4.435 -0.497 -3.845 633 HG2 ARG 81 HG2 ARG 81 6.370 0.447 -5.966 634 HG3 ARG 81 HG3 ARG 81 5.202 1.443 -5.122 635 HD2 ARG 81 HD2 ARG 81 6.407 1.378 -3.139 636 HD3 ARG 81 HD3 ARG 81 7.288 -0.087 -3.586 637 HE ARG 81 HE ARG 81 7.997 1.822 -5.501 638 HH11 ARG 81 HH21 ARG 81 8.324 1.515 -1.969 639 HH12 ARG 81 HH22 ARG 81 9.802 2.446 -1.961 640 HH21 ARG 81 HH11 ARG 81 9.831 2.940 -5.414 641 HH22 ARG 81 HH12 ARG 81 10.650 3.255 -3.892 642 H ALA 82 H ALA 82 4.493 -3.129 -6.450 643 HA ALA 82 HA ALA 82 2.482 -4.424 -4.921 644 HB1 ALA 82 HB1 ALA 82 3.573 -5.351 -7.611 645 HB2 ALA 82 HB2 ALA 82 1.931 -5.561 -6.966 646 HB3 ALA 82 HB3 ALA 82 2.498 -3.948 -7.430 647 H SER 83 H SER 83 5.723 -5.567 -6.030 648 HA SER 83 HA SER 83 5.274 -8.261 -5.245 649 HB2 SER 83 HB2 SER 83 7.595 -8.622 -5.477 650 HB3 SER 83 HB3 SER 83 7.160 -7.420 -6.702 651 HG SER 83 HG SER 83 7.918 -5.811 -5.119 652 H TYR 84 H TYR 84 6.499 -5.459 -3.366 653 HA TYR 84 HA TYR 84 7.259 -6.980 -1.078 654 HB2 TYR 84 HB2 TYR 84 6.110 -4.171 -1.028 655 HB3 TYR 84 HB3 TYR 84 7.209 -4.904 0.142 656 HD1 TYR 84 HD1 TYR 84 9.202 -6.159 -1.882 657 HD2 TYR 84 HD2 TYR 84 7.377 -2.255 -1.670 658 HE1 TYR 84 HE1 TYR 84 11.101 -5.191 -3.169 659 HE2 TYR 84 HE2 TYR 84 9.299 -1.303 -2.947 660 HH TYR 84 HH TYR 84 12.030 -3.312 -4.063 661 H LEU 85 H LEU 85 4.186 -5.399 -1.989 662 HA LEU 85 HA LEU 85 2.775 -6.150 0.371 663 HB2 LEU 85 HB2 LEU 85 1.962 -4.441 -1.220 664 HB3 LEU 85 HB3 LEU 85 1.754 -5.683 -2.453 665 HG LEU 85 HG LEU 85 0.007 -6.774 -1.081 666 HD11 LEU 85 HD11 LEU 85 -0.941 -5.471 0.856 667 HD12 LEU 85 HD12 LEU 85 0.502 -4.436 0.793 668 HD13 LEU 85 HD13 LEU 85 0.662 -6.167 1.159 669 HD21 LEU 85 HD21 LEU 85 -0.522 -3.818 -1.501 670 HD22 LEU 85 HD22 LEU 85 -1.731 -5.116 -1.426 671 HD23 LEU 85 HD23 LEU 85 -0.573 -5.056 -2.773 672 H ARG 86 H ARG 86 3.348 -7.822 -2.693 673 HA ARG 86 HA ARG 86 1.466 -9.934 -2.248 674 HB2 ARG 86 HB2 ARG 86 2.764 -9.329 -4.401 675 HB3 ARG 86 HB3 ARG 86 4.096 -10.255 -3.722 676 HG2 ARG 86 HG2 ARG 86 3.031 -11.789 -5.123 677 HG3 ARG 86 HG3 ARG 86 2.387 -12.207 -3.529 678 HD2 ARG 86 HD2 ARG 86 0.258 -11.739 -4.181 679 HD3 ARG 86 HD3 ARG 86 0.735 -10.174 -4.851 680 HE ARG 86 HE ARG 86 1.615 -12.258 -6.591 681 HH11 ARG 86 HH11 ARG 86 -1.351 -10.580 -5.661 682 HH12 ARG 86 HH12 ARG 86 -2.138 -10.944 -7.169 683 HH21 ARG 86 HH21 ARG 86 0.541 -12.672 -8.501 684 HH22 ARG 86 HH22 ARG 86 -1.086 -12.095 -8.746 685 H TYR 87 H TYR 87 4.924 -9.578 -1.324 686 HA TYR 87 HA TYR 87 5.167 -12.243 -0.293 687 HB2 TYR 87 HB2 TYR 87 6.632 -9.768 0.693 688 HB3 TYR 87 HB3 TYR 87 7.147 -11.447 0.862 689 HD1 TYR 87 HD2 TYR 87 6.643 -12.458 -1.969 690 HD2 TYR 87 HD1 TYR 87 8.382 -8.782 -0.544 691 HE1 TYR 87 HE2 TYR 87 7.912 -12.217 -4.104 692 HE2 TYR 87 HE1 TYR 87 9.637 -8.554 -2.689 693 HH TYR 87 HH TYR 87 10.048 -9.433 -4.750 694 H ASP 88 H ASP 88 4.337 -9.114 1.280 695 HA ASP 88 HA ASP 88 4.114 -10.185 3.911 696 HB2 ASP 88 HB2 ASP 88 2.734 -7.822 2.578 697 HB3 ASP 88 HB3 ASP 88 2.554 -8.227 4.291 698 H LEU 89 H LEU 89 1.601 -9.684 1.370 699 HA LEU 89 HA LEU 89 -0.558 -10.613 2.977 700 HB2 LEU 89 HB2 LEU 89 -0.142 -9.806 0.256 701 HB3 LEU 89 HB3 LEU 89 -1.022 -11.320 0.238 702 HG LEU 89 HG LEU 89 -2.503 -9.376 0.134 703 HD11 LEU 89 HD11 LEU 89 -3.285 -11.486 1.200 704 HD12 LEU 89 HD12 LEU 89 -4.091 -10.042 1.837 705 HD13 LEU 89 HD13 LEU 89 -2.818 -10.835 2.789 706 HD21 LEU 89 HD21 LEU 89 -1.076 -7.842 1.473 707 HD22 LEU 89 HD22 LEU 89 -1.565 -8.706 2.944 708 HD23 LEU 89 HD23 LEU 89 -2.776 -7.846 1.972 709 H LYS 90 H LYS 90 1.714 -12.423 0.921 710 HA LYS 90 HA LYS 90 0.225 -14.882 1.017 711 HB2 LYS 90 HB2 LYS 90 3.146 -14.214 0.575 712 HB3 LYS 90 HB3 LYS 90 2.596 -15.891 0.654 713 HG2 LYS 90 HG2 LYS 90 1.454 -13.865 -1.297 714 HG3 LYS 90 HG3 LYS 90 2.811 -14.942 -1.670 715 HD2 LYS 90 HD2 LYS 90 1.356 -16.901 -1.145 716 HD3 LYS 90 HD3 LYS 90 -0.010 -15.792 -0.901 717 HE2 LYS 90 HE2 LYS 90 0.216 -14.988 -3.217 718 HE3 LYS 90 HE3 LYS 90 1.592 -16.085 -3.466 719 HZ1 LYS 90 HZ1 LYS 90 0.102 -17.946 -3.027 720 HZ2 LYS 90 HZ2 LYS 90 -0.464 -17.052 -4.290 721 HZ3 LYS 90 HZ3 LYS 90 -1.180 -16.931 -2.807 722 H THR 91 H THR 91 2.248 -13.235 3.345 723 HA THR 91 HA THR 91 2.498 -15.621 5.035 724 HB THR 91 HB THR 91 3.044 -12.712 5.770 725 HG1 THR 91 HG1 THR 91 4.349 -13.138 4.040 726 HG21 THR 91 HG21 THR 91 4.615 -13.711 7.382 727 HG22 THR 91 HG22 THR 91 4.158 -15.340 6.839 728 HG23 THR 91 HG23 THR 91 2.968 -14.311 7.673 729 H VAL 92 H VAL 92 0.599 -12.544 5.010 730 HA VAL 92 HA VAL 92 -0.683 -12.864 7.498 731 HB VAL 92 HB VAL 92 -1.832 -11.616 4.947 732 HG11 VAL 92 HG11 VAL 92 -2.680 -11.327 7.872 733 HG12 VAL 92 HG12 VAL 92 -3.241 -10.276 6.557 734 HG13 VAL 92 HG13 VAL 92 -3.653 -11.995 6.539 735 HG21 VAL 92 HG21 VAL 92 0.289 -10.598 5.666 736 HG22 VAL 92 HG22 VAL 92 -1.062 -9.496 5.919 737 HG23 VAL 92 HG23 VAL 92 -0.363 -10.381 7.292 738 H ILE 93 H ILE 93 -1.708 -14.169 4.321 739 HA ILE 93 HA ILE 93 -4.270 -15.050 5.189 740 HB ILE 93 HB ILE 93 -4.166 -16.614 3.274 741 HG12 ILE 93 HG12 ILE 93 -1.371 -15.544 2.839 742 HG13 ILE 93 HG13 ILE 93 -1.738 -17.148 3.463 743 HG21 ILE 93 HG21 ILE 93 -3.178 -13.815 2.579 744 HG22 ILE 93 HG22 ILE 93 -4.175 -14.873 1.563 745 HG23 ILE 93 HG23 ILE 93 -4.838 -14.209 3.059 746 HD11 ILE 93 HD11 ILE 93 -2.342 -16.081 0.689 747 HD12 ILE 93 HD12 ILE 93 -1.204 -17.366 1.143 748 HD13 ILE 93 HD13 ILE 93 -2.954 -17.636 1.308 749 H SER 94 H SER 94 -1.204 -16.343 6.030 750 HA SER 94 HA SER 94 -2.174 -19.072 6.372 751 HB2 SER 94 HB2 SER 94 0.348 -17.702 7.328 752 HB3 SER 94 HB3 SER 94 0.044 -19.453 7.308 753 HG SER 94 HG SER 94 0.638 -17.707 5.223 754 H ALA 95 H ALA 95 -2.465 -16.167 8.196 755 HA ALA 95 HA ALA 95 -2.338 -17.274 10.853 756 HB1 ALA 95 HB1 ALA 95 -3.658 -15.264 11.497 757 HB2 ALA 95 HB2 ALA 95 -2.331 -14.820 10.411 758 HB3 ALA 95 HB3 ALA 95 -3.985 -14.918 9.782 759 H LYS 96 H LYS 96 -4.936 -16.909 8.461 760 HA LYS 96 HA LYS 96 -6.536 -18.955 9.945 761 HB2 LYS 96 HB2 LYS 96 -7.489 -16.279 8.885 762 HB3 LYS 96 HB3 LYS 96 -8.577 -17.650 9.097 763 HG2 LYS 96 HG2 LYS 96 -8.920 -16.602 11.092 764 HG3 LYS 96 HG3 LYS 96 -7.608 -17.682 11.563 765 HD2 LYS 96 HD2 LYS 96 -6.050 -15.956 11.690 766 HD3 LYS 96 HD3 LYS 96 -6.920 -14.927 10.539 767 HE2 LYS 96 HE2 LYS 96 -8.005 -15.581 13.300 768 HE3 LYS 96 HE3 LYS 96 -6.955 -14.184 12.981 769 HZ1 LYS 96 HZ1 LYS 96 -8.592 -13.424 11.340 770 HZ2 LYS 96 HZ2 LYS 96 -9.269 -13.538 12.845 771 HZ3 LYS 96 HZ3 LYS 96 -9.583 -14.682 11.690 772 HA PRO 97 HA PRO 97 -5.599 -19.863 5.541 773 HB2 PRO 97 HB2 PRO 97 -5.120 -22.531 5.757 774 HB3 PRO 97 HB3 PRO 97 -3.946 -21.294 6.298 775 HG2 PRO 97 HG2 PRO 97 -6.004 -22.756 7.922 776 HG3 PRO 97 HG3 PRO 97 -4.237 -22.621 8.200 777 HD2 PRO 97 HD2 PRO 97 -5.967 -20.989 9.453 778 HD3 PRO 97 HD3 PRO 97 -4.393 -20.371 8.846 779 H LYS 98 H LYS 98 -8.403 -19.784 6.727 780 HA LYS 98 HA LYS 98 -9.583 -21.807 4.895 781 HB2 LYS 98 HB2 LYS 98 -9.955 -22.156 7.403 782 HB3 LYS 98 HB3 LYS 98 -10.981 -20.731 7.355 783 HG2 LYS 98 HG2 LYS 98 -12.522 -22.496 7.141 784 HG3 LYS 98 HG3 LYS 98 -12.286 -21.991 5.465 785 HD2 LYS 98 HD2 LYS 98 -12.205 -24.337 5.368 786 HD3 LYS 98 HD3 LYS 98 -10.494 -23.869 5.336 787 HE2 LYS 98 HE2 LYS 98 -10.316 -24.344 7.763 788 HE3 LYS 98 HE3 LYS 98 -12.045 -24.737 7.821 789 HZ1 LYS 98 HZ1 LYS 98 -11.616 -26.589 6.316 790 HZ2 LYS 98 HZ2 LYS 98 -10.697 -26.733 7.678 791 HZ3 LYS 98 HZ3 LYS 98 -10.004 -26.232 6.268 792 H ASP 99 H ASP 99 -11.931 -19.688 6.176 793 HA ASP 99 HA ASP 99 -12.565 -18.804 3.546 794 HB2 ASP 99 HB2 ASP 99 -14.185 -19.027 5.425 795 HB3 ASP 99 HB3 ASP 99 -13.445 -17.608 6.190 796 H GLU 100 H GLU 100 -10.996 -17.122 6.292 797 HA GLU 100 HA GLU 100 -10.809 -14.595 5.037 798 HB2 GLU 100 HB2 GLU 100 -9.014 -15.950 7.068 799 HB3 GLU 100 HB3 GLU 100 -8.881 -14.245 6.612 800 HG2 GLU 100 HG2 GLU 100 -11.143 -13.817 7.421 801 HG3 GLU 100 HG3 GLU 100 -11.368 -15.537 7.784 802 H LYS 101 H LYS 101 -8.687 -17.479 4.839 803 HA LYS 101 HA LYS 101 -6.614 -16.195 3.321 804 HB2 LYS 101 HB2 LYS 101 -6.224 -18.256 4.433 805 HB3 LYS 101 HB3 LYS 101 -7.535 -19.038 3.587 806 HG2 LYS 101 HG2 LYS 101 -5.884 -18.277 1.482 807 HG3 LYS 101 HG3 LYS 101 -4.723 -18.611 2.769 808 HD2 LYS 101 HD2 LYS 101 -5.075 -20.637 1.531 809 HD3 LYS 101 HD3 LYS 101 -5.838 -20.813 3.121 810 HE2 LYS 101 HE2 LYS 101 -7.949 -19.818 1.784 811 HE3 LYS 101 HE3 LYS 101 -7.098 -20.560 0.412 812 HZ1 LYS 101 HZ1 LYS 101 -8.663 -22.083 1.551 813 HZ2 LYS 101 HZ2 LYS 101 -7.759 -21.985 2.934 814 HZ3 LYS 101 HZ3 LYS 101 -7.116 -22.658 1.572 815 H LYS 102 H LYS 102 -9.711 -17.663 2.395 816 HA LYS 102 HA LYS 102 -9.101 -17.519 -0.456 817 HB2 LYS 102 HB2 LYS 102 -10.695 -19.169 0.310 818 HB3 LYS 102 HB3 LYS 102 -11.613 -17.967 1.199 819 HG2 LYS 102 HG2 LYS 102 -12.877 -18.652 -0.701 820 HG3 LYS 102 HG3 LYS 102 -12.402 -16.967 -0.919 821 HD2 LYS 102 HD2 LYS 102 -10.946 -17.462 -2.661 822 HD3 LYS 102 HD3 LYS 102 -10.689 -19.133 -2.120 823 HE2 LYS 102 HE2 LYS 102 -12.081 -18.982 -4.202 824 HE3 LYS 102 HE3 LYS 102 -12.895 -19.799 -2.858 825 HZ1 LYS 102 HZ1 LYS 102 -14.081 -17.699 -2.421 826 HZ2 LYS 102 HZ2 LYS 102 -14.400 -18.278 -3.933 827 HZ3 LYS 102 HZ3 LYS 102 -13.377 -17.001 -3.735 828 H SER 103 H SER 103 -11.154 -15.571 1.767 829 HA SER 103 HA SER 103 -11.962 -13.674 -0.162 830 HB2 SER 103 HB2 SER 103 -12.889 -13.906 2.139 831 HB3 SER 103 HB3 SER 103 -11.387 -13.232 2.801 832 HG SER 103 HG SER 103 -13.498 -11.922 2.006 833 H LEU 104 H LEU 104 -9.110 -13.584 2.051 834 HA LEU 104 HA LEU 104 -8.154 -11.082 1.064 835 HB2 LEU 104 HB2 LEU 104 -6.851 -13.404 2.472 836 HB3 LEU 104 HB3 LEU 104 -5.897 -12.035 1.920 837 HG LEU 104 HG LEU 104 -8.247 -11.747 3.818 838 HD11 LEU 104 HD11 LEU 104 -6.556 -11.572 5.608 839 HD12 LEU 104 HD12 LEU 104 -5.269 -11.960 4.437 840 HD13 LEU 104 HD13 LEU 104 -6.519 -13.170 4.835 841 HD21 LEU 104 HD21 LEU 104 -5.955 -9.892 3.030 842 HD22 LEU 104 HD22 LEU 104 -7.101 -9.574 4.344 843 HD23 LEU 104 HD23 LEU 104 -7.681 -9.665 2.670 844 H GLN 105 H GLN 105 -7.444 -14.477 -0.081 845 HA GLN 105 HA GLN 105 -5.370 -13.444 -1.829 846 HB2 GLN 105 HB2 GLN 105 -6.823 -16.079 -1.695 847 HB3 GLN 105 HB3 GLN 105 -5.771 -15.671 -3.058 848 HG2 GLN 105 HG2 GLN 105 -4.003 -15.066 -1.270 849 HG3 GLN 105 HG3 GLN 105 -5.007 -16.016 -0.166 850 HE21 GLN 105 HE21 GLN 105 -5.747 -18.185 -1.319 851 HE22 GLN 105 HE22 GLN 105 -4.426 -19.082 -2.035 852 H GLU 106 H GLU 106 -8.882 -13.864 -2.208 853 HA GLU 106 HA GLU 106 -8.828 -13.479 -5.070 854 HB2 GLU 106 HB2 GLU 106 -10.948 -13.068 -2.951 855 HB3 GLU 106 HB3 GLU 106 -11.236 -12.721 -4.667 856 HG2 GLU 106 HG2 GLU 106 -10.690 -15.011 -5.266 857 HG3 GLU 106 HG3 GLU 106 -10.305 -15.392 -3.585 858 H LEU 107 H LEU 107 -9.098 -11.231 -2.269 859 HA LEU 107 HA LEU 107 -9.273 -8.882 -3.938 860 HB2 LEU 107 HB2 LEU 107 -8.216 -9.232 -1.119 861 HB3 LEU 107 HB3 LEU 107 -8.448 -7.690 -1.927 862 HG LEU 107 HG LEU 107 -10.598 -9.606 -1.031 863 HD11 LEU 107 HD11 LEU 107 -9.759 -6.790 -0.290 864 HD12 LEU 107 HD12 LEU 107 -9.501 -8.260 0.676 865 HD13 LEU 107 HD13 LEU 107 -11.144 -7.663 0.379 866 HD21 LEU 107 HD21 LEU 107 -12.163 -7.759 -1.753 867 HD22 LEU 107 HD22 LEU 107 -11.428 -8.684 -3.071 868 HD23 LEU 107 HD23 LEU 107 -10.807 -7.059 -2.670 869 H THR 108 H THR 108 -6.544 -10.668 -2.504 870 HA THR 108 HA THR 108 -4.470 -8.884 -3.284 871 HB THR 108 HB THR 108 -4.329 -11.946 -3.131 872 HG1 THR 108 HG1 THR 108 -5.130 -10.986 -1.196 873 HG21 THR 108 HG21 THR 108 -2.206 -9.786 -2.858 874 HG22 THR 108 HG22 THR 108 -2.296 -11.064 -4.094 875 HG23 THR 108 HG23 THR 108 -1.971 -11.491 -2.399 876 H SER 109 H SER 109 -6.220 -11.436 -5.102 877 HA SER 109 HA SER 109 -4.481 -11.146 -7.413 878 HB2 SER 109 HB2 SER 109 -5.882 -13.178 -6.865 879 HB3 SER 109 HB3 SER 109 -7.320 -12.250 -7.337 880 HG SER 109 HG SER 109 -6.517 -12.109 -9.414 881 H LYS 110 H LYS 110 -7.746 -9.870 -6.520 882 HA LYS 110 HA LYS 110 -8.313 -8.516 -8.963 883 HB2 LYS 110 HB2 LYS 110 -9.011 -7.854 -6.081 884 HB3 LYS 110 HB3 LYS 110 -9.603 -6.921 -7.451 885 HG2 LYS 110 HG2 LYS 110 -10.945 -8.710 -8.248 886 HG3 LYS 110 HG3 LYS 110 -10.166 -9.873 -7.161 887 HD2 LYS 110 HD2 LYS 110 -12.333 -9.276 -6.203 888 HD3 LYS 110 HD3 LYS 110 -11.047 -8.604 -5.196 889 HE2 LYS 110 HE2 LYS 110 -11.372 -6.378 -6.376 890 HE3 LYS 110 HE3 LYS 110 -12.770 -7.078 -7.200 891 HZ1 LYS 110 HZ1 LYS 110 -13.791 -7.388 -4.998 892 HZ2 LYS 110 HZ2 LYS 110 -13.417 -5.801 -5.242 893 HZ3 LYS 110 HZ3 LYS 110 -12.481 -6.713 -4.253 894 H LEU 111 H LEU 111 -6.690 -7.329 -6.022 895 HA LEU 111 HA LEU 111 -6.391 -4.634 -6.825 896 HB2 LEU 111 HB2 LEU 111 -6.106 -5.711 -4.567 897 HB3 LEU 111 HB3 LEU 111 -4.551 -6.314 -5.077 898 HG LEU 111 HG LEU 111 -5.194 -3.362 -4.853 899 HD11 LEU 111 HD11 LEU 111 -4.071 -3.551 -2.628 900 HD12 LEU 111 HD12 LEU 111 -4.052 -5.317 -2.818 901 HD13 LEU 111 HD13 LEU 111 -5.600 -4.443 -2.715 902 HD21 LEU 111 HD21 LEU 111 -2.563 -4.872 -4.905 903 HD22 LEU 111 HD22 LEU 111 -2.751 -3.136 -4.567 904 HD23 LEU 111 HD23 LEU 111 -3.193 -3.774 -6.156 905 H PHE 112 H PHE 112 -4.220 -7.437 -7.231 906 HA PHE 112 HA PHE 112 -2.170 -5.872 -8.512 907 HB2 PHE 112 HB2 PHE 112 -2.686 -8.819 -8.183 908 HB3 PHE 112 HB3 PHE 112 -1.357 -8.219 -9.182 909 HD1 PHE 112 HD1 PHE 112 -2.739 -7.342 -5.751 910 HD2 PHE 112 HD2 PHE 112 0.706 -8.257 -8.157 911 HE1 PHE 112 HE1 PHE 112 -1.317 -7.113 -3.759 912 HE2 PHE 112 HE2 PHE 112 2.146 -8.017 -6.147 913 HZ PHE 112 HZ PHE 112 1.121 -7.443 -3.939 914 H SER 113 H SER 113 -5.067 -7.493 -9.688 915 HA SER 113 HA SER 113 -4.222 -7.606 -12.450 916 HB2 SER 113 HB2 SER 113 -7.027 -7.366 -11.287 917 HB3 SER 113 HB3 SER 113 -6.620 -7.839 -12.948 918 HG SER 113 HG SER 113 -5.885 -9.224 -10.561 919 H SER 114 H SER 114 -5.871 -5.151 -10.413 920 HA SER 114 HA SER 114 -6.228 -3.291 -12.601 921 HB2 SER 114 HB2 SER 114 -6.101 -2.834 -9.596 922 HB3 SER 114 HB3 SER 114 -6.606 -1.621 -10.793 923 HG SER 114 HG SER 114 -8.413 -2.760 -11.218 924 H ILE 115 H ILE 115 -3.596 -3.977 -10.316 925 HA ILE 115 HA ILE 115 -2.005 -1.655 -10.920 926 HB ILE 115 HB ILE 115 -1.471 -4.381 -9.736 927 HG12 ILE 115 HG12 ILE 115 -0.899 -1.560 -8.778 928 HG13 ILE 115 HG13 ILE 115 -2.362 -2.479 -8.413 929 HG21 ILE 115 HG21 ILE 115 1.001 -3.748 -9.484 930 HG22 ILE 115 HG22 ILE 115 0.501 -4.227 -11.108 931 HG23 ILE 115 HG23 ILE 115 0.716 -2.511 -10.723 932 HD11 ILE 115 HD11 ILE 115 -0.813 -4.242 -7.355 933 HD12 ILE 115 HD12 ILE 115 0.458 -2.995 -7.454 934 HD13 ILE 115 HD13 ILE 115 -1.006 -2.697 -6.505 935 H ASP 116 H ASP 116 -2.181 -4.938 -12.350 936 HA ASP 116 HA ASP 116 0.001 -4.553 -14.147 937 HB2 ASP 116 HB2 ASP 116 -1.447 -6.671 -13.430 938 HB3 ASP 116 HB3 ASP 116 -2.340 -6.280 -14.909 939 H ASN 117 H ASN 117 -3.484 -3.890 -14.392 940 HA ASN 117 HA ASN 117 -3.369 -3.038 -17.142 941 HB2 ASN 117 HB2 ASN 117 -5.371 -3.633 -15.407 942 HB3 ASN 117 HB3 ASN 117 -5.436 -1.865 -15.355 943 HD21 ASN 117 HD21 ASN 117 -7.414 -3.674 -16.400 944 HD22 ASN 117 HD22 ASN 117 -7.576 -3.312 -18.102 945 H LEU 118 H LEU 118 -2.862 -1.386 -14.036 946 HA LEU 118 HA LEU 118 -2.945 1.298 -15.036 947 HB2 LEU 118 HB2 LEU 118 -2.779 0.189 -12.611 948 HB3 LEU 118 HB3 LEU 118 -1.075 0.507 -12.828 949 HG LEU 118 HG LEU 118 -3.219 2.641 -12.989 950 HD11 LEU 118 HD11 LEU 118 -3.288 1.543 -10.804 951 HD12 LEU 118 HD12 LEU 118 -2.590 3.167 -10.654 952 HD13 LEU 118 HD13 LEU 118 -1.528 1.743 -10.624 953 HD21 LEU 118 HD21 LEU 118 -0.245 2.883 -12.469 954 HD22 LEU 118 HD22 LEU 118 -1.421 4.211 -12.549 955 HD23 LEU 118 HD23 LEU 118 -1.050 3.269 -14.005 956 H ASP 119 H ASP 119 -0.324 -1.121 -14.742 957 HA ASP 119 HA ASP 119 1.768 0.598 -15.744 958 HB2 ASP 119 HB2 ASP 119 2.493 -1.335 -14.601 959 HB3 ASP 119 HB3 ASP 119 1.408 -2.391 -15.527 960 H HIS 120 H HIS 120 -0.547 -1.639 -17.376 961 HA HIS 120 HA HIS 120 0.662 -1.130 -19.951 962 HB2 HIS 120 HB2 HIS 120 -1.941 -2.365 -19.108 963 HB3 HIS 120 HB3 HIS 120 -1.534 -2.084 -20.806 964 HD1 HIS 120 HD1 HIS 120 -0.577 -4.282 -17.871 965 HD2 HIS 120 HD2 HIS 120 0.539 -3.626 -21.844 966 HE1 HIS 120 HE1 HIS 120 0.924 -6.198 -18.544 967 H ALA 121 H ALA 121 -1.948 0.489 -18.158 968 HA ALA 121 HA ALA 121 -2.751 2.206 -20.316 969 HB1 ALA 121 HB1 ALA 121 -4.050 1.962 -18.257 970 HB2 ALA 121 HB2 ALA 121 -2.735 2.695 -17.315 971 HB3 ALA 121 HB3 ALA 121 -3.613 3.661 -18.525 972 H ALA 122 H ALA 122 -0.061 2.265 -17.998 973 HA ALA 122 HA ALA 122 0.812 4.928 -18.691 974 HB1 ALA 122 HB1 ALA 122 2.852 4.325 -17.529 975 HB2 ALA 122 HB2 ALA 122 1.452 3.715 -16.621 976 HB3 ALA 122 HB3 ALA 122 2.434 2.605 -17.600 977 H LYS 123 H LYS 123 1.652 1.632 -19.835 978 HA LYS 123 HA LYS 123 3.758 2.496 -21.574 979 HB2 LYS 123 HB2 LYS 123 1.857 0.116 -21.680 980 HB3 LYS 123 HB3 LYS 123 3.187 0.318 -22.818 981 HG2 LYS 123 HG2 LYS 123 4.828 0.027 -21.129 982 HG3 LYS 123 HG3 LYS 123 3.636 0.220 -19.826 983 HD2 LYS 123 HD2 LYS 123 2.501 -1.832 -20.511 984 HD3 LYS 123 HD3 LYS 123 3.628 -2.043 -21.861 985 HE2 LYS 123 HE2 LYS 123 5.424 -2.544 -20.429 986 HE3 LYS 123 HE3 LYS 123 4.612 -1.834 -19.015 987 HZ1 LYS 123 HZ1 LYS 123 3.192 -3.629 -18.839 988 HZ2 LYS 123 HZ2 LYS 123 4.619 -4.354 -19.213 989 HZ3 LYS 123 HZ3 LYS 123 3.455 -4.182 -20.375 990 H ILE 124 H ILE 124 0.231 2.295 -21.979 991 HA ILE 124 HA ILE 124 0.458 2.981 -24.828 992 HB ILE 124 HB ILE 124 -1.339 1.428 -23.653 993 HG12 ILE 124 HG12 ILE 124 -3.003 2.112 -25.486 994 HG13 ILE 124 HG13 ILE 124 -1.836 3.357 -25.935 995 HG21 ILE 124 HG21 ILE 124 -2.784 