NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
560607 | 2m2k | 15440 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 LYS 2 HT1 LYS 2 35.175 -6.000 -2.098 2 H2 LYS 2 HT2 LYS 2 34.937 -5.419 -3.672 3 H3 LYS 2 HT3 LYS 2 35.275 -4.338 -2.413 4 HA LYS 2 HA LYS 2 37.118 -6.434 -3.407 5 HB2 LYS 2 HB2 LYS 2 37.185 -3.430 -3.778 6 HB3 LYS 2 HB1 LYS 2 38.454 -4.540 -4.274 7 HG2 LYS 2 HG2 LYS 2 35.640 -4.505 -5.337 8 HG3 LYS 2 HG1 LYS 2 37.058 -3.839 -6.146 9 HD2 LYS 2 HD2 LYS 2 38.049 -6.034 -6.309 10 HD3 LYS 2 HD1 LYS 2 36.731 -6.733 -5.366 11 HE2 LYS 2 HE2 LYS 2 36.417 -5.383 -8.044 12 HE3 LYS 2 HE1 LYS 2 36.504 -7.126 -7.799 13 HZ1 LYS 2 HZ1 LYS 2 34.466 -7.139 -6.682 14 HZ2 LYS 2 HZ2 LYS 2 34.215 -6.099 -8.000 15 HZ3 LYS 2 HZ3 LYS 2 34.462 -5.459 -6.452 16 H VAL 3 HN VAL 3 39.305 -6.138 -2.555 17 HA VAL 3 HA VAL 3 39.331 -4.831 0.087 18 HB VAL 3 HB VAL 3 40.701 -6.718 0.960 19 HG11 VAL 3 HG11 VAL 3 37.946 -7.473 -0.006 20 HG12 VAL 3 HG12 VAL 3 38.327 -6.584 1.470 21 HG13 VAL 3 HG13 VAL 3 38.834 -8.265 1.295 22 HG21 VAL 3 HG21 VAL 3 40.673 -8.859 -0.229 23 HG22 VAL 3 HG22 VAL 3 41.503 -7.611 -1.159 24 HG23 VAL 3 HG23 VAL 3 39.861 -8.090 -1.594 25 H GLN 4 HN GLN 4 40.460 -4.379 -2.740 26 HA GLN 4 HA GLN 4 43.321 -4.481 -2.238 27 HB2 GLN 4 HB2 GLN 4 42.405 -5.106 -4.456 28 HB3 GLN 4 HB1 GLN 4 41.812 -3.463 -4.653 29 HG2 GLN 4 HG2 GLN 4 44.086 -2.617 -4.625 30 HG3 GLN 4 HG1 GLN 4 44.703 -4.245 -4.354 31 HE21 GLN 4 HE21 GLN 4 43.209 -2.088 -6.647 32 HE22 GLN 4 HE22 GLN 4 43.583 -3.028 -8.057 33 H GLU 5 HN GLU 5 40.715 -2.236 -2.109 34 HA GLU 5 HA GLU 5 42.489 0.082 -2.130 35 HB2 GLU 5 HB2 GLU 5 39.497 0.060 -1.694 36 HB3 GLU 5 HB1 GLU 5 40.499 1.429 -2.145 37 HG2 GLU 5 HG2 GLU 5 39.276 0.752 -4.063 38 HG3 GLU 5 HG1 GLU 5 40.959 0.285 -4.311 39 H GLN 6 HN GLN 6 40.855 -1.997 0.049 40 HA GLN 6 HA GLN 6 40.553 -0.033 2.149 41 HB2 GLN 6 HB2 GLN 6 40.011 -2.999 2.290 42 HB3 GLN 6 HB1 GLN 6 39.357 -1.740 3.330 43 HG2 GLN 6 HG2 GLN 6 38.778 -2.041 0.392 44 HG3 GLN 6 HG1 GLN 6 37.721 -2.559 1.701 45 HE21 GLN 6 HE21 GLN 6 38.235 -0.278 3.385 46 HE22 GLN 6 HE22 GLN 6 37.430 1.069 2.652 47 H SER 7 HN SER 7 43.246 -0.392 1.505 48 HA SER 7 HA SER 7 44.434 -2.211 3.405 49 HB2 SER 7 HB2 SER 7 45.674 -0.118 1.608 50 HB3 SER 7 HB1 SER 7 46.583 -1.276 2.582 51 HG SER 7 HG SER 7 45.163 -2.883 1.385 52 H VAL 8 HN VAL 8 42.710 -0.230 4.516 53 HA VAL 8 HA VAL 8 44.582 1.390 6.108 54 HB VAL 8 HB VAL 8 41.567 1.641 6.071 55 HG11 VAL 8 HG11 VAL 8 42.014 3.908 6.894 56 HG12 VAL 8 HG12 VAL 8 43.743 3.560 6.894 57 HG13 VAL 8 HG13 VAL 8 42.665 2.673 7.972 58 HG21 VAL 8 HG21 VAL 8 42.364 1.962 3.794 59 HG22 VAL 8 HG22 VAL 8 43.544 3.144 4.358 60 HG23 VAL 8 HG23 VAL 8 41.819 3.489 4.486 61 H GLY 9 HN GLY 9 43.205 -1.539 6.110 62 HA2 GLY 9 HA2 GLY 9 43.035 -3.113 7.809 63 HA3 GLY 9 HA1 GLY 9 43.334 -1.834 8.979 64 H ALA 10 HN ALA 10 40.884 -1.468 6.558 65 HA ALA 10 HA ALA 10 38.768 -2.206 8.425 66 HB1 ALA 10 HB1 ALA 10 38.942 0.534 7.176 67 HB2 ALA 10 HB2 ALA 10 39.213 0.160 8.878 68 HB3 ALA 10 HB3 ALA 10 37.616 -0.076 8.167 69 HA PRO 11 HA PRO 11 37.285 -3.463 4.343 70 HB2 PRO 11 HB2 PRO 11 35.850 -5.554 5.181 71 HB3 PRO 11 HB1 PRO 11 37.615 -5.630 5.118 72 HG2 PRO 11 HG2 PRO 11 35.823 -5.193 7.473 73 HG3 PRO 11 HG1 PRO 11 37.287 -6.183 7.348 74 HD2 PRO 11 HD2 PRO 11 37.193 -3.634 8.415 75 HD3 PRO 11 HD1 PRO 11 38.656 -4.409 7.776 76 HA PRO 12 HA PRO 12 33.422 -1.257 4.522 77 HB2 PRO 12 HB2 PRO 12 32.646 -2.842 2.155 78 HB3 PRO 12 HB1 PRO 12 32.817 -1.093 2.329 79 HG2 PRO 12 HG2 PRO 12 34.587 -2.541 0.933 80 HG3 PRO 12 HG1 PRO 12 35.080 -1.134 1.893 81 HD2 PRO 12 HD2 PRO 12 35.336 -4.047 2.530 82 HD3 PRO 12 HD1 PRO 12 36.483 -2.722 2.824 83 HA PRO 13 HA PRO 13 31.133 -4.525 6.607 84 HB2 PRO 13 HB2 PRO 13 29.423 -2.876 7.918 85 HB3 PRO 13 HB1 PRO 13 31.083 -3.165 8.453 86 HG2 PRO 13 HG2 PRO 13 29.957 -0.856 6.926 87 HG3 PRO 13 HG1 PRO 13 31.148 -0.856 8.238 88 HD2 PRO 13 HD2 PRO 13 31.816 -0.616 5.611 89 HD3 PRO 13 HD1 PRO 13 32.888 -1.344 6.823 90 H GLY 14 HN GLY 14 30.365 -5.084 4.404 91 HA2 GLY 14 HA2 GLY 14 27.487 -4.495 4.217 92 HA3 GLY 14 HA1 GLY 14 28.497 -4.393 2.778 93 H ARG 15 HN ARG 15 26.358 -6.310 4.268 94 HA ARG 15 HA ARG 15 27.730 -8.829 4.057 95 HB2 ARG 15 HB2 ARG 15 26.062 -8.624 5.775 96 HB3 ARG 15 HB1 ARG 15 24.843 -8.141 4.603 97 HG2 ARG 15 HG2 ARG 15 24.981 -10.363 3.564 98 HG3 ARG 15 HG1 ARG 15 26.163 -10.842 4.781 99 HD2 ARG 15 HD2 ARG 15 24.557 -10.634 6.531 100 HD3 ARG 15 HD1 ARG 15 23.390 -9.874 5.449 101 HE ARG 15 HE ARG 15 23.460 -12.106 4.233 102 HH11 ARG 15 HH11 ARG 15 23.963 -11.811 7.682 103 HH12 ARG 15 HH12 ARG 15 23.406 -13.424 8.026 104 HH21 ARG 15 HH21 ARG 15 22.704 -14.195 4.670 105 HH22 ARG 15 HH22 ARG 15 22.643 -14.766 6.322 106 H ALA 16 HN ALA 16 28.198 -9.636 2.143 107 HA ALA 16 HA ALA 16 26.465 -9.303 -0.150 108 HB1 ALA 16 HB1 ALA 16 28.107 -10.711 -1.307 109 HB2 ALA 16 HB2 ALA 16 28.921 -11.023 0.225 110 HB3 ALA 16 HB3 ALA 16 28.896 -9.391 -0.444 111 H ASP 17 HN ASP 17 24.530 -10.311 0.203 112 HA ASP 17 HA ASP 17 24.610 -13.114 1.112 113 HB2 ASP 17 HB2 ASP 17 23.601 -11.624 2.767 114 HB3 ASP 17 HB1 ASP 17 22.476 -11.016 1.562 115 H LYS 18 HN LYS 18 22.891 -14.514 0.283 116 HA LYS 18 HA LYS 18 22.536 -14.491 -2.469 117 HB2 LYS 18 HB2 LYS 18 22.185 -16.500 -1.147 118 HB3 LYS 18 HB1 LYS 18 20.835 -15.756 -0.306 119 HG2 LYS 18 HG2 LYS 18 19.901 -17.243 -1.871 120 HG3 LYS 18 HG1 LYS 18 19.663 -15.627 -2.530 121 HD2 LYS 18 HD2 LYS 18 20.364 -17.102 -4.296 122 HD3 LYS 18 HD1 LYS 18 21.669 -15.966 -3.950 123 HE2 LYS 18 HE2 LYS 18 22.887 -17.619 -2.735 124 HE3 LYS 18 HE1 LYS 18 21.521 -18.734 -2.773 125 HZ1 LYS 18 HZ1 LYS 18 23.256 -19.305 -4.386 126 HZ2 LYS 18 HZ2 LYS 18 23.027 -17.819 -5.168 127 HZ3 LYS 18 HZ3 LYS 18 21.777 -18.964 -5.140 128 H THR 19 HN THR 19 20.421 -13.277 0.091 129 HA THR 19 HA THR 19 18.435 -12.346 -1.796 130 HB THR 19 HB THR 19 18.580 -11.686 1.145 131 HG1 THR 19 HG1 THR 19 18.475 -13.811 1.348 132 HG21 THR 19 HG21 THR 19 16.261 -11.953 -0.770 133 HG22 THR 19 HG22 THR 19 16.936 -10.440 -0.168 134 HG23 THR 19 HG23 THR 19 16.143 -11.554 0.945 135 H ALA 20 HN ALA 20 20.804 -10.945 0.434 136 HA ALA 20 HA ALA 20 20.195 -8.265 -0.570 137 HB1 ALA 20 HB1 ALA 20 21.846 -9.114 1.806 138 HB2 ALA 20 HB2 ALA 20 20.159 -8.599 1.851 139 HB3 ALA 20 HB3 ALA 20 21.418 -7.457 1.378 140 H ALA 21 HN ALA 21 21.385 -9.353 -2.571 141 HA ALA 21 HA ALA 21 24.266 -9.171 -2.361 142 HB1 ALA 21 HB1 ALA 21 24.337 -9.971 -4.636 143 HB2 ALA 21 HB2 ALA 21 22.596 -9.750 -4.802 144 HB3 ALA 21 HB3 ALA 21 23.228 -10.965 -3.690 145 HA PRO 22 HA PRO 22 23.759 -5.445 -5.178 146 HB2 PRO 22 HB2 PRO 22 21.212 -4.884 -6.193 147 HB3 PRO 22 HB1 PRO 22 22.495 -5.766 -7.020 148 HG2 PRO 22 HG2 PRO 22 20.018 -6.806 -6.140 149 HG3 PRO 22 HG1 PRO 22 21.398 -7.725 -6.762 150 HD2 PRO 22 HD2 PRO 22 20.552 -7.246 -3.949 151 HD3 PRO 22 HD1 PRO 22 21.389 -8.645 -4.659 152 H GLN 23 HN GLN 23 20.378 -4.733 -4.650 153 HA GLN 23 HA GLN 23 21.162 -2.633 -2.733 154 HB2 GLN 23 HB2 GLN 23 19.265 -1.313 -3.680 155 HB3 GLN 23 HB1 GLN 23 20.558 -1.622 -4.832 156 HG2 GLN 23 HG2 GLN 23 19.271 -3.394 -5.857 157 HG3 GLN 23 HG1 GLN 23 17.998 -3.197 -4.657 158 HE21 GLN 23 HE21 GLN 23 19.677 -0.469 -6.035 159 HE22 GLN 23 HE22 GLN 23 18.345 0.117 -6.978 160 H THR 24 HN THR 24 19.596 -5.471 -2.939 161 HA THR 24 HA THR 24 17.099 -4.846 -1.687 162 HB THR 24 HB THR 24 17.167 -7.478 -1.466 163 HG1 THR 24 HG1 THR 24 18.808 -8.386 -2.454 164 HG21 THR 24 HG21 THR 24 15.675 -6.213 -2.945 165 HG22 THR 24 HG22 THR 24 16.312 -7.642 -3.757 166 HG23 THR 24 HG23 THR 24 16.976 -6.051 -4.124 167 H ARG 25 HN ARG 25 19.286 -3.933 -0.127 168 HA ARG 25 HA ARG 25 18.625 -5.381 2.331 169 HB2 ARG 25 HB2 ARG 25 20.936 -5.194 3.145 170 HB3 ARG 25 HB1 ARG 25 20.828 -6.199 1.709 171 HG2 ARG 25 HG2 ARG 25 21.576 -4.232 0.366 172 HG3 ARG 25 HG1 ARG 25 21.845 -3.373 1.886 173 HD2 ARG 25 HD2 ARG 25 23.399 -5.150 2.588 174 HD3 ARG 25 HD1 ARG 25 23.159 -5.952 1.036 175 HE ARG 25 HE ARG 25 24.138 -3.198 1.013 176 HH11 ARG 25 HH11 ARG 25 24.827 -6.620 0.655 177 HH12 ARG 25 HH12 ARG 25 26.329 -6.357 -0.175 178 HH21 ARG 25 HH21 ARG 25 26.123 -2.858 -0.072 179 HH22 ARG 25 HH22 ARG 25 27.082 -4.228 -0.558 180 H LEU 26 HN LEU 26 18.466 -2.616 0.687 181 HA LEU 26 HA LEU 26 18.626 -0.965 3.110 182 HB2 LEU 26 HB2 LEU 26 19.052 -0.117 0.246 183 HB3 LEU 26 HB1 LEU 26 19.011 0.977 1.614 184 HG LEU 26 HG LEU 26 21.053 -1.217 1.263 185 HD11 LEU 26 HD11 LEU 26 22.604 0.570 0.673 186 HD12 LEU 26 HD12 LEU 26 21.291 1.744 0.749 187 HD13 LEU 26 HD13 LEU 26 21.273 0.480 -0.479 188 HD21 LEU 26 HD21 LEU 26 20.643 -0.575 3.587 189 HD22 LEU 26 HD22 LEU 26 20.916 1.117 3.170 190 HD23 LEU 26 HD23 LEU 26 22.236 -0.046 3.048 191 H THR 27 HN THR 27 16.631 -2.362 0.964 192 HA THR 27 HA THR 27 14.680 -0.187 0.870 193 HB THR 27 HB THR 27 14.416 -2.760 -0.654 194 HG1 THR 27 HG1 THR 27 15.645 -0.694 -2.001 195 HG21 THR 27 HG21 THR 27 13.643 0.099 -1.210 196 HG22 THR 27 HG22 THR 27 12.552 -1.186 -0.692 197 HG23 THR 27 HG23 THR 27 13.323 -1.266 -2.279 198 HA PRO 28 HA PRO 28 12.480 -2.742 3.896 199 HB2 PRO 28 HB2 PRO 28 11.091 -0.750 5.028 200 HB3 PRO 28 HB1 PRO 28 12.814 -0.971 5.349 201 HG2 PRO 28 HG2 PRO 28 11.456 0.989 3.554 202 HG3 PRO 28 HG1 PRO 28 12.869 1.216 4.599 203 HD2 PRO 28 HD2 PRO 28 12.956 0.748 1.860 204 HD3 PRO 28 HD1 PRO 28 14.304 0.499 2.986 205 H TYR 29 HN TYR 29 11.619 -3.180 1.438 206 HA TYR 29 HA TYR 29 9.853 -3.590 0.079 207 HB2 TYR 29 HB2 TYR 29 8.643 -3.625 2.812 208 HB3 TYR 29 HB1 TYR 29 7.588 -3.760 1.409 209 HD1 TYR 29 HD1 TYR 29 10.370 -5.378 3.236 210 HD2 TYR 29 HD2 TYR 29 7.499 -5.755 0.120 211 HE1 TYR 29 HE1 TYR 29 10.860 -7.785 3.079 212 HE2 TYR 29 HE2 TYR 29 7.975 -8.160 -0.040 213 HH TYR 29 HH TYR 29 9.815 -9.840 2.307 214 H ALA 30 HN ALA 30 10.614 -0.828 0.384 215 HA ALA 30 HA ALA 30 9.991 1.245 -0.268 216 HB1 ALA 30 HB1 ALA 30 7.681 -0.172 -1.587 217 HB2 ALA 30 HB2 ALA 30 9.303 -0.014 -2.265 218 HB3 ALA 30 HB3 ALA 30 8.318 1.424 -1.993 219 H GLN 31 HN GLN 31 8.946 0.255 2.306 220 HA GLN 31 HA GLN 31 6.389 1.564 2.601 221 HB2 GLN 31 HB2 GLN 31 8.298 0.391 4.630 222 HB3 GLN 31 HB1 GLN 31 6.719 1.057 5.027 223 HG2 GLN 31 HG2 GLN 31 5.638 -0.618 3.644 224 HG3 GLN 31 HG1 GLN 31 7.209 -1.265 3.175 225 HE21 GLN 31 HE21 GLN 31 6.516 -0.149 6.407 226 HE22 GLN 31 HE22 GLN 31 6.534 -1.705 7.156 227 H ALA 32 HN ALA 32 9.716 2.149 3.701 228 HA ALA 32 HA ALA 32 10.809 4.025 4.385 229 HB1 ALA 32 HB1 ALA 32 8.921 5.363 2.453 230 HB2 ALA 32 HB2 ALA 32 10.434 4.565 2.021 231 HB3 ALA 32 HB3 ALA 32 10.456 6.008 3.035 232 H GLY 33 HN GLY 33 9.317 3.425 6.384 233 HA2 GLY 33 HA2 GLY 33 8.922 5.592 7.930 234 HA3 GLY 33 HA1 GLY 33 7.405 5.494 7.044 235 H GLU 34 HN GLU 34 8.867 4.661 9.845 236 HA GLU 34 HA GLU 34 7.610 2.076 10.192 237 HB2 GLU 34 HB2 GLU 34 9.133 3.814 12.149 238 HB3 GLU 34 HB1 GLU 34 8.535 2.202 12.500 239 HG2 GLU 34 HG2 GLU 34 10.796 1.911 12.021 240 HG3 GLU 34 HG1 GLU 34 9.963 1.410 10.552 241 H ASP 35 HN ASP 35 5.515 3.199 9.623 242 HA ASP 35 HA ASP 35 4.127 3.972 12.081 243 HB2 ASP 35 HB2 ASP 35 4.861 6.083 11.040 244 HB3 ASP 35 HB1 ASP 35 4.095 5.612 9.529 245 H ASN 36 HN ASN 36 1.925 3.434 12.066 246 HA ASN 36 HA ASN 36 1.083 1.449 10.207 247 HB2 ASN 36 HB2 ASN 36 0.263 1.549 12.552 248 HB3 ASN 36 HB1 ASN 36 -0.605 3.031 12.164 249 HD21 ASN 36 HD21 ASN 36 -2.575 2.089 12.707 250 HD22 ASN 36 HD22 ASN 36 -3.354 0.932 11.678 251 H TRP 37 HN TRP 37 1.026 2.156 8.153 252 HA TRP 37 HA TRP 37 0.193 4.801 7.515 253 HB2 TRP 37 HB2 TRP 37 0.610 4.056 5.131 254 HB3 TRP 37 HB1 TRP 37 1.976 3.989 6.229 255 HD1 TRP 37 HD1 TRP 37 0.192 0.978 7.110 256 HE1 TRP 37 HE1 TRP 37 1.062 -1.062 5.802 257 HE3 TRP 37 HE3 TRP 37 2.761 3.423 3.434 258 HZ2 TRP 37 HZ2 TRP 37 2.628 -1.556 3.503 259 HZ3 TRP 37 HZ3 TRP 37 3.915 2.096 1.720 260 HH2 TRP 37 HH2 TRP 37 3.846 -0.339 1.758 261 H ARG 38 HN ARG 38 -1.541 1.794 7.622 262 HA ARG 38 HA ARG 38 -3.420 2.487 5.599 263 HB2 ARG 38 HB2 ARG 38 -4.831 0.690 6.436 264 HB3 ARG 38 HB1 ARG 38 -3.171 0.153 6.209 265 HG2 ARG 38 HG2 ARG 38 -2.773 0.158 8.560 266 HG3 ARG 38 HG1 ARG 38 -4.317 0.956 8.873 267 HD2 ARG 38 HD2 ARG 38 -4.429 -1.443 9.363 268 HD3 ARG 38 HD1 ARG 38 -5.514 -1.000 8.046 269 HE ARG 38 HE ARG 38 -2.907 -1.936 7.204 270 HH11 ARG 38 HH11 ARG 38 -6.207 -2.852 7.995 271 HH12 ARG 38 HH12 ARG 38 -6.148 -4.337 7.084 272 HH21 ARG 38 HH21 ARG 38 -2.837 -3.877 5.989 273 HH22 ARG 38 HH22 ARG 38 -4.226 -4.929 5.963 274 H SER 39 HN SER 39 -3.275 3.066 9.061 275 HA SER 39 HA SER 39 -5.932 4.055 9.269 276 HB2 SER 39 HB2 SER 39 -5.023 5.114 11.405 277 HB3 SER 39 HB1 SER 39 -4.884 3.356 11.292 278 HG SER 39 HG SER 39 -2.944 4.552 11.991 279 H ARG 40 HN ARG 40 -2.807 5.452 8.490 280 HA ARG 40 HA ARG 40 -3.631 8.151 8.485 281 HB2 ARG 40 HB2 ARG 40 -1.423 6.957 6.809 282 HB3 ARG 40 HB1 ARG 40 -1.556 8.565 7.464 283 HG2 ARG 40 HG2 ARG 40 -1.147 6.101 9.102 284 HG3 ARG 40 HG1 ARG 40 0.118 7.235 8.628 285 HD2 ARG 40 HD2 ARG 40 -1.217 9.024 9.805 286 HD3 ARG 40 HD1 ARG 40 -2.228 7.729 10.448 287 HE ARG 40 HE ARG 40 0.518 7.193 10.932 288 HH11 ARG 40 HH11 ARG 40 -2.176 9.133 12.081 289 HH12 ARG 40 HH12 ARG 40 -1.474 9.377 13.652 290 HH21 ARG 40 HH21 ARG 40 1.415 7.501 12.987 291 HH22 ARG 40 HH22 ARG 40 0.559 8.451 14.174 292 H ILE 41 HN ILE 41 -3.303 5.646 6.006 293 HA ILE 41 HA ILE 41 -4.128 7.092 3.762 294 HB ILE 41 HB ILE 41 -4.399 4.173 4.517 295 HG12 ILE 41 HG12 ILE 41 -2.691 5.585 2.464 296 HG13 ILE 41 HG11 ILE 41 -2.148 5.058 4.053 297 HG21 ILE 41 HG21 ILE 41 -5.172 5.414 1.882 298 HG22 ILE 41 HG22 ILE 41 -6.260 4.638 3.035 299 HG23 ILE 41 HG23 ILE 41 -5.034 3.684 2.198 300 HD11 ILE 41 HD11 ILE 41 -3.126 3.258 1.849 301 HD12 ILE 41 HD12 ILE 41 -2.545 2.742 3.432 302 HD13 ILE 41 HD13 ILE 41 -1.443 3.523 2.299 303 H SER 42 HN SER 42 -5.995 5.301 6.200 304 HA SER 42 HA SER 42 -8.556 5.657 5.179 305 HB2 SER 42 HB2 SER 42 -7.671 5.575 8.070 306 HB3 SER 42 HB1 SER 42 -9.333 5.371 7.516 307 HG SER 42 HG SER 42 -7.100 3.700 6.963 308 H GLY 43 HN GLY 43 -6.560 7.908 7.041 309 HA2 GLY 43 HA2 GLY 43 -8.582 9.868 7.439 310 HA3 GLY 43 HA1 GLY 43 -6.846 10.143 7.517 311 H ARG 44 HN ARG 44 -6.285 9.251 4.853 312 HA ARG 44 HA ARG 44 -6.740 11.634 3.401 313 HB2 ARG 44 HB2 ARG 44 -5.073 9.405 3.306 314 HB3 ARG 44 HB1 ARG 44 -6.005 9.319 1.843 315 HG2 ARG 44 HG2 ARG 44 -4.399 10.633 1.003 316 HG3 ARG 44 HG1 ARG 44 -5.226 11.936 1.869 317 HD2 ARG 44 HD2 ARG 44 -3.769 11.804 3.693 318 HD3 ARG 44 HD1 ARG 44 -3.187 10.205 3.222 319 HE ARG 44 HE ARG 44 -2.031 11.342 1.353 320 HH11 ARG 44 HH11 ARG 44 -3.067 13.302 4.067 321 HH12 ARG 44 HH12 ARG 44 -1.723 14.403 3.942 322 HH21 ARG 44 HH21 ARG 44 -0.269 12.789 1.181 323 HH22 ARG 44 HH22 ARG 44 -0.137 14.123 2.291 324 H LEU 45 HN LEU 45 -8.157 8.437 3.505 325 HA LEU 45 HA LEU 45 -9.813 8.630 1.223 326 HB2 LEU 45 HB2 LEU 45 -9.108 6.727 3.129 327 HB3 LEU 45 HB1 LEU 45 -10.819 6.964 3.377 328 HG LEU 45 HG LEU 45 -9.659 6.364 0.677 329 HD11 LEU 45 HD11 LEU 45 -8.987 4.571 2.158 330 HD12 LEU 45 HD12 LEU 45 -10.266 4.013 1.078 331 HD13 LEU 45 HD13 LEU 45 -10.640 4.414 2.754 332 HD21 LEU 45 HD21 LEU 45 -12.428 6.100 1.843 333 HD22 LEU 45 HD22 LEU 45 -11.951 5.490 0.254 334 HD23 LEU 45 HD23 LEU 45 -11.902 7.228 0.591 335 H ASN 46 HN ASN 46 -10.016 9.747 4.453 336 HA ASN 46 HA ASN 46 -12.805 10.308 4.543 337 HB2 ASN 46 HB2 ASN 46 -11.369 10.121 6.577 338 HB3 ASN 46 HB1 ASN 46 -10.569 11.620 6.113 339 HD21 ASN 46 HD21 ASN 46 -11.209 12.651 7.999 340 HD22 ASN 46 HD22 ASN 46 -12.841 13.155 8.261 341 H ARG 47 HN ARG 47 -9.923 12.068 3.587 342 HA ARG 47 HA ARG 47 -11.053 14.510 2.856 343 HB2 ARG 47 HB2 ARG 47 -8.841 14.753 2.570 344 HB3 ARG 47 HB1 ARG 47 -8.598 13.026 2.428 345 HG2 ARG 47 HG2 ARG 47 -9.202 13.156 0.042 346 HG3 ARG 47 HG1 ARG 47 -9.342 14.915 0.207 347 HD2 ARG 47 HD2 ARG 47 -6.997 15.045 0.886 348 HD3 ARG 47 HD1 ARG 47 -6.854 13.288 0.759 349 HE ARG 47 HE ARG 47 -7.745 14.557 -1.670 350 HH11 ARG 47 HH11 ARG 47 -4.923 13.770 0.237 351 HH12 ARG 47 HH12 ARG 47 -3.865 13.617 -1.131 352 HH21 ARG 47 HH21 ARG 47 -6.369 14.379 -3.490 353 HH22 ARG 47 HH22 ARG 47 -4.699 13.960 -3.255 354 H PHE 48 HN PHE 48 -11.178 11.372 1.395 355 HA PHE 48 HA PHE 48 -12.605 12.453 -0.921 356 HB2 PHE 48 HB2 PHE 48 -11.227 9.822 -0.454 357 HB3 PHE 48 HB1 PHE 48 -12.344 10.061 -1.790 358 HD1 PHE 48 HD1 PHE 48 -11.805 11.737 -3.548 359 HD2 PHE 48 HD2 PHE 48 -9.008 10.586 -0.556 360 HE1 PHE 48 HE1 PHE 48 -9.968 12.588 -4.944 361 HE2 PHE 48 HE2 PHE 48 -7.166 11.440 -1.942 362 HZ PHE 48 HZ PHE 48 -7.644 12.440 -4.141 363 H LYS 49 HN LYS 49 -13.656 12.103 1.815 364 HA LYS 49 HA LYS 49 -15.653 11.622 2.776 365 HB2 LYS 49 HB2 LYS 49 -16.176 10.591 0.022 366 HB3 LYS 49 HB1 LYS 49 -17.322 10.266 1.315 367 HG2 LYS 49 HG2 LYS 49 -17.777 12.570 1.600 368 HG3 LYS 49 HG1 LYS 49 -16.412 13.033 0.577 369 HD2 LYS 49 HD2 LYS 49 -18.644 13.198 -0.536 370 HD3 LYS 49 HD1 LYS 49 -17.477 12.171 -1.369 371 HE2 LYS 49 HE2 LYS 49 -19.661 11.124 -1.356 372 HE3 LYS 49 HE1 LYS 49 -18.532 10.188 -0.380 373 HZ1 LYS 49 HZ1 LYS 49 -19.494 11.094 1.607 374 HZ2 LYS 49 HZ2 LYS 49 -20.732 10.443 0.652 375 HZ3 LYS 49 HZ3 LYS 49 -20.501 12.125 0.713 376 H ARG 50 HN ARG 50 -15.107 10.299 4.380 377 HA ARG 50 HA ARG 50 -14.273 7.578 3.748 378 HB2 ARG 50 HB2 ARG 50 -12.907 8.960 5.291 379 HB3 ARG 50 HB1 ARG 50 -14.263 8.997 6.410 380 HG2 ARG 50 HG2 ARG 50 -14.150 6.609 6.701 381 HG3 ARG 50 HG1 ARG 50 -12.878 6.492 5.483 382 HD2 ARG 50 HD2 ARG 50 -11.951 6.387 7.733 383 HD3 ARG 50 HD1 ARG 50 -11.403 7.832 6.888 384 HE ARG 50 HE ARG 50 -13.312 8.948 8.193 385 HH11 ARG 50 HH11 ARG 50 -11.388 6.274 9.366 386 HH12 ARG 50 HH12 ARG 50 -11.528 6.728 11.036 387 HH21 ARG 50 HH21 ARG 50 -13.492 9.567 10.393 388 HH22 ARG 50 HH22 ARG 50 -12.756 8.575 11.620 389 H TYR 51 HN TYR 51 -15.952 6.341 3.402 390 HA TYR 51 HA TYR 51 -18.403 6.406 4.828 391 HB2 TYR 51 HB2 TYR 51 -17.517 5.238 2.533 392 HB3 TYR 51 HB1 TYR 51 -17.504 3.858 3.615 393 HD1 TYR 51 HD1 TYR 51 -19.984 5.016 5.232 394 HD2 TYR 51 HD2 TYR 51 -19.193 4.232 1.127 395 HE1 TYR 51 HE1 TYR 51 -22.391 4.733 4.825 396 HE2 TYR 51 HE2 TYR 51 -21.596 3.943 0.711 397 HH TYR 51 HH TYR 51 -23.949 4.964 2.817 398 HA PRO 52 HA PRO 52 -16.591 4.716 8.613 399 HB2 PRO 52 HB2 PRO 52 -19.458 4.346 9.302 400 HB3 PRO 52 HB1 PRO 52 -18.182 5.175 10.201 401 HG2 PRO 52 HG2 PRO 52 -20.077 6.554 8.930 402 HG3 PRO 52 HG1 PRO 52 -18.398 7.125 8.970 403 HD2 PRO 52 HD2 PRO 52 -19.893 5.780 6.755 404 HD3 PRO 52 HD1 PRO 52 -18.710 7.102 6.676 405 H LYS 53 HN LYS 53 -16.042 2.667 9.129 406 HA LYS 53 HA LYS 53 -16.602 0.642 7.266 407 HB2 LYS 53 HB2 LYS 53 -15.407 0.412 10.034 408 HB3 LYS 53 HB1 LYS 53 -15.366 -0.851 8.815 409 HG2 LYS 53 HG2 LYS 53 -14.132 1.869 8.447 410 HG3 LYS 53 HG1 LYS 53 -13.258 0.467 9.059 411 HD2 LYS 53 HD2 LYS 53 -12.722 0.437 6.811 412 HD3 LYS 53 HD1 LYS 53 -14.087 -0.678 6.878 413 HE2 LYS 53 HE2 LYS 53 -14.335 0.803 4.980 414 HE3 LYS 53 HE1 LYS 53 -15.580 1.154 6.176 415 HZ1 LYS 53 HZ1 LYS 53 -14.136 2.995 6.974 416 HZ2 LYS 53 HZ2 LYS 53 -14.705 3.197 5.398 417 HZ3 LYS 53 HZ3 LYS 53 -13.102 2.707 5.658 418 H ASP 54 HN ASP 54 -18.176 1.471 10.238 419 HA ASP 54 HA ASP 54 -19.500 -0.963 10.742 420 HB2 ASP 54 HB2 ASP 54 -20.150 1.888 11.466 421 HB3 ASP 54 HB1 ASP 54 -21.159 0.536 11.973 422 H ALA 55 HN ALA 55 -20.199 1.697 8.582 423 HA ALA 55 HA ALA 55 -22.856 0.833 7.971 424 HB1 ALA 55 HB1 ALA 55 -22.152 3.165 7.683 425 HB2 ALA 55 HB2 ALA 55 -22.788 2.477 6.189 426 HB3 ALA 55 HB3 ALA 55 -21.047 2.666 6.402 427 H LEU 56 HN LEU 56 -19.662 0.167 6.744 428 HA LEU 56 HA LEU 56 -20.536 -1.042 4.294 429 HB2 LEU 56 HB2 LEU 56 -17.907 -1.144 5.783 430 HB3 LEU 56 HB1 LEU 56 -18.172 -1.956 4.258 431 HG LEU 56 HG LEU 56 -16.983 0.059 3.832 432 HD11 LEU 56 HD11 LEU 56 -18.426 1.206 2.292 433 HD12 LEU 56 HD12 LEU 56 -19.851 0.518 3.076 434 HD13 LEU 56 HD13 LEU 56 -18.722 -0.531 2.216 435 HD21 LEU 56 HD21 LEU 56 -19.170 1.511 5.291 436 HD22 LEU 56 HD22 LEU 56 -17.838 2.261 4.413 437 HD23 LEU 56 HD23 LEU 56 -17.512 1.288 5.841 438 H ARG 57 HN ARG 57 -19.519 -2.262 7.478 439 HA ARG 57 HA ARG 57 -19.625 -4.990 6.770 440 HB2 ARG 57 HB2 ARG 57 -19.788 -5.413 9.232 441 HB3 ARG 57 HB1 ARG 57 -18.434 -4.407 8.741 442 HG2 ARG 57 HG2 ARG 57 -19.650 -2.418 9.448 443 HG3 ARG 57 HG1 ARG 57 -21.018 -3.423 9.929 444 HD2 ARG 57 HD2 ARG 57 -19.537 -2.746 11.813 445 HD3 ARG 57 HD1 ARG 57 -19.724 -4.489 11.633 446 HE ARG 57 HE ARG 57 -17.482 -4.294 10.385 447 HH11 ARG 57 HH11 ARG 57 -18.425 -2.188 13.025 448 HH12 ARG 57 HH12 ARG 57 -16.812 -2.041 13.649 449 HH21 ARG 57 HH21 ARG 57 -15.353 -4.070 11.183 450 HH22 ARG 57 HH22 ARG 57 -15.064 -3.104 12.593 451 H LEU 58 HN LEU 58 -22.113 -2.732 7.350 452 HA LEU 58 HA LEU 58 -24.078 -4.904 7.587 453 HB2 LEU 58 HB2 LEU 58 -24.392 -1.951 8.137 454 HB3 LEU 58 HB1 LEU 58 -25.662 -3.148 8.296 455 HG LEU 58 HG LEU 58 -23.136 -3.029 9.945 456 HD11 LEU 58 HD11 LEU 58 -24.704 -1.256 10.497 457 HD12 LEU 58 HD12 LEU 58 -24.656 -2.465 11.780 458 HD13 LEU 58 HD13 LEU 58 -26.007 -2.435 10.646 459 HD21 LEU 58 HD21 LEU 58 -24.174 -4.811 11.268 460 HD22 LEU 58 HD22 LEU 58 -23.869 -5.326 9.609 461 HD23 LEU 58 HD23 LEU 58 -25.504 -4.892 10.111 462 H LYS 59 HN LYS 59 -22.617 -3.310 5.197 463 HA LYS 59 HA LYS 59 -24.975 -3.393 3.488 464 HB2 LYS 59 HB2 LYS 59 -24.998 -1.093 4.200 465 HB3 LYS 59 HB1 LYS 59 -23.288 -0.910 3.848 466 HG2 LYS 59 HG2 LYS 59 -23.793 -1.294 1.454 467 HG3 LYS 59 HG1 LYS 59 -25.501 -1.327 1.867 468 HD2 LYS 59 HD2 LYS 59 -23.619 0.987 2.289 469 HD3 LYS 59 HD1 LYS 59 -24.846 0.868 1.029 470 HE2 LYS 59 HE2 LYS 59 -26.591 0.776 2.751 471 HE3 LYS 59 HE1 LYS 59 -25.358 0.923 4.002 472 HZ1 LYS 59 HZ1 LYS 59 -24.727 3.061 2.768 473 HZ2 LYS 59 HZ2 LYS 59 -26.113 3.073 3.735 474 HZ3 LYS 59 HZ3 LYS 59 -26.260 2.947 2.051 475 H ARG 60 HN ARG 60 -21.710 -2.015 3.097 476 HA ARG 60 HA ARG 60 -21.393 -3.748 0.745 477 HB2 ARG 60 HB2 ARG 60 -20.008 -1.144 1.411 478 HB3 ARG 60 HB1 ARG 60 -19.753 -2.095 -0.044 479 HG2 ARG 60 HG2 ARG 60 -22.354 -0.819 0.753 480 HG3 ARG 60 HG1 ARG 60 -21.202 -0.155 -0.408 481 HD2 ARG 60 HD2 ARG 60 -21.485 -2.112 -1.828 482 HD3 ARG 60 HD1 ARG 60 -22.608 -2.812 -0.660 483 HE ARG 60 HE ARG 60 -23.294 -0.185 -1.717 484 HH11 ARG 60 HH11 ARG 60 -23.785 -3.652 -1.858 485 HH12 ARG 60 HH12 ARG 60 -25.279 -3.544 -2.737 486 HH21 ARG 60 HH21 ARG 60 -25.257 -0.034 -2.877 487 HH22 ARG 60 HH22 ARG 60 -26.120 -1.481 -3.303 488 H GLN 61 HN GLN 61 -20.611 -5.519 1.906 489 HA GLN 61 HA GLN 61 -18.217 -5.210 3.520 490 HB2 GLN 61 HB2 GLN 61 -19.214 -7.891 2.664 491 HB3 GLN 61 HB1 GLN 61 -18.558 -7.388 4.214 492 HG2 GLN 61 HG2 GLN 61 -20.683 -6.135 4.609 493 HG3 GLN 61 HG1 GLN 61 -21.322 -6.891 3.150 494 HE21 GLN 61 HE21 GLN 61 -20.395 -7.340 6.438 495 HE22 GLN 61 HE22 GLN 61 -21.077 -8.918 6.632 496 H GLY 62 HN GLY 62 -16.192 -6.319 2.931 497 HA2 GLY 62 HA2 GLY 62 -15.813 -7.748 0.597 498 HA3 GLY 62 HA1 GLY 62 -15.631 -6.066 0.148 499 H VAL 63 HN VAL 63 -14.076 -8.760 1.123 500 HA VAL 63 HA VAL 63 -11.748 -7.203 2.010 501 HB VAL 63 HB VAL 63 -12.200 -10.186 2.273 502 HG11 VAL 63 HG11 VAL 63 -9.845 -9.597 2.059 503 HG12 VAL 63 HG12 VAL 63 -10.208 -10.147 3.695 504 HG13 VAL 63 HG13 VAL 63 -10.010 -8.425 3.368 505 HG21 VAL 63 HG21 VAL 63 -13.693 -8.938 3.743 506 HG22 VAL 63 HG22 VAL 63 -12.322 -8.027 4.374 507 HG23 VAL 63 HG23 VAL 63 -12.439 -9.760 4.675 508 H GLY 64 HN GLY 64 -10.256 -6.889 0.528 509 HA2 GLY 64 HA2 GLY 64 -9.499 -9.013 -1.290 510 HA3 GLY 64 HA1 GLY 64 -10.195 -7.592 -2.061 511 H GLN 65 HN GLN 65 -7.643 -8.339 -2.665 512 HA GLN 65 HA GLN 65 -5.981 -6.470 -1.121 513 HB2 GLN 65 HB2 GLN 65 -5.159 -8.704 -2.985 514 HB3 GLN 65 HB1 GLN 65 -4.040 -7.582 -2.223 515 HG2 GLN 65 HG2 GLN 65 -4.970 -8.373 -0.005 516 HG3 GLN 65 HG1 GLN 65 -5.758 -9.665 -0.910 517 HE21 GLN 65 HE21 GLN 65 -2.763 -8.376 0.230 518 HE22 GLN 65 HE22 GLN 65 -1.779 -9.752 -0.127 519 H VAL 66 HN VAL 66 -5.415 -4.639 -1.967 520 HA VAL 66 HA VAL 66 -5.945 -4.163 -4.826 521 HB VAL 66 HB VAL 66 -6.528 -2.431 -2.410 522 HG11 VAL 66 HG11 VAL 66 -5.691 -1.044 -4.262 523 HG12 VAL 66 HG12 VAL 66 -7.384 -0.738 -3.860 524 HG13 VAL 66 HG13 VAL 66 -6.972 -1.692 -5.293 525 HG21 VAL 66 HG21 VAL 66 -8.843 -2.574 -3.148 526 HG22 VAL 66 HG22 VAL 66 -8.167 -4.175 -2.832 527 HG23 VAL 66 HG23 VAL 66 -8.355 -3.609 -4.493 528 H ARG 67 HN ARG 67 -4.039 -3.753 -5.826 529 HA ARG 67 HA ARG 67 -1.940 -2.430 -4.244 530 HB2 ARG 67 HB2 ARG 67 -0.299 -3.615 -5.354 531 HB3 ARG 67 HB1 ARG 67 -1.587 -4.810 -5.318 532 HG2 ARG 67 HG2 ARG 67 -2.161 -4.273 -7.620 533 HG3 ARG 67 HG1 ARG 67 -0.885 -3.051 -7.661 534 HD2 ARG 67 HD2 ARG 67 0.702 -4.938 -6.995 535 HD3 ARG 67 HD1 ARG 67 -0.613 -6.034 -7.414 536 HE ARG 67 HE ARG 67 -0.102 -4.217 -9.534 537 HH11 ARG 67 HH11 ARG 67 1.244 -7.062 -7.985 538 HH12 ARG 67 HH12 ARG 67 2.033 -7.627 -9.428 539 HH21 ARG 67 HH21 ARG 67 0.984 -4.924 -11.410 540 HH22 ARG 67 HH22 ARG 67 1.892 -6.404 -11.371 541 H PHE 68 HN PHE 68 -0.864 -0.637 -5.137 542 HA PHE 68 HA PHE 68 -1.815 0.471 -7.602 543 HB2 PHE 68 HB2 PHE 68 -2.665 2.567 -6.286 544 HB3 PHE 68 HB1 PHE 68 -3.725 1.191 -6.544 545 HD1 PHE 68 HD2 PHE 68 -1.094 2.028 -4.007 546 HD2 PHE 68 HD1 PHE 68 -5.105 0.837 -4.790 547 HE1 PHE 68 HE2 PHE 68 -1.527 1.887 -1.591 548 HE2 PHE 68 HE1 PHE 68 -5.541 0.695 -2.375 549 HZ PHE 68 HZ PHE 68 -3.755 1.221 -0.773 550 H THR 69 HN THR 69 -0.884 2.435 -8.171 551 HA THR 69 HA THR 69 1.670 3.056 -6.834 552 HB THR 69 HB THR 69 0.741 4.055 -9.530 553 HG1 THR 69 HG1 THR 69 1.697 1.536 -8.774 554 HG21 THR 69 HG21 THR 69 2.651 5.188 -8.525 555 HG22 THR 69 HG22 THR 69 3.161 4.243 -9.924 556 HG23 THR 69 HG23 THR 69 3.466 3.643 -8.293 557 H LEU 70 HN LEU 70 1.943 4.997 -5.879 558 HA LEU 70 HA LEU 70 -0.434 6.731 -5.844 559 HB2 LEU 70 HB2 LEU 70 1.366 5.996 -3.542 560 HB3 LEU 70 HB1 LEU 70 -0.061 7.016 -3.456 561 HG LEU 70 HG LEU 70 -0.122 4.121 -4.292 562 HD11 LEU 70 HD11 LEU 70 -1.085 3.722 -2.042 563 HD12 LEU 70 HD12 LEU 70 -0.635 5.372 -1.599 564 HD13 LEU 70 HD13 LEU 70 0.613 4.199 -2.017 565 HD21 LEU 70 HD21 LEU 70 -1.949 5.522 -5.141 566 HD22 LEU 70 HD22 LEU 70 -2.326 6.016 -3.488 567 HD23 LEU 70 HD23 LEU 70 -2.515 4.330 -3.971 568 H ASP 71 HN ASP 71 -0.166 8.867 -5.902 569 HA ASP 71 HA ASP 71 2.461 9.972 -6.355 570 HB2 ASP 71 HB2 ASP 71 0.452 10.782 -7.595 571 HB3 ASP 71 HB1 ASP 71 -0.204 11.384 -6.073 572 H ARG 72 HN ARG 72 3.303 11.793 -5.067 573 HA ARG 72 HA ARG 72 3.659 11.065 -2.434 574 HB2 ARG 72 HB2 ARG 72 5.184 12.538 -3.629 575 HB3 ARG 72 HB1 ARG 72 3.969 13.808 -3.658 576 HG2 ARG 72 HG2 ARG 72 4.045 13.922 -1.214 577 HG3 ARG 72 HG1 ARG 72 5.293 12.673 -1.208 578 HD2 ARG 72 HD2 ARG 72 6.782 14.114 -2.464 579 HD3 ARG 72 HD1 ARG 72 5.527 15.349 -2.580 580 HE ARG 72 HE ARG 72 5.752 15.049 0.072 581 HH11 ARG 72 HH11 ARG 72 8.119 15.609 -2.453 582 HH12 ARG 72 HH12 ARG 72 9.282 16.333 -1.378 583 HH21 ARG 72 HH21 ARG 72 7.277 16.009 1.482 584 HH22 ARG 72 HH22 ARG 72 8.799 16.559 0.851 585 H GLN 73 HN GLN 73 1.302 13.416 -3.711 586 HA GLN 73 HA GLN 73 0.457 14.095 -1.009 587 HB2 GLN 73 HB2 GLN 73 -1.027 15.710 -2.037 588 HB3 GLN 73 HB1 GLN 73 0.579 15.860 -2.733 589 HG2 GLN 73 HG2 GLN 73 -0.121 14.700 -4.720 590 HG3 GLN 73 HG1 GLN 73 -1.706 14.382 -4.013 591 HE21 GLN 73 HE21 GLN 73 -3.183 16.077 -3.817 592 HE22 GLN 73 HE22 GLN 73 -3.013 17.549 -4.710 593 H GLY 74 HN GLY 74 0.010 11.433 -2.561 594 HA2 GLY 74 HA2 GLY 74 -1.544 9.760 -2.227 595 HA3 GLY 74 HA1 GLY 74 -2.549 10.908 -1.366 596 H HIS 75 HN HIS 75 -1.300 10.743 -4.670 597 HA HIS 75 HA HIS 75 -4.075 10.982 -5.617 598 HB2 HIS 75 HB2 HIS 75 -2.889 12.896 -6.372 599 HB3 HIS 75 HB1 HIS 75 -1.475 11.948 -6.809 600 HD1 HIS 75 HD1 HIS 75 -5.049 12.533 -7.958 601 HD2 HIS 75 HD2 HIS 75 -1.401 11.158 -9.415 602 HE1 HIS 75 HE1 HIS 75 -5.386 12.187 -10.428 603 HE2 HIS 75 HE2 HIS 75 -3.183 11.301 -11.285 604 H VAL 76 HN VAL 76 -4.835 9.093 -6.199 605 HA VAL 76 HA VAL 76 -3.580 6.769 -6.849 606 HB VAL 76 HB VAL 76 -5.960 6.825 -6.534 607 HG11 VAL 76 HG11 VAL 76 -6.447 9.017 -7.457 608 HG12 VAL 76 HG12 VAL 76 -7.505 7.793 -8.162 609 HG13 VAL 76 HG13 VAL 76 -6.137 8.416 -9.087 610 HG21 VAL 76 HG21 VAL 76 -6.728 5.483 -8.443 611 HG22 VAL 76 HG22 VAL 76 -5.123 5.001 -7.894 612 HG23 VAL 76 HG23 VAL 76 -5.299 5.978 -9.350 613 H LEU 77 HN LEU 77 -2.184 6.212 -8.366 614 HA LEU 77 HA LEU 77 -2.192 7.687 -10.906 615 HB2 LEU 77 HB2 LEU 77 0.015 6.218 -9.477 616 HB3 LEU 77 HB1 LEU 77 0.170 6.847 -11.108 617 HG LEU 77 HG LEU 77 -0.543 8.635 -8.798 618 HD11 LEU 77 HD11 LEU 77 1.811 9.198 -8.598 619 HD12 LEU 77 HD12 LEU 77 2.222 7.970 -9.797 620 HD13 LEU 77 HD13 LEU 77 1.544 7.492 -8.240 621 HD21 LEU 77 HD21 LEU 77 0.738 9.133 -11.483 622 HD22 LEU 77 HD22 LEU 77 0.386 10.356 -10.262 623 HD23 LEU 77 HD23 LEU 77 -0.933 9.492 -11.049 624 H ALA 78 HN ALA 78 -1.970 4.507 -9.449 625 HA ALA 78 HA ALA 78 -3.108 3.280 -11.822 626 HB1 ALA 78 HB1 ALA 78 -0.467 2.324 -10.709 627 HB2 ALA 78 HB2 ALA 78 -0.653 3.223 -12.219 628 HB3 ALA 78 HB3 ALA 78 -1.364 1.616 -12.054 629 H VAL 79 HN VAL 79 -4.182 1.332 -11.294 630 HA VAL 79 HA VAL 79 -3.816 0.274 -8.605 631 HB VAL 79 HB VAL 79 -6.591 0.850 -9.667 632 HG11 VAL 79 HG11 VAL 79 -6.424 -1.097 -8.204 633 HG12 VAL 79 HG12 VAL 79 -7.313 0.209 -7.424 634 HG13 VAL 79 HG13 VAL 79 -5.641 -0.111 -6.970 635 HG21 VAL 79 HG21 VAL 79 -5.079 2.313 -7.502 636 HG22 VAL 79 HG22 VAL 79 -6.775 2.555 -7.921 637 HG23 VAL 79 HG23 VAL 79 -5.515 2.960 -9.086 638 H THR 80 HN THR 80 -3.792 -1.863 -8.613 639 HA THR 80 HA THR 80 -5.071 -3.298 -10.845 640 HB THR 80 HB THR 80 -2.418 -4.017 -9.566 641 HG1 THR 80 HG1 THR 80 -3.053 -2.906 -12.122 642 HG21 THR 80 HG21 THR 80 -3.685 -5.971 -10.314 643 HG22 THR 80 HG22 THR 80 -2.279 -5.701 -11.346 644 HG23 THR 80 HG23 THR 80 -3.888 -5.239 -11.905 645 H LEU 81 HN LEU 81 -6.483 -4.810 -10.173 646 HA LEU 81 HA LEU 81 -6.788 -5.368 -7.378 647 HB2 LEU 81 HB2 LEU 81 -8.687 -5.357 -9.003 648 HB3 LEU 81 HB1 LEU 81 -8.036 -6.826 -9.710 649 HG LEU 81 HG LEU 81 -8.281 -7.925 -7.467 650 HD11 LEU 81 HD11 LEU 81 -9.820 -6.860 -5.863 651 HD12 LEU 81 HD12 LEU 81 -9.776 -5.388 -6.833 652 HD13 LEU 81 HD13 LEU 81 -8.307 -5.976 -6.055 653 HD21 LEU 81 HD21 LEU 81 -9.908 -8.295 -9.232 654 HD22 LEU 81 HD22 LEU 81 -10.789 -6.846 -8.750 655 HD23 LEU 81 HD23 LEU 81 -10.707 -8.231 -7.662 656 H VAL 82 HN VAL 82 -5.823 -6.885 -6.236 657 HA VAL 82 HA VAL 82 -3.888 -8.559 -7.667 658 HB VAL 82 HB VAL 82 -3.807 -8.301 -4.709 659 HG11 VAL 82 HG11 VAL 82 -2.027 -9.525 -5.613 660 HG12 VAL 82 HG12 VAL 82 -1.352 -7.917 -5.304 661 HG13 VAL 82 HG13 VAL 82 -1.809 -8.385 -6.941 662 HG21 VAL 82 HG21 VAL 82 -3.091 -6.022 -6.546 663 HG22 VAL 82 HG22 VAL 82 -2.747 -6.103 -4.817 664 HG23 VAL 82 HG23 VAL 82 -4.417 -6.049 -5.384 665 H SER 83 HN SER 83 -6.119 -8.736 -4.906 666 HA SER 83 HA SER 83 -6.745 -11.501 -5.623 667 HB2 SER 83 HB2 SER 83 -6.142 -10.672 -2.771 668 HB3 SER 83 HB1 SER 83 -6.489 -12.298 -3.358 669 HG SER 83 HG SER 83 -4.164 -11.451 -2.991 670 H SER 84 HN SER 84 -8.900 -11.981 -5.332 671 HA SER 84 HA SER 84 -10.490 -10.053 -3.777 672 HB2 SER 84 HB2 SER 84 -10.794 -9.506 -6.125 673 HB3 SER 84 HB1 SER 84 -11.199 -11.184 -6.496 674 HG SER 84 HG SER 84 -12.828 -9.234 -5.724 675 H ALA 85 HN ALA 85 -11.877 -10.931 -2.378 676 HA ALA 85 HA ALA 85 -11.949 -13.827 -2.176 677 HB1 ALA 85 HB1 ALA 85 -13.134 -11.754 -0.338 678 HB2 ALA 85 HB2 ALA 85 -11.517 -12.445 -0.187 679 HB3 ALA 85 HB3 ALA 85 -12.938 -13.474 0.000 680 H GLY 86 HN GLY 86 -13.622 -11.852 -4.037 681 HA2 GLY 86 HA2 GLY 86 -15.491 -12.707 -5.270 