4.104 -23.555 996 HG22 ILE 124 HG22 ILE 124 -3.457 2.508 -23.164 997 HG23 ILE 124 HG23 ILE 124 -2.205 3.210 -22.138 998 HD11 ILE 124 HD11 ILE 124 -0.134 1.618 -26.398 999 HD12 ILE 124 HD12 ILE 124 -1.272 0.356 -25.868 1000 HD13 ILE 124 HD13 ILE 124 -1.617 1.311 -27.328 1001 H LYS 125 H LYS 125 0.804 4.646 -22.056 1002 HA LYS 125 HA LYS 125 1.087 6.829 -21.571 1003 HB2 LYS 125 HB2 LYS 125 0.720 7.361 -24.531 1004 HB3 LYS 125 HB3 LYS 125 1.452 8.446 -23.359 1005 HG2 LYS 125 HG2 LYS 125 3.444 7.370 -23.367 1006 HG3 LYS 125 HG3 LYS 125 2.731 5.764 -23.486 1007 HD2 LYS 125 HD2 LYS 125 2.815 7.706 -25.817 1008 HD3 LYS 125 HD3 LYS 125 4.100 6.527 -25.483 1009 HE2 LYS 125 HE2 LYS 125 2.443 4.683 -25.621 1010 HE3 LYS 125 HE3 LYS 125 1.173 5.858 -25.996 1011 HZ1 LYS 125 HZ1 LYS 125 2.366 6.433 -28.002 1012 HZ2 LYS 125 HZ2 LYS 125 2.023 4.821 -27.979 1013 HZ3 LYS 125 HZ3 LYS 125 3.556 5.340 -27.660 1014 H SER 126 H SER 126 -1.601 5.761 -21.416 1015 HA SER 126 HA SER 126 -3.253 8.192 -21.948 1016 HB2 SER 126 HB2 SER 126 -3.969 5.388 -21.019 1017 HB3 SER 126 HB3 SER 126 -5.130 6.717 -21.220 1018 HG SER 126 HG SER 126 -4.843 5.195 -23.032 1019 HA PRO 127 HA PRO 127 -2.062 8.643 -17.593 1020 HB2 PRO 127 HB2 PRO 127 -2.715 11.286 -17.213 1021 HB3 PRO 127 HB3 PRO 127 -1.186 10.755 -17.977 1022 HG2 PRO 127 HG2 PRO 127 -3.746 11.629 -19.298 1023 HG3 PRO 127 HG3 PRO 127 -2.068 12.172 -19.617 1024 HD2 PRO 127 HD2 PRO 127 -3.242 10.299 -21.156 1025 HD3 PRO 127 HD3 PRO 127 -1.505 10.170 -20.708 1026 H THR 128 H THR 128 -5.119 9.883 -19.016 1027 HA THR 128 HA THR 128 -6.530 9.970 -16.518 1028 HB THR 128 HB THR 128 -8.561 9.918 -18.080 1029 HG1 THR 128 HG1 THR 128 -8.002 10.130 -20.307 1030 HG21 THR 128 HG21 THR 128 -8.144 12.146 -18.960 1031 HG22 THR 128 HG22 THR 128 -6.386 11.926 -18.810 1032 HG23 THR 128 HG23 THR 128 -7.398 12.030 -17.350 1033 H GLU 129 H GLU 129 -5.783 7.385 -18.780 1034 HA GLU 129 HA GLU 129 -7.834 5.628 -17.657 1035 HB2 GLU 129 HB2 GLU 129 -6.925 5.560 -20.035 1036 HB3 GLU 129 HB3 GLU 129 -5.463 4.833 -19.344 1037 HG2 GLU 129 HG2 GLU 129 -6.888 3.057 -18.358 1038 HG3 GLU 129 HG3 GLU 129 -8.287 3.757 -19.177 1039 H ALA 130 H ALA 130 -4.355 6.273 -17.284 1040 HA ALA 130 HA ALA 130 -3.861 4.091 -15.477 1041 HB1 ALA 130 HB1 ALA 130 -2.037 5.304 -16.578 1042 HB2 ALA 130 HB2 ALA 130 -2.509 6.809 -15.753 1043 HB3 ALA 130 HB3 ALA 130 -1.885 5.437 -14.812 1044 H GLU 131 H GLU 131 -5.015 7.466 -15.073 1045 HA GLU 131 HA GLU 131 -5.178 7.404 -12.210 1046 HB2 GLU 131 HB2 GLU 131 -6.638 8.980 -14.334 1047 HB3 GLU 131 HB3 GLU 131 -6.950 9.205 -12.606 1048 HG2 GLU 131 HG2 GLU 131 -4.612 9.784 -12.220 1049 HG3 GLU 131 HG3 GLU 131 -4.246 9.508 -13.922 1050 H LYS 132 H LYS 132 -7.385 6.321 -14.779 1051 HA LYS 132 HA LYS 132 -9.670 5.811 -13.133 1052 HB2 LYS 132 HB2 LYS 132 -9.536 5.859 -15.661 1053 HB3 LYS 132 HB3 LYS 132 -8.756 4.284 -15.591 1054 HG2 LYS 132 HG2 LYS 132 -10.855 3.477 -14.352 1055 HG3 LYS 132 HG3 LYS 132 -11.606 4.977 -14.938 1056 HD2 LYS 132 HD2 LYS 132 -10.257 2.842 -16.664 1057 HD3 LYS 132 HD3 LYS 132 -12.007 3.052 -16.480 1058 HE2 LYS 132 HE2 LYS 132 -11.855 5.306 -17.512 1059 HE3 LYS 132 HE3 LYS 132 -10.097 5.117 -17.676 1060 HZ1 LYS 132 HZ1 LYS 132 -12.112 3.391 -18.997 1061 HZ2 LYS 132 HZ2 LYS 132 -10.475 3.235 -19.141 1062 HZ3 LYS 132 HZ3 LYS 132 -11.231 4.575 -19.735 1063 H TYR 133 H TYR 133 -6.893 3.714 -14.088 1064 HA TYR 133 HA TYR 133 -7.887 1.487 -12.497 1065 HB2 TYR 133 HB2 TYR 133 -5.154 2.027 -13.693 1066 HB3 TYR 133 HB3 TYR 133 -5.645 0.506 -12.933 1067 HD1 TYR 133 HD1 TYR 133 -8.299 -0.064 -13.962 1068 HD2 TYR 133 HD2 TYR 133 -4.969 1.723 -16.013 1069 HE1 TYR 133 HE1 TYR 133 -9.259 -0.773 -16.156 1070 HE2 TYR 133 HE2 TYR 133 -5.930 0.976 -18.194 1071 HH TYR 133 HH TYR 133 -7.693 0.054 -19.268 1072 H TYR 134 H TYR 134 -5.757 4.250 -11.886 1073 HA TYR 134 HA TYR 134 -4.726 3.344 -9.375 1074 HB2 TYR 134 HB2 TYR 134 -3.683 5.262 -10.141 1075 HB3 TYR 134 HB3 TYR 134 -5.185 5.985 -10.694 1076 HD1 TYR 134 HD1 TYR 134 -3.297 5.177 -7.557 1077 HD2 TYR 134 HD2 TYR 134 -6.338 7.595 -9.402 1078 HE1 TYR 134 HE1 TYR 134 -3.395 6.611 -5.519 1079 HE2 TYR 134 HE2 TYR 134 -6.453 9.006 -7.346 1080 HH TYR 134 HH TYR 134 -5.632 9.375 -5.243 1081 H GLY 135 H GLY 135 -7.771 5.090 -10.243 1082 HA2 GLY 135 HA2 GLY 135 -8.745 5.314 -7.588 1083 HA3 GLY 135 HA3 GLY 135 -9.750 5.216 -9.047 1084 H GLN 136 H GLN 136 -8.924 2.591 -9.891 1085 HA GLN 136 HA GLN 136 -10.648 0.975 -8.240 1086 HB2 GLN 136 HB2 GLN 136 -8.593 0.184 -10.334 1087 HB3 GLN 136 HB3 GLN 136 -9.752 -0.923 -9.598 1088 HG2 GLN 136 HG2 GLN 136 -11.608 0.285 -10.570 1089 HG3 GLN 136 HG3 GLN 136 -10.526 1.537 -11.186 1090 HE21 GLN 136 HE21 GLN 136 -11.493 1.036 -13.260 1091 HE22 GLN 136 HE22 GLN 136 -10.849 -0.302 -14.183 1092 H THR 137 H THR 137 -7.055 1.251 -8.524 1093 HA THR 137 HA THR 137 -6.607 -0.872 -6.632 1094 HB THR 137 HB THR 137 -4.299 0.039 -6.356 1095 HG1 THR 137 HG1 THR 137 -5.482 2.247 -7.501 1096 HG21 THR 137 HG21 THR 137 -4.745 -1.486 -8.208 1097 HG22 THR 137 HG22 THR 137 -3.576 -0.241 -8.694 1098 HG23 THR 137 HG23 THR 137 -5.260 -0.126 -9.233 1099 H VAL 138 H VAL 138 -7.121 2.657 -6.171 1100 HA VAL 138 HA VAL 138 -6.371 2.712 -3.412 1101 HB VAL 138 HB VAL 138 -8.515 4.325 -4.903 1102 HG11 VAL 138 HG11 VAL 138 -7.349 4.754 -2.114 1103 HG12 VAL 138 HG12 VAL 138 -8.312 5.961 -3.001 1104 HG13 VAL 138 HG13 VAL 138 -9.048 4.420 -2.525 1105 HG21 VAL 138 HG21 VAL 138 -5.767 5.247 -4.001 1106 HG22 VAL 138 HG22 VAL 138 -6.066 4.578 -5.606 1107 HG23 VAL 138 HG23 VAL 138 -6.891 6.059 -5.105 1108 H SER 139 H SER 139 -9.513 2.019 -5.007 1109 HA SER 139 HA SER 139 -10.967 1.576 -2.593 1110 HB2 SER 139 HB2 SER 139 -12.023 1.860 -4.823 1111 HB3 SER 139 HB3 SER 139 -11.360 0.294 -5.332 1112 HG SER 139 HG SER 139 -12.617 -0.710 -3.743 1113 H ASN 140 H ASN 140 -9.179 -0.688 -4.733 1114 HA ASN 140 HA ASN 140 -9.872 -3.004 -3.218 1115 HB2 ASN 140 HB2 ASN 140 -8.611 -2.482 -5.585 1116 HB3 ASN 140 HB3 ASN 140 -7.273 -3.051 -4.591 1117 HD21 ASN 140 HD21 ASN 140 -9.461 -3.975 -6.742 1118 HD22 ASN 140 HD22 ASN 140 -9.668 -5.640 -6.269 1119 H ILE 141 H ILE 141 -7.122 -0.739 -2.915 1120 HA ILE 141 HA ILE 141 -5.667 -2.348 -1.019 1121 HB ILE 141 HB ILE 141 -5.660 0.651 -1.624 1122 HG12 ILE 141 HG12 ILE 141 -3.409 -1.345 -1.977 1123 HG13 ILE 141 HG13 ILE 141 -4.696 -1.236 -3.174 1124 HG21 ILE 141 HG21 ILE 141 -4.100 -0.879 0.494 1125 HG22 ILE 141 HG22 ILE 141 -3.469 0.624 -0.217 1126 HG23 ILE 141 HG23 ILE 141 -5.010 0.635 0.669 1127 HD11 ILE 141 HD11 ILE 141 -2.816 0.078 -3.906 1128 HD12 ILE 141 HD12 ILE 141 -4.165 1.163 -3.519 1129 HD13 ILE 141 HD13 ILE 141 -2.803 0.995 -2.388 1130 H ASN 142 H ASN 142 -8.276 0.093 -0.736 1131 HA ASN 142 HA ASN 142 -8.326 0.052 2.142 1132 HB2 ASN 142 HB2 ASN 142 -9.406 1.770 0.652 1133 HB3 ASN 142 HB3 ASN 142 -10.641 0.573 0.246 1134 HD21 ASN 142 HD21 ASN 142 -9.526 2.855 2.553 1135 HD22 ASN 142 HD22 ASN 142 -10.812 2.624 3.711 1136 H GLU 143 H GLU 143 -10.011 -1.915 -0.351 1137 HA GLU 143 HA GLU 143 -11.670 -3.338 1.462 1138 HB2 GLU 143 HB2 GLU 143 -10.420 -4.227 -1.167 1139 HB3 GLU 143 HB3 GLU 143 -11.616 -5.174 -0.297 1140 HG2 GLU 143 HG2 GLU 143 -13.311 -3.495 -0.662 1141 HG3 GLU 143 HG3 GLU 143 -12.130 -2.414 -1.407 1142 H VAL 144 H VAL 144 -8.342 -3.941 0.416 1143 HA VAL 144 HA VAL 144 -8.131 -6.466 1.838 1144 HB VAL 144 HB VAL 144 -6.024 -4.493 0.796 1145 HG11 VAL 144 HG11 VAL 144 -5.639 -7.258 2.021 1146 HG12 VAL 144 HG12 VAL 144 -4.397 -6.384 1.090 1147 HG13 VAL 144 HG13 VAL 144 -4.992 -5.712 2.615 1148 HG21 VAL 144 HG21 VAL 144 -5.665 -6.167 -0.957 1149 HG22 VAL 144 HG22 VAL 144 -6.880 -7.233 -0.221 1150 HG23 VAL 144 HG23 VAL 144 -7.369 -5.681 -0.936 1151 H LEU 145 H LEU 145 -7.606 -3.031 2.598 1152 HA LEU 145 HA LEU 145 -5.985 -3.505 4.903 1153 HB2 LEU 145 HB2 LEU 145 -6.934 -1.281 3.503 1154 HB3 LEU 145 HB3 LEU 145 -7.586 -1.081 5.122 1155 HG LEU 145 HG LEU 145 -4.652 -1.635 4.562 1156 HD11 LEU 145 HD11 LEU 145 -5.330 0.458 3.460 1157 HD12 LEU 145 HD12 LEU 145 -4.276 0.774 4.853 1158 HD13 LEU 145 HD13 LEU 145 -6.030 1.044 4.989 1159 HD21 LEU 145 HD21 LEU 145 -6.150 -0.595 7.004 1160 HD22 LEU 145 HD22 LEU 145 -4.382 -0.628 6.843 1161 HD23 LEU 145 HD23 LEU 145 -5.296 -2.149 6.854 1162 H ALA 146 H ALA 146 -9.513 -3.047 4.596 1163 HA ALA 146 HA ALA 146 -9.942 -3.102 7.443 1164 HB1 ALA 146 HB1 ALA 146 -12.323 -3.423 6.829 1165 HB2 ALA 146 HB2 ALA 146 -11.575 -2.151 5.833 1166 HB3 ALA 146 HB3 ALA 146 -11.849 -3.772 5.148 1167 H LYS 147 H LYS 147 -8.997 -5.591 5.344 1168 HA LYS 147 HA LYS 147 -10.147 -7.685 7.117 1169 HB2 LYS 147 HB2 LYS 147 -8.847 -7.839 4.409 1170 HB3 LYS 147 HB3 LYS 147 -9.374 -9.241 5.359 1171 HG2 LYS 147 HG2 LYS 147 -11.667 -8.440 5.334 1172 HG3 LYS 147 HG3 LYS 147 -11.159 -6.981 4.462 1173 HD2 LYS 147 HD2 LYS 147 -10.331 -8.392 2.636 1174 HD3 LYS 147 HD3 LYS 147 -10.935 -9.829 3.477 1175 HE2 LYS 147 HE2 LYS 147 -12.511 -9.067 1.763 1176 HE3 LYS 147 HE3 LYS 147 -13.208 -8.934 3.400 1177 HZ1 LYS 147 HZ1 LYS 147 -12.889 -6.602 3.371 1178 HZ2 LYS 147 HZ2 LYS 147 -13.554 -6.952 1.901 1179 HZ3 LYS 147 HZ3 LYS 147 -11.935 -6.630 2.032 1180 H LEU 148 H LEU 148 -7.301 -5.888 6.502 1181 HA LEU 148 HA LEU 148 -5.439 -7.943 7.502 1182 HB2 LEU 148 HB2 LEU 148 -5.147 -4.975 6.906 1183 HB3 LEU 148 HB3 LEU 148 -3.855 -5.961 7.558 1184 HG LEU 148 HG LEU 148 -5.101 -6.361 4.836 1185 HD11 LEU 148 HD11 LEU 148 -2.488 -5.073 5.706 1186 HD12 LEU 148 HD12 LEU 148 -3.888 -4.239 4.998 1187 HD13 LEU 148 HD13 LEU 148 -2.964 -5.396 4.021 1188 HD21 LEU 148 HD21 LEU 148 -3.117 -7.787 4.445 1189 HD22 LEU 148 HD22 LEU 148 -4.206 -8.438 5.678 1190 HD23 LEU 148 HD23 LEU 148 -2.697 -7.630 6.164 1191 H GLY 149 H GLY 149 -7.248 -5.109 8.652 1192 HA2 GLY 149 HA2 GLY 149 -7.572 -4.444 10.897 1193 HA3 GLY 149 HA3 GLY 149 -6.428 -5.707 11.436 Start of MODEL 19 1 H1 GLU 1 H1 GLU 1 24.161 7.903 1.057 2 H2 GLU 1 H2 GLU 1 23.961 6.686 2.151 3 H3 GLU 1 H3 GLU 1 25.379 7.529 2.106 4 HA GLU 1 HA GLU 1 25.863 6.685 -0.099 5 HB2 GLU 1 HB2 GLU 1 26.624 5.578 2.019 6 HB3 GLU 1 HB3 GLU 1 25.220 4.516 1.924 7 HG2 GLU 1 HG2 GLU 1 26.701 4.496 -0.571 8 HG3 GLU 1 HG3 GLU 1 27.760 4.121 0.800 9 H ALA 2 H ALA 2 25.166 5.636 -1.944 10 HA ALA 2 HA ALA 2 23.638 5.063 -3.514 11 HB1 ALA 2 HB1 ALA 2 22.857 3.066 -1.363 12 HB2 ALA 2 HB2 ALA 2 22.509 2.918 -3.105 13 HB3 ALA 2 HB3 ALA 2 24.188 2.902 -2.528 14 H ARG 3 H ARG 3 22.611 7.335 -2.204 15 HA ARG 3 HA ARG 3 19.839 7.049 -3.028 16 HB2 ARG 3 HB2 ARG 3 18.810 7.863 -0.963 17 HB3 ARG 3 HB3 ARG 3 19.574 6.296 -0.757 18 HG2 ARG 3 HG2 ARG 3 21.595 7.677 0.210 19 HG3 ARG 3 HG3 ARG 3 20.379 8.952 0.402 20 HD2 ARG 3 HD2 ARG 3 20.396 7.776 2.464 21 HD3 ARG 3 HD3 ARG 3 18.948 7.210 1.612 22 HE ARG 3 HE ARG 3 21.210 5.520 1.020 23 HH11 ARG 3 HH11 ARG 3 18.857 6.133 3.594 24 HH12 ARG 3 HH12 ARG 3 19.023 4.517 4.254 25 HH21 ARG 3 HH21 ARG 3 21.357 3.494 1.916 26 HH22 ARG 3 HH22 ARG 3 20.398 3.068 3.314 27 HA PRO 4 HA PRO 4 21.476 11.111 -3.970 28 HB2 PRO 4 HB2 PRO 4 19.624 11.940 -5.796 29 HB3 PRO 4 HB3 PRO 4 20.897 10.746 -6.212 30 HG2 PRO 4 HG2 PRO 4 18.037 10.252 -5.391 31 HG3 PRO 4 HG3 PRO 4 18.930 9.602 -6.804 32 HD2 PRO 4 HD2 PRO 4 18.647 8.176 -4.529 33 HD3 PRO 4 HD3 PRO 4 20.163 8.114 -5.484 34 H ILE 5 H ILE 5 20.985 13.156 -3.148 35 HA ILE 5 HA ILE 5 18.250 13.621 -2.047 36 HB ILE 5 HB ILE 5 20.906 14.168 -0.602 37 HG12 ILE 5 HG12 ILE 5 20.230 11.785 -0.477 38 HG13 ILE 5 HG13 ILE 5 20.228 12.585 1.087 39 HG21 ILE 5 HG21 ILE 5 18.032 14.877 0.170 40 HG22 ILE 5 HG22 ILE 5 19.398 14.921 1.309 41 HG23 ILE 5 HG23 ILE 5 19.392 15.988 -0.107 42 HD11 ILE 5 HD11 ILE 5 17.689 12.037 -0.539 43 HD12 ILE 5 HD12 ILE 5 18.292 11.017 0.781 44 HD13 ILE 5 HD13 ILE 5 17.772 12.679 1.118 45 H VAL 6 H VAL 6 17.552 15.652 -2.636 46 HA VAL 6 HA VAL 6 19.344 17.254 -4.322 47 HB VAL 6 HB VAL 6 16.898 16.854 -4.889 48 HG11 VAL 6 HG11 VAL 6 16.333 18.810 -2.612 49 HG12 VAL 6 HG12 VAL 6 15.147 18.128 -3.747 50 HG13 VAL 6 HG13 VAL 6 15.969 17.070 -2.583 51 HG21 VAL 6 HG21 VAL 6 17.595 19.801 -4.553 52 HG22 VAL 6 HG22 VAL 6 18.202 18.750 -5.860 53 HG23 VAL 6 HG23 VAL 6 16.466 19.090 -5.723 54 H VAL 7 H VAL 7 19.966 19.438 -3.818 55 HA VAL 7 HA VAL 7 20.317 19.893 -0.955 56 HB VAL 7 HB VAL 7 22.149 20.481 -2.513 57 HG11 VAL 7 HG11 VAL 7 21.994 22.380 -4.065 58 HG12 VAL 7 HG12 VAL 7 20.818 21.128 -4.500 59 HG13 VAL 7 HG13 VAL 7 20.279 22.600 -3.663 60 HG21 VAL 7 HG21 VAL 7 22.668 22.706 -1.654 61 HG22 VAL 7 HG22 VAL 7 20.964 22.972 -1.219 62 HG23 VAL 7 HG23 VAL 7 21.917 21.722 -0.380 63 H GLY 8 H GLY 8 19.072 21.164 0.316 64 HA2 GLY 8 HA2 GLY 8 17.479 22.794 0.851 65 HA3 GLY 8 HA3 GLY 8 17.187 23.080 -0.872 66 HA PRO 9 HA PRO 9 13.976 20.237 0.988 67 HB2 PRO 9 HB2 PRO 9 11.757 21.809 1.081 68 HB3 PRO 9 HB3 PRO 9 12.996 21.856 2.378 69 HG2 PRO 9 HG2 PRO 9 12.673 23.681 0.002 70 HG3 PRO 9 HG3 PRO 9 12.861 24.110 1.733 71 HD2 PRO 9 HD2 PRO 9 14.961 24.099 -0.003 72 HD3 PRO 9 HD3 PRO 9 15.149 23.625 1.722 73 HA PRO 10 HA PRO 10 12.369 19.619 -3.116 74 HB2 PRO 10 HB2 PRO 10 10.250 17.947 -2.718 75 HB3 PRO 10 HB3 PRO 10 11.940 17.394 -2.482 76 HG2 PRO 10 HG2 PRO 10 9.969 18.377 -0.430 77 HG3 PRO 10 HG3 PRO 10 10.948 16.875 -0.420 78 HD2 PRO 10 HD2 PRO 10 11.728 19.100 0.914 79 HD3 PRO 10 HD3 PRO 10 12.921 18.031 0.097 80 HA PRO 11 HA PRO 11 9.152 22.614 -3.312 81 HB2 PRO 11 HB2 PRO 11 7.731 22.024 -5.584 82 HB3 PRO 11 HB3 PRO 11 9.387 22.714 -5.627 83 HG2 PRO 11 HG2 PRO 11 8.545 19.826 -5.852 84 HG3 PRO 11 HG3 PRO 11 9.635 20.765 -6.921 85 HD2 PRO 11 HD2 PRO 11 10.603 19.159 -4.989 86 HD3 PRO 11 HD3 PRO 11 11.375 20.747 -5.344 87 HA PRO 12 HA PRO 12 5.966 20.423 -1.267 88 HB2 PRO 12 HB2 PRO 12 4.002 22.302 -0.929 89 HB3 PRO 12 HB3 PRO 12 5.552 22.348 -0.026 90 HG2 PRO 12 HG2 PRO 12 4.792 23.821 -2.546 91 HG3 PRO 12 HG3 PRO 12 5.500 24.471 -1.030 92 HD2 PRO 12 HD2 PRO 12 7.045 23.897 -3.164 93 HD3 PRO 12 HD3 PRO 12 7.615 23.557 -1.492 94 H LEU 13 H LEU 13 4.313 19.128 -1.771 95 HA LEU 13 HA LEU 13 2.769 18.009 -3.020 96 HB2 LEU 13 HB2 LEU 13 1.819 20.795 -3.750 97 HB3 LEU 13 HB3 LEU 13 0.876 19.313 -3.849 98 HG LEU 13 HG LEU 13 1.903 20.518 -1.257 99 HD11 LEU 13 HD11 LEU 13 -0.428 21.232 -0.916 100 HD12 LEU 13 HD12 LEU 13 -0.861 20.612 -2.527 101 HD13 LEU 13 HD13 LEU 13 0.266 21.980 -2.372 102 HD21 LEU 13 HD21 LEU 13 1.527 18.096 -1.073 103 HD22 LEU 13 HD22 LEU 13 -0.083 18.269 -1.808 104 HD23 LEU 13 HD23 LEU 13 0.252 18.976 -0.211 105 H SER 14 H SER 14 5.306 18.684 -4.461 106 HA SER 14 HA SER 14 4.216 18.405 -7.218 107 HB2 SER 14 HB2 SER 14 6.446 20.297 -6.389 108 HB3 SER 14 HB3 SER 14 5.878 20.018 -8.046 109 HG SER 14 HG SER 14 4.343 21.075 -5.883 110 H GLY 15 H GLY 15 5.454 17.245 -8.648 111 HA2 GLY 15 HA2 GLY 15 7.316 16.121 -9.451 112 HA3 GLY 15 HA3 GLY 15 8.199 16.536 -7.982 113 H GLY 16 H GLY 16 7.181 15.333 -5.933 114 HA2 GLY 16 HA2 GLY 16 6.835 13.276 -4.914 115 HA3 GLY 16 HA3 GLY 16 6.214 12.658 -6.452 116 H LEU 17 H LEU 17 7.536 10.813 -5.207 117 HA LEU 17 HA LEU 17 9.960 10.396 -6.796 118 HB2 LEU 17 HB2 LEU 17 11.444 10.086 -4.900 119 HB3 LEU 17 HB3 LEU 17 10.833 11.715 -4.903 120 HG LEU 17 HG LEU 17 9.184 10.049 -3.190 121 HD11 LEU 17 HD11 LEU 17 12.188 10.117 -2.653 122 HD12 LEU 17 HD12 LEU 17 11.189 8.669 -2.948 123 HD13 LEU 17 HD13 LEU 17 10.951 9.629 -1.475 124 HD21 LEU 17 HD21 LEU 17 9.305 12.512 -3.139 125 HD22 LEU 17 HD22 LEU 17 11.032 12.436 -2.706 126 HD23 LEU 17 HD23 LEU 17 9.794 11.837 -1.581 127 HA PRO 18 HA PRO 18 8.254 6.454 -6.483 128 HB2 PRO 18 HB2 PRO 18 10.100 4.582 -5.677 129 HB3 PRO 18 HB3 PRO 18 10.157 5.377 -7.276 130 HG2 PRO 18 HG2 PRO 18 11.609 6.129 -4.763 131 HG3 PRO 18 HG3 PRO 18 12.268 5.827 -6.402 132 HD2 PRO 18 HD2 PRO 18 11.795 8.305 -5.617 133 HD3 PRO 18 HD3 PRO 18 11.313 7.801 -7.272 134 H GLY 19 H GLY 19 6.990 5.131 -5.256 135 HA2 GLY 19 HA2 GLY 19 6.082 4.174 -3.343 136 HA3 GLY 19 HA3 GLY 19 7.538 4.633 -2.441 137 H THR 20 H THR 20 5.966 5.127 -0.723 138 HA THR 20 HA THR 20 4.665 7.802 -1.140 139 HB THR 20 HB THR 20 3.137 5.967 -0.367 140 HG1 THR 20 HG1 THR 20 3.677 8.237 1.231 141 HG21 THR 20 HG21 THR 20 3.259 4.992 1.778 142 HG22 THR 20 HG22 THR 20 4.524 6.109 2.322 143 HG23 THR 20 HG23 THR 20 4.904 4.845 1.141 144 H GLU 21 H GLU 21 7.399 7.429 -1.028 145 HA GLU 21 HA GLU 21 9.326 7.954 0.011 146 HB2 GLU 21 HB2 GLU 21 9.385 10.286 0.934 147 HB3 GLU 21 HB3 GLU 21 8.838 10.056 -0.705 148 HG2 GLU 21 HG2 GLU 21 6.821 10.391 1.508 149 HG3 GLU 21 HG3 GLU 21 7.650 11.781 0.807 150 H ASN 22 H ASN 22 7.624 6.301 1.805 151 HA ASN 22 HA ASN 22 8.550 7.137 4.477 152 HB2 ASN 22 HB2 ASN 22 6.308 6.059 4.022 153 HB3 ASN 22 HB3 ASN 22 7.169 4.574 3.597 154 HD21 ASN 22 HD21 ASN 22 6.539 3.262 5.192 155 HD22 ASN 22 HD22 ASN 22 6.845 3.555 6.887 156 H SER 23 H SER 23 10.512 6.548 2.342 157 HA SER 23 HA SER 23 11.795 4.048 3.382 158 HB2 SER 23 HB2 SER 23 11.266 4.076 0.955 159 HB3 SER 23 HB3 SER 23 12.223 5.561 0.773 160 HG SER 23 HG SER 23 13.710 4.093 0.332 161 H ASP 24 H ASP 24 13.825 4.169 4.312 162 HA ASP 24 HA ASP 24 14.939 6.813 4.868 163 HB2 ASP 24 HB2 ASP 24 16.717 5.651 6.002 164 HB3 ASP 24 HB3 ASP 24 15.205 4.839 6.429 165 H GLN 25 H GLN 25 15.191 4.344 2.457 166 HA GLN 25 HA GLN 25 17.544 5.688 1.234 167 HB2 GLN 25 HB2 GLN 25 17.689 3.244 1.716 168 HB3 GLN 25 HB3 GLN 25 16.348 2.966 0.599 169 HG2 GLN 25 HG2 GLN 25 17.651 3.702 -1.276 170 HG3 GLN 25 HG3 GLN 25 18.903 4.364 -0.223 171 HE21 GLN 25 HE21 GLN 25 20.302 3.088 -1.641 172 HE22 GLN 25 HE22 GLN 25 20.582 1.412 -1.190 173 H ALA 26 H ALA 26 16.428 7.463 0.396 174 HA ALA 26 HA ALA 26 14.178 7.098 -1.420 175 HB1 ALA 26 HB1 ALA 26 14.569 9.505 -1.931 176 HB2 ALA 26 HB2 ALA 26 14.496 9.222 -0.177 177 HB3 ALA 26 HB3 ALA 26 16.070 9.467 -0.979 178 H ARG 27 H ARG 27 14.824 5.597 -2.994 179 HA ARG 27 HA ARG 27 16.678 6.600 -5.056 180 HB2 ARG 27 HB2 ARG 27 18.025 5.344 -3.235 181 HB3 ARG 27 HB3 ARG 27 17.147 3.902 -3.736 182 HG2 ARG 27 HG2 ARG 27 18.111 4.718 -6.148 183 HG3 ARG 27 HG3 ARG 27 19.365 5.367 -5.072 184 HD2 ARG 27 HD2 ARG 27 20.064 3.156 -5.643 185 HD3 ARG 27 HD3 ARG 27 19.423 3.051 -3.988 186 HE ARG 27 HE ARG 27 17.500 2.543 -6.173 187 HH11 ARG 27 HH11 ARG 27 19.654 1.015 -3.804 188 HH12 ARG 27 HH12 ARG 27 18.803 -0.505 -3.909 189 HH21 ARG 27 HH21 ARG 27 16.514 0.638 -6.232 190 HH22 ARG 27 HH22 ARG 27 17.040 -0.722 -5.258 191 H ASP 28 H ASP 28 16.069 5.762 -7.064 192 HA ASP 28 HA ASP 28 13.562 4.330 -7.212 193 HB2 ASP 28 HB2 ASP 28 15.640 4.998 -9.326 194 HB3 ASP 28 HB3 ASP 28 14.007 4.396 -9.655 195 H GLY 29 H GLY 29 13.222 2.283 -8.346 196 HA2 GLY 29 HA2 GLY 29 14.066 0.298 -9.364 197 HA3 GLY 29 HA3 GLY 29 15.634 0.578 -8.614 198 H THR 30 H THR 30 15.595 -1.662 -8.029 199 HA THR 30 HA THR 30 13.540 -2.855 -6.492 200 HB THR 30 HB THR 30 15.778 -4.302 -5.849 201 HG1 THR 30 HG1 THR 30 17.203 -4.081 -7.604 202 HG21 THR 30 HG21 THR 30 13.852 -5.166 -7.101 203 HG22 THR 30 HG22 THR 30 15.368 -5.585 -7.921 204 HG23 THR 30 HG23 THR 30 14.366 -4.256 -8.544 205 H LEU 31 H LEU 31 12.888 -1.885 -4.626 206 HA LEU 31 HA LEU 31 14.860 -2.048 -2.403 207 HB2 LEU 31 HB2 LEU 31 12.783 0.103 -2.905 208 HB3 LEU 31 HB3 LEU 31 13.501 -0.191 -1.327 209 HG LEU 31 HG LEU 31 15.017 0.711 -3.793 210 HD11 LEU 31 HD11 LEU 31 14.132 2.164 -1.273 211 HD12 LEU 31 HD12 LEU 31 13.493 2.403 -2.919 212 HD13 LEU 31 HD13 LEU 31 15.169 2.841 -2.550 213 HD21 LEU 31 HD21 LEU 31 16.861 1.145 -2.167 214 HD22 LEU 31 HD22 LEU 31 16.482 -0.580 -2.308 215 HD23 LEU 31 HD23 LEU 31 15.914 0.343 -0.899 216 HA PRO 32 HA PRO 32 11.307 -4.459 -1.004 217 HB2 PRO 32 HB2 PRO 32 12.372 -5.554 1.226 218 HB3 PRO 32 HB3 PRO 32 13.012 -6.003 -0.383 219 HG2 PRO 32 HG2 PRO 32 14.064 -3.972 1.572 220 HG3 PRO 32 HG3 PRO 32 14.940 -5.300 0.749 221 HD2 PRO 32 HD2 PRO 32 14.918 -2.704 -0.156 222 HD3 PRO 32 HD3 PRO 32 15.074 -4.124 -1.247 223 H TYR 33 H TYR 33 10.761 -4.649 1.819 224 HA TYR 33 HA TYR 33 9.754 -2.054 2.539 225 HB2 TYR 33 HB2 TYR 33 9.106 -4.427 3.415 226 HB3 TYR 33 HB3 TYR 33 10.516 -4.288 4.465 227 HD1 TYR 33 HD2 TYR 33 10.505 -1.771 5.737 228 HD2 TYR 33 HD1 TYR 33 7.049 -4.015 4.467 229 HE1 TYR 33 HE2 TYR 33 9.116 -0.581 7.407 230 HE2 TYR 33 HE1 TYR 33 5.681 -2.801 6.154 231 HH TYR 33 HH TYR 33 7.061 -0.356 8.347 232 H THR 34 H THR 34 10.913 -0.347 3.380 233 HA THR 34 HA THR 34 13.731 -0.807 4.311 234 HB THR 34 HB THR 34 14.118 1.554 3.353 235 HG1 THR 34 HG1 THR 34 12.637 2.233 1.804 236 HG21 THR 34 HG21 THR 34 14.502 0.802 1.077 237 HG22 THR 34 HG22 THR 34 13.439 -0.594 1.330 238 HG23 THR 34 HG23 THR 34 14.971 -0.475 2.219 239 H LYS 35 H LYS 35 14.326 1.601 5.289 240 HA LYS 35 HA LYS 35 14.062 3.074 7.001 241 HB2 LYS 35 HB2 LYS 35 12.026 3.728 5.695 242 HB3 LYS 35 HB3 LYS 35 11.076 2.661 6.718 243 HG2 LYS 35 HG2 LYS 35 12.519 4.406 8.442 244 HG3 LYS 35 HG3 LYS 35 11.784 5.375 7.147 245 HD2 LYS 35 HD2 LYS 35 9.613 4.172 7.558 246 HD3 LYS 35 HD3 LYS 35 10.377 3.349 8.931 247 HE2 LYS 35 HE2 LYS 35 9.182 5.162 9.861 248 HE3 LYS 35 HE3 LYS 35 10.885 5.665 9.871 249 HZ1 LYS 35 HZ1 LYS 35 10.457 6.922 7.851 250 HZ2 LYS 35 HZ2 LYS 35 9.401 7.400 9.023 251 HZ3 LYS 35 HZ3 LYS 35 8.888 6.414 7.800 252 H ASP 36 H ASP 36 14.165 3.046 9.194 253 HA ASP 36 HA ASP 36 14.384 2.073 11.250 254 HB2 ASP 36 HB2 ASP 36 11.539 1.239 10.637 255 HB3 ASP 36 HB3 ASP 36 12.277 1.260 12.243 256 H ARG 37 H ARG 37 15.528 0.526 9.275 257 HA ARG 37 HA ARG 37 14.712 -2.096 8.999 258 HB2 ARG 37 HB2 ARG 37 16.504 -0.795 7.774 259 HB3 ARG 37 HB3 ARG 37 17.611 -1.229 9.082 260 HG2 ARG 37 HG2 ARG 37 17.371 -3.594 8.558 261 HG3 ARG 37 HG3 ARG 37 16.107 -3.238 7.364 262 HD2 ARG 37 HD2 ARG 37 17.731 -1.945 6.033 263 HD3 ARG 37 HD3 ARG 37 18.996 -2.313 7.225 264 HE ARG 37 HE ARG 37 17.867 -4.763 6.382 265 HH11 ARG 37 HH11 ARG 37 19.792 -2.168 4.957 266 HH12 ARG 37 HH12 ARG 37 20.559 -3.238 3.815 267 HH21 ARG 37 HH21 ARG 37 18.883 -6.065 4.894 268 HH22 ARG 37 HH22 ARG 37 20.053 -5.405 3.784 269 H PHE 38 H PHE 38 16.217 -0.832 11.870 270 HA PHE 38 HA PHE 38 17.311 -3.289 12.853 271 HB2 PHE 38 HB2 PHE 38 16.148 -0.990 14.457 272 HB3 PHE 38 HB3 PHE 38 17.354 -2.165 14.996 273 HD1 PHE 38 HD1 PHE 38 19.614 -2.201 13.649 274 HD2 PHE 38 HD2 PHE 38 16.812 1.066 13.576 275 HE1 PHE 38 HE1 PHE 38 21.418 -0.680 12.847 276 HE2 PHE 38 HE2 PHE 38 18.606 2.595 12.769 277 HZ PHE 38 HZ PHE 38 20.915 1.723 12.401 278 H TYR 39 H TYR 39 14.045 -2.045 12.640 279 HA TYR 39 HA TYR 39 13.083 -4.156 14.525 280 HB2 TYR 39 HB2 TYR 39 11.639 -1.658 13.616 281 HB3 TYR 39 HB3 TYR 39 11.249 -2.704 14.995 282 HD1 TYR 39 HD2 TYR 39 13.233 -2.932 16.806 283 HD2 TYR 39 HD1 TYR 39 12.878 0.303 13.992 284 HE1 TYR 39 HE2 TYR 39 14.727 -1.523 18.225 285 HE2 TYR 39 HE1 TYR 39 14.373 1.705 15.419 286 HH TYR 39 HH TYR 39 15.758 0.499 18.477 287 H LEU 40 H LEU 40 13.626 -3.927 11.406 288 HA LEU 40 HA LEU 40 11.035 -4.590 10.255 289 HB2 LEU 40 HB2 LEU 40 13.730 -4.023 9.339 290 HB3 LEU 40 HB3 LEU 40 13.080 -5.427 8.510 291 HG LEU 40 HG LEU 40 11.143 -4.141 7.757 292 HD11 LEU 40 HD11 LEU 40 12.409 -1.853 9.320 293 HD12 LEU 40 HD12 LEU 40 10.797 -2.561 9.555 294 HD13 LEU 40 HD13 LEU 40 11.156 -1.634 8.091 295 HD21 LEU 40 HD21 LEU 40 12.344 -2.620 6.236 296 HD22 LEU 40 HD22 LEU 40 13.194 -4.165 6.395 297 HD23 LEU 40 HD23 LEU 40 13.785 -2.720 7.250 298 H GLN 41 H GLN 41 12.849 -6.256 12.308 299 HA GLN 41 HA GLN 41 13.364 -8.802 11.295 300 HB2 GLN 41 HB2 GLN 41 12.355 -7.963 14.041 301 HB3 GLN 41 HB3 GLN 41 13.114 -9.516 13.673 302 HG2 GLN 41 HG2 GLN 41 15.184 -8.306 12.975 303 HG3 GLN 41 HG3 GLN 41 14.426 -6.778 13.448 304 HE21 GLN 41 HE21 GLN 41 15.222 -6.066 15.301 305 HE22 GLN 41 HE22 GLN 41 15.596 -7.071 16.686 306 HA PRO 42 HA PRO 42 9.517 -10.559 10.410 307 HB2 PRO 42 HB2 PRO 42 9.627 -13.168 11.266 308 HB3 PRO 42 HB3 PRO 42 10.555 -12.560 9.857 309 HG2 PRO 42 HG2 PRO 42 11.466 -12.872 12.711 310 HG3 PRO 42 HG3 PRO 42 12.234 -13.487 11.208 311 HD2 PRO 42 HD2 PRO 42 13.078 -11.211 12.324 312 HD3 PRO 42 HD3 PRO 42 12.902 -11.323 10.539 313 H LEU 43 H LEU 43 7.491 -10.991 11.157 314 HA LEU 43 HA LEU 43 7.043 -10.939 14.118 315 HB2 LEU 43 HB2 LEU 43 6.188 -9.146 11.913 316 HB3 LEU 43 HB3 LEU 43 4.852 -9.742 12.881 317 HG LEU 43 HG LEU 43 5.737 -8.718 14.882 318 HD11 LEU 43 HD11 LEU 43 8.089 -7.822 13.167 319 HD12 LEU 43 HD12 LEU 43 8.145 -8.915 14.569 320 HD13 LEU 43 HD13 LEU 43 7.721 -7.212 14.796 321 HD21 LEU 43 HD21 LEU 43 5.883 -6.746 12.561 322 HD22 LEU 43 HD22 LEU 43 5.447 -6.393 14.248 323 HD23 LEU 43 HD23 LEU 43 4.373 -7.383 13.246 324 HA PRO 44 HA PRO 44 4.491 -14.403 13.032 325 HB2 PRO 44 HB2 PRO 44 2.212 -14.130 14.547 326 HB3 PRO 44 HB3 PRO 44 3.789 -14.600 15.259 327 HG2 PRO 44 HG2 PRO 44 2.527 -11.884 15.100 328 HG3 PRO 44 HG3 PRO 44 3.204 -12.732 16.526 329 HD2 PRO 44 HD2 PRO 44 4.647 -10.905 15.191 330 HD3 PRO 44 HD3 PRO 44 5.419 -12.409 15.804 331 HA PRO 45 HA PRO 45 2.165 -12.868 9.760 332 HB2 PRO 45 HB2 PRO 45 0.074 -14.593 9.316 333 HB3 PRO 45 HB3 PRO 45 1.783 -14.998 8.979 334 HG2 PRO 45 HG2 PRO 45 0.171 -15.627 11.442 335 HG3 PRO 45 HG3 PRO 45 1.125 -16.739 10.404 336 HD2 PRO 45 HD2 PRO 45 2.201 -15.760 12.643 337 HD3 PRO 45 HD3 PRO 45 3.187 -15.822 11.139 338 H THR 46 H THR 46 0.362 -13.250 12.732 339 HA THR 46 HA THR 46 -2.008 -11.802 11.978 340 HB THR 46 HB THR 46 -1.956 -11.341 14.564 341 HG1 THR 46 HG1 THR 46 -0.302 -12.201 15.624 342 HG21 THR 46 HG21 THR 46 -1.881 -14.217 13.544 343 HG22 THR 46 HG22 THR 46 -3.307 -13.148 13.531 344 HG23 THR 46 HG23 THR 46 -2.595 -13.664 15.075 345 H GLU 47 H GLU 47 1.156 -10.866 13.359 346 HA GLU 47 HA GLU 47 0.309 -8.035 13.483 347 HB2 GLU 47 HB2 GLU 47 2.830 -9.502 14.306 348 HB3 GLU 47 HB3 GLU 47 2.560 -7.770 14.552 349 HG2 GLU 47 HG2 GLU 47 0.862 -8.133 16.142 350 HG3 GLU 47 HG3 GLU 47 0.619 -9.813 15.641 351 H ALA 48 H ALA 48 2.158 -10.192 11.467 352 HA ALA 48 HA ALA 48 3.696 -8.204 10.077 353 HB1 ALA 48 HB1 ALA 48 4.173 -10.634 9.943 354 HB2 ALA 48 HB2 ALA 48 2.628 -10.881 9.094 355 HB3 ALA 48 HB3 ALA 48 3.914 -9.926 8.327 356 H ALA 49 H ALA 49 0.332 -8.881 10.204 357 HA ALA 49 HA ALA 49 -0.550 -8.020 7.655 358 HB1 ALA 49 HB1 ALA 49 -2.629 -7.381 8.847 359 HB2 ALA 49 HB2 ALA 49 -2.046 -8.964 9.401 360 HB3 ALA 49 HB3 ALA 49 -1.790 -7.518 10.405 361 H GLN 50 H GLN 50 0.604 -6.207 10.509 362 HA GLN 50 HA GLN 50 -0.118 -3.611 9.546 363 HB2 GLN 50 HB2 GLN 50 2.201 -4.448 11.321 364 HB3 GLN 50 HB3 GLN 50 1.601 -2.798 11.121 365 HG2 GLN 50 HG2 GLN 50 -0.591 -3.499 12.059 366 HG3 GLN 50 HG3 GLN 50 0.046 -5.135 12.297 367 HE21 GLN 50 HE21 GLN 50 0.611 -5.530 14.324 368 HE22 GLN 50 HE22 GLN 50 1.289 -4.363 15.431 369 H ARG 51 H ARG 51 2.790 -5.626 9.046 370 HA ARG 51 HA ARG 51 4.321 -3.599 7.692 371 HB2 ARG 51 HB2 ARG 51 4.457 -6.627 7.415 372 HB3 ARG 51 HB3 ARG 51 5.701 -5.491 6.898 373 HG2 ARG 51 HG2 ARG 51 6.283 -4.948 9.162 374 HG3 ARG 51 HG3 ARG 51 4.811 -5.703 9.794 375 HD2 ARG 51 HD2 ARG 51 6.212 -7.420 10.249 376 HD3 ARG 51 HD3 ARG 51 5.839 -7.869 8.584 377 HE ARG 51 HE ARG 51 8.382 -6.858 9.662 378 HH11 ARG 51 HH21 ARG 51 6.580 -7.558 6.668 379 HH12 ARG 51 HH22 ARG 51 8.042 -7.676 5.742 380 HH21 ARG 51 HH11 ARG 51 10.180 -7.048 8.383 381 HH22 ARG 51 HH12 ARG 51 10.014 -7.371 6.674 382 H ALA 52 H ALA 52 2.156 -6.211 6.552 383 HA ALA 52 HA ALA 52 2.473 -5.660 3.774 384 HB1 ALA 52 HB1 ALA 52 0.059 -6.817 5.236 385 HB2 ALA 52 HB2 ALA 52 0.376 -6.917 3.483 386 HB3 ALA 52 HB3 ALA 52 1.460 -7.737 4.630 387 H LYS 53 H LYS 53 0.212 -4.278 6.215 388 HA LYS 53 HA LYS 53 -1.327 -2.740 4.335 389 HB2 LYS 53 HB2 LYS 53 -0.724 -2.338 7.277 390 HB3 LYS 53 HB3 LYS 53 -1.746 -1.234 6.346 391 HG2 LYS 53 HG2 LYS 53 -3.200 -3.186 5.724 392 HG3 LYS 53 HG3 LYS 53 -2.277 -4.185 6.836 393 HD2 LYS 53 HD2 LYS 53 -3.739 -1.649 7.665 394 HD3 LYS 53 HD3 LYS 53 -4.438 -3.274 7.752 395 HE2 LYS 53 HE2 LYS 53 -2.456 -3.947 9.196 396 HE3 LYS 53 HE3 LYS 53 -2.024 -2.225 9.280 397 HZ1 LYS 53 HZ1 LYS 53 -3.372 -2.827 11.174 398 HZ2 LYS 53 HZ2 LYS 53 -4.548 -3.481 10.232 399 HZ3 LYS 53 HZ3 LYS 53 -4.288 -1.852 10.215 400 H VAL 54 H VAL 54 1.710 -1.946 6.110 401 HA VAL 54 HA VAL 54 1.862 0.732 5.049 402 HB VAL 54 HB VAL 54 4.066 -1.131 6.059 403 HG11 VAL 54 HG11 VAL 54 5.091 0.568 4.624 404 HG12 VAL 54 HG12 VAL 54 4.156 1.856 5.421 405 HG13 VAL 54 HG13 VAL 54 5.414 0.973 6.318 406 HG21 VAL 54 HG21 VAL 54 2.349 -0.500 7.759 407 HG22 VAL 54 HG22 VAL 54 3.933 0.204 8.120 408 HG23 VAL 54 HG23 VAL 54 2.651 1.213 7.412 409 H SER 55 H SER 55 3.141 -2.421 3.912 410 HA SER 55 HA SER 55 4.621 -1.388 1.706 411 HB2 SER 55 HB2 SER 55 3.170 -4.056 1.931 412 HB3 SER 55 HB3 SER 55 4.480 -3.667 0.798 413 HG SER 55 HG SER 55 4.618 -3.764 3.648 414 H ALA 56 H ALA 56 1.186 -2.136 2.095 415 HA ALA 56 HA ALA 56 0.516 -1.851 -0.705 416 HB1 ALA 56 HB1 ALA 56 -0.779 -3.068 1.131 417 HB2 ALA 56 HB2 ALA 56 -1.322 -1.457 1.645 418 HB3 ALA 56 HB3 ALA 56 -1.710 -2.053 0.018 419 H SER 57 H SER 57 0.794 0.387 2.045 420 HA SER 57 HA SER 57 -0.626 2.544 0.807 421 HB2 SER 57 HB2 SER 57 1.566 2.609 2.915 422 HB3 SER 57 HB3 SER 57 0.473 3.949 2.508 423 HG SER 57 HG SER 57 -0.179 2.625 4.335 424 H GLU 58 H GLU 58 2.638 1.329 0.369 425 HA GLU 58 HA GLU 58 3.860 3.686 -0.683 426 HB2 GLU 58 HB2 GLU 58 4.260 0.784 -1.508 427 HB3 GLU 58 HB3 GLU 58 5.342 2.115 -1.887 428 HG2 GLU 58 HG2 GLU 58 4.731 1.162 0.933 429 HG3 GLU 58 HG3 GLU 58 6.128 0.653 -0.023 430 H ILE 59 H ILE 59 1.638 1.334 -2.046 431 HA ILE 59 HA ILE 59 1.988 2.145 -4.808 432 HB ILE 59 HB ILE 59 -0.179 0.503 -3.405 433 HG12 ILE 59 HG12 ILE 59 2.148 -0.424 -5.138 434 HG13 ILE 59 HG13 ILE 59 2.231 -0.344 -3.379 435 HG21 ILE 59 HG21 ILE 59 -0.728 -0.344 -5.709 436 HG22 ILE 59 HG22 ILE 59 -1.109 1.367 -5.489 437 HG23 ILE 59 HG23 ILE 59 0.351 0.897 -6.381 438 HD11 ILE 59 HD11 ILE 59 1.779 -2.610 -3.964 439 HD12 ILE 59 HD12 ILE 59 0.293 -1.943 -3.261 440 HD13 ILE 59 HD13 ILE 59 0.431 -2.148 -5.026 441 H LEU 60 H LEU 60 0.036 3.301 -2.108 442 HA LEU 60 HA LEU 60 -2.039 4.489 -3.693 443 HB2 LEU 60 HB2 LEU 60 -0.997 5.214 -0.942 444 HB3 LEU 60 HB3 LEU 60 -2.454 5.883 -1.662 445 HG LEU 60 HG LEU 60 -2.067 2.922 -1.092 446 HD11 LEU 60 HD11 LEU 60 -2.060 4.306 0.981 447 HD12 LEU 60 HD12 LEU 60 -3.502 3.279 0.856 448 HD13 LEU 60 HD13 LEU 60 -3.612 5.019 0.490 449 HD21 LEU 60 HD21 LEU 60 -3.702 3.284 -2.825 450 HD22 LEU 60 HD22 LEU 60 -4.484 4.573 -1.878 451 HD23 LEU 60 HD23 LEU 60 -4.549 2.886 -1.321 452 H ASN 61 H ASN 61 1.249 5.556 -3.026 453 HA ASN 61 HA ASN 61 0.571 8.273 -4.019 454 HB2 ASN 61 HB2 ASN 61 2.059 7.885 -1.998 455 HB3 ASN 61 HB3 ASN 61 3.275 7.274 -3.126 456 HD21 ASN 61 HD21 ASN 61 4.786 8.859 -2.939 457 HD22 ASN 61 HD22 ASN 61 4.496 10.538 -3.311 458 H VAL 62 H VAL 62 1.231 5.369 -5.465 459 HA VAL 62 HA VAL 62 3.417 5.985 -7.164 460 HB VAL 62 HB VAL 62 2.140 3.737 -6.630 461 HG11 VAL 62 HG11 VAL 62 0.678 2.921 -8.380 462 HG12 VAL 62 HG12 VAL 62 0.012 4.449 -7.781 463 HG13 VAL 62 HG13 VAL 62 0.886 4.405 -9.335 464 HG21 VAL 62 HG21 VAL 62 4.279 3.990 -7.835 465 HG22 VAL 62 HG22 VAL 62 3.278 2.663 -8.441 466 HG23 VAL 62 HG23 VAL 62 3.369 4.181 -9.353 467 H LYS 63 H LYS 63 0.319 7.367 -7.228 468 HA LYS 63 HA LYS 63 -0.083 7.786 -10.014 469 HB2 LYS 63 HB2 LYS 63 -1.620 8.229 -7.976 470 HB3 LYS 63 HB3 LYS 63 -0.840 9.807 -7.893 471 HG2 LYS 63 HG2 LYS 63 -1.825 9.023 -10.586 472 HG3 LYS 63 HG3 LYS 63 -3.088 9.203 -9.363 473 HD2 LYS 63 HD2 LYS 63 -2.392 11.489 -8.889 474 HD3 LYS 63 HD3 LYS 63 -1.009 11.329 -9.990 475 HE2 LYS 63 HE2 LYS 63 -2.548 10.922 -11.873 476 HE3 LYS 63 HE3 LYS 63 -3.929 11.097 -10.785 477 HZ1 LYS 63 HZ1 LYS 63 -3.256 13.396 -10.428 478 HZ2 LYS 63 HZ2 LYS 63 -3.535 13.095 -12.030 479 HZ3 LYS 63 HZ3 LYS 63 -1.981 13.226 -11.464 480 H GLN 64 H GLN 64 2.263 9.224 -7.841 481 HA GLN 64 HA GLN 64 2.654 11.740 -9.074 482 HB2 GLN 64 HB2 GLN 64 4.741 9.837 -7.939 483 HB3 GLN 64 HB3 GLN 64 5.011 11.545 -8.284 484 HG2 GLN 64 HG2 GLN 64 2.999 10.494 -6.266 485 HG3 GLN 64 HG3 GLN 64 4.624 11.035 -5.869 486 HE21 GLN 64 HE21 GLN 64 2.136 12.026 -4.855 487 HE22 GLN 64 HE22 GLN 64 2.044 13.715 -5.321 488 H PHE 65 H PHE 65 3.767 8.503 -10.134 489 HA PHE 65 HA PHE 65 5.547 9.490 -12.153 490 HB2 PHE 65 HB2 PHE 65 4.011 6.886 -11.989 491 HB3 PHE 65 HB3 PHE 65 5.293 7.232 -13.155 492 HD1 PHE 65 HD1 PHE 65 7.565 8.156 -12.020 493 HD2 PHE 65 HD2 PHE 65 4.602 5.733 -10.072 494 HE1 PHE 65 HE1 PHE 65 9.279 7.379 -10.392 495 HE2 PHE 65 HE2 PHE 65 6.301 4.955 -8.442 496 HZ PHE 65 HZ PHE 65 8.643 5.762 -8.616 497 H ILE 66 H ILE 66 2.042 9.159 -12.099 498 HA ILE 66 HA ILE 66 1.746 9.107 -14.990 499 HB ILE 66 HB ILE 66 -0.290 9.984 -12.873 500 HG12 ILE 66 HG12 ILE 66 0.458 7.751 -12.312 501 HG13 ILE 66 HG13 ILE 66 -1.168 7.681 -12.982 502 HG21 ILE 66 HG21 ILE 66 -1.024 10.692 -15.060 503 HG22 ILE 66 HG22 ILE 66 -0.593 9.129 -15.789 504 HG23 ILE 66 HG23 ILE 66 -1.955 9.238 -14.652 505 HD11 ILE 66 HD11 ILE 66 1.419 6.873 -14.388 506 HD12 ILE 66 HD12 ILE 66 0.101 5.817 -13.845 507 HD13 ILE 66 HD13 ILE 66 -0.170 6.941 -15.186 508 H ASP 67 H ASP 67 1.620 11.602 -12.429 509 HA ASP 67 HA ASP 67 1.050 13.771 -14.244 510 HB2 ASP 67 HB2 ASP 67 2.247 13.685 -11.455 511 HB3 ASP 67 HB3 ASP 67 1.841 15.185 -12.308 512 H ARG 68 H ARG 68 4.012 12.270 -13.009 513 HA ARG 68 HA ARG 68 5.820 14.196 -14.248 514 HB2 ARG 68 HB2 ARG 68 6.134 11.349 -13.241 515 HB3 ARG 68 HB3 ARG 68 7.454 12.219 -14.010 516 HG2 ARG 68 HG2 ARG 68 6.378 13.883 -11.927 517 HG3 ARG 68 HG3 ARG 68 6.693 12.255 -11.284 518 HD2 ARG 68 HD2 ARG 68 8.952 12.413 -12.544 519 HD3 ARG 68 HD3 ARG 68 8.623 14.154 -12.640 520 HE ARG 68 HE ARG 68 8.292 13.299 -9.937 521 HH11 ARG 68 HH21 ARG 68 10.898 13.758 -12.288 522 HH12 ARG 68 HH22 ARG 68 12.097 14.011 -11.050 523 HH21 ARG 68 HH11 ARG 68 9.894 13.593 -8.412 524 HH22 ARG 68 HH12 ARG 68 11.534 13.934 -8.908 525 H LYS 69 H LYS 69 3.766 11.830 -15.524 526 HA LYS 69 HA LYS 69 3.601 10.681 -17.487 527 HB2 LYS 69 HB2 LYS 69 5.372 12.911 -18.537 528 HB3 LYS 69 HB3 LYS 69 4.423 11.791 -19.524 529 HG2 LYS 69 HG2 LYS 69 2.350 12.618 -18.457 530 HG3 LYS 69 HG3 LYS 69 3.307 13.754 -17.495 531 HD2 LYS 69 HD2 LYS 69 4.115 14.815 -19.576 532 HD3 LYS 69 HD3 LYS 69 3.066 13.722 -20.513 533 HE2 LYS 69 HE2 LYS 69 1.090 14.586 -19.292 534 HE3 LYS 69 HE3 LYS 69 2.142 15.671 -18.359 535 HZ1 LYS 69 HZ1 LYS 69 1.768 15.766 -21.297 536 HZ2 LYS 69 HZ2 LYS 69 2.741 16.773 -20.423 537 HZ3 LYS 69 HZ3 LYS 69 1.106 16.814 -20.209 538 H ALA 70 H ALA 70 5.545 9.934 -15.599 539 HA ALA 70 HA ALA 70 7.949 9.118 -17.090 540 HB1 ALA 70 HB1 ALA 70 8.120 9.970 -14.763 541 HB2 ALA 70 HB2 ALA 70 7.106 8.621 -14.202 542 HB3 ALA 70 HB3 ALA 70 8.711 8.303 -14.901 543 H TRP 71 H TRP 71 6.162 7.962 -18.493 544 HA TRP 71 HA TRP 71 4.862 5.623 -17.735 545 HB2 TRP 71 HB2 TRP 71 6.311 5.791 -20.359 546 HB3 TRP 71 HB3 TRP 71 4.723 5.125 -19.994 547 HD1 TRP 71 HD1 TRP 71 6.215 8.044 -21.567 548 HE1 TRP 71 HE1 TRP 71 4.646 10.029 -21.766 549 HE3 TRP 71 HE3 TRP 71 2.668 6.486 -18.224 550 HZ2 TRP 71 HZ2 TRP 71 2.137 10.830 -20.673 551 HZ3 TRP 71 HZ3 TRP 71 0.670 7.943 -17.829 552 HH2 TRP 71 HH2 TRP 71 0.423 10.094 -19.058 553 HA PRO 72 HA PRO 72 8.504 2.828 -18.449 554 HB2 PRO 72 HB2 PRO 72 11.094 3.620 -18.394 555 HB3 PRO 72 HB3 PRO 72 10.107 3.726 -19.888 556 HG2 PRO 72 HG2 PRO 72 10.680 5.861 -17.852 557 HG3 PRO 72 HG3 PRO 72 10.909 5.909 -19.632 558 HD2 PRO 72 HD2 PRO 72 8.702 6.927 -18.467 559 HD3 PRO 72 HD3 PRO 72 8.609 6.069 -20.041 560 H SER 73 H SER 73 8.470 5.338 -16.068 561 HA SER 73 HA SER 73 10.071 3.741 -14.150 562 HB2 SER 73 HB2 SER 73 10.265 6.262 -14.337 563 HB3 SER 73 HB3 SER 73 8.630 6.359 -13.649 564 HG SER 73 HG SER 73 9.373 5.463 -11.776 565 H LEU 74 H LEU 74 6.716 4.715 -14.859 566 HA LEU 74 HA LEU 74 5.551 3.794 -12.424 567 HB2 LEU 74 HB2 LEU 74 4.368 5.139 -14.163 568 HB3 LEU 74 HB3 LEU 74 4.399 3.766 -15.248 569 HG LEU 74 HG LEU 74 2.163 4.170 -14.270 570 HD11 LEU 74 HD11 LEU 74 2.944 1.922 -14.953 571 HD12 LEU 74 HD12 LEU 74 1.536 2.031 -13.889 572 HD13 LEU 74 HD13 LEU 74 3.111 1.561 -13.218 573 HD21 LEU 74 HD21 LEU 74 1.704 3.672 -11.920 574 HD22 LEU 74 HD22 LEU 74 2.802 5.048 -12.091 575 HD23 LEU 74 HD23 LEU 74 3.440 3.459 -11.619 576 H GLN 75 H GLN 75 6.109 2.104 -15.562 577 HA GLN 75 HA GLN 75 5.031 -0.384 -14.770 578 HB2 GLN 75 HB2 GLN 75 6.315 -1.346 -16.615 579 HB3 GLN 75 HB3 GLN 75 5.572 0.183 -17.098 580 HG2 GLN 75 HG2 GLN 75 7.698 1.331 -16.860 581 HG3 GLN 75 HG3 GLN 75 8.470 -0.139 -16.265 582 HE21 GLN 75 HE21 GLN 75 9.940 0.499 -18.056 583 HE22 GLN 75 HE22 GLN 75 9.585 -0.172 -19.634 584 H ASN 76 H ASN 76 8.092 1.061 -13.914 585 HA ASN 76 HA ASN 76 9.277 -1.487 -13.066 586 HB2 ASN 76 HB2 ASN 76 10.706 0.265 -14.004 587 HB3 ASN 76 HB3 ASN 76 10.148 1.416 -12.788 588 HD21 ASN 76 HD21 ASN 76 11.616 1.794 -11.311 589 HD22 ASN 76 HD22 ASN 76 12.704 0.606 -10.639 590 H ASP 77 H ASP 77 8.549 1.620 -11.369 591 HA ASP 77 HA ASP 77 9.060 0.457 -8.819 592 HB2 ASP 77 HB2 ASP 77 9.161 2.898 -9.506 593 HB3 ASP 77 HB3 ASP 77 7.395 2.927 -9.384 594 H LEU 78 H LEU 78 5.998 1.001 -10.576 595 HA LEU 78 HA LEU 78 4.296 0.472 -8.345 596 HB2 LEU 78 HB2 LEU 78 3.811 1.502 -10.652 597 HB3 LEU 78 HB3 LEU 78 3.698 -0.126 -11.256 598 HG LEU 78 HG LEU 78 1.700 1.562 -10.132 599 HD11 LEU 78 HD11 LEU 78 0.231 -0.264 -11.022 600 HD12 LEU 78 HD12 LEU 78 1.695 -1.218 -11.344 601 HD13 LEU 78 HD13 LEU 78 1.440 0.329 -12.170 602 HD21 LEU 78 HD21 LEU 78 1.847 -1.109 -8.716 603 HD22 LEU 78 HD22 LEU 78 0.517 0.065 -8.652 604 HD23 LEU 78 HD23 LEU 78 2.094 0.484 -7.963 605 H ARG 79 H ARG 79 5.542 -1.638 -10.979 606 HA ARG 79 HA ARG 79 4.200 -3.977 -9.959 607 HB2 ARG 79 HB2 ARG 79 6.539 -3.640 -11.862 608 HB3 ARG 79 HB3 ARG 79 5.845 -5.210 -11.435 609 HG2 ARG 79 HG2 ARG 79 3.628 -4.424 -12.266 610 HG3 ARG 79 HG3 ARG 79 4.403 -2.929 -12.829 611 HD2 ARG 79 HD2 ARG 79 5.891 -4.228 -14.282 612 HD3 ARG 79 HD3 ARG 79 5.191 -5.743 -13.687 613 HE ARG 79 HE ARG 79 3.982 -3.810 -15.566 614 HH11 ARG 79 HH11 ARG 79 3.424 -6.725 -13.609 615 HH12 ARG 79 HH12 ARG 79 1.979 -7.149 -14.514 616 HH21 ARG 79 HH21 ARG 79 2.154 -4.464 -16.655 617 HH22 ARG 79 HH22 ARG 79 1.307 -5.934 -16.191 618 H LEU 80 H LEU 80 7.426 -2.564 -9.360 619 HA LEU 80 HA LEU 80 8.447 -4.872 -8.008 620 HB2 LEU 80 HB2 LEU 80 9.075 -1.922 -7.904 621 HB3 LEU 80 HB3 LEU 80 9.853 -3.041 -6.786 622 HG LEU 80 HG LEU 80 9.995 -3.327 -9.804 623 HD11 LEU 80 HD11 LEU 80 11.014 -1.228 -9.113 624 HD12 LEU 80 HD12 LEU 80 12.276 -2.394 -9.555 625 HD13 LEU 80 HD13 LEU 80 11.931 -2.057 -7.838 626 HD21 LEU 80 HD21 LEU 80 11.534 -4.630 -7.523 627 HD22 LEU 80 HD22 LEU 80 11.949 -4.780 -9.248 628 HD23 LEU 80 HD23 LEU 80 10.415 -5.429 -8.649 629 H ARG 81 H ARG 81 6.857 -1.896 -6.687 630 HA ARG 81 HA ARG 81 6.999 -2.901 -3.993 631 HB2 ARG 81 HB2 ARG 81 5.282 -0.755 -5.276 632 HB3 ARG 81 HB3 ARG 81 5.370 -1.057 -3.525 633 HG2 ARG 81 HG2 ARG 81 7.754 -0.589 -3.508 634 HG3 ARG 81 HG3 ARG 81 7.786 -0.449 -5.269 635 HD2 ARG 81 HD2 ARG 81 6.262 1.494 -5.114 636 HD3 ARG 81 HD3 ARG 81 6.402 1.407 -3.348 637 HE ARG 81 HE ARG 81 8.483 2.195 -5.295 638 HH11 ARG 81 HH21 ARG 81 7.749 1.553 -1.879 639 HH12 ARG 81 HH22 ARG 81 9.220 2.303 -1.338 640 HH21 ARG 81 HH11 ARG 81 10.309 3.097 -4.528 641 HH22 ARG 81 HH12 ARG 81 10.641 3.185 -2.816 642 H ALA 82 H ALA 82 4.565 -3.203 -6.565 643 HA ALA 82 HA ALA 82 2.598 -4.471 -4.910 644 HB1 ALA 82 HB1 ALA 82 2.171 -3.616 -7.213 645 HB2 ALA 82 HB2 ALA 82 3.178 -4.929 -7.867 646 HB3 ALA 82 HB3 ALA 82 1.667 -5.306 -7.007 647 H SER 83 H SER 83 5.488 -5.745 -6.654 648 HA SER 83 HA SER 83 4.875 -8.496 -6.139 649 HB2 SER 83 HB2 SER 83 7.579 -7.167 -6.515 650 HB3 SER 83 HB3 SER 83 7.257 -8.909 -6.596 651 HG SER 83 HG SER 83 6.260 -6.862 -8.308 652 H TYR 84 H TYR 84 6.649 -6.037 -4.215 653 HA TYR 84 HA TYR 84 7.426 -7.953 -2.192 654 HB2 TYR 84 HB2 TYR 84 7.163 -4.932 -2.128 655 HB3 TYR 84 HB3 TYR 84 7.750 -5.900 -0.768 656 HD1 TYR 84 HD1 TYR 84 9.714 -7.637 -1.391 657 HD2 TYR 84 HD2 TYR 84 8.775 -4.091 -3.640 658 HE1 TYR 84 HE1 TYR 84 12.006 -7.649 -2.389 659 HE2 TYR 84 HE2 TYR 84 11.051 -4.122 -4.635 660 HH TYR 84 HH TYR 84 13.067 -5.154 -4.716 661 H LEU 85 H LEU 85 4.566 -5.827 -2.630 662 HA LEU 85 HA LEU 85 3.339 -6.485 -0.130 663 HB2 LEU 85 HB2 LEU 85 2.513 -4.664 -1.547 664 HB3 LEU 85 HB3 LEU 85 2.120 -5.812 -2.822 665 HG LEU 85 HG LEU 85 0.386 -6.841 -1.403 666 HD11 LEU 85 HD11 LEU 85 1.231 -6.380 0.831 667 HD12 LEU 85 HD12 LEU 85 -0.362 -5.627 0.649 668 HD13 LEU 85 HD13 LEU 85 1.105 -4.628 0.557 669 HD21 LEU 85 HD21 LEU 85 -1.210 -4.976 -1.541 670 HD22 LEU 85 HD22 LEU 85 -0.176 -5.051 -2.983 671 HD23 LEU 85 HD23 LEU 85 0.137 -3.831 -1.728 672 H ARG 86 H ARG 86 3.314 -8.081 -3.288 673 HA ARG 86 HA ARG 86 1.393 -10.102 -2.648 674 HB2 ARG 86 HB2 ARG 86 2.460 -9.513 -4.937 675 HB3 ARG 86 HB3 ARG 86 3.811 -10.513 -4.436 676 HG2 ARG 86 HG2 ARG 86 2.611 -12.022 -5.677 677 HG3 ARG 86 HG3 ARG 86 1.946 -12.363 -4.073 678 HD2 ARG 86 HD2 ARG 86 -0.061 -11.080 -4.567 679 HD3 ARG 86 HD3 ARG 86 0.666 -10.420 -6.039 680 HE ARG 86 HE ARG 86 0.613 -13.253 -6.233 681 HH11 ARG 86 HH11 ARG 86 -1.589 -10.497 -6.379 682 HH12 ARG 86 HH12 ARG 86 -2.714 -11.333 -7.414 683 HH21 ARG 86 HH21 ARG 86 -0.876 -14.251 -7.571 684 HH22 ARG 86 HH22 ARG 86 -2.312 -13.407 -8.079 685 H TYR 87 H TYR 87 4.917 -9.915 -2.138 686 HA TYR 87 HA TYR 87 5.144 -12.628 -1.177 687 HB2 TYR 87 HB2 TYR 87 7.243 -12.077 -1.701 688 HB3 TYR 87 HB3 TYR 87 6.870 -10.354 -1.702 689 HD1 TYR 87 HD2 TYR 87 7.784 -13.196 0.592 690 HD2 TYR 87 HD1 TYR 87 7.679 -8.930 0.027 691 HE1 TYR 87 HE2 TYR 87 9.101 -12.873 2.687 692 HE2 TYR 87 HE1 TYR 87 8.988 -8.622 2.114 693 HH TYR 87 HH TYR 87 10.036 -11.370 4.133 694 H ASP 88 H ASP 88 4.843 -9.440 0.502 695 HA ASP 88 HA ASP 88 5.157 -10.584 3.119 696 HB2 ASP 88 HB2 ASP 88 5.336 -8.125 2.395 697 HB3 ASP 88 HB3 ASP 88 3.568 -8.079 2.449 698 H LEU 89 H LEU 89 2.280 -9.673 1.188 699 HA LEU 89 HA LEU 89 0.350 -10.480 3.097 700 HB2 LEU 89 HB2 LEU 89 0.005 -9.044 1.103 701 HB3 LEU 89 HB3 LEU 89 0.142 -10.461 0.074 702 HG LEU 89 HG LEU 89 -1.954 -11.334 0.847 703 HD11 LEU 89 HD11 LEU 89 -3.365 -10.014 2.482 704 HD12 LEU 89 HD12 LEU 89 -1.907 -9.082 2.895 705 HD13 LEU 89 HD13 LEU 89 -1.972 -10.833 3.204 706 HD21 LEU 89 HD21 LEU 89 -2.145 -8.320 0.410 707 HD22 LEU 89 HD22 LEU 89 -3.436 -9.510 0.121 708 HD23 LEU 89 HD23 LEU 89 -1.963 -9.545 -0.866 709 H LYS 90 H LYS 90 2.180 -12.398 0.734 710 HA LYS 90 HA LYS 90 0.678 -14.761 0.729 711 HB2 LYS 90 HB2 LYS 90 2.893 -14.127 -0.489 712 HB3 LYS 90 HB3 LYS 90 3.702 -14.663 0.979 713 HG2 LYS 90 HG2 LYS 90 3.803 -16.497 -0.414 714 HG3 LYS 90 HG3 LYS 90 2.429 -16.859 0.647 715 HD2 LYS 90 HD2 LYS 90 0.946 -15.814 -1.156 716 HD3 LYS 90 HD3 LYS 90 2.377 -15.843 -2.209 717 HE2 LYS 90 HE2 LYS 90 1.126 -18.196 -0.786 718 HE3 LYS 90 HE3 LYS 90 0.953 -17.817 -2.511 719 HZ1 LYS 90 HZ1 LYS 90 2.663 -19.497 -2.143 720 HZ2 LYS 90 HZ2 LYS 90 3.503 -18.488 -1.144 721 HZ3 LYS 90 HZ3 LYS 90 3.357 -18.126 -2.745 722 H THR 91 H THR 91 2.817 -13.419 3.222 723 HA THR 91 HA THR 91 2.751 -15.881 4.826 724 HB THR 91 HB THR 91 3.705 -13.087 5.622 725 HG1 THR 91 HG1 THR 91 5.011 -13.505 3.981 726 HG21 THR 91 HG21 THR 91 5.201 -14.358 7.130 727 HG22 THR 91 HG22 THR 91 4.434 -15.874 6.608 728 HG23 THR 91 HG23 THR 91 3.491 -14.656 7.501 729 H VAL 92 H VAL 92 1.412 -12.567 4.921 730 HA VAL 92 HA VAL 92 0.111 -12.752 7.414 731 HB VAL 92 HB VAL 92 -0.626 -11.128 4.947 732 HG11 VAL 92 HG11 VAL 92 -1.449 -10.788 7.853 733 HG12 VAL 92 HG12 VAL 92 -1.711 -9.588 6.565 734 HG13 VAL 92 HG13 VAL 92 -2.519 -11.160 6.480 735 HG21 VAL 92 HG21 VAL 92 1.663 -10.695 5.717 736 HG22 VAL 92 HG22 VAL 92 0.628 -9.327 6.125 737 HG23 VAL 92 HG23 VAL 92 1.083 -10.493 7.380 738 H ILE 93 H ILE 93 -1.146 -13.757 4.187 739 HA ILE 93 HA ILE 93 -3.838 -14.132 5.067 740 HB ILE 93 HB ILE 93 -4.068 -15.753 3.203 741 HG12 ILE 93 HG12 ILE 93 -1.125 -15.266 2.690 742 HG13 ILE 93 HG13 ILE 93 -1.783 -16.742 3.387 743 HG21 ILE 93 HG21 ILE 93 -3.916 -14.136 1.458 744 HG22 ILE 93 HG22 ILE 93 -4.122 -13.186 2.937 745 HG23 ILE 93 HG23 ILE 93 -2.523 -13.335 2.205 746 HD11 ILE 93 HD11 ILE 93 -3.091 -17.111 1.288 747 HD12 ILE 93 HD12 ILE 93 -2.284 -15.687 0.582 748 HD13 ILE 93 HD13 ILE 93 -1.329 -17.110 1.047 749 H SER 94 H SER 94 -1.013 -15.964 5.847 750 HA SER 94 HA SER 94 -2.485 -18.436 6.339 751 HB2 SER 94 HB2 SER 94 0.314 -17.612 7.132 752 HB3 SER 94 HB3 SER 94 -0.346 -19.260 7.116 753 HG SER 94 HG SER 94 0.433 -17.602 5.001 754 H ALA 95 H ALA 95 -2.301 -15.506 8.013 755 HA ALA 95 HA ALA 95 -2.085 -16.422 10.725 756 HB1 ALA 95 HB1 ALA 95 -3.216 -14.283 11.277 757 HB2 ALA 95 HB2 ALA 95 -1.932 -14.031 10.077 758 HB3 ALA 95 HB3 ALA 95 -3.630 -14.052 9.563 759 H LYS 96 H LYS 96 -4.793 -16.181 8.445 760 HA LYS 96 HA LYS 96 -6.399 -17.914 10.276 761 HB2 LYS 96 HB2 LYS 96 -7.371 -15.489 8.745 762 HB3 LYS 96 HB3 LYS 96 -8.439 -16.749 9.368 763 HG2 LYS 96 HG2 LYS 96 -8.598 -15.466 11.180 764 HG3 LYS 96 HG3 LYS 96 -7.030 -16.141 11.627 765 HD2 LYS 96 HD2 LYS 96 -5.863 -14.255 10.881 766 HD3 LYS 96 HD3 LYS 96 -7.207 -13.688 9.875 767 HE2 LYS 96 HE2 LYS 96 -7.279 -13.775 12.916 768 HE3 LYS 96 HE3 LYS 96 -6.863 -12.335 11.961 769 HZ1 LYS 96 HZ1 LYS 96 -9.192 -12.277 12.518 770 HZ2 LYS 96 HZ2 LYS 96 -9.460 -13.777 11.875 771 HZ3 LYS 96 HZ3 LYS 96 -9.069 -12.528 10.887 772 HA PRO 97 HA PRO 97 -5.458 -19.426 6.054 773 HB2 PRO 97 HB2 PRO 97 -5.160 -22.088 6.572 774 HB3 PRO 97 HB3 PRO 97 -3.915 -20.864 6.982 775 HG2 PRO 97 HG2 PRO 97 -6.065 -22.009 8.742 776 HG3 PRO 97 HG3 PRO 97 -4.294 -21.934 9.028 777 HD2 PRO 97 HD2 PRO 97 -5.923 -20.075 10.064 778 HD3 PRO 97 HD3 PRO 97 -4.336 -19.608 9.369 779 H LYS 98 H LYS 98 -8.338 -19.704 7.670 780 HA LYS 98 HA LYS 98 -9.465 -21.708 5.843 781 HB2 LYS 98 HB2 LYS 98 -9.937 -21.502 8.396 782 HB3 LYS 98 HB3 LYS 98 -11.046 -20.216 7.939 783 HG2 LYS 98 HG2 LYS 98 -12.367 -22.194 8.142 784 HG3 LYS 98 HG3 LYS 98 -12.196 -21.939 6.399 785 HD2 LYS 98 HD2 LYS 98 -10.364 -23.628 6.345 786 HD3 LYS 98 HD3 LYS 98 -10.570 -23.885 8.092 787 HE2 LYS 98 HE2 LYS 98 -12.925 -24.583 7.699 788 HE3 LYS 98 HE3 LYS 98 -12.697 -24.349 5.953 789 HZ1 LYS 98 HZ1 LYS 98 -11.213 -26.299 7.632 790 HZ2 LYS 98 HZ2 LYS 98 -10.998 -26.082 6.011 791 HZ3 LYS 98 HZ3 LYS 98 -12.430 -26.668 6.581 792 H ASP 99 H ASP 99 -12.102 -19.855 6.327 793 HA ASP 99 HA ASP 99 -12.118 -19.126 3.567 794 HB2 ASP 99 HB2 ASP 99 -14.126 -19.651 5.008 795 HB3 ASP 99 HB3 ASP 99 -13.958 -18.026 5.696 796 H GLU 100 H GLU 100 -11.173 -17.353 6.475 797 HA GLU 100 HA GLU 100 -11.244 -14.748 5.305 798 HB2 GLU 100 HB2 GLU 100 -9.456 -15.959 7.426 799 HB3 GLU 100 HB3 GLU 100 -9.375 -14.264 6.933 800 HG2 GLU 100 HG2 GLU 100 -11.817 -14.068 7.522 801 HG3 GLU 100 HG3 GLU 100 -11.709 -15.694 8.226 802 H LYS 101 H LYS 101 -8.799 -17.393 5.209 803 HA LYS 101 HA LYS 101 -6.858 -15.817 3.746 804 HB2 LYS 101 HB2 LYS 101 -6.215 -17.813 4.935 805 HB3 LYS 101 HB3 LYS 101 -7.320 -18.793 4.006 806 HG2 LYS 101 HG2 LYS 101 -5.630 -17.610 2.087 807 HG3 LYS 101 HG3 LYS 101 -4.574 -18.014 3.442 808 HD2 LYS 101 HD2 LYS 101 -4.665 -19.859 1.865 809 HD3 LYS 101 HD3 LYS 101 -5.416 -20.346 3.395 810 HE2 LYS 101 HE2 LYS 101 -7.613 -20.208 2.488 811 HE3 LYS 101 HE3 LYS 101 -7.065 -19.240 1.104 812 HZ1 LYS 101 HZ1 LYS 101 -6.327 -22.062 1.560 813 HZ2 LYS 101 HZ2 LYS 101 -5.935 -21.141 0.243 814 HZ3 LYS 101 HZ3 LYS 101 -7.507 -21.550 0.525 815 H LYS 102 H LYS 102 -9.583 -17.931 2.803 816 HA LYS 102 HA LYS 102 -9.070 -17.868 -0.026 817 HB2 LYS 102 HB2 LYS 102 -10.630 -19.443 1.041 818 HB3 LYS 102 HB3 LYS 102 -11.675 -18.117 1.524 819 HG2 LYS 102 HG2 LYS 102 -11.117 -18.542 -1.410 820 HG3 LYS 102 HG3 LYS 102 -12.277 -19.583 -0.555 821 HD2 LYS 102 HD2 LYS 102 -13.384 -17.444 0.291 822 HD3 LYS 102 HD3 LYS 102 -12.383 -16.576 -0.882 823 HE2 LYS 102 HE2 LYS 102 -13.376 -17.883 -2.714 824 HE3 LYS 102 HE3 LYS 102 -14.382 -18.764 -1.534 825 HZ1 LYS 102 HZ1 LYS 102 -14.437 -15.834 -2.036 826 HZ2 LYS 102 HZ2 LYS 102 -15.346 -16.614 -0.894 827 HZ3 LYS 102 HZ3 LYS 102 -15.596 -16.914 -2.499 828 H SER 103 H SER 103 -11.093 -15.776 2.057 829 HA SER 103 HA SER 103 -11.913 -14.084 -0.083 830 HB2 SER 103 HB2 SER 103 -13.067 -14.252 2.087 831 HB3 SER 103 HB3 SER 103 -11.677 -13.485 2.883 832 HG SER 103 HG SER 103 -13.235 -12.323 0.799 833 H LEU 104 H LEU 104 -9.122 -13.892 2.176 834 HA LEU 104 HA LEU 104 -8.228 -11.347 1.181 835 HB2 LEU 104 HB2 LEU 104 -6.911 -13.653 2.603 836 HB3 LEU 104 HB3 LEU 104 -5.936 -12.331 1.968 837 HG LEU 104 HG LEU 104 -8.240 -11.849 3.868 838 HD11 LEU 104 HD11 LEU 104 -6.627 -11.764 5.692 839 HD12 LEU 104 HD12 LEU 104 -5.306 -12.199 4.587 840 HD13 LEU 104 HD13 LEU 104 -6.602 -13.371 4.937 841 HD21 LEU 104 HD21 LEU 104 -7.470 -9.880 2.607 842 HD22 LEU 104 HD22 LEU 104 -5.790 -10.207 3.083 843 HD23 LEU 104 HD23 LEU 104 -6.987 -9.738 4.308 844 H GLN 105 H GLN 105 -7.574 -14.735 0.112 845 HA GLN 105 HA GLN 105 -5.552 -13.930 -1.766 846 HB2 GLN 105 HB2 GLN 105 -7.261 -16.408 -1.480 847 HB3 GLN 105 HB3 GLN 105 -6.170 -16.184 -2.853 848 HG2 GLN 105 HG2 GLN 105 -4.289 -15.832 -1.254 849 HG3 GLN 105 HG3 GLN 105 -5.374 -16.271 0.068 850 HE21 GLN 105 HE21 GLN 105 -3.200 -17.384 -2.241 851 HE22 GLN 105 HE22 GLN 105 -3.541 -19.093 -2.119 852 H GLU 106 H GLU 106 -9.121 -14.331 -2.158 853 HA GLU 106 HA GLU 106 -8.889 -13.948 -5.023 854 HB2 GLU 106 HB2 GLU 106 -11.285 -13.791 -5.070 855 HB3 GLU 106 HB3 GLU 106 -10.776 -15.118 -4.022 856 HG2 GLU 106 HG2 GLU 106 -11.119 -13.541 -2.078 857 HG3 GLU 106 HG3 GLU 106 -11.925 -12.444 -3.201 858 H LEU 107 H LEU 107 -9.238 -11.734 -2.242 859 HA LEU 107 HA LEU 107 -9.582 -9.389 -3.935 860 HB2 LEU 107 HB2 LEU 107 -8.499 -9.670 -1.113 861 HB3 LEU 107 HB3 LEU 107 -8.739 -8.148 -1.948 862 HG LEU 107 HG LEU 107 -10.805 -9.975 -0.785 863 HD11 LEU 107 HD11 LEU 107 -10.242 -7.002 -0.691 864 HD12 LEU 107 HD12 LEU 107 -9.756 -8.186 0.538 865 HD13 LEU 107 HD13 LEU 107 -11.479 -7.856 0.254 866 HD21 LEU 107 HD21 LEU 107 -11.718 -9.560 -2.995 867 HD22 LEU 107 HD22 LEU 107 -11.303 -7.829 -2.873 868 HD23 LEU 107 HD23 LEU 107 -12.553 -8.526 -1.820 869 H THR 108 H THR 108 -6.802 -11.159 -2.600 870 HA THR 108 HA THR 108 -4.769 -9.310 -3.378 871 HB THR 108 HB THR 108 -4.575 -12.376 -3.311 872 HG1 THR 108 HG1 THR 108 -5.307 -11.400 -1.321 873 HG21 THR 108 HG21 THR 108 -2.184 -11.872 -2.654 874 HG22 THR 108 HG22 THR 108 -2.479 -10.183 -3.137 875 HG23 THR 108 HG23 THR 108 -2.595 -11.486 -4.340 876 H SER 109 H SER 109 -6.564 -11.833 -5.179 877 HA SER 109 HA SER 109 -4.938 -11.490 -7.559 878 HB2 SER 109 HB2 SER 109 -6.353 -13.515 -7.005 879 HB3 SER 109 HB3 SER 109 -7.790 -12.546 -7.391 880 HG SER 109 HG SER 109 -7.006 -12.309 -9.494 881 H LYS 110 H LYS 110 -8.116 -10.184 -6.463 882 HA LYS 110 HA LYS 110 -8.781 -8.765 -8.832 883 HB2 LYS 110 HB2 LYS 110 -10.226 -9.189 -6.756 884 HB3 LYS 110 HB3 LYS 110 -9.357 -7.859 -5.985 885 HG2 LYS 110 HG2 LYS 110 -10.113 -6.482 -8.089 886 HG3 LYS 110 HG3 LYS 110 -11.311 -7.765 -8.293 887 HD2 LYS 110 HD2 LYS 110 -10.943 -6.118 -5.745 888 HD3 LYS 110 HD3 LYS 110 -12.114 -5.734 -7.009 889 HE2 LYS 110 HE2 LYS 110 -13.246 -7.896 -6.600 890 HE3 LYS 110 HE3 LYS 110 -12.067 -8.250 -5.309 891 HZ1 LYS 110 HZ1 LYS 110 -14.069 -7.227 -4.392 892 HZ2 LYS 110 HZ2 LYS 110 -13.893 -5.901 -5.356 893 HZ3 LYS 110 HZ3 LYS 110 -12.786 -6.209 -4.180 894 H LEU 111 H LEU 111 -6.916 -7.742 -5.976 895 HA LEU 111 HA LEU 111 -6.534 -5.045 -6.694 896 HB2 LEU 111 HB2 LEU 111 -6.100 -6.160 -4.508 897 HB3 LEU 111 HB3 LEU 111 -4.655 -6.889 -5.173 898 HG LEU 111 HG LEU 111 -4.963 -3.884 -5.017 899 HD11 LEU 111 HD11 LEU 111 -4.043 -5.818 -2.860 900 HD12 LEU 111 HD12 LEU 111 -5.480 -4.766 -2.816 901 HD13 LEU 111 HD13 LEU 111 -3.862 -4.057 -2.795 902 HD21 LEU 111 HD21 LEU 111 -3.017 -4.766 -6.293 903 HD22 LEU 111 HD22 LEU 111 -2.491 -5.635 -4.841 904 HD23 LEU 111 HD23 LEU 111 -2.544 -3.862 -4.850 905 H PHE 112 H PHE 112 -4.510 -7.894 -7.446 906 HA PHE 112 HA PHE 112 -2.530 -6.235 -8.717 907 HB2 PHE 112 HB2 PHE 112 -2.955 -9.182 -8.454 908 HB3 PHE 112 HB3 PHE 112 -1.718 -8.540 -9.544 909 HD1 PHE 112 HD1 PHE 112 -2.886 -8.021 -5.990 910 HD2 PHE 112 HD2 PHE 112 0.428 -8.202 -8.715 911 HE1 PHE 112 HE1 PHE 112 -1.349 -7.712 -4.093 912 HE2 PHE 112 HE2 PHE 112 1.988 -7.868 -6.807 913 HZ PHE 112 HZ PHE 112 1.077 -7.626 -4.482 914 H SER 113 H SER 113 -5.511 -7.582 -9.902 915 HA SER 113 HA SER 113 -4.762 -7.540 -12.697 916 HB2 SER 113 HB2 SER 113 -6.881 -8.567 -11.842 917 HB3 SER 113 HB3 SER 113 -7.473 -6.945 -11.431 918 HG SER 