682 HA3 GLY 86 HA1 GLY 86 -16.034 -13.518 -3.808 683 H LEU 87 HN LEU 87 -15.460 -10.246 -5.094 684 HA LEU 87 HA LEU 87 -17.804 -9.366 -3.534 685 HB2 LEU 87 HB2 LEU 87 -15.592 -7.577 -4.525 686 HB3 LEU 87 HB1 LEU 87 -16.892 -7.137 -3.458 687 HG LEU 87 HG LEU 87 -15.039 -7.242 -2.054 688 HD11 LEU 87 HD11 LEU 87 -15.375 -9.189 -0.625 689 HD12 LEU 87 HD12 LEU 87 -16.341 -9.947 -1.892 690 HD13 LEU 87 HD13 LEU 87 -16.900 -8.459 -1.128 691 HD21 LEU 87 HD21 LEU 87 -13.497 -8.272 -3.656 692 HD22 LEU 87 HD22 LEU 87 -14.219 -9.848 -3.326 693 HD23 LEU 87 HD23 LEU 87 -13.369 -8.982 -2.047 694 HA PRO 88 HA PRO 88 -19.027 -8.873 -7.927 695 HB2 PRO 88 HB2 PRO 88 -21.704 -9.585 -7.083 696 HB3 PRO 88 HB1 PRO 88 -20.617 -10.467 -8.157 697 HG2 PRO 88 HG2 PRO 88 -21.331 -11.349 -5.668 698 HG3 PRO 88 HG1 PRO 88 -19.811 -11.783 -6.470 699 HD2 PRO 88 HD2 PRO 88 -20.320 -9.726 -4.352 700 HD3 PRO 88 HD1 PRO 88 -18.959 -10.859 -4.521 701 H SER 89 HN SER 89 -21.931 -8.348 -6.034 702 HA SER 89 HA SER 89 -22.403 -5.782 -7.097 703 HB2 SER 89 HB2 SER 89 -23.609 -6.972 -4.592 704 HB3 SER 89 HB1 SER 89 -24.320 -5.741 -5.638 705 HG SER 89 HG SER 89 -25.174 -7.352 -6.671 706 H LEU 90 HN LEU 90 -20.454 -6.840 -4.547 707 HA LEU 90 HA LEU 90 -20.646 -4.554 -2.836 708 HB2 LEU 90 HB2 LEU 90 -18.447 -6.623 -2.961 709 HB3 LEU 90 HB1 LEU 90 -18.840 -5.574 -1.613 710 HG LEU 90 HG LEU 90 -20.819 -7.586 -2.630 711 HD11 LEU 90 HD11 LEU 90 -19.965 -9.208 -1.115 712 HD12 LEU 90 HD12 LEU 90 -18.800 -8.061 -0.452 713 HD13 LEU 90 HD13 LEU 90 -18.605 -8.655 -2.106 714 HD21 LEU 90 HD21 LEU 90 -21.656 -5.854 -1.156 715 HD22 LEU 90 HD22 LEU 90 -20.380 -6.202 0.011 716 HD23 LEU 90 HD23 LEU 90 -21.628 -7.405 -0.315 717 H ASP 91 HN ASP 91 -18.419 -5.684 -5.308 718 HA ASP 91 HA ASP 91 -16.210 -4.106 -4.746 719 HB2 ASP 91 HB2 ASP 91 -16.330 -6.082 -6.293 720 HB3 ASP 91 HB1 ASP 91 -17.062 -5.021 -7.493 721 H ARG 92 HN ARG 92 -18.979 -3.409 -6.802 722 HA ARG 92 HA ARG 92 -17.992 -1.231 -8.187 723 HB2 ARG 92 HB2 ARG 92 -20.366 -0.572 -8.501 724 HB3 ARG 92 HB1 ARG 92 -20.066 -2.273 -8.828 725 HG2 ARG 92 HG2 ARG 92 -20.928 -2.818 -6.581 726 HG3 ARG 92 HG1 ARG 92 -21.308 -1.112 -6.347 727 HD2 ARG 92 HD2 ARG 92 -23.298 -2.270 -7.013 728 HD3 ARG 92 HD1 ARG 92 -22.786 -1.215 -8.331 729 HE ARG 92 HE ARG 92 -21.848 -3.943 -8.526 730 HH11 ARG 92 HH11 ARG 92 -24.419 -1.704 -9.321 731 HH12 ARG 92 HH12 ARG 92 -24.985 -2.646 -10.672 732 HH21 ARG 92 HH21 ARG 92 -22.636 -5.215 -10.261 733 HH22 ARG 92 HH22 ARG 92 -23.992 -4.634 -11.185 734 H GLU 93 HN GLU 93 -19.741 -1.195 -5.063 735 HA GLU 93 HA GLU 93 -19.497 1.664 -4.896 736 HB2 GLU 93 HB2 GLU 93 -21.456 0.426 -3.997 737 HB3 GLU 93 HB1 GLU 93 -20.412 -0.254 -2.757 738 HG2 GLU 93 HG2 GLU 93 -20.311 1.676 -1.579 739 HG3 GLU 93 HG1 GLU 93 -20.438 2.693 -3.014 740 H ILE 94 HN ILE 94 -18.025 -1.086 -3.167 741 HA ILE 94 HA ILE 94 -16.601 0.476 -1.331 742 HB ILE 94 HB ILE 94 -15.249 -1.497 -0.858 743 HG12 ILE 94 HG12 ILE 94 -16.705 -2.803 -3.169 744 HG13 ILE 94 HG11 ILE 94 -15.013 -2.316 -3.192 745 HG21 ILE 94 HG21 ILE 94 -17.445 -1.287 0.145 746 HG22 ILE 94 HG22 ILE 94 -17.065 -2.980 -0.172 747 HG23 ILE 94 HG23 ILE 94 -18.172 -2.111 -1.235 748 HD11 ILE 94 HD11 ILE 94 -15.260 -4.706 -2.805 749 HD12 ILE 94 HD12 ILE 94 -16.227 -4.382 -1.366 750 HD13 ILE 94 HD13 ILE 94 -14.528 -3.910 -1.411 751 H GLN 95 HN GLN 95 -15.670 -0.738 -4.556 752 HA GLN 95 HA GLN 95 -13.021 0.281 -4.244 753 HB2 GLN 95 HB2 GLN 95 -14.384 -0.525 -6.796 754 HB3 GLN 95 HB1 GLN 95 -12.697 -0.271 -6.546 755 HG2 GLN 95 HG2 GLN 95 -14.264 -2.394 -5.146 756 HG3 GLN 95 HG1 GLN 95 -13.360 -2.655 -6.635 757 HE21 GLN 95 HE21 GLN 95 -13.047 -3.954 -4.127 758 HE22 GLN 95 HE22 GLN 95 -11.441 -3.625 -3.575 759 H ALA 96 HN ALA 96 -16.037 1.470 -5.646 760 HA ALA 96 HA ALA 96 -15.026 3.653 -7.040 761 HB1 ALA 96 HB1 ALA 96 -17.417 3.117 -7.015 762 HB2 ALA 96 HB2 ALA 96 -17.145 4.799 -6.563 763 HB3 ALA 96 HB3 ALA 96 -17.514 3.602 -5.323 764 H LEU 97 HN LEU 97 -15.595 3.183 -3.629 765 HA LEU 97 HA LEU 97 -14.855 5.687 -2.676 766 HB2 LEU 97 HB2 LEU 97 -16.225 4.042 -1.510 767 HB3 LEU 97 HB1 LEU 97 -14.868 2.931 -1.460 768 HG LEU 97 HG LEU 97 -13.791 5.048 -0.295 769 HD11 LEU 97 HD11 LEU 97 -16.697 5.111 0.471 770 HD12 LEU 97 HD12 LEU 97 -15.792 6.389 -0.344 771 HD13 LEU 97 HD13 LEU 97 -15.409 5.964 1.324 772 HD21 LEU 97 HD21 LEU 97 -14.590 3.852 1.891 773 HD22 LEU 97 HD22 LEU 97 -13.498 3.053 0.761 774 HD23 LEU 97 HD23 LEU 97 -15.226 2.660 0.745 775 H VAL 98 HN VAL 98 -13.062 2.583 -2.828 776 HA VAL 98 HA VAL 98 -10.643 3.864 -1.852 777 HB VAL 98 HB VAL 98 -11.318 0.990 -2.473 778 HG11 VAL 98 HG11 VAL 98 -8.939 1.385 -2.972 779 HG12 VAL 98 HG12 VAL 98 -9.149 0.369 -1.546 780 HG13 VAL 98 HG13 VAL 98 -8.724 2.073 -1.362 781 HG21 VAL 98 HG21 VAL 98 -11.247 0.690 -0.094 782 HG22 VAL 98 HG22 VAL 98 -12.292 2.072 -0.440 783 HG23 VAL 98 HG23 VAL 98 -10.649 2.332 0.141 784 H LYS 99 HN LYS 99 -11.636 2.157 -4.791 785 HA LYS 99 HA LYS 99 -9.216 2.127 -6.174 786 HB2 LYS 99 HB2 LYS 99 -11.463 0.988 -6.782 787 HB3 LYS 99 HB1 LYS 99 -11.898 2.529 -7.501 788 HG2 LYS 99 HG2 LYS 99 -11.118 1.361 -9.311 789 HG3 LYS 99 HG1 LYS 99 -9.689 2.276 -8.824 790 HD2 LYS 99 HD2 LYS 99 -9.101 -0.027 -9.315 791 HD3 LYS 99 HD1 LYS 99 -8.867 0.319 -7.602 792 HE2 LYS 99 HE2 LYS 99 -9.913 -1.853 -7.877 793 HE3 LYS 99 HE1 LYS 99 -11.037 -0.731 -7.109 794 HZ1 LYS 99 HZ1 LYS 99 -12.138 -0.412 -9.230 795 HZ2 LYS 99 HZ2 LYS 99 -12.113 -2.060 -8.826 796 HZ3 LYS 99 HZ3 LYS 99 -11.043 -1.458 -9.993 797 H ARG 100 HN ARG 100 -11.745 4.661 -5.996 798 HA ARG 100 HA ARG 100 -10.209 6.347 -7.788 799 HB2 ARG 100 HB2 ARG 100 -12.657 6.419 -7.864 800 HB3 ARG 100 HB1 ARG 100 -12.702 6.953 -6.189 801 HG2 ARG 100 HG2 ARG 100 -13.034 8.780 -7.819 802 HG3 ARG 100 HG1 ARG 100 -11.647 9.031 -6.758 803 HD2 ARG 100 HD2 ARG 100 -11.061 9.631 -9.031 804 HD3 ARG 100 HD1 ARG 100 -10.161 8.197 -8.539 805 HE ARG 100 HE ARG 100 -12.606 7.597 -9.925 806 HH11 ARG 100 HH11 ARG 100 -9.214 8.368 -10.335 807 HH12 ARG 100 HH12 ARG 100 -9.111 7.642 -11.908 808 HH21 ARG 100 HH21 ARG 100 -12.459 6.633 -11.985 809 HH22 ARG 100 HH22 ARG 100 -10.946 6.665 -12.848 810 H ALA 101 HN ALA 101 -10.669 5.965 -4.347 811 HA ALA 101 HA ALA 101 -8.993 8.334 -3.896 812 HB1 ALA 101 HB1 ALA 101 -9.786 8.383 -1.631 813 HB2 ALA 101 HB2 ALA 101 -10.636 6.846 -1.844 814 HB3 ALA 101 HB3 ALA 101 -11.174 8.287 -2.715 815 H SER 102 HN SER 102 -7.387 6.592 -4.822 816 HA SER 102 HA SER 102 -6.271 4.978 -2.684 817 HB2 SER 102 HB2 SER 102 -5.161 5.447 -5.456 818 HB3 SER 102 HB1 SER 102 -4.685 4.184 -4.326 819 HG SER 102 HG SER 102 -7.330 4.062 -4.672 820 HA PRO 103 HA PRO 103 -3.954 8.704 -1.789 821 HB2 PRO 103 HB2 PRO 103 -4.433 8.628 0.861 822 HB3 PRO 103 HB1 PRO 103 -5.668 9.081 -0.318 823 HG2 PRO 103 HG2 PRO 103 -5.501 6.686 1.337 824 HG3 PRO 103 HG1 PRO 103 -6.865 7.294 0.385 825 HD2 PRO 103 HD2 PRO 103 -4.866 5.256 -0.314 826 HD3 PRO 103 HD1 PRO 103 -6.446 5.586 -1.059 827 H LEU 104 HN LEU 104 -2.204 9.322 -0.411 828 HA LEU 104 HA LEU 104 -0.555 7.208 0.746 829 HB2 LEU 104 HB2 LEU 104 0.106 7.508 -1.635 830 HB3 LEU 104 HB1 LEU 104 0.408 9.202 -1.319 831 HG LEU 104 HG LEU 104 2.183 8.485 0.319 832 HD11 LEU 104 HD11 LEU 104 3.099 6.176 -0.090 833 HD12 LEU 104 HD12 LEU 104 1.577 5.801 -0.906 834 HD13 LEU 104 HD13 LEU 104 1.576 6.239 0.803 835 HD21 LEU 104 HD21 LEU 104 2.493 7.676 -2.567 836 HD22 LEU 104 HD22 LEU 104 3.814 7.986 -1.441 837 HD23 LEU 104 HD23 LEU 104 2.725 9.295 -1.902 838 HA PRO 105 HA PRO 105 -0.688 10.926 3.377 839 HB2 PRO 105 HB2 PRO 105 -0.494 9.592 5.749 840 HB3 PRO 105 HB1 PRO 105 -2.008 9.885 4.895 841 HG2 PRO 105 HG2 PRO 105 -0.462 7.395 5.181 842 HG3 PRO 105 HG1 PRO 105 -2.182 7.630 4.857 843 HD2 PRO 105 HD2 PRO 105 -0.206 6.924 2.978 844 HD3 PRO 105 HD1 PRO 105 -1.885 7.407 2.644 845 H THR 106 HN THR 106 1.525 8.211 4.039 846 HA THR 106 HA THR 106 3.534 10.083 5.018 847 HB THR 106 HB THR 106 3.764 7.074 4.795 848 HG1 THR 106 HG1 THR 106 2.985 6.984 6.900 849 HG21 THR 106 HG21 THR 106 5.453 7.330 6.541 850 HG22 THR 106 HG22 THR 106 5.194 9.074 6.553 851 HG23 THR 106 HG23 THR 106 5.875 8.292 5.125 852 HA PRO 107 HA PRO 107 4.945 10.178 0.738 853 HB2 PRO 107 HB2 PRO 107 6.903 12.095 1.815 854 HB3 PRO 107 HB1 PRO 107 5.695 12.317 0.546 855 HG2 PRO 107 HG2 PRO 107 5.415 13.464 2.949 856 HG3 PRO 107 HG1 PRO 107 4.016 12.837 2.053 857 HD2 PRO 107 HD2 PRO 107 5.520 11.590 4.330 858 HD3 PRO 107 HD1 PRO 107 3.765 11.691 4.064 859 HA PRO 108 HA PRO 108 8.498 7.509 1.652 860 HB2 PRO 108 HB2 PRO 108 7.967 5.644 -0.142 861 HB3 PRO 108 HB1 PRO 108 6.913 5.819 1.268 862 HG2 PRO 108 HG2 PRO 108 6.497 6.781 -1.538 863 HG3 PRO 108 HG1 PRO 108 5.337 6.000 -0.451 864 HD2 PRO 108 HD2 PRO 108 5.555 8.736 -0.857 865 HD3 PRO 108 HD1 PRO 108 4.800 7.974 0.556 866 H ALA 109 HN ALA 109 9.355 9.709 0.610 867 HA ALA 109 HA ALA 109 10.051 9.915 -2.045 868 HB1 ALA 109 HB1 ALA 109 11.909 11.302 -1.348 869 HB2 ALA 109 HB2 ALA 109 11.809 10.653 0.290 870 HB3 ALA 109 HB3 ALA 109 10.496 11.644 -0.347 871 H ASP 110 HN ASP 110 11.863 8.262 0.529 872 HA ASP 110 HA ASP 110 13.862 7.357 -1.307 873 HB2 ASP 110 HB2 ASP 110 14.849 6.221 0.645 874 HB3 ASP 110 HB1 ASP 110 14.506 7.916 0.967 875 H ALA 111 HN ALA 111 10.859 6.404 -1.155 876 HA ALA 111 HA ALA 111 11.458 3.535 -1.326 877 HB1 ALA 111 HB1 ALA 111 9.693 4.130 0.244 878 HB2 ALA 111 HB2 ALA 111 9.055 3.173 -1.095 879 HB3 ALA 111 HB3 ALA 111 8.795 4.920 -1.053 880 H TYR 112 HN TYR 112 10.350 6.303 -3.168 881 HA TYR 112 HA TYR 112 9.901 4.463 -5.403 882 HB2 TYR 112 HB2 TYR 112 8.454 6.260 -6.412 883 HB3 TYR 112 HB1 TYR 112 7.832 5.341 -5.064 884 HD1 TYR 112 HD2 TYR 112 10.044 8.365 -4.984 885 HD2 TYR 112 HD1 TYR 112 6.241 6.655 -4.167 886 HE1 TYR 112 HE2 TYR 112 9.358 10.436 -3.843 887 HE2 TYR 112 HE1 TYR 112 5.536 8.698 -3.043 888 HH TYR 112 HH TYR 112 6.668 10.639 -1.865 889 H VAL 113 HN VAL 113 12.251 6.177 -4.441 890 HA VAL 113 HA VAL 113 12.934 7.601 -6.829 891 HB VAL 113 HB VAL 113 15.332 7.367 -5.956 892 HG11 VAL 113 HG11 VAL 113 13.257 8.660 -4.191 893 HG12 VAL 113 HG12 VAL 113 13.988 9.370 -5.630 894 HG13 VAL 113 HG13 VAL 113 14.978 9.045 -4.207 895 HG21 VAL 113 HG21 VAL 113 13.922 6.359 -3.480 896 HG22 VAL 113 HG22 VAL 113 15.645 6.686 -3.662 897 HG23 VAL 113 HG23 VAL 113 14.903 5.358 -4.552 898 H ASN 114 HN ASN 114 12.549 6.349 -8.528 899 HA ASN 114 HA ASN 114 14.053 4.488 -9.734 900 HB2 ASN 114 HB2 ASN 114 13.550 2.311 -9.011 901 HB3 ASN 114 HB1 ASN 114 13.691 3.173 -7.485 902 HD21 ASN 114 HD21 ASN 114 11.782 3.651 -6.313 903 HD22 ASN 114 HD22 ASN 114 10.314 2.793 -6.602 904 H GLY 115 HN GLY 115 11.036 5.717 -8.788 905 HA2 GLY 115 HA2 GLY 115 9.900 6.078 -11.230 906 HA3 GLY 115 HA1 GLY 115 9.409 4.449 -10.779 907 H THR 116 HN THR 116 8.113 4.148 -8.929 908 HA THR 116 HA THR 116 7.108 6.356 -7.412 909 HB THR 116 HB THR 116 4.841 4.985 -8.700 910 HG1 THR 116 HG1 THR 116 6.651 6.575 -10.193 911 HG21 THR 116 HG21 THR 116 4.555 6.828 -7.140 912 HG22 THR 116 HG22 THR 116 3.962 7.288 -8.735 913 HG23 THR 116 HG23 THR 116 5.527 7.874 -8.171 914 H VAL 117 HN VAL 117 5.106 5.314 -6.004 915 HA VAL 117 HA VAL 117 6.202 2.742 -5.138 916 HB VAL 117 HB VAL 117 4.796 3.060 -3.074 917 HG11 VAL 117 HG11 VAL 117 6.898 5.122 -3.676 918 HG12 VAL 117 HG12 VAL 117 7.138 3.519 -2.977 919 HG13 VAL 117 HG13 VAL 117 6.272 4.761 -2.066 920 HG21 VAL 117 HG21 VAL 117 3.159 4.641 -3.929 921 HG22 VAL 117 HG22 VAL 117 4.422 5.852 -4.160 922 HG23 VAL 117 HG23 VAL 117 4.000 5.315 -2.534 923 H GLU 118 HN GLU 118 5.304 1.142 -6.108 924 HA GLU 118 HA GLU 118 2.371 0.989 -6.188 925 HB2 GLU 118 HB2 GLU 118 3.625 0.875 -8.393 926 HB3 GLU 118 HB1 GLU 118 4.343 -0.623 -7.826 927 HG2 GLU 118 HG2 GLU 118 1.374 -0.293 -7.943 928 HG3 GLU 118 HG1 GLU 118 2.299 -0.720 -9.380 929 H LEU 119 HN LEU 119 1.645 -0.185 -4.562 930 HA LEU 119 HA LEU 119 3.130 -2.541 -3.699 931 HB2 LEU 119 HB2 LEU 119 3.086 -1.849 -1.365 932 HB3 LEU 119 HB1 LEU 119 4.000 -0.713 -2.336 933 HG LEU 119 HG LEU 119 1.461 0.389 -2.315 934 HD11 LEU 119 HD11 LEU 119 0.708 -1.190 -0.658 935 HD12 LEU 119 HD12 LEU 119 0.816 0.429 0.036 936 HD13 LEU 119 HD13 LEU 119 2.062 -0.768 0.392 937 HD21 LEU 119 HD21 LEU 119 2.447 2.049 -0.816 938 HD22 LEU 119 HD22 LEU 119 3.572 1.593 -2.095 939 HD23 LEU 119 HD23 LEU 119 3.780 0.948 -0.466 940 H THR 120 HN THR 120 1.878 -3.968 -2.367 941 HA THR 120 HA THR 120 -0.927 -3.861 -3.148 942 HB THR 120 HB THR 120 0.674 -6.104 -1.905 943 HG1 THR 120 HG1 THR 120 0.997 -5.321 -4.235 944 HG21 THR 120 HG21 THR 120 -1.245 -7.508 -2.440 945 HG22 THR 120 HG22 THR 120 -2.109 -6.110 -3.075 946 HG23 THR 120 HG23 THR 120 -1.722 -6.201 -1.355 947 H LEU 121 HN LEU 121 -2.476 -3.294 -1.799 948 HA LEU 121 HA LEU 121 -2.076 -3.741 1.079 949 HB2 LEU 121 HB2 LEU 121 -3.230 -1.310 -0.275 950 HB3 LEU 121 HB1 LEU 121 -3.481 -1.662 1.424 951 HG LEU 121 HG LEU 121 -0.820 -1.163 0.092 952 HD11 LEU 121 HD11 LEU 121 -2.084 0.861 0.288 953 HD12 LEU 121 HD12 LEU 121 -0.815 0.858 1.510 954 HD13 LEU 121 HD13 LEU 121 -2.485 0.504 1.967 955 HD21 LEU 121 HD21 LEU 121 -1.492 -1.679 2.989 956 HD22 LEU 121 HD22 LEU 121 0.099 -1.262 2.348 957 HD23 LEU 121 HD23 LEU 121 -0.659 -2.794 1.904 958 HA PRO 122 HA PRO 122 -6.007 -5.753 0.397 959 HB2 PRO 122 HB2 PRO 122 -5.926 -6.441 3.222 960 HB3 PRO 122 HB1 PRO 122 -5.812 -7.509 1.822 961 HG2 PRO 122 HG2 PRO 122 -3.721 -7.029 3.495 962 HG3 PRO 122 HG1 PRO 122 -3.522 -7.420 1.777 963 HD2 PRO 122 HD2 PRO 122 -3.417 -4.750 3.135 964 HD3 PRO 122 HD1 PRO 122 -2.384 -5.398 1.841 965 H ILE 123 HN ILE 123 -7.726 -4.477 0.308 966 HA ILE 123 HA ILE 123 -8.253 -2.578 2.452 967 HB ILE 123 HB ILE 123 -9.956 -1.621 1.050 968 HG12 ILE 123 HG12 ILE 123 -9.535 -3.953 -0.821 969 HG13 ILE 123 HG11 ILE 123 -10.937 -3.718 0.214 970 HG21 ILE 123 HG21 ILE 123 -7.808 -0.856 0.397 971 HG22 ILE 123 HG22 ILE 123 -8.676 -1.197 -1.108 972 HG23 ILE 123 HG23 ILE 123 -7.474 -2.336 -0.499 973 HD11 ILE 123 HD11 ILE 123 -10.105 -1.920 -2.047 974 HD12 ILE 123 HD12 ILE 123 -11.502 -1.681 -0.997 975 HD13 ILE 123 HD13 ILE 123 -11.432 -3.082 -2.068 976 H ASP 124 HN ASP 124 -9.545 -3.144 4.122 977 HA ASP 124 HA ASP 124 -11.205 -5.532 3.686 978 HB2 ASP 124 HB2 ASP 124 -9.718 -6.206 5.300 979 HB3 ASP 124 HB1 ASP 124 -9.610 -4.608 6.030 980 H PHE 125 HN PHE 125 -13.193 -5.170 3.490 981 HA PHE 125 HA PHE 125 -14.550 -3.451 5.458 982 HB2 PHE 125 HB2 PHE 125 -15.561 -4.555 2.817 983 HB3 PHE 125 HB1 PHE 125 -16.481 -3.531 3.909 984 HD1 PHE 125 HD1 PHE 125 -15.654 -1.167 4.312 985 HD2 PHE 125 HD2 PHE 125 -14.111 -3.659 1.229 986 HE1 PHE 125 HE1 PHE 125 -14.746 0.814 3.168 987 HE2 PHE 125 HE2 PHE 125 -13.202 -1.684 0.081 988 HZ PHE 125 HZ PHE 125 -13.520 0.556 1.049 989 H SER 126 HN SER 126 -15.898 -4.517 6.922 990 HA SER 126 HA SER 126 -15.170 -7.153 7.511 991 HB2 SER 126 HB2 SER 126 -17.707 -5.811 8.455 992 HB3 SER 126 HB1 SER 126 -16.786 -7.068 9.281 993 HG SER 126 HG SER 126 -15.104 -5.097 8.846 994 H LEU 127 HN LEU 127 -15.561 -8.791 6.208 995 HA LEU 127 HA LEU 127 -17.996 -8.830 4.588 996 HB2 LEU 127 HB2 LEU 127 -15.388 -9.212 3.929 997 HB3 LEU 127 HB1 LEU 127 -15.898 -10.867 4.186 998 HG LEU 127 HG LEU 127 -17.122 -8.927 2.221 999 HD11 LEU 127 HD11 LEU 127 -15.440 -11.388 1.774 1000 HD12 LEU 127 HD12 LEU 127 -14.894 -9.721 1.587 1001 HD13 LEU 127 HD13 LEU 127 -16.149 -10.361 0.524 1002 HD21 LEU 127 HD21 LEU 127 -17.745 -11.822 2.760 1003 HD22 LEU 127 HD22 LEU 127 -18.357 -10.887 1.396 1004 HD23 LEU 127 HD23 LEU 127 -18.810 -10.446 3.044 1005 H ARG 128 HN ARG 128 -19.621 -9.838 5.611 1006 HA ARG 128 HA ARG 128 -19.191 -12.231 7.159 1007 HB2 ARG 128 HB2 ARG 128 -21.661 -10.716 6.315 1008 HB3 ARG 128 HB1 ARG 128 -21.725 -12.210 7.229 1009 HG2 ARG 128 HG2 ARG 128 -20.511 -11.177 9.054 1010 HG3 ARG 128 HG1 ARG 128 -20.358 -9.685 8.123 1011 HD2 ARG 128 HD2 ARG 128 -22.995 -10.928 8.887 1012 HD3 ARG 128 HD1 ARG 128 -22.189 -9.686 9.841 1013 HE ARG 128 HE ARG 128 -22.553 -8.136 8.070 1014 HH11 ARG 128 HH11 ARG 128 -24.123 -11.243 7.593 1015 HH12 ARG 128 HH12 ARG 128 -25.300 -10.613 6.477 1016 HH21 ARG 128 HH21 ARG 128 -24.108 -7.319 6.602 1017 HH22 ARG 128 HH22 ARG 128 -25.295 -8.384 5.921 1018 H GLY 129 HN GLY 129 -20.949 -11.366 4.194 1019 HA2 GLY 129 HA2 GLY 129 -20.018 -13.347 2.544 1020 HA3 GLY 129 HA1 GLY 129 -21.348 -14.094 3.421 1021 H ALA 130 HN ALA 130 -20.845 -10.842 2.067 1022 HA ALA 130 HA ALA 130 -23.557 -10.919 1.005 1023 HB1 ALA 130 HB1 ALA 130 -23.305 -8.545 0.626 1024 HB2 ALA 130 HB2 ALA 130 -21.590 -8.633 1.024 1025 HB3 ALA 130 HB3 ALA 130 -22.801 -8.938 2.270 1026 H GLY 131 HN GLY 131 -23.785 -9.742 -1.205 1027 HA2 GLY 131 HA2 GLY 131 -23.233 -9.641 -3.463 1028 HA3 GLY 131 HA1 GLY 131 -21.673 -10.365 -3.091 1029 H PHE 132 HN PHE 132 -24.581 -11.780 -1.904 1030 HA PHE 132 HA PHE 132 -24.058 -14.134 -3.548 1031 HB2 PHE 132 HB2 PHE 132 -25.399 -15.358 -1.884 1032 HB3 PHE 132 HB1 PHE 132 -24.060 -14.498 -1.132 1033 HD1 PHE 132 HD1 PHE 132 -24.522 -12.383 0.126 1034 HD2 PHE 132 HD2 PHE 132 -27.635 -14.928 -1.271 1035 HE1 PHE 132 HE1 PHE 132 -26.085 -11.332 1.707 1036 HE2 PHE 132 HE2 PHE 132 -29.202 -13.879 0.310 1037 HZ PHE 132 HZ PHE 132 -28.429 -12.081 1.800 Start of MODEL 2 1 H1 LYS 2 HT1 LYS 2 -5.983 22.303 21.207 2 H2 LYS 2 HT2 LYS 2 -7.534 21.611 21.155 3 H3 LYS 2 HT3 LYS 2 -6.906 22.388 19.786 4 HA LYS 2 HA LYS 2 -5.240 20.736 19.506 5 HB2 LYS 2 HB2 LYS 2 -4.944 20.312 21.946 6 HB3 LYS 2 HB1 LYS 2 -6.457 19.420 21.945 7 HG2 LYS 2 HG2 LYS 2 -5.516 17.750 20.467 8 HG3 LYS 2 HG1 LYS 2 -4.019 18.676 20.334 9 HD2 LYS 2 HD2 LYS 2 -3.652 18.411 22.749 10 HD3 LYS 2 HD1 LYS 2 -5.135 17.466 22.862 11 HE2 LYS 2 HE2 LYS 2 -2.757 16.714 21.168 12 HE3 LYS 2 HE1 LYS 2 -3.054 16.097 22.791 13 HZ1 LYS 2 HZ1 LYS 2 -3.871 14.494 21.285 14 HZ2 LYS 2 HZ2 LYS 2 -4.686 15.648 20.350 15 HZ3 LYS 2 HZ3 LYS 2 -5.241 15.273 21.911 16 H VAL 3 HN VAL 3 -6.675 20.793 17.705 17 HA VAL 3 HA VAL 3 -8.736 18.682 17.778 18 HB VAL 3 HB VAL 3 -8.702 21.141 16.014 19 HG11 VAL 3 HG11 VAL 3 -10.959 20.426 15.355 20 HG12 VAL 3 HG12 VAL 3 -10.761 18.956 16.310 21 HG13 VAL 3 HG13 VAL 3 -9.732 19.242 14.907 22 HG21 VAL 3 HG21 VAL 3 -9.212 21.745 18.300 23 HG22 VAL 3 HG22 VAL 3 -10.424 20.469 18.396 24 HG23 VAL 3 HG23 VAL 3 -10.674 21.843 17.318 25 H GLN 4 HN GLN 4 -6.606 20.447 15.521 26 HA GLN 4 HA GLN 4 -6.541 18.062 13.831 27 HB2 GLN 4 HB2 GLN 4 -7.093 20.184 12.729 28 HB3 GLN 4 HB1 GLN 4 -5.561 20.864 13.263 29 HG2 GLN 4 HG2 GLN 4 -4.372 19.150 11.954 30 HG3 GLN 4 HG1 GLN 4 -5.924 18.551 11.373 31 HE21 GLN 4 HE21 GLN 4 -7.076 21.229 11.171 32 HE22 GLN 4 HE22 GLN 4 -6.352 21.950 9.774 33 H GLU 5 HN GLU 5 -5.160 16.790 15.019 34 HA GLU 5 HA GLU 5 -2.375 17.683 15.181 35 HB2 GLU 5 HB2 GLU 5 -2.143 15.454 16.454 36 HB3 GLU 5 HB1 GLU 5 -2.996 16.772 17.245 37 HG2 GLU 5 HG2 GLU 5 -5.116 15.675 16.256 38 HG3 GLU 5 HG1 GLU 5 -4.089 14.253 16.068 39 H GLN 6 HN GLN 6 -1.356 17.400 13.354 40 HA GLN 6 HA GLN 6 -2.318 15.669 11.318 41 HB2 GLN 6 HB2 GLN 6 -1.131 17.911 11.045 42 HB3 GLN 6 HB1 GLN 6 0.365 17.036 11.338 43 HG2 GLN 6 HG2 GLN 6 -0.068 17.350 8.951 44 HG3 GLN 6 HG1 GLN 6 -0.029 15.644 9.399 45 HE21 GLN 6 HE21 GLN 6 -2.065 18.307 8.427 46 HE22 GLN 6 HE22 GLN 6 -3.445 17.347 8.000 47 H SER 7 HN SER 7 0.835 15.694 13.015 48 HA SER 7 HA SER 7 1.096 12.867 12.263 49 HB2 SER 7 HB2 SER 7 2.865 14.457 11.438 50 HB3 SER 7 HB1 SER 7 3.318 14.735 13.119 51 HG SER 7 HG SER 7 4.582 13.094 12.048 52 H VAL 8 HN VAL 8 0.763 11.457 13.807 53 HA VAL 8 HA VAL 8 0.841 12.310 16.596 54 HB VAL 8 HB VAL 8 -0.060 9.640 15.503 55 HG11 VAL 8 HG11 VAL 8 -1.240 9.436 17.624 56 HG12 VAL 8 HG12 VAL 8 -0.627 11.011 18.128 57 HG13 VAL 8 HG13 VAL 8 0.488 9.667 17.886 58 HG21 VAL 8 HG21 VAL 8 -1.400 11.407 14.495 59 HG22 VAL 8 HG22 VAL 8 -1.724 12.091 16.087 60 HG23 VAL 8 HG23 VAL 8 -2.354 10.498 15.667 61 H GLY 9 HN GLY 9 3.154 12.490 16.575 62 HA2 GLY 9 HA2 GLY 9 4.404 10.166 17.642 63 HA3 GLY 9 HA1 GLY 9 4.992 10.517 16.019 64 H ALA 10 HN ALA 10 6.947 10.650 17.676 65 HA ALA 10 HA ALA 10 7.199 13.478 18.468 66 HB1 ALA 10 HB1 ALA 10 8.839 12.769 20.136 67 HB2 ALA 10 HB2 ALA 10 8.630 11.091 19.633 68 HB3 ALA 10 HB3 ALA 10 7.291 11.959 20.382 69 HA PRO 11 HA PRO 11 10.234 13.109 15.052 70 HB2 PRO 11 HB2 PRO 11 9.776 15.994 14.833 71 HB3 PRO 11 HB1 PRO 11 9.536 14.733 13.620 72 HG2 PRO 11 HG2 PRO 11 7.472 16.034 14.780 73 HG3 PRO 11 HG1 PRO 11 7.364 14.340 14.266 74 HD2 PRO 11 HD2 PRO 11 7.804 15.466 17.008 75 HD3 PRO 11 HD1 PRO 11 6.769 14.115 16.498 76 HA PRO 12 HA PRO 12 13.280 14.649 18.010 77 HB2 PRO 12 HB2 PRO 12 15.366 13.253 17.034 78 HB3 PRO 12 HB1 PRO 12 14.106 12.492 18.012 79 HG2 PRO 12 HG2 PRO 12 14.452 12.490 15.039 80 HG3 PRO 12 HG1 PRO 12 14.012 11.151 16.116 81 HD2 PRO 12 HD2 PRO 12 12.194 12.568 14.651 82 HD3 PRO 12 HD1 PRO 12 11.805 11.777 16.192 83 HA PRO 13 HA PRO 13 15.179 17.857 15.591 84 HB2 PRO 13 HB2 PRO 13 17.352 18.047 17.524 85 HB3 PRO 13 HB1 PRO 13 16.019 19.168 17.237 86 HG2 PRO 13 HG2 PRO 13 16.228 17.678 19.495 87 HG3 PRO 13 HG1 PRO 13 14.671 18.174 18.808 88 HD2 PRO 13 HD2 PRO 13 16.084 15.539 18.596 89 HD3 PRO 13 HD1 PRO 13 14.359 15.874 18.865 90 H GLY 14 HN GLY 14 15.792 15.453 14.497 91 HA2 GLY 14 HA2 GLY 14 18.399 15.947 13.383 92 HA3 GLY 14 HA1 GLY 14 18.338 14.485 14.364 93 H ARG 15 HN ARG 15 17.755 15.826 11.324 94 HA ARG 15 HA ARG 15 15.673 13.916 10.577 95 HB2 ARG 15 HB2 ARG 15 16.975 15.954 8.781 96 HB3 ARG 15 HB1 ARG 15 15.376 15.238 8.641 97 HG2 ARG 15 HG2 ARG 15 14.488 16.573 10.320 98 HG3 ARG 15 HG1 ARG 15 16.081 16.952 10.987 99 HD2 ARG 15 HD2 ARG 15 14.906 17.929 8.389 100 HD3 ARG 15 HD1 ARG 15 15.269 18.885 9.828 101 HE ARG 15 HE ARG 15 17.676 17.944 9.282 102 HH11 ARG 15 HH11 ARG 15 15.278 19.311 7.129 103 HH12 ARG 15 HH12 ARG 15 16.455 19.817 5.949 104 HH21 ARG 15 HH21 ARG 15 19.216 18.605 7.743 105 HH22 ARG 15 HH22 ARG 15 18.679 19.431 6.305 106 H ALA 16 HN ALA 16 17.836 12.496 11.160 107 HA ALA 16 HA ALA 16 19.477 11.090 10.457 108 HB1 ALA 16 HB1 ALA 16 18.163 11.437 7.759 109 HB2 ALA 16 HB2 ALA 16 17.731 10.234 8.976 110 HB3 ALA 16 HB3 ALA 16 19.311 10.171 8.196 111 H ASP 17 HN ASP 17 19.905 13.956 10.494 112 HA ASP 17 HA ASP 17 21.513 14.747 8.295 113 HB2 ASP 17 HB2 ASP 17 21.392 15.815 11.128 114 HB3 ASP 17 HB1 ASP 17 22.259 16.587 9.804 115 H LYS 18 HN LYS 18 23.692 14.710 8.021 116 HA LYS 18 HA LYS 18 25.739 13.740 8.043 117 HB2 LYS 18 HB2 LYS 18 25.905 15.323 9.989 118 HB3 LYS 18 HB1 LYS 18 25.530 13.970 11.049 119 HG2 LYS 18 HG2 LYS 18 27.540 12.817 10.325 120 HG3 LYS 18 HG1 LYS 18 27.900 14.124 9.196 121 HD2 LYS 18 HD2 LYS 18 28.151 15.681 11.040 122 HD3 LYS 18 HD1 LYS 18 27.710 14.418 12.192 123 HE2 LYS 18 HE2 LYS 18 30.149 14.797 12.070 124 HE3 LYS 18 HE1 LYS 18 29.689 13.155 11.628 125 HZ1 LYS 18 HZ1 LYS 18 31.377 14.168 10.148 126 HZ2 LYS 18 HZ2 LYS 18 30.221 15.311 9.655 127 HZ3 LYS 18 HZ3 LYS 18 29.979 13.667 9.330 128 H THR 19 HN THR 19 23.918 11.894 7.602 129 HA THR 19 HA THR 19 24.977 9.573 9.061 130 HB THR 19 HB THR 19 22.104 9.761 8.128 131 HG1 THR 19 HG1 THR 19 22.768 11.266 9.897 132 HG21 THR 19 HG21 THR 19 22.977 7.488 8.392 133 HG22 THR 19 HG22 THR 19 21.777 7.849 9.633 134 HG23 THR 19 HG23 THR 19 23.495 7.870 10.034 135 H ALA 20 HN ALA 20 25.018 11.128 6.268 136 HA ALA 20 HA ALA 20 24.479 8.884 4.490 137 HB1 ALA 20 HB1 ALA 20 24.875 10.465 2.681 138 HB2 ALA 20 HB2 ALA 20 25.400 11.684 3.840 139 HB3 ALA 20 HB3 ALA 20 23.725 11.132 3.843 140 H ALA 21 HN ALA 21 26.451 8.207 6.156 141 HA ALA 21 HA ALA 21 29.046 8.877 5.129 142 HB1 ALA 21 HB1 ALA 21 28.278 6.751 7.126 143 HB2 ALA 21 HB2 ALA 21 28.713 8.416 7.509 144 HB3 ALA 21 HB3 ALA 21 29.911 7.334 6.799 145 HA PRO 22 HA PRO 22 29.003 4.530 3.248 146 HB2 PRO 22 HB2 PRO 22 27.055 2.766 3.682 147 HB3 PRO 22 HB1 PRO 22 28.279 3.088 4.918 148 HG2 PRO 22 HG2 PRO 22 25.458 4.046 4.746 149 HG3 PRO 22 HG1 PRO 22 26.390 3.545 6.166 150 HD2 PRO 22 HD2 PRO 22 25.956 6.177 5.349 151 HD3 PRO 22 HD1 PRO 22 27.202 5.638 6.489 152 H GLN 23 HN GLN 23 27.195 6.879 2.561 153 HA GLN 23 HA GLN 23 25.967 7.634 0.822 154 HB2 GLN 23 HB2 GLN 23 26.613 4.938 -0.367 155 HB3 GLN 23 HB1 GLN 23 25.777 6.219 -1.234 156 HG2 GLN 23 HG2 GLN 23 27.741 7.673 -0.912 157 HG3 GLN 23 HG1 GLN 23 28.576 6.327 -0.135 158 HE21 GLN 23 HE21 GLN 23 29.272 4.596 -1.372 159 HE22 GLN 23 HE22 GLN 23 29.351 4.679 -3.107 160 H THR 24 HN THR 24 23.967 7.963 1.529 161 HA THR 24 HA THR 24 22.236 5.916 2.434 162 HB THR 24 HB THR 24 21.476 8.722 1.597 163 HG1 THR 24 HG1 THR 24 22.638 7.668 3.967 164 HG21 THR 24 HG21 THR 24 20.216 6.816 3.578 165 HG22 THR 24 HG22 THR 24 19.579 7.199 1.978 166 HG23 THR 24 HG23 THR 24 19.665 8.449 3.218 167 H ARG 25 HN ARG 25 22.941 7.188 -0.688 168 HA ARG 25 HA ARG 25 20.569 6.428 -2.035 169 HB2 ARG 25 HB2 ARG 25 21.830 6.614 -4.078 170 HB3 ARG 25 HB1 ARG 25 22.329 7.913 -3.003 171 HG2 ARG 25 HG2 ARG 25 24.371 6.807 -2.485 172 HG3 ARG 25 HG1 ARG 25 23.848 5.334 -3.304 173 HD2 ARG 25 HD2 ARG 25 23.745 6.638 -5.426 174 HD3 ARG 25 HD1 ARG 25 24.447 8.004 -4.562 175 HE ARG 25 HE ARG 25 26.380 6.429 -4.110 176 HH11 ARG 25 HH11 ARG 25 24.334 6.171 -6.943 177 HH12 ARG 25 HH12 ARG 25 25.569 5.445 -7.930 178 HH21 ARG 25 HH21 ARG 25 28.004 5.452 -5.393 179 HH22 ARG 25 HH22 ARG 25 27.660 5.021 -7.043 180 H LEU 26 HN LEU 26 22.957 4.592 -0.531 181 HA LEU 26 HA LEU 26 22.178 2.186 -2.034 182 HB2 LEU 26 HB2 LEU 26 24.614 2.685 -0.319 183 HB3 LEU 26 HB1 LEU 26 24.225 1.155 -1.081 184 HG LEU 26 HG LEU 26 24.797 3.715 -2.577 185 HD11 LEU 26 HD11 LEU 26 26.933 2.684 -3.137 186 HD12 LEU 26 HD12 LEU 26 26.546 1.306 -2.109 187 HD13 LEU 26 HD13 LEU 26 26.772 2.901 -1.394 188 HD21 LEU 26 HD21 LEU 26 24.520 0.868 -3.535 189 HD22 LEU 26 HD22 LEU 26 24.911 2.271 -4.529 190 HD23 LEU 26 HD23 LEU 26 23.328 2.147 -3.764 191 H THR 27 HN THR 27 20.870 3.661 0.289 192 HA THR 27 HA THR 27 20.529 1.320 1.985 193 HB THR 27 HB THR 27 20.911 4.093 3.122 194 HG1 THR 27 HG1 THR 27 22.779 2.557 2.159 195 HG21 THR 27 HG21 THR 27 20.484 1.365 4.245 196 HG22 THR 27 HG22 THR 27 19.600 2.846 4.605 197 HG23 THR 27 HG23 THR 27 21.246 2.626 5.210 198 HA PRO 28 HA PRO 28 16.359 3.177 1.134 199 HB2 PRO 28 HB2 PRO 28 15.609 0.445 0.444 200 HB3 PRO 28 HB1 PRO 28 15.471 1.909 -0.532 201 HG2 PRO 28 HG2 PRO 28 17.213 -0.091 -1.108 202 HG3 PRO 28 HG1 PRO 28 17.523 1.608 -1.510 203 HD2 PRO 28 HD2 PRO 28 18.578 -0.024 0.772 204 HD3 PRO 28 HD1 PRO 28 19.421 1.164 -0.247 205 H TYR 29 HN TYR 29 14.905 3.176 2.789 206 HA TYR 29 HA TYR 29 15.164 0.999 4.757 207 HB2 TYR 29 HB2 TYR 29 14.864 2.775 6.543 208 HB3 TYR 29 HB1 TYR 29 16.413 2.760 5.711 209 HD1 TYR 29 HD2 TYR 29 13.134 4.503 5.850 210 HD2 TYR 29 HD1 TYR 29 17.192 4.669 4.587 211 HE1 TYR 29 HE2 TYR 29 12.855 6.879 5.284 212 HE2 TYR 29 HE1 TYR 29 16.922 7.044 4.020 213 HH TYR 29 HH TYR 29 15.118 8.594 3.431 214 H ALA 30 HN ALA 30 13.079 2.392 2.705 215 HA ALA 30 HA ALA 30 10.764 2.557 4.426 216 HB1 ALA 30 HB1 ALA 30 10.940 2.548 1.413 217 HB2 ALA 30 HB2 ALA 30 10.931 3.976 2.449 218 HB3 ALA 30 HB3 ALA 30 9.509 2.937 2.367 219 H GLN 31 HN GLN 31 10.304 0.623 5.378 220 HA GLN 31 HA GLN 31 10.212 -1.806 3.808 221 HB2 GLN 31 HB2 GLN 31 9.790 -2.968 5.817 222 HB3 GLN 31 HB1 GLN 31 10.915 -1.698 6.257 223 HG2 GLN 31 HG2 GLN 31 7.939 -1.597 6.705 224 HG3 GLN 31 HG1 GLN 31 9.131 -2.054 7.916 225 HE21 GLN 31 HE21 GLN 31 7.199 0.096 7.946 226 HE22 GLN 31 HE22 GLN 31 8.102 1.558 8.150 227 H ALA 32 HN ALA 32 8.269 -3.122 3.658 228 HA ALA 32 HA ALA 32 6.163 -1.486 2.611 229 HB1 ALA 32 HB1 ALA 32 5.233 -3.547 1.760 230 HB2 ALA 32 HB2 ALA 32 6.340 -4.489 2.760 231 HB3 ALA 32 HB3 ALA 32 6.968 -3.490 1.450 232 H GLY 33 HN GLY 33 5.741 -0.654 4.936 233 HA2 GLY 33 HA2 GLY 33 3.501 -0.384 5.804 234 HA3 GLY 33 HA1 GLY 33 3.314 -2.126 5.734 235 H GLU 34 HN GLU 34 2.521 -1.807 7.883 236 HA GLU 34 HA GLU 34 2.628 -2.004 10.110 237 HB2 GLU 34 HB2 GLU 34 5.146 -3.287 9.197 238 HB3 GLU 34 HB1 GLU 34 4.929 -3.025 10.923 239 HG2 GLU 34 HG2 GLU 34 4.194 -5.261 10.109 240 HG3 GLU 34 HG1 GLU 34 2.958 -4.343 10.966 241 H ASP 35 HN ASP 35 2.698 0.439 9.720 242 HA ASP 35 HA ASP 35 4.342 1.464 11.850 243 HB2 ASP 35 HB2 ASP 35 5.701 1.761 9.695 244 HB3 ASP 35 HB1 ASP 35 4.450 2.887 9.178 245 H ASN 36 HN ASN 36 3.723 4.172 11.551 246 HA ASN 36 HA ASN 36 0.879 4.096 12.108 247 HB2 ASN 36 HB2 ASN 36 2.940 6.301 12.282 248 HB3 ASN 36 HB1 ASN 36 1.232 6.552 12.628 249 HD21 ASN 36 HD21 ASN 36 0.330 5.631 14.456 250 HD22 ASN 36 HD22 ASN 36 1.297 5.046 15.763 251 H TRP 37 HN TRP 37 2.458 4.090 9.349 252 HA TRP 37 HA TRP 37 1.522 6.295 7.897 253 HB2 TRP 37 HB2 TRP 37 2.190 5.128 5.935 254 HB3 TRP 37 HB1 TRP 37 3.324 4.661 7.190 255 HD1 TRP 37 HD1 TRP 37 1.839 2.255 8.544 256 HE1 TRP 37 HE1 TRP 37 1.398 0.074 7.238 257 HE3 TRP 37 HE3 TRP 37 2.241 4.077 3.788 258 HZ2 TRP 37 HZ2 TRP 37 1.275 -0.753 4.541 259 HZ3 TRP 37 HZ3 TRP 37 1.962 2.524 1.902 260 HH2 TRP 37 HH2 TRP 37 1.492 0.163 2.272 261 H ARG 38 HN ARG 38 -0.019 3.308 8.806 262 HA ARG 38 HA ARG 38 -2.186 3.488 6.982 263 HB2 ARG 38 HB2 ARG 38 -3.278 1.901 8.755 264 HB3 ARG 38 HB1 ARG 38 -1.986 1.329 7.713 265 HG2 ARG 38 HG2 ARG 38 -1.402 0.509 9.800 266 HG3 ARG 38 HG1 ARG 38 -0.419 1.962 9.647 267 HD2 ARG 38 HD2 ARG 38 -2.147 3.185 10.963 268 HD3 ARG 38 HD1 ARG 38 -2.975 1.649 11.211 269 HE ARG 38 HE ARG 38 -0.269 1.433 12.005 270 HH11 ARG 38 HH11 ARG 38 -3.322 2.823 13.033 271 HH12 ARG 38 HH12 ARG 38 -2.892 2.811 14.717 272 HH21 ARG 38 HH21 ARG 38 0.281 1.403 14.218 273 HH22 ARG 38 HH22 ARG 38 -0.857 2.012 15.397 274 H SER 39 HN SER 39 -1.547 4.844 10.120 275 HA SER 39 HA SER 39 -4.185 5.682 10.711 276 HB2 SER 39 HB2 SER 39 -1.609 7.066 11.512 277 HB3 SER 39 HB1 SER 39 -3.164 7.137 12.342 278 HG SER 39 HG SER 39 -2.777 5.275 13.260 279 H ARG 40 HN ARG 40 -1.514 7.001 8.845 280 HA ARG 40 HA ARG 40 -2.760 9.480 8.243 281 HB2 ARG 40 HB2 ARG 40 -0.721 8.261 6.425 282 HB3 ARG 40 HB1 ARG 40 -0.902 9.902 6.981 283 HG2 ARG 40 HG2 ARG 40 0.176 7.649 8.634 284 HG3 ARG 40 HG1 ARG 40 1.132 8.889 7.831 285 HD2 ARG 40 HD2 ARG 40 -0.852 9.295 10.060 286 HD3 ARG 40 HD1 ARG 40 0.901 9.428 10.169 287 HE ARG 40 HE ARG 40 -0.949 11.362 9.022 288 HH11 ARG 40 HH11 ARG 40 2.415 10.374 9.318 289 HH12 ARG 40 HH12 ARG 40 3.024 11.996 9.137 290 HH21 ARG 40 HH21 ARG 40 -0.154 13.451 8.786 291 HH22 ARG 40 HH22 ARG 40 1.557 13.758 8.857 292 H ILE 41 HN ILE 41 -2.380 6.364 6.614 293 HA ILE 41 HA ILE 41 -3.614 6.951 4.171 294 HB ILE 41 HB ILE 41 -3.323 4.394 5.753 295 HG12 ILE 41 HG12 ILE 41 -2.140 5.382 3.153 296 HG13 ILE 41 HG11 ILE 41 -1.326 5.344 4.712 297 HG21 ILE 41 HG21 ILE 41 -4.572 4.615 3.016 298 HG22 ILE 41 HG22 ILE 41 -5.430 4.205 4.500 299 HG23 ILE 41 HG23 ILE 41 -4.189 3.120 3.869 300 HD11 ILE 41 HD11 ILE 41 -1.441 2.916 4.727 301 HD12 ILE 41 HD12 ILE 41 -0.625 3.504 3.277 302 HD13 ILE 41 HD13 ILE 41 -2.295 2.943 3.183 303 H SER 42 HN SER 42 -5.017 5.950 7.299 304 HA SER 42 HA SER 42 -7.674 5.692 6.430 305 HB2 SER 42 HB2 SER 42 -6.375 5.445 8.852 306 HB3 SER 42 HB1 SER 42 -7.393 6.863 9.105 307 HG SER 42 HG SER 42 -8.093 4.217 8.765 308 H GLY 43 HN GLY 43 -5.874 8.506 7.634 309 HA2 GLY 43 HA2 GLY 43 -7.975 10.378 7.407 310 HA3 GLY 43 HA1 GLY 43 -6.261 10.758 7.431 311 H ARG 44 HN ARG 44 -5.500 9.322 5.103 312 HA ARG 44 HA ARG 44 -5.927 11.198 3.082 313 HB2 ARG 44 HB2 ARG 44 -4.636 9.855 1.728 314 HB3 ARG 44 HB1 ARG 44 -4.234 9.120 3.274 315 HG2 ARG 44 HG2 ARG 44 -6.105 7.498 2.868 316 HG3 ARG 44 HG1 ARG 44 -6.236 8.176 1.251 317 HD2 ARG 44 HD2 ARG 44 -4.042 7.388 0.676 318 HD3 ARG 44 HD1 ARG 44 -3.732 6.891 2.344 319 HE ARG 44 