113 HG SER 113 -7.212 -6.419 -13.694 919 H SER 114 H SER 114 -6.071 -5.155 -10.370 920 HA SER 114 HA SER 114 -6.272 -3.014 -12.256 921 HB2 SER 114 HB2 SER 114 -7.393 -3.195 -9.990 922 HB3 SER 114 HB3 SER 114 -5.833 -2.771 -9.257 923 HG SER 114 HG SER 114 -5.900 -0.812 -10.403 924 H ILE 115 H ILE 115 -3.610 -4.186 -10.223 925 HA ILE 115 HA ILE 115 -1.815 -1.973 -10.593 926 HB ILE 115 HB ILE 115 -1.249 -4.974 -10.243 927 HG12 ILE 115 HG12 ILE 115 -2.457 -3.913 -8.364 928 HG13 ILE 115 HG13 ILE 115 -0.884 -4.549 -7.918 929 HG21 ILE 115 HG21 ILE 115 0.727 -3.939 -11.244 930 HG22 ILE 115 HG22 ILE 115 0.717 -2.666 -10.009 931 HG23 ILE 115 HG23 ILE 115 1.050 -4.346 -9.550 932 HD11 ILE 115 HD11 ILE 115 -1.410 -1.605 -8.468 933 HD12 ILE 115 HD12 ILE 115 -1.481 -2.358 -6.863 934 HD13 ILE 115 HD13 ILE 115 0.049 -2.337 -7.756 935 H ASP 116 H ASP 116 -2.368 -4.999 -12.437 936 HA ASP 116 HA ASP 116 -0.311 -4.470 -14.357 937 HB2 ASP 116 HB2 ASP 116 -1.758 -6.626 -13.671 938 HB3 ASP 116 HB3 ASP 116 -2.678 -6.139 -15.103 939 H ASN 117 H ASN 117 -3.776 -3.686 -14.228 940 HA ASN 117 HA ASN 117 -3.927 -2.762 -16.958 941 HB2 ASN 117 HB2 ASN 117 -5.616 -2.071 -14.514 942 HB3 ASN 117 HB3 ASN 117 -5.992 -1.586 -16.172 943 HD21 ASN 117 HD21 ASN 117 -5.357 -3.888 -17.582 944 HD22 ASN 117 HD22 ASN 117 -6.469 -5.146 -17.109 945 H LEU 118 H LEU 118 -3.169 -1.157 -13.857 946 HA LEU 118 HA LEU 118 -3.176 1.522 -14.857 947 HB2 LEU 118 HB2 LEU 118 -3.027 0.474 -12.445 948 HB3 LEU 118 HB3 LEU 118 -1.301 0.545 -12.704 949 HG LEU 118 HG LEU 118 -3.221 2.884 -12.586 950 HD11 LEU 118 HD11 LEU 118 -2.802 1.735 -10.440 951 HD12 LEU 118 HD12 LEU 118 -2.053 3.344 -10.454 952 HD13 LEU 118 HD13 LEU 118 -1.048 1.898 -10.686 953 HD21 LEU 118 HD21 LEU 118 -1.228 4.317 -12.536 954 HD22 LEU 118 HD22 LEU 118 -1.373 3.452 -14.075 955 HD23 LEU 118 HD23 LEU 118 -0.206 2.898 -12.859 956 H ASP 119 H ASP 119 -0.560 -0.853 -14.419 957 HA ASP 119 HA ASP 119 1.554 0.539 -15.592 958 HB2 ASP 119 HB2 ASP 119 2.172 -1.398 -14.501 959 HB3 ASP 119 HB3 ASP 119 0.841 -2.337 -15.195 960 H HIS 120 H HIS 120 -0.796 -1.618 -17.306 961 HA HIS 120 HA HIS 120 0.550 -1.162 -19.800 962 HB2 HIS 120 HB2 HIS 120 -2.125 -2.267 -19.021 963 HB3 HIS 120 HB3 HIS 120 -1.789 -1.880 -20.715 964 HD1 HIS 120 HD1 HIS 120 -0.809 -4.331 -17.999 965 HD2 HIS 120 HD2 HIS 120 0.144 -3.441 -21.970 966 HE1 HIS 120 HE1 HIS 120 0.545 -6.267 -18.890 967 H ALA 121 H ALA 121 -2.123 0.566 -18.186 968 HA ALA 121 HA ALA 121 -2.673 2.271 -20.440 969 HB1 ALA 121 HB1 ALA 121 -4.238 2.028 -18.610 970 HB2 ALA 121 HB2 ALA 121 -3.052 2.692 -17.464 971 HB3 ALA 121 HB3 ALA 121 -3.726 3.726 -18.746 972 H ALA 122 H ALA 122 -0.321 2.389 -17.762 973 HA ALA 122 HA ALA 122 0.623 5.042 -18.305 974 HB1 ALA 122 HB1 ALA 122 2.117 2.705 -17.129 975 HB2 ALA 122 HB2 ALA 122 2.532 4.425 -16.982 976 HB3 ALA 122 HB3 ALA 122 1.045 3.801 -16.229 977 H LYS 123 H LYS 123 1.681 1.784 -19.382 978 HA LYS 123 HA LYS 123 3.919 2.722 -20.913 979 HB2 LYS 123 HB2 LYS 123 2.224 0.220 -20.895 980 HB3 LYS 123 HB3 LYS 123 3.432 0.450 -22.165 981 HG2 LYS 123 HG2 LYS 123 5.182 0.091 -20.783 982 HG3 LYS 123 HG3 LYS 123 4.423 0.926 -19.419 983 HD2 LYS 123 HD2 LYS 123 4.691 -1.418 -18.873 984 HD3 LYS 123 HD3 LYS 123 2.981 -1.030 -19.022 985 HE2 LYS 123 HE2 LYS 123 2.941 -2.014 -21.289 986 HE3 LYS 123 HE3 LYS 123 4.659 -2.452 -21.109 987 HZ1 LYS 123 HZ1 LYS 123 2.604 -3.290 -19.146 988 HZ2 LYS 123 HZ2 LYS 123 4.117 -3.907 -19.354 989 HZ3 LYS 123 HZ3 LYS 123 2.944 -4.207 -20.481 990 H ILE 124 H ILE 124 0.475 2.370 -21.711 991 HA ILE 124 HA ILE 124 1.033 2.927 -24.539 992 HB ILE 124 HB ILE 124 -0.876 1.407 -23.516 993 HG12 ILE 124 HG12 ILE 124 -2.306 1.969 -25.569 994 HG13 ILE 124 HG13 ILE 124 -1.113 3.217 -25.932 995 HG21 ILE 124 HG21 ILE 124 -1.925 3.264 -22.208 996 HG22 ILE 124 HG22 ILE 124 -2.359 4.055 -23.734 997 HG23 ILE 124 HG23 ILE 124 -3.039 2.466 -23.322 998 HD11 ILE 124 HD11 ILE 124 -0.507 0.236 -25.649 999 HD12 ILE 124 HD12 ILE 124 -0.692 1.110 -27.186 1000 HD13 ILE 124 HD13 ILE 124 0.662 1.500 -26.104 1001 H LYS 125 H LYS 125 1.102 4.736 -21.856 1002 HA LYS 125 HA LYS 125 1.336 6.947 -21.474 1003 HB2 LYS 125 HB2 LYS 125 1.199 7.305 -24.483 1004 HB3 LYS 125 HB3 LYS 125 1.828 8.466 -23.322 1005 HG2 LYS 125 HG2 LYS 125 3.823 7.426 -23.131 1006 HG3 LYS 125 HG3 LYS 125 3.138 5.805 -23.180 1007 HD2 LYS 125 HD2 LYS 125 3.384 7.571 -25.637 1008 HD3 LYS 125 HD3 LYS 125 4.649 6.440 -25.115 1009 HE2 LYS 125 HE2 LYS 125 3.001 4.573 -25.229 1010 HE3 LYS 125 HE3 LYS 125 1.787 5.708 -25.842 1011 HZ1 LYS 125 HZ1 LYS 125 4.334 5.043 -27.180 1012 HZ2 LYS 125 HZ2 LYS 125 3.209 6.109 -27.747 1013 HZ3 LYS 125 HZ3 LYS 125 2.838 4.507 -27.626 1014 H SER 126 H SER 126 -1.354 5.813 -21.553 1015 HA SER 126 HA SER 126 -2.964 8.223 -22.268 1016 HB2 SER 126 HB2 SER 126 -3.771 5.410 -21.479 1017 HB3 SER 126 HB3 SER 126 -4.897 6.745 -21.808 1018 HG SER 126 HG SER 126 -4.564 5.454 -23.657 1019 HA PRO 127 HA PRO 127 -2.178 8.675 -17.836 1020 HB2 PRO 127 HB2 PRO 127 -2.978 11.294 -17.514 1021 HB3 PRO 127 HB3 PRO 127 -1.364 10.817 -18.127 1022 HG2 PRO 127 HG2 PRO 127 -3.815 11.589 -19.694 1023 HG3 PRO 127 HG3 PRO 127 -2.135 12.200 -19.848 1024 HD2 PRO 127 HD2 PRO 127 -3.054 10.290 -21.492 1025 HD3 PRO 127 HD3 PRO 127 -1.381 10.203 -20.838 1026 H THR 128 H THR 128 -5.194 9.953 -19.382 1027 HA THR 128 HA THR 128 -6.733 9.954 -17.019 1028 HB THR 128 HB THR 128 -7.776 9.339 -19.812 1029 HG1 THR 128 HG1 THR 128 -7.117 11.851 -18.637 1030 HG21 THR 128 HG21 THR 128 -9.477 9.272 -18.040 1031 HG22 THR 128 HG22 THR 128 -9.688 10.727 -19.037 1032 HG23 THR 128 HG23 THR 128 -8.931 10.854 -17.432 1033 H GLU 129 H GLU 129 -6.052 7.331 -19.337 1034 HA GLU 129 HA GLU 129 -7.927 5.485 -18.172 1035 HB2 GLU 129 HB2 GLU 129 -5.391 4.974 -19.768 1036 HB3 GLU 129 HB3 GLU 129 -6.634 3.770 -19.395 1037 HG2 GLU 129 HG2 GLU 129 -6.920 6.248 -21.123 1038 HG3 GLU 129 HG3 GLU 129 -6.948 4.560 -21.661 1039 H ALA 130 H ALA 130 -4.445 6.137 -17.709 1040 HA ALA 130 HA ALA 130 -4.016 4.058 -15.796 1041 HB1 ALA 130 HB1 ALA 130 -2.589 6.732 -16.101 1042 HB2 ALA 130 HB2 ALA 130 -1.976 5.292 -15.259 1043 HB3 ALA 130 HB3 ALA 130 -2.213 5.252 -17.019 1044 H GLU 131 H GLU 131 -5.130 7.441 -15.473 1045 HA GLU 131 HA GLU 131 -5.031 7.492 -12.610 1046 HB2 GLU 131 HB2 GLU 131 -6.610 9.041 -14.676 1047 HB3 GLU 131 HB3 GLU 131 -6.778 9.345 -12.941 1048 HG2 GLU 131 HG2 GLU 131 -4.428 9.881 -12.752 1049 HG3 GLU 131 HG3 GLU 131 -4.156 9.481 -14.444 1050 H LYS 132 H LYS 132 -7.568 6.443 -14.927 1051 HA LYS 132 HA LYS 132 -9.577 6.038 -12.881 1052 HB2 LYS 132 HB2 LYS 132 -9.180 4.850 -15.640 1053 HB3 LYS 132 HB3 LYS 132 -10.539 4.408 -14.599 1054 HG2 LYS 132 HG2 LYS 132 -11.260 6.769 -14.510 1055 HG3 LYS 132 HG3 LYS 132 -9.934 7.221 -15.589 1056 HD2 LYS 132 HD2 LYS 132 -12.120 5.228 -16.311 1057 HD3 LYS 132 HD3 LYS 132 -12.156 6.952 -16.733 1058 HE2 LYS 132 HE2 LYS 132 -9.999 6.673 -17.948 1059 HE3 LYS 132 HE3 LYS 132 -10.050 4.939 -17.600 1060 HZ1 LYS 132 HZ1 LYS 132 -12.066 4.781 -18.887 1061 HZ2 LYS 132 HZ2 LYS 132 -10.855 5.439 -19.797 1062 HZ3 LYS 132 HZ3 LYS 132 -12.055 6.404 -19.196 1063 H TYR 133 H TYR 133 -7.112 3.878 -14.366 1064 HA TYR 133 HA TYR 133 -7.898 1.606 -12.776 1065 HB2 TYR 133 HB2 TYR 133 -5.270 2.282 -14.134 1066 HB3 TYR 133 HB3 TYR 133 -5.633 0.728 -13.367 1067 HD1 TYR 133 HD1 TYR 133 -8.250 -0.064 -14.169 1068 HD2 TYR 133 HD2 TYR 133 -5.351 2.120 -16.471 1069 HE1 TYR 133 HE1 TYR 133 -9.338 -0.834 -16.274 1070 HE2 TYR 133 HE2 TYR 133 -6.447 1.344 -18.575 1071 HH TYR 133 HH TYR 133 -8.184 0.182 -19.494 1072 H TYR 134 H TYR 134 -5.699 4.348 -12.211 1073 HA TYR 134 HA TYR 134 -4.545 3.320 -9.791 1074 HB2 TYR 134 HB2 TYR 134 -3.495 5.208 -10.770 1075 HB3 TYR 134 HB3 TYR 134 -5.013 6.094 -10.884 1076 HD1 TYR 134 HD1 TYR 134 -2.584 4.735 -8.358 1077 HD2 TYR 134 HD2 TYR 134 -5.723 7.566 -9.192 1078 HE1 TYR 134 HE1 TYR 134 -2.194 5.833 -6.153 1079 HE2 TYR 134 HE2 TYR 134 -5.312 8.662 -6.994 1080 HH TYR 134 HH TYR 134 -2.776 7.591 -4.750 1081 H GLY 135 H GLY 135 -7.537 5.241 -10.428 1082 HA2 GLY 135 HA2 GLY 135 -8.250 5.517 -7.681 1083 HA3 GLY 135 HA3 GLY 135 -9.378 5.540 -9.053 1084 H GLN 136 H GLN 136 -8.907 2.914 -10.045 1085 HA GLN 136 HA GLN 136 -10.534 1.355 -8.237 1086 HB2 GLN 136 HB2 GLN 136 -8.862 0.567 -10.648 1087 HB3 GLN 136 HB3 GLN 136 -9.950 -0.530 -9.791 1088 HG2 GLN 136 HG2 GLN 136 -11.858 0.952 -10.317 1089 HG3 GLN 136 HG3 GLN 136 -10.775 2.025 -11.208 1090 HE21 GLN 136 HE21 GLN 136 -13.135 0.343 -12.018 1091 HE22 GLN 136 HE22 GLN 136 -12.542 -0.606 -13.359 1092 H THR 137 H THR 137 -7.031 1.562 -8.876 1093 HA THR 137 HA THR 137 -6.292 -0.692 -7.279 1094 HB THR 137 HB THR 137 -4.651 1.837 -7.792 1095 HG1 THR 137 HG1 THR 137 -5.325 0.882 -9.742 1096 HG21 THR 137 HG21 THR 137 -3.674 0.414 -6.059 1097 HG22 THR 137 HG22 THR 137 -2.739 0.283 -7.562 1098 HG23 THR 137 HG23 THR 137 -3.863 -1.017 -7.105 1099 H VAL 138 H VAL 138 -6.668 2.813 -6.463 1100 HA VAL 138 HA VAL 138 -5.843 2.597 -3.739 1101 HB VAL 138 HB VAL 138 -7.910 4.436 -5.066 1102 HG11 VAL 138 HG11 VAL 138 -6.750 4.560 -2.248 1103 HG12 VAL 138 HG12 VAL 138 -7.591 5.910 -3.042 1104 HG13 VAL 138 HG13 VAL 138 -8.460 4.403 -2.705 1105 HG21 VAL 138 HG21 VAL 138 -5.553 4.681 -5.850 1106 HG22 VAL 138 HG22 VAL 138 -6.127 6.114 -4.988 1107 HG23 VAL 138 HG23 VAL 138 -5.041 4.966 -4.181 1108 H SER 139 H SER 139 -9.072 2.118 -5.262 1109 HA SER 139 HA SER 139 -10.442 1.572 -2.811 1110 HB2 SER 139 HB2 SER 139 -11.526 2.066 -5.016 1111 HB3 SER 139 HB3 SER 139 -11.044 0.452 -5.575 1112 HG SER 139 HG SER 139 -12.244 -0.349 -3.691 1113 H ASN 140 H ASN 140 -8.706 -0.561 -5.100 1114 HA ASN 140 HA ASN 140 -9.400 -3.024 -3.790 1115 HB2 ASN 140 HB2 ASN 140 -7.346 -2.095 -5.762 1116 HB3 ASN 140 HB3 ASN 140 -7.055 -3.613 -4.915 1117 HD21 ASN 140 HD21 ASN 140 -9.046 -1.975 -7.239 1118 HD22 ASN 140 HD22 ASN 140 -9.857 -3.420 -7.801 1119 H ILE 141 H ILE 141 -6.660 -0.756 -3.372 1120 HA ILE 141 HA ILE 141 -5.206 -2.393 -1.501 1121 HB ILE 141 HB ILE 141 -5.293 0.657 -1.870 1122 HG12 ILE 141 HG12 ILE 141 -4.382 -0.854 -3.744 1123 HG13 ILE 141 HG13 ILE 141 -3.385 0.491 -3.211 1124 HG21 ILE 141 HG21 ILE 141 -3.045 0.585 -0.596 1125 HG22 ILE 141 HG22 ILE 141 -4.525 0.384 0.368 1126 HG23 ILE 141 HG23 ILE 141 -3.541 -1.032 -0.049 1127 HD11 ILE 141 HD11 ILE 141 -2.236 -1.762 -3.666 1128 HD12 ILE 141 HD12 ILE 141 -1.825 -0.927 -2.159 1129 HD13 ILE 141 HD13 ILE 141 -2.943 -2.305 -2.131 1130 H ASN 142 H ASN 142 -7.715 0.153 -1.159 1131 HA ASN 142 HA ASN 142 -7.838 0.129 1.671 1132 HB2 ASN 142 HB2 ASN 142 -8.911 1.796 0.151 1133 HB3 ASN 142 HB3 ASN 142 -10.130 0.586 -0.267 1134 HD21 ASN 142 HD21 ASN 142 -8.941 2.745 2.188 1135 HD22 ASN 142 HD22 ASN 142 -10.318 2.591 3.252 1136 H GLU 143 H GLU 143 -9.595 -1.957 -0.694 1137 HA GLU 143 HA GLU 143 -11.266 -3.187 1.245 1138 HB2 GLU 143 HB2 GLU 143 -10.105 -4.236 -1.359 1139 HB3 GLU 143 HB3 GLU 143 -11.247 -5.154 -0.382 1140 HG2 GLU 143 HG2 GLU 143 -12.966 -3.449 -0.719 1141 HG3 GLU 143 HG3 GLU 143 -11.841 -2.506 -1.706 1142 H VAL 144 H VAL 144 -8.032 -4.123 0.078 1143 HA VAL 144 HA VAL 144 -7.965 -6.524 1.696 1144 HB VAL 144 HB VAL 144 -5.711 -4.881 0.430 1145 HG11 VAL 144 HG11 VAL 144 -4.780 -6.212 2.263 1146 HG12 VAL 144 HG12 VAL 144 -5.638 -7.663 1.693 1147 HG13 VAL 144 HG13 VAL 144 -4.331 -6.952 0.716 1148 HG21 VAL 144 HG21 VAL 144 -7.111 -7.450 -0.437 1149 HG22 VAL 144 HG22 VAL 144 -7.263 -5.860 -1.218 1150 HG23 VAL 144 HG23 VAL 144 -5.714 -6.722 -1.254 1151 H LEU 145 H LEU 145 -7.152 -3.107 2.183 1152 HA LEU 145 HA LEU 145 -5.587 -3.547 4.580 1153 HB2 LEU 145 HB2 LEU 145 -6.624 -1.269 3.067 1154 HB3 LEU 145 HB3 LEU 145 -6.734 -1.006 4.800 1155 HG LEU 145 HG LEU 145 -4.329 -1.378 5.055 1156 HD11 LEU 145 HD11 LEU 145 -3.882 -2.969 3.273 1157 HD12 LEU 145 HD12 LEU 145 -2.864 -1.534 3.086 1158 HD13 LEU 145 HD13 LEU 145 -4.288 -1.750 2.048 1159 HD21 LEU 145 HD21 LEU 145 -5.168 0.885 4.587 1160 HD22 LEU 145 HD22 LEU 145 -4.999 0.595 2.839 1161 HD23 LEU 145 HD23 LEU 145 -3.556 0.642 3.879 1162 H ALA 146 H ALA 146 -9.042 -2.950 3.974 1163 HA ALA 146 HA ALA 146 -9.741 -2.640 6.741 1164 HB1 ALA 146 HB1 ALA 146 -11.414 -3.643 4.386 1165 HB2 ALA 146 HB2 ALA 146 -12.048 -3.069 5.947 1166 HB3 ALA 146 HB3 ALA 146 -11.205 -1.940 4.860 1167 H LYS 147 H LYS 147 -9.271 -5.490 4.679 1168 HA LYS 147 HA LYS 147 -10.400 -7.322 6.665 1169 HB2 LYS 147 HB2 LYS 147 -8.666 -7.756 4.214 1170 HB3 LYS 147 HB3 LYS 147 -9.234 -9.053 5.266 1171 HG2 LYS 147 HG2 LYS 147 -11.600 -8.254 4.813 1172 HG3 LYS 147 HG3 LYS 147 -10.916 -7.188 3.576 1173 HD2 LYS 147 HD2 LYS 147 -11.607 -9.147 2.420 1174 HD3 LYS 147 HD3 LYS 147 -9.844 -9.258 2.550 1175 HE2 LYS 147 HE2 LYS 147 -10.736 -11.422 3.054 1176 HE3 LYS 147 HE3 LYS 147 -10.163 -10.733 4.582 1177 HZ1 LYS 147 HZ1 LYS 147 -12.970 -10.857 3.644 1178 HZ2 LYS 147 HZ2 LYS 147 -12.491 -10.061 5.010 1179 HZ3 LYS 147 HZ3 LYS 147 -12.314 -11.697 4.904 1180 H LEU 148 H LEU 148 -7.445 -5.646 6.366 1181 HA LEU 148 HA LEU 148 -6.102 -7.557 8.233 1182 HB2 LEU 148 HB2 LEU 148 -4.946 -5.442 6.387 1183 HB3 LEU 148 HB3 LEU 148 -4.013 -6.466 7.470 1184 HG LEU 148 HG LEU 148 -5.610 -7.413 5.081 1185 HD11 LEU 148 HD11 LEU 148 -3.406 -7.829 4.097 1186 HD12 LEU 148 HD12 LEU 148 -2.609 -7.222 5.567 1187 HD13 LEU 148 HD13 LEU 148 -3.565 -6.122 4.544 1188 HD21 LEU 148 HD21 LEU 148 -4.388 -9.579 5.496 1189 HD22 LEU 148 HD22 LEU 148 -5.634 -9.181 6.694 1190 HD23 LEU 148 HD23 LEU 148 -3.919 -8.929 7.087 1191 H GLY 149 H GLY 149 -8.085 -5.156 8.646 1192 HA2 GLY 149 HA2 GLY 149 -6.679 -2.981 9.722 1193 HA3 GLY 149 HA3 GLY 149 -8.316 -3.459 10.178 Start of MODEL 20 1 H1 GLU 1 H1 GLU 1 -8.708 10.769 -6.119 2 H2 GLU 1 H2 GLU 1 -8.067 10.219 -4.697 3 H3 GLU 1 H3 GLU 1 -9.346 11.262 -4.674 4 HA GLU 1 HA GLU 1 -6.602 11.864 -5.572 5 HB2 GLU 1 HB2 GLU 1 -9.222 13.212 -5.988 6 HB3 GLU 1 HB3 GLU 1 -7.907 14.267 -5.453 7 HG2 GLU 1 HG2 GLU 1 -8.268 14.021 -7.977 8 HG3 GLU 1 HG3 GLU 1 -6.615 13.849 -7.358 9 H ALA 2 H ALA 2 -5.299 12.647 -4.017 10 HA ALA 2 HA ALA 2 -6.328 14.114 -1.729 11 HB1 ALA 2 HB1 ALA 2 -5.049 11.349 -1.317 12 HB2 ALA 2 HB2 ALA 2 -5.407 12.525 -0.030 13 HB3 ALA 2 HB3 ALA 2 -6.737 11.771 -0.935 14 H ARG 3 H ARG 3 -4.316 14.757 -0.402 15 HA ARG 3 HA ARG 3 -1.738 14.190 -1.672 16 HB2 ARG 3 HB2 ARG 3 -1.053 16.511 -1.899 17 HB3 ARG 3 HB3 ARG 3 -2.480 16.231 -2.903 18 HG2 ARG 3 HG2 ARG 3 -3.900 17.335 -1.219 19 HG3 ARG 3 HG3 ARG 3 -2.484 17.566 -0.178 20 HD2 ARG 3 HD2 ARG 3 -1.411 18.910 -1.971 21 HD3 ARG 3 HD3 ARG 3 -2.904 18.776 -2.927 22 HE ARG 3 HE ARG 3 -3.644 19.742 -0.394 23 HH11 ARG 3 HH11 ARG 3 -1.641 20.910 -3.058 24 HH12 ARG 3 HH12 ARG 3 -1.923 22.582 -2.657 25 HH21 ARG 3 HH21 ARG 3 -3.959 21.897 0.054 26 HH22 ARG 3 HH22 ARG 3 -3.210 23.126 -0.927 27 HA PRO 4 HA PRO 4 -1.123 14.204 2.666 28 HB2 PRO 4 HB2 PRO 4 1.575 14.169 2.928 29 HB3 PRO 4 HB3 PRO 4 0.673 12.811 2.187 30 HG2 PRO 4 HG2 PRO 4 2.117 15.079 0.824 31 HG3 PRO 4 HG3 PRO 4 2.221 13.321 0.500 32 HD2 PRO 4 HD2 PRO 4 0.647 15.016 -0.944 33 HD3 PRO 4 HD3 PRO 4 0.209 13.299 -0.644 34 H ILE 5 H ILE 5 -2.048 16.204 3.296 35 HA ILE 5 HA ILE 5 -0.085 18.062 4.380 36 HB ILE 5 HB ILE 5 -0.489 18.953 2.005 37 HG12 ILE 5 HG12 ILE 5 -1.027 21.312 2.726 38 HG13 ILE 5 HG13 ILE 5 -1.364 20.699 4.340 39 HG21 ILE 5 HG21 ILE 5 -3.290 19.603 3.044 40 HG22 ILE 5 HG22 ILE 5 -2.608 20.019 1.459 41 HG23 ILE 5 HG23 ILE 5 -2.922 18.317 1.874 42 HD11 ILE 5 HD11 ILE 5 1.310 20.459 2.915 43 HD12 ILE 5 HD12 ILE 5 0.895 21.683 4.135 44 HD13 ILE 5 HD13 ILE 5 0.956 19.971 4.589 45 H VAL 6 H VAL 6 -0.892 19.113 6.169 46 HA VAL 6 HA VAL 6 -3.797 18.823 6.757 47 HB VAL 6 HB VAL 6 -1.494 18.625 8.777 48 HG11 VAL 6 HG11 VAL 6 -3.294 18.151 10.422 49 HG12 VAL 6 HG12 VAL 6 -3.468 19.765 9.708 50 HG13 VAL 6 HG13 VAL 6 -4.518 18.432 9.163 51 HG21 VAL 6 HG21 VAL 6 -1.666 16.526 7.538 52 HG22 VAL 6 HG22 VAL 6 -2.324 16.294 9.164 53 HG23 VAL 6 HG23 VAL 6 -3.428 16.483 7.779 54 H VAL 7 H VAL 7 -4.482 20.904 6.461 55 HA VAL 7 HA VAL 7 -2.983 23.085 7.730 56 HB VAL 7 HB VAL 7 -1.906 22.780 5.445 57 HG11 VAL 7 HG11 VAL 7 -3.120 23.403 3.421 58 HG12 VAL 7 HG12 VAL 7 -3.922 22.027 4.207 59 HG13 VAL 7 HG13 VAL 7 -4.613 23.660 4.351 60 HG21 VAL 7 HG21 VAL 7 -1.860 25.119 4.860 61 HG22 VAL 7 HG22 VAL 7 -3.400 25.420 5.691 62 HG23 VAL 7 HG23 VAL 7 -1.943 24.982 6.624 63 H GLY 8 H GLY 8 -4.296 24.961 7.933 64 HA2 GLY 8 HA2 GLY 8 -7.205 24.426 7.502 65 HA3 GLY 8 HA3 GLY 8 -6.542 25.334 8.865 66 HA PRO 9 HA PRO 9 -6.900 28.987 6.483 67 HB2 PRO 9 HB2 PRO 9 -4.555 30.379 6.474 68 HB3 PRO 9 HB3 PRO 9 -5.475 30.109 7.990 69 HG2 PRO 9 HG2 PRO 9 -3.159 28.550 6.881 70 HG3 PRO 9 HG3 PRO 9 -3.346 29.286 8.506 71 HD2 PRO 9 HD2 PRO 9 -3.884 26.686 8.073 72 HD3 PRO 9 HD3 PRO 9 -4.901 27.665 9.186 73 HA PRO 10 HA PRO 10 -5.552 28.279 2.322 74 HB2 PRO 10 HB2 PRO 10 -5.304 30.755 1.168 75 HB3 PRO 10 HB3 PRO 10 -6.900 30.048 1.581 76 HG2 PRO 10 HG2 PRO 10 -5.220 31.971 3.176 77 HG3 PRO 10 HG3 PRO 10 -6.946 32.107 2.702 78 HD2 PRO 10 HD2 PRO 10 -6.253 31.198 5.130 79 HD3 PRO 10 HD3 PRO 10 -7.611 30.440 4.226 80 HA PRO 11 HA PRO 11 -1.196 28.507 2.542 81 HB2 PRO 11 HB2 PRO 11 -0.326 28.478 -0.063 82 HB3 PRO 11 HB3 PRO 11 -1.084 27.054 0.721 83 HG2 PRO 11 HG2 PRO 11 -2.369 29.155 -1.013 84 HG3 PRO 11 HG3 PRO 11 -2.419 27.369 -1.182 85 HD2 PRO 11 HD2 PRO 11 -4.423 28.678 0.019 86 HD3 PRO 11 HD3 PRO 11 -3.828 27.120 0.694 87 HA PRO 12 HA PRO 12 -0.043 32.725 2.277 88 HB2 PRO 12 HB2 PRO 12 2.686 32.671 2.235 89 HB3 PRO 12 HB3 PRO 12 1.743 32.162 3.672 90 HG2 PRO 12 HG2 PRO 12 2.885 30.449 1.472 91 HG3 PRO 12 HG3 PRO 12 3.093 30.286 3.247 92 HD2 PRO 12 HD2 PRO 12 1.253 28.842 1.930 93 HD3 PRO 12 HD3 PRO 12 0.887 29.537 3.548 94 H LEU 13 H LEU 13 0.956 34.402 0.976 95 HA LEU 13 HA LEU 13 0.532 34.015 -1.821 96 HB2 LEU 13 HB2 LEU 13 0.961 36.158 0.011 97 HB3 LEU 13 HB3 LEU 13 2.139 36.346 -1.283 98 HG LEU 13 HG LEU 13 -0.854 36.059 -1.729 99 HD11 LEU 13 HD11 LEU 13 -0.827 38.493 -2.132 100 HD12 LEU 13 HD12 LEU 13 0.895 38.556 -1.687 101 HD13 LEU 13 HD13 LEU 13 -0.329 38.111 -0.472 102 HD21 LEU 13 HD21 LEU 13 1.403 36.916 -3.593 103 HD22 LEU 13 HD22 LEU 13 -0.333 36.955 -3.985 104 HD23 LEU 13 HD23 LEU 13 0.476 35.404 -3.692 105 H SER 14 H SER 14 3.332 33.444 0.112 106 HA SER 14 HA SER 14 4.867 32.777 -2.300 107 HB2 SER 14 HB2 SER 14 5.478 35.160 -1.861 108 HB3 SER 14 HB3 SER 14 5.936 34.719 -0.203 109 HG SER 14 HG SER 14 7.723 34.771 -1.662 110 H GLY 15 H GLY 15 6.471 31.214 -1.800 111 HA2 GLY 15 HA2 GLY 15 7.718 30.156 0.167 112 HA3 GLY 15 HA3 GLY 15 6.107 29.985 0.898 113 H GLY 16 H GLY 16 7.089 27.616 0.748 114 HA2 GLY 16 HA2 GLY 16 5.535 26.027 -0.823 115 HA3 GLY 16 HA3 GLY 16 6.892 26.420 -1.907 116 H LEU 17 H LEU 17 6.915 23.933 -1.546 117 HA LEU 17 HA LEU 17 8.090 22.100 -0.869 118 HB2 LEU 17 HB2 LEU 17 9.889 24.315 -0.041 119 HB3 LEU 17 HB3 LEU 17 10.141 22.791 0.785 120 HG LEU 17 HG LEU 17 10.389 21.674 -1.446 121 HD11 LEU 17 HD11 LEU 17 10.388 24.547 -2.470 122 HD12 LEU 17 HD12 LEU 17 9.218 23.278 -2.892 123 HD13 LEU 17 HD13 LEU 17 10.911 23.130 -3.408 124 HD21 LEU 17 HD21 LEU 17 12.288 23.971 -0.832 125 HD22 LEU 17 HD22 LEU 17 12.670 22.534 -1.812 126 HD23 LEU 17 HD23 LEU 17 12.314 22.358 -0.080 127 HA PRO 18 HA PRO 18 6.449 21.071 3.008 128 HB2 PRO 18 HB2 PRO 18 8.029 19.121 4.094 129 HB3 PRO 18 HB3 PRO 18 6.987 18.821 2.666 130 HG2 PRO 18 HG2 PRO 18 9.917 19.501 2.758 131 HG3 PRO 18 HG3 PRO 18 9.095 18.168 1.883 132 HD2 PRO 18 HD2 PRO 18 9.760 20.474 0.647 133 HD3 PRO 18 HD3 PRO 18 8.228 19.620 0.260 134 H GLY 19 H GLY 19 6.602 21.667 5.219 135 HA2 GLY 19 HA2 GLY 19 9.150 22.558 6.324 136 HA3 GLY 19 HA3 GLY 19 8.059 23.879 5.851 137 H THR 20 H THR 20 8.212 24.285 8.253 138 HA THR 20 HA THR 20 7.118 22.453 10.125 139 HB THR 20 HB THR 20 8.617 24.404 10.662 140 HG1 THR 20 HG1 THR 20 6.149 24.030 12.017 141 HG21 THR 20 HG21 THR 20 6.053 26.046 10.470 142 HG22 THR 20 HG22 THR 20 7.410 26.141 9.319 143 HG23 THR 20 HG23 THR 20 7.646 26.610 11.015 144 H GLU 21 H GLU 21 5.381 24.035 7.732 145 HA GLU 21 HA GLU 21 2.970 24.774 9.074 146 HB2 GLU 21 HB2 GLU 21 3.576 25.304 6.699 147 HB3 GLU 21 HB3 GLU 21 3.373 23.599 6.292 148 HG2 GLU 21 HG2 GLU 21 0.983 23.738 6.920 149 HG3 GLU 21 HG3 GLU 21 1.196 25.453 7.318 150 H ASN 22 H ASN 22 4.206 21.689 7.776 151 HA ASN 22 HA ASN 22 2.518 20.206 9.637 152 HB2 ASN 22 HB2 ASN 22 0.940 20.471 7.773 153 HB3 ASN 22 HB3 ASN 22 2.155 19.858 6.644 154 HD21 ASN 22 HD21 ASN 22 1.224 18.008 5.977 155 HD22 ASN 22 HD22 ASN 22 0.885 16.664 7.059 156 H SER 23 H SER 23 3.569 18.379 10.232 157 HA SER 23 HA SER 23 6.275 18.077 9.233 158 HB2 SER 23 HB2 SER 23 5.605 17.935 11.627 159 HB3 SER 23 HB3 SER 23 4.758 16.417 11.274 160 HG SER 23 HG SER 23 6.866 16.044 12.053 161 H ASP 24 H ASP 24 3.325 15.997 9.001 162 HA ASP 24 HA ASP 24 4.995 13.803 8.020 163 HB2 ASP 24 HB2 ASP 24 3.121 12.412 8.238 164 HB3 ASP 24 HB3 ASP 24 3.046 13.525 9.610 165 H GLN 25 H GLN 25 4.531 16.303 6.330 166 HA GLN 25 HA GLN 25 2.904 15.672 4.108 167 HB2 GLN 25 HB2 GLN 25 5.487 17.268 4.241 168 HB3 GLN 25 HB3 GLN 25 4.435 17.190 2.822 169 HG2 GLN 25 HG2 GLN 25 2.586 18.111 4.181 170 HG3 GLN 25 HG3 GLN 25 3.707 18.293 5.534 171 HE21 GLN 25 HE21 GLN 25 4.222 20.368 5.762 172 HE22 GLN 25 HE22 GLN 25 4.545 21.480 4.442 173 H ALA 26 H ALA 26 6.284 14.747 4.748 174 HA ALA 26 HA ALA 26 7.795 13.528 3.480 175 HB1 ALA 26 HB1 ALA 26 5.297 11.822 3.080 176 HB2 ALA 26 HB2 ALA 26 6.983 11.267 2.933 177 HB3 ALA 26 HB3 ALA 26 6.349 11.790 4.514 178 H ARG 27 H ARG 27 6.996 15.670 1.977 179 HA ARG 27 HA ARG 27 5.773 14.917 -0.511 180 HB2 ARG 27 HB2 ARG 27 5.667 17.189 0.585 181 HB3 ARG 27 HB3 ARG 27 7.341 17.444 0.100 182 HG2 ARG 27 HG2 ARG 27 6.000 16.615 -2.253 183 HG3 ARG 27 HG3 ARG 27 4.880 17.726 -1.447 184 HD2 ARG 27 HD2 ARG 27 6.332 18.937 -3.004 185 HD3 ARG 27 HD3 ARG 27 6.673 19.435 -1.331 186 HE ARG 27 HE ARG 27 8.436 17.331 -1.842 187 HH11 ARG 27 HH11 ARG 27 7.900 20.502 -3.317 188 HH12 ARG 27 HH12 ARG 27 9.572 20.659 -3.786 189 HH21 ARG 27 HH21 ARG 27 10.508 17.593 -2.462 190 HH22 ARG 27 HH22 ARG 27 11.029 19.022 -3.319 191 H ASP 28 H ASP 28 6.876 13.326 -1.439 192 HA ASP 28 HA ASP 28 8.313 12.326 -2.878 193 HB2 ASP 28 HB2 ASP 28 8.357 14.812 -3.858 194 HB3 ASP 28 HB3 ASP 28 10.039 14.737 -3.306 195 H GLY 29 H GLY 29 10.858 11.926 -3.166 196 HA2 GLY 29 HA2 GLY 29 12.793 11.225 -2.032 197 HA3 GLY 29 HA3 GLY 29 12.331 12.236 -0.640 198 H THR 30 H THR 30 10.066 10.065 -2.112 199 HA THR 30 HA THR 30 9.349 8.806 0.304 200 HB THR 30 HB THR 30 8.934 7.741 -2.525 201 HG1 THR 30 HG1 THR 30 7.521 9.724 -1.037 202 HG21 THR 30 HG21 THR 30 6.797 6.945 -1.587 203 HG22 THR 30 HG22 THR 30 7.275 7.538 0.017 204 HG23 THR 30 HG23 THR 30 8.181 6.215 -0.760 205 H LEU 31 H LEU 31 9.902 6.929 1.287 206 HA LEU 31 HA LEU 31 11.992 5.228 0.037 207 HB2 LEU 31 HB2 LEU 31 13.207 5.256 2.228 208 HB3 LEU 31 HB3 LEU 31 13.225 6.763 1.342 209 HG LEU 31 HG LEU 31 11.351 7.544 2.943 210 HD11 LEU 31 HD11 LEU 31 10.803 5.442 4.047 211 HD12 LEU 31 HD12 LEU 31 11.530 6.551 5.220 212 HD13 LEU 31 HD13 LEU 31 12.496 5.220 4.542 213 HD21 LEU 31 HD21 LEU 31 14.203 7.064 3.890 214 HD22 LEU 31 HD22 LEU 31 13.074 8.273 4.548 215 HD23 LEU 31 HD23 LEU 31 13.637 8.412 2.872 216 HA PRO 32 HA PRO 32 9.429 2.031 1.498 217 HB2 PRO 32 HB2 PRO 32 11.102 -0.051 2.042 218 HB3 PRO 32 HB3 PRO 32 10.930 0.614 0.390 219 HG2 PRO 32 HG2 PRO 32 13.002 1.258 2.469 220 HG3 PRO 32 HG3 PRO 32 13.238 0.720 0.774 221 HD2 PRO 32 HD2 PRO 32 13.329 3.324 1.434 222 HD3 PRO 32 HD3 PRO 32 12.560 2.790 -0.099 223 H TYR 33 H TYR 33 9.352 0.149 3.332 224 HA TYR 33 HA TYR 33 8.649 1.341 5.723 225 HB2 TYR 33 HB2 TYR 33 8.321 -1.077 4.821 226 HB3 TYR 33 HB3 TYR 33 9.848 -1.446 5.619 227 HD1 TYR 33 HD2 TYR 33 9.813 -0.395 8.258 228 HD2 TYR 33 HD1 TYR 33 6.430 -1.780 5.978 229 HE1 TYR 33 HE2 TYR 33 8.566 -0.854 10.369 230 HE2 TYR 33 HE1 TYR 33 5.200 -2.196 8.103 231 HH TYR 33 HH TYR 33 6.615 -1.688 11.304 232 H THR 34 H THR 34 11.775 -0.216 5.001 233 HA THR 34 HA THR 34 13.882 0.041 5.753 234 HB THR 34 HB THR 34 13.015 2.729 6.898 235 HG1 THR 34 HG1 THR 34 12.424 2.748 4.773 236 HG21 THR 34 HG21 THR 34 15.345 3.359 6.319 237 HG22 THR 34 HG22 THR 34 15.677 1.675 5.857 238 HG23 THR 34 HG23 THR 34 15.294 2.078 7.550 239 H LYS 35 H LYS 35 11.731 1.135 8.379 240 HA LYS 35 HA LYS 35 13.466 0.494 10.567 241 HB2 LYS 35 HB2 LYS 35 10.428 0.442 10.467 242 HB3 LYS 35 HB3 LYS 35 11.421 0.670 11.909 243 HG2 LYS 35 HG2 LYS 35 12.112 2.872 11.156 244 HG3 LYS 35 HG3 LYS 35 11.414 2.600 9.554 245 HD2 LYS 35 HD2 LYS 35 9.154 2.318 10.735 246 HD3 LYS 35 HD3 LYS 35 9.949 3.019 12.161 247 HE2 LYS 35 HE2 LYS 35 8.876 4.825 10.983 248 HE3 LYS 35 HE3 LYS 35 10.620 4.986 10.697 249 HZ1 LYS 35 HZ1 LYS 35 10.261 3.868 8.527 250 HZ2 LYS 35 HZ2 LYS 35 9.406 5.276 8.635 251 HZ3 LYS 35 HZ3 LYS 35 8.637 3.827 8.801 252 H ASP 36 H ASP 36 11.622 -1.396 8.399 253 HA ASP 36 HA ASP 36 10.983 -3.698 9.883 254 HB2 ASP 36 HB2 ASP 36 10.304 -3.041 7.517 255 HB3 ASP 36 HB3 ASP 36 11.894 -3.607 6.993 256 H ARG 37 H ARG 37 14.121 -2.524 8.818 257 HA ARG 37 HA ARG 37 15.451 -5.054 8.729 258 HB2 ARG 37 HB2 ARG 37 16.261 -2.708 7.997 259 HB3 ARG 37 HB3 ARG 37 16.742 -2.478 9.682 260 HG2 ARG 37 HG2 ARG 37 17.654 -4.979 8.308 261 HG3 ARG 37 HG3 ARG 37 18.384 -3.460 7.773 262 HD2 ARG 37 HD2 ARG 37 19.254 -2.988 9.949 263 HD3 ARG 37 HD3 ARG 37 18.282 -4.258 10.702 264 HE ARG 37 HE ARG 37 20.781 -4.587 9.202 265 HH11 ARG 37 HH21 ARG 37 17.997 -6.268 10.631 266 HH12 ARG 37 HH22 ARG 37 18.827 -7.805 10.614 267 HH21 ARG 37 HH11 ARG 37 21.751 -6.583 9.246 268 HH22 ARG 37 HH12 ARG 37 20.898 -7.976 9.849 269 H PHE 38 H PHE 38 14.355 -3.109 11.454 270 HA PHE 38 HA PHE 38 16.047 -4.529 13.381 271 HB2 PHE 38 HB2 PHE 38 13.568 -2.826 13.815 272 HB3 PHE 38 HB3 PHE 38 14.717 -3.339 15.055 273 HD1 PHE 38 HD1 PHE 38 17.312 -2.731 14.323 274 HD2 PHE 38 HD2 PHE 38 13.754 -0.614 13.147 275 HE1 PHE 38 HE1 PHE 38 18.675 -0.691 13.890 276 HE2 PHE 38 HE2 PHE 38 15.107 1.431 12.709 277 HZ PHE 38 HZ PHE 38 17.574 1.397 13.080 278 H TYR 39 H TYR 39 13.139 -5.142 11.692 279 HA TYR 39 HA TYR 39 12.304 -7.240 13.646 280 HB2 TYR 39 HB2 TYR 39 10.583 -5.777 11.622 281 HB3 TYR 39 HB3 TYR 39 10.044 -6.855 12.918 282 HD1 TYR 39 HD2 TYR 39 10.588 -6.098 15.378 283 HD2 TYR 39 HD1 TYR 39 10.710 -3.445 11.995 284 HE1 TYR 39 HE2 TYR 39 10.423 -4.131 16.905 285 HE2 TYR 39 HE1 TYR 39 10.555 -1.484 13.530 286 HH TYR 39 HH TYR 39 10.342 -1.855 17.070 287 H LEU 40 H LEU 40 14.271 -7.292 11.365 288 HA LEU 40 HA LEU 40 12.971 -8.649 9.166 289 HB2 LEU 40 HB2 LEU 40 15.242 -7.208 9.441 290 HB3 LEU 40 HB3 LEU 40 15.915 -8.831 9.514 291 HG LEU 40 HG LEU 40 14.808 -9.319 7.306 292 HD11 LEU 40 HD11 LEU 40 14.232 -6.319 7.342 293 HD12 LEU 40 HD12 LEU 40 13.024 -7.616 7.313 294 HD13 LEU 40 HD13 LEU 40 14.090 -7.375 5.918 295 HD21 LEU 40 HD21 LEU 40 17.177 -8.681 7.485 296 HD22 LEU 40 HD22 LEU 40 16.732 -6.960 7.389 297 HD23 LEU 40 HD23 LEU 40 16.457 -8.033 5.999 298 H GLN 41 H GLN 41 13.557 -9.787 12.162 299 HA GLN 41 HA GLN 41 14.720 -12.401 11.620 300 HB2 GLN 41 HB2 GLN 41 12.883 -11.445 13.873 301 HB3 GLN 41 HB3 GLN 41 13.813 -12.935 13.870 302 HG2 GLN 41 HG2 GLN 41 15.220 -11.676 15.142 303 HG3 GLN 41 HG3 GLN 41 15.873 -11.262 13.552 304 HE21 GLN 41 HE21 GLN 41 16.255 -9.620 15.775 305 HE22 GLN 41 HE22 GLN 41 15.355 -8.137 15.530 306 HA PRO 42 HA PRO 42 10.927 -14.157 10.116 307 HB2 PRO 42 HB2 PRO 42 10.514 -16.501 11.503 308 HB3 PRO 42 HB3 PRO 42 11.719 -16.353 10.183 309 HG2 PRO 42 HG2 PRO 42 12.143 -16.141 13.161 310 HG3 PRO 42 HG3 PRO 42 13.044 -17.124 11.961 311 HD2 PRO 42 HD2 PRO 42 13.988 -14.751 12.797 312 HD3 PRO 42 HD3 PRO 42 14.138 -15.239 11.074 313 H LEU 43 H LEU 43 8.890 -13.550 10.617 314 HA LEU 43 HA LEU 43 8.275 -12.936 13.479 315 HB2 LEU 43 HB2 LEU 43 8.521 -11.255 11.134 316 HB3 LEU 43 HB3 LEU 43 6.845 -11.248 11.667 317 HG LEU 43 HG LEU 43 7.540 -10.463 13.895 318 HD11 LEU 43 HD11 LEU 43 9.812 -11.388 14.043 319 HD12 LEU 43 HD12 LEU 43 9.846 -9.627 14.253 320 HD13 LEU 43 HD13 LEU 43 10.340 -10.345 12.703 321 HD21 LEU 43 HD21 LEU 43 6.970 -8.913 12.004 322 HD22 LEU 43 HD22 LEU 43 8.712 -8.757 11.669 323 HD23 LEU 43 HD23 LEU 43 8.044 -8.204 13.225 324 HA PRO 44 HA PRO 44 4.692 -15.292 12.642 325 HB2 PRO 44 HB2 PRO 44 2.752 -14.197 14.235 326 HB3 PRO 44 HB3 PRO 44 4.140 -15.110 14.911 327 HG2 PRO 44 HG2 PRO 44 3.817 -12.149 14.574 328 HG3 PRO 44 HG3 PRO 44 4.267 -13.072 16.042 329 HD2 PRO 44 HD2 PRO 44 6.135 -11.928 14.489 330 HD3 PRO 44 HD3 PRO 44 6.416 -13.543 15.220 331 HA PRO 45 HA PRO 45 2.547 -13.263 9.418 332 HB2 PRO 45 HB2 PRO 45 0.032 -14.383 9.434 333 HB3 PRO 45 HB3 PRO 45 1.503 -15.262 8.911 334 HG2 PRO 45 HG2 PRO 45 0.193 -15.270 11.607 335 HG3 PRO 45 HG3 PRO 45 0.643 -16.661 10.566 336 HD2 PRO 45 HD2 PRO 45 2.247 -15.895 12.535 337 HD3 PRO 45 HD3 PRO 45 2.947 -16.314 10.929 338 H THR 46 H THR 46 1.182 -13.027 12.635 339 HA THR 46 HA THR 46 -0.832 -11.047 12.056 340 HB THR 46 HB THR 46 -0.353 -10.530 14.581 341 HG1 THR 46 HG1 THR 46 0.972 -11.965 15.582 342 HG21 THR 46 HG21 THR 46 -1.535 -12.568 15.293 343 HG22 THR 46 HG22 THR 46 -1.161 -13.349 13.740 344 HG23 THR 46 HG23 THR 46 -2.245 -11.935 13.792 345 H GLU 47 H GLU 47 2.623 -10.905 13.045 346 HA GLU 47 HA GLU 47 2.582 -7.991 13.113 347 HB2 GLU 47 HB2 GLU 47 4.823 -10.026 13.219 348 HB3 GLU 47 HB3 GLU 47 5.066 -8.274 13.325 349 HG2 GLU 47 HG2 GLU 47 3.579 -8.209 15.306 350 HG3 GLU 47 HG3 GLU 47 3.438 -9.973 15.233 351 H ALA 48 H ALA 48 3.266 -10.476 10.726 352 HA ALA 48 HA ALA 48 4.698 -8.838 8.862 353 HB1 ALA 48 HB1 ALA 48 4.059 -10.528 7.202 354 HB2 ALA 48 HB2 ALA 48 4.543 -11.323 8.720 355 HB3 ALA 48 HB3 ALA 48 2.818 -11.176 8.301 356 H ALA 49 H ALA 49 1.357 -8.866 9.858 357 HA ALA 49 HA ALA 49 0.176 -7.745 7.518 358 HB1 ALA 49 HB1 ALA 49 -1.645 -7.068 8.983 359 HB2 ALA 49 HB2 ALA 49 -1.092 -8.689 9.461 360 HB3 ALA 49 HB3 ALA 49 -0.615 -7.269 10.419 361 H GLN 50 H GLN 50 2.147 -6.319 10.098 362 HA GLN 50 HA GLN 50 1.461 -3.581 9.612 363 HB2 GLN 50 HB2 GLN 50 4.126 -4.761 10.492 364 HB3 GLN 50 HB3 GLN 50 3.656 -3.065 10.622 365 HG2 GLN 50 HG2 GLN 50 1.838 -3.710 12.181 366 HG3 GLN 50 HG3 GLN 50 2.372 -5.397 12.077 367 HE21 GLN 50 HE21 GLN 50 4.134 -6.071 13.236 368 HE22 GLN 50 HE22 GLN 50 5.020 -5.031 14.325 369 H ARG 51 H ARG 51 4.041 -5.686 8.284 370 HA ARG 51 HA ARG 51 5.218 -3.738 6.563 371 HB2 ARG 51 HB2 ARG 51 4.947 -6.747 6.212 372 HB3 ARG 51 HB3 ARG 51 6.029 -5.720 5.287 373 HG2 ARG 51 HG2 ARG 51 7.377 -5.257 7.244 374 HG3 ARG 51 HG3 ARG 51 6.219 -6.127 8.287 375 HD2 ARG 51 HD2 ARG 51 6.559 -8.164 6.964 376 HD3 ARG 51 HD3 ARG 51 7.737 -7.324 5.949 377 HE ARG 51 HE ARG 51 8.794 -7.037 8.464 378 HH11 ARG 51 HH21 ARG 51 7.755 -9.813 6.523 379 HH12 ARG 51 HH22 ARG 51 8.911 -10.884 7.287 380 HH21 ARG 51 HH11 ARG 51 10.211 -8.470 9.413 381 HH22 ARG 51 HH12 ARG 51 10.272 -10.135 8.900 382 H ALA 52 H ALA 52 2.612 -6.085 6.105 383 HA ALA 52 HA ALA 52 2.225 -5.568 3.347 384 HB1 ALA 52 HB1 ALA 52 0.069 -6.715 3.645 385 HB2 ALA 52 HB2 ALA 52 1.372 -7.571 4.501 386 HB3 ALA 52 HB3 ALA 52 0.220 -6.566 5.411 387 H LYS 53 H LYS 53 0.429 -4.123 6.193 388 HA LYS 53 HA LYS 53 -1.171 -2.562 4.338 389 HB2 LYS 53 HB2 LYS 53 -2.072 -1.396 6.259 390 HB3 LYS 53 HB3 LYS 53 -2.143 -3.145 6.388 391 HG2 LYS 53 HG2 LYS 53 0.167 -2.579 7.771 392 HG3 LYS 53 HG3 LYS 53 -0.855 -1.181 8.142 393 HD2 LYS 53 HD2 LYS 53 -1.641 -4.126 8.480 394 HD3 LYS 53 HD3 LYS 53 -1.186 -3.035 9.792 395 HE2 LYS 53 HE2 LYS 53 -3.193 -1.644 9.334 396 HE3 LYS 53 HE3 LYS 53 -3.632 -2.710 7.984 397 HZ1 LYS 53 HZ1 LYS 53 -3.494 -3.524 10.836 398 HZ2 LYS 53 HZ2 LYS 53 -3.835 -4.548 9.588 399 HZ3 LYS 53 HZ3 LYS 53 -4.869 -3.318 9.950 400 H VAL 54 H VAL 54 1.973 -1.941 5.827 401 HA VAL 54 HA VAL 54 1.909 0.891 5.109 402 HB VAL 54 HB VAL 54 4.211 -0.996 5.783 403 HG11 VAL 54 HG11 VAL 54 4.268 2.014 5.256 404 HG12 VAL 54 HG12 VAL 54 5.591 1.094 6.010 405 HG13 VAL 54 HG13 VAL 54 5.120 0.754 4.334 406 HG21 VAL 54 HG21 VAL 54 2.917 1.300 7.339 407 HG22 VAL 54 HG22 VAL 54 2.658 -0.427 7.656 408 HG23 VAL 54 HG23 VAL 54 4.262 0.283 7.901 409 H SER 55 H SER 55 3.238 -2.094 3.522 410 HA SER 55 HA SER 55 4.251 -0.583 1.271 411 HB2 SER 55 HB2 SER 55 4.400 -2.806 0.166 412 HB3 SER 55 HB3 SER 55 5.165 -2.746 1.769 413 HG SER 55 HG SER 55 3.575 -3.933 2.619 414 H ALA 56 H ALA 56 1.106 -1.940 2.057 415 HA ALA 56 HA ALA 56 -0.001 -1.719 -0.591 416 HB1 ALA 56 HB1 ALA 56 -1.321 -1.547 2.137 417 HB2 ALA 56 HB2 ALA 56 -2.153 -1.814 0.593 418 HB3 ALA 56 HB3 ALA 56 -1.034 -3.038 1.215 419 H SER 57 H SER 57 0.516 0.569 2.089 420 HA SER 57 HA SER 57 -1.122 2.656 0.983 421 HB2 SER 57 HB2 SER 57 1.255 2.853 2.866 422 HB3 SER 57 HB3 SER 57 0.056 4.124 2.557 423 HG SER 57 HG SER 57 -0.391 1.563 3.740 424 H GLU 58 H GLU 58 2.186 1.588 0.357 425 HA GLU 58 HA GLU 58 3.053 3.974 -0.997 426 HB2 GLU 58 HB2 GLU 58 3.916 1.144 -0.780 427 HB3 GLU 58 HB3 GLU 58 4.442 1.989 -2.229 428 HG2 GLU 58 HG2 GLU 58 4.895 2.948 0.618 429 HG3 GLU 58 HG3 GLU 58 6.103 2.139 -0.401 430 H ILE 59 H ILE 59 1.164 1.199 -1.983 431 HA ILE 59 HA ILE 59 1.338 1.713 -4.822 432 HB ILE 59 HB ILE 59 -0.745 0.188 -3.198 433 HG12 ILE 59 HG12 ILE 59 1.554 -0.814 -4.928 434 HG13 ILE 59 HG13 ILE 59 1.682 -0.598 -3.184 435 HG21 ILE 59 HG21 ILE 59 -1.728 0.880 -5.367 436 HG22 ILE 59 HG22 ILE 59 -0.305 0.256 -6.227 437 HG23 ILE 59 HG23 ILE 59 -1.400 -0.858 -5.379 438 HD11 ILE 59 HD11 ILE 59 -0.132 -2.545 -4.620 439 HD12 ILE 59 HD12 ILE 59 1.293 -2.910 -3.630 440 HD13 ILE 59 HD13 ILE 59 -0.162 -2.235 -2.871 441 H LEU 60 H LEU 60 -0.645 3.068 -2.203 442 HA LEU 60 HA LEU 60 -2.608 4.333 -3.905 443 HB2 LEU 60 HB2 LEU 60 -1.507 5.296 -1.243 444 HB3 LEU 60 HB3 LEU 60 -2.994 5.835 -1.996 445 HG LEU 60 HG LEU 60 -2.529 3.001 -1.009 446 HD11 LEU 60 HD11 LEU 60 -3.887 3.644 0.930 447 HD12 LEU 60 HD12 LEU 60 -3.997 5.315 0.324 448 HD13 LEU 60 HD13 LEU 60 -2.429 4.651 0.835 449 HD21 LEU 60 HD21 LEU 60 -5.013 2.910 -1.125 450 HD22 LEU 60 HD22 LEU 60 -4.256 3.140 -2.712 451 HD23 LEU 60 HD23 LEU 60 -5.013 4.517 -1.872 452 H ASN 61 H ASN 61 0.710 5.004 -3.097 453 HA ASN 61 HA ASN 61 0.682 7.823 -3.733 454 HB2 ASN 61 HB2 ASN 61 2.316 6.230 -2.319 455 HB3 ASN 61 HB3 ASN 61 3.185 6.169 -3.854 456 HD21 ASN 61 HD21 ASN 61 4.530 7.167 -1.836 457 HD22 ASN 61 HD22 ASN 61 4.632 8.912 -1.931 458 H VAL 62 H VAL 62 0.228 5.235 -5.769 459 HA VAL 62 HA VAL 62 2.049 5.718 -7.898 460 HB VAL 62 HB VAL 62 0.547 3.690 -7.590 461 HG11 VAL 62 HG11 VAL 62 -1.581 4.926 -7.213 462 HG12 VAL 62 HG12 VAL 62 -1.573 5.424 -8.923 463 HG13 VAL 62 HG13 VAL 62 -1.707 3.704 -8.488 464 HG21 VAL 62 HG21 VAL 62 0.254 3.271 -9.984 465 HG22 VAL 62 HG22 VAL 62 0.504 4.991 -10.334 466 HG23 VAL 62 HG23 VAL 62 1.822 4.021 -9.635 467 H LYS 63 H LYS 63 -0.685 7.637 -6.878 468 HA LYS 63 HA LYS 63 -1.365 8.798 -9.387 469 HB2 LYS 63 HB2 LYS 63 -2.348 9.035 -6.905 470 HB3 