HE ARG 44 -5.860 5.434 1.850 320 HH11 ARG 44 HH11 ARG 44 -3.165 5.995 -0.336 321 HH12 ARG 44 HH12 ARG 44 -3.323 4.444 -1.101 322 HH21 ARG 44 HH21 ARG 44 -6.067 3.425 0.816 323 HH22 ARG 44 HH22 ARG 44 -4.975 2.995 -0.458 324 H LEU 45 HN LEU 45 -7.782 8.345 3.971 325 HA LEU 45 HA LEU 45 -9.267 8.261 1.535 326 HB2 LEU 45 HB2 LEU 45 -8.812 6.621 3.828 327 HB3 LEU 45 HB1 LEU 45 -10.526 6.812 3.593 328 HG LEU 45 HG LEU 45 -8.901 6.118 1.200 329 HD11 LEU 45 HD11 LEU 45 -9.661 4.132 3.352 330 HD12 LEU 45 HD12 LEU 45 -8.017 4.594 2.898 331 HD13 LEU 45 HD13 LEU 45 -9.040 3.725 1.751 332 HD21 LEU 45 HD21 LEU 45 -11.601 5.210 2.172 333 HD22 LEU 45 HD22 LEU 45 -10.898 4.924 0.576 334 HD23 LEU 45 HD23 LEU 45 -11.315 6.563 1.078 335 H ASN 46 HN ASN 46 -9.634 9.620 4.694 336 HA ASN 46 HA ASN 46 -12.436 10.141 4.541 337 HB2 ASN 46 HB2 ASN 46 -11.067 10.008 6.683 338 HB3 ASN 46 HB1 ASN 46 -10.412 11.588 6.268 339 HD21 ASN 46 HD21 ASN 46 -11.735 13.403 6.402 340 HD22 ASN 46 HD22 ASN 46 -13.260 13.365 7.226 341 H ARG 47 HN ARG 47 -9.507 11.690 3.691 342 HA ARG 47 HA ARG 47 -10.352 14.228 2.994 343 HB2 ARG 47 HB2 ARG 47 -8.135 14.249 2.759 344 HB3 ARG 47 HB1 ARG 47 -8.072 12.506 2.677 345 HG2 ARG 47 HG2 ARG 47 -8.617 12.732 0.214 346 HG3 ARG 47 HG1 ARG 47 -8.288 14.462 0.414 347 HD2 ARG 47 HD2 ARG 47 -6.071 13.823 1.412 348 HD3 ARG 47 HD1 ARG 47 -6.406 12.154 0.930 349 HE ARG 47 HE ARG 47 -6.682 13.518 -1.384 350 HH11 ARG 47 HH11 ARG 47 -4.188 13.553 1.067 351 HH12 ARG 47 HH12 ARG 47 -2.888 13.818 -0.065 352 HH21 ARG 47 HH21 ARG 47 -4.971 13.884 -2.890 353 HH22 ARG 47 HH22 ARG 47 -3.339 14.029 -2.312 354 H PHE 48 HN PHE 48 -11.094 11.186 1.511 355 HA PHE 48 HA PHE 48 -12.386 12.691 -0.632 356 HB2 PHE 48 HB2 PHE 48 -10.982 10.049 -0.851 357 HB3 PHE 48 HB1 PHE 48 -12.147 10.586 -2.055 358 HD1 PHE 48 HD2 PHE 48 -11.596 13.306 -2.563 359 HD2 PHE 48 HD1 PHE 48 -8.848 10.196 -1.631 360 HE1 PHE 48 HE2 PHE 48 -9.809 14.540 -3.722 361 HE2 PHE 48 HE1 PHE 48 -7.059 11.422 -2.789 362 HZ PHE 48 HZ PHE 48 -7.540 13.597 -3.839 363 H LYS 49 HN LYS 49 -12.515 9.522 0.968 364 HA LYS 49 HA LYS 49 -15.349 9.724 1.449 365 HB2 LYS 49 HB2 LYS 49 -14.267 7.855 -0.650 366 HB3 LYS 49 HB1 LYS 49 -15.670 7.400 0.300 367 HG2 LYS 49 HG2 LYS 49 -16.793 9.477 -0.508 368 HG3 LYS 49 HG1 LYS 49 -15.414 9.733 -1.579 369 HD2 LYS 49 HD2 LYS 49 -17.212 8.625 -2.781 370 HD3 LYS 49 HD1 LYS 49 -15.829 7.542 -2.617 371 HE2 LYS 49 HE2 LYS 49 -16.952 6.486 -0.667 372 HE3 LYS 49 HE1 LYS 49 -18.355 7.512 -0.967 373 HZ1 LYS 49 HZ1 LYS 49 -17.255 5.452 -2.802 374 HZ2 LYS 49 HZ2 LYS 49 -18.523 6.496 -3.190 375 HZ3 LYS 49 HZ3 LYS 49 -18.713 5.356 -1.948 376 H ARG 50 HN ARG 50 -15.043 9.227 3.611 377 HA ARG 50 HA ARG 50 -13.979 6.520 4.079 378 HB2 ARG 50 HB2 ARG 50 -12.388 8.305 4.830 379 HB3 ARG 50 HB1 ARG 50 -13.614 8.841 5.969 380 HG2 ARG 50 HG2 ARG 50 -13.479 6.817 7.200 381 HG3 ARG 50 HG1 ARG 50 -12.492 6.051 5.949 382 HD2 ARG 50 HD2 ARG 50 -10.686 7.579 6.386 383 HD3 ARG 50 HD1 ARG 50 -11.658 8.465 7.545 384 HE ARG 50 HE ARG 50 -10.399 5.861 7.930 385 HH11 ARG 50 HH11 ARG 50 -12.467 8.375 9.229 386 HH12 ARG 50 HH12 ARG 50 -12.246 7.883 10.876 387 HH21 ARG 50 HH21 ARG 50 -10.079 5.231 10.089 388 HH22 ARG 50 HH22 ARG 50 -10.880 6.082 11.375 389 H TYR 51 HN TYR 51 -15.741 5.400 4.427 390 HA TYR 51 HA TYR 51 -17.862 6.529 6.094 391 HB2 TYR 51 HB2 TYR 51 -18.069 5.562 3.601 392 HB3 TYR 51 HB1 TYR 51 -18.252 4.051 4.488 393 HD1 TYR 51 HD1 TYR 51 -19.433 7.405 5.516 394 HD2 TYR 51 HD2 TYR 51 -20.517 3.550 4.089 395 HE1 TYR 51 HE1 TYR 51 -21.795 7.945 5.878 396 HE2 TYR 51 HE2 TYR 51 -22.886 4.079 4.451 397 HH TYR 51 HH TYR 51 -24.240 5.623 5.881 398 HA PRO 52 HA PRO 52 -16.673 3.711 9.383 399 HB2 PRO 52 HB2 PRO 52 -19.584 3.975 9.978 400 HB3 PRO 52 HB1 PRO 52 -18.194 4.166 11.056 401 HG2 PRO 52 HG2 PRO 52 -19.502 6.302 10.174 402 HG3 PRO 52 HG1 PRO 52 -17.730 6.312 10.290 403 HD2 PRO 52 HD2 PRO 52 -19.471 6.026 7.876 404 HD3 PRO 52 HD1 PRO 52 -17.931 6.891 8.062 405 H LYS 53 HN LYS 53 -16.659 1.557 9.515 406 HA LYS 53 HA LYS 53 -17.678 0.019 7.392 407 HB2 LYS 53 HB2 LYS 53 -16.636 -0.926 10.067 408 HB3 LYS 53 HB1 LYS 53 -16.859 -1.934 8.647 409 HG2 LYS 53 HG2 LYS 53 -14.943 0.380 8.884 410 HG3 LYS 53 HG1 LYS 53 -14.519 -1.325 8.984 411 HD2 LYS 53 HD2 LYS 53 -13.992 -0.881 6.794 412 HD3 LYS 53 HD1 LYS 53 -15.661 -1.430 6.620 413 HE2 LYS 53 HE2 LYS 53 -15.260 0.594 5.296 414 HE3 LYS 53 HE1 LYS 53 -16.419 0.901 6.596 415 HZ1 LYS 53 HZ1 LYS 53 -14.598 1.856 7.911 416 HZ2 LYS 53 HZ2 LYS 53 -14.847 2.691 6.460 417 HZ3 LYS 53 HZ3 LYS 53 -13.534 1.624 6.607 418 H ASP 54 HN ASP 54 -19.062 0.911 10.401 419 HA ASP 54 HA ASP 54 -20.856 -1.106 10.968 420 HB2 ASP 54 HB2 ASP 54 -21.214 1.891 11.155 421 HB3 ASP 54 HB1 ASP 54 -22.347 0.733 11.839 422 H ALA 55 HN ALA 55 -21.092 1.448 8.557 423 HA ALA 55 HA ALA 55 -23.741 0.749 7.722 424 HB1 ALA 55 HB1 ALA 55 -21.659 2.423 6.337 425 HB2 ALA 55 HB2 ALA 55 -22.877 3.017 7.467 426 HB3 ALA 55 HB3 ALA 55 -23.368 2.334 5.916 427 H LEU 56 HN LEU 56 -20.482 0.090 6.572 428 HA LEU 56 HA LEU 56 -21.209 -1.015 4.079 429 HB2 LEU 56 HB2 LEU 56 -18.730 -1.343 5.765 430 HB3 LEU 56 HB1 LEU 56 -18.907 -2.078 4.186 431 HG LEU 56 HG LEU 56 -17.606 -0.110 3.930 432 HD11 LEU 56 HD11 LEU 56 -19.241 -0.514 2.169 433 HD12 LEU 56 HD12 LEU 56 -18.916 1.208 2.379 434 HD13 LEU 56 HD13 LEU 56 -20.403 0.506 3.020 435 HD21 LEU 56 HD21 LEU 56 -19.797 1.376 5.357 436 HD22 LEU 56 HD22 LEU 56 -18.409 2.121 4.566 437 HD23 LEU 56 HD23 LEU 56 -18.168 1.066 5.958 438 H ARG 57 HN ARG 57 -20.814 -2.391 7.273 439 HA ARG 57 HA ARG 57 -20.818 -5.105 6.541 440 HB2 ARG 57 HB2 ARG 57 -21.806 -3.827 9.095 441 HB3 ARG 57 HB1 ARG 57 -21.501 -5.545 8.878 442 HG2 ARG 57 HG2 ARG 57 -19.129 -5.009 8.391 443 HG3 ARG 57 HG1 ARG 57 -19.477 -3.320 8.761 444 HD2 ARG 57 HD2 ARG 57 -19.709 -5.667 10.641 445 HD3 ARG 57 HD1 ARG 57 -18.484 -4.402 10.685 446 HE ARG 57 HE ARG 57 -21.343 -3.817 11.124 447 HH11 ARG 57 HH11 ARG 57 -17.988 -3.555 12.091 448 HH12 ARG 57 HH12 ARG 57 -18.331 -2.541 13.457 449 HH21 ARG 57 HH21 ARG 57 -21.798 -2.529 12.930 450 HH22 ARG 57 HH22 ARG 57 -20.502 -1.968 13.945 451 H LEU 58 HN LEU 58 -23.337 -2.824 6.374 452 HA LEU 58 HA LEU 58 -25.318 -4.997 6.126 453 HB2 LEU 58 HB2 LEU 58 -25.679 -2.163 7.075 454 HB3 LEU 58 HB1 LEU 58 -27.024 -3.171 6.587 455 HG LEU 58 HG LEU 58 -26.252 -4.807 8.395 456 HD11 LEU 58 HD11 LEU 58 -24.722 -2.366 9.279 457 HD12 LEU 58 HD12 LEU 58 -24.023 -3.898 8.756 458 HD13 LEU 58 HD13 LEU 58 -24.979 -3.824 10.239 459 HD21 LEU 58 HD21 LEU 58 -27.266 -2.076 9.165 460 HD22 LEU 58 HD22 LEU 58 -27.396 -3.532 10.151 461 HD23 LEU 58 HD23 LEU 58 -28.243 -3.433 8.607 462 H LYS 59 HN LYS 59 -23.439 -3.464 4.187 463 HA LYS 59 HA LYS 59 -25.493 -3.011 2.162 464 HB2 LYS 59 HB2 LYS 59 -25.089 -0.806 3.131 465 HB3 LYS 59 HB1 LYS 59 -23.363 -0.977 2.860 466 HG2 LYS 59 HG2 LYS 59 -23.792 -1.072 0.427 467 HG3 LYS 59 HG1 LYS 59 -25.501 -0.788 0.756 468 HD2 LYS 59 HD2 LYS 59 -23.212 1.057 1.418 469 HD3 LYS 59 HD1 LYS 59 -24.422 1.296 0.156 470 HE2 LYS 59 HE2 LYS 59 -26.172 1.411 1.866 471 HE3 LYS 59 HE1 LYS 59 -24.960 1.177 3.125 472 HZ1 LYS 59 HZ1 LYS 59 -23.878 3.249 2.184 473 HZ2 LYS 59 HZ2 LYS 59 -25.332 3.466 3.033 474 HZ3 LYS 59 HZ3 LYS 59 -25.326 3.503 1.334 475 H ARG 60 HN ARG 60 -22.010 -2.303 2.300 476 HA ARG 60 HA ARG 60 -21.570 -4.363 0.264 477 HB2 ARG 60 HB2 ARG 60 -20.404 -1.569 0.199 478 HB3 ARG 60 HB1 ARG 60 -20.023 -2.868 -0.922 479 HG2 ARG 60 HG2 ARG 60 -22.727 -1.583 -0.591 480 HG3 ARG 60 HG1 ARG 60 -21.578 -1.251 -1.887 481 HD2 ARG 60 HD2 ARG 60 -21.713 -3.624 -2.561 482 HD3 ARG 60 HD1 ARG 60 -22.931 -3.883 -1.313 483 HE ARG 60 HE ARG 60 -23.611 -1.764 -3.127 484 HH11 ARG 60 HH11 ARG 60 -23.752 -5.223 -2.600 485 HH12 ARG 60 HH12 ARG 60 -25.070 -5.469 -3.707 486 HH21 ARG 60 HH21 ARG 60 -25.309 -2.079 -4.606 487 HH22 ARG 60 HH22 ARG 60 -25.931 -3.682 -4.877 488 H GLN 61 HN GLN 61 -20.507 -5.766 1.515 489 HA GLN 61 HA GLN 61 -18.098 -4.782 2.883 490 HB2 GLN 61 HB2 GLN 61 -18.323 -6.603 4.474 491 HB3 GLN 61 HB1 GLN 61 -19.772 -5.615 4.472 492 HG2 GLN 61 HG2 GLN 61 -19.524 -8.227 3.000 493 HG3 GLN 61 HG1 GLN 61 -20.150 -8.076 4.639 494 HE21 GLN 61 HE21 GLN 61 -22.141 -6.997 4.956 495 HE22 GLN 61 HE22 GLN 61 -23.278 -6.812 3.660 496 H GLY 62 HN GLY 62 -16.421 -6.640 3.112 497 HA2 GLY 62 HA2 GLY 62 -16.077 -8.783 1.591 498 HA3 GLY 62 HA1 GLY 62 -16.014 -7.523 0.370 499 H VAL 63 HN VAL 63 -14.014 -9.478 1.442 500 HA VAL 63 HA VAL 63 -11.917 -7.527 2.103 501 HB VAL 63 HB VAL 63 -12.078 -9.189 3.840 502 HG11 VAL 63 HG11 VAL 63 -13.232 -10.946 2.641 503 HG12 VAL 63 HG12 VAL 63 -11.777 -11.586 3.407 504 HG13 VAL 63 HG13 VAL 63 -11.793 -11.260 1.673 505 HG21 VAL 63 HG21 VAL 63 -9.831 -10.165 3.781 506 HG22 VAL 63 HG22 VAL 63 -9.829 -8.480 3.259 507 HG23 VAL 63 HG23 VAL 63 -9.713 -9.772 2.065 508 H GLY 64 HN GLY 64 -10.392 -7.151 0.640 509 HA2 GLY 64 HA2 GLY 64 -9.794 -9.160 -1.393 510 HA3 GLY 64 HA1 GLY 64 -10.439 -7.628 -1.962 511 H GLN 65 HN GLN 65 -7.986 -8.498 -2.789 512 HA GLN 65 HA GLN 65 -6.085 -6.919 -1.196 513 HB2 GLN 65 HB2 GLN 65 -5.486 -9.290 -1.668 514 HB3 GLN 65 HB1 GLN 65 -5.510 -8.924 -3.388 515 HG2 GLN 65 HG2 GLN 65 -3.671 -7.408 -3.149 516 HG3 GLN 65 HG1 GLN 65 -3.704 -7.584 -1.395 517 HE21 GLN 65 HE21 GLN 65 -2.894 -9.453 -0.464 518 HE22 GLN 65 HE22 GLN 65 -1.890 -10.558 -1.341 519 H VAL 66 HN VAL 66 -5.362 -5.039 -1.947 520 HA VAL 66 HA VAL 66 -6.055 -4.286 -4.711 521 HB VAL 66 HB VAL 66 -6.565 -2.802 -2.131 522 HG11 VAL 66 HG11 VAL 66 -7.274 -0.883 -3.340 523 HG12 VAL 66 HG12 VAL 66 -6.949 -1.669 -4.890 524 HG13 VAL 66 HG13 VAL 66 -5.612 -1.250 -3.815 525 HG21 VAL 66 HG21 VAL 66 -8.267 -4.404 -2.823 526 HG22 VAL 66 HG22 VAL 66 -8.398 -3.595 -4.387 527 HG23 VAL 66 HG23 VAL 66 -8.865 -2.747 -2.911 528 H ARG 67 HN ARG 67 -4.213 -3.789 -5.777 529 HA ARG 67 HA ARG 67 -2.056 -2.485 -4.247 530 HB2 ARG 67 HB2 ARG 67 -0.417 -3.548 -5.579 531 HB3 ARG 67 HB1 ARG 67 -1.564 -4.821 -5.182 532 HG2 ARG 67 HG2 ARG 67 -2.371 -4.954 -7.333 533 HG3 ARG 67 HG1 ARG 67 -1.824 -3.325 -7.753 534 HD2 ARG 67 HD2 ARG 67 -0.408 -4.968 -8.835 535 HD3 ARG 67 HD1 ARG 67 0.509 -4.091 -7.611 536 HE ARG 67 HE ARG 67 -0.602 -6.775 -7.117 537 HH11 ARG 67 HH11 ARG 67 2.070 -4.505 -7.056 538 HH12 ARG 67 HH12 ARG 67 3.135 -5.604 -6.218 539 HH21 ARG 67 HH21 ARG 67 0.798 -8.200 -6.012 540 HH22 ARG 67 HH22 ARG 67 2.403 -7.688 -5.594 541 H PHE 68 HN PHE 68 -0.995 -0.713 -5.217 542 HA PHE 68 HA PHE 68 -1.879 0.285 -7.741 543 HB2 PHE 68 HB2 PHE 68 -2.801 2.437 -6.666 544 HB3 PHE 68 HB1 PHE 68 -3.830 1.017 -6.729 545 HD1 PHE 68 HD2 PHE 68 -1.232 2.351 -4.373 546 HD2 PHE 68 HD1 PHE 68 -5.142 0.753 -4.919 547 HE1 PHE 68 HE2 PHE 68 -1.649 2.527 -1.952 548 HE2 PHE 68 HE1 PHE 68 -5.562 0.933 -2.505 549 HZ PHE 68 HZ PHE 68 -3.819 1.824 -1.021 550 H THR 69 HN THR 69 -0.990 2.406 -8.262 551 HA THR 69 HA THR 69 1.552 2.950 -6.856 552 HB THR 69 HB THR 69 0.835 3.872 -9.644 553 HG1 THR 69 HG1 THR 69 1.601 1.366 -8.739 554 HG21 THR 69 HG21 THR 69 2.678 5.036 -8.535 555 HG22 THR 69 HG22 THR 69 3.281 4.044 -9.866 556 HG23 THR 69 HG23 THR 69 3.462 3.497 -8.197 557 H LEU 70 HN LEU 70 1.874 4.891 -5.987 558 HA LEU 70 HA LEU 70 -0.358 6.799 -6.182 559 HB2 LEU 70 HB2 LEU 70 1.338 6.093 -3.793 560 HB3 LEU 70 HB1 LEU 70 0.081 7.318 -3.817 561 HG LEU 70 HG LEU 70 -0.428 4.405 -4.399 562 HD11 LEU 70 HD11 LEU 70 -1.456 4.435 -2.085 563 HD12 LEU 70 HD12 LEU 70 -0.555 5.930 -1.809 564 HD13 LEU 70 HD13 LEU 70 0.307 4.430 -2.165 565 HD21 LEU 70 HD21 LEU 70 -2.767 5.047 -3.997 566 HD22 LEU 70 HD22 LEU 70 -2.060 5.931 -5.350 567 HD23 LEU 70 HD23 LEU 70 -2.261 6.726 -3.788 568 H ASP 71 HN ASP 71 0.075 8.882 -6.474 569 HA ASP 71 HA ASP 71 2.769 9.726 -7.060 570 HB2 ASP 71 HB2 ASP 71 0.830 10.534 -8.387 571 HB3 ASP 71 HB1 ASP 71 0.196 11.322 -6.942 572 H ARG 72 HN ARG 72 3.753 11.620 -6.006 573 HA ARG 72 HA ARG 72 3.886 11.394 -3.228 574 HB2 ARG 72 HB2 ARG 72 5.643 12.435 -4.604 575 HB3 ARG 72 HB1 ARG 72 4.581 13.804 -4.920 576 HG2 ARG 72 HG2 ARG 72 4.513 14.106 -2.385 577 HG3 ARG 72 HG1 ARG 72 5.893 13.004 -2.347 578 HD2 ARG 72 HD2 ARG 72 6.684 15.278 -2.376 579 HD3 ARG 72 HD1 ARG 72 7.082 14.499 -3.908 580 HE ARG 72 HE ARG 72 4.592 15.930 -3.956 581 HH11 ARG 72 HH11 ARG 72 8.053 16.187 -4.374 582 HH12 ARG 72 HH12 ARG 72 7.952 17.613 -5.358 583 HH21 ARG 72 HH21 ARG 72 4.451 17.802 -5.246 584 HH22 ARG 72 HH22 ARG 72 5.909 18.549 -5.843 585 H GLN 73 HN GLN 73 1.883 13.477 -5.271 586 HA GLN 73 HA GLN 73 0.879 15.005 -3.027 587 HB2 GLN 73 HB2 GLN 73 0.008 14.916 -5.920 588 HB3 GLN 73 HB1 GLN 73 -0.587 16.057 -4.719 589 HG2 GLN 73 HG2 GLN 73 2.288 15.798 -5.566 590 HG3 GLN 73 HG1 GLN 73 1.155 16.993 -6.190 591 HE21 GLN 73 HE21 GLN 73 -0.153 17.393 -3.642 592 HE22 GLN 73 HE22 GLN 73 0.939 18.301 -2.659 593 H GLY 74 HN GLY 74 0.364 11.944 -3.889 594 HA2 GLY 74 HA2 GLY 74 -1.220 10.478 -3.060 595 HA3 GLY 74 HA1 GLY 74 -2.155 11.851 -2.498 596 H HIS 75 HN HIS 75 -1.029 11.403 -5.760 597 HA HIS 75 HA HIS 75 -3.815 11.255 -6.647 598 HB2 HIS 75 HB2 HIS 75 -2.446 13.046 -7.635 599 HB3 HIS 75 HB1 HIS 75 -1.285 11.856 -8.209 600 HD1 HIS 75 HD1 HIS 75 -4.548 13.420 -9.023 601 HD2 HIS 75 HD2 HIS 75 -2.168 10.311 -10.423 602 HE1 HIS 75 HE1 HIS 75 -5.510 12.778 -11.260 603 HE2 HIS 75 HE2 HIS 75 -4.149 10.798 -12.018 604 H VAL 76 HN VAL 76 -4.489 9.210 -6.725 605 HA VAL 76 HA VAL 76 -3.141 6.887 -7.142 606 HB VAL 76 HB VAL 76 -5.490 6.892 -6.611 607 HG11 VAL 76 HG11 VAL 76 -7.222 7.436 -8.259 608 HG12 VAL 76 HG12 VAL 76 -5.970 7.968 -9.381 609 HG13 VAL 76 HG13 VAL 76 -6.215 8.828 -7.863 610 HG21 VAL 76 HG21 VAL 76 -4.986 5.543 -9.258 611 HG22 VAL 76 HG22 VAL 76 -6.318 5.169 -8.163 612 HG23 VAL 76 HG23 VAL 76 -4.652 4.878 -7.659 613 H LEU 77 HN LEU 77 -1.704 6.377 -8.622 614 HA LEU 77 HA LEU 77 -1.932 7.511 -11.310 615 HB2 LEU 77 HB2 LEU 77 0.383 6.100 -9.986 616 HB3 LEU 77 HB1 LEU 77 0.413 6.844 -11.574 617 HG LEU 77 HG LEU 77 -0.127 8.397 -9.048 618 HD11 LEU 77 HD11 LEU 77 2.088 7.358 -8.942 619 HD12 LEU 77 HD12 LEU 77 2.190 9.109 -9.137 620 HD13 LEU 77 HD13 LEU 77 2.480 8.047 -10.517 621 HD21 LEU 77 HD21 LEU 77 0.688 9.236 -11.826 622 HD22 LEU 77 HD22 LEU 77 0.468 10.312 -10.446 623 HD23 LEU 77 HD23 LEU 77 -0.910 9.434 -11.113 624 H ALA 78 HN ALA 78 -2.153 4.600 -9.556 625 HA ALA 78 HA ALA 78 -3.006 3.127 -11.894 626 HB1 ALA 78 HB1 ALA 78 -0.545 2.781 -11.892 627 HB2 ALA 78 HB2 ALA 78 -1.446 1.291 -11.610 628 HB3 ALA 78 HB3 ALA 78 -0.669 2.120 -10.258 629 H VAL 79 HN VAL 79 -4.110 1.149 -11.253 630 HA VAL 79 HA VAL 79 -4.164 0.414 -8.494 631 HB VAL 79 HB VAL 79 -5.777 2.297 -8.484 632 HG11 VAL 79 HG11 VAL 79 -7.969 2.003 -9.574 633 HG12 VAL 79 HG12 VAL 79 -7.333 0.589 -10.415 634 HG13 VAL 79 HG13 VAL 79 -6.644 2.182 -10.725 635 HG21 VAL 79 HG21 VAL 79 -6.001 0.493 -6.883 636 HG22 VAL 79 HG22 VAL 79 -6.985 -0.423 -8.025 637 HG23 VAL 79 HG23 VAL 79 -7.588 1.096 -7.361 638 H THR 80 HN THR 80 -4.597 -1.720 -8.306 639 HA THR 80 HA THR 80 -5.982 -3.078 -10.495 640 HB THR 80 HB THR 80 -3.224 -3.879 -9.537 641 HG1 THR 80 HG1 THR 80 -4.054 -2.191 -11.476 642 HG21 THR 80 HG21 THR 80 -4.643 -5.808 -10.111 643 HG22 THR 80 HG22 THR 80 -3.326 -5.599 -11.266 644 HG23 THR 80 HG23 THR 80 -4.962 -5.095 -11.693 645 H LEU 81 HN LEU 81 -7.359 -4.548 -9.726 646 HA LEU 81 HA LEU 81 -7.327 -5.338 -6.971 647 HB2 LEU 81 HB2 LEU 81 -9.413 -5.151 -8.319 648 HB3 LEU 81 HB1 LEU 81 -8.887 -6.535 -9.263 649 HG LEU 81 HG LEU 81 -8.823 -7.823 -7.064 650 HD11 LEU 81 HD11 LEU 81 -8.854 -5.930 -5.553 651 HD12 LEU 81 HD12 LEU 81 -10.258 -6.960 -5.277 652 HD13 LEU 81 HD13 LEU 81 -10.437 -5.443 -6.159 653 HD21 LEU 81 HD21 LEU 81 -11.461 -6.799 -8.116 654 HD22 LEU 81 HD22 LEU 81 -11.252 -8.233 -7.113 655 HD23 LEU 81 HD23 LEU 81 -10.553 -8.180 -8.730 656 H VAL 82 HN VAL 82 -5.916 -6.714 -6.207 657 HA VAL 82 HA VAL 82 -4.340 -8.329 -8.029 658 HB VAL 82 HB VAL 82 -3.818 -8.569 -5.144 659 HG11 VAL 82 HG11 VAL 82 -2.208 -7.972 -7.603 660 HG12 VAL 82 HG12 VAL 82 -2.142 -9.394 -6.556 661 HG13 VAL 82 HG13 VAL 82 -1.522 -7.839 -5.984 662 HG21 VAL 82 HG21 VAL 82 -3.597 -5.891 -6.501 663 HG22 VAL 82 HG22 VAL 82 -2.881 -6.301 -4.941 664 HG23 VAL 82 HG23 VAL 82 -4.636 -6.303 -5.136 665 H SER 83 HN SER 83 -6.524 -8.742 -5.310 666 HA SER 83 HA SER 83 -7.182 -11.409 -6.248 667 HB2 SER 83 HB2 SER 83 -6.164 -10.916 -3.435 668 HB3 SER 83 HB1 SER 83 -6.918 -12.411 -3.985 669 HG SER 83 HG SER 83 -4.990 -11.795 -5.702 670 H SER 84 HN SER 84 -9.223 -12.142 -5.448 671 HA SER 84 HA SER 84 -10.759 -10.188 -3.907 672 HB2 SER 84 HB2 SER 84 -11.167 -9.590 -6.228 673 HB3 SER 84 HB1 SER 84 -11.590 -11.258 -6.617 674 HG SER 84 HG SER 84 -13.507 -10.253 -6.289 675 H ALA 85 HN ALA 85 -12.400 -11.059 -2.696 676 HA ALA 85 HA ALA 85 -12.404 -13.989 -2.527 677 HB1 ALA 85 HB1 ALA 85 -13.222 -13.689 -0.256 678 HB2 ALA 85 HB2 ALA 85 -13.297 -11.943 -0.499 679 HB3 ALA 85 HB3 ALA 85 -11.738 -12.770 -0.511 680 H GLY 86 HN GLY 86 -14.026 -12.139 -4.349 681 HA2 GLY 86 HA2 GLY 86 -16.058 -12.831 -5.377 682 HA3 GLY 86 HA1 GLY 86 -16.570 -13.506 -3.835 683 H LEU 87 HN LEU 87 -15.657 -10.331 -5.196 684 HA LEU 87 HA LEU 87 -17.946 -9.201 -3.719 685 HB2 LEU 87 HB2 LEU 87 -15.462 -7.685 -4.487 686 HB3 LEU 87 HB1 LEU 87 -16.782 -7.098 -3.522 687 HG LEU 87 HG LEU 87 -15.079 -7.446 -1.987 688 HD11 LEU 87 HD11 LEU 87 -17.164 -8.445 -1.255 689 HD12 LEU 87 HD12 LEU 87 -15.766 -9.293 -0.591 690 HD13 LEU 87 HD13 LEU 87 -16.666 -9.994 -1.936 691 HD21 LEU 87 HD21 LEU 87 -14.488 -10.115 -3.246 692 HD22 LEU 87 HD22 LEU 87 -13.654 -9.397 -1.868 693 HD23 LEU 87 HD23 LEU 87 -13.543 -8.641 -3.458 694 HA PRO 88 HA PRO 88 -18.648 -8.464 -8.215 695 HB2 PRO 88 HB2 PRO 88 -21.432 -9.106 -7.723 696 HB3 PRO 88 HB1 PRO 88 -20.267 -9.962 -8.735 697 HG2 PRO 88 HG2 PRO 88 -21.282 -10.988 -6.415 698 HG3 PRO 88 HG1 PRO 88 -19.688 -11.416 -7.060 699 HD2 PRO 88 HD2 PRO 88 -20.398 -9.477 -4.888 700 HD3 PRO 88 HD1 PRO 88 -19.063 -10.651 -4.957 701 H SER 89 HN SER 89 -21.720 -7.910 -6.618 702 HA SER 89 HA SER 89 -21.869 -5.220 -7.493 703 HB2 SER 89 HB2 SER 89 -23.519 -6.712 -5.441 704 HB3 SER 89 HB1 SER 89 -23.929 -5.132 -6.111 705 HG SER 89 HG SER 89 -24.072 -7.660 -7.278 706 H LEU 90 HN LEU 90 -20.418 -6.722 -4.844 707 HA LEU 90 HA LEU 90 -20.550 -4.617 -2.941 708 HB2 LEU 90 HB2 LEU 90 -18.455 -6.784 -3.171 709 HB3 LEU 90 HB1 LEU 90 -18.879 -5.867 -1.737 710 HG LEU 90 HG LEU 90 -20.865 -7.658 -3.113 711 HD11 LEU 90 HD11 LEU 90 -20.241 -9.455 -1.721 712 HD12 LEU 90 HD12 LEU 90 -19.151 -8.439 -0.777 713 HD13 LEU 90 HD13 LEU 90 -18.741 -8.854 -2.445 714 HD21 LEU 90 HD21 LEU 90 -20.652 -6.585 -0.302 715 HD22 LEU 90 HD22 LEU 90 -21.941 -7.614 -0.924 716 HD23 LEU 90 HD23 LEU 90 -21.736 -5.980 -1.557 717 H ASP 91 HN ASP 91 -18.426 -5.427 -5.586 718 HA ASP 91 HA ASP 91 -16.123 -4.030 -4.945 719 HB2 ASP 91 HB2 ASP 91 -16.106 -5.518 -6.808 720 HB3 ASP 91 HB1 ASP 91 -17.414 -4.653 -7.603 721 H ARG 92 HN ARG 92 -19.058 -2.871 -6.520 722 HA ARG 92 HA ARG 92 -18.049 -0.535 -7.579 723 HB2 ARG 92 HB2 ARG 92 -20.327 0.231 -7.789 724 HB3 ARG 92 HB1 ARG 92 -20.222 -1.480 -8.172 725 HG2 ARG 92 HG2 ARG 92 -20.977 -1.879 -5.762 726 HG3 ARG 92 HG1 ARG 92 -21.417 -0.168 -5.761 727 HD2 ARG 92 HD2 ARG 92 -22.474 -2.360 -7.524 728 HD3 ARG 92 HD1 ARG 92 -23.364 -1.372 -6.369 729 HE ARG 92 HE ARG 92 -22.358 0.432 -8.151 730 HH11 ARG 92 HH11 ARG 92 -24.308 -2.458 -8.465 731 HH12 ARG 92 HH12 ARG 92 -25.177 -1.873 -9.853 732 HH21 ARG 92 HH21 ARG 92 -23.472 1.194 -9.969 733 HH22 ARG 92 HH22 ARG 92 -24.687 0.200 -10.722 734 H GLU 93 HN GLU 93 -19.576 -0.887 -4.348 735 HA GLU 93 HA GLU 93 -19.163 1.899 -3.780 736 HB2 GLU 93 HB2 GLU 93 -21.059 0.717 -2.802 737 HB3 GLU 93 HB1 GLU 93 -19.965 -0.358 -1.945 738 HG2 GLU 93 HG2 GLU 93 -20.740 1.238 -0.380 739 HG3 GLU 93 HG1 GLU 93 -19.066 1.649 -0.746 740 H ILE 94 HN ILE 94 -17.710 -1.121 -2.527 741 HA ILE 94 HA ILE 94 -16.043 0.192 -0.679 742 HB ILE 94 HB ILE 94 -14.846 -1.919 -0.421 743 HG12 ILE 94 HG12 ILE 94 -16.544 -2.907 -2.723 744 HG13 ILE 94 HG11 ILE 94 -14.811 -2.611 -2.792 745 HG21 ILE 94 HG21 ILE 94 -17.834 -2.234 -0.626 746 HG22 ILE 94 HG22 ILE 94 -16.932 -1.616 0.757 747 HG23 ILE 94 HG23 ILE 94 -16.754 -3.301 0.270 748 HD11 ILE 94 HD11 ILE 94 -15.314 -4.981 -2.561 749 HD12 ILE 94 HD12 ILE 94 -16.177 -4.658 -1.057 750 HD13 ILE 94 HD13 ILE 94 -14.439 -4.375 -1.153 751 H GLN 95 HN GLN 95 -15.475 -0.830 -4.024 752 HA GLN 95 HA GLN 95 -12.715 -0.078 -3.852 753 HB2 GLN 95 HB2 GLN 95 -14.365 -0.733 -6.273 754 HB3 GLN 95 HB1 GLN 95 -12.639 -0.597 -6.207 755 HG2 GLN 95 HG2 GLN 95 -14.181 -2.606 -4.616 756 HG3 GLN 95 HG1 GLN 95 -13.512 -2.939 -6.210 757 HE21 GLN 95 HE21 GLN 95 -12.963 -4.247 -3.732 758 HE22 GLN 95 HE22 GLN 95 -11.275 -4.050 -3.419 759 H ALA 96 HN ALA 96 -15.723 1.392 -4.971 760 HA ALA 96 HA ALA 96 -14.608 3.685 -6.121 761 HB1 ALA 96 HB1 ALA 96 -16.631 4.880 -5.407 762 HB2 ALA 96 HB2 ALA 96 -17.055 3.528 -4.355 763 HB3 ALA 96 HB3 ALA 96 -17.023 3.309 -6.104 764 H LEU 97 HN LEU 97 -15.196 2.815 -2.761 765 HA LEU 97 HA LEU 97 -14.349 5.151 -1.545 766 HB2 LEU 97 HB2 LEU 97 -15.706 3.302 -0.592 767 HB3 LEU 97 HB1 LEU 97 -14.256 2.311 -0.548 768 HG LEU 97 HG LEU 97 -13.630 4.702 0.668 769 HD11 LEU 97 HD11 LEU 97 -15.960 5.201 0.994 770 HD12 LEU 97 HD12 LEU 97 -15.273 4.727 2.548 771 HD13 LEU 97 HD13 LEU 97 -16.256 3.583 1.629 772 HD21 LEU 97 HD21 LEU 97 -13.457 3.221 2.704 773 HD22 LEU 97 HD22 LEU 97 -12.561 2.701 1.277 774 HD23 LEU 97 HD23 LEU 97 -14.097 1.928 1.687 775 H VAL 98 HN VAL 98 -12.598 2.046 -1.856 776 HA VAL 98 HA VAL 98 -10.112 3.339 -1.091 777 HB VAL 98 HB VAL 98 -10.712 0.452 -1.733 778 HG11 VAL 98 HG11 VAL 98 -8.192 1.647 -0.587 779 HG12 VAL 98 HG12 VAL 98 -8.374 1.020 -2.226 780 HG13 VAL 98 HG13 VAL 98 -8.517 -0.069 -0.846 781 HG21 VAL 98 HG21 VAL 98 -11.787 1.229 0.301 782 HG22 VAL 98 HG22 VAL 98 -10.253 1.870 0.889 783 HG23 VAL 98 HG23 VAL 98 -10.463 0.130 0.690 784 H LYS 99 HN LYS 99 -11.273 1.533 -3.924 785 HA LYS 99 HA LYS 99 -8.802 1.603 -5.302 786 HB2 LYS 99 HB2 LYS 99 -10.378 -0.159 -5.782 787 HB3 LYS 99 HB1 LYS 99 -11.618 0.993 -6.259 788 HG2 LYS 99 HG2 LYS 99 -10.087 1.673 -8.144 789 HG3 LYS 99 HG1 LYS 99 -9.079 0.291 -7.716 790 HD2 LYS 99 HD2 LYS 99 -11.989 0.181 -8.511 791 HD3 LYS 99 HD1 LYS 99 -10.622 -0.250 -9.539 792 HE2 LYS 99 HE2 LYS 99 -10.055 -2.093 -8.111 793 HE3 LYS 99 HE1 LYS 99 -11.255 -1.599 -6.918 794 HZ1 LYS 99 HZ1 LYS 99 -11.775 -2.633 -9.653 795 HZ2 LYS 99 HZ2 LYS 99 -12.973 -1.981 -8.650 796 HZ3 LYS 99 HZ3 LYS 99 -12.158 -3.388 -8.182 797 H ARG 100 HN ARG 100 -11.578 3.792 -5.252 798 HA ARG 100 HA ARG 100 -10.445 5.313 -7.466 799 HB2 ARG 100 HB2 ARG 100 -12.905 5.048 -7.243 800 HB3 ARG 100 HB1 ARG 100 -12.845 5.937 -5.732 801 HG2 ARG 100 HG2 ARG 100 -11.867 7.148 -8.288 802 HG3 ARG 100 HG1 ARG 100 -13.572 7.170 -7.851 803 HD2 ARG 100 HD2 ARG 100 -12.995 8.319 -5.752 804 HD3 ARG 100 HD1 ARG 100 -11.300 8.330 -6.239 805 HE ARG 100 HE ARG 100 -12.776 9.527 -8.287 806 HH11 ARG 100 HH11 ARG 100 -11.932 10.148 -4.939 807 HH12 ARG 100 HH12 ARG 100 -12.044 11.874 -5.103 808 HH21 ARG 100 HH21 ARG 100 -12.946 11.803 -8.483 809 HH22 ARG 100 HH22 ARG 100 -12.617 12.808 -7.099 810 H ALA 101 HN ALA 101 -11.080 5.733 -3.992 811 HA ALA 101 HA ALA 101 -9.519 8.177 -3.959 812 HB1 ALA 101 HB1 ALA 101 -10.236 8.536 -1.790 813 HB2 ALA 101 HB2 ALA 101 -10.453 6.813 -1.453 814 HB3 ALA 101 HB3 ALA 101 -11.608 7.668 -2.494 815 H SER 102 HN SER 102 -7.598 6.892 -4.804 816 HA SER 102 HA SER 102 -6.143 5.914 -2.456 817 HB2 SER 102 HB2 SER 102 -5.629 5.435 -5.387 818 HB3 SER 102 HB1 SER 102 -4.502 4.977 -4.113 819 HG SER 102 HG SER 102 -7.192 4.156 -3.960 820 HA PRO 103 HA PRO 103 -3.829 9.745 -2.876 821 HB2 PRO 103 HB2 PRO 103 -4.386 10.272 -0.136 822 HB3 PRO 103 HB1 PRO 103 -5.111 11.066 -1.540 823 HG2 PRO 103 HG2 PRO 103 -6.475 9.455 0.251 824 HG3 PRO 103 HG1 PRO 103 -7.012 9.825 -1.398 825 HD2 PRO 103 HD2 PRO 103 -5.534 7.420 -0.385 826 HD3 PRO 103 HD1 PRO 103 -6.908 7.505 -1.512 827 H LEU 104 HN LEU 104 -2.108 10.496 -1.225 828 HA LEU 104 HA LEU 104 -0.858 8.214 0.139 829 HB2 LEU 104 HB2 LEU 104 0.135 8.530 -2.121 830 HB3 LEU 104 HB1 LEU 104 0.534 10.181 -1.690 831 HG LEU 104 HG LEU 104 1.899 9.061 0.239 832 HD11 LEU 104 HD11 LEU 104 1.853 6.821 -1.784 833 HD12 LEU 104 HD12 LEU 104 1.005 6.782 -0.239 834 HD13 LEU 104 HD13 LEU 104 2.769 6.878 -0.276 835 HD21 LEU 104 HD21 LEU 104 2.769 8.977 -2.648 836 HD22 LEU 104 HD22 LEU 104 3.839 8.977 -1.246 837 HD23 LEU 104 HD23 LEU 104 2.830 10.382 -1.584 838 HA PRO 105 HA PRO 105 -1.114 11.836 2.881 839 HB2 PRO 105 HB2 PRO 105 -1.172 10.567 5.228 840 HB3 PRO 105 HB1 PRO 105 -2.570 10.557 4.146 841 HG2 PRO 105 HG2 PRO 105 -0.477 8.444 4.553 842 HG3 PRO 105 HG1 PRO 105 -2.238 8.269 4.454 843 HD2 PRO 105 HD2 PRO 105 -0.579 7.796 2.345 844 HD3 PRO 105 HD1 PRO 105 -2.270 8.340 2.186 845 H THR 106 HN THR 106 1.189 9.222 3.097 846 HA THR 106 HA THR 106 3.155 11.078 4.236 847 HB THR 106 HB THR 106 2.710 9.501 5.967 848 HG1 THR 106 HG1 THR 106 4.905 8.111 5.196 849 HG21 THR 106 HG21 THR 106 3.087 7.311 3.921 850 HG22 THR 106 HG22 THR 106 1.565 7.784 4.678 851 HG23 THR 106 HG23 THR 106 2.849 7.068 5.652 852 HA PRO 107 HA PRO 107 4.808 10.219 0.159 853 HB2 PRO 107 HB2 PRO 107 6.853 12.018 0.345 854 HB3 PRO 107 HB1 PRO 107 5.193 12.464 -0.064 855 HG2 PRO 107 HG2 PRO 107 6.607 12.636 2.568 856 HG3 PRO 107 HG1 PRO 107 5.516 13.808 1.805 857 HD2 PRO 107 HD2 PRO 107 4.702 12.148 3.767 858 HD3 PRO 107 HD1 PRO 107 3.627 12.654 2.447 859 HA PRO 108 HA PRO 108 8.134 7.568 1.752 860 HB2 PRO 108 HB2 PRO 108 7.639 5.465 0.220 861 HB3 PRO 108 HB1 PRO 108 6.509 5.883 1.522 862 HG2 PRO 108 HG2 PRO 108 6.315 6.467 -1.411 863 HG3 PRO 108 HG1 PRO 108 5.064 5.832 -0.327 864 HD2 PRO 108 HD2 PRO 108 5.314 8.482 -1.038 865 HD3 PRO 108 HD1 PRO 108 4.531 7.919 0.453 866 H ALA 109 HN ALA 109 9.111 9.562 0.491 867 HA ALA 109 HA ALA 109 9.990 9.459 -2.103 868 HB1 ALA 109 HB1 ALA 109 11.591 10.390 0.280 869 HB2 ALA 109 HB2 ALA 109 10.397 11.346 -0.599 870 HB3 ALA 109 HB3 ALA 109 11.879 10.829 -1.404 871 H ASP 110 HN ASP 110 11.473 7.946 0.727 872 HA ASP 110 HA ASP 110 13.713 6.830 -0.488 873 HB2 ASP 110 HB2 ASP 110 13.411 6.923 1.937 874 HB3 ASP 110 HB1 ASP 110 12.090 5.765 1.830 875 H ALA 111 HN ALA 111 10.402 5.768 -0.487 876 HA ALA 111 HA ALA 111 11.014 3.081 -1.322 877 HB1 ALA 111 HB1 ALA 111 8.350 4.487 -1.172 878 HB2 ALA 111 HB2 ALA 111 9.100 3.560 0.133 879 HB3 ALA 111 HB3 ALA 111 8.613 2.751 -1.357 880 H TYR 112 HN TYR 112 10.144 6.095 -2.902 881 HA TYR 112 HA TYR 112 9.888 4.547 -5.370 882 HB2 TYR 112 HB2 TYR 112 8.421 6.316 -6.283 883 HB3 TYR 112 HB1 TYR 112 7.767 5.331 -4.999 884 HD1 TYR 112 HD2 TYR 112 9.885 8.411 -4.751 885 HD2 TYR 112 HD1 TYR 112 6.120 6.569 -4.086 886 HE1 TYR 112 HE2 TYR 112 9.103 10.428 -3.577 887 HE2 TYR 112 HE1 TYR 112 5.320 8.550 -2.928 888 HH TYR 112 HH TYR 112 6.219 10.477 -1.742 889 H VAL 113 HN VAL 113 12.165 6.123 -4.095 890 HA VAL 113 HA VAL 113 12.934 7.841 -6.257 891 HB VAL 113 HB VAL 113 15.323 7.398 -5.416 892 HG11 VAL 113 HG11 VAL 113 14.083 9.405 -4.844 893 HG12 VAL 113 HG12 VAL 113 15.024 8.849 -3.459 894 HG13 VAL 113 HG13 VAL 113 13.286 8.557 -3.517 895 HG21 VAL 113 HG21 VAL 113 15.578 6.430 -3.213 896 HG22 VAL 113 HG22 VAL 113 14.822 5.254 -4.289 897 HG23 VAL 113 HG23 VAL 113 13.845 6.130 -3.110 898 H ASN 114 HN ASN 114 12.563 6.869 -8.116 899 HA ASN 114 HA ASN 114 14.025 5.168 -9.561 900 HB2 ASN 114 HB2 ASN 114 13.383 2.914 -9.232 901 HB3 ASN 114 HB1 ASN 114 13.675 3.507 -7.605 902 HD21 ASN 114 HD21 ASN 114 11.894 3.855 -6.225 903 HD22 ASN 114 HD22 ASN 114 10.363 3.119 -6.533 904 H GLY 115 HN GLY 115 10.966 6.227 -8.465 905 HA2 GLY 115 HA2 GLY 115 9.905 7.036 -10.842 906 HA3 GLY 115 HA1 GLY 115 9.413 5.351 -10.712 907 H THR 116 HN THR 116 8.122 4.717 -8.882 908 HA THR 116 HA THR 116 6.865 6.683 -7.218 909 HB THR 116 HB THR 116 4.554 5.743 -8.298 910 HG1 THR 116 HG1 THR 116 6.011 4.863 -10.065 911 HG21 THR 116 HG21 THR 116 4.339 7.952 -9.363 912 HG22 THR 116 HG22 THR 116 6.072 8.208 -9.152 913 HG23 THR 116 HG23 THR 116 5.025 8.066 -7.741 914 H VAL 117 HN VAL 117 4.806 5.427 -6.112 915 HA VAL 117 HA VAL 117 6.057 2.905 -5.268 916 HB VAL 117 HB VAL 117 4.514 3.098 -3.253 917 HG11 VAL 117 HG11 VAL 117 6.687 5.128 -3.685 918 HG12 VAL 117 HG12 VAL 117 6.844 3.509 -2.998 919 HG13 VAL 117 HG13 VAL 117 5.961 4.762 -2.119 920 HG21 VAL 117 HG21 VAL 117 2.935 4.732 -4.098 921 HG22 VAL 117 HG22 VAL 117 4.223 5.927 -4.268 922 HG23 VAL 117 HG23 VAL 117 3.747 5.363 -2.665 923 H GLU 118 HN GLU 118 5.245 1.303 -6.394 924 HA GLU 118 HA GLU 118 2.328 0.988 -6.459 925 HB2 GLU 118 HB2 GLU 118 3.820 0.665 -8.557 926 HB3 GLU 118 HB1 GLU 118 4.362 -0.814 -7.781 927 HG2 GLU 118 HG2 GLU 118 1.477 -0.216 -8.380 928 HG3 GLU 118 HG1 GLU 118 2.549 -1.083 -9.480 929 H LEU 119 HN LEU 119 1.553 -0.068 -4.729 930 HA LEU 119 HA LEU 119 3.145 -2.219 -3.579 931 HB2 LEU 119 HB2 LEU 119 3.168 -1.335 -1.373 932 HB3 LEU 119 HB1 LEU 119 3.812 -0.108 -2.439 933 HG LEU 119 HG LEU 119 1.284 0.772 -2.336 934 HD11 LEU 119 HD11 LEU 119 0.357 0.462 -0.130 935 HD12 LEU 119 HD12 LEU 119 1.677 -0.625 0.294 936 HD13 LEU 119 HD13 LEU 119 0.523 -1.088 -0.958 937 HD21 LEU 119 HD21 LEU 119 1.997 2.266 -0.522 938 HD22 LEU 119 HD22 LEU 119 3.258 2.067 -1.739 939 HD23 LEU 119 HD23 LEU 119 3.373 1.210 -0.202 940 H THR 120 HN THR 120 1.989 -3.670 -2.327 941 HA THR 120 HA THR 120 -0.821 -3.804 -3.014 942 HB THR 120 HB THR 120 0.993 -5.765 -1.607 943 HG1 THR 120 HG1 THR 120 1.218 -5.241 -3.968 944 HG21 THR 120 HG21 THR 120 -1.805 -6.184 -2.655 945 HG22 THR 120 HG22 THR 120 -1.382 -6.007 -0.950 946 HG23 THR 120 HG23 THR 120 -0.782 -7.388 -1.875 947 H LEU 121 HN LEU 121 -2.387 -3.162 -1.720 948 HA LEU 121 HA LEU 121 -1.945 -3.326 1.181 949 HB2 LEU 121 HB2 LEU 121 -3.325 -1.198 -0.427 950 HB3 LEU 121 HB1 LEU 121 -3.697 -1.438 1.271 951 HG LEU 121 HG LEU 121 -1.003 -0.714 0.116 952 HD11 LEU 121 HD11 LEU 121 -1.351 1.340 1.509 953 HD12 LEU 121 HD12 LEU 121 -3.045 0.856 1.656 954 HD13 LEU 121 HD13 LEU 121 -2.350 1.194 0.069 955 HD21 LEU 121 HD21 LEU 121 -0.277 -0.582 2.454 956 HD22 LEU 121 HD22 LEU 121 -0.767 -2.218 2.004 957 HD23 LEU 121 HD23 LEU 121 -1.844 -1.208 2.970 958 HA PRO 122 HA PRO 122 -5.521 -5.981 0.817 959 HB2 PRO 122 HB2 PRO 122 -5.277 -6.390 3.677 960 HB3 PRO 122 HB1 PRO 122 -4.977 -7.536 2.371 961 HG2 PRO 122 HG2 PRO 122 -3.008 -6.522 3.966 962 HG3 PRO 122 HG1 PRO 122 -2.739 -7.071 2.302 963 HD2 PRO 122 HD2 PRO 122 -3.071 -4.287 3.350 964 HD3 PRO 122 HD1 PRO 122 -1.972 -4.898 2.093 965 H ILE 123 HN ILE 123 -7.477 -5.065 0.725 966 HA ILE 123 HA ILE 123 -8.242 -3.208 2.868 967 HB ILE 123 HB ILE 123 -9.812 -2.183 1.414 968 HG12 ILE 123 HG12 ILE 123 -9.320 -4.348 -0.637 969 HG13 ILE 123 HG11 ILE 123 -10.717 -4.298 0.434 970 HG21 ILE 123 HG21 ILE 123 -8.475 -1.656 -0.670 971 HG22 ILE 123 HG22 ILE 123 -7.287 -2.830 -0.094 972 HG23 ILE 123 HG23 ILE 123 -7.647 -1.399 0.871 973 HD11 ILE 123 HD11 ILE 123 -11.343 -2.128 -0.555 974 HD12 ILE 123 HD12 ILE 123 -11.325 -3.450 -1.722 975 HD13 ILE 123 HD13 ILE 123 -9.997 -2.289 -1.681 976 H ASP 124 HN ASP 124 -9.680 -3.940 4.356 977 HA ASP 124 HA ASP 124 -11.312 -6.235 3.515 978 HB2 ASP 124 HB2 ASP 124 -10.995 -7.368 5.588 979 HB3 ASP 124 HB1 ASP 124 -9.403 -6.934 4.986 980 H PHE 125 HN PHE 125 -13.327 -5.865 3.604 981 HA PHE 125 HA PHE 125 -14.453 -4.270 5.810 982 HB2 PHE 125 HB2 PHE 125 -15.691 -5.010 3.139 983 HB3 PHE 125 HB1 PHE 125 -16.451 -4.024 4.374 984 HD1 PHE 125 HD2 PHE 125 -13.684 -4.170 1.942 985 HD2 PHE 125 HD1 PHE 125 -16.014 -1.702 4.505 986 HE1 PHE 125 HE2 PHE 125 -12.707 -2.177 0.897 987 HE2 PHE 125 HE1 PHE 125 -15.039 0.303 3.457 988 HZ PHE 125 HZ PHE 125 -13.380 0.063 1.652 989 H SER 126 HN SER 126 -15.984 -5.340 7.130 990 HA SER 126 HA SER 126 -15.492 -8.048 7.547 991 HB2 SER 126 HB2 SER 126 -17.954 -6.530 8.429 992 HB3 SER 126 HB1 SER 126 -17.243 -7.946 9.202 993 HG SER 126 HG SER 126 -15.300 -6.543 9.421 994 H LEU 127 HN LEU 127 -15.901 -9.514 5.979 995 HA LEU 127 HA LEU 127 -18.371 -9.321 4.425 996 HB2 LEU 127 HB2 LEU 127 -15.834 -9.840 3.650 997 HB3 LEU 127 HB1 LEU 127 -16.425 -11.474 3.863 998 HG LEU 127 HG LEU 127 -17.457 -9.375 1.968 999 HD11 LEU 127 HD11 LEU 127 -16.357 -12.140 1.525 1000 HD12 LEU 127 HD12 LEU 127 -15.498 -10.624 1.249 1001 HD13 LEU 127 HD13 LEU 127 -16.913 -11.024 0.275 1002 HD21 LEU 127 HD21 LEU 127 -19.396 -10.471 2.923 1003 HD22 LEU 127 HD22 LEU 127 -18.684 -12.053 2.601 1004 HD23 LEU 127 HD23 LEU 127 -19.146 -11.006 1.260 1005 H ARG 128 HN ARG 128 -20.033 -10.234 5.434 1006 HA ARG 128 HA ARG 128 -19.751 -13.055 6.194 1007 HB2 ARG 128 HB2 ARG 128 -21.386 -12.620 8.050 1008 HB3 ARG 128 HB1 ARG 128 -19.812 -11.872 8.273 1009 HG2 ARG 128 HG2 ARG 128 -21.223 -10.182 8.914 1010 HG3 ARG 128 HG1 ARG 128 -20.958 -9.785 7.217 1011 HD2 ARG 128 HD2 ARG 128 -23.063 -11.098 6.721 1012 HD3 ARG 128 HD1 ARG 128 -23.352 -11.119 8.458 1013 HE ARG 128 HE ARG 128 -22.956 -8.471 7.771 1014 HH11 ARG 128 HH11 ARG 128 -25.223 -11.042 7.070 1015 HH12 ARG 128 HH12 ARG 128 -26.521 -9.961 6.638 1016 HH21 ARG 128 HH21 ARG 128 -24.655 -7.034 7.225 1017 HH22 ARG 128 HH22 ARG 128 -26.210 -7.672 6.766 1018 H GLY 129 HN GLY 129 -20.775 -11.540 3.791 1019 HA2 GLY 129 HA2 GLY 129 -23.534 -12.583 3.824 1020 HA3 GLY 129 HA1 GLY 129 -23.174 -10.990 3.180 1021 H ALA 130 HN ALA 130 -22.714 -10.813 1.085 1022 HA ALA 130 HA ALA 130 -23.100 -13.181 -0.516 1023 HB1 ALA 130 HB1 ALA 130 -24.274 -11.096 -1.025 1024 HB2 ALA 130 HB2 ALA 130 -23.292 -11.639 -2.383 1025 HB3 ALA 130 HB3 ALA 130 -22.732 -10.310 -1.367 1026 H GLY 131 HN GLY 131 -20.692 -13.456 0.741 1027 HA2 GLY 131 HA2 GLY 131 -18.906 -13.814 -1.450 1028 HA3 GLY 131 HA1 GLY 131 -18.401 -12.467 -0.439 1029 H PHE 132 HN PHE 132 -18.519 -15.868 -0.773 1030 HA PHE 132 HA PHE 132 -16.915 -16.118 1.634 1031 HB2 PHE 132 HB2 PHE 132 -18.159 -18.240 2.233 1032 HB3 PHE 132 HB1 PHE 132 -19.032 -16.741 2.493 1033 HD1 PHE 132 HD1 PHE 132 -20.728 -16.035 0.690 1034 HD2 PHE 132 HD2 PHE 132 -19.118 -19.963 1.007 1035 HE1 PHE 132 HE1 PHE 132 -22.626 -16.914 -0.598 1036 HE2 PHE 132 HE2 PHE 132 -21.017 -20.846 -0.286 1037 HZ PHE 132 HZ PHE 132 -22.773 -19.319 -1.088 Start of MODEL 3 1 H1 LYS 2 HT1 LYS 2 27.231 -12.158 20.281 2 H2 LYS 2 HT2 LYS 2 26.186 -12.734 19.077 3 H3 LYS 2 HT3 LYS 2 27.818 -13.200 19.076 4 HA LYS 2 HA LYS 2 27.481 -14.337 21.205 5 HB2 LYS 2 HB2 LYS 2 25.493 -12.892 21.801 6 HB3 LYS 2 HB1 LYS 2 24.553 -13.805 20.634 7 HG2 LYS 2 HG2 LYS 2 24.984 -15.853 21.935 8 HG3 LYS 2 HG1 LYS 2 25.846 -14.882 23.128 9 HD2 LYS 2 HD2 LYS 2 22.960 -14.456 22.352 10 HD3 LYS 2 HD1 LYS 2 23.479 -15.413 23.737 11 HE2 LYS 2 HE2 LYS 2 22.928 -13.298 24.608 12 HE3 LYS 2 HE1 LYS 2 24.686 -13.329 24.543 13 HZ1 LYS 2 HZ1 LYS 2 23.063 -12.142 22.372 14 HZ2 LYS 2 HZ2 LYS 2 24.711 -11.900 22.704 15 HZ3 LYS 2 HZ3 LYS 2 23.530 -11.245 23.731 16 H VAL 3 HN VAL 3 26.708 -16.630 21.173 17 HA VAL 3 HA VAL 3 26.714 -17.708 18.524 18 HB VAL 3 HB VAL 3 26.368 -19.901 19.597 19 HG11 VAL 3 HG11 VAL 3 28.451 -19.934 20.922 20 HG12 VAL 3 HG12 VAL 3 28.454 -18.169 20.919 21 HG13 VAL 3 HG13 VAL 3 28.621 -19.053 19.403 22 HG21 VAL 3 HG21 VAL 3 26.286 -20.076 22.053 23 HG22 VAL 3 HG22 VAL 3 24.870 -19.252 21.399 24 HG23 VAL 3 HG23 VAL 3 26.157 -18.320 22.162 25 H GLN 4 HN GLN 4 24.278 -16.808 20.816 26 HA GLN 4 HA GLN 4 22.184 -18.055 19.201 27 HB2 GLN 4 HB2 GLN 4 21.972 -16.689 21.890 28 HB3 GLN 4 HB1 GLN 4 20.681 -17.548 21.060 29 HG2 GLN 4 HG2 GLN 4 22.022 -19.619 21.210 30 HG3 GLN 4 HG1 GLN 4 23.224 -18.732 22.146 31 HE21 GLN 4 HE21 GLN 4 20.057 -20.137 22.137 32 HE22 GLN 4 HE22 GLN 4 19.778 -20.023 23.843 33 H GLU 5 HN GLU 5 22.680 -16.441 17.503 34 HA GLU 5 HA GLU 5 21.635 -13.767 17.966 35 HB2 GLU 5 HB2 GLU 5 22.553 -15.098 15.405 36 HB3 GLU 5 HB1 GLU 5 22.154 -13.395 15.587 37 HG2 GLU 5 HG2 GLU 5 24.369 -14.784 17.075 38 HG3 GLU 5 HG1 GLU 5 24.585 -13.891 15.572 39 H GLN 6 HN GLN 6 19.804 -15.667 18.583 40 HA GLN 6 HA GLN 6 18.135 -16.316 16.315 41 HB2 GLN 6 HB2 GLN 6 17.691 -16.824 19.261 42 HB3 GLN 6 HB1 GLN 6 16.826 -17.581 17.930 43 HG2 GLN 6 HG2 GLN 6 18.764 -18.782 17.248 44 HG3 GLN 6 HG1 GLN 6 19.792 -17.859 18.341 45 HE21 GLN 6 HE21 GLN 6 16.639 -18.996 19.271 46 HE22 GLN 6 HE22 GLN 6 17.183 -20.204 20.384 47 H SER 7 HN SER 7 17.658 -14.582 19.395 48 HA SER 7 HA SER 7 15.222 -13.390 18.408 49 HB2 SER 7 HB2 SER 7 16.714 -12.924 20.999 50 HB3 SER 7 HB1 SER 7 15.071 -12.392 20.638 51 HG SER 7 HG SER 7 14.343 -14.367 20.919 52 H VAL 8 HN VAL 8 16.095 -12.226 16.628 53 HA VAL 8 HA VAL 8 17.688 -9.871 17.354 54 HB VAL 8 HB VAL 8 17.055 -10.993 14.616 55 HG11 VAL 8 HG11 VAL 8 18.815 -8.665 15.387 56 HG12 VAL 8 HG12 VAL 8 17.267 -8.560 14.550 57 HG13 VAL 8 HG13 VAL 8 18.643 -9.335 13.765 58 HG21 VAL 8 HG21 VAL 8 19.620 -10.959 16.204 59 HG22 VAL 8 HG22 VAL 8 19.454 -11.523 14.543 60 HG23 VAL 8 HG23 VAL 8 18.630 -12.375 15.849 61 H GLY 9 HN GLY 9 14.776 -10.776 15.501 62 HA2 GLY 9 HA2 GLY 9 13.131 -8.810 16.548 63 HA3 GLY 9 HA1 GLY 9 13.903 -8.102 15.136 64 H ALA 10 HN ALA 10 11.858 -7.918 14.177 65 HA ALA 10 HA ALA 10 10.275 -8.491 12.669 66 HB1 ALA 10 HB1 ALA 10 11.710 -11.139 12.471 67 HB2 ALA 10 HB2 ALA 10 12.037 -9.710 11.491 68 HB3 ALA 10 HB3 ALA 10 10.484 -10.535 11.357 69 HA PRO 11 HA PRO 11 7.988 -10.731 16.009 70 HB2 PRO 11 HB2 PRO 11 6.188 -8.791 16.523 71 HB3 PRO 11 HB1 PRO 11 7.795 -8.799 17.257 72 HG2 PRO 11 HG2 PRO 11 6.781 -7.221 14.930 73 HG3 PRO 11 HG1 PRO 11 7.840 -6.707 16.257 74 HD2 PRO 11 HD2 PRO 11 8.747 -7.393 13.765 75 HD3 PRO 11 HD1 PRO 11 9.716 -7.541 15.245 76 HA PRO 12 HA PRO 12 4.833 -11.680 12.967 77 HB2 PRO 12 HB2 PRO 12 4.269 -14.147 13.985 78 HB3 PRO 12 HB1 PRO 12 5.667 -13.808 12.963 79 HG2 PRO 12 HG2 PRO 12 5.586 -14.463 15.797 80 HG3 PRO 12 HG1 PRO 12 6.980 -14.392 14.710 81 HD2 PRO 12 HD2 PRO 12 6.043 -12.415 16.639 82 HD3 PRO 12 HD1 PRO 12 7.580 -12.475 15.754 83 HA PRO 13 HA PRO 13 1.501 -10.539 15.888 84 HB2 PRO 13 HB2 PRO 13 0.342 -8.968 13.776 85 HB3 PRO 13 HB1 PRO 13 1.137 -8.400 15.244 86 HG2 PRO 13 HG2 PRO 13 2.140 -8.063 12.701 87 HG3 PRO 13 HG1 PRO 13 3.119 -8.047 14.178 88 HD2 PRO 13 HD2 PRO 13 2.702 -10.252 12.199 89 HD3 PRO 13 HD1 PRO 13 4.179 -9.772 13.062 90 H GLY 14 HN GLY 14 1.036 -12.904 15.396 91 HA2 GLY 14 HA2 GLY 14 -0.837 -14.279 15.139 92 HA3 GLY 14 HA1 GLY 14 -1.600 -13.024 14.172 93 H ARG 15 HN ARG 15 0.119 -12.586 12.158 94 HA ARG 15 HA ARG 15 0.400 -15.233 10.899 95 HB2 ARG 15 HB2 ARG 15 -1.524 -14.064 9.975 96 HB3 ARG 15 HB1 ARG 15 -0.534 -12.656 9.624 97 HG2 ARG 15 HG2 ARG 15 0.739 -13.927 7.997 98 HG3 ARG 15 HG1 ARG 15 -0.192 -15.377 8.380 99 HD2 ARG 15 HD2 ARG 15 -2.223 -14.317 7.603 100 HD3 ARG 15 HD1 ARG 15 -1.357 -12.809 7.315 101 HE ARG 15 HE ARG 15 -0.127 -13.970 5.545 102 HH11 ARG 15 HH11 ARG 15 -3.018 -15.546 6.761 103 HH12 ARG 15 HH12 ARG 15 -3.372 -16.326 5.247 104 HH21 ARG 15 HH21 ARG 15 -0.595 -15.011 3.565 105 HH22 ARG 15 HH22 ARG 15 -2.013 -16.017 3.437 106 H ALA 16 HN ALA 16 1.256 -11.989 9.763 107 HA ALA 16 HA ALA 16 3.170 -11.083 8.978 108 HB1 ALA 16 HB1 ALA 16 4.517 -12.967 10.906 109 HB2 ALA 16 HB2 ALA 16 3.959 -11.333 11.268 110 HB3 ALA 16 HB3 ALA 16 5.270 -11.583 10.115 111 H ASP 17 HN ASP 17 3.114 -11.693 6.880 112 HA ASP 17 HA ASP 17 3.955 -14.299 6.008 113 HB2 ASP 17 HB2 ASP 17 3.470 -11.766 4.411 114 HB3 ASP 17 HB1 ASP 17 3.716 -13.368 3.728 115 H LYS 18 HN LYS 18 5.271 -11.031 5.985 116 HA LYS 18 HA LYS 18 7.371 -10.197 5.823 117 HB2 LYS 18 HB2 LYS 18 7.410 -11.883 7.848 118 HB3 LYS 18 HB1 LYS 18 8.512 -12.775 6.808 119 HG2 LYS 18 HG2 LYS 18 9.715 -11.327 8.351 120 HG3 LYS 18 HG1 LYS 18 9.978 -10.834 6.675 121 HD2 LYS 18 HD2 LYS 18 8.413 -9.029 6.896 122 HD3 LYS 18 HD1 LYS 18 7.927 -9.586 8.498 123 HE2 LYS 18 HE2 LYS 18 10.156 -9.106 9.353 124 HE3 LYS 18 HE1 LYS 18 10.672 -8.590 7.747 125 HZ1 LYS 18 HZ1 LYS 18 8.417 -7.310 9.182 126 HZ2 LYS 18 HZ2 LYS 18 9.258 -6.728 7.831 127 HZ3 LYS 18 HZ3 LYS 18 10.019 -6.774 9.345 128 H THR 19 HN THR 19 7.330 -10.149 3.545 129 HA THR 19 HA THR 19 8.258 -12.421 2.039 130 HB THR 19 HB THR 19 8.068 -10.709 0.109 131 HG1 THR 19 HG1 THR 19 7.958 -8.783 1.175 132 HG21 THR 19 HG21 THR 19 5.647 -11.492 1.734 133 HG22 THR 19 HG22 THR 19 6.437 -12.479 0.504 134 HG23 THR 19 HG23 THR 19 5.623 -10.982 0.047 135 H ALA 20 HN ALA 20 10.329 -12.109 3.509 136 HA ALA 20 HA ALA 20 12.273 -10.307 2.302 137 HB1 ALA 20 HB1 ALA 20 13.817 -11.155 3.972 138 HB2 ALA 20 HB2 ALA 20 12.663 -12.403 4.442 139 HB3 ALA 20 HB3 ALA 20 12.293 -10.704 4.735 140 H ALA 21 HN ALA 21 12.376 -11.053 0.225 141 HA ALA 21 HA ALA 21 13.253 -13.783 -0.282 142 HB1 ALA 21 HB1 ALA 21 12.619 -11.514 -2.174 143 HB2 ALA 21 HB2 ALA 21 11.539 -12.837 -1.739 144 HB3 ALA 21 HB3 ALA 21 13.009 -13.166 -2.654 145 HA PRO 22 HA PRO 22 17.595 -12.971 -0.878 146 HB2 PRO 22 HB2 PRO 22 17.305 -13.549 -3.787 147 HB3 PRO 22 HB1 PRO 22 18.444 -14.220 -2.614 148 HG2 PRO 22 HG2 PRO 22 16.369 -15.655 -3.445 149 HG3 PRO 22 HG1 PRO 22 16.882 -15.702 -1.747 150 HD2 PRO 22 HD2 PRO 22 14.556 -14.299 -2.988 151 HD3 PRO 22 HD1 PRO 22 14.680 -15.100 -1.408 152 H GLN 23 HN GLN 23 15.269 -11.399 -2.901 153 HA GLN 23 HA GLN 23 17.142 -9.548 -4.060 154 HB2 GLN 23 HB2 GLN 23 15.256 -8.572 -5.184 155 HB3 GLN 23 HB1 GLN 23 15.117 -10.323 -5.274 156 HG2 GLN 23 HG2 GLN 23 13.477 -10.308 -3.484 157 HG3 GLN 23 HG1 GLN 23 13.647 -8.561 -3.323 158 HE21 GLN 23 HE21 GLN 23 11.270 -10.115 -3.931 159 HE22 GLN 23 HE22 GLN 23 10.688 -9.549 -5.460 160 H THR 24 HN THR 24 15.417 -9.686 -1.082 161 HA THR 24 HA THR 24 15.271 -6.787 -0.841 162 HB THR 24 HB THR 24 14.282 -7.204 1.375 163 HG1 THR 24 HG1 THR 24 15.323 -9.133 1.944 164 HG21 THR 24 HG21 THR 24 12.231 -8.341 0.598 165 HG22 THR 24 HG22 THR 24 13.088 -8.842 -0.861 166 HG23 THR 24 HG23 THR 24 12.808 -7.129 -0.545 167 H ARG 25 HN ARG 25 17.881 -7.795 -1.187 168 HA ARG 25 HA ARG 25 19.052 -7.258 1.471 169 HB2 ARG 25 HB2 ARG 25 20.447 -8.695 -0.788 170 HB3 ARG 25 HB1 ARG 25 20.956 -8.574 0.889 171 HG2 ARG 25 HG2 ARG 25 18.560 -10.089 -0.116 172 HG3 ARG 25 HG1 ARG 25 20.104 -10.790 0.358 173 HD2 ARG 25 HD2 ARG 25 19.769 -9.925 2.640 174 HD3 ARG 25 HD1 ARG 25 18.199 -9.285 2.148 175 HE ARG 25 HE ARG 25 18.499 -12.091 1.617 176 HH11 ARG 25 HH11 ARG 25 17.649 -9.743 4.093 177 HH12 ARG 25 HH12 ARG 25 16.637 -10.856 4.962 178 HH21 ARG 25 HH21 ARG 25 17.140 -13.537 2.754 179 HH22 ARG 25 HH22 ARG 25 16.342 -12.999 4.209 180 H LEU 26 HN LEU 26 19.701 -6.947 -2.020 181 HA LEU 26 HA LEU 26 21.311 -4.556 -1.453 182 HB2 LEU 26 HB2 LEU 26 21.203 -6.427 -3.805 183 HB3 LEU 26 HB1 LEU 26 21.967 -4.855 -3.922 184 HG LEU 26 HG LEU 26 23.697 -6.416 -3.544 185 HD11 LEU 26 HD11 LEU 26 23.051 -5.097 -0.917 186 HD12 LEU 26 HD12 LEU 26 23.913 -4.364 -2.270 187 HD13 LEU 26 HD13 LEU 26 24.626 -5.724 -1.401 188 HD21 LEU 26 HD21 LEU 26 23.722 -7.986 -1.666 189 HD22 LEU 26 HD22 LEU 26 22.375 -8.292 -2.763 190 HD23 LEU 26 HD23 LEU 26 22.092 -7.478 -1.226 191 H THR 27 HN THR 27 18.343 -4.610 -1.500 192 HA THR 27 HA THR 27 17.943 -2.715 -3.711 193 HB THR 27 HB THR 27 15.444 -3.143 -3.152 194 HG1 THR 27 HG1 THR 27 16.169 -5.725 -2.442 195 HG21 THR 27 HG21 THR 27 15.408 -5.071 -4.686 196 HG22 THR 27 HG22 THR 27 17.150 -5.253 -4.484 197 HG23 THR 27 HG23 THR 27 16.499 -3.802 -5.248 198 HA PRO 28 HA PRO 28 17.787 0.004 -0.064 199 HB2 PRO 28 HB2 PRO 28 18.904 2.145 -1.244 200 HB3 PRO 28 HB1 PRO 28 19.878 0.785 -0.674 201 HG2 PRO 28 HG2 PRO 28 18.983 1.443 -3.447 202 HG3 PRO 28 HG1 PRO 28 20.551 0.831 -2.893 203 HD2 PRO 28 HD2 PRO 28 18.581 -0.735 -4.002 204 HD3 PRO 28 HD1 PRO 28 19.839 -1.337 -2.906 205 H TYR 29 HN TYR 29 15.420 -0.474 -1.108 206 HA TYR 29 HA TYR 29 14.378 2.155 -1.935 207 HB2 TYR 29 HB2 TYR 29 13.390 -0.537 -2.910 208 HB3 TYR 29 HB1 TYR 29 12.723 1.030 -3.352 209 HD1 TYR 29 HD1 TYR 29 14.028 2.559 -4.814 210 HD2 TYR 29 HD2 TYR 29 15.343 -1.396 -3.958 211 HE1 TYR 29 HE1 TYR 29 15.576 2.666 -6.721 212 HE2 TYR 29 HE2 TYR 29 16.897 -1.298 -5.858 213 HH TYR 29 HH TYR 29 17.233 -0.112 -7.903 214 H ALA 30 HN ALA 30 12.614 2.861 -0.887 215 HA ALA 30 HA ALA 30 10.816 2.981 0.476 216 HB1 ALA 30 HB1 ALA 30 10.658 0.016 -0.033 217 HB2 ALA 30 HB2 ALA 30 9.822 1.298 -0.915 218 HB3 ALA 30 HB3 ALA 30 9.410 0.970 0.767 219 H GLN 31 HN GLN 31 12.519 3.521 2.091 220 HA GLN 31 HA GLN 31 13.004 1.563 4.150 221 HB2 GLN 31 HB2 GLN 31 13.621 4.500 3.911 222 HB3 GLN 31 HB1 GLN 31 13.939 3.594 5.383 223 HG2 GLN 31 HG2 GLN 31 15.407 2.093 4.140 224 HG3 GLN 31 HG1 GLN 31 15.091 3.012 2.668 225 HE21 GLN 31 HE21 GLN 31 16.650 3.015 5.776 226 HE22 GLN 31 HE22 GLN 31 17.678 4.376 5.477 227 H ALA 32 HN ALA 32 10.382 1.592 3.856 228 HA ALA 32 HA ALA 32 9.397 2.972 6.267 229 HB1 ALA 32 HB1 ALA 32 7.835 2.446 3.730 230 HB2 ALA 32 HB2 ALA 32 8.428 4.018 4.269 231 HB3 ALA 32 HB3 ALA 32 7.198 3.169 5.208 232 H GLY 33 HN GLY 33 7.374 1.753 7.132 233 HA2 GLY 33 HA2 GLY 33 7.107 -0.988 6.464 234 HA3 GLY 33 HA1 GLY 33 8.203 -0.810 7.822 235 H GLU 34 HN GLU 34 6.985 -1.759 9.322 236 HA GLU 34 HA GLU 34 4.170 -1.356 9.527 237 HB2 GLU 34 HB2 GLU 34 6.117 -2.742 11.375 238 HB3 GLU 34 HB1 GLU 34 4.370 -2.801 11.532 239 HG2 GLU 34 HG2 GLU 34 5.054 -4.821 10.515 240 HG3 GLU 34 HG1 GLU 34 4.280 -3.852 9.267 241 H ASP 35 HN ASP 35 3.192 0.268 10.491 242 HA ASP 35 HA ASP 35 3.824 0.850 13.210 243 HB2 ASP 35 HB2 ASP 35 3.946 3.308 12.959 244 HB3 ASP 35 HB1 ASP 35 5.313 2.490 12.228 245 H ASN 36 HN ASN 36 2.056 2.710 10.756 246 HA ASN 36 HA ASN 36 -0.404 1.434 11.039 247 HB2 ASN 36 HB2 ASN 36 -1.724 2.975 12.351 248 HB3 ASN 36 HB1 ASN 36 -0.376 2.429 13.333 249 HD21 ASN 36 HD21 ASN 36 1.553 4.231 12.037 250 HD22 ASN 36 HD22 ASN 36 1.184 5.816 12.637 251 H TRP 37 HN TRP 37 1.206 2.334 8.994 252 HA TRP 37 HA TRP 37 0.575 4.917 8.077 253 HB2 TRP 37 HB2 TRP 37 1.489 4.104 5.866 254 HB3 TRP 37 HB1 TRP 37 2.575 3.994 7.236 255 HD1 TRP 37 HD1 TRP 37 2.149 1.244 8.437 256 HE1 TRP 37 HE1 TRP 37 2.534 -0.924 7.098 257 HE3 TRP 37 HE3 TRP 37 1.677 3.131 3.714 258 HZ2 TRP 37 HZ2 TRP 37 2.632 -1.715 4.388 259 HZ3 TRP 37 HZ3 TRP 37 1.944 1.607 1.803 260 HH2 TRP 37 HH2 TRP 37 2.413 -0.764 2.136 261 H ARG 38 HN ARG 38 -1.057 1.848 7.643 262 HA ARG 38 HA ARG 38 -2.749 2.743 5.535 263 HB2 ARG 38 HB2 ARG 38 -4.184 0.836 6.084 264 HB3 ARG 38 HB1 ARG 38 -2.499 0.360 5.922 265 HG2 ARG 38 HG2 ARG 38 -2.883 -0.767 7.823 266 HG3 ARG 38 HG1 ARG 38 -2.654 0.805 8.591 267 HD2 ARG 38 HD2 ARG 38 -4.657 -0.152 9.470 268 HD3 ARG 38 HD1 ARG 38 -5.120 1.169 8.401 269 HE ARG 38 HE ARG 38 -5.109 -1.228 6.928 270 HH11 ARG 38 HH11 ARG 38 -6.939 0.307 9.509 271 HH12 ARG 38 HH12 ARG 38 -8.405 -0.545 9.125 272 HH21 ARG 38 HH21 ARG 38 -7.034 -2.338 6.464 273 HH22 ARG 38 HH22 ARG 38 -8.457 -2.046 7.416 274 H SER 39 HN SER 39 -2.830 2.969 9.006 275 HA SER 39 HA SER 39 -5.508 3.899 9.220 276 HB2 SER 39 HB2 SER 39 -3.228 4.447 11.131 277 HB3 SER 39 HB1 SER 39 -4.955 4.386 11.500 278 HG SER 39 HG SER 39 -4.947 2.191 11.205 279 H ARG 40 HN ARG 40 -2.351 5.417 8.761 280 HA ARG 40 HA ARG 40 -3.172 8.089 8.912 281 HB2 ARG 40 HB2 ARG 40 -1.043 6.967 7.097 282 HB3 ARG 40 HB1 ARG 40 -1.155 8.567 7.761 283 HG2 ARG 40 HG2 ARG 40 -0.712 7.680 9.999 284 HG3 ARG 40 HG1 ARG 40 -0.533 6.070 9.289 285 HD2 ARG 40 HD2 ARG 40 1.231 7.053 7.787 286 HD3 ARG 40 HD1 ARG 40 1.145 8.516 8.761 287 HE ARG 40 HE ARG 40 1.773 5.974 10.082 288 HH11 ARG 40 HH11 ARG 40 2.760 9.157 9.021 289 HH12 ARG 40 HH12 ARG 40 4.252 9.128 9.905 290 HH21 ARG 40 HH21 ARG 40 3.751 5.910 11.202 291 HH22 ARG 40 HH22 ARG 40 4.818 7.294 11.157 292 H ILE 41 HN ILE 41 -2.901 5.783 6.246 293 HA ILE 41 HA ILE 41 -3.771 7.423 4.150 294 HB ILE 41 HB ILE 41 -4.003 4.429 4.556 295 HG12 ILE 41 HG12 ILE 41 -2.155 6.082 2.824 296 HG13 ILE 41 HG11 ILE 41 -1.723 5.359 4.371 297 HG21 ILE 41 HG21 ILE 41 -4.470 4.246 2.152 298 HG22 ILE 41 HG22 ILE 41 -4.586 6.003 2.052 299 HG23 ILE 41 HG23 ILE 41 -5.752 5.096 3.017 300 HD11 ILE 41 HD11 ILE 41 -0.890 4.052 2.491 301 HD12 ILE 41 HD12 ILE 41 -2.541 3.847 1.900 302 HD13 ILE 41 HD13 ILE 41 -2.063 3.141 3.444 303 H SER 42 HN SER 42 -5.564 5.423 6.463 304 HA SER 42 HA SER 42 -8.138 5.709 5.444 305 HB2 SER 42 HB2 SER 42 -7.313 5.658 8.359 306 HB3 SER 42 HB1 SER 42 -8.928 5.313 7.740 307 HG SER 42 HG SER 42 -6.631 3.860 6.924 308 H GLY 43 HN GLY 43 -6.185 7.988 7.289 309 HA2 GLY 43 HA2 GLY 43 -8.240 9.915 7.723 310 HA3 GLY 43 HA1 GLY 43 -6.510 10.227 7.743 311 H ARG 44 HN ARG 44 -5.854 9.482 5.148 312 HA ARG 44 HA ARG 44 -6.574 11.797 3.699 313 HB2 ARG 44 HB2 ARG 44 -4.869 9.417 3.300 314 HB3 ARG 44 HB1 ARG 44 -5.450 10.204 1.858 315 HG2 ARG 44 HG2 ARG 44 -3.292 11.064 2.418 316 HG3 ARG 44 HG1 ARG 44 -4.502 12.328 2.655 317 HD2 ARG 44 HD2 ARG 44 -4.533 11.792 5.064 318 HD3 ARG 44 HD1 ARG 44 -3.254 10.601 4.789 319 HE ARG 44 HE ARG 44 -2.218 12.878 3.739 320 HH11 ARG 44 HH11 ARG 44 -3.617 12.122 6.874 321 HH12 ARG 44 HH12 ARG 44 -2.673 13.312 7.715 322 HH21 ARG 44 HH21 ARG 44 -0.983 14.428 4.856 323 HH22 ARG 44 HH22 ARG 44 -1.188 14.621 6.567 324 H LEU 45 HN LEU 45 -7.659 8.481 3.732 325 HA LEU 45 HA LEU 45 -9.146 8.465 1.350 326 HB2 LEU 45 HB2 LEU 45 -8.500 6.666 3.284 327 HB3 LEU 45 HB1 LEU 45 -10.184 6.947 3.659 328 HG LEU 45 HG LEU 45 -9.284 6.194 0.899 329 HD11 LEU 45 HD11 LEU 45 -8.476 4.486 2.458 330 HD12 LEU 45 HD12 LEU 45 -9.787 3.875 1.449 331 HD13 LEU 45 HD13 LEU 45 -10.104 4.329 3.123 332 HD21 LEU 45 HD21 LEU 45 -11.912 5.907 2.342 333 HD22 LEU 45 HD22 LEU 45 -11.586 5.411 0.678 334 HD23 LEU 45 HD23 LEU 45 -11.529 7.121 1.120 335 H ASN 46 HN ASN 46 -9.782 9.658 4.539 336 HA ASN 46 HA ASN 46 -12.582 10.094 4.264 337 HB2 ASN 46 HB2 ASN 46 -11.518 9.890 6.484 338 HB3 ASN 46 HB1 ASN 46 -10.613 11.368 6.182 339 HD21 ASN 46 HD21 ASN 46 -14.001 10.815 5.343 340 HD22 ASN 46 HD22 ASN 46 -14.650 11.988 6.428 341 H ARG 47 HN ARG 47 -9.675 11.939 3.678 342 HA ARG 47 HA ARG 47 -10.692 14.430 3.087 343 HB2 ARG 47 HB2 ARG 47 -8.484 14.624 2.761 344 HB3 ARG 47 HB1 ARG 47 -8.303 12.902 2.509 345 HG2 ARG 47 HG2 ARG 47 -8.916 13.197 0.140 346 HG3 ARG 47 HG1 ARG 47 -9.013 14.943 0.408 347 HD2 ARG 47 HD2 ARG 47 -6.674 15.044 0.964 348 HD3 ARG 47 HD1 ARG 47 -6.546 13.286 0.927 349 HE ARG 47 HE ARG 47 -7.444 14.315 -1.567 350 HH11 ARG 47 HH11 ARG 47 -4.562 13.973 0.394 351 HH12 ARG 47 HH12 ARG 47 -3.493 13.888 -0.974 352 HH21 ARG 47 HH21 ARG 47 -6.015 14.212 -3.374 353 HH22 ARG 47 HH22 ARG 47 -4.316 14.024 -3.098 354 H PHE 48 HN PHE 48 -10.983 11.431 1.318 355 HA PHE 48 HA PHE 48 -12.330 12.864 -0.814 356 HB2 PHE 48 HB2 PHE 48 -11.315 10.046 -0.657 357 HB3 PHE 48 HB1 PHE 48 -12.361 10.600 -1.959 358 HD1 PHE 48 HD2 PHE 48 -11.566 12.518 -3.397 359 HD2 PHE 48 HD1 PHE 48 -9.007 10.401 -0.738 360 HE1 PHE 48 HE2 PHE 48 -9.608 13.323 -4.649 361 HE2 PHE 48 HE1 PHE 48 -7.042 11.200 -1.987 362 HZ PHE 48 HZ PHE 48 -7.344 12.663 -3.947 363 H LYS 49 HN LYS 49 -12.871 9.950 1.157 364 HA LYS 49 HA LYS 49 -15.527 10.630 1.849 365 HB2 LYS 49 HB2 LYS 49 -15.550 9.888 -0.717 366 HB3 LYS 49 HB1 LYS 49 -15.541 8.287 -0.007 367 HG2 LYS 49 HG2 LYS 49 -17.534 10.299 0.928 368 HG3 LYS 49 HG1 LYS 49 -17.792 9.448 -0.594 369 HD2 LYS 49 HD2 LYS 49 -17.148 7.927 1.908 370 HD3 LYS 49 HD1 LYS 49 -18.794 8.476 1.592 371 HE2 LYS 49 HE2 LYS 49 -17.175 6.825 -0.337 372 HE3 LYS 49 HE1 LYS 49 -18.296 6.141 0.836 373 HZ1 LYS 49 HZ1 LYS 49 -20.087 7.400 -0.206 374 HZ2 LYS 49 HZ2 LYS 49 -19.329 6.372 -1.326 375 HZ3 LYS 49 HZ3 LYS 49 -19.003 8.033 -1.348 376 H ARG 50 HN ARG 50 -15.599 9.715 3.817 377 HA ARG 50 HA ARG 50 -14.734 6.913 4.012 378 HB2 ARG 50 HB2 ARG 50 -12.973 8.461 4.952 379 HB3 ARG 50 HB1 ARG 50 -14.148 8.940 6.171 380 HG2 ARG 50 HG2 ARG 50 -14.283 6.613 6.935 381 HG3 ARG 50 HG1 ARG 50 -13.077 6.158 5.731 382 HD2 ARG 50 HD2 ARG 50 -11.981 6.419 7.846 383 HD3 ARG 50 HD1 ARG 50 -11.498 7.750 6.795 384 HE ARG 50 HE ARG 50 -13.734 8.293 8.566 385 HH11 ARG 50 HH11 ARG 50 -10.274 8.506 8.050 386 HH12 ARG 50 HH12 ARG 50 -10.039 9.739 9.250 387 HH21 ARG 50 HH21 ARG 50 -13.427 9.903 10.162 388 HH22 ARG 50 HH22 ARG 50 -11.832 10.537 10.450 389 H TYR 51 HN TYR 51 -16.617 5.972 4.234 390 HA TYR 51 HA TYR 51 -18.604 7.028 6.099 391 HB2 TYR 51 HB2 TYR 51 -18.855 5.981 3.586 392 HB3 TYR 51 HB1 TYR 51 -19.159 4.555 4.578 393 HD1 TYR 51 HD1 TYR 51 -20.137 8.167 4.534 394 HD2 TYR 51 HD2 TYR 51 -21.382 4.135 5.053 395 HE1 TYR 51 HE1 TYR 51 -22.446 8.932 4.860 396 HE2 TYR 51 HE2 TYR 51 -23.698 4.891 5.385 397 HH TYR 51 HH TYR 51 -24.712 8.082 4.672 398 HA PRO 52 HA PRO 52 -17.445 4.179 9.337 399 HB2 PRO 52 HB2 PRO 52 -20.384 3.818 9.662 400 HB3 PRO 52 HB1 PRO 52 -19.164 4.241 10.867 401 HG2 PRO 52 HG2 PRO 52 -20.821 6.089 9.917 402 HG3 PRO 52 HG1 PRO 52 -19.119 6.471 10.230 403 HD2 PRO 52 HD2 PRO 52 -20.506 5.973 7.633 404 HD3 PRO 52 HD1 PRO 52 -19.200 7.113 8.016 405 H LYS 53 HN LYS 53 -16.996 2.044 9.368 406 HA LYS 53 HA LYS 53 -17.532 0.567 7.025 407 HB2 LYS 53 HB2 LYS 53 -16.365 -0.323 9.663 408 HB3 LYS 53 HB1 LYS 53 -16.420 -1.327 8.226 409 HG2 LYS 53 HG2 LYS 53 -14.932 1.273 8.530 410 HG3 LYS 53 HG1 LYS 53 -14.229 -0.344 8.502 411 HD2 LYS 53 HD2 LYS 53 -13.877 0.308 6.326 412 HD3 LYS 53 HD1 LYS 53 -15.447 -0.483 6.172 413 HE2 LYS 53 HE2 LYS 53 -15.506 1.617 4.979 414 HE3 LYS 53 HE1 LYS 53 -16.535 1.728 6.412 415 HZ1 LYS 53 HZ1 LYS 53 -13.835 2.882 6.037 416 HZ2 LYS 53 HZ2 LYS 53 -14.582 2.782 7.551 417 HZ3 LYS 53 HZ3 LYS 53 -15.290 3.705 6.317 418 H ASP 54 HN ASP 54 -19.231 0.703 10.049 419 HA ASP 54 HA ASP 54 -20.544 -1.789 9.862 420 HB2 ASP 54 HB2 ASP 54 -21.238 0.767 11.287 421 HB3 ASP 54 HB1 ASP 54 -22.306 -0.635 11.329 422 H ALA 55 HN ALA 55 -21.211 1.353 8.461 423 HA ALA 55 HA ALA 55 -23.766 0.687 7.409 424 HB1 ALA 55 HB1 ALA 55 -23.487 2.650 5.998 425 HB2 ALA 55 HB2 ALA 55 -21.782 2.732 6.439 426 HB3 ALA 55 HB3 ALA 55 -23.023 3.005 7.663 427 H LEU 56 HN LEU 56 -20.481 0.249 6.345 428 HA LEU 56 HA LEU 56 -21.137 -0.655 3.713 429 HB2 LEU 56 HB2 LEU 56 -18.644 -0.890 5.404 430 HB3 LEU 56 HB1 LEU 56 -18.765 -1.607 3.811 431 HG LEU 56 HG LEU 56 -17.587 0.453 3.600 432 HD11 LEU 56 HD11 LEU 56 -20.408 0.923 2.678 433 HD12 LEU 56 HD12 LEU 56 -19.217 -0.071 1.839 434 HD13 LEU 56 HD13 LEU 56 -18.943 1.662 2.026 435 HD21 LEU 56 HD21 LEU 56 -18.553 2.611 4.264 436 HD22 LEU 56 HD22 LEU 56 -18.271 1.550 5.645 437 HD23 LEU 56 HD23 LEU 56 -19.905 1.761 5.012 438 H ARG 57 HN ARG 57 -20.429 -2.198 6.817 439 HA ARG 57 HA ARG 57 -20.595 -4.864 6.080 440 HB2 ARG 57 HB2 ARG 57 -21.532 -3.514 8.616 441 HB3 ARG 57 HB1 ARG 57 -21.412 -5.256 8.421 442 HG2 ARG 57 HG2 ARG 57 -19.014 -5.047 8.047 443 HG3 ARG 57 HG1 ARG 57 -19.131 -3.300 8.238 444 HD2 ARG 57 HD2 ARG 57 -19.771 -3.501 10.516 445 HD3 ARG 57 HD1 ARG 57 -20.009 -5.241 10.364 446 HE ARG 57 HE ARG 57 -17.451 -5.123 9.818 447 HH11 ARG 57 HH11 ARG 57 -19.181 -3.275 12.253 448 HH12 ARG 57 HH12 ARG 57 -17.834 -3.247 13.351 449 HH21 ARG 57 HH21 ARG 57 -15.706 -5.086 11.248 450 HH22 ARG 57 HH22 ARG 57 -15.844 -4.264 12.779 451 H LEU 58 HN LEU 58 -23.125 -2.494 6.456 452 HA LEU 58 HA LEU 58 -25.192 -4.545 6.168 453 HB2 LEU 58 HB2 LEU 58 -25.518 -1.584 6.657 454 HB3 LEU 58 HB1 LEU 58 -26.767 -2.809 6.772 455 HG LEU 58 HG LEU 58 -24.370 -2.573 8.594 456 HD11 LEU 58 HD11 LEU 58 -25.974 -0.785 8.950 457 HD12 LEU 58 HD12 LEU 58 -26.006 -1.930 10.291 458 HD13 LEU 58 HD13 LEU 58 -27.283 -1.962 9.074 459 HD21 LEU 58 HD21 LEU 58 -25.086 -4.887 8.284 460 HD22 LEU 58 HD22 LEU 58 -26.736 -4.438 8.713 461 HD23 LEU 58 HD23 LEU 58 -25.449 -4.316 9.913 462 H LYS 59 HN LYS 59 -23.297 -3.295 4.026 463 HA LYS 59 HA LYS 59 -25.395 -2.977 2.028 464 HB2 LYS 59 HB2 LYS 59 -24.962 -0.699 2.824 465 HB3 LYS 59 HB1 LYS 59 -23.254 -0.880 2.464 466 HG2 LYS 59 HG2 LYS 59 -23.746 -1.063 0.101 467 HG3 LYS 59 HG1 LYS 59 -25.474 -0.987 0.441 468 HD2 LYS 59 HD2 LYS 59 -23.451 1.186 0.981 469 HD3 LYS 59 HD1 LYS 59 -24.663 1.183 -0.301 470 HE2 LYS 59 HE2 LYS 59 -25.249 1.146 2.659 471 HE3 LYS 59 HE1 LYS 59 -25.326 2.570 1.624 472 HZ1 LYS 59 HZ1 LYS 59 -27.505 1.481 2.052 473 HZ2 LYS 59 HZ2 LYS 59 -26.968 0.130 1.186 474 HZ3 LYS 59 HZ3 LYS 59 -27.120 1.632 0.407 475 H ARG 60 HN ARG 60 -21.889 -2.281 2.015 476 HA ARG 60 HA ARG 60 -21.553 -4.554 0.193 477 HB2 ARG 60 HB2 ARG 60 -20.349 -1.797 -0.109 478 HB3 ARG 60 HB1 ARG 60 -19.815 -3.205 -1.019 479 HG2 ARG 60 HG2 ARG 60 -22.543 -1.930 -1.102 480 HG3 ARG 60 HG1 ARG 60 -21.318 -1.914 -2.374 481 HD2 ARG 60 HD2 ARG 60 -21.479 -4.345 -2.556 482 HD3 ARG 60 HD1 ARG 60 -22.701 -4.360 -1.287 483 HE ARG 60 HE ARG 60 -23.137 -2.956 -3.849 484 HH11 ARG 60 HH11 ARG 60 -24.210 -5.096 -1.301 485 HH12 ARG 60 HH12 ARG 60 -25.705 -5.511 -2.086 486 HH21 ARG 60 HH21 ARG 60 -25.091 -3.479 -4.896 487 HH22 ARG 60 HH22 ARG 60 -26.216 -4.573 -4.145 488 H GLN 61 HN GLN 61 -20.889 -5.727 2.000 489 HA GLN 61 HA GLN 61 -18.410 -4.917 3.292 490 HB2 GLN 61 HB2 GLN 61 -18.813 -6.938 4.706 491 HB3 GLN 61 HB1 GLN 61 -20.101 -5.749 4.774 492 HG2 GLN 61 HG2 GLN 61 -21.379 -7.108 3.143 493 HG3 GLN 61 HG1 GLN 61 -20.115 -8.332 3.235 494 HE21 GLN 61 HE21 GLN 61 -22.905 -8.596 3.891 495 HE22 GLN 61 HE22 GLN 61 -22.991 -9.046 5.559 496 H GLY 62 HN GLY 62 -16.546 -5.468 2.341 497 HA2 GLY 62 HA2 GLY 62 -16.224 -8.170 1.333 498 HA3 GLY 62 HA1 GLY 62 -16.094 -6.897 0.133 499 H VAL 63 HN VAL 63 -14.271 -8.914 1.737 500 HA VAL 63 HA VAL 63 -12.133 -6.998 2.326 501 HB VAL 63 HB VAL 63 -12.610 -8.542 4.150 502 HG11 VAL 63 HG11 VAL 63 -13.541 -10.402 2.907 503 HG12 VAL 63 HG12 VAL 63 -12.207 -10.954 3.921 504 HG13 VAL 63 HG13 VAL 63 -11.965 -10.738 2.188 505 HG21 VAL 63 HG21 VAL 63 -10.309 -7.808 3.865 506 HG22 VAL 63 HG22 VAL 63 -9.995 -9.173 2.793 507 HG23 VAL 63 HG23 VAL 63 -10.365 -9.456 4.493 508 H GLY 64 HN GLY 64 -10.319 -6.930 1.130 509 HA2 GLY 64 HA2 GLY 64 -9.602 -9.017 -0.707 510 HA3 GLY 64 HA1 GLY 64 -10.325 -7.625 -1.498 511 H GLN 65 HN GLN 65 -7.790 -8.317 -2.148 512 HA GLN 65 HA GLN 65 -6.055 -6.490 -0.655 513 HB2 GLN 65 HB2 GLN 65 -5.425 -8.573 -2.763 514 HB3 GLN 65 HB1 GLN 65 -4.227 -7.517 -2.028 515 HG2 GLN 65 HG2 GLN 65 -4.726 -8.494 0.169 516 HG3 GLN 65 HG1 GLN 65 -5.890 -9.577 -0.591 517 HE21 GLN 65 HE21 GLN 65 -2.534 -8.860 -0.109 518 HE22 GLN 65 HE22 GLN 65 -1.907 -10.336 -0.761 519 H VAL 66 HN VAL 66 -5.212 -4.682 -1.594 520 HA VAL 66 HA VAL 66 -6.094 -4.094 -4.336 521 HB VAL 66 HB VAL 66 -6.389 -2.419 -1.848 522 HG11 VAL 66 HG11 VAL 66 -5.415 -0.991 -3.610 523 HG12 VAL 66 HG12 VAL 66 -7.059 -0.535 -3.154 524 HG13 VAL 66 HG13 VAL 66 -6.771 -1.417 -4.660 525 HG21 VAL 66 HG21 VAL 66 -8.710 -2.265 -2.585 526 HG22 VAL 66 HG22 VAL 66 -8.202 -3.944 -2.391 527 HG23 VAL 66 HG23 VAL 66 -8.325 -3.241 -4.005 528 H ARG 67 HN ARG 67 -4.380 -3.799 -5.566 529 HA ARG 67 HA ARG 67 -1.882 -2.813 -4.365 530 HB2 ARG 67 HB2 ARG 67 -1.864 -5.046 -5.559 531 HB3 ARG 67 HB1 ARG 67 -2.269 -4.187 -7.040 532 HG2 ARG 67 HG2 ARG 67 -0.175 -2.836 -6.705 533 HG3 ARG 67 HG1 ARG 67 0.244 -3.958 -5.410 534 HD2 ARG 67 HD2 ARG 67 1.356 -4.690 -7.387 535 HD3 ARG 67 HD1 ARG 67 0.037 -5.818 -7.066 536 HE ARG 67 HE ARG 67 -1.070 -4.021 -8.772 537 HH11 ARG 67 HH11 ARG 67 1.854 -5.945 -8.891 538 HH12 ARG 67 HH12 ARG 67 1.843 -6.076 -10.618 539 HH21 ARG 67 HH21 ARG 67 -1.077 -4.182 -11.051 540 HH22 ARG 67 HH22 ARG 67 0.187 -5.067 -11.849 541 H PHE 68 HN PHE 68 -1.192 -0.793 -4.921 542 HA PHE 68 HA PHE 68 -2.242 0.396 -7.351 543 HB2 PHE 68 HB2 PHE 68 -2.806 2.500 -5.929 544 HB3 PHE 68 HB1 PHE 68 -3.961 1.182 -6.038 545 HD1 PHE 68 HD1 PHE 68 -0.917 1.551 -3.896 546 HD2 PHE 68 HD2 PHE 68 -5.153 1.217 -4.101 547 HE1 PHE 68 HE1 PHE 68 -1.028 1.437 -1.439 548 HE2 PHE 68 HE2 PHE 68 -5.273 1.102 -1.651 549 HZ PHE 68 HZ PHE 68 -3.213 1.211 -0.316 550 H THR 69 HN THR 69 -1.264 2.295 -8.006 551 HA THR 69 HA THR 69 1.406 2.834 -6.865 552 HB THR 69 HB THR 69 0.343 3.650 -9.585 553 HG1 THR 69 HG1 THR 69 1.277 1.240 -8.666 554 HG21 THR 69 HG21 THR 69 3.134 3.517 -8.439 555 HG22 THR 69 HG22 THR 69 2.212 4.985 -8.762 556 HG23 THR 69 HG23 THR 69 2.725 3.955 -10.098 557 H LEU 70 HN LEU 70 1.693 4.701 -5.857 558 HA LEU 70 HA LEU 70 -0.575 6.575 -5.897 559 HB2 LEU 70 HB2 LEU 70 1.235 5.881 -3.595 560 HB3 LEU 70 HB1 LEU 70 -0.163 6.943 -3.539 561 HG LEU 70 HG LEU 70 -0.325 4.013 -4.250 562 HD11 LEU 70 HD11 LEU 70 -1.012 5.280 -1.606 563 HD12 LEU 70 HD12 LEU 70 0.515 4.454 -1.926 564 HD13 LEU 70 HD13 LEU 70 -1.008 3.562 -2.017 565 HD21 LEU 70 HD21 LEU 70 -2.412 6.067 -3.523 566 HD22 LEU 70 HD22 LEU 70 -2.717 4.349 -3.766 567 HD23 LEU 70 HD23 LEU 70 -2.158 5.344 -5.112 568 H ASP 71 HN ASP 71 -0.207 8.731 -5.680 569 HA ASP 71 HA ASP 71 2.341 9.650 -6.705 570 HB2 ASP 71 HB2 ASP 71 0.314 10.491 -7.765 571 HB3 ASP 71 HB1 ASP 71 -0.288 11.072 -6.215 572 H ARG 72 HN ARG 72 3.376 11.532 -5.825 573 HA ARG 72 HA ARG 72 4.123 11.519 -3.189 574 HB2 ARG 72 HB2 ARG 72 5.374 12.771 -4.775 575 HB3 ARG 72 HB1 ARG 72 3.991 13.766 -5.199 576 HG2 ARG 72 HG2 ARG 72 5.361 15.155 -3.930 577 HG3 ARG 72 HG1 ARG 72 4.111 14.632 -2.799 578 HD2 ARG 72 HD2 ARG 72 5.597 12.981 -1.863 579 HD3 ARG 72 HD1 ARG 72 6.831 13.363 -3.062 580 HE ARG 72 HE ARG 72 5.920 15.451 -1.204 581 HH11 ARG 72 HH11 ARG 72 8.439 13.320 -2.368 582 HH12 ARG 72 HH12 ARG 72 9.719 14.138 -1.526 583 HH21 ARG 72 HH21 ARG 72 7.588 16.530 -0.082 584 HH22 ARG 72 HH22 ARG 72 9.224 15.958 -0.193 585 H GLN 73 HN GLN 73 1.405 13.243 -4.656 586 HA GLN 73 HA GLN 73 0.744 14.567 -2.146 587 HB2 GLN 73 HB2 GLN 73 -0.751 14.612 -4.768 588 HB3 GLN 73 HB1 GLN 73 -0.930 15.738 -3.427 589 HG2 GLN 73 HG2 GLN 73 1.132 16.746 -3.849 590 HG3 GLN 73 HG1 GLN 73 1.677 15.412 -4.865 591 HE21 GLN 73 HE21 GLN 73 0.806 15.178 -6.943 592 HE22 GLN 73 HE22 GLN 73 0.108 16.534 -7.771 593 H GLY 74 HN GLY 74 0.379 11.549 -3.062 594 HA2 GLY 74 HA2 GLY 74 -1.008 9.878 -2.289 595 HA3 GLY 74 HA1 GLY 74 -1.948 11.102 -1.456 596 H HIS 75 HN HIS 75 -1.220 10.928 -4.889 597 HA HIS 75 HA HIS 75 -4.103 10.824 -5.406 598 HB2 HIS 75 HB2 HIS 75 -2.805 12.726 -6.358 599 HB3 HIS 75 HB1 HIS 75 -1.858 11.573 -7.290 600 HD1 HIS 75 HD1 HIS 75 -5.206 13.221 -7.149 601 HD2 HIS 75 HD2 HIS 75 -3.162 10.489 -9.526 602 HE1 HIS 75 HE1 HIS 75 -6.582 12.981 -9.246 603 HE2 HIS 75 HE2 HIS 75 -5.221 11.475 -10.744 604 H VAL 76 HN VAL 76 -4.934 8.974 -6.013 605 HA VAL 76 HA VAL 76 -3.628 6.626 -6.599 606 HB VAL 76 HB VAL 76 -5.985 6.660 -6.057 607 HG11 VAL 76 HG11 VAL 76 -6.409 7.968 -8.738 608 HG12 VAL 76 HG12 VAL 76 -6.637 8.721 -7.159 609 HG13 VAL 76 HG13 VAL 76 -7.683 7.393 -7.663 610 HG21 VAL 76 HG21 VAL 76 -6.844 5.112 -7.774 611 HG22 VAL 76 HG22 VAL 76 -5.200 4.722 -7.268 612 HG23 VAL 76 HG23 VAL 76 -5.479 5.536 -8.808 613 H LEU 77 HN LEU 77 -2.325 6.079 -8.202 614 HA LEU 77 HA LEU 77 -2.609 7.438 -10.790 615 HB2 LEU 77 HB2 LEU 77 -0.270 5.845 -9.747 616 HB3 LEU 77 HB1 LEU 77 -0.306 6.819 -11.204 617 HG LEU 77 HG LEU 77 -0.662 7.982 -8.448 618 HD11 LEU 77 HD11 LEU 77 1.861 7.814 -10.086 619 HD12 LEU 77 HD12 LEU 77 1.517 6.868 -8.637 620 HD13 LEU 77 HD13 LEU 77 1.668 8.625 -8.529 621 HD21 LEU 77 HD21 LEU 77 -1.526 9.313 -10.325 622 HD22 LEU 77 HD22 LEU 77 0.058 9.238 -11.097 623 HD23 LEU 77 HD23 LEU 77 -0.135 10.081 -9.560 624 H ALA 78 HN ALA 78 -1.856 4.263 -9.409 625 HA ALA 78 HA