LYS 63 HB3 LYS 63 -1.410 10.529 -6.942 471 HG2 LYS 63 HG2 LYS 63 -3.243 9.900 -9.263 472 HG3 LYS 63 HG3 LYS 63 -3.964 10.429 -7.739 473 HD2 LYS 63 HD2 LYS 63 -3.317 12.582 -8.020 474 HD3 LYS 63 HD3 LYS 63 -1.705 12.121 -8.583 475 HE2 LYS 63 HE2 LYS 63 -2.732 13.218 -10.427 476 HE3 LYS 63 HE3 LYS 63 -2.759 11.494 -10.804 477 HZ1 LYS 63 HZ1 LYS 63 -5.015 13.188 -9.972 478 HZ2 LYS 63 HZ2 LYS 63 -5.111 11.553 -9.889 479 HZ3 LYS 63 HZ3 LYS 63 -4.869 12.296 -11.355 480 H GLN 64 H GLN 64 1.495 9.253 -7.395 481 HA GLN 64 HA GLN 64 2.335 11.809 -8.341 482 HB2 GLN 64 HB2 GLN 64 3.939 9.313 -7.683 483 HB3 GLN 64 HB3 GLN 64 4.656 10.886 -8.035 484 HG2 GLN 64 HG2 GLN 64 3.508 11.842 -6.067 485 HG3 GLN 64 HG3 GLN 64 2.867 10.235 -5.684 486 HE21 GLN 64 HE21 GLN 64 4.270 11.178 -3.698 487 HE22 GLN 64 HE22 GLN 64 5.907 10.558 -3.651 488 H PHE 65 H PHE 65 2.543 8.568 -9.850 489 HA PHE 65 HA PHE 65 4.473 9.265 -11.818 490 HB2 PHE 65 HB2 PHE 65 4.241 7.016 -11.835 491 HB3 PHE 65 HB3 PHE 65 2.541 7.075 -11.373 492 HD1 PHE 65 HD1 PHE 65 4.887 7.259 -14.246 493 HD2 PHE 65 HD2 PHE 65 0.773 7.053 -13.001 494 HE1 PHE 65 HE1 PHE 65 4.189 6.862 -16.598 495 HE2 PHE 65 HE2 PHE 65 0.081 6.653 -15.357 496 HZ PHE 65 HZ PHE 65 1.783 6.583 -17.153 497 H ILE 66 H ILE 66 1.003 9.866 -11.678 498 HA ILE 66 HA ILE 66 0.560 10.293 -14.456 499 HB ILE 66 HB ILE 66 -0.799 11.654 -12.074 500 HG12 ILE 66 HG12 ILE 66 -0.886 9.201 -11.875 501 HG13 ILE 66 HG13 ILE 66 -2.474 9.889 -12.179 502 HG21 ILE 66 HG21 ILE 66 -2.774 11.827 -13.669 503 HG22 ILE 66 HG22 ILE 66 -1.387 12.851 -14.093 504 HG23 ILE 66 HG23 ILE 66 -1.676 11.342 -14.981 505 HD11 ILE 66 HD11 ILE 66 -2.403 9.151 -14.523 506 HD12 ILE 66 HD12 ILE 66 -0.757 8.534 -14.297 507 HD13 ILE 66 HD13 ILE 66 -2.110 7.786 -13.429 508 H ASP 67 H ASP 67 1.767 12.442 -11.862 509 HA ASP 67 HA ASP 67 1.955 14.688 -13.730 510 HB2 ASP 67 HB2 ASP 67 1.498 14.876 -11.237 511 HB3 ASP 67 HB3 ASP 67 3.212 14.492 -10.991 512 H ARG 68 H ARG 68 4.082 12.116 -12.572 513 HA ARG 68 HA ARG 68 6.508 13.466 -13.500 514 HB2 ARG 68 HB2 ARG 68 6.009 10.536 -12.855 515 HB3 ARG 68 HB3 ARG 68 7.585 11.250 -13.206 516 HG2 ARG 68 HG2 ARG 68 7.287 12.757 -11.199 517 HG3 ARG 68 HG3 ARG 68 5.817 11.852 -10.810 518 HD2 ARG 68 HD2 ARG 68 7.282 9.738 -10.913 519 HD3 ARG 68 HD3 ARG 68 8.673 10.830 -10.886 520 HE ARG 68 HE ARG 68 6.884 10.139 -8.674 521 HH11 ARG 68 HH21 ARG 68 9.288 12.536 -9.721 522 HH12 ARG 68 HH22 ARG 68 9.629 12.996 -8.065 523 HH21 ARG 68 HH11 ARG 68 7.425 10.781 -6.645 524 HH22 ARG 68 HH12 ARG 68 8.653 12.018 -6.399 525 H LYS 69 H LYS 69 4.036 11.510 -14.975 526 HA LYS 69 HA LYS 69 3.737 10.636 -17.071 527 HB2 LYS 69 HB2 LYS 69 5.540 12.954 -17.852 528 HB3 LYS 69 HB3 LYS 69 4.632 11.962 -18.994 529 HG2 LYS 69 HG2 LYS 69 2.879 13.329 -18.751 530 HG3 LYS 69 HG3 LYS 69 2.736 12.772 -17.079 531 HD2 LYS 69 HD2 LYS 69 4.546 14.522 -16.525 532 HD3 LYS 69 HD3 LYS 69 4.218 15.207 -18.121 533 HE2 LYS 69 HE2 LYS 69 1.948 15.732 -17.526 534 HE3 LYS 69 HE3 LYS 69 2.011 14.687 -16.093 535 HZ1 LYS 69 HZ1 LYS 69 2.218 16.969 -15.409 536 HZ2 LYS 69 HZ2 LYS 69 3.499 17.232 -16.420 537 HZ3 LYS 69 HZ3 LYS 69 3.648 16.211 -15.126 538 H ALA 70 H ALA 70 5.837 9.465 -15.498 539 HA ALA 70 HA ALA 70 8.035 8.820 -17.310 540 HB1 ALA 70 HB1 ALA 70 8.337 9.015 -14.839 541 HB2 ALA 70 HB2 ALA 70 7.281 7.599 -14.611 542 HB3 ALA 70 HB3 ALA 70 8.835 7.428 -15.459 543 H TRP 71 H TRP 71 6.233 8.142 -18.935 544 HA TRP 71 HA TRP 71 4.516 6.058 -18.669 545 HB2 TRP 71 HB2 TRP 71 6.141 6.412 -21.193 546 HB3 TRP 71 HB3 TRP 71 4.488 5.840 -21.039 547 HD1 TRP 71 HD1 TRP 71 6.268 8.809 -22.041 548 HE1 TRP 71 HE1 TRP 71 4.885 10.938 -21.918 549 HE3 TRP 71 HE3 TRP 71 2.502 7.030 -19.078 550 HZ2 TRP 71 HZ2 TRP 71 2.447 11.773 -20.705 551 HZ3 TRP 71 HZ3 TRP 71 0.657 8.584 -18.423 552 HH2 TRP 71 HH2 TRP 71 0.645 10.942 -19.241 553 HA PRO 72 HA PRO 72 7.104 2.510 -19.801 554 HB2 PRO 72 HB2 PRO 72 9.790 2.414 -20.062 555 HB3 PRO 72 HB3 PRO 72 8.743 3.043 -21.378 556 HG2 PRO 72 HG2 PRO 72 10.262 4.573 -19.273 557 HG3 PRO 72 HG3 PRO 72 10.247 4.814 -21.049 558 HD2 PRO 72 HD2 PRO 72 8.684 6.272 -19.345 559 HD3 PRO 72 HD3 PRO 72 8.162 5.842 -21.009 560 H SER 73 H SER 73 8.465 4.625 -17.363 561 HA SER 73 HA SER 73 10.007 2.606 -16.005 562 HB2 SER 73 HB2 SER 73 10.437 5.097 -16.026 563 HB3 SER 73 HB3 SER 73 9.067 5.274 -14.911 564 HG SER 73 HG SER 73 10.183 4.294 -13.342 565 H LEU 74 H LEU 74 6.656 3.641 -15.733 566 HA LEU 74 HA LEU 74 6.282 3.037 -13.015 567 HB2 LEU 74 HB2 LEU 74 4.671 4.192 -14.590 568 HB3 LEU 74 HB3 LEU 74 4.215 2.587 -15.184 569 HG LEU 74 HG LEU 74 3.499 1.955 -12.889 570 HD11 LEU 74 HD11 LEU 74 3.225 3.880 -11.223 571 HD12 LEU 74 HD12 LEU 74 4.361 4.792 -12.233 572 HD13 LEU 74 HD13 LEU 74 4.870 3.282 -11.450 573 HD21 LEU 74 HD21 LEU 74 2.316 4.437 -14.106 574 HD22 LEU 74 HD22 LEU 74 1.576 3.585 -12.739 575 HD23 LEU 74 HD23 LEU 74 1.794 2.749 -14.288 576 H GLN 75 H GLN 75 6.488 0.858 -15.750 577 HA GLN 75 HA GLN 75 5.387 -1.495 -14.687 578 HB2 GLN 75 HB2 GLN 75 6.375 -1.219 -16.986 579 HB3 GLN 75 HB3 GLN 75 7.981 -1.135 -16.265 580 HG2 GLN 75 HG2 GLN 75 7.385 -3.499 -15.290 581 HG3 GLN 75 HG3 GLN 75 6.179 -3.521 -16.583 582 HE21 GLN 75 HE21 GLN 75 9.131 -4.581 -15.828 583 HE22 GLN 75 HE22 GLN 75 9.901 -4.542 -17.395 584 H ASN 76 H ASN 76 8.571 0.012 -14.146 585 HA ASN 76 HA ASN 76 9.496 -2.151 -12.388 586 HB2 ASN 76 HB2 ASN 76 11.086 -0.868 -13.769 587 HB3 ASN 76 HB3 ASN 76 10.561 0.641 -13.015 588 HD21 ASN 76 HD21 ASN 76 11.587 1.360 -11.274 589 HD22 ASN 76 HD22 ASN 76 12.734 0.402 -10.357 590 H ASP 77 H ASP 77 8.638 1.297 -12.083 591 HA ASP 77 HA ASP 77 9.202 1.525 -9.360 592 HB2 ASP 77 HB2 ASP 77 7.137 3.074 -10.961 593 HB3 ASP 77 HB3 ASP 77 7.916 3.616 -9.468 594 H LEU 78 H LEU 78 6.096 0.635 -10.889 595 HA LEU 78 HA LEU 78 4.719 0.717 -8.299 596 HB2 LEU 78 HB2 LEU 78 3.908 0.971 -10.866 597 HB3 LEU 78 HB3 LEU 78 3.555 -0.730 -10.632 598 HG LEU 78 HG LEU 78 2.437 1.590 -9.027 599 HD11 LEU 78 HD11 LEU 78 1.257 -0.254 -11.143 600 HD12 LEU 78 HD12 LEU 78 1.534 1.491 -11.268 601 HD13 LEU 78 HD13 LEU 78 0.305 0.869 -10.150 602 HD21 LEU 78 HD21 LEU 78 2.537 -0.273 -7.520 603 HD22 LEU 78 HD22 LEU 78 1.948 -1.393 -8.767 604 HD23 LEU 78 HD23 LEU 78 0.867 -0.152 -8.100 605 H ARG 79 H ARG 79 5.814 -1.830 -10.607 606 HA ARG 79 HA ARG 79 4.646 -3.918 -9.037 607 HB2 ARG 79 HB2 ARG 79 6.823 -4.096 -11.134 608 HB3 ARG 79 HB3 ARG 79 5.946 -5.468 -10.454 609 HG2 ARG 79 HG2 ARG 79 3.821 -4.632 -11.396 610 HG3 ARG 79 HG3 ARG 79 4.653 -3.197 -12.030 611 HD2 ARG 79 HD2 ARG 79 6.180 -4.795 -13.303 612 HD3 ARG 79 HD3 ARG 79 5.066 -6.094 -12.867 613 HE ARG 79 HE ARG 79 4.568 -3.831 -14.734 614 HH11 ARG 79 HH21 ARG 79 3.271 -6.803 -13.288 615 HH12 ARG 79 HH22 ARG 79 2.024 -6.924 -14.516 616 HH21 ARG 79 HH11 ARG 79 2.969 -4.089 -16.211 617 HH22 ARG 79 HH12 ARG 79 1.857 -5.462 -16.095 618 H LEU 80 H LEU 80 7.878 -2.416 -8.832 619 HA LEU 80 HA LEU 80 9.056 -4.539 -7.305 620 HB2 LEU 80 HB2 LEU 80 9.517 -1.553 -7.399 621 HB3 LEU 80 HB3 LEU 80 10.377 -2.568 -6.251 622 HG LEU 80 HG LEU 80 10.536 -2.866 -9.266 623 HD11 LEU 80 HD11 LEU 80 12.779 -1.882 -8.976 624 HD12 LEU 80 HD12 LEU 80 12.468 -1.664 -7.238 625 HD13 LEU 80 HD13 LEU 80 11.510 -0.762 -8.441 626 HD21 LEU 80 HD21 LEU 80 10.991 -5.000 -8.160 627 HD22 LEU 80 HD22 LEU 80 12.100 -4.206 -7.016 628 HD23 LEU 80 HD23 LEU 80 12.509 -4.299 -8.745 629 H ARG 81 H ARG 81 7.289 -1.588 -6.222 630 HA ARG 81 HA ARG 81 7.482 -2.285 -3.435 631 HB2 ARG 81 HB2 ARG 81 5.638 -0.427 -4.983 632 HB3 ARG 81 HB3 ARG 81 5.651 -0.549 -3.216 633 HG2 ARG 81 HG2 ARG 81 7.979 0.168 -3.124 634 HG3 ARG 81 HG3 ARG 81 8.094 0.186 -4.892 635 HD2 ARG 81 HD2 ARG 81 6.147 1.903 -3.344 636 HD3 ARG 81 HD3 ARG 81 7.782 2.432 -3.759 637 HE ARG 81 HE ARG 81 6.680 1.578 -6.167 638 HH11 ARG 81 HH21 ARG 81 5.876 4.086 -3.776 639 HH12 ARG 81 HH22 ARG 81 5.128 5.095 -4.993 640 HH21 ARG 81 HH11 ARG 81 5.755 2.923 -7.614 641 HH22 ARG 81 HH12 ARG 81 5.071 4.456 -7.127 642 H ALA 82 H ALA 82 5.116 -2.927 -5.996 643 HA ALA 82 HA ALA 82 3.142 -4.092 -4.284 644 HB1 ALA 82 HB1 ALA 82 3.701 -4.776 -7.195 645 HB2 ALA 82 HB2 ALA 82 2.166 -4.943 -6.314 646 HB3 ALA 82 HB3 ALA 82 2.811 -3.327 -6.665 647 H SER 83 H SER 83 6.125 -5.429 -5.741 648 HA SER 83 HA SER 83 5.422 -8.177 -5.321 649 HB2 SER 83 HB2 SER 83 8.162 -6.861 -5.429 650 HB3 SER 83 HB3 SER 83 7.853 -8.609 -5.511 651 HG SER 83 HG SER 83 6.977 -6.606 -7.344 652 H TYR 84 H TYR 84 7.039 -5.758 -3.247 653 HA TYR 84 HA TYR 84 7.732 -7.553 -1.128 654 HB2 TYR 84 HB2 TYR 84 8.591 -5.245 -1.359 655 HB3 TYR 84 HB3 TYR 84 6.974 -4.609 -1.073 656 HD1 TYR 84 HD1 TYR 84 5.984 -4.623 1.160 657 HD2 TYR 84 HD2 TYR 84 9.956 -6.115 0.539 658 HE1 TYR 84 HE1 TYR 84 6.432 -4.413 3.596 659 HE2 TYR 84 HE2 TYR 84 10.396 -5.941 3.006 660 HH TYR 84 HH TYR 84 9.470 -5.444 5.114 661 H LEU 85 H LEU 85 4.771 -5.619 -1.788 662 HA LEU 85 HA LEU 85 3.330 -6.469 0.520 663 HB2 LEU 85 HB2 LEU 85 2.526 -4.609 -0.837 664 HB3 LEU 85 HB3 LEU 85 2.380 -5.656 -2.241 665 HG LEU 85 HG LEU 85 0.560 -6.924 -1.139 666 HD11 LEU 85 HD11 LEU 85 1.082 -6.583 1.202 667 HD12 LEU 85 HD12 LEU 85 -0.530 -5.927 0.865 668 HD13 LEU 85 HD13 LEU 85 0.858 -4.828 1.029 669 HD21 LEU 85 HD21 LEU 85 0.063 -5.051 -2.635 670 HD22 LEU 85 HD22 LEU 85 0.103 -3.933 -1.252 671 HD23 LEU 85 HD23 LEU 85 -1.148 -5.194 -1.345 672 H ARG 86 H ARG 86 3.623 -7.860 -2.719 673 HA ARG 86 HA ARG 86 1.639 -9.867 -2.441 674 HB2 ARG 86 HB2 ARG 86 2.912 -9.167 -4.548 675 HB3 ARG 86 HB3 ARG 86 4.249 -10.153 -3.969 676 HG2 ARG 86 HG2 ARG 86 3.216 -11.573 -5.459 677 HG3 ARG 86 HG3 ARG 86 2.507 -12.103 -3.927 678 HD2 ARG 86 HD2 ARG 86 0.444 -10.892 -4.400 679 HD3 ARG 86 HD3 ARG 86 1.188 -10.092 -5.796 680 HE ARG 86 HE ARG 86 1.319 -12.922 -6.133 681 HH11 ARG 86 HH11 ARG 86 -1.001 -10.265 -6.315 682 HH12 ARG 86 HH12 ARG 86 -2.014 -11.106 -7.456 683 HH21 ARG 86 HH21 ARG 86 -0.020 -13.924 -7.609 684 HH22 ARG 86 HH22 ARG 86 -1.459 -13.129 -8.184 685 H TYR 87 H TYR 87 5.120 -9.932 -1.562 686 HA TYR 87 HA TYR 87 5.037 -12.707 -0.794 687 HB2 TYR 87 HB2 TYR 87 6.974 -10.524 0.048 688 HB3 TYR 87 HB3 TYR 87 7.220 -12.263 0.246 689 HD1 TYR 87 HD2 TYR 87 6.335 -13.353 -2.390 690 HD2 TYR 87 HD1 TYR 87 8.620 -9.815 -1.486 691 HE1 TYR 87 HE2 TYR 87 7.365 -13.427 -4.659 692 HE2 TYR 87 HE1 TYR 87 9.649 -9.911 -3.757 693 HH TYR 87 HH TYR 87 9.759 -11.029 -5.752 694 H ASP 88 H ASP 88 4.946 -9.666 1.187 695 HA ASP 88 HA ASP 88 4.796 -11.163 3.642 696 HB2 ASP 88 HB2 ASP 88 4.285 -8.308 2.862 697 HB3 ASP 88 HB3 ASP 88 3.758 -8.887 4.452 698 H LEU 89 H LEU 89 2.281 -9.840 1.467 699 HA LEU 89 HA LEU 89 0.104 -10.398 3.239 700 HB2 LEU 89 HB2 LEU 89 0.032 -8.959 1.218 701 HB3 LEU 89 HB3 LEU 89 0.165 -10.386 0.202 702 HG LEU 89 HG LEU 89 -2.049 -11.109 0.783 703 HD11 LEU 89 HD11 LEU 89 -2.146 -10.530 3.157 704 HD12 LEU 89 HD12 LEU 89 -3.498 -9.778 2.300 705 HD13 LEU 89 HD13 LEU 89 -2.094 -8.798 2.750 706 HD21 LEU 89 HD21 LEU 89 -1.972 -8.089 0.327 707 HD22 LEU 89 HD22 LEU 89 -3.330 -9.171 -0.061 708 HD23 LEU 89 HD23 LEU 89 -1.792 -9.335 -0.928 709 H LYS 90 H LYS 90 1.870 -12.426 0.888 710 HA LYS 90 HA LYS 90 0.158 -14.687 0.989 711 HB2 LYS 90 HB2 LYS 90 2.362 -14.093 -0.391 712 HB3 LYS 90 HB3 LYS 90 3.149 -14.983 0.910 713 HG2 LYS 90 HG2 LYS 90 2.781 -16.533 -0.811 714 HG3 LYS 90 HG3 LYS 90 1.524 -16.874 0.397 715 HD2 LYS 90 HD2 LYS 90 -0.109 -15.574 -0.933 716 HD3 LYS 90 HD3 LYS 90 1.169 -15.162 -2.096 717 HE2 LYS 90 HE2 LYS 90 -0.059 -16.959 -3.022 718 HE3 LYS 90 HE3 LYS 90 1.499 -17.611 -2.473 719 HZ1 LYS 90 HZ1 LYS 90 0.289 -18.296 -0.407 720 HZ2 LYS 90 HZ2 LYS 90 -0.209 -19.089 -1.767 721 HZ3 LYS 90 HZ3 LYS 90 -1.136 -17.875 -1.142 722 H THR 91 H THR 91 2.462 -13.418 3.309 723 HA THR 91 HA THR 91 2.501 -15.892 4.882 724 HB THR 91 HB THR 91 3.455 -13.096 5.669 725 HG1 THR 91 HG1 THR 91 4.675 -13.582 3.938 726 HG21 THR 91 HG21 THR 91 3.282 -14.664 7.557 727 HG22 THR 91 HG22 THR 91 4.980 -14.354 7.150 728 HG23 THR 91 HG23 THR 91 4.215 -15.876 6.646 729 H VAL 92 H VAL 92 1.025 -12.599 5.110 730 HA VAL 92 HA VAL 92 -0.154 -12.938 7.656 731 HB VAL 92 HB VAL 92 -1.268 -11.327 5.307 732 HG11 VAL 92 HG11 VAL 92 -1.811 -11.234 8.313 733 HG12 VAL 92 HG12 VAL 92 -2.241 -9.915 7.212 734 HG13 VAL 92 HG13 VAL 92 -2.987 -11.507 7.002 735 HG21 VAL 92 HG21 VAL 92 -0.063 -9.444 6.253 736 HG22 VAL 92 HG22 VAL 92 0.552 -10.458 7.577 737 HG23 VAL 92 HG23 VAL 92 1.077 -10.741 5.916 738 H ILE 93 H ILE 93 -1.472 -13.830 4.442 739 HA ILE 93 HA ILE 93 -4.092 -14.432 5.373 740 HB ILE 93 HB ILE 93 -4.330 -15.870 3.366 741 HG12 ILE 93 HG12 ILE 93 -1.420 -15.232 2.812 742 HG13 ILE 93 HG13 ILE 93 -1.981 -16.777 3.440 743 HG21 ILE 93 HG21 ILE 93 -2.916 -13.245 2.740 744 HG22 ILE 93 HG22 ILE 93 -4.082 -14.099 1.708 745 HG23 ILE 93 HG23 ILE 93 -4.604 -13.405 3.247 746 HD11 ILE 93 HD11 ILE 93 -3.380 -17.040 1.375 747 HD12 ILE 93 HD12 ILE 93 -2.584 -15.582 0.730 748 HD13 ILE 93 HD13 ILE 93 -1.624 -17.027 1.104 749 H SER 94 H SER 94 -1.144 -16.199 5.896 750 HA SER 94 HA SER 94 -2.167 -18.833 6.028 751 HB2 SER 94 HB2 SER 94 0.245 -18.166 6.099 752 HB3 SER 94 HB3 SER 94 0.006 -17.641 7.780 753 HG SER 94 HG SER 94 0.772 -19.769 7.713 754 H ALA 95 H ALA 95 -2.161 -16.240 8.479 755 HA ALA 95 HA ALA 95 -3.182 -17.988 10.576 756 HB1 ALA 95 HB1 ALA 95 -1.818 -16.116 11.211 757 HB2 ALA 95 HB2 ALA 95 -2.866 -14.967 10.345 758 HB3 ALA 95 HB3 ALA 95 -3.458 -15.800 11.805 759 H LYS 96 H LYS 96 -4.618 -16.029 8.063 760 HA LYS 96 HA LYS 96 -7.111 -15.502 9.382 761 HB2 LYS 96 HB2 LYS 96 -6.010 -15.310 6.629 762 HB3 LYS 96 HB3 LYS 96 -7.754 -15.508 6.729 763 HG2 LYS 96 HG2 LYS 96 -7.202 -13.136 6.621 764 HG3 LYS 96 HG3 LYS 96 -7.910 -13.509 8.198 765 HD2 LYS 96 HD2 LYS 96 -5.704 -13.475 9.256 766 HD3 LYS 96 HD3 LYS 96 -4.915 -13.297 7.679 767 HE2 LYS 96 HE2 LYS 96 -4.962 -11.150 8.818 768 HE3 LYS 96 HE3 LYS 96 -5.980 -11.097 7.376 769 HZ1 LYS 96 HZ1 LYS 96 -6.954 -10.002 9.348 770 HZ2 LYS 96 HZ2 LYS 96 -7.043 -11.455 10.118 771 HZ3 LYS 96 HZ3 LYS 96 -7.918 -11.196 8.739 772 HA PRO 97 HA PRO 97 -8.841 -19.496 9.229 773 HB2 PRO 97 HB2 PRO 97 -11.541 -19.044 9.170 774 HB3 PRO 97 HB3 PRO 97 -10.532 -18.693 10.610 775 HG2 PRO 97 HG2 PRO 97 -11.431 -16.830 8.445 776 HG3 PRO 97 HG3 PRO 97 -11.574 -16.648 10.219 777 HD2 PRO 97 HD2 PRO 97 -9.565 -15.475 8.859 778 HD3 PRO 97 HD3 PRO 97 -9.278 -16.208 10.477 779 H LYS 98 H LYS 98 -10.283 -20.952 7.960 780 HA LYS 98 HA LYS 98 -9.408 -21.380 5.481 781 HB2 LYS 98 HB2 LYS 98 -10.849 -22.929 6.655 782 HB3 LYS 98 HB3 LYS 98 -12.228 -21.844 6.489 783 HG2 LYS 98 HG2 LYS 98 -12.518 -23.649 4.940 784 HG3 LYS 98 HG3 LYS 98 -12.178 -22.189 4.006 785 HD2 LYS 98 HD2 LYS 98 -9.783 -22.929 3.810 786 HD3 LYS 98 HD3 LYS 98 -10.221 -24.438 4.639 787 HE2 LYS 98 HE2 LYS 98 -11.385 -23.415 2.009 788 HE3 LYS 98 HE3 LYS 98 -10.186 -24.712 2.174 789 HZ1 LYS 98 HZ1 LYS 98 -11.849 -26.000 3.394 790 HZ2 LYS 98 HZ2 LYS 98 -12.411 -25.603 1.894 791 HZ3 LYS 98 HZ3 LYS 98 -12.963 -24.795 3.220 792 H ASP 99 H ASP 99 -12.478 -19.470 5.811 793 HA ASP 99 HA ASP 99 -12.440 -19.180 2.915 794 HB2 ASP 99 HB2 ASP 99 -14.470 -19.451 4.545 795 HB3 ASP 99 HB3 ASP 99 -14.350 -17.686 4.674 796 H GLU 100 H GLU 100 -11.763 -17.028 5.687 797 HA GLU 100 HA GLU 100 -11.598 -14.613 4.161 798 HB2 GLU 100 HB2 GLU 100 -11.169 -15.482 6.826 799 HB3 GLU 100 HB3 GLU 100 -9.673 -14.710 6.309 800 HG2 GLU 100 HG2 GLU 100 -12.425 -13.515 6.135 801 HG3 GLU 100 HG3 GLU 100 -11.227 -13.159 7.395 802 H LYS 101 H LYS 101 -9.333 -17.235 4.880 803 HA LYS 101 HA LYS 101 -6.958 -16.146 3.741 804 HB2 LYS 101 HB2 LYS 101 -7.155 -18.203 5.108 805 HB3 LYS 101 HB3 LYS 101 -8.017 -19.001 3.802 806 HG2 LYS 101 HG2 LYS 101 -6.037 -18.965 2.390 807 HG3 LYS 101 HG3 LYS 101 -5.141 -18.045 3.612 808 HD2 LYS 101 HD2 LYS 101 -6.364 -20.781 4.190 809 HD3 LYS 101 HD3 LYS 101 -4.713 -20.585 3.564 810 HE2 LYS 101 HE2 LYS 101 -4.144 -19.170 5.490 811 HE3 LYS 101 HE3 LYS 101 -5.767 -19.339 6.128 812 HZ1 LYS 101 HZ1 LYS 101 -4.173 -20.722 7.248 813 HZ2 LYS 101 HZ2 LYS 101 -3.832 -21.542 5.856 814 HZ3 LYS 101 HZ3 LYS 101 -5.338 -21.646 6.527 815 H LYS 102 H LYS 102 -9.835 -17.610 2.299 816 HA LYS 102 HA LYS 102 -8.677 -17.722 -0.382 817 HB2 LYS 102 HB2 LYS 102 -10.760 -18.972 0.930 818 HB3 LYS 102 HB3 LYS 102 -11.625 -17.812 -0.075 819 HG2 LYS 102 HG2 LYS 102 -9.572 -19.790 -1.134 820 HG3 LYS 102 HG3 LYS 102 -11.317 -20.093 -1.079 821 HD2 LYS 102 HD2 LYS 102 -11.674 -18.050 -2.479 822 HD3 LYS 102 HD3 LYS 102 -9.911 -17.906 -2.647 823 HE2 LYS 102 HE2 LYS 102 -9.816 -20.151 -3.671 824 HE3 LYS 102 HE3 LYS 102 -11.578 -20.312 -3.484 825 HZ1 LYS 102 HZ1 LYS 102 -10.981 -19.583 -5.712 826 HZ2 LYS 102 HZ2 LYS 102 -10.221 -18.243 -5.118 827 HZ3 LYS 102 HZ3 LYS 102 -11.852 -18.408 -4.946 828 H SER 103 H SER 103 -10.980 -15.583 1.387 829 HA SER 103 HA SER 103 -11.599 -13.982 -0.908 830 HB2 SER 103 HB2 SER 103 -12.984 -13.989 1.125 831 HB3 SER 103 HB3 SER 103 -11.671 -13.188 2.019 832 HG SER 103 HG SER 103 -12.627 -12.054 -0.396 833 H LEU 104 H LEU 104 -9.142 -13.537 1.717 834 HA LEU 104 HA LEU 104 -8.180 -11.073 0.653 835 HB2 LEU 104 HB2 LEU 104 -7.237 -13.080 2.578 836 HB3 LEU 104 HB3 LEU 104 -5.927 -12.340 1.659 837 HG LEU 104 HG LEU 104 -8.001 -10.810 3.236 838 HD11 LEU 104 HD11 LEU 104 -6.463 -12.116 4.670 839 HD12 LEU 104 HD12 LEU 104 -6.249 -10.367 4.853 840 HD13 LEU 104 HD13 LEU 104 -5.078 -11.301 3.895 841 HD21 LEU 104 HD21 LEU 104 -7.234 -9.374 1.482 842 