ALA 78 -3.215 2.995 -11.693 626 HB1 ALA 78 HB1 ALA 78 -0.768 2.809 -11.978 627 HB2 ALA 78 HB2 ALA 78 -1.539 1.240 -11.736 628 HB3 ALA 78 HB3 ALA 78 -0.666 2.009 -10.407 629 H VAL 79 HN VAL 79 -4.274 1.037 -11.197 630 HA VAL 79 HA VAL 79 -4.256 0.134 -8.441 631 HB VAL 79 HB VAL 79 -6.838 0.028 -8.542 632 HG11 VAL 79 HG11 VAL 79 -5.611 1.390 -6.945 633 HG12 VAL 79 HG12 VAL 79 -7.027 2.260 -7.538 634 HG13 VAL 79 HG13 VAL 79 -5.424 2.663 -8.151 635 HG21 VAL 79 HG21 VAL 79 -7.887 1.862 -9.794 636 HG22 VAL 79 HG22 VAL 79 -7.101 0.704 -10.867 637 HG23 VAL 79 HG23 VAL 79 -6.328 2.250 -10.519 638 H THR 80 HN THR 80 -4.171 -1.952 -8.394 639 HA THR 80 HA THR 80 -5.395 -3.525 -10.563 640 HB THR 80 HB THR 80 -2.853 -4.162 -9.043 641 HG1 THR 80 HG1 THR 80 -3.385 -3.087 -11.597 642 HG21 THR 80 HG21 THR 80 -2.645 -6.054 -10.600 643 HG22 THR 80 HG22 THR 80 -4.216 -5.653 -11.291 644 HG23 THR 80 HG23 THR 80 -4.102 -6.185 -9.613 645 H LEU 81 HN LEU 81 -6.953 -4.852 -9.831 646 HA LEU 81 HA LEU 81 -7.322 -5.129 -6.986 647 HB2 LEU 81 HB2 LEU 81 -9.234 -4.904 -8.576 648 HB3 LEU 81 HB1 LEU 81 -8.849 -6.500 -9.194 649 HG LEU 81 HG LEU 81 -9.151 -7.348 -6.811 650 HD11 LEU 81 HD11 LEU 81 -8.993 -5.208 -5.676 651 HD12 LEU 81 HD12 LEU 81 -10.550 -5.971 -5.351 652 HD13 LEU 81 HD13 LEU 81 -10.443 -4.643 -6.506 653 HD21 LEU 81 HD21 LEU 81 -10.794 -7.762 -8.561 654 HD22 LEU 81 HD22 LEU 81 -11.525 -6.183 -8.273 655 HD23 LEU 81 HD23 LEU 81 -11.603 -7.429 -7.027 656 H VAL 82 HN VAL 82 -6.002 -6.402 -5.973 657 HA VAL 82 HA VAL 82 -5.019 -8.869 -7.145 658 HB VAL 82 HB VAL 82 -4.320 -8.641 -4.381 659 HG11 VAL 82 HG11 VAL 82 -2.959 -9.705 -6.122 660 HG12 VAL 82 HG12 VAL 82 -2.047 -8.453 -5.274 661 HG13 VAL 82 HG13 VAL 82 -2.699 -8.130 -6.879 662 HG21 VAL 82 HG21 VAL 82 -4.933 -6.289 -4.547 663 HG22 VAL 82 HG22 VAL 82 -3.888 -6.102 -5.957 664 HG23 VAL 82 HG23 VAL 82 -3.186 -6.467 -4.378 665 H SER 83 HN SER 83 -6.954 -7.800 -4.386 666 HA SER 83 HA SER 83 -8.880 -8.609 -3.527 667 HB2 SER 83 HB2 SER 83 -9.395 -8.999 -5.917 668 HB3 SER 83 HB1 SER 83 -8.796 -10.648 -5.752 669 HG SER 83 HG SER 83 -11.015 -10.667 -5.475 670 H SER 84 HN SER 84 -9.930 -10.951 -2.937 671 HA SER 84 HA SER 84 -7.929 -12.746 -1.879 672 HB2 SER 84 HB2 SER 84 -9.655 -11.120 0.003 673 HB3 SER 84 HB1 SER 84 -8.552 -12.414 0.473 674 HG SER 84 HG SER 84 -7.049 -10.858 -0.892 675 H ALA 85 HN ALA 85 -11.348 -11.753 -1.423 676 HA ALA 85 HA ALA 85 -12.039 -14.608 -1.357 677 HB1 ALA 85 HB1 ALA 85 -14.072 -13.955 -0.178 678 HB2 ALA 85 HB2 ALA 85 -13.604 -12.258 -0.303 679 HB3 ALA 85 HB3 ALA 85 -12.629 -13.374 0.653 680 H GLY 86 HN GLY 86 -14.012 -11.751 -2.172 681 HA2 GLY 86 HA2 GLY 86 -14.324 -12.216 -4.895 682 HA3 GLY 86 HA1 GLY 86 -15.522 -13.203 -4.066 683 H LEU 87 HN LEU 87 -14.649 -10.040 -5.071 684 HA LEU 87 HA LEU 87 -17.046 -8.955 -3.740 685 HB2 LEU 87 HB2 LEU 87 -14.714 -7.302 -4.661 686 HB3 LEU 87 HB1 LEU 87 -16.033 -6.801 -3.644 687 HG LEU 87 HG LEU 87 -14.240 -6.927 -2.187 688 HD11 LEU 87 HD11 LEU 87 -15.578 -9.608 -1.992 689 HD12 LEU 87 HD12 LEU 87 -16.136 -8.095 -1.274 690 HD13 LEU 87 HD13 LEU 87 -14.630 -8.833 -0.723 691 HD21 LEU 87 HD21 LEU 87 -12.653 -7.987 -3.708 692 HD22 LEU 87 HD22 LEU 87 -13.414 -9.550 -3.415 693 HD23 LEU 87 HD23 LEU 87 -12.593 -8.709 -2.101 694 HA PRO 88 HA PRO 88 -17.904 -8.484 -8.228 695 HB2 PRO 88 HB2 PRO 88 -20.615 -9.263 -7.699 696 HB3 PRO 88 HB1 PRO 88 -19.382 -10.150 -8.594 697 HG2 PRO 88 HG2 PRO 88 -20.432 -10.942 -6.167 698 HG3 PRO 88 HG1 PRO 88 -18.864 -11.464 -6.805 699 HD2 PRO 88 HD2 PRO 88 -19.479 -9.362 -4.768 700 HD3 PRO 88 HD1 PRO 88 -18.129 -10.514 -4.830 701 H SER 89 HN SER 89 -20.952 -8.065 -6.535 702 HA SER 89 HA SER 89 -21.395 -5.456 -7.500 703 HB2 SER 89 HB2 SER 89 -22.697 -6.673 -5.058 704 HB3 SER 89 HB1 SER 89 -23.379 -5.482 -6.168 705 HG SER 89 HG SER 89 -24.247 -7.298 -6.917 706 H LEU 90 HN LEU 90 -19.544 -6.642 -4.936 707 HA LEU 90 HA LEU 90 -19.804 -4.459 -3.118 708 HB2 LEU 90 HB2 LEU 90 -17.601 -6.519 -3.305 709 HB3 LEU 90 HB1 LEU 90 -17.976 -5.510 -1.921 710 HG LEU 90 HG LEU 90 -19.928 -7.529 -3.021 711 HD11 LEU 90 HD11 LEU 90 -18.051 -7.921 -0.708 712 HD12 LEU 90 HD12 LEU 90 -17.734 -8.537 -2.333 713 HD13 LEU 90 HD13 LEU 90 -19.149 -9.100 -1.430 714 HD21 LEU 90 HD21 LEU 90 -20.827 -5.731 -1.608 715 HD22 LEU 90 HD22 LEU 90 -19.693 -6.188 -0.337 716 HD23 LEU 90 HD23 LEU 90 -20.950 -7.315 -0.842 717 H ASP 91 HN ASP 91 -17.659 -5.266 -5.769 718 HA ASP 91 HA ASP 91 -15.426 -3.750 -5.135 719 HB2 ASP 91 HB2 ASP 91 -15.290 -5.307 -6.933 720 HB3 ASP 91 HB1 ASP 91 -16.611 -4.532 -7.798 721 H ARG 92 HN ARG 92 -18.232 -2.784 -7.077 722 HA ARG 92 HA ARG 92 -17.283 -0.338 -7.939 723 HB2 ARG 92 HB2 ARG 92 -19.688 0.257 -8.239 724 HB3 ARG 92 HB1 ARG 92 -19.233 -1.303 -8.918 725 HG2 ARG 92 HG2 ARG 92 -20.035 -2.204 -6.600 726 HG3 ARG 92 HG1 ARG 92 -20.933 -0.684 -6.556 727 HD2 ARG 92 HD2 ARG 92 -22.290 -2.469 -7.498 728 HD3 ARG 92 HD1 ARG 92 -21.947 -1.225 -8.698 729 HE ARG 92 HE ARG 92 -19.982 -3.193 -8.931 730 HH11 ARG 92 HH11 ARG 92 -23.428 -2.813 -9.497 731 HH12 ARG 92 HH12 ARG 92 -23.485 -4.093 -10.678 732 HH21 ARG 92 HH21 ARG 92 -20.068 -4.848 -10.500 733 HH22 ARG 92 HH22 ARG 92 -21.593 -5.219 -11.260 734 H GLU 93 HN GLU 93 -19.039 -1.057 -4.933 735 HA GLU 93 HA GLU 93 -19.238 1.717 -4.222 736 HB2 GLU 93 HB2 GLU 93 -20.885 -0.073 -3.565 737 HB3 GLU 93 HB1 GLU 93 -19.679 -0.678 -2.436 738 HG2 GLU 93 HG2 GLU 93 -21.267 0.714 -1.281 739 HG3 GLU 93 HG1 GLU 93 -19.684 1.496 -1.295 740 H ILE 94 HN ILE 94 -17.377 -1.048 -2.937 741 HA ILE 94 HA ILE 94 -16.142 0.580 -0.937 742 HB ILE 94 HB ILE 94 -14.811 -1.371 -0.345 743 HG12 ILE 94 HG12 ILE 94 -16.108 -2.731 -2.721 744 HG13 ILE 94 HG11 ILE 94 -14.422 -2.230 -2.643 745 HG21 ILE 94 HG21 ILE 94 -16.643 -2.864 0.269 746 HG22 ILE 94 HG22 ILE 94 -17.699 -2.042 -0.879 747 HG23 ILE 94 HG23 ILE 94 -17.071 -1.173 0.522 748 HD11 ILE 94 HD11 ILE 94 -14.037 -3.785 -0.810 749 HD12 ILE 94 HD12 ILE 94 -14.673 -4.616 -2.231 750 HD13 ILE 94 HD13 ILE 94 -15.731 -4.275 -0.862 751 H GLN 95 HN GLN 95 -15.200 -0.545 -4.135 752 HA GLN 95 HA GLN 95 -12.499 0.357 -3.782 753 HB2 GLN 95 HB2 GLN 95 -13.933 -0.483 -6.282 754 HB3 GLN 95 HB1 GLN 95 -12.227 -0.241 -6.103 755 HG2 GLN 95 HG2 GLN 95 -13.782 -2.293 -4.570 756 HG3 GLN 95 HG1 GLN 95 -12.929 -2.624 -6.077 757 HE21 GLN 95 HE21 GLN 95 -12.551 -3.801 -3.489 758 HE22 GLN 95 HE22 GLN 95 -10.919 -3.482 -3.026 759 H ALA 96 HN ALA 96 -15.497 1.640 -5.085 760 HA ALA 96 HA ALA 96 -14.474 3.956 -6.263 761 HB1 ALA 96 HB1 ALA 96 -16.882 3.474 -6.235 762 HB2 ALA 96 HB2 ALA 96 -16.550 5.081 -5.586 763 HB3 ALA 96 HB3 ALA 96 -16.919 3.746 -4.493 764 H LEU 97 HN LEU 97 -15.170 3.176 -2.909 765 HA LEU 97 HA LEU 97 -14.387 5.564 -1.749 766 HB2 LEU 97 HB2 LEU 97 -15.857 3.905 -0.745 767 HB3 LEU 97 HB1 LEU 97 -14.548 2.737 -0.716 768 HG LEU 97 HG LEU 97 -13.572 4.934 0.586 769 HD11 LEU 97 HD11 LEU 97 -16.419 4.395 1.395 770 HD12 LEU 97 HD12 LEU 97 -15.734 5.926 0.829 771 HD13 LEU 97 HD13 LEU 97 -15.260 5.271 2.399 772 HD21 LEU 97 HD21 LEU 97 -13.988 3.378 2.626 773 HD22 LEU 97 HD22 LEU 97 -12.889 2.888 1.338 774 HD23 LEU 97 HD23 LEU 97 -14.534 2.234 1.390 775 H VAL 98 HN VAL 98 -12.675 2.414 -1.918 776 HA VAL 98 HA VAL 98 -10.255 3.678 -0.930 777 HB VAL 98 HB VAL 98 -10.769 0.791 -1.644 778 HG11 VAL 98 HG11 VAL 98 -8.445 2.054 -0.192 779 HG12 VAL 98 HG12 VAL 98 -8.400 1.380 -1.822 780 HG13 VAL 98 HG13 VAL 98 -8.694 0.326 -0.440 781 HG21 VAL 98 HG21 VAL 98 -12.107 1.564 0.248 782 HG22 VAL 98 HG22 VAL 98 -10.650 2.172 1.034 783 HG23 VAL 98 HG23 VAL 98 -10.853 0.439 0.773 784 H LYS 99 HN LYS 99 -11.198 1.900 -3.871 785 HA LYS 99 HA LYS 99 -8.586 1.937 -4.987 786 HB2 LYS 99 HB2 LYS 99 -10.301 0.225 -5.541 787 HB3 LYS 99 HB1 LYS 99 -11.232 1.445 -6.392 788 HG2 LYS 99 HG2 LYS 99 -9.160 1.769 -7.849 789 HG3 LYS 99 HG1 LYS 99 -8.567 0.271 -7.128 790 HD2 LYS 99 HD2 LYS 99 -11.162 0.599 -8.639 791 HD3 LYS 99 HD1 LYS 99 -9.690 -0.146 -9.263 792 HE2 LYS 99 HE2 LYS 99 -9.846 -1.940 -7.682 793 HE3 LYS 99 HE1 LYS 99 -11.165 -1.140 -6.829 794 HZ1 LYS 99 HZ1 LYS 99 -11.223 -2.412 -9.506 795 HZ2 LYS 99 HZ2 LYS 99 -12.421 -1.323 -9.008 796 HZ3 LYS 99 HZ3 LYS 99 -12.185 -2.765 -8.149 797 H ARG 100 HN ARG 100 -11.363 4.118 -5.238 798 HA ARG 100 HA ARG 100 -10.021 5.659 -7.303 799 HB2 ARG 100 HB2 ARG 100 -12.446 5.471 -7.382 800 HB3 ARG 100 HB1 ARG 100 -12.580 6.151 -5.771 801 HG2 ARG 100 HG2 ARG 100 -11.307 7.729 -7.960 802 HG3 ARG 100 HG1 ARG 100 -13.062 7.618 -7.846 803 HD2 ARG 100 HD2 ARG 100 -12.891 8.425 -5.494 804 HD3 ARG 100 HD1 ARG 100 -11.163 8.669 -5.753 805 HE ARG 100 HE ARG 100 -12.172 10.108 -7.753 806 HH11 ARG 100 HH11 ARG 100 -13.098 9.962 -4.377 807 HH12 ARG 100 HH12 ARG 100 -13.681 11.600 -4.326 808 HH21 ARG 100 HH21 ARG 100 -12.948 12.263 -7.694 809 HH22 ARG 100 HH22 ARG 100 -13.583 12.912 -6.210 810 H ALA 101 HN ALA 101 -10.750 5.894 -3.862 811 HA ALA 101 HA ALA 101 -9.106 8.307 -3.697 812 HB1 ALA 101 HB1 ALA 101 -9.941 8.600 -1.470 813 HB2 ALA 101 HB2 ALA 101 -10.670 6.987 -1.474 814 HB3 ALA 101 HB3 ALA 101 -11.308 8.252 -2.532 815 H SER 102 HN SER 102 -7.362 6.599 -4.381 816 HA SER 102 HA SER 102 -6.234 5.278 -2.039 817 HB2 SER 102 HB2 SER 102 -5.211 5.306 -4.887 818 HB3 SER 102 HB1 SER 102 -4.651 4.262 -3.586 819 HG SER 102 HG SER 102 -7.297 4.001 -3.789 820 HA PRO 103 HA PRO 103 -3.627 8.949 -1.807 821 HB2 PRO 103 HB2 PRO 103 -4.260 9.543 0.732 822 HB3 PRO 103 HB1 PRO 103 -5.389 9.825 -0.601 823 HG2 PRO 103 HG2 PRO 103 -5.545 7.859 1.563 824 HG3 PRO 103 HG1 PRO 103 -6.802 8.369 0.426 825 HD2 PRO 103 HD2 PRO 103 -5.002 6.047 0.296 826 HD3 PRO 103 HD1 PRO 103 -6.519 6.347 -0.582 827 H LEU 104 HN LEU 104 -1.893 9.637 -0.364 828 HA LEU 104 HA LEU 104 -0.874 7.710 1.557 829 HB2 LEU 104 HB2 LEU 104 0.454 8.413 -0.975 830 HB3 LEU 104 HB1 LEU 104 1.470 8.591 0.443 831 HG LEU 104 HG LEU 104 0.042 6.065 -0.393 832 HD11 LEU 104 HD11 LEU 104 2.916 6.933 -0.552 833 HD12 LEU 104 HD12 LEU 104 1.859 6.407 -1.863 834 HD13 LEU 104 HD13 LEU 104 2.409 5.249 -0.655 835 HD21 LEU 104 HD21 LEU 104 1.955 6.551 1.886 836 HD22 LEU 104 HD22 LEU 104 1.251 5.001 1.424 837 HD23 LEU 104 HD23 LEU 104 0.218 6.290 2.043 838 HA PRO 105 HA PRO 105 -0.536 11.649 3.660 839 HB2 PRO 105 HB2 PRO 105 0.466 10.209 5.935 840 HB3 PRO 105 HB1 PRO 105 -1.114 10.963 5.724 841 HG2 PRO 105 HG2 PRO 105 -0.633 8.238 5.860 842 HG3 PRO 105 HG1 PRO 105 -2.086 9.004 5.221 843 HD2 PRO 105 HD2 PRO 105 0.155 7.745 3.788 844 HD3 PRO 105 HD1 PRO 105 -1.544 7.948 3.305 845 H THR 106 HN THR 106 1.839 9.145 4.378 846 HA THR 106 HA THR 106 3.963 11.115 4.543 847 HB THR 106 HB THR 106 4.140 8.114 4.860 848 HG1 THR 106 HG1 THR 106 3.775 10.159 6.828 849 HG21 THR 106 HG21 THR 106 6.184 8.612 6.109 850 HG22 THR 106 HG22 THR 106 5.955 10.336 5.818 851 HG23 THR 106 HG23 THR 106 6.291 9.252 4.469 852 HA PRO 107 HA PRO 107 4.818 10.530 0.158 853 HB2 PRO 107 HB2 PRO 107 7.009 12.173 0.152 854 HB3 PRO 107 HB1 PRO 107 5.344 12.751 0.031 855 HG2 PRO 107 HG2 PRO 107 7.139 12.625 2.422 856 HG3 PRO 107 HG1 PRO 107 6.030 13.916 1.923 857 HD2 PRO 107 HD2 PRO 107 5.393 12.175 3.865 858 HD3 PRO 107 HD1 PRO 107 4.172 12.808 2.739 859 HA PRO 108 HA PRO 108 8.077 7.496 1.079 860 HB2 PRO 108 HB2 PRO 108 7.282 5.628 -0.644 861 HB3 PRO 108 HB1 PRO 108 6.367 5.927 0.841 862 HG2 PRO 108 HG2 PRO 108 5.799 6.846 -1.951 863 HG3 PRO 108 HG1 PRO 108 4.677 6.203 -0.739 864 HD2 PRO 108 HD2 PRO 108 5.047 8.888 -1.270 865 HD3 PRO 108 HD1 PRO 108 4.419 8.242 0.260 866 H ALA 109 HN ALA 109 9.095 9.556 -0.108 867 HA ALA 109 HA ALA 109 9.649 9.455 -2.851 868 HB1 ALA 109 HB1 ALA 109 10.057 11.445 -1.506 869 HB2 ALA 109 HB2 ALA 109 11.522 10.953 -2.357 870 HB3 ALA 109 HB3 ALA 109 11.342 10.606 -0.637 871 H ASP 110 HN ASP 110 11.276 8.055 -0.077 872 HA ASP 110 HA ASP 110 13.522 7.078 -1.519 873 HB2 ASP 110 HB2 ASP 110 12.432 6.231 1.173 874 HB3 ASP 110 HB1 ASP 110 14.018 5.806 0.536 875 H ALA 111 HN ALA 111 10.349 6.151 -1.505 876 HA ALA 111 HA ALA 111 10.933 3.320 -1.954 877 HB1 ALA 111 HB1 ALA 111 8.251 4.676 -1.717 878 HB2 ALA 111 HB2 ALA 111 9.126 3.924 -0.381 879 HB3 ALA 111 HB3 ALA 111 8.568 2.939 -1.733 880 H TYR 112 HN TYR 112 9.837 6.214 -3.636 881 HA TYR 112 HA TYR 112 9.435 4.520 -5.985 882 HB2 TYR 112 HB2 TYR 112 8.094 6.423 -6.952 883 HB3 TYR 112 HB1 TYR 112 7.392 5.446 -5.688 884 HD1 TYR 112 HD2 TYR 112 9.581 8.483 -5.602 885 HD2 TYR 112 HD1 TYR 112 5.911 6.643 -4.529 886 HE1 TYR 112 HE2 TYR 112 8.929 10.507 -4.374 887 HE2 TYR 112 HE1 TYR 112 5.233 8.639 -3.311 888 HH TYR 112 HH TYR 112 6.318 10.572 -2.211 889 H VAL 113 HN VAL 113 11.856 6.031 -4.904 890 HA VAL 113 HA VAL 113 12.657 7.554 -7.185 891 HB VAL 113 HB VAL 113 15.037 7.008 -6.393 892 HG11 VAL 113 HG11 VAL 113 13.918 9.102 -5.880 893 HG12 VAL 113 HG12 VAL 113 14.883 8.561 -4.507 894 HG13 VAL 113 HG13 VAL 113 13.131 8.361 -4.487 895 HG21 VAL 113 HG21 VAL 113 15.296 6.139 -4.143 896 HG22 VAL 113 HG22 VAL 113 14.470 4.949 -5.150 897 HG23 VAL 113 HG23 VAL 113 13.554 5.918 -3.994 898 H ASN 114 HN ASN 114 12.102 6.482 -8.941 899 HA ASN 114 HA ASN 114 13.479 4.673 -10.371 900 HB2 ASN 114 HB2 ASN 114 12.646 2.471 -9.969 901 HB3 ASN 114 HB1 ASN 114 13.095 3.088 -8.386 902 HD21 ASN 114 HD21 ASN 114 11.425 3.650 -6.908 903 HD22 ASN 114 HD22 ASN 114 9.826 3.024 -7.098 904 H GLY 115 HN GLY 115 10.444 5.823 -9.208 905 HA2 GLY 115 HA2 GLY 115 9.410 6.739 -11.562 906 HA3 GLY 115 HA1 GLY 115 8.870 5.067 -11.483 907 H THR 116 HN THR 116 7.737 4.417 -9.489 908 HA THR 116 HA THR 116 6.537 6.413 -7.825 909 HB THR 116 HB THR 116 4.177 5.406 -8.638 910 HG1 THR 116 HG1 THR 116 5.932 5.248 -10.840 911 HG21 THR 116 HG21 THR 116 4.652 7.769 -8.369 912 HG22 THR 116 HG22 THR 116 3.850 7.488 -9.915 913 HG23 THR 116 HG23 THR 116 5.590 7.773 -9.863 914 H VAL 117 HN VAL 117 4.671 5.164 -6.467 915 HA VAL 117 HA VAL 117 6.008 2.666 -5.697 916 HB VAL 117 HB VAL 117 4.806 2.883 -3.514 917 HG11 VAL 117 HG11 VAL 117 7.103 3.545 -3.682 918 HG12 VAL 117 HG12 VAL 117 6.241 4.670 -2.629 919 HG13 VAL 117 HG13 VAL 117 6.636 5.135 -4.285 920 HG21 VAL 117 HG21 VAL 117 4.059 5.615 -4.559 921 HG22 VAL 117 HG22 VAL 117 3.917 5.097 -2.877 922 HG23 VAL 117 HG23 VAL 117 2.955 4.306 -4.125 923 H GLU 118 HN GLU 118 5.103 0.998 -6.621 924 HA GLU 118 HA GLU 118 2.175 0.761 -6.525 925 HB2 GLU 118 HB2 GLU 118 3.350 0.394 -8.713 926 HB3 GLU 118 HB1 GLU 118 4.189 -0.968 -7.982 927 HG2 GLU 118 HG2 GLU 118 1.885 -1.913 -7.489 928 HG3 GLU 118 HG1 GLU 118 1.275 -0.672 -8.588 929 H LEU 119 HN LEU 119 1.498 -0.224 -4.713 930 HA LEU 119 HA LEU 119 2.983 -2.547 -3.767 931 HB2 LEU 119 HB2 LEU 119 3.255 -1.768 -1.554 932 HB3 LEU 119 HB1 LEU 119 3.847 -0.500 -2.603 933 HG LEU 119 HG LEU 119 1.306 0.371 -2.209 934 HD11 LEU 119 HD11 LEU 119 0.748 0.060 0.133 935 HD12 LEU 119 HD12 LEU 119 2.123 -1.028 0.325 936 HD13 LEU 119 HD13 LEU 119 0.778 -1.482 -0.724 937 HD21 LEU 119 HD21 LEU 119 3.646 0.854 -0.360 938 HD22 LEU 119 HD22 LEU 119 2.248 1.910 -0.568 939 HD23 LEU 119 HD23 LEU 119 3.376 1.666 -1.903 940 H THR 120 HN THR 120 1.790 -4.003 -2.592 941 HA THR 120 HA THR 120 -1.067 -3.847 -3.028 942 HB THR 120 HB THR 120 0.639 -6.065 -1.879 943 HG1 THR 120 HG1 THR 120 1.163 -5.973 -3.985 944 HG21 THR 120 HG21 THR 120 -2.232 -6.122 -2.818 945 HG22 THR 120 HG22 THR 120 -1.699 -6.194 -1.136 946 HG23 THR 120 HG23 THR 120 -1.295 -7.504 -2.248 947 H LEU 121 HN LEU 121 -2.404 -3.061 -1.552 948 HA LEU 121 HA LEU 121 -1.829 -3.655 1.272 949 HB2 LEU 121 HB2 LEU 121 -2.966 -1.168 0.028 950 HB3 LEU 121 HB1 LEU 121 -3.305 -1.578 1.701 951 HG LEU 121 HG LEU 121 -0.581 -1.092 0.501 952 HD11 LEU 121 HD11 LEU 121 -1.578 0.996 0.774 953 HD12 LEU 121 HD12 LEU 121 -0.622 0.769 2.237 954 HD13 LEU 121 HD13 LEU 121 -2.370 0.526 2.277 955 HD21 LEU 121 HD21 LEU 121 0.274 -1.397 2.743 956 HD22 LEU 121 HD22 LEU 121 -0.578 -2.852 2.216 957 HD23 LEU 121 HD23 LEU 121 -1.350 -1.734 3.343 958 HA PRO 122 HA PRO 122 -5.720 -5.764 0.783 959 HB2 PRO 122 HB2 PRO 122 -5.480 -6.462 3.594 960 HB3 PRO 122 HB1 PRO 122 -5.391 -7.515 2.179 961 HG2 PRO 122 HG2 PRO 122 -3.245 -6.955 3.766 962 HG3 PRO 122 HG1 PRO 122 -3.111 -7.360 2.046 963 HD2 PRO 122 HD2 PRO 122 -2.996 -4.680 3.378 964 HD3 PRO 122 HD1 PRO 122 -2.045 -5.306 2.014 965 H ILE 123 HN ILE 123 -7.511 -4.595 0.811 966 HA ILE 123 HA ILE 123 -7.970 -2.757 3.034 967 HB ILE 123 HB ILE 123 -9.632 -1.661 1.697 968 HG12 ILE 123 HG12 ILE 123 -9.262 -3.790 -0.414 969 HG13 ILE 123 HG11 ILE 123 -10.630 -3.718 0.689 970 HG21 ILE 123 HG21 ILE 123 -7.487 -0.901 1.105 971 HG22 ILE 123 HG22 ILE 123 -8.305 -1.178 -0.441 972 HG23 ILE 123 HG23 ILE 123 -7.137 -2.353 0.168 973 HD11 ILE 123 HD11 ILE 123 -9.902 -1.670 -1.386 974 HD12 ILE 123 HD12 ILE 123 -11.223 -1.515 -0.228 975 HD13 ILE 123 HD13 ILE 123 -11.256 -2.800 -1.437 976 H ASP 124 HN ASP 124 -8.768 -3.909 4.717 977 HA ASP 124 HA ASP 124 -10.578 -6.087 4.096 978 HB2 ASP 124 HB2 ASP 124 -10.413 -6.667 6.497 979 HB3 ASP 124 HB1 ASP 124 -8.850 -6.616 5.694 980 H PHE 125 HN PHE 125 -12.594 -5.741 3.912 981 HA PHE 125 HA PHE 125 -13.958 -4.191 6.009 982 HB2 PHE 125 HB2 PHE 125 -14.962 -5.112 3.299 983 HB3 PHE 125 HB1 PHE 125 -15.959 -4.315 4.510 984 HD1 PHE 125 HD1 PHE 125 -12.918 -3.821 2.416 985 HD2 PHE 125 HD2 PHE 125 -16.142 -2.007 4.517 986 HE1 PHE 125 HE1 PHE 125 -12.306 -1.638 1.465 987 HE2 PHE 125 HE2 PHE 125 -15.529 0.181 3.574 988 HZ PHE 125 HZ PHE 125 -13.609 0.367 2.044 989 H SER 126 HN SER 126 -15.428 -5.344 7.306 990 HA SER 126 HA SER 126 -14.907 -8.095 7.613 991 HB2 SER 126 HB2 SER 126 -17.373 -6.689 8.643 992 HB3 SER 126 HB1 SER 126 -16.486 -8.024 9.383 993 HG SER 126 HG SER 126 -14.678 -6.237 9.241 994 H LEU 127 HN LEU 127 -15.380 -9.434 5.966 995 HA LEU 127 HA LEU 127 -17.778 -9.025 4.371 996 HB2 LEU 127 HB2 LEU 127 -15.270 -9.726 3.677 997 HB3 LEU 127 HB1 LEU 127 -15.963 -11.323 3.872 998 HG LEU 127 HG LEU 127 -17.049 -9.192 2.023 999 HD11 LEU 127 HD11 LEU 127 -15.434 -11.655 1.401 1000 HD12 LEU 127 HD12 LEU 127 -14.866 -9.988 1.299 1001 HD13 LEU 127 HD13 LEU 127 -16.146 -10.549 0.222 1002 HD21 LEU 127 HD21 LEU 127 -18.778 -10.728 2.750 1003 HD22 LEU 127 HD22 LEU 127 -17.757 -12.103 2.325 1004 HD23 LEU 127 HD23 LEU 127 -18.354 -11.025 1.061 1005 H ARG 128 HN ARG 128 -19.314 -9.617 6.004 1006 HA ARG 128 HA ARG 128 -19.316 -12.264 7.080 1007 HB2 ARG 128 HB2 ARG 128 -21.526 -10.209 6.971 1008 HB3 ARG 128 HB1 ARG 128 -21.510 -11.652 7.963 1009 HG2 ARG 128 HG2 ARG 128 -19.543 -10.786 9.160 1010 HG3 ARG 128 HG1 ARG 128 -19.641 -9.312 8.195 1011 HD2 ARG 128 HD2 ARG 128 -21.745 -10.355 10.087 1012 HD3 ARG 128 HD1 ARG 128 -20.666 -8.991 10.374 1013 HE ARG 128 HE ARG 128 -22.642 -8.982 8.184 1014 HH11 ARG 128 HH11 ARG 128 -21.063 -7.457 10.918 1015 HH12 ARG 128 HH12 ARG 128 -22.037 -6.012 10.842 1016 HH21 ARG 128 HH21 ARG 128 -23.919 -7.068 8.066 1017 HH22 ARG 128 HH22 ARG 128 -23.638 -5.794 9.212 1018 H GLY 129 HN GLY 129 -20.382 -10.794 4.175 1019 HA2 GLY 129 HA2 GLY 129 -20.722 -12.770 2.522 1020 HA3 GLY 129 HA1 GLY 129 -22.125 -13.068 3.539 1021 H ALA 130 HN ALA 130 -20.904 -11.367 0.880 1022 HA ALA 130 HA ALA 130 -23.503 -10.261 0.319 1023 HB1 ALA 130 HB1 ALA 130 -22.544 -8.486 1.712 1024 HB2 ALA 130 HB2 ALA 130 -22.763 -7.953 0.044 1025 HB3 ALA 130 HB3 ALA 130 -21.157 -8.388 0.627 1026 H GLY 131 HN GLY 131 -23.674 -9.496 -1.893 1027 HA2 GLY 131 HA2 GLY 131 -22.986 -9.390 -4.127 1028 HA3 GLY 131 HA1 GLY 131 -21.405 -9.998 -3.646 1029 H PHE 132 HN PHE 132 -24.427 -11.476 -2.742 1030 HA PHE 132 HA PHE 132 -23.614 -13.877 -4.198 1031 HB2 PHE 132 HB2 PHE 132 -25.187 -15.071 -2.639 1032 HB3 PHE 132 HB1 PHE 132 -23.809 -14.316 -1.853 1033 HD1 PHE 132 HD1 PHE 132 -24.154 -12.130 -0.644 1034 HD2 PHE 132 HD2 PHE 132 -27.389 -14.536 -2.014 1035 HE1 PHE 132 HE1 PHE 132 -25.665 -10.982 0.920 1036 HE2 PHE 132 HE2 PHE 132 -28.907 -13.383 -0.460 1037 HZ PHE 132 HZ PHE 132 -28.046 -11.605 1.010 Start of MODEL 4 1 H1 LYS 2 HT1 LYS 2 18.152 -27.728 -19.650 2 H2 LYS 2 HT2 LYS 2 18.346 -26.856 -18.209 3 H3 LYS 2 HT3 LYS 2 18.892 -26.201 -19.671 4 HA LYS 2 HA LYS 2 16.867 -25.136 -19.029 5 HB2 LYS 2 HB2 LYS 2 16.450 -27.049 -21.334 6 HB3 LYS 2 HB1 LYS 2 15.551 -25.564 -21.060 7 HG2 LYS 2 HG2 LYS 2 17.600 -24.267 -21.357 8 HG3 LYS 2 HG1 LYS 2 18.502 -25.757 -21.628 9 HD2 LYS 2 HD2 LYS 2 16.230 -24.729 -23.326 10 HD3 LYS 2 HD1 LYS 2 17.944 -24.665 -23.740 11 HE2 LYS 2 HE2 LYS 2 18.025 -27.130 -23.655 12 HE3 LYS 2 HE1 LYS 2 16.295 -27.155 -23.318 13 HZ1 LYS 2 HZ1 LYS 2 16.621 -27.538 -25.629 14 HZ2 LYS 2 HZ2 LYS 2 17.620 -26.179 -25.789 15 HZ3 LYS 2 HZ3 LYS 2 15.967 -25.981 -25.461 16 H VAL 3 HN VAL 3 16.979 -27.414 -17.245 17 HA VAL 3 HA VAL 3 14.104 -28.079 -17.245 18 HB VAL 3 HB VAL 3 14.668 -30.051 -15.830 19 HG11 VAL 3 HG11 VAL 3 15.524 -31.450 -17.639 20 HG12 VAL 3 HG12 VAL 3 16.032 -30.010 -18.520 21 HG13 VAL 3 HG13 VAL 3 14.318 -30.309 -18.235 22 HG21 VAL 3 HG21 VAL 3 16.990 -30.856 -15.768 23 HG22 VAL 3 HG22 VAL 3 16.809 -29.310 -14.938 24 HG23 VAL 3 HG23 VAL 3 17.519 -29.367 -16.552 25 H GLN 4 HN GLN 4 16.872 -26.954 -15.488 26 HA GLN 4 HA GLN 4 15.103 -25.815 -13.441 27 HB2 GLN 4 HB2 GLN 4 17.737 -27.216 -12.922 28 HB3 GLN 4 HB1 GLN 4 16.845 -26.291 -11.724 29 HG2 GLN 4 HG2 GLN 4 15.081 -27.861 -11.683 30 HG3 GLN 4 HG1 GLN 4 15.680 -28.676 -13.128 31 HE21 GLN 4 HE21 GLN 4 16.117 -28.213 -9.703 32 HE22 GLN 4 HE22 GLN 4 17.201 -29.542 -9.468 33 H GLU 5 HN GLU 5 17.937 -25.758 -15.394 34 HA GLU 5 HA GLU 5 18.993 -23.307 -14.279 35 HB2 GLU 5 HB2 GLU 5 20.079 -24.236 -16.848 36 HB3 GLU 5 HB1 GLU 5 20.913 -23.838 -15.357 37 HG2 GLU 5 HG2 GLU 5 21.383 -26.071 -15.560 38 HG3 GLU 5 HG1 GLU 5 19.954 -26.113 -14.530 39 H GLN 6 HN GLN 6 16.719 -22.406 -14.867 40 HA GLN 6 HA GLN 6 16.454 -21.596 -17.636 41 HB2 GLN 6 HB2 GLN 6 14.797 -20.803 -15.233 42 HB3 GLN 6 HB1 GLN 6 14.389 -20.503 -16.916 43 HG2 GLN 6 HG2 GLN 6 14.554 -23.169 -15.531 44 HG3 GLN 6 HG1 GLN 6 13.106 -22.357 -16.125 45 HE21 GLN 6 HE21 GLN 6 12.718 -22.280 -18.354 46 HE22 GLN 6 HE22 GLN 6 13.515 -23.364 -19.448 47 H SER 7 HN SER 7 18.782 -20.684 -16.956 48 HA SER 7 HA SER 7 18.538 -17.970 -15.901 49 HB2 SER 7 HB2 SER 7 20.302 -19.522 -15.017 50 HB3 SER 7 HB1 SER 7 21.043 -19.518 -16.615 51 HG SER 7 HG SER 7 20.547 -17.128 -15.186 52 H VAL 8 HN VAL 8 17.811 -16.676 -17.496 53 HA VAL 8 HA VAL 8 19.155 -16.798 -20.091 54 HB VAL 8 HB VAL 8 16.777 -16.901 -20.320 55 HG11 VAL 8 HG11 VAL 8 15.277 -15.115 -19.543 56 HG12 VAL 8 HG12 VAL 8 16.632 -14.365 -18.699 57 HG13 VAL 8 HG13 VAL 8 16.064 -15.964 -18.214 58 HG21 VAL 8 HG21 VAL 8 17.737 -14.140 -21.045 59 HG22 VAL 8 HG22 VAL 8 16.335 -14.959 -21.732 60 HG23 VAL 8 HG23 VAL 8 17.954 -15.604 -22.004 61 H GLY 9 HN GLY 9 21.014 -15.701 -19.884 62 HA2 GLY 9 HA2 GLY 9 21.410 -13.128 -20.283 63 HA3 GLY 9 HA1 GLY 9 21.000 -13.082 -18.573 64 H ALA 10 HN ALA 10 23.452 -13.499 -20.836 65 HA ALA 10 HA ALA 10 25.317 -14.224 -18.673 66 HB1 ALA 10 HB1 ALA 10 25.549 -15.005 -21.579 67 HB2 ALA 10 HB2 ALA 10 25.112 -16.083 -20.254 68 HB3 ALA 10 HB3 ALA 10 26.723 -15.365 -20.311 69 HA PRO 11 HA PRO 11 26.377 -10.116 -20.419 70 HB2 PRO 11 HB2 PRO 11 26.607 -8.784 -18.106 71 HB3 PRO 11 HB1 PRO 11 25.031 -9.136 -18.822 72 HG2 PRO 11 HG2 PRO 11 26.424 -10.473 -16.547 73 HG3 PRO 11 HG1 PRO 11 24.701 -10.119 -16.759 74 HD2 PRO 11 HD2 PRO 11 25.900 -12.580 -17.217 75 HD3 PRO 11 HD1 PRO 11 24.331 -12.067 -17.865 76 HA PRO 12 HA PRO 12 30.796 -10.643 -19.587 77 HB2 PRO 12 HB2 PRO 12 31.189 -8.640 -21.647 78 HB3 PRO 12 HB1 PRO 12 31.593 -10.358 -21.693 79 HG2 PRO 12 HG2 PRO 12 29.635 -9.228 -23.222 80 HG3 PRO 12 HG1 PRO 12 29.625 -10.925 -22.709 81 HD2 PRO 12 HD2 PRO 12 28.133 -8.589 -21.570 82 HD3 PRO 12 HD1 PRO 12 27.582 -10.258 -21.838 83 HA PRO 13 HA PRO 13 30.290 -6.944 -17.022 84 HB2 PRO 13 HB2 PRO 13 32.442 -8.084 -15.405 85 HB3 PRO 13 HB1 PRO 13 30.763 -7.768 -14.965 86 HG2 PRO 13 HG2 PRO 13 31.741 -10.272 -15.266 87 HG3 PRO 13 HG1 PRO 13 30.058 -9.852 -15.633 88 HD2 PRO 13 HD2 PRO 13 32.370 -10.227 -17.499 89 HD3 PRO 13 HD1 PRO 13 30.681 -10.755 -17.677 90 H GLY 14 HN GLY 14 31.184 -5.108 -17.748 91 HA2 GLY 14 HA2 GLY 14 33.845 -4.903 -18.738 92 HA3 GLY 14 HA1 GLY 14 32.783 -3.556 -18.334 93 H ARG 15 HN ARG 15 32.324 -4.280 -15.646 94 HA ARG 15 HA ARG 15 34.917 -4.539 -14.370 95 HB2 ARG 15 HB2 ARG 15 34.571 -2.089 -14.683 96 HB3 ARG 15 HB1 ARG 15 33.089 -2.209 -13.743 97 HG2 ARG 15 HG2 ARG 15 34.424 -3.034 -11.830 98 HG3 ARG 15 HG1 ARG 15 35.886 -2.763 -12.780 99 HD2 ARG 15 HD2 ARG 15 33.872 -0.685 -11.937 100 HD3 ARG 15 HD1 ARG 15 35.496 -0.898 -11.285 101 HE ARG 15 HE ARG 15 35.619 -0.494 -14.088 102 HH11 ARG 15 HH11 ARG 15 34.992 1.214 -11.092 103 HH12 ARG 15 HH12 ARG 15 35.501 2.758 -11.715 104 HH21 ARG 15 HH21 ARG 15 36.272 1.526 -14.919 105 HH22 ARG 15 HH22 ARG 15 36.232 2.933 -13.900 106 H ALA 16 HN ALA 16 31.580 -3.595 -13.481 107 HA ALA 16 HA ALA 16 31.570 -5.875 -11.616 108 HB1 ALA 16 HB1 ALA 16 31.869 -3.740 -10.433 109 HB2 ALA 16 HB2 ALA 16 30.363 -4.549 -10.003 110 HB3 ALA 16 HB3 ALA 16 30.339 -3.174 -11.109 111 H ASP 17 HN ASP 17 30.042 -7.271 -11.960 112 HA ASP 17 HA ASP 17 27.321 -6.502 -12.410 113 HB2 ASP 17 HB2 ASP 17 28.517 -6.608 -14.757 114 HB3 ASP 17 HB1 ASP 17 28.411 -8.350 -14.521 115 H LYS 18 HN LYS 18 26.523 -9.145 -13.338 116 HA LYS 18 HA LYS 18 25.951 -11.165 -12.457 117 HB2 LYS 18 HB2 LYS 18 28.810 -11.094 -11.464 118 HB3 LYS 18 HB1 LYS 18 27.786 -12.523 -11.483 119 HG2 LYS 18 HG2 LYS 18 27.731 -12.547 -13.862 120 HG3 LYS 18 HG1 LYS 18 28.515 -10.971 -13.952 121 HD2 LYS 18 HD2 LYS 18 30.193 -12.558 -14.446 122 HD3 LYS 18 HD1 LYS 18 30.500 -12.027 -12.796 123 HE2 LYS 18 HE2 LYS 18 29.006 -14.548 -13.504 124 HE3 LYS 18 HE1 LYS 18 30.735 -14.491 -13.184 125 HZ1 LYS 18 HZ1 LYS 18 28.501 -13.998 -11.308 126 HZ2 LYS 18 HZ2 LYS 18 30.076 -13.466 -10.968 127 HZ3 LYS 18 HZ3 LYS 18 29.766 -15.123 -11.176 128 H THR 19 HN THR 19 25.143 -8.985 -10.966 129 HA THR 19 HA THR 19 25.822 -9.603 -8.182 130 HB THR 19 HB THR 19 24.294 -7.226 -9.261 131 HG1 THR 19 HG1 THR 19 26.876 -7.824 -9.491 132 HG21 THR 19 HG21 THR 19 24.881 -6.203 -7.103 133 HG22 THR 19 HG22 THR 19 25.644 -7.711 -6.598 134 HG23 THR 19 HG23 THR 19 23.904 -7.655 -6.884 135 H ALA 20 HN ALA 20 23.007 -9.170 -10.308 136 HA ALA 20 HA ALA 20 21.494 -11.039 -8.706 137 HB1 ALA 20 HB1 ALA 20 20.555 -8.179 -8.934 138 HB2 ALA 20 HB2 ALA 20 21.118 -8.972 -7.463 139 HB3 ALA 20 HB3 ALA 20 19.634 -9.517 -8.245 140 H ALA 21 HN ALA 21 20.620 -12.322 -10.193 141 HA ALA 21 HA ALA 21 19.233 -11.013 -12.422 142 HB1 ALA 21 HB1 ALA 21 20.560 -13.708 -12.662 143 HB2 ALA 21 HB2 ALA 21 21.306 -12.196 -13.167 144 HB3 ALA 21 HB3 ALA 21 19.823 -12.749 -13.948 145 HA PRO 22 HA PRO 22 16.373 -14.490 -10.952 146 HB2 PRO 22 HB2 PRO 22 17.686 -16.480 -9.355 147 HB3 PRO 22 HB1 PRO 22 16.990 -16.668 -10.966 148 HG2 PRO 22 HG2 PRO 22 19.680 -16.832 -10.404 149 HG3 PRO 22 HG1 PRO 22 19.009 -16.431 -11.995 150 HD2 PRO 22 HD2 PRO 22 20.099 -14.608 -9.883 151 HD3 PRO 22 HD1 PRO 22 20.301 -14.540 -11.648 152 H GLN 23 HN GLN 23 18.719 -13.145 -8.902 153 HA GLN 23 HA GLN 23 17.331 -13.654 -6.416 154 HB2 GLN 23 HB2 GLN 23 19.684 -11.847 -7.020 155 HB3 GLN 23 HB1 GLN 23 19.054 -12.174 -5.413 156 HG2 GLN 23 HG2 GLN 23 20.913 -13.555 -5.596 157 HG3 GLN 23 HG1 GLN 23 19.553 -14.630 -5.911 158 HE21 GLN 23 HE21 GLN 23 20.871 -16.081 -7.015 159 HE22 GLN 23 HE22 GLN 23 21.463 -15.759 -8.610 160 H THR 24 HN THR 24 16.952 -11.553 -8.957 161 HA THR 24 HA THR 24 16.424 -9.089 -7.720 162 HB THR 24 HB THR 24 15.157 -10.039 -10.288 163 HG1 THR 24 HG1 THR 24 17.233 -9.108 -11.162 164 HG21 THR 24 HG21 THR 24 16.168 -7.337 -9.378 165 HG22 THR 24 HG22 THR 24 14.476 -7.822 -9.492 166 HG23 THR 24 HG23 THR 24 15.457 -7.691 -10.952 167 H ARG 25 HN ARG 25 14.679 -11.946 -7.466 168 HA ARG 25 HA ARG 25 12.035 -10.844 -7.471 169 HB2 ARG 25 HB2 ARG 25 11.297 -12.993 -6.667 170 HB3 ARG 25 HB1 ARG 25 12.469 -13.229 -7.955 171 HG2 ARG 25 HG2 ARG 25 14.182 -13.793 -6.362 172 HG3 ARG 25 HG1 ARG 25 13.100 -13.424 -5.016 173 HD2 ARG 25 HD2 ARG 25 11.605 -15.219 -5.722 174 HD3 ARG 25 HD1 ARG 25 12.666 -15.574 -7.082 175 HE ARG 25 HE ARG 25 14.017 -15.718 -4.562 176 HH11 ARG 25 HH11 ARG 25 11.928 -17.477 -6.772 177 HH12 ARG 25 HH12 ARG 25 12.472 -19.037 -6.231 178 HH21 ARG 25 HH21 ARG 25 14.710 -17.758 -3.842 179 HH22 ARG 25 HH22 ARG 25 14.055 -19.202 -4.573 180 H LEU 26 HN LEU 26 14.602 -10.853 -5.232 181 HA LEU 26 HA LEU 26 12.723 -10.158 -3.074 182 HB2 LEU 26 HB2 LEU 26 15.489 -11.342 -2.890 183 HB3 LEU 26 HB1 LEU 26 14.596 -10.736 -1.510 184 HG LEU 26 HG LEU 26 13.788 -13.057 -3.263 185 HD11 LEU 26 HD11 LEU 26 14.787 -12.935 -0.422 186 HD12 LEU 26 HD12 LEU 26 15.661 -13.574 -1.814 187 HD13 LEU 26 HD13 LEU 26 14.203 -14.383 -1.242 188 HD21 LEU 26 HD21 LEU 26 12.458 -11.907 -0.809 189 HD22 LEU 26 HD22 LEU 26 11.985 -13.391 -1.639 190 HD23 LEU 26 HD23 LEU 26 11.837 -11.835 -2.458 191 H THR 27 HN THR 27 14.147 -8.579 -5.268 192 HA THR 27 HA THR 27 15.238 -6.518 -3.468 193 HB THR 27 HB THR 27 16.634 -5.738 -5.396 194 HG1 THR 27 HG1 THR 27 15.354 -6.874 -7.009 195 HG21 THR 27 HG21 THR 27 18.334 -7.501 -5.190 196 HG22 THR 27 HG22 THR 27 17.130 -8.570 -4.471 197 HG23 THR 27 HG23 THR 27 17.620 -7.100 -3.628 198 HA PRO 28 HA PRO 28 11.711 -4.534 -5.622 199 HB2 PRO 28 HB2 PRO 28 10.981 -3.355 -3.118 200 HB3 PRO 28 HB1 PRO 28 10.119 -4.605 -4.014 201 HG2 PRO 28 HG2 PRO 28 11.357 -4.982 -1.573 202 HG3 PRO 28 HG1 PRO 28 10.967 -6.273 -2.720 203 HD2 PRO 28 HD2 PRO 28 13.574 -4.904 -2.217 204 HD3 PRO 28 HD1 PRO 28 13.245 -6.608 -2.603 205 H TYR 29 HN TYR 29 11.657 -2.399 -6.318 206 HA TYR 29 HA TYR 29 13.914 -0.785 -5.574 207 HB2 TYR 29 HB2 TYR 29 13.121 0.812 -7.270 208 HB3 TYR 29 HB1 TYR 29 13.260 -0.820 -7.905 209 HD1 TYR 29 HD2 TYR 29 10.717 1.510 -6.462 210 HD2 TYR 29 HD1 TYR 29 11.515 -1.682 -9.157 211 HE1 TYR 29 HE2 TYR 29 8.432 1.684 -7.335 212 HE2 TYR 29 HE1 TYR 29 9.227 -1.511 -10.044 213 HH TYR 29 HH TYR 29 7.016 -0.658 -9.354 214 H ALA 30 HN ALA 30 10.853 -1.174 -4.389 215 HA ALA 30 HA ALA 30 11.110 1.284 -2.798 216 HB1 ALA 30 HB1 ALA 30 8.717 1.568 -2.744 217 HB2 ALA 30 HB2 ALA 30 8.482 0.087 -3.681 218 HB3 ALA 30 HB3 ALA 30 9.243 1.492 -4.428 219 H GLN 31 HN GLN 31 11.328 0.838 -0.695 220 HA GLN 31 HA GLN 31 11.084 -1.938 0.114 221 HB2 GLN 31 HB2 GLN 31 12.034 0.338 1.843 222 HB3 GLN 31 HB1 GLN 31 12.410 -1.372 1.996 223 HG2 GLN 31 HG2 GLN 31 13.378 0.513 -0.136 224 HG3 GLN 31 HG1 GLN 31 14.328 -0.211 1.158 225 HE21 GLN 31 HE21 GLN 31 14.622 -0.311 -1.765 226 HE22 GLN 31 HE22 GLN 31 14.634 -1.987 -2.186 227 H ALA 32 HN ALA 32 9.776 1.214 0.984 228 HA ALA 32 HA ALA 32 7.924 1.866 2.130 229 HB1 ALA 32 HB1 ALA 32 6.940 -0.928 1.548 230 HB2 ALA 32 HB2 ALA 32 6.780 0.460 0.471 231 HB3 ALA 32 HB3 ALA 32 5.951 0.448 2.029 232 H GLY 33 HN GLY 33 6.211 0.301 3.844 233 HA2 GLY 33 HA2 GLY 33 7.247 -1.377 5.663 234 HA3 GLY 33 HA1 GLY 33 7.943 0.156 6.156 235 H GLU 34 HN GLU 34 5.180 -1.851 6.193 236 HA GLU 34 HA GLU 34 3.417 0.186 7.236 237 HB2 GLU 34 HB2 GLU 34 2.363 -1.613 6.052 238 HB3 GLU 34 HB1 GLU 34 3.172 -2.818 7.041 239 HG2 GLU 34 HG2 GLU 34 0.873 -2.665 7.698 240 HG3 GLU 34 HG1 GLU 34 1.886 -2.045 8.996 241 H ASP 35 HN ASP 35 2.882 0.535 9.299 242 HA ASP 35 HA ASP 35 3.617 -0.965 11.545 243 HB2 ASP 35 HB2 ASP 35 5.920 -0.365 11.064 244 HB3 ASP 35 HB1 ASP 35 5.480 1.332 10.878 245 H ASN 36 HN ASN 36 3.209 2.250 10.204 246 HA ASN 36 HA ASN 36 0.908 2.692 11.889 247 HB2 ASN 36 HB2 ASN 36 1.700 4.823 12.799 248 HB3 ASN 36 HB1 ASN 36 2.736 3.505 13.325 249 HD21 ASN 36 HD21 ASN 36 4.841 3.356 12.513 250 HD22 ASN 36 HD22 ASN 36 5.608 4.694 11.719 251 H TRP 37 HN TRP 37 1.405 2.314 9.083 252 HA TRP 37 HA TRP 37 1.307 4.964 7.873 253 HB2 TRP 37 HB2 TRP 37 2.613 2.889 6.974 254 HB3 TRP 37 HB1 TRP 37 1.049 2.367 6.369 255 HD1 TRP 37 HD1 TRP 37 1.253 6.045 6.077 256 HE1 TRP 37 HE1 TRP 37 1.919 6.720 3.682 257 HE3 TRP 37 HE3 TRP 37 2.721 1.488 4.339 258 HZ2 TRP 37 HZ2 TRP 37 2.928 5.474 1.358 259 HZ3 TRP 37 HZ3 TRP 37 3.524 1.300 2.027 260 HH2 TRP 37 HH2 TRP 37 3.625 3.254 0.576 261 H ARG 38 HN ARG 38 -0.759 2.214 8.483 262 HA ARG 38 HA ARG 38 -2.813 2.917 6.654 263 HB2 ARG 38 HB2 ARG 38 -4.154 1.200 7.777 264 HB3 ARG 38 HB1 ARG 38 -2.549 0.616 7.354 265 HG2 ARG 38 HG2 ARG 38 -1.840 1.010 9.694 266 HG3 ARG 38 HG1 ARG 38 -3.504 1.460 10.082 267 HD2 ARG 38 HD2 ARG 38 -3.076 -0.858 10.672 268 HD3 ARG 38 HD1 ARG 38 -4.261 -0.753 9.369 269 HE ARG 38 HE ARG 38 -1.697 -1.029 8.239 270 HH11 ARG 38 HH11 ARG 38 -4.024 -2.882 10.081 271 HH12 ARG 38 HH12 ARG 38 -3.502 -4.415 9.454 272 HH21 ARG 38 HH21 ARG 38 -0.992 -3.027 7.419 273 HH22 ARG 38 HH22 ARG 38 -1.737 -4.498 7.967 274 H SER 39 HN SER 39 -2.213 3.698 10.011 275 HA SER 39 HA SER 39 -4.766 4.738 10.594 276 HB2 SER 39 HB2 SER 39 -3.413 6.114 12.313 277 HB3 SER 39 HB1 SER 39 -3.357 4.355 12.449 278 HG SER 39 HG SER 39 -1.264 4.954 12.547 279 H ARG 40 HN ARG 40 -1.866 6.084 9.116 280 HA ARG 40 HA ARG 40 -2.934 8.714 8.811 281 HB2 ARG 40 HB2 ARG 40 -0.765 7.670 7.025 282 HB3 ARG 40 HB1 ARG 40 -0.945 9.214 7.805 283 HG2 ARG 40 HG2 ARG 40 -0.194 6.712 9.265 284 HG3 ARG 40 HG1 ARG 40 0.946 7.918 8.682 285 HD2 ARG 40 HD2 ARG 40 -1.304 8.543 10.583 286 HD3 ARG 40 HD1 ARG 40 0.323 8.109 11.109 287 HE ARG 40 HE ARG 40 -0.100 10.408 9.325 288 HH11 ARG 40 HH11 ARG 40 1.049 9.056 12.347 289 HH12 ARG 40 HH12 ARG 40 1.825 10.528 12.846 290 HH21 ARG 40 HH21 ARG 40 0.918 12.331 9.983 291 HH22 ARG 40 HH22 ARG 40 1.736 12.401 11.511 292 H ILE 41 HN ILE 41 -2.648 5.797 6.909 293 HA ILE 41 HA ILE 41 -3.608 6.665 4.446 294 HB ILE 41 HB ILE 41 -3.584 4.019 5.860 295 HG12 ILE 41 HG12 ILE 41 -2.370 4.973 3.263 296 HG13 ILE 41 HG11 ILE 41 -1.544 4.936 4.817 297 HG21 ILE 41 HG21 ILE 41 -4.503 2.899 3.886 298 HG22 ILE 41 HG22 ILE 41 -4.875 4.471 3.175 299 HG23 ILE 41 HG23 ILE 41 -5.686 3.957 4.654 300 HD11 ILE 41 HD11 ILE 41 -2.580 2.557 3.296 301 HD12 ILE 41 HD12 ILE 41 -1.798 2.500 4.875 302 HD13 ILE 41 HD13 ILE 41 -0.895 3.047 3.462 303 H SER 42 HN SER 42 -5.365 5.580 7.337 304 HA SER 42 HA SER 42 -7.956 5.713 6.291 305 HB2 SER 42 HB2 SER 42 -7.036 6.347 9.109 306 HB3 SER 42 HB1 SER 42 -8.691 5.967 8.627 307 HG SER 42 HG SER 42 -6.424 4.256 8.444 308 H GLY 43 HN GLY 43 -5.949 8.219 7.823 309 HA2 GLY 43 HA2 GLY 43 -7.811 10.304 7.759 310 HA3 GLY 43 HA1 GLY 43 -6.068 10.510 7.748 311 H ARG 44 HN ARG 44 -5.313 9.519 5.310 312 HA ARG 44 HA ARG 44 -6.099 11.686 3.657 313 HB2 ARG 44 HB2 ARG 44 -4.329 11.243 2.372 314 HB3 ARG 44 HB1 ARG 44 -3.860 10.178 3.667 315 HG2 ARG 44 HG2 ARG 44 -5.472 9.201 1.363 316 HG3 ARG 44 HG1 ARG 44 -3.722 9.353 1.269 317 HD2 ARG 44 HD2 ARG 44 -3.616 7.906 3.327 318 HD3 ARG 44 HD1 ARG 44 -5.338 7.601 3.089 319 HE ARG 44 HE ARG 44 -3.219 6.884 1.157 320 HH11 ARG 44 HH11 ARG 44 -6.358 6.319 2.594 321 HH12 ARG 44 HH12 ARG 44 -6.711 4.953 1.584 322 HH21 ARG 44 HH21 ARG 44 -3.666 5.091 -0.159 323 HH22 ARG 44 HH22 ARG 44 -5.165 4.238 0.023 324 H LEU 45 HN LEU 45 -7.210 8.392 3.888 325 HA LEU 45 HA LEU 45 -8.551 8.267 1.396 326 HB2 LEU 45 HB2 LEU 45 -8.103 6.550 3.470 327 HB3 LEU 45 HB1 LEU 45 -9.796 6.913 3.693 328 HG LEU 45 HG LEU 45 -8.753 6.018 1.025 329 HD11 LEU 45 HD11 LEU 45 -9.350 3.720 1.640 330 HD12 LEU 45 HD12 LEU 45 -9.695 4.251 3.286 331 HD13 LEU 45 HD13 LEU 45 -8.048 4.337 2.658 332 HD21 LEU 45 HD21 LEU 45 -11.451 5.774 2.334 333 HD22 LEU 45 HD22 LEU 45 -11.033 5.261 0.695 334 HD23 LEU 45 HD23 LEU 45 -11.000 6.975 1.124 335 H ASN 46 HN ASN 46 -9.249 9.704 4.438 336 HA ASN 46 HA ASN 46 -12.041 10.149 4.098 337 HB2 ASN 46 HB2 ASN 46 -11.002 10.059 6.337 338 HB3 ASN 46 HB1 ASN 46 -10.068 11.502 5.959 339 HD21 ASN 46 HD21 ASN 46 -11.064 13.495 5.975 340 HD22 ASN 46 HD22 ASN 46 -12.662 13.746 6.596 341 H ARG 47 HN ARG 47 -9.098 11.833 3.384 342 HA ARG 47 HA ARG 47 -9.982 14.336 2.632 343 HB2 ARG 47 HB2 ARG 47 -7.732 14.285 2.393 344 HB3 ARG 47 HB1 ARG 47 -7.715 12.579 1.981 345 HG2 ARG 47 HG2 ARG 47 -8.342 13.128 -0.318 346 HG3 ARG 47 HG1 ARG 47 -8.349 14.847 0.104 347 HD2 ARG 47 HD2 ARG 47 -5.959 14.681 0.706 348 HD3 ARG 47 HD1 ARG 47 -5.967 12.987 0.209 349 HE ARG 47 HE ARG 47 -6.893 14.715 -1.866 350 HH11 ARG 47 HH11 ARG 47 -3.945 13.565 -0.323 351 HH12 ARG 47 HH12 ARG 47 -2.978 13.812 -1.743 352 HH21 ARG 47 HH21 ARG 47 -5.616 15.025 -3.709 353 HH22 ARG 47 HH22 ARG 47 -3.924 14.633 -3.665 354 H PHE 48 HN PHE 48 -10.551 11.254 1.116 355 HA PHE 48 HA PHE 48 -11.927 12.676 -1.024 356 HB2 PHE 48 HB2 PHE 48 -10.709 9.950 -0.986 357 HB3 PHE 48 HB1 PHE 48 -11.879 10.413 -2.211 358 HD1 PHE 48 HD2 PHE 48 -11.318 12.159 -3.850 359 HD2 PHE 48 HD1 PHE 48 -8.460 10.703 -1.059 360 HE1 PHE 48 HE2 PHE 48 -9.504 13.097 -5.223 361 HE2 PHE 48 HE1 PHE 48 -6.642 11.634 -2.430 362 HZ PHE 48 HZ PHE 48 -7.161 12.832 -4.515 363 H LYS 49 HN LYS 49 -12.230 9.651 0.838 364 HA LYS 49 HA LYS 49 -15.022 10.063 1.364 365 HB2 LYS 49 HB2 LYS 49 -14.169 8.232 -0.858 366 HB3 LYS 49 HB1 LYS 49 -15.555 7.801 0.125 367 HG2 LYS 49 HG2 LYS 49 -15.651 10.536 -0.882 368 HG3 LYS 49 HG1 LYS 49 -15.605 9.309 -2.149 369 HD2 LYS 49 HD2 LYS 49 -17.901 9.803 -1.585 370 HD3 LYS 49 HD1 LYS 49 -17.504 8.164 -1.071 371 HE2 LYS 49 HE2 LYS 49 -17.207 8.956 1.224 372 HE3 LYS 49 HE1 LYS 49 -17.579 10.600 0.707 373 HZ1 LYS 49 HZ1 LYS 49 -19.501 9.511 1.705 374 HZ2 LYS 49 HZ2 LYS 49 -19.439 8.284 0.534 375 HZ3 LYS 49 HZ3 LYS 49 -19.788 9.878 0.075 376 H ARG 50 HN ARG 50 -14.744 9.481 3.483 377 HA ARG 50 HA ARG 50 -14.013 6.673 3.892 378 HB2 ARG 50 HB2 ARG 50 -12.068 7.925 4.562 379 HB3 ARG 50 HB1 ARG 50 -13.046 9.003 5.546 380 HG2 ARG 50 HG2 ARG 50 -13.504 7.274 7.120 381 HG3 ARG 50 HG1 ARG 50 -12.780 6.053 6.069 382 HD2 ARG 50 HD2 ARG 50 -10.636 6.762 6.495 383 HD3 ARG 50 HD1 ARG 50 -11.141 8.386 6.942 384 HE ARG 50 HE ARG 50 -11.759 6.089 8.686 385 HH11 ARG 50 HH11 ARG 50 -10.155 9.137 8.120 386 HH12 ARG 50 HH12 ARG 50 -9.770 9.414 9.792 387 HH21 ARG 50 HH21 ARG 50 -11.255 6.424 10.902 388 HH22 ARG 50 HH22 ARG 50 -10.398 7.860 11.380 389 H TYR 51 HN TYR 51 -15.850 5.787 4.387 390 HA TYR 51 HA TYR 51 -17.638 7.052 6.336 391 HB2 TYR 51 HB2 TYR 51 -18.224 6.033 3.910 392 HB3 TYR 51 HB1 TYR 51 -18.382 4.568 4.878 393 HD1 TYR 51 HD2 TYR 51 -19.623 8.014 4.449 394 HD2 TYR 51 HD1 TYR 51 -20.271 4.233 6.270 395 HE1 TYR 51 HE2 TYR 51 -21.865 8.736 5.124 396 HE2 TYR 51 HE1 TYR 51 -22.520 4.944 6.956 397 HH TYR 51 HH TYR 51 -24.024 7.757 5.740 398 HA PRO 52 HA PRO 52 -16.335 4.174 9.517 399 HB2 PRO 52 HB2 PRO 52 -18.857 3.759 10.648 400 HB3 PRO 52 HB1 PRO 52 -17.729 5.044 11.087 401 HG2 PRO 52 HG2 PRO 52 -20.089 5.129 9.266 402 HG3 PRO 52 HG1 PRO 52 -19.495 6.358 10.398 403 HD2 PRO 52 HD2 PRO 52 -19.087 6.588 7.763 404 HD3 PRO 52 HD1 PRO 52 -17.844 7.087 8.933 405 H LYS 53 HN LYS 53 -16.058 2.011 9.552 406 HA LYS 53 HA LYS 53 -16.939 0.521 7.328 407 HB2 LYS 53 HB2 LYS 53 -15.668 -0.475 9.884 408 HB3 LYS 53 HB1 LYS 53 -15.860 -1.421 8.419 409 HG2 LYS 53 HG2 LYS 53 -14.161 1.046 8.743 410 HG3 LYS 53 HG1 LYS 53 -13.591 -0.617 8.636 411 HD2 LYS 53 HD2 LYS 53 -13.261 0.106 6.478 412 HD3 LYS 53 HD1 LYS 53 -14.876 -0.597 6.352 413 HE2 LYS 53 HE2 LYS 53 -14.783 1.583 5.245 414 HE3 LYS 53 HE1 LYS 53 -15.867 1.615 6.636 415 HZ1 LYS 53 HZ1 LYS 53 -13.105 2.699 6.501 416 HZ2 LYS 53 HZ2 LYS 53 -13.998 2.569 7.937 417 HZ3 LYS 53 HZ3 LYS 53 -14.551 3.569 6.686 418 H ASP 54 HN ASP 54 -18.298 0.862 10.504 419 HA ASP 54 HA ASP 54 -19.744 -1.511 10.733 420 HB2 ASP 54 HB2 ASP 54 -19.591 0.112 12.554 421 HB3 ASP 54 HB1 ASP 54 -20.552 1.264 11.631 422 H ALA 55 HN ALA 55 -20.565 1.472 9.034 423 HA ALA 55 HA ALA 55 -23.152 0.632 8.219 424 HB1 ALA 55 HB1 ALA 55 -22.507 2.990 8.318 425 HB2 ALA 55 HB2 ALA 55 -23.097 2.542 6.718 426 HB3 ALA 55 HB3 ALA 55 -21.366 2.730 7.001 427 H LEU 56 HN LEU 56 -19.942 0.228 6.918 428 HA LEU 56 HA LEU 56 -20.808 -0.646 4.331 429 HB2 LEU 56 HB2 LEU 56 -18.171 -0.842 5.777 430 HB3 LEU 56 HB1 LEU 56 -18.421 -1.532 4.188 431 HG LEU 56 HG LEU 56 -17.323 0.550 3.899 432 HD11 LEU 56 HD11 LEU 56 -18.865 1.775 2.513 433 HD12 LEU 56 HD12 LEU 56 -20.234 0.974 3.280 434 HD13 LEU 56 HD13 LEU 56 -19.106 0.042 2.295 435 HD21 LEU 56 HD21 LEU 56 -18.235 2.673 4.714 436 HD22 LEU 56 HD22 LEU 56 -17.801 1.583 6.032 437 HD23 LEU 56 HD23 LEU 56 -19.494 1.788 5.578 438 H ARG 57 HN ARG 57 -19.776 -2.274 7.313 439 HA ARG 57 HA ARG 57 -19.941 -4.908 6.335 440 HB2 ARG 57 HB2 ARG 57 -20.532 -3.931 9.134 441 HB3 ARG 57 HB1 ARG 57 -20.190 -5.594 8.677 442 HG2 ARG 57 HG2 ARG 57 -17.943 -4.942 7.980 443 HG3 ARG 57 HG1 ARG 57 -18.285 -3.275 8.449 444 HD2 ARG 57 HD2 ARG 57 -18.243 -5.684 10.260 445 HD3 ARG 57 HD1 ARG 57 -17.040 -4.398 10.200 446 HE ARG 57 HE ARG 57 -19.809 -3.701 10.870 447 HH11 ARG 57 HH11 ARG 57 -16.460 -4.071 11.814 448 HH12 ARG 57 HH12 ARG 57 -16.677 -3.298 13.357 449 HH21 ARG 57 HH21 ARG 57 -20.093 -2.616 12.868 450 HH22 ARG 57 HH22 ARG 57 -18.734 -2.438 13.941 451 H LEU 58 HN LEU 58 -22.332 -2.615 7.182 452 HA LEU 58 HA LEU 58 -24.501 -4.550 7.317 453 HB2 LEU 58 HB2 LEU 58 -24.334 -2.603 8.861 454 HB3 LEU 58 HB1 LEU 58 -24.520 -1.533 7.486 455 HG LEU 58 HG LEU 58 -26.776 -2.524 7.091 456 HD11 LEU 58 HD11 LEU 58 -27.803 -3.807 8.915 457 HD12 LEU 58 HD12 LEU 58 -26.242 -3.869 9.737 458 HD13 LEU 58 HD13 LEU 58 -26.452 -4.667 8.177 459 HD21 LEU 58 HD21 LEU 58 -26.269 -1.267 9.786 460 HD22 LEU 58 HD22 LEU 58 -27.842 -1.378 8.997 461 HD23 LEU 58 HD23 LEU 58 -26.554 -0.422 8.264 462 H LYS 59 HN LYS 59 -22.854 -2.807 4.947 463 HA LYS 59 HA LYS 59 -25.167 -2.879 3.137 464 HB2 LYS 59 HB2 LYS 59 -24.988 -0.600 3.886 465 HB3 LYS 59 HB1 LYS 59 -23.266 -0.568 3.542 466 HG2 LYS 59 HG2 LYS 59 -23.753 -0.811 1.149 467 HG3 LYS 59 HG1 LYS 59 -25.477 -0.801 1.521 468 HD2 LYS 59 HD2 LYS 59 -24.745 1.405 0.786 469 HD3 LYS 59 HD1 LYS 59 -25.260 1.448 2.473 470 HE2 LYS 59 HE2 LYS 59 -22.975 1.422 3.225 471 HE3 LYS 59 HE1 LYS 59 -22.392 1.195 1.579 472 HZ1 LYS 59 HZ1 LYS 59 -22.102 3.438 1.977 473 HZ2 LYS 59 HZ2 LYS 59 -23.573 3.607 2.800 474 HZ3 LYS 59 HZ3 LYS 59 -23.558 3.406 1.113 475 H ARG 60 HN ARG 60 -21.753 -1.872 2.862 476 HA ARG 60 HA ARG 60 -21.537 -3.600 0.489 477 HB2 ARG 60 HB2 ARG 60 -19.834 -1.200 1.172 478 HB3 ARG 60 HB1 ARG 60 -19.831 -2.105 -0.333 479 HG2 ARG 60 HG2 ARG 60 -22.182 -0.547 0.686 480 HG3 ARG 60 HG1 ARG 60 -20.980 0.089 -0.433 481 HD2 ARG 60 HD2 ARG 60 -21.552 -1.798 -1.976 482 HD3 ARG 60 HD1 ARG 60 -22.882 -2.204 -0.887 483 HE ARG 60 HE ARG 60 -22.920 0.554 -1.660 484 HH11 ARG 60 HH11 ARG 60 -23.764 -2.667 -2.773 485 HH12 ARG 60 HH12 ARG 60 -25.043 -2.114 -3.813 486 HH21 ARG 60 HH21 ARG 60 -24.579 1.280 -3.017 487 HH22 ARG 60 HH22 ARG 60 -25.500 0.150 -3.960 488 H GLN 61 HN GLN 61 -20.888 -5.443 1.576 489 HA GLN 61 HA GLN 61 -18.523 -5.380 3.253 490 HB2 GLN 61 HB2 GLN 61 -19.919 -7.837 2.199 491 HB3 GLN 61 HB1 GLN 61 -18.958 -7.678 3.660 492 HG2 GLN 61 HG2 GLN 61 -20.663 -6.370 4.717 493 HG3 GLN 61 HG1 GLN 61 -21.605 -6.319 3.227 494 HE21 GLN 61 HE21 GLN 61 -22.371 -7.278 5.841 495 HE22 GLN 61 HE22 GLN 61 -22.821 -8.937 5.638 496 H GLY 62 HN GLY 62 -16.717 -7.010 2.660 497 HA2 GLY 62 HA2 GLY 62 -16.266 -8.258 0.347 498 HA3 GLY 62 HA1 GLY 62 -16.045 -6.590 -0.141 499 H VAL 63 HN VAL 63 -14.472 -9.276 0.800 500 HA VAL 63 HA VAL 63 -12.205 -7.734 1.869 501 HB VAL 63 HB VAL 63 -12.650 -10.725 1.998 502 HG11 VAL 63 HG11 VAL 63 -10.290 -10.119 1.925 503 HG12 VAL 63 HG12 VAL 63 -10.733 -10.731 3.518 504 HG13 VAL 63 HG13 VAL 63 -10.530 -8.998 3.266 505 HG21 VAL 63 HG21 VAL 63 -12.870 -8.656 4.178 506 HG22 VAL 63 HG22 VAL 63 -13.028 -10.400 4.384 507 HG23 VAL 63 HG23 VAL 63 -14.218 -9.513 3.430 508 H GLY 64 HN GLY 64 -10.620 -7.350 0.504 509 HA2 GLY 64 HA2 GLY 64 -9.659 -9.390 -1.296 510 HA3 GLY 64 HA1 GLY 64 -10.398 -8.017 -2.113 511 H GLN 65 HN GLN 65 -7.740 -8.576 -2.547 512 HA GLN 65 HA GLN 65 -6.343 -6.608 -0.873 513 HB2 GLN 65 HB2 GLN 65 -5.163 -8.666 -2.752 514 HB3 GLN 65 HB1 GLN 65 -4.252 -7.566 -1.724 515 HG2 GLN 65 HG2 GLN 65 -5.431 -8.629 0.240 516 HG3 GLN 65 HG1 GLN 65 -6.010 -9.853 -0.889 517 HE21 GLN 65 HE21 GLN 65 -4.314 -10.205 1.407 518 HE22 GLN 65 HE22 GLN 65 -2.827 -10.880 0.822 519 H VAL 66 HN VAL 66 -5.603 -4.775 -1.697 520 HA VAL 66 HA VAL 66 -6.280 -4.233 -4.506 521 HB VAL 66 HB VAL 66 -6.851 -2.690 -1.992 522 HG11 VAL 66 HG11 VAL 66 -5.705 -1.150 -3.593 523 HG12 VAL 66 HG12 VAL 66 -7.357 -0.706 -3.160 524 HG13 VAL 66 HG13 VAL 66 -7.024 -1.456 -4.729 525 HG21 VAL 66 HG21 VAL 66 -8.544 -4.210 -2.848 526 HG22 VAL 66 HG22 VAL 66 -8.508 -3.388 -4.410 527 HG23 VAL 66 HG23 VAL 66 -9.078 -2.534 -2.974 528 H ARG 67 HN ARG 67 -4.529 -3.823 -5.636 529 HA ARG 67 HA ARG 67 -2.183 -2.661 -4.293 530 HB2 ARG 67 HB2 ARG 67 -1.950 -4.937 -5.412 531 HB3 ARG 67 HB1 ARG 67 -2.232 -4.117 -6.945 532 HG2 ARG 67 HG2 ARG 67 -0.266 -2.610 -6.259 533 HG3 ARG 67 HG1 ARG 67 0.096 -3.879 -5.089 534 HD2 ARG 67 HD2 ARG 67 1.375 -4.247 -7.088 535 HD3 ARG 67 HD1 ARG 67 0.158 -5.513 -6.929 536 HE ARG 67 HE ARG 67 -1.087 -4.480 -8.686 537 HH11 ARG 67 HH11 ARG 67 2.133 -3.228 -8.212 538 HH12 ARG 67 HH12 ARG 67 2.171 -2.379 -9.729 539 HH21 ARG 67 HH21 ARG 67 -1.045 -3.386 -10.709 540 HH22 ARG 67 HH22 ARG 67 0.379 -2.487 -11.152 541 H PHE 68 HN PHE 68 -1.314 -0.785 -5.062 542 HA PHE 68 HA PHE 68 -2.166 0.255 -7.611 543 HB2 PHE 68 HB2 PHE 68 -2.777 2.491 -6.412 544 HB3 PHE 68 HB1 PHE 68 -3.969 1.211 -6.556 545 HD1 PHE 68 HD2 PHE 68 -1.209 2.007 -4.150 546 HD2 PHE 68 HD1 PHE 68 -5.314 1.055 -4.743 547 HE1 PHE 68 HE2 PHE 68 -1.581 2.078 -1.719 548 HE2 PHE 68 HE1 PHE 68 -5.689 1.129 -2.315 549 HZ PHE 68 HZ PHE 68 -3.822 1.642 -0.803 550 H THR 69 HN THR 69 -0.957 1.950 -8.379 551 HA THR 69 HA THR 69 1.540 2.539 -6.943 552 HB THR 69 HB THR 69 0.781 3.279 -9.783 553 HG1 THR 69 HG1 THR 69 2.413 1.125 -8.858 554 HG21 THR 69 HG21 THR 69 3.444 3.241 -8.352 555 HG22 THR 69 HG22 THR 69 2.528 4.681 -8.800 556 HG23 THR 69 HG23 THR 69 3.193 3.632 -10.053 557 H LEU 70 HN LEU 70 1.965 4.563 -6.201 558 HA LEU 70 HA LEU 70 -0.308 6.423 -6.360 559 HB2 LEU 70 HB2 LEU 70 1.405 5.784 -3.968 560 HB3 LEU 70 HB1 LEU 70 0.088 6.944 -4.004 561 HG LEU 70 HG LEU 70 -0.245 3.995 -4.541 562 HD11 LEU 70 HD11 LEU 70 -1.336 3.997 -2.281 563 HD12 LEU 70 HD12 LEU 70 -0.618 5.590 -2.016 564 HD13 LEU 70 HD13 LEU 70 0.417 4.186 -2.275 565 HD21 LEU 70 HD21 LEU 70 -2.261 6.181 -4.030 566 HD22 LEU 70 HD22 LEU 70 -2.620 4.471 -4.277 567 HD23 LEU 70 HD23 LEU 70 -1.926 5.424 -5.590 568 H ASP 71 HN ASP 71 0.064 8.526 -6.546 569 HA ASP 71 HA ASP 71 2.723 9.377 -7.274 570 HB2 ASP 71 HB2 ASP 71 0.748 10.100 -8.566 571 HB3 ASP 71 HB1 ASP 71 0.129 10.931 -7.138 572 H ARG 72 HN ARG 72 3.687 11.332 -6.354 573 HA ARG 72 HA ARG 72 4.057 11.234 -3.620 574 HB2 ARG 72 HB2 ARG 72 5.561 12.357 -5.238 575 HB3 ARG 72 HB1 ARG 72 4.389 13.657 -5.398 576 HG2 ARG 72 HG2 ARG 72 4.703 14.276 -3.093 577 HG3 ARG 72 HG1 ARG 72 5.776 12.898 -2.838 578 HD2 ARG 72 HD2 ARG 72 7.168 13.922 -4.754 579 HD3 ARG 72 HD1 ARG 72 6.250 15.392 -4.430 580 HE ARG 72 HE ARG 72 7.096 14.949 -2.016 581 HH11 ARG 72 HH11 ARG 72 8.858 14.582 -5.017 582 HH12 ARG 72 HH12 ARG 72 10.427 14.708 -4.274 583 HH21 ARG 72 HH21 ARG 72 9.166 15.095 -1.014 584 HH22 ARG 72 HH22 ARG 72 10.602 14.981 -1.995 585 H GLN 73 HN GLN 73 1.790 13.216 -5.478 586 HA GLN 73 HA GLN 73 0.854 14.539 -3.052 587 HB2 GLN 73 HB2 GLN 73 0.078 14.863 -5.953 588 HB3 GLN 73 HB1 GLN 73 -0.646 15.775 -4.635 589 HG2 GLN 73 HG2 GLN 73 1.555 16.704 -4.081 590 HG3 GLN 73 HG1 GLN 73 2.259 15.809 -5.426 591 HE21 GLN 73 HE21 GLN 73 2.117 18.690 -4.900 592 HE22 GLN 73 HE22 GLN 73 1.339 19.386 -6.287 593 H GLY 74 HN GLY 74 0.433 11.604 -3.885 594 HA2 GLY 74 HA2 GLY 74 -1.159 10.049 -3.315 595 HA3 GLY 74 HA1 GLY 74 -2.130 11.355 -2.666 596 H HIS 75 HN HIS 75 -0.955 10.807 -5.946 597 HA HIS 75 HA HIS 75 -3.741 10.836 -6.870 598 HB2 HIS 75 HB2 HIS 75 -2.316 12.535 -7.893 599 HB3 HIS 75 HB1 HIS 75 -1.149 11.310 -8.371 600 HD1 HIS 75 HD1 HIS 75 -4.544 12.663 -9.248 601 HD2 HIS 75 HD2 HIS 75 -1.762 9.941 -10.721 602 HE1 HIS 75 HE1 HIS 75 -5.329 12.070 -11.565 603 HE2 HIS 75 HE2 HIS 75 -3.694 10.343 -12.400 604 H VAL 76 HN VAL 76 -4.559 8.848 -7.047 605 HA VAL 76 HA VAL 76 -3.312 6.438 -7.334 606 HB VAL 76 HB VAL 76 -5.698 6.596 -6.967 607 HG11 VAL 76 HG11 VAL 76 -5.885 7.620 -9.793 608 HG12 VAL 76 HG12 VAL 76 -6.229 8.522 -8.318 609 HG13 VAL 76 HG13 VAL 76 -7.256 7.166 -8.782 610 HG21 VAL 76 HG21 VAL 76 -4.882 4.518 -7.888 611 HG22 VAL 76 HG22 VAL 76 -5.056 5.146 -9.527 612 HG23 VAL 76 HG23 VAL 76 -6.487 4.871 -8.529 613 H LEU 77 HN LEU 77 -2.048 5.539 -8.809 614 HA LEU 77 HA LEU 77 -1.982 6.709 -11.508 615 HB2 LEU 77 HB2 LEU 77 0.151 5.137 -10.061 616 HB3 LEU 77 HB1 LEU 77 0.315 5.893 -11.635 617 HG LEU 77 HG LEU 77 -0.245 7.461 -9.121 618 HD11 LEU 77 HD11 LEU 77 2.122 8.006 -9.058 619 HD12 LEU 77 HD12 LEU 77 2.421 6.932 -10.427 620 HD13 LEU 77 HD13 LEU 77 1.882 6.265 -8.885 621 HD21 LEU 77 HD21 LEU 77 0.795 8.268 -11.835 622 HD22 LEU 77 HD22 LEU 77 0.540 9.342 -10.460 623 HD23 LEU 77 HD23 LEU 77 -0.837 8.552 -11.228 624 H ALA 78 HN ALA 78 -1.791 3.674 -9.727 625 HA ALA 78 HA ALA 78 -2.787 2.260 -12.109 626 HB1 ALA 78 HB1 ALA 78 -0.373 1.832 -11.872 627 HB2 ALA 78 HB2 ALA 78 -1.329 0.373 -11.615 628 HB3 ALA 78 HB3 ALA 78 -0.650 1.236 -10.233 629 H VAL 79 HN VAL 79 -4.151 0.495 -11.659 630 HA VAL 79 HA VAL 79 -4.785 -0.014 -8.854 631 HB VAL 79 HB VAL 79 -7.236 -0.166 -9.500 632 HG11 VAL 79 HG11 VAL 79 -7.632 2.224 -9.197 633 HG12 VAL 79 HG12 VAL 79 -5.944 2.557 -9.584 634 HG13 VAL 79 HG13 VAL 79 -6.354 1.646 -8.130 635 HG21 VAL 79 HG21 VAL 79 -7.970 1.215 -11.402 636 HG22 VAL 79 HG22 VAL 79 -7.005 -0.169 -11.916 637 HG23 VAL 79 HG23 VAL 79 -6.286 1.440 -11.873 638 H THR 80 HN THR 80 -4.725 -2.112 -8.456 639 HA THR 80 HA THR 80 -5.558 -3.995 -10.532 640 HB THR 80 HB THR 80 -2.939 -4.312 -9.050 641 HG1 THR 80 HG1 THR 80 -3.579 -3.021 -11.426 642 HG21 THR 80 HG21 THR 80 -4.121 -5.833 -11.379 643 HG22 THR 80 HG22 THR 80 -4.011 -6.415 -9.719 644 HG23 THR 80 HG23 THR 80 -2.542 -6.122 -10.649 645 H LEU 81 HN LEU 81 -7.003 -5.315 -9.620 646 HA LEU 81 HA LEU 81 -7.097 -5.725 -6.777 647 HB2 LEU 81 HB2 LEU 81 -9.108 -5.769 -8.288 648 HB3 LEU 81 HB1 LEU 81 -8.525 -7.298 -8.921 649 HG LEU 81 HG LEU 81 -8.618 -8.197 -6.567 650 HD11 LEU 81 HD11 LEU 81 -8.598 -6.082 -5.384 651 HD12 LEU 81 HD12 LEU 81 -10.042 -7.009 -4.975 652 HD13 LEU 81 HD13 LEU 81 -10.152 -5.648 -6.093 653 HD21 LEU 81 HD21 LEU 81 -10.327 -8.708 -8.240 654 HD22 LEU 81 HD22 LEU 81 -11.206 -7.244 -7.797 655 HD23 LEU 81 HD23 LEU 81 -11.036 -8.557 -6.632 656 H VAL 82 HN VAL 82 -5.754 -6.988 -5.757 657 HA VAL 82 HA VAL 82 -3.996 -8.724 -7.277 658 HB VAL 82 HB VAL 82 -3.706 -8.600 -4.346 659 HG11 VAL 82 HG11 VAL 82 -1.801 -8.060 -6.620 660 HG12 VAL 82 HG12 VAL 82 -2.013 -9.609 -5.802 661 HG13 VAL 82 HG13 VAL 82 -1.364 -8.225 -4.920 662 HG21 VAL 82 HG21 VAL 82 -4.537 -6.370 -4.714 663 HG22 VAL 82 HG22 VAL 82 -3.401 -6.130 -6.043 664 HG23 VAL 82 HG23 VAL 82 -2.802 -6.304 -4.392 665 H SER 83 HN SER 83 -6.391 -8.957 -4.719 666 HA SER 83 HA SER 83 -6.732 -11.787 -5.299 667 HB2 SER 83 HB2 SER 83 -5.029 -11.521 -3.409 668 HB3 SER 83 HB1 SER 83 -6.350 -10.866 -2.444 669 HG SER 83 HG SER 83 -7.045 -12.816 -2.118 670 H SER 84 HN SER 84 -8.828 -12.558 -4.621 671 HA SER 84 HA SER 84 -10.692 -10.561 -3.622 672 HB2 SER 84 HB2 SER 84 -10.634 -10.067 -6.011 673 HB3 SER 84 HB1 SER 84 -10.942 -11.759 -6.393 674 HG SER 84 HG SER 84 -12.917 -10.898 -6.487 675 H ALA 85 HN ALA 85 -12.601 -11.413 -2.844 676 HA ALA 85 HA ALA 85 -12.704 -14.338 -2.639 677 HB1 ALA 85 HB1 ALA 85 -14.217 -13.980 -0.752 678 HB2 ALA 85 HB2 ALA 85 -14.143 -12.238 -1.018 679 HB3 ALA 85 HB3 ALA 85 -12.697 -13.115 -0.524 680 H GLY 86 HN GLY 86 -14.184 -11.684 -4.173 681 HA2 GLY 86 HA2 GLY 86 -15.762 -12.304 -5.986 682 HA3 GLY 86 HA1 GLY 86 -16.566 -13.315 -4.793 683 H LEU 87 HN LEU 87 -15.846 -9.968 -5.674 684 HA LEU 87 HA LEU 87 -18.128 -9.142 -3.996 685 HB2 LEU 87 HB2 LEU 87 -15.866 -7.327 -4.810 686 HB3 LEU 87 HB1 LEU 87 -17.110 -7.008 -3.633 687 HG LEU 87 HG LEU 87 -15.232 -7.364 -2.326 688 HD11 LEU 87 HD11 LEU 87 -16.545 -10.060 -2.539 689 HD12 LEU 87 HD12 LEU 87 -17.061 -8.711 -1.526 690 HD13 LEU 87 HD13 LEU 87 -15.522 -9.514 -1.210 691 HD21 LEU 87 HD21 LEU 87 -13.757 -8.125 -4.133 692 HD22 LEU 87 HD22 LEU 87 -14.470 -9.735 -4.024 693 HD23 LEU 87 HD23 LEU 87 -13.566 -9.078 -2.663 694 HA PRO 88 HA PRO 88 -19.336 -8.207 -8.311 695 HB2 PRO 88 HB2 PRO 88 -22.048 -8.793 -7.504 696 HB3 PRO 88 HB1 PRO 88 -21.015 -9.688 -8.619 697 HG2 PRO 88 HG2 PRO 88 -21.797 -10.648 -6.186 698 HG3 PRO 88 HG1 PRO 88 -20.292 -11.128 -6.992 699 HD2 PRO 88 HD2 PRO 88 -20.709 -9.130 -4.791 700 HD3 PRO 88 HD1 PRO 88 -19.424 -10.347 -4.977 701 H SER 89 HN SER 89 -22.139 -7.577 -6.257 702 HA SER 89 HA SER 89 -22.429 -4.919 -7.232 703 HB2 SER 89 HB2 SER 89 -24.244 -4.775 -5.508 704 HB3 SER 89 HB1 SER 89 -24.386 -6.179 -6.565 705 HG SER 89 HG SER 89 -23.879 -7.492 -4.944 706 H LEU 90 HN LEU 90 -20.593 -6.318 -4.788 707 HA LEU 90 HA LEU 90 -20.583 -4.182 -2.895 708 HB2 LEU 90 HB2 LEU 90 -18.542 -6.387 -3.220 709 HB3 LEU 90 HB1 LEU 90 -18.881 -5.449 -1.778 710 HG LEU 90 HG LEU 90 -20.921 -7.281 -3.019 711 HD11 LEU 90 HD11 LEU 90 -18.811 -8.472 -2.427 712 HD12 LEU 90 HD12 LEU 90 -20.230 -8.990 -1.506 713 HD13 LEU 90 HD13 LEU 90 -19.037 -7.923 -0.762 714 HD21 LEU 90 HD21 LEU 90 -21.804 -5.591 -1.516 715 HD22 LEU 90 HD22 LEU 90 -20.620 -6.040 -0.290 716 HD23 LEU 90 HD23 LEU 90 -21.881 -7.180 -0.753 717 H ASP 91 HN ASP 91 -18.568 -5.176 -5.587 718 HA ASP 91 HA ASP 91 -16.184 -3.915 -4.947 719 HB2 ASP 91 HB2 ASP 91 -16.603 -5.584 -6.793 720 HB3 ASP 91 HB1 ASP 91 -17.255 -4.261 -7.748 721 H ARG 92 HN ARG 92 -18.982 -2.629 -6.679 722 HA ARG 92 HA ARG 92 -17.789 -0.407 -7.808 723 HB2 ARG 92 HB2 ARG 92 -20.061 0.579 -7.919 724 HB3 ARG 92 HB1 ARG 92 -19.979 -1.078 -8.499 725 HG2 ARG 92 HG2 ARG 92 -20.777 -1.759 -6.176 726 HG3 ARG 92 HG1 ARG 92 -21.163 -0.053 -5.940 727 HD2 ARG 92 HD2 ARG 92 -23.123 -1.265 -6.692 728 HD3 ARG 92 HD1 ARG 92 -22.604 -0.122 -7.931 729 HE ARG 92 HE ARG 92 -21.424 -2.207 -8.899 730 HH11 ARG 92 HH11 ARG 92 -24.540 -2.162 -7.280 731 HH12 ARG 92 HH12 ARG 92 -25.128 -3.581 -8.096 732 HH21 ARG 92 HH21 ARG 92 -22.191 -4.072 -9.970 733 HH22 ARG 92 HH22 ARG 92 -23.795 -4.654 -9.636 734 H GLU 93 HN GLU 93 -19.450 -0.515 -4.622 735 HA GLU 93 HA GLU 93 -18.836 2.263 -4.196 736 HB2 GLU 93 HB2 GLU 93 -20.894 1.022 -3.304 737 HB3 GLU 93 HB1 GLU 93 -19.821 0.413 -2.047 738 HG2 GLU 93 HG2 GLU 93 -19.261 2.735 -1.442 739 HG3 GLU 93 HG1 GLU 93 -20.409 3.301 -2.652 740 H ILE 94 HN ILE 94 -17.673 -0.801 -2.777 741 HA ILE 94 HA ILE 94 -16.018 0.410 -0.861 742 HB ILE 94 HB ILE 94 -14.907 -1.745 -0.610 743 HG12 ILE 94 HG12 ILE 94 -16.548 -2.653 -2.989 744 HG13 ILE 94 HG11 ILE 94 -14.812 -2.364 -3.017 745 HG21 ILE 94 HG21 ILE 94 -17.891 -1.987 -0.960 746 HG22 ILE 94 HG22 ILE 94 -17.054 -1.377 0.466 747 HG23 ILE 94 HG23 ILE 94 -16.874 -3.067 -0.004 748 HD11 ILE 94 HD11 ILE 94 -15.301 -4.730 -2.836 749 HD12 ILE 94 HD12 ILE 94 -16.234 -4.440 -1.367 750 HD13 ILE 94 HD13 ILE 94 -14.495 -4.147 -1.378 751 H GLN 95 HN GLN 95 -15.392 -0.567 -4.209 752 HA GLN 95 HA GLN 95 -12.629 0.192 -4.010 753 HB2 GLN 95 HB2 GLN 95 -14.270 -0.402 -6.453 754 HB3 GLN 95 HB1 GLN 95 -12.546 -0.275 -6.370 755 HG2 GLN 95 HG2 GLN 95 -14.167 -2.341 -4.930 756 HG3 GLN 95 HG1 GLN 95 -13.317 -2.604 -6.451 757 HE21 GLN 95 HE21 GLN 95 -13.008 -3.976 -3.954 758 HE22 GLN 95 HE22 GLN 95 -11.366 -3.757 -3.459 759 H ALA 96 HN ALA 96 -15.638 1.683 -5.060 760 HA ALA 96 HA ALA 96 -14.557 4.004 -6.173 761 HB1 ALA 96 HB1 ALA 96 -16.957 3.828 -4.341 762 HB2 ALA 96 HB2 ALA 96 -16.980 3.605 -6.091 763 HB3 ALA 96 HB3 ALA 96 -16.564 5.177 -5.407 764 H LEU 97 HN LEU 97 -15.125 3.096 -2.826 765 HA LEU 97 HA LEU 97 -14.213 5.394 -1.594 766 HB2 LEU 97 HB2 LEU 97 -15.649 3.667 -0.619 767 HB3 LEU 97 HB1 LEU 97 -14.317 2.524 -0.677 768 HG LEU 97 HG LEU 97 -13.424 4.789 0.648 769 HD11 LEU 97 HD11 LEU 97 -14.968 4.889 2.564 770 HD12 LEU 97 HD12 LEU 97 -16.048 3.773 1.723 771 HD13 LEU 97 HD13 LEU 97 -15.751 5.381 1.061 772 HD21 LEU 97 HD21 LEU 97 -13.422 3.102 2.598 773 HD22 LEU 97 HD22 LEU 97 -12.437 2.773 1.174 774 HD23 LEU 97 HD23 LEU 97 -13.993 1.955 1.378 775 H VAL 98 HN VAL 98 -12.561 2.235 -1.972 776 HA VAL 98 HA VAL 98 -10.054 3.438 -1.136 777 HB VAL 98 HB VAL 98 -10.679 0.580 -1.885 778 HG11 VAL 98 HG11 VAL 98 -8.519 0.032 -0.887 779 HG12 VAL 98 HG12 VAL 98 -8.203 1.744 -0.606 780 HG13 VAL 98 HG13 VAL 98 -8.318 1.128 -2.255 781 HG21 VAL 98 HG21 VAL 98 -11.831 1.320 0.137 782 HG22 VAL 98 HG22 VAL 98 -10.302 1.887 0.810 783 HG23 VAL 98 HG23 VAL 98 -10.556 0.165 0.525 784 H LYS 99 HN LYS 99 -11.229 1.747 -4.050 785 HA LYS 99 HA LYS 99 -8.704 1.828 -5.356 786 HB2 LYS 99 HB2 LYS 99 -10.390 0.083 -5.826 787 HB3 LYS 99 HB1 LYS 99 -11.455 1.289 -6.533 788 HG2 LYS 99 HG2 LYS 99 -9.569 1.748 -8.184 789 HG3 LYS 99 HG1 LYS 99 -8.826 0.267 -7.577 790 HD2 LYS 99 HD2 LYS 99 -11.558 0.516 -8.842 791 HD3 LYS 99 HD1 LYS 99 -10.123 -0.181 -9.591 792 HE2 LYS 99 HE2 LYS 99 -10.105 -1.993 -8.026 793 HE3 LYS 99 HE1 LYS 99 -11.383 -1.246 -7.068 794 HZ1 LYS 99 HZ1 LYS 99 -12.427 -2.894 -8.345 795 HZ2 LYS 99 HZ2 LYS 99 -11.592 -2.473 -9.755 796 HZ3 LYS 99 HZ3 LYS 99 -12.798 -1.444 -9.143 797 H ARG 100 HN ARG 100 -11.464 4.026 -5.282 798 HA ARG 100 HA ARG 100 -10.328 5.569 -7.473 799 HB2 ARG 100 HB2 ARG 100 -12.755 5.437 -7.347 800 HB3 ARG 100 HB1 ARG 100 -12.732 6.105 -5.721 801 HG2 ARG 100 HG2 ARG 100 -13.387 7.774 -7.371 802 HG3 ARG 100 HG1 ARG 100 -11.869 8.210 -6.578 803 HD2 ARG 100 HD2 ARG 100 -10.650 7.233 -8.508 804 HD3 ARG 100 HD1 ARG 100 -12.202 6.981 -9.306 805 HE ARG 100 HE ARG 100 -12.422 9.522 -9.007 806 HH11 ARG 100 HH11 ARG 100 -9.409 7.816 -9.517 807 HH12 ARG 100 HH12 ARG 100 -8.655 9.147 -10.355 808 HH21 ARG 100 HH21 ARG 100 -11.436 11.266 -10.142 809 HH22 ARG 100 HH22 ARG 100 -9.800 11.091 -10.702 810 H ALA 101 HN ALA 101 -10.767 5.809 -3.970 811 HA ALA 101 HA ALA 101 -9.206 8.265 -3.934 812 HB1 ALA 101 HB1 ALA 101 -9.756 8.477 -1.650 813 HB2 ALA 101 HB2 ALA 101 -10.289 6.796 -1.534 814 HB3 ALA 101 HB3 ALA 101 -11.233 7.965 -2.473 815 H SER 102 HN SER 102 -7.266 7.081 -4.787 816 HA SER 102 HA SER 102 -5.884 5.880 -2.489 817 HB2 SER 102 HB2 SER 102 -5.105 5.692 -5.402 818 HB3 SER 102 HB1 SER 102 -4.365 4.831 -4.056 819 HG SER 102 HG SER 102 -7.032 4.408 -4.091 820 HA PRO 103 HA PRO 103 -3.385 9.636 -2.675 821 HB2 PRO 103 HB2 PRO 103 -4.276 10.384 -0.089 822 HB3 PRO 103 HB1 PRO 103 -4.875 11.038 -1.632 823 HG2 PRO 103 HG2 PRO 103 -6.374 9.527 0.172 824 HG3 PRO 103 HG1 PRO 103 -6.783 9.787 -1.535 825 HD2 PRO 103 HD2 PRO 103 -5.321 7.479 -0.274 826 HD3 PRO 103 HD1 PRO 103 -6.630 7.454 -1.480 827 H LEU 104 HN LEU 104 -1.784 10.343 -0.886 828 HA LEU 104 HA LEU 104 -1.314 8.258 1.107 829 HB2 LEU 104 HB2 LEU 104 0.719 9.363 -0.812 830 HB3 LEU 104 HB1 LEU 104 1.206 8.739 0.758 831 HG LEU 104 HG LEU 104 -0.311 7.169 -1.328 832 HD11 LEU 104 HD11 LEU 104 2.018 7.670 -1.981 833 HD12 LEU 104 HD12 LEU 104 1.716 5.954 -1.710 834 HD13 LEU 104 HD13 LEU 104 2.569 6.901 -0.488 835 HD21 LEU 104 HD21 LEU 104 -0.815 6.467 0.951 836 HD22 LEU 104 HD22 LEU 104 0.909 6.318 1.296 837 HD23 LEU 104 HD23 LEU 104 0.148 5.252 0.113 838 HA PRO 105 HA PRO 105 -1.526 11.850 3.625 839 HB2 PRO 105 HB2 PRO 105 -0.990 10.675 6.003 840 HB3 PRO 105 HB1 PRO 105 -2.534 10.477 5.167 841 HG2 PRO 105 HG2 PRO 105 -0.222 8.599 5.352 842 HG3 PRO 105 HG1 PRO 105 -1.952 8.262 5.338 843 HD2 PRO 105 HD2 PRO 105 -0.313 7.969 3.157 844 HD3 PRO 105 HD1 PRO 105 -2.074 8.208 3.082 845 H THR 106 HN THR 106 1.216 9.747 3.568 846 HA THR 106 HA THR 106 2.942 12.061 4.033 847 HB THR 106 HB THR 106 3.106 10.822 6.077 848 HG1 THR 106 HG1 THR 106 5.412 9.735 5.171 849 HG21 THR 106 HG21 THR 106 3.716 8.453 6.175 850 HG22 THR 106 HG22 THR 106 3.659 8.361 4.415 851 HG23 THR 106 HG23 THR 106 2.185 8.685 5.328 852 HA PRO 107 HA PRO 107 4.175 10.792 -0.084 853 HB2 PRO 107 HB2 PRO 107 6.332 12.746 0.527 854 HB3 PRO 107 HB1 PRO 107 5.242 12.667 -0.862 855 HG2 PRO 107 HG2 PRO 107 4.891 14.507 1.026 856 HG3 PRO 107 HG1 PRO 107 3.501 13.698 0.276 857 HD2 PRO 107 HD2 PRO 107 4.752 13.225 2.954 858 HD3 PRO 107 HD1 PRO 107 3.037 13.233 2.495 859 HA PRO 108 HA PRO 108 7.390 8.031 1.596 860 HB2 PRO 108 HB2 PRO 108 7.016 6.036 -0.167 861 HB3 PRO 108 HB1 PRO 108 5.905 6.292 1.187 862 HG2 PRO 108 HG2 PRO 108 5.628 7.132 -1.679 863 HG3 PRO 108 HG1 PRO 108 4.424 6.363 -0.629 864 HD2 PRO 108 HD2 PRO 108 4.469 9.037 -1.101 865 HD3 PRO 108 HD1 PRO 108 3.906 8.350 0.434 866 H ALA 109 HN ALA 109 8.509 10.053 0.519 867 HA ALA 109 HA ALA 109 9.526 9.927 -2.076 868 HB1 ALA 109 HB1 ALA 109 10.808 11.109 0.388 869 HB2 ALA 109 HB2 ALA 109 9.701 11.934 -0.710 870 HB3 ALA 109 HB3 ALA 109 11.294 11.433 -1.276 871 H ASP 110 HN ASP 110 10.677 8.550 0.937 872 HA ASP 110 HA ASP 110 13.150 7.613 -0.095 873 HB2 ASP 110 HB2 ASP 110 11.631 6.770 2.380 874 HB3 ASP 110 HB1 ASP 110 13.310 6.365 2.028 875 H ALA 111 HN ALA 111 10.162 6.650 -0.905 876 HA ALA 111 HA ALA 111 10.967 3.845 -1.261 877 HB1 ALA 111 HB1 ALA 111 8.617 3.281 -1.442 878 HB2 ALA 111 HB2 ALA 111 8.177 4.984 -1.266 879 HB3 ALA 111 HB3 ALA 111 8.932 4.125 0.079 880 H TYR 112 HN TYR 112 9.788 6.745 -2.910 881 HA TYR 112 HA TYR 112 9.894 5.183 -5.388 882 HB2 TYR 112 HB2 TYR 112 8.280 6.809 -6.386 883 HB3 TYR 112 HB1 TYR 112 7.669 5.699 -5.185 884 HD1 TYR 112 HD2 TYR 112 9.411 8.952 -4.599 885 HD2 TYR 112 HD1 TYR 112 5.800 6.722 -4.430 886 HE1 TYR 112 HE2 TYR 112 8.328 10.796 -3.382 887 HE2 TYR 112 HE1 TYR 112 4.708 8.542 -3.227 888 HH TYR 112 HH TYR 112 5.328 10.439 -1.822 889 H VAL 113 HN VAL 113 11.836 7.073 -3.944 890 HA VAL 113 HA VAL 113 12.514 8.886 -6.055 891 HB VAL 113 HB VAL 113 14.873 8.785 -5.014 892 HG11 VAL 113 HG11 VAL 113 14.210 10.221 -3.146 893 HG12 VAL 113 HG12 VAL 113 12.540 9.682 -3.328 894 HG13 VAL 113 HG13 VAL 113 13.316 10.607 -4.614 895 HG21 VAL 113 HG21 VAL 113 14.561 6.609 -3.876 896 HG22 VAL 113 HG22 VAL 113 13.376 7.365 -2.809 897 HG23 VAL 113 HG23 VAL 113 15.058 7.894 -2.775 898 H ASN 114 HN ASN 114 12.418 7.850 -7.910 899 HA ASN 114 HA ASN 114 14.254 6.422 -9.238 900 HB2 ASN 114 HB2 ASN 114 14.016 4.106 -8.892 901 HB3 ASN 114 HB1 ASN 114 13.925 4.722 -7.249 902 HD21 ASN 114 HD21 ASN 114 11.912 4.680 -6.163 903 HD22 ASN 114 HD22 ASN 114 10.602 3.707 -6.727 904 H GLY 115 HN GLY 115 10.949 6.784 -8.292 905 HA2 GLY 115 HA2 GLY 115 9.885 7.485 -10.710 906 HA3 GLY 115 HA1 GLY 115 9.781 5.732 -10.679 907 H THR 116 HN THR 116 8.569 4.734 -8.908 908 HA THR 116 HA THR 116 6.548 6.433 -7.674 909 HB THR 116 HB THR 116 4.817 4.771 -8.759 910 HG1 THR 116 HG1 THR 116 7.036 4.063 -10.008 911 HG21 THR 116 HG21 THR 116 4.757 7.185 -9.050 912 HG22 THR 116 HG22 THR 116 4.440 6.370 -10.582 913 HG23 THR 116 HG23 THR 116 6.024 7.085 -10.275 914 H VAL 117 HN VAL 117 4.990 5.103 -6.342 915 HA VAL 117 HA VAL 117 6.288 2.674 -5.316 916 HB VAL 117 HB VAL 117 4.867 2.941 -3.293 917 HG11 VAL 117 HG11 VAL 117 7.131 3.725 -3.220 918 HG12 VAL 117 HG12 VAL 117 6.090 4.836 -2.324 919 HG13 VAL 117 HG13 VAL 117 6.656 5.265 -3.939 920 HG21 VAL 117 HG21 