HD22 LEU 104 HD22 LEU 104 -5.557 -9.930 1.654 843 HD23 LEU 104 HD23 LEU 104 -6.297 -8.912 2.912 844 H GLN 105 H GLN 105 -7.481 -14.467 -0.220 845 HA GLN 105 HA GLN 105 -5.305 -13.786 -1.948 846 HB2 GLN 105 HB2 GLN 105 -7.075 -16.167 -1.588 847 HB3 GLN 105 HB3 GLN 105 -6.130 -16.057 -3.073 848 HG2 GLN 105 HG2 GLN 105 -4.795 -15.622 -0.416 849 HG3 GLN 105 HG3 GLN 105 -5.166 -17.265 -0.948 850 HE21 GLN 105 HE21 GLN 105 -4.331 -14.762 -3.299 851 HE22 GLN 105 HE22 GLN 105 -2.757 -15.407 -3.689 852 H GLU 106 H GLU 106 -8.862 -13.961 -2.616 853 HA GLU 106 HA GLU 106 -8.299 -13.567 -5.452 854 HB2 GLU 106 HB2 GLU 106 -10.713 -13.180 -5.741 855 HB3 GLU 106 HB3 GLU 106 -10.292 -14.716 -5.007 856 HG2 GLU 106 HG2 GLU 106 -12.180 -14.063 -3.850 857 HG3 GLU 106 HG3 GLU 106 -10.851 -13.683 -2.769 858 H LEU 107 H LEU 107 -9.007 -11.397 -2.682 859 HA LEU 107 HA LEU 107 -9.152 -9.012 -4.282 860 HB2 LEU 107 HB2 LEU 107 -8.053 -9.427 -1.478 861 HB3 LEU 107 HB3 LEU 107 -8.199 -7.869 -2.258 862 HG LEU 107 HG LEU 107 -10.386 -9.603 -1.162 863 HD11 LEU 107 HD11 LEU 107 -9.584 -6.686 -0.818 864 HD12 LEU 107 HD12 LEU 107 -9.150 -8.011 0.287 865 HD13 LEU 107 HD13 LEU 107 -10.847 -7.540 0.079 866 HD21 LEU 107 HD21 LEU 107 -12.021 -7.953 -2.047 867 HD22 LEU 107 HD22 LEU 107 -11.252 -8.882 -3.341 868 HD23 LEU 107 HD23 LEU 107 -10.736 -7.204 -3.015 869 H THR 108 H THR 108 -6.427 -10.825 -2.874 870 HA THR 108 HA THR 108 -4.352 -9.027 -3.612 871 HB THR 108 HB THR 108 -4.203 -12.091 -3.503 872 HG1 THR 108 HG1 THR 108 -4.988 -11.149 -1.552 873 HG21 THR 108 HG21 THR 108 -2.184 -11.247 -4.475 874 HG22 THR 108 HG22 THR 108 -1.836 -11.590 -2.768 875 HG23 THR 108 HG23 THR 108 -2.098 -9.913 -3.301 876 H SER 109 H SER 109 -6.026 -11.595 -5.472 877 HA SER 109 HA SER 109 -4.229 -11.300 -7.736 878 HB2 SER 109 HB2 SER 109 -5.606 -13.349 -7.212 879 HB3 SER 109 HB3 SER 109 -7.053 -12.445 -7.709 880 HG SER 109 HG SER 109 -6.246 -12.316 -9.771 881 H LYS 110 H LYS 110 -7.551 -10.111 -6.981 882 HA LYS 110 HA LYS 110 -8.049 -8.792 -9.435 883 HB2 LYS 110 HB2 LYS 110 -9.802 -9.245 -7.822 884 HB3 LYS 110 HB3 LYS 110 -8.959 -8.327 -6.577 885 HG2 LYS 110 HG2 LYS 110 -10.784 -6.996 -7.268 886 HG3 LYS 110 HG3 LYS 110 -9.325 -6.255 -7.919 887 HD2 LYS 110 HD2 LYS 110 -10.048 -7.858 -10.009 888 HD3 LYS 110 HD3 LYS 110 -11.631 -7.440 -9.320 889 HE2 LYS 110 HE2 LYS 110 -9.421 -5.519 -10.137 890 HE3 LYS 110 HE3 LYS 110 -10.948 -5.781 -11.000 891 HZ1 LYS 110 HZ1 LYS 110 -10.677 -4.643 -8.266 892 HZ2 LYS 110 HZ2 LYS 110 -12.110 -4.899 -9.043 893 HZ3 LYS 110 HZ3 LYS 110 -11.039 -3.790 -9.632 894 H LEU 111 H LEU 111 -6.557 -7.584 -6.435 895 HA LEU 111 HA LEU 111 -6.321 -4.882 -7.282 896 HB2 LEU 111 HB2 LEU 111 -6.107 -5.962 -4.988 897 HB3 LEU 111 HB3 LEU 111 -4.449 -6.352 -5.398 898 HG LEU 111 HG LEU 111 -5.511 -3.520 -5.427 899 HD11 LEU 111 HD11 LEU 111 -4.851 -3.317 -3.129 900 HD12 LEU 111 HD12 LEU 111 -4.214 -4.975 -3.098 901 HD13 LEU 111 HD13 LEU 111 -5.961 -4.678 -3.254 902 HD21 LEU 111 HD21 LEU 111 -3.333 -3.772 -6.487 903 HD22 LEU 111 HD22 LEU 111 -2.711 -4.639 -5.064 904 HD23 LEU 111 HD23 LEU 111 -3.167 -2.924 -4.949 905 H PHE 112 H PHE 112 -4.012 -7.628 -7.479 906 HA PHE 112 HA PHE 112 -1.984 -5.973 -8.703 907 HB2 PHE 112 HB2 PHE 112 -2.324 -8.923 -8.273 908 HB3 PHE 112 HB3 PHE 112 -1.011 -8.295 -9.276 909 HD1 PHE 112 HD1 PHE 112 -2.524 -7.511 -5.881 910 HD2 PHE 112 HD2 PHE 112 1.034 -7.962 -8.258 911 HE1 PHE 112 HE1 PHE 112 -1.152 -7.072 -3.875 912 HE2 PHE 112 HE2 PHE 112 2.421 -7.510 -6.242 913 HZ PHE 112 HZ PHE 112 1.320 -7.084 -4.039 914 H SER 113 H SER 113 -4.705 -7.822 -9.976 915 HA SER 113 HA SER 113 -3.798 -7.792 -12.724 916 HB2 SER 113 HB2 SER 113 -5.722 -9.170 -11.914 917 HB3 SER 113 HB3 SER 113 -6.642 -7.680 -11.629 918 HG SER 113 HG SER 113 -6.333 -7.227 -13.910 919 H SER 114 H SER 114 -5.616 -5.551 -10.611 920 HA SER 114 HA SER 114 -6.115 -3.608 -12.660 921 HB2 SER 114 HB2 SER 114 -5.846 -3.131 -9.670 922 HB3 SER 114 HB3 SER 114 -6.717 -2.122 -10.842 923 HG SER 114 HG SER 114 -7.330 -4.783 -10.016 924 H ILE 115 H ILE 115 -3.390 -4.189 -10.454 925 HA ILE 115 HA ILE 115 -1.942 -1.764 -11.043 926 HB ILE 115 HB ILE 115 -1.148 -4.516 -10.017 927 HG12 ILE 115 HG12 ILE 115 -0.950 -1.749 -8.785 928 HG13 ILE 115 HG13 ILE 115 -2.315 -2.841 -8.561 929 HG21 ILE 115 HG21 ILE 115 1.199 -3.657 -9.673 930 HG22 ILE 115 HG22 ILE 115 0.782 -3.871 -11.376 931 HG23 ILE 115 HG23 ILE 115 0.783 -2.246 -10.664 932 HD11 ILE 115 HD11 ILE 115 0.539 -3.274 -7.608 933 HD12 ILE 115 HD12 ILE 115 -0.903 -3.001 -6.623 934 HD13 ILE 115 HD13 ILE 115 -0.732 -4.518 -7.527 935 H ASP 116 H ASP 116 -2.022 -5.025 -12.546 936 HA ASP 116 HA ASP 116 0.042 -4.462 -14.454 937 HB2 ASP 116 HB2 ASP 116 -0.808 -6.741 -13.892 938 HB3 ASP 116 HB3 ASP 116 -2.323 -6.350 -14.720 939 H ASN 117 H ASN 117 -3.498 -3.991 -14.482 940 HA ASN 117 HA ASN 117 -3.605 -3.111 -17.223 941 HB2 ASN 117 HB2 ASN 117 -5.421 -2.439 -14.869 942 HB3 ASN 117 HB3 ASN 117 -5.774 -2.091 -16.564 943 HD21 ASN 117 HD21 ASN 117 -4.973 -4.413 -17.820 944 HD22 ASN 117 HD22 ASN 117 -5.984 -5.724 -17.276 945 H LEU 118 H LEU 118 -3.043 -1.454 -14.122 946 HA LEU 118 HA LEU 118 -3.153 1.214 -15.135 947 HB2 LEU 118 HB2 LEU 118 -3.089 0.177 -12.718 948 HB3 LEU 118 HB3 LEU 118 -1.356 0.385 -12.855 949 HG LEU 118 HG LEU 118 -3.346 2.653 -13.172 950 HD11 LEU 118 HD11 LEU 118 -3.642 1.577 -10.975 951 HD12 LEU 118 HD12 LEU 118 -2.895 3.178 -10.805 952 HD13 LEU 118 HD13 LEU 118 -1.897 1.713 -10.663 953 HD21 LEU 118 HD21 LEU 118 -1.430 4.060 -12.532 954 HD22 LEU 118 HD22 LEU 118 -1.123 3.164 -14.028 955 HD23 LEU 118 HD23 LEU 118 -0.393 2.615 -12.504 956 H ASP 119 H ASP 119 -0.414 -1.099 -14.739 957 HA ASP 119 HA ASP 119 1.571 0.728 -15.783 958 HB2 ASP 119 HB2 ASP 119 2.288 -1.236 -14.527 959 HB3 ASP 119 HB3 ASP 119 1.494 -2.307 -15.701 960 H HIS 120 H HIS 120 -0.634 -1.646 -17.370 961 HA HIS 120 HA HIS 120 0.558 -1.324 -19.974 962 HB2 HIS 120 HB2 HIS 120 -2.171 -2.180 -19.021 963 HB3 HIS 120 HB3 HIS 120 -1.903 -1.836 -20.733 964 HD1 HIS 120 HD1 HIS 120 -0.929 -4.309 -18.006 965 HD2 HIS 120 HD2 HIS 120 -0.380 -3.726 -22.129 966 HE1 HIS 120 HE1 HIS 120 0.046 -6.463 -18.930 967 H ALA 121 H ALA 121 -2.011 0.510 -18.272 968 HA ALA 121 HA ALA 121 -2.574 2.256 -20.475 969 HB1 ALA 121 HB1 ALA 121 -2.857 2.721 -17.475 970 HB2 ALA 121 HB2 ALA 121 -3.600 3.707 -18.755 971 HB3 ALA 121 HB3 ALA 121 -4.087 2.008 -18.547 972 H ALA 122 H ALA 122 -0.173 2.329 -17.848 973 HA ALA 122 HA ALA 122 0.759 4.980 -18.343 974 HB1 ALA 122 HB1 ALA 122 2.193 2.560 -17.180 975 HB2 ALA 122 HB2 ALA 122 2.759 4.236 -17.079 976 HB3 ALA 122 HB3 ALA 122 1.241 3.762 -16.282 977 H LYS 123 H LYS 123 1.965 1.792 -19.513 978 HA LYS 123 HA LYS 123 4.147 2.988 -20.957 979 HB2 LYS 123 HB2 LYS 123 2.809 0.279 -21.248 980 HB3 LYS 123 HB3 LYS 123 4.320 0.751 -22.044 981 HG2 LYS 123 HG2 LYS 123 5.351 1.142 -19.808 982 HG3 LYS 123 HG3 LYS 123 3.853 0.620 -19.044 983 HD2 LYS 123 HD2 LYS 123 4.978 -1.368 -18.971 984 HD3 LYS 123 HD3 LYS 123 4.226 -1.532 -20.567 985 HE2 LYS 123 HE2 LYS 123 6.503 -2.119 -20.893 986 HE3 LYS 123 HE3 LYS 123 6.366 -0.457 -21.511 987 HZ1 LYS 123 HZ1 LYS 123 7.140 0.221 -19.202 988 HZ2 LYS 123 HZ2 LYS 123 8.273 -0.514 -20.152 989 HZ3 LYS 123 HZ3 LYS 123 7.536 -1.363 -18.951 990 H ILE 124 H ILE 124 0.781 2.401 -21.799 991 HA ILE 124 HA ILE 124 1.339 3.066 -24.618 992 HB ILE 124 HB ILE 124 -0.353 1.262 -23.723 993 HG12 ILE 124 HG12 ILE 124 -1.879 1.757 -25.721 994 HG13 ILE 124 HG13 ILE 124 -0.867 3.175 -26.008 995 HG21 ILE 124 HG21 ILE 124 -1.607 2.908 -22.273 996 HG22 ILE 124 HG22 ILE 124 -2.246 3.641 -23.755 997 HG23 ILE 124 HG23 ILE 124 -2.618 1.949 -23.366 998 HD11 ILE 124 HD11 ILE 124 1.118 1.728 -26.284 999 HD12 ILE 124 HD12 ILE 124 0.140 0.293 -25.900 1000 HD13 ILE 124 HD13 ILE 124 -0.180 1.217 -27.386 1001 H LYS 125 H LYS 125 1.533 4.827 -22.092 1002 HA LYS 125 HA LYS 125 1.262 6.954 -21.465 1003 HB2 LYS 125 HB2 LYS 125 1.745 8.662 -23.064 1004 HB3 LYS 125 HB3 LYS 125 2.753 7.245 -23.335 1005 HG2 LYS 125 HG2 LYS 125 1.440 6.635 -25.314 1006 HG3 LYS 125 HG3 LYS 125 0.296 7.947 -24.994 1007 HD2 LYS 125 HD2 LYS 125 1.713 8.715 -26.712 1008 HD3 LYS 125 HD3 LYS 125 2.233 9.560 -25.241 1009 HE2 LYS 125 HE2 LYS 125 4.101 7.972 -24.977 1010 HE3 LYS 125 HE3 LYS 125 3.537 7.053 -26.390 1011 HZ1 LYS 125 HZ1 LYS 125 4.450 9.873 -26.442 1012 HZ2 LYS 125 HZ2 LYS 125 3.927 9.014 -27.749 1013 HZ3 LYS 125 HZ3 LYS 125 5.318 8.576 -26.978 1014 H SER 126 H SER 126 -1.187 5.698 -21.394 1015 HA SER 126 HA SER 126 -3.050 7.962 -22.026 1016 HB2 SER 126 HB2 SER 126 -3.640 5.077 -21.263 1017 HB3 SER 126 HB3 SER 126 -4.837 6.322 -21.678 1018 HG SER 126 HG SER 126 -3.770 6.458 -23.747 1019 HA PRO 127 HA PRO 127 -2.123 8.067 -17.540 1020 HB2 PRO 127 HB2 PRO 127 -2.548 10.731 -17.060 1021 HB3 PRO 127 HB3 PRO 127 -1.011 10.099 -17.730 1022 HG2 PRO 127 HG2 PRO 127 -3.376 11.247 -19.208 1023 HG3 PRO 127 HG3 PRO 127 -1.644 11.701 -19.328 1024 HD2 PRO 127 HD2 PRO 127 -2.727 10.010 -21.100 1025 HD3 PRO 127 HD3 PRO 127 -1.080 9.705 -20.441 1026 H THR 128 H THR 128 -4.923 9.408 -19.286 1027 HA THR 128 HA THR 128 -6.611 9.815 -17.031 1028 HB THR 128 HB THR 128 -8.331 9.162 -19.044 1029 HG1 THR 128 HG1 THR 128 -6.976 8.566 -20.630 1030 HG21 THR 128 HG21 THR 128 -8.085 11.397 -17.977 1031 HG22 THR 128 HG22 THR 128 -8.208 11.514 -19.748 1032 HG23 THR 128 HG23 THR 128 -6.626 11.685 -18.955 1033 H GLU 129 H GLU 129 -5.806 6.949 -18.941 1034 HA GLU 129 HA GLU 129 -7.931 5.351 -17.718 1035 HB2 GLU 129 HB2 GLU 129 -5.682 4.860 -19.656 1036 HB3 GLU 129 HB3 GLU 129 -6.550 3.498 -18.931 1037 HG2 GLU 129 HG2 GLU 129 -7.458 4.161 -21.163 1038 HG3 GLU 129 HG3 GLU 129 -8.651 4.243 -19.856 1039 H ALA 130 H ALA 130 -4.481 5.976 -17.290 1040 HA ALA 130 HA ALA 130 -4.026 3.907 -15.345 1041 HB1 ALA 130 HB1 ALA 130 -2.173 5.080 -16.464 1042 HB2 ALA 130 HB2 ALA 130 -2.680 6.619 -15.729 1043 HB3 ALA 130 HB3 ALA 130 -2.069 5.306 -14.703 1044 H GLU 131 H GLU 131 -5.237 7.281 -15.176 1045 HA GLU 131 HA GLU 131 -5.431 7.410 -12.322 1046 HB2 GLU 131 HB2 GLU 131 -6.880 8.818 -14.562 1047 HB3 GLU 131 HB3 GLU 131 -7.253 9.130 -12.861 1048 HG2 GLU 131 HG2 GLU 131 -4.933 9.774 -12.442 1049 HG3 GLU 131 HG3 GLU 131 -4.527 9.442 -14.125 1050 H LYS 132 H LYS 132 -7.646 6.104 -14.812 1051 HA LYS 132 HA LYS 132 -9.862 5.701 -13.023 1052 HB2 LYS 132 HB2 LYS 132 -9.120 4.861 -15.734 1053 HB3 LYS 132 HB3 LYS 132 -9.939 3.579 -14.844 1054 HG2 LYS 132 HG2 LYS 132 -11.753 4.638 -15.802 1055 HG3 LYS 132 HG3 LYS 132 -11.676 5.458 -14.236 1056 HD2 LYS 132 HD2 LYS 132 -11.953 7.224 -15.755 1057 HD3 LYS 132 HD3 LYS 132 -10.204 7.218 -15.467 1058 HE2 LYS 132 HE2 LYS 132 -9.946 5.797 -17.541 1059 HE3 LYS 132 HE3 LYS 132 -11.677 6.009 -17.849 1060 HZ1 LYS 132 HZ1 LYS 132 -9.741 8.230 -17.609 1061 HZ2 LYS 132 HZ2 LYS 132 -11.320 8.348 -18.088 1062 HZ3 LYS 132 HZ3 LYS 132 -10.214 7.570 -19.049 1063 H TYR 133 H TYR 133 -7.071 3.615 -13.911 1064 HA TYR 133 HA TYR 133 -8.004 1.503 -12.136 1065 HB2 TYR 133 HB2 TYR 133 -5.430 1.961 -13.640 1066 HB3 TYR 133 HB3 TYR 133 -5.642 0.613 -12.508 1067 HD1 TYR 133 HD1 TYR 133 -7.709 -0.937 -12.854 1068 HD2 TYR 133 HD2 TYR 133 -6.207 1.721 -15.889 1069 HE1 TYR 133 HE1 TYR 133 -8.930 -2.234 -14.600 1070 HE2 TYR 133 HE2 TYR 133 -7.441 0.426 -17.628 1071 HH TYR 133 HH TYR 133 -8.844 -1.334 -18.052 1072 H TYR 134 H TYR 134 -6.018 4.384 -11.720 1073 HA TYR 134 HA TYR 134 -4.894 3.633 -9.174 1074 HB2 TYR 134 HB2 TYR 134 -3.904 5.551 -9.976 1075 HB3 TYR 134 HB3 TYR 134 -5.403 6.173 -10.648 1076 HD1 TYR 134 HD1 TYR 134 -3.632 5.665 -7.377 1077 HD2 TYR 134 HD2 TYR 134 -6.706 7.796 -9.501 1078 HE1 TYR 134 HE1 TYR 134 -3.914 7.198 -5.434 1079 HE2 TYR 134 HE2 TYR 134 -7.004 9.301 -7.545 1080 HH TYR 134 HH TYR 134 -5.032 8.971 -4.571 1081 H GLY 135 H GLY 135 -7.979 5.263 -10.134 1082 HA2 GLY 135 HA2 GLY 135 -8.957 5.557 -7.483 1083 HA3 GLY 135 HA3 GLY 135 -9.959 5.421 -8.941 1084 H GLN 136 H GLN 136 -9.216 2.805 -9.754 1085 HA GLN 136 HA GLN 136 -10.915 1.226 -8.060 1086 HB2 GLN 136 HB2 GLN 136 -8.915 0.447 -10.208 1087 HB3 GLN 136 HB3 GLN 136 -9.993 -0.700 -9.408 1088 HG2 GLN 136 HG2 GLN 136 -11.945 0.473 -10.263 1089 HG3 GLN 136 HG3 GLN 136 -10.916 1.707 -10.998 1090 HE21 GLN 136 HE21 GLN 136 -10.751 1.475 -13.105 1091 HE22 GLN 136 HE22 GLN 136 -10.644 -0.050 -13.957 1092 H THR 137 H THR 137 -7.325 1.410 -8.367 1093 HA THR 137 HA THR 137 -6.948 -0.751 -6.490 1094 HB THR 137 HB THR 137 -4.558 0.152 -6.321 1095 HG1 THR 137 HG1 THR 137 -5.428 1.769 -8.501 1096 HG21 THR 137 HG21 THR 137 -5.680 -0.464 -9.082 1097 HG22 THR 137 HG22 THR 137 -5.133 -1.651 -7.873 1098 HG23 THR 137 HG23 THR 137 -3.966 -0.538 -8.619 1099 H VAL 138 H VAL 138 -7.360 2.779 -6.073 1100 HA VAL 138 HA VAL 138 -6.438 2.852 -3.369 1101 HB VAL 138 HB VAL 138 -8.583 4.488 -4.797 1102 HG11 VAL 138 HG11 VAL 138 -7.500 4.841 -1.963 1103 HG12 VAL 138 HG12 VAL 138 -8.408 6.087 -2.852 1104 HG13 VAL 138 HG13 VAL 138 -9.191 4.553 -2.439 1105 HG21 VAL 138 HG21 VAL 138 -6.111 4.732 -5.426 1106 HG22 VAL 138 HG22 VAL 138 -6.931 6.214 -4.909 1107 HG23 VAL 138 HG23 VAL 138 -5.845 5.358 -3.793 1108 H SER 139 H SER 139 -9.675 2.093 -4.725 1109 HA SER 139 HA SER 139 -10.886 1.634 -2.162 1110 HB2 SER 139 HB2 SER 139 -12.130 1.968 -4.317 1111 HB3 SER 139 HB3 SER 139 -11.603 0.354 -4.834 1112 HG SER 139 HG SER 139 -12.776 -0.557 -3.151 1113 H ASN 140 H ASN 140 -9.388 -0.565 -4.566 1114 HA ASN 140 HA ASN 140 -9.865 -2.940 -3.127 1115 HB2 ASN 140 HB2 ASN 140 -8.921 -2.379 -5.553 1116 HB3 ASN 140 HB3 ASN 140 -7.370 -2.658 -4.757 1117 HD21 ASN 140 HD21 ASN 140 -8.607 -4.669 -2.893 1118 HD22 ASN 140 HD22 ASN 140 -8.842 -6.089 -3.886 1119 H ILE 141 H ILE 141 -7.160 -0.621 -2.858 1120 HA ILE 141 HA ILE 141 -5.550 -2.274 -1.118 1121 HB ILE 141 HB ILE 141 -5.663 0.726 -1.669 1122 HG12 ILE 141 HG12 ILE 141 -4.680 -0.868 -3.373 1123 HG13 ILE 141 HG13 ILE 141 -3.613 0.427 -2.840 1124 HG21 ILE 141 HG21 ILE 141 -3.456 0.847 -0.339 1125 HG22 ILE 141 HG22 ILE 141 -4.952 0.719 0.607 1126 HG23 ILE 141 HG23 ILE 141 -3.928 -0.712 0.373 1127 HD11 ILE 141 HD11 ILE 141 -3.457 -2.384 -1.679 1128 HD12 ILE 141 HD12 ILE 141 -2.549 -1.862 -3.113 1129 HD13 ILE 141 HD13 ILE 141 -2.271 -1.075 -1.560 1130 H ASN 142 H ASN 142 -8.137 0.157 -0.570 1131 HA ASN 142 HA ASN 142 -7.898 0.124 2.293 1132 HB2 ASN 142 HB2 ASN 142 -9.154 1.818 0.905 1133 HB3 ASN 142 HB3 ASN 142 -10.409 0.599 0.644 1134 HD21 ASN 142 HD21 ASN 142 -9.156 2.978 2.744 1135 HD22 ASN 142 HD22 ASN 142 -10.287 2.728 4.051 1136 H GLU 143 H GLU 143 -9.827 -1.828 -0.008 1137 HA GLU 143 HA GLU 143 -11.257 -3.304 1.956 1138 HB2 GLU 143 HB2 GLU 143 -10.310 -4.106 -0.814 1139 HB3 GLU 143 HB3 GLU 143 -11.491 -5.019 0.121 1140 HG2 GLU 143 HG2 GLU 143 -13.184 -3.519 -0.274 1141 HG3 GLU 143 HG3 GLU 143 -12.090 -2.135 -0.402 1142 H VAL 144 H VAL 144 -8.092 -3.874 0.442 1143 HA VAL 144 HA VAL 144 -7.661 -6.418 1.766 1144 HB VAL 144 HB VAL 144 -5.775 -4.402 0.440 1145 HG11 VAL 144 HG11 VAL 144 -4.019 -6.195 0.566 1146 HG12 VAL 144 HG12 VAL 144 -4.433 -5.495 2.139 1147 HG13 VAL 144 HG13 VAL 144 -5.069 -7.092 1.689 1148 HG21 VAL 144 HG21 VAL 144 -6.655 -7.215 -0.345 1149 HG22 VAL 144 HG22 VAL 144 -7.281 -5.708 -1.045 1150 HG23 VAL 144 HG23 VAL 144 -5.582 -6.154 -1.281 1151 H LEU 145 H LEU 145 -7.101 -2.985 2.606 1152 HA LEU 145 HA LEU 145 -5.319 -3.552 4.797 1153 HB2 LEU 145 HB2 LEU 145 -6.582 -1.213 3.653 1154 HB3 LEU 145 HB3 LEU 145 -6.716 -1.185 5.408 1155 HG LEU 145 HG LEU 145 -4.202 -1.633 5.498 1156 HD11 LEU 145 HD11 LEU 145 -2.925 -0.932 3.516 1157 HD12 LEU 145 HD12 LEU 145 -4.435 -0.864 2.584 1158 HD13 LEU 145 HD13 LEU 145 -3.861 -2.415 3.227 1159 HD21 LEU 145 HD21 LEU 145 -3.656 0.741 5.104 1160 HD22 LEU 145 HD22 LEU 145 -5.209 0.572 5.951 1161 HD23 LEU 145 HD23 LEU 145 -5.183 0.950 4.212 1162 H ALA 146 H ALA 146 -8.855 -3.273 4.596 1163 HA ALA 146 HA ALA 146 -9.220 -3.405 7.468 1164 HB1 ALA 146 HB1 ALA 146 -11.111 -4.158 5.180 1165 HB2 ALA 146 HB2 ALA 146 -11.582 -3.914 6.881 1166 HB3 ALA 146 HB3 ALA 146 -10.974 -2.544 5.918 1167 H LYS 147 H LYS 147 -8.885 -5.804 4.879 1168 HA LYS 147 HA LYS 147 -9.464 -8.023 6.693 1169 HB2 LYS 147 HB2 LYS 147 -8.292 -7.903 3.914 1170 HB3 LYS 147 HB3 LYS 147 -8.559 -9.400 4.822 1171 HG2 LYS 147 HG2 LYS 147 -10.956 -8.884 4.992 1172 HG3 LYS 147 HG3 LYS 147 -10.703 -7.409 4.037 1173 HD2 LYS 147 HD2 LYS 147 -9.905 -8.755 2.156 1174 HD3 LYS 147 HD3 LYS 147 -10.076 -10.231 3.110 1175 HE2 LYS 147 HE2 LYS 147 -11.970 -9.997 1.611 1176 HE3 LYS 147 HE3 LYS 147 -12.492 -9.861 3.298 1177 HZ1 LYS 147 HZ1 LYS 147 -12.544 -7.463 3.023 1178 HZ2 LYS 147 HZ2 LYS 147 -13.517 -8.186 1.903 1179 HZ3 LYS 147 HZ3 LYS 147 -12.048 -7.586 1.457 1180 H LEU 148 H LEU 148 -6.726 -6.028 6.047 1181 HA LEU 148 HA LEU 148 -4.809 -7.936 7.197 1182 HB2 LEU 148 HB2 LEU 148 -4.660 -5.036 6.348 1183 HB3 LEU 148 HB3 LEU 148 -3.350 -5.804 7.231 1184 HG LEU 148 HG LEU 148 -4.408 -6.835 4.591 1185 HD11 LEU 148 HD11 LEU 148 -3.441 -4.577 4.339 1186 HD12 LEU 148 HD12 LEU 148 -2.414 -5.810 3.588 1187 HD13 LEU 148 HD13 LEU 148 -1.965 -5.124 5.163 1188 HD21 LEU 148 HD21 LEU 148 -2.040 -7.505 6.365 1189 HD22 LEU 148 HD22 LEU 148 -2.079 -7.928 4.646 1190 HD23 LEU 148 HD23 LEU 148 -3.306 -8.588 5.734 1191 H GLY 149 H GLY 149 -7.359 -6.270 8.498 1192 HA2 GLY 149 HA2 GLY 149 -6.067 -5.458 10.999 1193 HA3 GLY 149 HA3 GLY 149 -7.809 -5.664 10.699
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