VAL 117 3.037 4.238 -4.187 921 HG22 VAL 117 HG22 VAL 117 4.119 5.593 -4.522 922 HG23 VAL 117 HG23 VAL 117 3.792 5.112 -2.855 923 H GLU 118 HN GLU 118 5.404 0.814 -5.904 924 HA GLU 118 HA GLU 118 2.487 0.707 -6.240 925 HB2 GLU 118 HB2 GLU 118 2.971 -1.480 -7.447 926 HB3 GLU 118 HB1 GLU 118 3.450 -0.012 -8.287 927 HG2 GLU 118 HG2 GLU 118 5.726 -0.365 -7.786 928 HG3 GLU 118 HG1 GLU 118 5.342 -1.639 -6.630 929 H LEU 119 HN LEU 119 1.422 -0.261 -4.629 930 HA LEU 119 HA LEU 119 2.809 -2.308 -3.059 931 HB2 LEU 119 HB2 LEU 119 2.029 -1.222 -0.960 932 HB3 LEU 119 HB1 LEU 119 3.263 -0.326 -1.825 933 HG LEU 119 HG LEU 119 0.620 0.545 -2.620 934 HD11 LEU 119 HD11 LEU 119 -0.066 -0.175 -0.438 935 HD12 LEU 119 HD12 LEU 119 0.004 1.588 -0.498 936 HD13 LEU 119 HD13 LEU 119 1.289 0.682 0.302 937 HD21 LEU 119 HD21 LEU 119 2.880 1.961 -1.210 938 HD22 LEU 119 HD22 LEU 119 1.537 2.721 -2.064 939 HD23 LEU 119 HD23 LEU 119 2.728 1.778 -2.959 940 H THR 120 HN THR 120 1.539 -3.831 -2.162 941 HA THR 120 HA THR 120 -1.264 -3.875 -2.977 942 HB THR 120 HB THR 120 0.512 -6.039 -1.828 943 HG1 THR 120 HG1 THR 120 1.128 -5.728 -3.908 944 HG21 THR 120 HG21 THR 120 -2.303 -6.234 -2.907 945 HG22 THR 120 HG22 THR 120 -1.839 -6.358 -1.210 946 HG23 THR 120 HG23 THR 120 -1.305 -7.583 -2.364 947 H LEU 121 HN LEU 121 -2.715 -3.131 -1.554 948 HA LEU 121 HA LEU 121 -2.270 -3.746 1.297 949 HB2 LEU 121 HB2 LEU 121 -3.860 -1.446 0.157 950 HB3 LEU 121 HB1 LEU 121 -3.595 -1.783 1.857 951 HG LEU 121 HG LEU 121 -1.513 -0.923 -0.150 952 HD11 LEU 121 HD11 LEU 121 -2.399 0.474 2.350 953 HD12 LEU 121 HD12 LEU 121 -3.142 0.765 0.781 954 HD13 LEU 121 HD13 LEU 121 -1.426 1.107 1.017 955 HD21 LEU 121 HD21 LEU 121 0.040 -0.918 1.744 956 HD22 LEU 121 HD22 LEU 121 -0.564 -2.541 1.401 957 HD23 LEU 121 HD23 LEU 121 -1.209 -1.628 2.767 958 HA PRO 122 HA PRO 122 -6.009 -6.115 0.674 959 HB2 PRO 122 HB2 PRO 122 -5.843 -6.732 3.518 960 HB3 PRO 122 HB1 PRO 122 -5.661 -7.814 2.136 961 HG2 PRO 122 HG2 PRO 122 -3.593 -7.130 3.756 962 HG3 PRO 122 HG1 PRO 122 -3.387 -7.525 2.040 963 HD2 PRO 122 HD2 PRO 122 -3.484 -4.844 3.374 964 HD3 PRO 122 HD1 PRO 122 -2.432 -5.412 2.058 965 H ILE 123 HN ILE 123 -7.898 -5.083 0.591 966 HA ILE 123 HA ILE 123 -8.654 -3.358 2.841 967 HB ILE 123 HB ILE 123 -10.220 -2.238 1.414 968 HG12 ILE 123 HG12 ILE 123 -9.533 -4.138 -0.828 969 HG13 ILE 123 HG11 ILE 123 -10.974 -4.302 0.173 970 HG21 ILE 123 HG21 ILE 123 -8.757 -1.506 -0.527 971 HG22 ILE 123 HG22 ILE 123 -7.587 -2.707 0.028 972 HG23 ILE 123 HG23 ILE 123 -8.039 -1.371 1.085 973 HD11 ILE 123 HD11 ILE 123 -11.495 -3.200 -1.919 974 HD12 ILE 123 HD12 ILE 123 -10.295 -1.953 -1.576 975 HD13 ILE 123 HD13 ILE 123 -11.730 -2.101 -0.560 976 H ASP 124 HN ASP 124 -10.033 -4.245 4.295 977 HA ASP 124 HA ASP 124 -11.670 -6.481 3.311 978 HB2 ASP 124 HB2 ASP 124 -11.465 -7.535 5.528 979 HB3 ASP 124 HB1 ASP 124 -9.910 -7.346 4.730 980 H PHE 125 HN PHE 125 -13.690 -6.132 3.322 981 HA PHE 125 HA PHE 125 -14.945 -4.795 5.625 982 HB2 PHE 125 HB2 PHE 125 -16.023 -5.245 2.826 983 HB3 PHE 125 HB1 PHE 125 -16.910 -4.485 4.139 984 HD1 PHE 125 HD2 PHE 125 -14.254 -4.101 1.669 985 HD2 PHE 125 HD1 PHE 125 -16.362 -2.223 4.855 986 HE1 PHE 125 HE2 PHE 125 -13.338 -1.926 0.984 987 HE2 PHE 125 HE1 PHE 125 -15.450 -0.042 4.172 988 HZ PHE 125 HZ PHE 125 -13.936 0.110 2.235 989 H SER 126 HN SER 126 -16.343 -6.054 6.843 990 HA SER 126 HA SER 126 -15.822 -8.786 6.893 991 HB2 SER 126 HB2 SER 126 -18.259 -7.470 8.095 992 HB3 SER 126 HB1 SER 126 -17.411 -8.908 8.671 993 HG SER 126 HG SER 126 -15.559 -7.491 8.996 994 H LEU 127 HN LEU 127 -16.293 -10.047 5.208 995 HA LEU 127 HA LEU 127 -18.805 -9.884 3.793 996 HB2 LEU 127 HB2 LEU 127 -16.262 -11.393 3.501 997 HB3 LEU 127 HB1 LEU 127 -17.703 -12.105 2.803 998 HG LEU 127 HG LEU 127 -16.639 -9.356 2.138 999 HD11 LEU 127 HD11 LEU 127 -16.068 -10.376 -0.023 1000 HD12 LEU 127 HD12 LEU 127 -16.518 -11.957 0.622 1001 HD13 LEU 127 HD13 LEU 127 -15.153 -11.079 1.314 1002 HD21 LEU 127 HD21 LEU 127 -18.280 -9.370 0.369 1003 HD22 LEU 127 HD22 LEU 127 -19.089 -9.620 1.918 1004 HD23 LEU 127 HD23 LEU 127 -18.814 -10.984 0.835 1005 H ARG 128 HN ARG 128 -20.500 -10.585 4.969 1006 HA ARG 128 HA ARG 128 -20.585 -13.435 5.460 1007 HB2 ARG 128 HB2 ARG 128 -21.615 -13.055 7.750 1008 HB3 ARG 128 HB1 ARG 128 -19.886 -12.792 7.612 1009 HG2 ARG 128 HG2 ARG 128 -20.571 -11.016 8.913 1010 HG3 ARG 128 HG1 ARG 128 -20.503 -10.312 7.298 1011 HD2 ARG 128 HD2 ARG 128 -22.936 -10.672 7.079 1012 HD3 ARG 128 HD1 ARG 128 -22.972 -11.280 8.735 1013 HE ARG 128 HE ARG 128 -21.813 -8.847 9.005 1014 HH11 ARG 128 HH11 ARG 128 -24.797 -9.951 7.519 1015 HH12 ARG 128 HH12 ARG 128 -25.596 -8.419 7.709 1016 HH21 ARG 128 HH21 ARG 128 -22.896 -6.864 9.303 1017 HH22 ARG 128 HH22 ARG 128 -24.528 -6.681 8.727 1018 H GLY 129 HN GLY 129 -21.740 -11.556 3.582 1019 HA2 GLY 129 HA2 GLY 129 -24.529 -12.333 3.946 1020 HA3 GLY 129 HA1 GLY 129 -24.196 -10.616 3.796 1021 H ALA 130 HN ALA 130 -23.019 -9.929 1.814 1022 HA ALA 130 HA ALA 130 -24.158 -11.396 -0.455 1023 HB1 ALA 130 HB1 ALA 130 -23.113 -8.566 -0.332 1024 HB2 ALA 130 HB2 ALA 130 -24.808 -9.045 -0.215 1025 HB3 ALA 130 HB3 ALA 130 -23.914 -9.321 -1.710 1026 H GLY 131 HN GLY 131 -21.819 -12.393 0.757 1027 HA2 GLY 131 HA2 GLY 131 -20.219 -12.903 -1.469 1028 HA3 GLY 131 HA1 GLY 131 -19.448 -11.623 -0.541 1029 H PHE 132 HN PHE 132 -19.859 -14.938 -0.872 1030 HA PHE 132 HA PHE 132 -18.627 -15.387 1.746 1031 HB2 PHE 132 HB2 PHE 132 -20.445 -17.123 0.082 1032 HB3 PHE 132 HB1 PHE 132 -19.534 -17.720 1.449 1033 HD1 PHE 132 HD2 PHE 132 -19.919 -16.564 3.717 1034 HD2 PHE 132 HD1 PHE 132 -22.532 -16.170 0.384 1035 HE1 PHE 132 HE2 PHE 132 -21.728 -15.844 5.222 1036 HE2 PHE 132 HE1 PHE 132 -24.340 -15.445 1.882 1037 HZ PHE 132 HZ PHE 132 -23.939 -15.282 4.305 Start of MODEL 5 1 H1 LYS 2 HT1 LYS 2 -0.166 -40.917 16.377 2 H2 LYS 2 HT2 LYS 2 0.628 -42.174 15.566 3 H3 LYS 2 HT3 LYS 2 -0.694 -41.395 14.837 4 HA LYS 2 HA LYS 2 0.565 -39.324 14.772 5 HB2 LYS 2 HB2 LYS 2 2.753 -41.115 15.824 6 HB3 LYS 2 HB1 LYS 2 3.049 -39.541 15.099 7 HG2 LYS 2 HG2 LYS 2 1.738 -38.478 16.861 8 HG3 LYS 2 HG1 LYS 2 1.426 -40.059 17.584 9 HD2 LYS 2 HD2 LYS 2 3.808 -40.388 17.935 10 HD3 LYS 2 HD1 LYS 2 4.148 -38.837 17.170 11 HE2 LYS 2 HE2 LYS 2 2.967 -37.673 18.942 12 HE3 LYS 2 HE1 LYS 2 2.523 -39.212 19.682 13 HZ1 LYS 2 HZ1 LYS 2 4.770 -39.658 20.205 14 HZ2 LYS 2 HZ2 LYS 2 4.474 -38.063 20.701 15 HZ3 LYS 2 HZ3 LYS 2 5.335 -38.359 19.266 16 H VAL 3 HN VAL 3 1.090 -38.859 12.748 17 HA VAL 3 HA VAL 3 2.280 -40.978 11.069 18 HB VAL 3 HB VAL 3 0.674 -38.606 10.090 19 HG11 VAL 3 HG11 VAL 3 1.602 -41.116 8.698 20 HG12 VAL 3 HG12 VAL 3 2.247 -39.491 8.464 21 HG13 VAL 3 HG13 VAL 3 0.590 -39.860 7.984 22 HG21 VAL 3 HG21 VAL 3 -0.766 -40.073 11.405 23 HG22 VAL 3 HG22 VAL 3 -0.238 -41.460 10.453 24 HG23 VAL 3 HG23 VAL 3 -1.163 -40.167 9.690 25 H GLN 4 HN GLN 4 2.191 -37.558 11.890 26 HA GLN 4 HA GLN 4 4.915 -37.254 10.804 27 HB2 GLN 4 HB2 GLN 4 2.614 -35.331 11.004 28 HB3 GLN 4 HB1 GLN 4 4.267 -34.740 10.911 29 HG2 GLN 4 HG2 GLN 4 3.040 -36.587 8.880 30 HG3 GLN 4 HG1 GLN 4 3.043 -34.829 8.739 31 HE21 GLN 4 HE21 GLN 4 5.007 -33.748 8.442 32 HE22 GLN 4 HE22 GLN 4 6.419 -34.570 7.860 33 H GLU 5 HN GLU 5 6.025 -37.864 12.655 34 HA GLU 5 HA GLU 5 5.542 -36.521 15.166 35 HB2 GLU 5 HB2 GLU 5 6.389 -38.803 15.207 36 HB3 GLU 5 HB1 GLU 5 7.787 -38.339 14.251 37 HG2 GLU 5 HG2 GLU 5 8.309 -38.657 16.631 38 HG3 GLU 5 HG1 GLU 5 8.657 -37.025 16.068 39 H GLN 6 HN GLN 6 5.645 -34.378 14.302 40 HA GLN 6 HA GLN 6 8.238 -33.475 13.302 41 HB2 GLN 6 HB2 GLN 6 5.935 -32.947 12.230 42 HB3 GLN 6 HB1 GLN 6 5.770 -31.774 13.526 43 HG2 GLN 6 HG2 GLN 6 6.581 -30.649 11.596 44 HG3 GLN 6 HG1 GLN 6 7.890 -30.727 12.775 45 HE21 GLN 6 HE21 GLN 6 9.717 -31.912 12.305 46 HE22 GLN 6 HE22 GLN 6 10.018 -32.591 10.737 47 H SER 7 HN SER 7 8.459 -34.126 15.891 48 HA SER 7 HA SER 7 8.017 -31.927 17.656 49 HB2 SER 7 HB2 SER 7 9.977 -33.397 18.850 50 HB3 SER 7 HB1 SER 7 8.257 -33.780 18.948 51 HG SER 7 HG SER 7 8.507 -35.402 17.594 52 H VAL 8 HN VAL 8 10.603 -32.988 15.571 53 HA VAL 8 HA VAL 8 12.210 -30.657 16.343 54 HB VAL 8 HB VAL 8 14.046 -31.700 15.058 55 HG11 VAL 8 HG11 VAL 8 12.830 -33.511 17.139 56 HG12 VAL 8 HG12 VAL 8 13.872 -32.123 17.449 57 HG13 VAL 8 HG13 VAL 8 14.511 -33.536 16.608 58 HG21 VAL 8 HG21 VAL 8 13.862 -33.993 14.259 59 HG22 VAL 8 HG22 VAL 8 12.687 -32.957 13.447 60 HG23 VAL 8 HG23 VAL 8 12.165 -34.039 14.738 61 H GLY 9 HN GLY 9 13.137 -29.345 14.623 62 HA2 GLY 9 HA2 GLY 9 12.835 -29.342 11.977 63 HA3 GLY 9 HA1 GLY 9 11.195 -28.951 12.483 64 H ALA 10 HN ALA 10 14.530 -27.873 12.489 65 HA ALA 10 HA ALA 10 13.553 -25.132 12.856 66 HB1 ALA 10 HB1 ALA 10 15.398 -24.602 14.343 67 HB2 ALA 10 HB2 ALA 10 15.985 -26.262 14.241 68 HB3 ALA 10 HB3 ALA 10 14.434 -25.919 15.010 69 HA PRO 11 HA PRO 11 16.178 -24.908 9.135 70 HB2 PRO 11 HB2 PRO 11 14.697 -22.369 8.876 71 HB3 PRO 11 HB1 PRO 11 14.863 -23.691 7.716 72 HG2 PRO 11 HG2 PRO 11 12.548 -23.223 8.987 73 HG3 PRO 11 HG1 PRO 11 13.085 -24.869 8.606 74 HD2 PRO 11 HD2 PRO 11 13.211 -23.389 11.207 75 HD3 PRO 11 HD1 PRO 11 12.772 -25.082 10.895 76 HA PRO 12 HA PRO 12 19.292 -22.451 11.078 77 HB2 PRO 12 HB2 PRO 12 20.534 -21.520 8.775 78 HB3 PRO 12 HB1 PRO 12 20.856 -23.076 9.546 79 HG2 PRO 12 HG2 PRO 12 19.111 -22.439 7.212 80 HG3 PRO 12 HG1 PRO 12 20.174 -23.834 7.473 81 HD2 PRO 12 HD2 PRO 12 17.521 -24.033 7.777 82 HD3 PRO 12 HD1 PRO 12 18.637 -24.903 8.850 83 HA PRO 13 HA PRO 13 16.879 -18.655 10.949 84 HB2 PRO 13 HB2 PRO 13 18.660 -17.923 13.188 85 HB3 PRO 13 HB1 PRO 13 16.897 -18.014 13.136 86 HG2 PRO 13 HG2 PRO 13 18.344 -19.839 14.449 87 HG3 PRO 13 HG1 PRO 13 16.871 -20.288 13.568 88 HD2 PRO 13 HD2 PRO 13 19.738 -20.621 12.767 89 HD3 PRO 13 HD1 PRO 13 18.376 -21.745 12.570 90 H GLY 14 HN GLY 14 17.283 -17.117 9.531 91 HA2 GLY 14 HA2 GLY 14 20.010 -16.038 9.302 92 HA3 GLY 14 HA1 GLY 14 18.741 -15.885 8.093 93 H ARG 15 HN ARG 15 19.616 -13.584 8.285 94 HA ARG 15 HA ARG 15 18.341 -12.165 10.522 95 HB2 ARG 15 HB2 ARG 15 20.425 -11.195 8.552 96 HB3 ARG 15 HB1 ARG 15 19.753 -10.244 9.870 97 HG2 ARG 15 HG2 ARG 15 21.351 -12.776 10.189 98 HG3 ARG 15 HG1 ARG 15 21.969 -11.137 10.398 99 HD2 ARG 15 HD2 ARG 15 20.430 -10.767 12.239 100 HD3 ARG 15 HD1 ARG 15 19.729 -12.367 11.999 101 HE ARG 15 HE ARG 15 22.370 -12.883 12.392 102 HH11 ARG 15 HH11 ARG 15 19.963 -11.078 14.204 103 HH12 ARG 15 HH12 ARG 15 20.695 -11.430 15.744 104 HH21 ARG 15 HH21 ARG 15 23.327 -13.319 14.420 105 HH22 ARG 15 HH22 ARG 15 22.583 -12.704 15.867 106 H ALA 16 HN ALA 16 17.075 -10.285 10.093 107 HA ALA 16 HA ALA 16 15.538 -10.519 7.638 108 HB1 ALA 16 HB1 ALA 16 13.992 -8.973 8.684 109 HB2 ALA 16 HB2 ALA 16 15.136 -8.675 9.993 110 HB3 ALA 16 HB3 ALA 16 14.403 -10.269 9.806 111 H ASP 17 HN ASP 17 17.991 -9.751 6.897 112 HA ASP 17 HA ASP 17 17.924 -6.835 6.622 113 HB2 ASP 17 HB2 ASP 17 20.139 -8.831 6.132 114 HB3 ASP 17 HB1 ASP 17 20.254 -7.133 5.680 115 H LYS 18 HN LYS 18 17.639 -5.842 4.768 116 HA LYS 18 HA LYS 18 17.152 -5.410 2.603 117 HB2 LYS 18 HB2 LYS 18 19.164 -6.941 2.168 118 HB3 LYS 18 HB1 LYS 18 17.984 -8.204 1.838 119 HG2 LYS 18 HG2 LYS 18 16.984 -6.725 0.102 120 HG3 LYS 18 HG1 LYS 18 18.313 -5.598 0.370 121 HD2 LYS 18 HD2 LYS 18 19.851 -7.586 -0.121 122 HD3 LYS 18 HD1 LYS 18 18.408 -8.380 -0.755 123 HE2 LYS 18 HE2 LYS 18 19.627 -5.794 -1.707 124 HE3 LYS 18 HE1 LYS 18 19.604 -7.332 -2.565 125 HZ1 LYS 18 HZ1 LYS 18 17.936 -5.699 -3.342 126 HZ2 LYS 18 HZ2 LYS 18 17.167 -5.802 -1.838 127 HZ3 LYS 18 HZ3 LYS 18 17.256 -7.170 -2.841 128 H THR 19 HN THR 19 16.276 -8.771 3.388 129 HA THR 19 HA THR 19 14.337 -9.924 3.203 130 HB THR 19 HB THR 19 12.987 -7.213 3.155 131 HG1 THR 19 HG1 THR 19 14.185 -7.276 5.020 132 HG21 THR 19 HG21 THR 19 11.488 -9.044 2.560 133 HG22 THR 19 HG22 THR 19 11.099 -8.442 4.172 134 HG23 THR 19 HG23 THR 19 11.997 -9.947 3.985 135 H ALA 20 HN ALA 20 15.307 -10.378 1.057 136 HA ALA 20 HA ALA 20 13.314 -9.864 -1.010 137 HB1 ALA 20 HB1 ALA 20 15.014 -8.121 -1.340 138 HB2 ALA 20 HB2 ALA 20 14.991 -9.273 -2.676 139 HB3 ALA 20 HB3 ALA 20 16.258 -9.365 -1.453 140 H ALA 21 HN ALA 21 12.779 -12.008 -0.617 141 HA ALA 21 HA ALA 21 14.708 -14.111 -1.025 142 HB1 ALA 21 HB1 ALA 21 11.705 -14.223 -0.723 143 HB2 ALA 21 HB2 ALA 21 12.885 -14.405 0.575 144 HB3 ALA 21 HB3 ALA 21 12.790 -15.611 -0.708 145 HA PRO 22 HA PRO 22 14.445 -14.974 -5.352 146 HB2 PRO 22 HB2 PRO 22 12.920 -17.471 -4.739 147 HB3 PRO 22 HB1 PRO 22 14.324 -17.238 -5.789 148 HG2 PRO 22 HG2 PRO 22 14.619 -18.309 -3.374 149 HG3 PRO 22 HG1 PRO 22 15.811 -17.158 -4.004 150 HD2 PRO 22 HD2 PRO 22 13.702 -16.762 -1.938 151 HD3 PRO 22 HD1 PRO 22 15.312 -16.025 -2.066 152 H GLN 23 HN GLN 23 11.449 -15.501 -3.547 153 HA GLN 23 HA GLN 23 9.721 -15.395 -5.796 154 HB2 GLN 23 HB2 GLN 23 9.157 -14.901 -2.868 155 HB3 GLN 23 HB1 GLN 23 7.919 -15.018 -4.108 156 HG2 GLN 23 HG2 GLN 23 8.000 -17.104 -2.998 157 HG3 GLN 23 HG1 GLN 23 8.729 -17.335 -4.585 158 HE21 GLN 23 HE21 GLN 23 9.842 -19.155 -3.919 159 HE22 GLN 23 HE22 GLN 23 11.224 -19.066 -2.871 160 H THR 24 HN THR 24 10.906 -12.937 -3.550 161 HA THR 24 HA THR 24 9.217 -10.908 -4.749 162 HB THR 24 HB THR 24 10.572 -9.407 -3.144 163 HG1 THR 24 HG1 THR 24 12.136 -11.337 -2.925 164 HG21 THR 24 HG21 THR 24 8.832 -11.645 -2.093 165 HG22 THR 24 HG22 THR 24 8.286 -10.073 -2.676 166 HG23 THR 24 HG23 THR 24 9.243 -10.179 -1.199 167 H ARG 25 HN ARG 25 11.200 -12.252 -6.415 168 HA ARG 25 HA ARG 25 13.427 -10.513 -6.803 169 HB2 ARG 25 HB2 ARG 25 13.861 -11.819 -8.826 170 HB3 ARG 25 HB1 ARG 25 13.517 -12.873 -7.461 171 HG2 ARG 25 HG2 ARG 25 11.244 -13.203 -8.272 172 HG3 ARG 25 HG1 ARG 25 11.563 -12.118 -9.628 173 HD2 ARG 25 HD2 ARG 25 13.316 -13.643 -10.419 174 HD3 ARG 25 HD1 ARG 25 12.978 -14.726 -9.068 175 HE ARG 25 HE ARG 25 10.566 -14.432 -10.324 176 HH11 ARG 25 HH11 ARG 25 13.770 -15.457 -11.318 177 HH12 ARG 25 HH12 ARG 25 13.185 -16.524 -12.564 178 HH21 ARG 25 HH21 ARG 25 9.797 -15.852 -11.948 179 HH22 ARG 25 HH22 ARG 25 10.924 -16.764 -12.907 180 H LEU 26 HN LEU 26 10.156 -10.517 -7.948 181 HA LEU 26 HA LEU 26 10.794 -8.247 -9.709 182 HB2 LEU 26 HB2 LEU 26 8.864 -10.501 -10.277 183 HB3 LEU 26 HB1 LEU 26 9.005 -9.047 -11.244 184 HG LEU 26 HG LEU 26 11.200 -11.088 -10.857 185 HD11 LEU 26 HD11 LEU 26 9.328 -11.959 -12.175 186 HD12 LEU 26 HD12 LEU 26 10.765 -11.710 -13.168 187 HD13 LEU 26 HD13 LEU 26 9.432 -10.558 -13.241 188 HD21 LEU 26 HD21 LEU 26 12.339 -9.865 -12.635 189 HD22 LEU 26 HD22 LEU 26 12.044 -8.826 -11.241 190 HD23 LEU 26 HD23 LEU 26 11.027 -8.688 -12.675 191 H THR 27 HN THR 27 9.849 -8.282 -6.966 192 HA THR 27 HA THR 27 7.459 -6.694 -7.327 193 HB THR 27 HB THR 27 7.565 -8.926 -5.287 194 HG1 THR 27 HG1 THR 27 6.645 -8.826 -7.912 195 HG21 THR 27 HG21 THR 27 5.603 -6.801 -6.004 196 HG22 THR 27 HG22 THR 27 6.211 -7.243 -4.410 197 HG23 THR 27 HG23 THR 27 5.059 -8.295 -5.239 198 HA PRO 28 HA PRO 28 10.133 -4.650 -4.306 199 HB2 PRO 28 HB2 PRO 28 9.538 -2.136 -5.024 200 HB3 PRO 28 HB1 PRO 28 10.634 -3.143 -5.976 201 HG2 PRO 28 HG2 PRO 28 7.798 -2.410 -6.498 202 HG3 PRO 28 HG1 PRO 28 9.123 -2.667 -7.644 203 HD2 PRO 28 HD2 PRO 28 7.118 -4.510 -7.008 204 HD3 PRO 28 HD1 PRO 28 8.639 -4.872 -7.843 205 H TYR 29 HN TYR 29 9.482 -4.490 -2.254 206 HA TYR 29 HA TYR 29 6.804 -3.431 -1.701 207 HB2 TYR 29 HB2 TYR 29 8.610 -5.272 -0.161 208 HB3 TYR 29 HB1 TYR 29 7.314 -4.398 0.650 209 HD1 TYR 29 HD1 TYR 29 4.953 -4.771 -0.074 210 HD2 TYR 29 HD2 TYR 29 8.149 -7.224 -1.446 211 HE1 TYR 29 HE1 TYR 29 3.335 -6.492 -0.746 212 HE2 TYR 29 HE2 TYR 29 6.534 -8.954 -2.124 213 HH TYR 29 HH TYR 29 4.225 -9.658 -1.552 214 H ALA 30 HN ALA 30 6.660 -1.427 -1.042 215 HA ALA 30 HA ALA 30 9.038 -0.050 -0.065 216 HB1 ALA 30 HB1 ALA 30 6.354 1.067 -0.865 217 HB2 ALA 30 HB2 ALA 30 7.773 0.955 -1.906 218 HB3 ALA 30 HB3 ALA 30 7.804 1.997 -0.484 219 H GLN 31 HN GLN 31 9.301 -0.416 2.065 220 HA GLN 31 HA GLN 31 7.005 -0.401 3.849 221 HB2 GLN 31 HB2 GLN 31 8.862 -2.048 4.142 222 HB3 GLN 31 HB1 GLN 31 9.942 -0.713 4.522 223 HG2 GLN 31 HG2 GLN 31 9.224 -1.757 6.555 224 HG3 GLN 31 HG1 GLN 31 8.523 -0.143 6.453 225 HE21 GLN 31 HE21 GLN 31 7.912 -3.541 6.464 226 HE22 GLN 31 HE22 GLN 31 6.184 -3.437 6.564 227 H ALA 32 HN ALA 32 6.389 1.795 3.541 228 HA ALA 32 HA ALA 32 8.198 3.899 4.349 229 HB1 ALA 32 HB1 ALA 32 5.244 4.010 3.739 230 HB2 ALA 32 HB2 ALA 32 6.546 4.285 2.582 231 HB3 ALA 32 HB3 ALA 32 6.317 5.396 3.933 232 H GLY 33 HN GLY 33 5.536 2.077 5.720 233 HA2 GLY 33 HA2 GLY 33 6.321 2.907 8.382 234 HA3 GLY 33 HA1 GLY 33 4.706 3.415 7.899 235 H GLU 34 HN GLU 34 5.889 1.357 9.869 236 HA GLU 34 HA GLU 34 5.092 -1.184 8.804 237 HB2 GLU 34 HB2 GLU 34 6.969 -0.805 10.461 238 HB3 GLU 34 HB1 GLU 34 5.735 -0.538 11.684 239 HG2 GLU 34 HG2 GLU 34 4.982 -2.761 11.562 240 HG3 GLU 34 HG1 GLU 34 5.853 -3.057 10.058 241 H ASP 35 HN ASP 35 2.961 -0.359 8.252 242 HA ASP 35 HA ASP 35 0.742 -0.747 8.380 243 HB2 ASP 35 HB2 ASP 35 1.537 -2.739 9.839 244 HB3 ASP 35 HB1 ASP 35 0.943 -1.777 11.189 245 H ASN 36 HN ASN 36 2.377 1.328 10.383 246 HA ASN 36 HA ASN 36 0.159 2.453 11.818 247 HB2 ASN 36 HB2 ASN 36 1.710 4.279 12.374 248 HB3 ASN 36 HB1 ASN 36 2.464 2.710 12.646 249 HD21 ASN 36 HD21 ASN 36 2.479 5.610 10.735 250 HD22 ASN 36 HD22 ASN 36 3.969 5.299 9.914 251 H TRP 37 HN TRP 37 1.002 2.467 8.631 252 HA TRP 37 HA TRP 37 0.448 5.203 8.000 253 HB2 TRP 37 HB2 TRP 37 0.626 4.382 5.616 254 HB3 TRP 37 HB1 TRP 37 2.045 4.124 6.618 255 HD1 TRP 37 HD1 TRP 37 -0.256 1.450 7.566 256 HE1 TRP 37 HE1 TRP 37 0.267 -0.716 6.282 257 HE3 TRP 37 HE3 TRP 37 2.756 3.377 3.926 258 HZ2 TRP 37 HZ2 TRP 37 1.760 -1.496 4.022 259 HZ3 TRP 37 HZ3 TRP 37 3.691 1.859 2.242 260 HH2 TRP 37 HH2 TRP 37 3.199 -0.522 2.292 261 H ARG 38 HN ARG 38 -1.549 2.522 8.589 262 HA ARG 38 HA ARG 38 -3.393 2.899 6.458 263 HB2 ARG 38 HB2 ARG 38 -4.883 1.374 7.663 264 HB3 ARG 38 HB1 ARG 38 -3.261 0.721 7.486 265 HG2 ARG 38 HG2 ARG 38 -2.769 1.242 9.801 266 HG3 ARG 38 HG1 ARG 38 -4.349 2.006 9.987 267 HD2 ARG 38 HD2 ARG 38 -4.443 -0.212 10.916 268 HD3 ARG 38 HD1 ARG 38 -5.418 -0.162 9.448 269 HE ARG 38 HE ARG 38 -2.728 -1.380 9.648 270 HH11 ARG 38 HH11 ARG 38 -5.955 -1.274 8.280 271 HH12 ARG 38 HH12 ARG 38 -5.687 -2.616 7.210 272 HH21 ARG 38 HH21 ARG 38 -2.380 -3.157 8.259 273 HH22 ARG 38 HH22 ARG 38 -3.675 -3.707 7.229 274 H SER 39 HN SER 39 -3.355 3.961 9.833 275 HA SER 39 HA SER 39 -5.935 5.093 9.835 276 HB2 SER 39 HB2 SER 39 -4.907 6.494 11.756 277 HB3 SER 39 HB1 SER 39 -4.983 4.743 11.957 278 HG SER 39 HG SER 39 -2.885 4.663 11.969 279 H ARG 40 HN ARG 40 -2.779 6.306 8.898 280 HA ARG 40 HA ARG 40 -3.614 8.992 8.574 281 HB2 ARG 40 HB2 ARG 40 -1.214 7.527 7.467 282 HB3 ARG 40 HB1 ARG 40 -1.431 9.253 7.567 283 HG2 ARG 40 HG2 ARG 40 -1.279 7.402 9.920 284 HG3 ARG 40 HG1 ARG 40 0.019 8.455 9.352 285 HD2 ARG 40 HD2 ARG 40 -1.241 10.413 9.879 286 HD3 ARG 40 HD1 ARG 40 -2.692 9.464 10.196 287 HE ARG 40 HE ARG 40 -0.696 8.591 11.951 288 HH11 ARG 40 HH11 ARG 40 -2.575 11.482 11.326 289 HH12 ARG 40 HH12 ARG 40 -2.551 12.023 12.978 290 HH21 ARG 40 HH21 ARG 40 -0.688 9.284 14.146 291 HH22 ARG 40 HH22 ARG 40 -1.507 10.758 14.580 292 H ILE 41 HN ILE 41 -3.047 6.249 6.374 293 HA ILE 41 HA ILE 41 -3.728 7.476 3.964 294 HB ILE 41 HB ILE 41 -4.182 4.627 4.878 295 HG12 ILE 41 HG12 ILE 41 -2.117 5.832 3.023 296 HG13 ILE 41 HG11 ILE 41 -1.833 5.378 4.699 297 HG21 ILE 41 HG21 ILE 41 -4.469 5.745 2.092 298 HG22 ILE 41 HG22 ILE 41 -5.780 5.150 3.112 299 HG23 ILE 41 HG23 ILE 41 -4.538 4.038 2.531 300 HD11 ILE 41 HD11 ILE 41 -0.971 3.696 3.194 301 HD12 ILE 41 HD12 ILE 41 -2.561 3.512 2.455 302 HD13 ILE 41 HD13 ILE 41 -2.310 3.045 4.137 303 H SER 42 HN SER 42 -5.748 5.913 6.419 304 HA SER 42 HA SER 42 -8.224 6.174 5.152 305 HB2 SER 42 HB2 SER 42 -7.601 6.178 8.114 306 HB3 SER 42 HB1 SER 42 -9.197 5.917 7.410 307 HG SER 42 HG SER 42 -6.888 4.299 7.019 308 H GLY 43 HN GLY 43 -6.337 8.558 6.926 309 HA2 GLY 43 HA2 GLY 43 -8.465 10.361 7.458 310 HA3 GLY 43 HA1 GLY 43 -6.757 10.774 7.412 311 H ARG 44 HN ARG 44 -5.961 10.470 4.918 312 HA ARG 44 HA ARG 44 -7.300 12.487 3.464 313 HB2 ARG 44 HB2 ARG 44 -5.737 11.698 1.583 314 HB3 ARG 44 HB1 ARG 44 -5.062 12.442 3.020 315 HG2 ARG 44 HG2 ARG 44 -5.237 9.595 3.318 316 HG3 ARG 44 HG1 ARG 44 -4.319 10.055 1.880 317 HD2 ARG 44 HD2 ARG 44 -3.851 11.186 4.632 318 HD3 ARG 44 HD1 ARG 44 -2.943 9.838 3.950 319 HE ARG 44 HE ARG 44 -2.296 11.482 2.145 320 HH11 ARG 44 HH11 ARG 44 -3.176 12.549 5.357 321 HH12 ARG 44 HH12 ARG 44 -2.085 13.910 5.344 322 HH21 ARG 44 HH21 ARG 44 -0.843 13.266 2.120 323 HH22 ARG 44 HH22 ARG 44 -0.778 14.322 3.504 324 H LEU 45 HN LEU 45 -7.552 8.981 3.402 325 HA LEU 45 HA LEU 45 -8.981 8.644 1.043 326 HB2 LEU 45 HB2 LEU 45 -8.265 6.987 2.985 327 HB3 LEU 45 HB1 LEU 45 -9.901 7.272 3.538 328 HG LEU 45 HG LEU 45 -9.302 6.300 0.753 329 HD11 LEU 45 HD11 LEU 45 -9.793 4.035 1.579 330 HD12 LEU 45 HD12 LEU 45 -9.806 4.660 3.228 331 HD13 LEU 45 HD13 LEU 45 -8.319 4.705 2.280 332 HD21 LEU 45 HD21 LEU 45 -11.769 6.178 2.483 333 HD22 LEU 45 HD22 LEU 45 -11.609 5.439 0.888 334 HD23 LEU 45 HD23 LEU 45 -11.532 7.196 1.064 335 H ASN 46 HN ASN 46 -9.957 9.990 4.100 336 HA ASN 46 HA ASN 46 -12.743 10.240 3.535 337 HB2 ASN 46 HB2 ASN 46 -12.065 10.184 5.849 338 HB3 ASN 46 HB1 ASN 46 -10.991 11.560 5.620 339 HD21 ASN 46 HD21 ASN 46 -14.312 10.527 5.885 340 HD22 ASN 46 HD22 ASN 46 -14.983 12.090 6.186 341 H ARG 47 HN ARG 47 -9.895 12.245 3.219 342 HA ARG 47 HA ARG 47 -10.964 14.643 2.425 343 HB2 ARG 47 HB2 ARG 47 -8.780 15.027 2.240 344 HB3 ARG 47 HB1 ARG 47 -8.450 13.315 2.334 345 HG2 ARG 47 HG2 ARG 47 -8.799 13.171 -0.137 346 HG3 ARG 47 HG1 ARG 47 -8.899 14.939 -0.160 347 HD2 ARG 47 HD2 ARG 47 -6.643 15.038 0.862 348 HD3 ARG 47 HD1 ARG 47 -6.545 13.273 0.758 349 HE ARG 47 HE ARG 47 -7.148 14.347 -1.788 350 HH11 ARG 47 HH11 ARG 47 -4.492 14.240 0.500 351 HH12 ARG 47 HH12 ARG 47 -3.264 14.271 -0.731 352 HH21 ARG 47 HH21 ARG 47 -5.531 14.403 -3.405 353 HH22 ARG 47 HH22 ARG 47 -3.855 14.380 -2.950 354 H PHE 48 HN PHE 48 -10.832 11.595 0.703 355 HA PHE 48 HA PHE 48 -11.944 12.874 -1.648 356 HB2 PHE 48 HB2 PHE 48 -11.114 10.022 -1.154 357 HB3 PHE 48 HB1 PHE 48 -11.860 10.574 -2.648 358 HD1 PHE 48 HD1 PHE 48 -10.657 12.232 -4.072 359 HD2 PHE 48 HD2 PHE 48 -8.814 10.313 -0.751 360 HE1 PHE 48 HE1 PHE 48 -8.441 12.811 -4.968 361 HE2 PHE 48 HE2 PHE 48 -6.596 10.895 -1.640 362 HZ PHE 48 HZ PHE 48 -6.410 12.145 -3.752 363 H LYS 49 HN LYS 49 -12.734 10.081 0.377 364 HA LYS 49 HA LYS 49 -15.389 10.757 0.965 365 HB2 LYS 49 HB2 LYS 49 -15.005 9.109 -1.509 366 HB3 LYS 49 HB1 LYS 49 -16.310 8.670 -0.423 367 HG2 LYS 49 HG2 LYS 49 -15.944 11.309 -1.820 368 HG3 LYS 49 HG1 LYS 49 -17.137 10.068 -2.200 369 HD2 LYS 49 HD2 LYS 49 -16.973 11.637 0.375 370 HD3 LYS 49 HD1 LYS 49 -18.127 11.912 -0.930 371 HE2 LYS 49 HE2 LYS 49 -19.013 9.635 -0.584 372 HE3 LYS 49 HE1 LYS 49 -17.894 9.427 0.764 373 HZ1 LYS 49 HZ1 LYS 49 -20.161 11.331 0.569 374 HZ2 LYS 49 HZ2 LYS 49 -18.976 11.436 1.775 375 HZ3 LYS 49 HZ3 LYS 49 -19.969 10.063 1.679 376 H ARG 50 HN ARG 50 -15.487 9.767 2.921 377 HA ARG 50 HA ARG 50 -14.474 6.999 3.065 378 HB2 ARG 50 HB2 ARG 50 -12.922 8.747 4.083 379 HB3 ARG 50 HB1 ARG 50 -14.158 8.973 5.313 380 HG2 ARG 50 HG2 ARG 50 -13.953 6.653 5.982 381 HG3 ARG 50 HG1 ARG 50 -12.765 6.374 4.704 382 HD2 ARG 50 HD2 ARG 50 -11.460 6.701 6.607 383 HD3 ARG 50 HD1 ARG 50 -11.433 8.262 5.799 384 HE ARG 50 HE ARG 50 -13.545 8.309 7.628 385 HH11 ARG 50 HH11 ARG 50 -10.058 8.190 7.582 386 HH12 ARG 50 HH12 ARG 50 -9.863 8.831 9.184 387 HH21 ARG 50 HH21 ARG 50 -13.317 9.207 9.748 388 HH22 ARG 50 HH22 ARG 50 -11.722 9.406 10.418 389 H TYR 51 HN TYR 51 -16.289 5.868 3.244 390 HA TYR 51 HA TYR 51 -18.438 6.760 4.981 391 HB2 TYR 51 HB2 TYR 51 -18.534 5.527 2.618 392 HB3 TYR 51 HB1 TYR 51 -18.459 4.093 3.641 393 HD1 TYR 51 HD1 TYR 51 -20.244 7.370 3.670 394 HD2 TYR 51 HD2 TYR 51 -20.518 3.153 4.112 395 HE1 TYR 51 HE1 TYR 51 -22.651 7.584 4.082 396 HE2 TYR 51 HE2 TYR 51 -22.932 3.354 4.529 397 HH TYR 51 HH TYR 51 -24.504 5.164 5.422 398 HA PRO 52 HA PRO 52 -16.916 4.577 8.547 399 HB2 PRO 52 HB2 PRO 52 -19.794 4.343 9.239 400 HB3 PRO 52 HB1 PRO 52 -18.468 5.055 10.166 401 HG2 PRO 52 HG2 PRO 52 -20.276 6.609 8.987 402 HG3 PRO 52 HG1 PRO 52 -18.560 7.065 9.003 403 HD2 PRO 52 HD2 PRO 52 -20.183 5.863 6.790 404 HD3 PRO 52 HD1 PRO 52 -18.962 7.151 6.719 405 H LYS 53 HN LYS 53 -16.483 2.492 8.994 406 HA LYS 53 HA LYS 53 -17.147 0.543 7.088 407 HB2 LYS 53 HB2 LYS 53 -15.946 0.191 9.836 408 HB3 LYS 53 HB1 LYS 53 -16.013 -1.065 8.610 409 HG2 LYS 53 HG2 LYS 53 -14.520 1.544 8.412 410 HG3 LYS 53 HG1 LYS 53 -13.816 -0.045 8.702 411 HD2 LYS 53 HD2 LYS 53 -13.457 0.158 6.446 412 HD3 LYS 53 HD1 LYS 53 -15.037 -0.627 6.438 413 HE2 LYS 53 HE2 LYS 53 -14.998 1.231 4.859 414 HE3 LYS 53 HE1 LYS 53 -16.112 1.566 6.187 415 HZ1 LYS 53 HZ1 LYS 53 -14.768 3.492 5.683 416 HZ2 LYS 53 HZ2 LYS 53 -13.341 2.607 5.935 417 HZ3 LYS 53 HZ3 LYS 53 -14.391 2.915 7.232 418 H ASP 54 HN ASP 54 -18.651 1.346 10.106 419 HA ASP 54 HA ASP 54 -19.993 -1.020 10.692 420 HB2 ASP 54 HB2 ASP 54 -19.982 0.832 12.250 421 HB3 ASP 54 HB1 ASP 54 -20.859 1.846 11.108 422 H ALA 55 HN ALA 55 -20.838 1.590 8.485 423 HA ALA 55 HA ALA 55 -23.384 0.504 7.798 424 HB1 ALA 55 HB1 ALA 55 -21.754 2.565 6.350 425 HB2 ALA 55 HB2 ALA 55 -22.890 2.896 7.659 426 HB3 ALA 55 HB3 ALA 55 -23.473 2.238 6.128 427 H LEU 56 HN LEU 56 -20.149 0.199 6.533 428 HA LEU 56 HA LEU 56 -20.846 -0.953 4.042 429 HB2 LEU 56 HB2 LEU 56 -18.342 -1.083 5.714 430 HB3 LEU 56 HB1 LEU 56 -18.487 -1.948 4.196 431 HG LEU 56 HG LEU 56 -17.302 0.076 3.785 432 HD11 LEU 56 HD11 LEU 56 -18.988 -0.618 2.113 433 HD12 LEU 56 HD12 LEU 56 -18.642 1.113 2.099 434 HD13 LEU 56 HD13 LEU 56 -20.125 0.514 2.852 435 HD21 LEU 56 HD21 LEU 56 -17.899 1.406 5.668 436 HD22 LEU 56 HD22 LEU 56 -19.587 1.462 5.161 437 HD23 LEU 56 HD23 LEU 56 -18.350 2.292 4.212 438 H ARG 57 HN ARG 57 -20.232 -2.283 7.233 439 HA ARG 57 HA ARG 57 -20.312 -5.006 6.559 440 HB2 ARG 57 HB2 ARG 57 -21.163 -3.669 9.129 441 HB3 ARG 57 HB1 ARG 57 -20.875 -5.393 8.933 442 HG2 ARG 57 HG2 ARG 57 -18.532 -4.900 8.343 443 HG3 ARG 57 HG1 ARG 57 -18.844 -3.190 8.643 444 HD2 ARG 57 HD2 ARG 57 -19.086 -5.426 10.653 445 HD3 ARG 57 HD1 ARG 57 -17.788 -4.237 10.574 446 HE ARG 57 HE ARG 57 -20.352 -3.006 10.811 447 HH11 ARG 57 HH11 ARG 57 -17.819 -4.600 12.624 448 HH12 ARG 57 HH12 ARG 57 -18.247 -3.847 14.131 449 HH21 ARG 57 HH21 ARG 57 -20.905 -1.974 12.793 450 HH22 ARG 57 HH22 ARG 57 -19.968 -2.334 14.218 451 H LEU 58 HN LEU 58 -22.820 -2.690 6.578 452 HA LEU 58 HA LEU 58 -24.854 -4.814 6.585 453 HB2 LEU 58 HB2 LEU 58 -25.196 -1.858 7.097 454 HB3 LEU 58 HB1 LEU 58 -26.478 -3.052 7.126 455 HG LEU 58 HG LEU 58 -24.133 -2.985 9.028 456 HD11 LEU 58 HD11 LEU 58 -25.785 -2.292 10.695 457 HD12 LEU 58 HD12 LEU 58 -27.017 -2.212 9.436 458 HD13 LEU 58 HD13 LEU 58 -25.638 -1.113 9.393 459 HD21 LEU 58 HD21 LEU 58 -24.999 -5.243 8.620 460 HD22 LEU 58 HD22 LEU 58 -26.622 -4.691 9.037 461 HD23 LEU 58 HD23 LEU 58 -25.350 -4.694 10.258 462 H LYS 59 HN LYS 59 -23.080 -3.075 4.477 463 HA LYS 59 HA LYS 59 -25.272 -2.945 2.520 464 HB2 LYS 59 HB2 LYS 59 -24.827 -0.677 3.240 465 HB3 LYS 59 HB1 LYS 59 -23.108 -0.875 2.948 466 HG2 LYS 59 HG2 LYS 59 -23.359 -0.785 0.639 467 HG3 LYS 59 HG1 LYS 59 -25.075 -1.194 0.715 468 HD2 LYS 59 HD2 LYS 59 -24.826 1.144 0.160 469 HD3 LYS 59 HD1 LYS 59 -25.523 0.989 1.768 470 HE2 LYS 59 HE2 LYS 59 -23.946 2.663 2.039 471 HE3 LYS 59 HE1 LYS 59 -23.097 1.226 2.602 472 HZ1 LYS 59 HZ1 LYS 59 -22.847 2.334 -0.145 473 HZ2 LYS 59 HZ2 LYS 59 -21.909 1.092 0.540 474 HZ3 LYS 59 HZ3 LYS 59 -21.772 2.681 1.113 475 H ARG 60 HN ARG 60 -21.738 -2.419 2.456 476 HA ARG 60 HA ARG 60 -21.499 -4.666 0.607 477 HB2 ARG 60 HB2 ARG 60 -20.409 -1.891 0.101 478 HB3 ARG 60 HB1 ARG 60 -19.916 -3.320 -0.795 479 HG2 ARG 60 HG2 ARG 60 -22.702 -2.179 -0.684 480 HG3 ARG 60 HG1 ARG 60 -21.569 -2.041 -2.030 481 HD2 ARG 60 HD2 ARG 60 -21.562 -4.504 -2.224 482 HD3 ARG 60 HD1 ARG 60 -22.770 -4.584 -0.942 483 HE ARG 60 HE ARG 60 -23.266 -3.200 -3.499 484 HH11 ARG 60 HH11 ARG 60 -24.298 -5.342 -0.922 485 HH12 ARG 60 HH12 ARG 60 -25.827 -5.698 -1.665 486 HH21 ARG 60 HH21 ARG 60 -25.269 -3.663 -4.471 487 HH22 ARG 60 HH22 ARG 60 -26.391 -4.720 -3.669 488 H GLN 61 HN GLN 61 -20.378 -5.964 1.862 489 HA GLN 61 HA GLN 61 -17.947 -4.941 3.172 490 HB2 GLN 61 HB2 GLN 61 -18.217 -6.753 4.779 491 HB3 GLN 61 HB1 GLN 61 -19.694 -5.801 4.706 492 HG2 GLN 61 HG2 GLN 61 -20.479 -7.570 3.002 493 HG3 GLN 61 HG1 GLN 61 -19.175 -8.553 3.662 494 HE21 GLN 61 HE21 GLN 61 -19.511 -7.347 6.340 495 HE22 GLN 61 HE22 GLN 61 -20.946 -8.065 6.993 496 H GLY 62 HN GLY 62 -16.138 -6.585 3.263 497 HA2 GLY 62 HA2 GLY 62 -15.768 -8.839 1.921 498 HA3 GLY 62 HA1 GLY 62 -15.899 -7.700 0.593 499 H VAL 63 HN VAL 63 -13.677 -9.413 1.679 500 HA VAL 63 HA VAL 63 -11.696 -7.289 2.099 501 HB VAL 63 HB VAL 63 -11.428 -10.259 2.619 502 HG11 VAL 63 HG11 VAL 63 -9.303 -9.206 1.998 503 HG12 VAL 63 HG12 VAL 63 -9.312 -9.688 3.694 504 HG13 VAL 63 HG13 VAL 63 -9.536 -7.994 3.257 505 HG21 VAL 63 HG21 VAL 63 -12.940 -9.196 4.197 506 HG22 VAL 63 HG22 VAL 63 -11.740 -7.948 4.531 507 HG23 VAL 63 HG23 VAL 63 -11.423 -9.621 4.991 508 H GLY 64 HN GLY 64 -10.414 -6.791 0.469 509 HA2 GLY 64 HA2 GLY 64 -9.730 -8.873 -1.486 510 HA3 GLY 64 HA1 GLY 64 -10.370 -7.338 -2.060 511 H GLN 65 HN GLN 65 -7.881 -8.233 -2.853 512 HA GLN 65 HA GLN 65 -6.058 -6.524 -1.305 513 HB2 GLN 65 HB2 GLN 65 -5.506 -8.738 -3.273 514 HB3 GLN 65 HB1 GLN 65 -4.259 -7.637 -2.707 515 HG2 GLN 65 HG2 GLN 65 -4.797 -8.350 -0.377 516 HG3 GLN 65 HG1 GLN 65 -5.867 -9.571 -1.060 517 HE21 GLN 65 HE21 GLN 65 -2.575 -8.545 -0.665 518 HE22 GLN 65 HE22 GLN 65 -1.827 -10.032 -1.139 519 H VAL 66 HN VAL 66 -5.313 -4.706 -2.115 520 HA VAL 66 HA VAL 66 -5.958 -4.045 -4.911 521 HB VAL 66 HB VAL 66 -6.466 -2.439 -2.404 522 HG11 VAL 66 HG11 VAL 66 -7.101 -0.560 -3.710 523 HG12 VAL 66 HG12 VAL 66 -6.788 -1.427 -5.218 524 HG13 VAL 66 HG13 VAL 66 -5.448 -0.994 -4.154 525 HG21 VAL 66 HG21 VAL 66 -8.275 -3.291 -4.653 526 HG22 VAL 66 HG22 VAL 66 -8.749 -2.365 -3.226 527 HG23 VAL 66 HG23 VAL 66 -8.190 -4.032 -3.053 528 H ARG 67 HN ARG 67 -4.148 -3.539 -5.982 529 HA ARG 67 HA ARG 67 -1.949 -2.339 -4.441 530 HB2 ARG 67 HB2 ARG 67 -0.352 -3.375 -5.866 531 HB3 ARG 67 HB1 ARG 67 -1.487 -4.635 -5.402 532 HG2 ARG 67 HG2 ARG 67 -2.498 -4.626 -7.546 533 HG3 ARG 67 HG1 ARG 67 -1.620 -3.165 -8.024 534 HD2 ARG 67 HD2 ARG 67 0.463 -4.308 -7.992 535 HD3 ARG 67 HD1 ARG 67 -0.251 -5.719 -7.216 536 HE ARG 67 HE ARG 67 -1.575 -5.852 -9.431 537 HH11 ARG 67 HH11 ARG 67 1.708 -4.673 -9.140 538 HH12 ARG 67 HH12 ARG 67 2.210 -5.333 -10.670 539 HH21 ARG 67 HH21 ARG 67 -0.916 -6.704 -11.450 540 HH22 ARG 67 HH22 ARG 67 0.717 -6.463 -11.988 541 H PHE 68 HN PHE 68 -0.788 -0.604 -5.419 542 HA PHE 68 HA PHE 68 -1.932 0.700 -7.688 543 HB2 PHE 68 HB2 PHE 68 -2.620 2.706 -6.133 544 HB3 PHE 68 HB1 PHE 68 -3.733 1.388 -6.454 545 HD1 PHE 68 HD2 PHE 68 -0.877 1.661 -4.048 546 HD2 PHE 68 HD1 PHE 68 -5.062 1.151 -4.624 547 HE1 PHE 68 HE2 PHE 68 -1.166 1.295 -1.632 548 HE2 PHE 68 HE1 PHE 68 -5.358 0.789 -2.212 549 HZ PHE 68 HZ PHE 68 -3.412 0.859 -0.714 550 H THR 69 HN THR 69 -0.891 2.554 -8.307 551 HA THR 69 HA THR 69 1.669 3.166 -7.003 552 HB THR 69 HB THR 69 0.539 4.266 -9.590 553 HG1 THR 69 HG1 THR 69 1.570 1.823 -9.022 554 HG21 THR 69 HG21 THR 69 3.342 4.218 -8.467 555 HG22 THR 69 HG22 THR 69 2.291 5.632 -8.571 556 HG23 THR 69 HG23 THR 69 2.877 4.855 -10.044 557 H LEU 70 HN LEU 70 1.902 4.941 -5.791 558 HA LEU 70 HA LEU 70 -0.455 6.696 -5.589 559 HB2 LEU 70 HB2 LEU 70 1.421 5.815 -3.403 560 HB3 LEU 70 HB1 LEU 70 0.007 6.838 -3.206 561 HG LEU 70 HG LEU 70 -0.107 4.004 -4.223 562 HD11 LEU 70 HD11 LEU 70 -0.651 5.047 -1.451 563 HD12 LEU 70 HD12 LEU 70 0.724 4.048 -1.937 564 HD13 LEU 70 HD13 LEU 70 -0.914 3.394 -2.014 565 HD21 LEU 70 HD21 LEU 70 -2.498 4.210 -3.770 566 HD22 LEU 70 HD22 LEU 70 -1.967 5.431 -4.928 567 HD23 LEU 70 HD23 LEU 70 -2.261 5.878 -3.247 568 H ASP 71 HN ASP 71 -0.197 8.838 -5.284 569 HA ASP 71 HA ASP 71 2.329 9.952 -6.146 570 HB2 ASP 71 HB2 ASP 71 0.307 10.812 -7.163 571 HB3 ASP 71 HB1 ASP 71 -0.365 11.196 -5.579 572 H ARG 72 HN ARG 72 3.359 11.629 -5.103 573 HA ARG 72 HA ARG 72 4.093 11.295 -2.470 574 HB2 ARG 72 HB2 ARG 72 5.317 12.519 -4.265 575 HB3 ARG 72 HB1 ARG 72 4.197 13.855 -4.070 576 HG2 ARG 72 HG2 ARG 72 4.972 14.111 -1.738 577 HG3 ARG 72 HG1 ARG 72 6.163 12.836 -2.031 578 HD2 ARG 72 HD2 ARG 72 6.994 14.207 -3.966 579 HD3 ARG 72 HD1 ARG 72 5.945 15.506 -3.408 580 HE ARG 72 HE ARG 72 7.741 14.538 -1.384 581 HH11 ARG 72 HH11 ARG 72 7.322 16.749 -4.061 582 HH12 ARG 72 HH12 ARG 72 8.629 17.790 -3.584 583 HH21 ARG 72 HH21 ARG 72 9.449 15.898 -0.728 584 HH22 ARG 72 HH22 ARG 72 9.837 17.314 -1.662 585 H GLN 73 HN GLN 73 1.547 13.369 -3.796 586 HA GLN 73 HA GLN 73 0.977 14.403 -1.112 587 HB2 GLN 73 HB2 GLN 73 -0.055 15.219 -3.831 588 HB3 GLN 73 HB1 GLN 73 -0.512 15.983 -2.311 589 HG2 GLN 73 HG2 GLN 73 2.333 15.787 -3.246 590 HG3 GLN 73 HG1 GLN 73 1.278 17.136 -3.646 591 HE21 GLN 73 HE21 GLN 73 2.919 15.451 -1.065 592 HE22 GLN 73 HE22 GLN 73 2.805 16.717 0.110 593 H GLY 74 HN GLY 74 0.287 11.693 -2.517 594 HA2 GLY 74 HA2 GLY 74 -1.271 10.128 -1.856 595 HA3 GLY 74 HA1 GLY 74 -2.146 11.388 -1.018 596 H HIS 75 HN HIS 75 -1.273 11.321 -4.427 597 HA HIS 75 HA HIS 75 -4.136 11.283 -5.077 598 HB2 HIS 75 HB2 HIS 75 -2.836 13.175 -5.978 599 HB3 HIS 75 HB1 HIS 75 -1.756 12.052 -6.791 600 HD1 HIS 75 HD1 HIS 75 -5.238 13.460 -6.974 601 HD2 HIS 75 HD2 HIS 75 -2.683 11.034 -9.189 602 HE1 HIS 75 HE1 HIS 75 -6.341 13.180 -9.222 603 HE2 HIS 75 HE2 HIS 75 -4.705 11.827 -10.593 604 H VAL 76 HN VAL 76 -4.920 9.333 -5.570 605 HA VAL 76 HA VAL 76 -3.532 7.045 -6.199 606 HB VAL 76 HB VAL 76 -5.850 6.914 -5.621 607 HG11 VAL 76 HG11 VAL 76 -6.628 9.015 -6.565 608 HG12 VAL 76 HG12 VAL 76 -7.648 7.678 -7.097 609 HG13 VAL 76 HG13 VAL 76 -6.450 8.364 -8.196 610 HG21 VAL 76 HG21 VAL 76 -5.026 5.100 -6.991 611 HG22 VAL 76 HG22 VAL 76 -5.444 5.985 -8.458 612 HG23 VAL 76 HG23 VAL 76 -6.716 5.429 -7.370 613 H LEU 77 HN LEU 77 -2.150 6.672 -7.791 614 HA LEU 77 HA LEU 77 -2.459 8.114 -10.316 615 HB2 LEU 77 HB2 LEU 77 -0.127 6.537 -9.230 616 HB3 LEU 77 HB1 LEU 77 -0.133 7.403 -10.755 617 HG LEU 77 HG LEU 77 -0.530 8.736 -8.078 618 HD11 LEU 77 HD11 LEU 77 1.981 8.531 -9.734 619 HD12 LEU 77 HD12 LEU 77 1.684 7.709 -8.200 620 HD13 LEU 77 HD13 LEU 77 1.776 9.470 -8.253 621 HD21 LEU 77 HD21 LEU 77 -0.009 10.777 -9.344 622 HD22 LEU 77 HD22 LEU 77 -1.457 9.973 -9.953 623 HD23 LEU 77 HD23 LEU 77 0.069 9.826 -10.828 624 H ALA 78 HN ALA 78 -1.846 4.848 -9.098 625 HA ALA 78 HA ALA 78 -3.165 3.789 -11.506 626 HB1 ALA 78 HB1 ALA 78 -1.611 1.927 -11.578 627 HB2 ALA 78 HB2 ALA 78 -0.752 2.555 -10.172 628 HB3 ALA 78 HB3 ALA 78 -0.723 3.447 -11.695 629 H VAL 79 HN VAL 79 -4.237 1.746 -11.152 630 HA VAL 79 HA VAL 79 -4.404 0.740 -8.444 631 HB VAL 79 HB VAL 79 -6.998 0.677 -8.740 632 HG11 VAL 79 HG11 VAL 79 -5.869 1.810 -6.915 633 HG12 VAL 79 HG12 VAL 79 -7.219 2.779 -7.507 634 HG13 VAL 79 HG13 VAL 79 -5.565 3.206 -7.948 635 HG21 VAL 79 HG21 VAL 79 -7.052 1.625 -10.994 636 HG22 VAL 79 HG22 VAL 79 -6.314 3.110 -10.392 637 HG23 VAL 79 HG23 VAL 79 -7.927 2.645 -9.852 638 H THR 80 HN THR 80 -4.499 -1.413 -8.491 639 HA THR 80 HA THR 80 -5.792 -2.735 -10.762 640 HB THR 80 HB THR 80 -3.023 -3.489 -9.789 641 HG1 THR 80 HG1 THR 80 -3.932 -1.795 -11.805 642 HG21 THR 80 HG21 THR 80 -3.025 -5.003 -11.718 643 HG22 THR 80 HG22 THR 80 -4.672 -4.509 -12.108 644 HG23 THR 80 HG23 THR 80 -4.346 -5.385 -10.612 645 H LEU 81 HN LEU 81 -7.142 -4.245 -10.036 646 HA LEU 81 HA LEU 81 -7.225 -5.017 -7.297 647 HB2 LEU 81 HB2 LEU 81 -9.228 -4.947 -8.761 648 HB3 LEU 81 HB1 LEU 81 -8.585 -6.301 -9.675 649 HG LEU 81 HG LEU 81 -8.621 -7.626 -7.524 650 HD11 LEU 81 HD11 LEU 81 -10.105 -6.842 -5.757 651 HD12 LEU 81 HD12 LEU 81 -10.321 -5.313 -6.608 652 HD13 LEU 81 HD13 LEU 81 -8.735 -5.753 -5.975 653 HD21 LEU 81 HD21 LEU 81 -10.277 -7.953 -9.269 654 HD22 LEU 81 HD22 LEU 81 -11.237 -6.618 -8.633 655 HD23 LEU 81 HD23 LEU 81 -11.026 -8.084 -7.678 656 H VAL 82 HN VAL 82 -6.116 -6.544 -6.315 657 HA VAL 82 HA VAL 82 -4.351 -8.212 -7.955 658 HB VAL 82 HB VAL 82 -4.059 -8.188 -5.007 659 HG11 VAL 82 HG11 VAL 82 -2.349 -9.314 -6.114 660 HG12 VAL 82 HG12 VAL 82 -1.649 -7.723 -5.766 661 HG13 VAL 82 HG13 VAL 82 -2.246 -8.092 -7.384 662 HG21 VAL 82 HG21 VAL 82 -3.425 -5.751 -6.656 663 HG22 VAL 82 HG22 VAL 82 -3.007 -5.999 -4.959 664 HG23 VAL 82 HG23 VAL 82 -4.700 -5.877 -5.443 665 H SER 83 HN SER 83 -6.721 -8.409 -5.332 666 HA SER 83 HA SER 83 -7.262 -11.178 -6.033 667 HB2 SER 83 HB2 SER 83 -6.515 -10.398 -3.202 668 HB3 SER 83 HB1 SER 83 -7.004 -11.999 -3.747 669 HG SER 83 HG SER 83 -4.623 -11.386 -3.537 670 H SER 84 HN SER 84 -9.387 -11.560 -5.960 671 HA SER 84 HA SER 84 -11.048 -10.109 -4.027 672 HB2 SER 84 HB2 SER 84 -11.254 -8.907 -6.162 673 HB3 SER 84 HB1 SER 84 -11.687 -10.410 -6.976 674 HG SER 84 HG SER 84 -13.527 -9.150 -6.421 675 H ALA 85 HN ALA 85 -11.872 -11.644 -2.799 676 HA ALA 85 HA ALA 85 -11.949 -14.379 -3.545 677 HB1 ALA 85 HB1 ALA 85 -12.901 -14.762 -1.350 678 HB2 ALA 85 HB2 ALA 85 -13.216 -13.037 -1.164 679 HB3 ALA 85 HB3 ALA 85 -11.555 -13.626 -1.246 680 H GLY 86 HN GLY 86 -14.660 -12.236 -2.611 681 HA2 GLY 86 HA2 GLY 86 -16.317 -13.394 -4.687 682 HA3 GLY 86 HA1 GLY 86 -16.784 -13.824 -3.047 683 H LEU 87 HN LEU 87 -15.843 -10.918 -4.868 684 HA LEU 87 HA LEU 87 -17.997 -9.463 -3.472 685 HB2 LEU 87 HB2 LEU 87 -15.535 -8.294 -4.751 686 HB3 LEU 87 HB1 LEU 87 -16.749 -7.408 -3.880 687 HG LEU 87 HG LEU 87 -14.845 -7.524 -2.486 688 HD11 LEU 87 HD11 LEU 87 -15.625 -8.781 -0.550 689 HD12 LEU 87 HD12 LEU 87 -16.825 -9.583 -1.565 690 HD13 LEU 87 HD13 LEU 87 -16.908 -7.837 -1.309 691 HD21 LEU 87 HD21 LEU 87 -14.794 -10.507 -2.883 692 HD22 LEU 87 HD22 LEU 87 -13.723 -9.574 -1.838 693 HD23 LEU 87 HD23 LEU 87 -13.665 -9.349 -3.586 694 HA PRO 88 HA PRO 88 -19.212 -9.500 -7.922 695 HB2 PRO 88 HB2 PRO 88 -21.944 -9.768 -7.014 696 HB3 PRO 88 HB1 PRO 88 -20.981 -10.913 -7.948 697 HG2 PRO 88 HG2 PRO 88 -21.784 -11.343 -5.364 698 HG3 PRO 88 HG1 PRO 88 -20.347 -12.084 -6.091 699 HD2 PRO 88 HD2 PRO 88 -20.547 -9.727 -4.258 700 HD3 PRO 88 HD1 PRO 88 -19.337 -11.027 -4.297 701 H SER 89 HN SER 89 -21.923 -8.365 -5.992 702 HA SER 89 HA SER 89 -21.983 -5.828 -7.306 703 HB2 SER 89 HB2 SER 89 -23.780 -5.411 -5.488 704 HB3 SER 89 HB1 SER 89 -24.092 -6.674 -6.682 705 HG SER 89 HG SER 89 -24.461 -7.738 -4.854 706 H LEU 90 HN LEU 90 -20.394 -7.112 -4.624 707 HA LEU 90 HA LEU 90 -20.195 -4.821 -2.964 708 HB2 LEU 90 HB2 LEU 90 -18.348 -7.198 -3.144 709 HB3 LEU 90 HB1 LEU 90 -18.488 -6.086 -1.796 710 HG LEU 90 HG LEU 90 -20.883 -7.671 -2.647 711 HD11 LEU 90 HD11 LEU 90 -20.219 -9.550 -1.431 712 HD12 LEU 90 HD12 LEU 90 -18.893 -8.686 -0.650 713 HD13 LEU 90 HD13 LEU 90 -18.772 -9.118 -2.361 714 HD21 LEU 90 HD21 LEU 90 -19.875 -6.561 -0.037 715 HD22 LEU 90 HD22 LEU 90 -21.380 -7.457 -0.255 716 HD23 LEU 90 HD23 LEU 90 -21.166 -5.887 -1.033 717 H ASP 91 HN ASP 91 -18.250 -6.139 -5.571 718 HA ASP 91 HA ASP 91 -15.823 -4.884 -5.096 719 HB2 ASP 91 HB2 ASP 91 -16.169 -6.667 -6.761 720 HB3 ASP 91 HB1 ASP 91 -17.077 -5.547 -7.767 721 H ARG 92 HN ARG 92 -18.507 -3.779 -7.123 722 HA ARG 92 HA ARG 92 -17.339 -1.478 -8.135 723 HB2 ARG 92 HB2 ARG 92 -19.543 -0.780 -8.746 724 HB3 ARG 92 HB1 ARG 92 -19.506 -2.533 -8.866 725 HG2 ARG 92 HG2 ARG 92 -20.415 -2.319 -6.372 726 HG3 ARG 92 HG1 ARG 92 -20.999 -0.782 -7.006 727 HD2 ARG 92 HD2 ARG 92 -21.588 -3.538 -8.060 728 HD3 ARG 92 HD1 ARG 92 -22.710 -2.439 -7.262 729 HE ARG 92 HE ARG 92 -21.474 -1.585 -9.778 730 HH11 ARG 92 HH11 ARG 92 -24.312 -2.646 -8.018 731 HH12 ARG 92 HH12 ARG 92 -25.413 -2.240 -9.297 732 HH21 ARG 92 HH21 ARG 92 -22.900 -1.042 -11.450 733 HH22 ARG 92 HH22 ARG 92 -24.614 -1.300 -11.255 734 H GLU 93 HN GLU 93 -19.013 -1.974 -5.076 735 HA GLU 93 HA GLU 93 -19.179 0.827 -4.476 736 HB2 GLU 93 HB2 GLU 93 -20.656 -1.286 -3.758 737 HB3 GLU 93 HB1 GLU 93 -19.583 -1.219 -2.369 738 HG2 GLU 93 HG2 GLU 93 -20.939 1.278 -3.244 739 HG3 GLU 93 HG1 GLU 93 -21.877 0.050 -2.396 740 H ILE 94 HN ILE 94 -17.368 -1.924 -3.066 741 HA ILE 94 HA ILE 94 -16.028 -0.352 -1.157 742 HB ILE 94 HB ILE 94 -14.506 -2.258 -0.857 743 HG12 ILE 94 HG12 ILE 94 -16.027 -3.511 -3.163 744 HG13 ILE 94 HG11 ILE 94 -14.357 -2.956 -3.230 745 HG21 ILE 94 HG21 ILE 94 -16.233 -3.900 -0.190 746 HG22 ILE 94 HG22 ILE 94 -17.432 -2.952 -1.073 747 HG23 ILE 94 HG23 ILE 94 -16.604 -2.254 0.319 748 HD11 ILE 94 HD11 ILE 94 -13.740 -4.617 -1.553 749 HD12 ILE 94 HD12 ILE 94 -14.477 -5.361 -2.971 750 HD13 ILE 94 HD13 ILE 94 -15.413 -5.171 -1.489 751 H GLN 95 HN GLN 95 -15.163 -1.251 -4.475 752 HA GLN 95 HA GLN 95 -12.531 -0.147 -4.236 753 HB2 GLN 95 HB2 GLN 95 -14.049 -0.798 -6.742 754 HB3 GLN 95 HB1 GLN 95 -12.345 -0.558 -6.581 755 HG2 GLN 95 HG2 GLN 95 -13.836 -2.778 -5.239 756 HG3 GLN 95 HG1 GLN 95 -13.003 -2.938 -6.785 757 HE21 GLN 95 HE21 GLN 95 -12.581 -4.308 -4.244 758 HE22 GLN 95 HE22 GLN 95 -10.931 -4.016 -3.818 759 H ALA 96 HN ALA 96 -15.673 0.990 -5.252 760 HA ALA 96 HA ALA 96 -14.923 3.362 -6.499 761 HB1 ALA 96 HB1 ALA 96 -17.242 2.963 -4.602 762 HB2 ALA 96 HB2 ALA 96 -17.266 2.662 -6.340 763 HB3 ALA 96 HB3 ALA 96 -17.053 4.304 -5.732 764 H LEU 97 HN LEU 97 -15.294 2.611 -3.069 765 HA LEU 97 HA LEU 97 -14.655 5.132 -2.075 766 HB2 LEU 97 HB2 LEU 97 -15.917 3.448 -0.850 767 HB3 LEU 97 HB1 LEU 97 -14.523 2.376 -0.854 768 HG LEU 97 HG LEU 97 -13.539 4.658 0.196 769 HD11 LEU 97 HD11 LEU 97 -16.315 4.245 1.283 770 HD12 LEU 97 HD12 LEU 97 -15.736 5.656 0.393 771 HD13 LEU 97 HD13 LEU 97 -15.094 5.300 1.996 772 HD21 LEU 97 HD21 LEU 97 -14.704 2.447 1.854 773 HD22 LEU 97 HD22 LEU 97 -13.270 3.431 2.186 774 HD23 LEU 97 HD23 LEU 97 -13.249 2.250 0.876 775 H VAL 98 HN VAL 98 -12.722 2.115 -2.277 776 HA VAL 98 HA VAL 98 -10.382 3.551 -1.336 777 HB VAL 98 HB VAL 98 -10.745 0.639 -2.037 778 HG11 VAL 98 HG11 VAL 98 -8.389 2.002 -0.734 779 HG12 VAL 98 HG12 VAL 98 -8.427 1.365 -2.377 780 HG13 VAL 98 HG13 VAL 98 -8.573 0.267 -1.006 781 HG21 VAL 98 HG21 VAL 98 -11.994 1.248 -0.077 782 HG22 VAL 98 HG22 VAL 98 -10.606 2.102 0.595 783 HG23 VAL 98 HG23 VAL 98 -10.564 0.346 0.426 784 H LYS 99 HN LYS 99 -11.293 1.746 -4.260 785 HA LYS 99 HA LYS 99 -8.778 1.998 -5.514 786 HB2 LYS 99 HB2 LYS 99 -10.303 0.220 -6.160 787 HB3 LYS 99 HB1 LYS 99 -11.515 1.379 -6.681 788 HG2 LYS 99 HG2 LYS 99 -9.922 2.149 -8.435 789 HG3 LYS 99 HG1 LYS 99 -8.834 0.845 -7.956 790 HD2 LYS 99 HD2 LYS 99 -11.670 0.475 -8.923 791 HD3 LYS 99 HD1 LYS 99 -10.226 0.266 -9.913 792 HE2 LYS 99 HE2 LYS 99 -9.470 -1.534 -8.448 793 HE3 LYS 99 HE1 LYS 99 -10.893 -1.315 -7.430 794 HZ1 LYS 99 HZ1 LYS 99 -11.222 -3.148 -8.950 795 HZ2 LYS 99 HZ2 LYS 99 -10.900 -2.158 -10.281 796 HZ3 LYS 99 HZ3 LYS 99 -12.285 -1.890 -9.344 797 H ARG 100 HN ARG 100 -11.541 4.170 -5.322 798 HA ARG 100 HA ARG 100 -10.291 5.894 -7.322 799 HB2 ARG 100 HB2 ARG 100 -12.729 5.696 -7.343 800 HB3 ARG 100 HB1 ARG 100 -12.803 6.301 -5.694 801 HG2 ARG 100 HG2 ARG 100 -13.374 7.992 -7.406 802 HG3 ARG 100 HG1 ARG 100 -12.014 8.454 -6.381 803 HD2 ARG 100 HD2 ARG 100 -10.446 7.821 -8.113 804 HD3 ARG 100 HD1 ARG 100 -11.766 7.240 -9.131 805 HE ARG 100 HE ARG 100 -12.390 9.855 -8.617 806 HH11 ARG 100 HH11 ARG 100 -9.634 8.195 -10.026 807 HH12 ARG 100 HH12 ARG 100 -9.195 9.541 -11.041 808 HH21 ARG 100 HH21 ARG 100 -11.821 11.595 -9.933 809 HH22 ARG 100 HH22 ARG 100 -10.460 11.473 -11.009 810 H ALA 101 HN ALA 101 -10.523 5.579 -3.857 811 HA ALA 101 HA ALA 101 -9.065 8.127 -3.594 812 HB1 ALA 101 HB1 ALA 101 -9.933 8.407 -1.400 813 HB2 ALA 101 HB2 ALA 101 -10.622 6.777 -1.388 814 HB3 ALA 101 HB3 ALA 101 -11.297 8.018 -2.452 815 H SER 102 HN SER 102 -7.165 6.763 -4.188 816 HA SER 102 HA SER 102 -6.139 5.354 -1.826 817 HB2 SER 102 HB2 SER 102 -5.016 5.291 -4.634 818 HB3 SER 102 HB1 SER 102 -4.570 4.243 -3.286 819 HG SER 102 HG SER 102 -7.223 4.111 -3.690 820 HA PRO 103 HA PRO 103 -3.393 8.937 -1.687 821 HB2 PRO 103 HB2 PRO 103 -4.344 9.921 0.630 822 HB3 PRO 103 HB1 PRO 103 -5.222 10.094 -0.893 823 HG2 PRO 103 HG2 PRO 103 -5.923 8.489 1.439 824 HG3 PRO 103 HG1 PRO 103 -6.908 8.871 0.017 825 HD2 PRO 103 HD2 PRO 103 -5.239 6.487 0.566 826 HD3 PRO 103 HD1 PRO 103 -6.615 6.674 -0.549 827 H LEU 104 HN LEU 104 -1.317 8.462 -1.098 828 HA LEU 104 HA LEU 104 -0.737 7.157 1.438 829 HB2 LEU 104 HB2 LEU 104 0.588 7.416 -1.088 830 HB3 LEU 104 HB1 LEU 104 1.625 8.087 0.153 831 HG LEU 104 HG LEU 104 0.517 5.278 0.083 832 HD11 LEU 104 HD11 LEU 104 3.324 6.331 -0.225 833 HD12 LEU 104 HD12 LEU 104 2.319 5.651 -1.504 834 HD13 LEU 104 HD13 LEU 104 2.858 4.631 -0.171 835 HD21 LEU 104 HD21 LEU 104 2.341 6.563 2.109 836 HD22 LEU 104 HD22 LEU 104 1.850 4.868 2.072 837 HD23 LEU 104 HD23 LEU 104 0.654 6.129 2.374 838 HA PRO 105 HA PRO 105 -0.176 11.215 3.258 839 HB2 PRO 105 HB2 PRO 105 0.508 9.996 5.745 840 HB3 PRO 105 HB1 PRO 105 -1.028 10.731 5.290 841 HG2 PRO 105 HG2 PRO 105 -0.577 8.015 5.757 842 HG3 PRO 105 HG1 PRO 105 -1.986 8.726 4.966 843 HD2 PRO 105 HD2 PRO 105 0.325 7.331 3.774 844 HD3 PRO 105 HD1 PRO 105 -1.343 7.498 3.176 845 H THR 106 HN THR 106 1.931 8.684 4.555 846 HA THR 106 HA THR 106 4.173 10.362 4.887 847 HB THR 106 HB THR 106 4.013 8.355 6.204 848 HG1 THR 106 HG1 THR 106 6.109 8.396 6.110 849 HG21 THR 106 HG21 THR 106 2.742 6.955 4.675 850 HG22 THR 106 HG22 THR 106 4.190 6.110 5.223 851 HG23 THR 106 HG23 THR 106 4.141 6.816 3.608 852 HA PRO 107 HA PRO 107 5.476 10.374 0.633 853 HB2 PRO 107 HB2 PRO 107 7.613 11.984 0.932 854 HB3 PRO 107 HB1 PRO 107 5.959 12.596 1.038 855 HG2 PRO 107 HG2 PRO 107 7.901 11.997 3.215 856 HG3 PRO 107 HG1 PRO 107 6.702 13.297 3.104 857 HD2 PRO 107 HD2 PRO 107 6.399 10.941 4.550 858 HD3 PRO 107 HD1 PRO 107 5.081 12.011 4.042 859 HA PRO 108 HA PRO 108 8.631 7.177 1.306 860 HB2 PRO 108 HB2 PRO 108 7.803 5.472 -0.554 861 HB3 PRO 108 HB1 PRO 108 6.877 5.682 0.941 862 HG2 PRO 108 HG2 PRO 108 6.346 6.783 -1.786 863 HG3 PRO 108 HG1 PRO 108 5.201 6.141 -0.596 864 HD2 PRO 108 HD2 PRO 108 5.757 8.840 -1.015 865 HD3 PRO 108 HD1 PRO 108 4.994 8.161 0.434 866 H ALA 109 HN ALA 109 9.498 9.422 0.198 867 HA ALA 109 HA ALA 109 10.132 9.497 -2.497 868 HB1 ALA 109 HB1 ALA 109 10.492 11.375 -0.982 869 HB2 ALA 109 HB2 ALA 109 11.967 10.987 -1.868 870 HB3 ALA 109 HB3 ALA 109 11.792 10.492 -0.184 871 H ASP 110 HN ASP 110 11.886 7.992 0.174 872 HA ASP 110 HA ASP 110 14.049 7.119 -1.463 873 HB2 ASP 110 HB2 ASP 110 13.229 6.394 1.349 874 HB3 ASP 110 HB1 ASP 110 14.701 5.804 0.580 875 H ALA 111 HN ALA 111 10.946 6.073 -1.212 876 HA ALA 111 HA ALA 111 11.558 3.231 -1.522 877 HB1 ALA 111 HB1 ALA 111 9.850 3.834 0.107 878 HB2 ALA 111 HB2 ALA 111 9.156 2.894 -1.214 879 HB3 ALA 111 HB3 ALA 111 8.917 4.643 -1.158 880 H TYR 112 HN TYR 112 10.660 6.008 -3.372 881 HA TYR 112 HA TYR 112 10.077 4.216 -5.612 882 HB2 TYR 112 HB2 TYR 112 8.509 5.901 -6.530 883 HB3 TYR 112 HB1 TYR 112 7.996 5.068 -5.084 884 HD1 TYR 112 HD2 TYR 112 10.183 8.095 -5.334 885 HD2 TYR 112 HD1 TYR 112 6.443 6.439 -4.188 886 HE1 TYR 112 HE2 TYR 112 9.554 10.232 -4.292 887 HE2 TYR 112 HE1 TYR 112 5.798 8.544 -3.158 888 HH TYR 112 HH TYR 112 7.441 11.440 -3.713 889 H VAL 113 HN VAL 113 12.439 5.838 -4.694 890 HA VAL 113 HA VAL 113 12.969 7.577 -6.899 891 HB VAL 113 HB VAL 113 15.444 7.181 -6.208 892 HG11 VAL 113 HG11 VAL 113 14.199 9.209 -5.733 893 HG12 VAL 113 HG12 VAL 113 15.209 8.766 -4.356 894 HG13 VAL 113 HG13 VAL 113 13.474 8.451 -4.315 895 HG21 VAL 113 HG21 VAL 113 14.092 6.104 -3.733 896 HG22 VAL 113 HG22 VAL 113 15.819 6.346 -3.988 897 HG23 VAL 113 HG23 VAL 113 14.958 5.111 -4.905 898 H ASN 114 HN ASN 114 12.505 6.596 -8.696 899 HA ASN 114 HA ASN 114 13.999 5.198 -10.365 900 HB2 ASN 114 HB2 ASN 114 13.650 2.850 -10.205 901 HB3 ASN 114 HB1 ASN 114 14.124 3.355 -8.593 902 HD21 ASN 114 HD21 ASN 114 11.550 4.397 -7.798 903 HD22 ASN 114 HD22 ASN 114 10.507 3.035 -7.599 904 H GLY 115 HN GLY 115 11.037 6.040 -9.030 905 HA2 GLY 115 HA2 GLY 115 9.734 6.695 -11.342 906 HA3 GLY 115 HA1 GLY 115 9.285 5.020 -11.048 907 H THR 116 HN THR 116 8.046 4.504 -9.229 908 HA THR 116 HA THR 116 7.087 6.485 -7.412 909 HB THR 116 HB THR 116 4.778 5.343 -8.845 910 HG1 THR 116 HG1 THR 116 6.554 7.170 -10.111 911 HG21 THR 116 HG21 THR 116 5.531 8.117 -7.931 912 HG22 THR 116 HG22 THR 116 4.539 6.956 -7.050 913 HG23 THR 116 HG23 THR 116 3.952 7.648 -8.561 914 H VAL 117 HN VAL 117 5.099 5.299 -6.131 915 HA VAL 117 HA VAL 117 6.227 2.653 -5.580 916 HB VAL 117 HB VAL 117 4.979 2.794 -3.396 917 HG11 VAL 117 HG11 VAL 117 6.601 4.297 -2.340 918 HG12 VAL 117 HG12 VAL 117 7.068 4.893 -3.932 919 HG13 VAL 117 HG13 VAL 117 7.354 3.207 -3.504 920 HG21 VAL 117 HG21 VAL 117 3.307 4.437 -3.870 921 HG22 VAL 117 HG22 VAL 117 4.531 5.640 -4.289 922 HG23 VAL 117 HG23 VAL 117 4.369 5.091 -2.619 923 H GLU 118 HN GLU 118 5.222 1.059 -6.465 924 HA GLU 118 HA GLU 118 2.283 0.994 -6.359 925 HB2 GLU 118 HB2 GLU 118 3.484 0.893 -8.645 926 HB3 GLU 118 HB1 GLU 118 4.020 -0.705 -8.156 927 HG2 GLU 118 HG2 GLU 118 1.129 0.107 -8.297 928 HG3 GLU 118 HG1 GLU 118 2.004 -0.639 -9.631 929 H LEU 119 HN LEU 119 1.636 -0.228 -4.710 930 HA LEU 119 HA LEU 119 3.061 -2.688 -4.104 931 HB2 LEU 119 HB2 LEU 119 3.351 -2.167 -1.770 932 HB3 LEU 119 HB1 LEU 119 4.143 -0.943 -2.742 933 HG LEU 119 HG LEU 119 1.674 0.192 -2.298 934 HD11 LEU 119 HD11 LEU 119 1.242 -0.043 0.088 935 HD12 LEU 119 HD12 LEU 119 2.487 -1.288 0.192 936 HD13 LEU 119 HD13 LEU 119 1.034 -1.572 -0.767 937 HD21 LEU 119 HD21 LEU 119 3.835 1.313 -2.136 938 HD22 LEU 119 HD22 LEU 119 4.175 0.457 -0.632 939 HD23 LEU 119 HD23 LEU 119 2.854 1.622 -0.704 940 H THR 120 HN THR 120 1.841 -4.146 -2.795 941 HA THR 120 HA THR 120 -0.998 -3.836 -3.306 942 HB THR 120 HB THR 120 0.551 -6.235 -2.324 943 HG1 THR 120 HG1 THR 120 0.486 -5.173 -4.702 944 HG21 THR 120 HG21 THR 120 -1.478 -7.493 -2.803 945 HG22 THR 120 HG22 THR 120 -2.299 -6.015 -3.299 946 HG23 THR 120 HG23 THR 120 -1.807 -6.231 -1.618 947 H LEU 121 HN LEU 121 -2.386 -3.248 -1.835 948 HA LEU 121 HA LEU 121 -1.838 -3.859 0.989 949 HB2 LEU 121 HB2 LEU 121 -3.010 -1.342 -0.189 950 HB3 LEU 121 HB1 LEU 121 -3.175 -1.762 1.506 951 HG LEU 121 HG LEU 121 -0.574 -1.246 0.048 952 HD11 LEU 121 HD11 LEU 121 -0.433 0.697 1.557 953 HD12 LEU 121 HD12 LEU 121 -2.067 0.349 2.127 954 HD13 LEU 121 HD13 LEU 121 -1.794 0.795 0.444 955 HD21 LEU 121 HD21 LEU 121 -1.124 -1.949 2.929 956 HD22 LEU 121 HD22 LEU 121 0.437 -1.435 2.285 957 HD23 LEU 121 HD23 LEU 121 -0.290 -2.952 1.741 958 HA PRO 122 HA PRO 122 -5.763 -5.919 0.458 959 HB2 PRO 122 HB2 PRO 122 -5.606 -6.430 3.333 960 HB3 PRO 122 HB1 PRO 122 -5.577 -7.582 1.996 961 HG2 PRO 122 HG2 PRO 122 -3.404 -7.066 3.525 962 HG3 PRO 122 HG1 PRO 122 -3.286 -7.510 1.813 963 HD2 PRO 122 HD2 PRO 122 -3.081 -4.811 3.092 964 HD3 PRO 122 HD1 PRO 122 -2.133 -5.501 1.757 965 H ILE 123 HN ILE 123 -7.550 -4.719 0.336 966 HA ILE 123 HA ILE 123 -8.121 -2.779 2.442 967 HB ILE 123 HB ILE 123 -9.834 -1.865 0.961 968 HG12 ILE 123 HG12 ILE 123 -9.029 -3.861 -1.142 969 HG13 ILE 123 HG11 ILE 123 -10.409 -4.137 -0.082 970 HG21 ILE 123 HG21 ILE 123 -8.364 -1.294 -1.045 971 HG22 ILE 123 HG22 ILE 123 -7.153 -2.353 -0.309 972 HG23 ILE 123 HG23 ILE 123 -7.715 -0.924 0.559 973 HD11 ILE 123 HD11 ILE 123 -11.103 -3.216 -2.223 974 HD12 ILE 123 HD12 ILE 123 -10.071 -1.810 -1.961 975 HD13 ILE 123 HD13 ILE 123 -11.455 -2.096 -0.906 976 H ASP 124 HN ASP 124 -8.992 -3.851 4.165 977 HA ASP 124 HA ASP 124 -10.833 -6.028 3.538 978 HB2 ASP 124 HB2 ASP 124 -10.487 -6.837 5.785 979 HB3 ASP 124 HB1 ASP 124 -8.928 -6.541 5.025 980 H PHE 125 HN PHE 125 -12.866 -5.671 3.549 981 HA PHE 125 HA PHE 125 -14.028 -4.170 5.804 982 HB2 PHE 125 HB2 PHE 125 -15.353 -4.965 3.189 983 HB3 PHE 125 HB1 PHE 125 -16.081 -4.006 4.468 984 HD1 PHE 125 HD1 PHE 125 -13.541 -4.035 1.804 985 HD2 PHE 125 HD2 PHE 125 -15.678 -1.674 4.622 986 HE1 PHE 125 HE1 PHE 125 -12.739 -1.993 0.691 987 HE2 PHE 125 HE2 PHE 125 -14.876 0.374 3.519 988 HZ PHE 125 HZ PHE 125 -13.405 0.217 1.548 989 H SER 126 HN SER 126 -15.026 -5.492 7.330 990 HA SER 126 HA SER 126 -14.454 -8.225 7.236 991 HB2 SER 126 HB2 SER 126 -16.067 -8.365 9.204 992 HB3 SER 126 HB1 SER 126 -14.708 -7.256 9.371 993 HG SER 126 HG SER 126 -17.287 -6.728 9.578 994 H LEU 127 HN LEU 127 -15.216 -9.585 5.807 995 HA LEU 127 HA LEU 127 -17.792 -9.181 4.555 996 HB2 LEU 127 HB2 LEU 127 -15.418 -10.080 3.632 997 HB3 LEU 127 HB1 LEU 127 -16.191 -11.608 3.986 998 HG LEU 127 HG LEU 127 -17.210 -9.490 2.090 999 HD11 LEU 127 HD11 LEU 127 -16.153 -12.266 1.585 1000 HD12 LEU 127 HD12 LEU 127 -15.311 -10.756 1.237 1001 HD13 LEU 127 HD13 LEU 127 -16.795 -11.158 0.371 1002 HD21 LEU 127 HD21 LEU 127 -18.959 -11.100 1.507 1003 HD22 LEU 127 HD22 LEU 127 -19.080 -10.574 3.186 1004 HD23 LEU 127 HD23 LEU 127 -18.409 -12.160 2.807 1005 H ARG 128 HN ARG 128 -19.392 -9.719 5.991 1006 HA ARG 128 HA ARG 128 -19.396 -12.241 7.356 1007 HB2 ARG 128 HB2 ARG 128 -21.462 -10.073 7.010 1008 HB3 ARG 128 HB1 ARG 128 -21.767 -11.553 7.900 1009 HG2 ARG 128 HG2 ARG 128 -19.910 -11.000 9.417 1010 HG3 ARG 128 HG1 ARG 128 -19.678 -9.486 8.537 1011 HD2 ARG 128 HD2 ARG 128 -20.984 -9.186 10.595 1012 HD3 ARG 128 HD1 ARG 128 -21.898 -8.755 9.151 1013 HE ARG 128 HE ARG 128 -22.579 -11.353 9.584 1014 HH11 ARG 128 HH11 ARG 128 -22.558 -8.502 11.620 1015 HH12 ARG 128 HH12 ARG 128 -23.941 -9.014 12.548 1016 HH21 ARG 128 HH21 ARG 128 -24.421 -11.994 10.789 1017 HH22 ARG 128 HH22 ARG 128 -25.012 -10.960 12.055 1018 H GLY 129 HN GLY 129 -21.249 -10.807 4.652 1019 HA2 GLY 129 HA2 GLY 129 -21.068 -12.890 2.915 1020 HA3 GLY 129 HA1 GLY 129 -22.389 -13.367 3.970 1021 H ALA 130 HN ALA 130 -21.311 -10.519 2.104 1022 HA ALA 130 HA ALA 130 -24.132 -10.005 1.457 1023 HB1 ALA 130 HB1 ALA 130 -23.493 -7.752 0.923 1024 HB2 ALA 130 HB2 ALA 130 -21.784 -8.150 1.084 1025 HB3 ALA 130 HB3 ALA 130 -22.830 -8.165 2.507 1026 H GLY 131 HN GLY 131 -21.760 -11.739 0.216 1027 HA2 GLY 131 HA2 GLY 131 -21.989 -10.780 -2.547 1028 HA3 GLY 131 HA1 GLY 131 -20.819 -11.955 -1.955 1029 H PHE 132 HN PHE 132 -24.353 -11.576 -2.148 1030 HA PHE 132 HA PHE 132 -24.514 -14.272 -3.260 1031 HB2 PHE 132 HB2 PHE 132 -26.271 -14.942 -1.754 1032 HB3 PHE 132 HB1 PHE 132 -24.900 -14.403 -0.792 1033 HD1 PHE 132 HD1 PHE 132 -24.986 -12.001 0.120 1034 HD2 PHE 132 HD2 PHE 132 -28.384 -14.075 -1.383 1035 HE1 PHE 132 HE1 PHE 132 -26.464 -10.474 1.360 1036 HE2 PHE 132 HE2 PHE 132 -29.867 -12.552 -0.148 1037 HZ PHE 132 HZ PHE 132 -28.908 -10.749 1.227 Start of MODEL 6 1 H1 LYS 2 HT1 LYS 2 -3.265 -35.342 8.739 2 H2 LYS 2 HT2 LYS 2 -2.940 -35.992 7.207 3 H3 LYS 2 HT3 LYS 2 -1.849 -34.913 7.923 4 HA LYS 2 HA LYS 2 -1.347 -36.471 9.658 5 HB2 LYS 2 HB2 LYS 2 -3.206 -38.314 8.138 6 HB3 LYS 2 HB1 LYS 2 -2.196 -38.782 9.497 7 HG2 LYS 2 HG2 LYS 2 -3.452 -37.206 10.926 8 HG3 LYS 2 HG1 LYS 2 -4.505 -36.849 9.555 9 HD2 LYS 2 HD2 LYS 2 -5.092 -39.260 9.442 10 HD3 LYS 2 HD1 LYS 2 -4.131 -39.525 10.898 11 HE2 LYS 2 HE2 LYS 2 -6.456 -39.342 11.502 12 HE3 LYS 2 HE1 LYS 2 -5.590 -37.929 12.101 13 HZ1 LYS 2 HZ1 LYS 2 -7.742 -37.389 11.066 14 HZ2 LYS 2 HZ2 LYS 2 -7.166 -37.991 9.583 15 HZ3 LYS 2 HZ3 LYS 2 -6.437 -36.635 10.286 16 H VAL 3 HN VAL 3 0.620 -37.268 9.323 17 HA VAL 3 HA VAL 3 2.500 -38.026 8.300 18 HB VAL 3 HB VAL 3 0.668 -39.578 6.473 19 HG11 VAL 3 HG11 VAL 3 3.011 -39.653 5.850 20 HG12 VAL 3 HG12 VAL 3 2.497 -41.216 6.485 21 HG13 VAL 3 HG13 VAL 3 3.451 -40.126 7.492 22 HG21 VAL 3 HG21 VAL 3 0.715 -41.367 8.159 23 HG22 VAL 3 HG22 VAL 3 -0.070 -39.909 8.767 24 HG23 VAL 3 HG23 VAL 3 1.579 -40.293 9.258 25 H GLN 4 HN GLN 4 2.532 -35.712 7.507 26 HA GLN 4 HA GLN 4 3.150 -35.805 4.673 27 HB2 GLN 4 HB2 GLN 4 1.906 -33.715 4.191 28 HB3 GLN 4 HB1 GLN 4 0.852 -35.060 4.600 29 HG2 GLN 4 HG2 GLN 4 0.645 -34.164 6.884 30 HG3 GLN 4 HG1 GLN 4 1.640 -32.789 6.409 31 HE21 GLN 4 HE21 GLN 4 -0.703 -34.278 4.294 32 HE22 GLN 4 HE22 GLN 4 -1.816 -32.950 4.271 33 H GLU 5 HN GLU 5 4.372 -33.878 3.973 34 HA GLU 5 HA GLU 5 5.980 -32.848 6.224 35 HB2 GLU 5 HB2 GLU 5 6.856 -34.508 4.297 36 HB3 GLU 5 HB1 GLU 5 7.117 -32.977 3.478 37 HG2 GLU 5 HG2 GLU 5 8.236 -33.738 6.166 38 HG3 GLU 5 HG1 GLU 5 9.114 -33.762 4.639 39 H GLN 6 HN GLN 6 6.110 -30.680 6.428 40 HA GLN 6 HA GLN 6 4.644 -29.094 4.428 41 HB2 GLN 6 HB2 GLN 6 5.221 -28.409 7.312 42 HB3 GLN 6 HB1 GLN 6 4.150 -27.546 6.219 43 HG2 GLN 6 HG2 GLN 6 2.658 -29.458 6.136 44 HG3 GLN 6 HG1 GLN 6 3.747 -30.367 7.183 45 HE21 GLN 6 HE21 GLN 6 4.367 -28.015 8.814 46 HE22 GLN 6 HE22 GLN 6 2.969 -27.730 9.795 47 H SER 7 HN SER 7 7.670 -29.815 4.830 48 HA SER 7 HA SER 7 9.636 -28.893 4.210 49 HB2 SER 7 HB2 SER 7 8.046 -26.420 3.477 50 HB3 SER 7 HB1 SER 7 9.680 -26.815 2.944 51 HG SER 7 HG SER 7 8.536 -28.841 2.124 52 H VAL 8 HN VAL 8 8.093 -25.882 5.250 53 HA VAL 8 HA VAL 8 10.032 -25.737 7.468 54 HB VAL 8 HB VAL 8 8.926 -23.387 5.911 55 HG11 VAL 8 HG11 VAL 8 9.526 -22.838 8.204 56 HG12 VAL 8 HG12 VAL 8 10.666 -22.106 7.074 57 HG13 VAL 8 HG13 VAL 8 11.121 -23.554 7.973 58 HG21 VAL 8 HG21 VAL 8 11.166 -23.184 4.928 59 HG22 VAL 8 HG22 VAL 8 10.383 -24.701 4.478 60 HG23 VAL 8 HG23 VAL 8 11.639 -24.690 5.717 61 H GLY 9 HN GLY 9 6.755 -25.337 6.386 62 HA2 GLY 9 HA2 GLY 9 4.892 -25.445 7.852 63 HA3 GLY 9 HA1 GLY 9 5.914 -24.854 9.154 64 H ALA 10 HN ALA 10 6.432 -23.167 6.309 65 HA ALA 10 HA ALA 10 4.827 -20.914 7.292 66 HB1 ALA 10 HB1 ALA 10 7.141 -20.909 5.350 67 HB2 ALA 10 HB2 ALA 10 7.244 -20.523 7.068 68 HB3 ALA 10 HB3 ALA 10 6.310 -19.492 5.985 69 HA PRO 11 HA PRO 11 2.208 -21.670 3.791 70 HB2 PRO 11 HB2 PRO 11 0.401 -19.737 4.268 71 HB3 PRO 11 HB1 PRO 11 0.503 -21.193 5.263 72 HG2 PRO 11 HG2 PRO 11 1.485 -18.436 5.829 73 HG3 PRO 11 HG1 PRO 11 0.767 -19.622 6.933 74 HD2 PRO 11 HD2 PRO 11 3.480 -19.107 6.685 75 HD3 PRO 11 HD1 PRO 11 2.778 -20.583 7.375 76 HA PRO 12 HA PRO 12 3.838 -18.599 0.930 77 HB2 PRO 12 HB2 PRO 12 2.569 -20.203 -1.137 78 HB3 PRO 12 HB1 PRO 12 4.288 -19.941 -0.840 79 HG2 PRO 12 HG2 PRO 12 3.056 -22.333 -0.439 80 HG3 PRO 12 HG1 PRO 12 4.475 -21.805 0.483 81 HD2 PRO 12 HD2 PRO 12 1.585 -21.775 1.265 82 HD3 PRO 12 HD1 PRO 12 3.012 -22.196 2.238 83 HA PRO 13 HA PRO 13 -0.177 -16.567 0.783 84 HB2 PRO 13 HB2 PRO 13 0.757 -14.059 0.432 85 HB3 PRO 13 HB1 PRO 13 0.822 -14.882 1.995 86 HG2 PRO 13 HG2 PRO 13 2.980 -14.511 -0.042 87 HG3 PRO 13 HG1 PRO 13 3.071 -14.370 1.722 88 HD2 PRO 13 HD2 PRO 13 3.890 -16.577 0.335 89 HD3 PRO 13 HD1 PRO 13 3.303 -16.634 2.011 90 H GLY 14 HN GLY 14 -0.023 -17.916 -1.410 91 HA2 GLY 14 HA2 GLY 14 -0.745 -17.909 -3.587 92 HA3 GLY 14 HA1 GLY 14 -1.192 -16.231 -3.335 93 H ARG 15 HN ARG 15 1.673 -18.263 -3.933 94 HA ARG 15 HA ARG 15 2.424 -16.541 -6.107 95 HB2 ARG 15 HB2 ARG 15 4.808 -16.283 -5.128 96 HB3 ARG 15 HB1 ARG 15 3.543 -15.195 -4.589 97 HG2 ARG 15 HG2 ARG 15 4.653 -15.751 -2.639 98 HG3 ARG 15 HG1 ARG 15 3.255 -16.824 -2.625 99 HD2 ARG 15 HD2 ARG 15 5.202 -18.068 -1.976 100 HD3 ARG 15 HD1 ARG 15 4.685 -18.616 -3.569 101 HE ARG 15 HE ARG 15 6.827 -16.621 -3.359 102 HH11 ARG 15 HH11 ARG 15 5.741 -19.820 -4.252 103 HH12 ARG 15 HH12 ARG 15 7.235 -20.261 -5.030 104 HH21 ARG 15 HH21 ARG 15 8.800 -17.191 -4.403 105 HH22 ARG 15 HH22 ARG 15 8.959 -18.764 -5.133 106 H ALA 16 HN ALA 16 3.361 -17.633 -7.676 107 HA ALA 16 HA ALA 16 4.320 -20.358 -7.081 108 HB1 ALA 16 HB1 ALA 16 3.276 -19.241 -9.684 109 HB2 ALA 16 HB2 ALA 16 2.370 -20.259 -8.566 110 HB3 ALA 16 HB3 ALA 16 3.786 -20.905 -9.395 111 H ASP 17 HN ASP 17 6.226 -21.085 -8.040 112 HA ASP 17 HA ASP 17 8.171 -18.969 -8.456 113 HB2 ASP 17 HB2 ASP 17 8.514 -21.973 -8.294 114 HB3 ASP 17 HB1 ASP 17 9.833 -20.811 -8.411 115 H LYS 18 HN LYS 18 6.066 -19.804 -10.474 116 HA LYS 18 HA LYS 18 7.915 -20.214 -12.726 117 HB2 LYS 18 HB2 LYS 18 4.984 -20.947 -12.606 118 HB3 LYS 18 HB1 LYS 18 6.069 -21.231 -13.959 119 HG2 LYS 18 HG2 LYS 18 7.432 -22.687 -12.448 120 HG3 LYS 18 HG1 LYS 18 6.156 -22.517 -11.241 121 HD2 LYS 18 HD2 LYS 18 5.754 -24.559 -12.395 122 HD3 LYS 18 HD1 LYS 18 4.552 -23.401 -12.965 123 HE2 LYS 18 HE2 LYS 18 5.440 -24.646 -14.840 124 HE3 LYS 18 HE1 LYS 18 5.948 -22.963 -14.947 125 HZ1 LYS 18 HZ1 LYS 18 8.095 -23.629 -13.976 126 HZ2 LYS 18 HZ2 LYS 18 7.791 -24.398 -15.455 127 HZ3 LYS 18 HZ3 LYS 18 7.595 -25.250 -14.000 128 H THR 19 HN THR 19 5.667 -18.123 -11.255 129 HA THR 19 HA THR 19 5.662 -16.448 -13.666 130 HB THR 19 HB THR 19 3.437 -15.537 -12.822 131 HG1 THR 19 HG1 THR 19 2.246 -17.053 -11.521 132 HG21 THR 19 HG21 THR 19 3.525 -18.408 -13.754 133 HG22 THR 19 HG22 THR 19 3.621 -16.985 -14.791 134 HG23 THR 19 HG23 THR 19 2.145 -17.318 -13.885 135 H ALA 20 HN ALA 20 4.601 -15.992 -10.299 136 HA ALA 20 HA ALA 20 5.966 -13.433 -10.231 137 HB1 ALA 20 HB1 ALA 20 3.698 -13.610 -9.325 138 HB2 ALA 20 HB2 ALA 20 4.848 -13.106 -8.087 139 HB3 ALA 20 HB3 ALA 20 4.268 -14.771 -8.128 140 H ALA 21 HN ALA 21 7.729 -15.464 -10.491 141 HA ALA 21 HA ALA 21 8.817 -16.303 -7.976 142 HB1 ALA 21 HB1 ALA 21 10.633 -17.261 -9.309 143 HB2 ALA 21 HB2 ALA 21 10.002 -16.456 -10.746 144 HB3 ALA 21 HB3 ALA 21 9.051 -17.706 -9.946 145 HA PRO 22 HA PRO 22 12.157 -12.952 -8.908 146 HB2 PRO 22 HB2 PRO 22 11.699 -11.086 -10.787 147 HB3 PRO 22 HB1 PRO 22 12.398 -12.661 -11.182 148 HG2 PRO 22 HG2 PRO 22 9.567 -11.724 -11.463 149 HG3 PRO 22 HG1 PRO 22 10.560 -12.644 -12.611 150 HD2 PRO 22 HD2 PRO 22 8.723 -13.805 -10.980 151 HD3 PRO 22 HD1 PRO 22 10.192 -14.632 -11.530 152 H GLN 23 HN GLN 23 9.738 -12.874 -7.359 153 HA GLN 23 HA GLN 23 8.628 -11.536 -5.902 154 HB2 GLN 23 HB2 GLN 23 10.878 -9.619 -6.535 155 HB3 GLN 23 HB1 GLN 23 9.770 -9.469 -5.179 156 HG2 GLN 23 HG2 GLN 23 11.669 -11.759 -5.632 157 HG3 GLN 23 HG1 GLN 23 11.932 -10.416 -4.520 158 HE21 GLN 23 HE21 GLN 23 9.203 -10.254 -3.644 159 HE22 GLN 23 HE22 GLN 23 8.904 -11.636 -2.644 160 H THR 24 HN THR 24 7.634 -11.529 -8.498 161 HA THR 24 HA THR 24 7.107 -8.956 -9.528 162 HB THR 24 HB THR 24 5.218 -11.276 -9.840 163 HG1 THR 24 HG1 THR 24 7.027 -11.473 -11.734 164 HG21 THR 24 HG21 THR 24 6.226 -9.167 -11.765 165 HG22 THR 24 HG22 THR 24 4.663 -9.147 -10.944 166 HG23 THR 24 HG23 THR 24 5.026 -10.408 -12.124 167 H ARG 25 HN ARG 25 5.884 -10.630 -6.815 168 HA ARG 25 HA ARG 25 3.295 -9.437 -6.680 169 HB2 ARG 25 HB2 ARG 25 3.231 -10.331 -4.395 170 HB3 ARG 25 HB1 ARG 25 3.782 -11.543 -5.544 171 HG2 ARG 25 HG2 ARG 25 6.115 -11.053 -4.864 172 HG3 ARG 25 HG1 ARG 25 5.485 -9.960 -3.632 173 HD2 ARG 25 HD2 ARG 25 4.963 -12.924 -3.843 174 HD3 ARG 25 HD1 ARG 25 6.003 -12.126 -2.664 175 HE ARG 25 HE ARG 25 3.066 -11.793 -2.783 176 HH11 ARG 25 HH11 ARG 25 6.069 -11.970 -0.973 177 HH12 ARG 25 HH12 ARG 25 5.280 -11.807 0.569 178 HH21 ARG 25 HH21 ARG 25 2.047 -11.610 -0.757 179 HH22 ARG 25 HH22 ARG 25 3.012 -11.601 0.697 180 H LEU 26 HN LEU 26 6.452 -8.388 -5.889 181 HA LEU 26 HA LEU 26 5.574 -5.765 -5.252 182 HB2 LEU 26 HB2 LEU 26 5.169 -6.876 -3.077 183 HB3 LEU 26 HB1 LEU 26 6.853 -7.353 -3.019 184 HG LEU 26 HG LEU 26 7.484 -4.940 -2.985 185 HD11 LEU 26 HD11 LEU 26 5.780 -3.277 -2.508 186 HD12 LEU 26 HD12 LEU 26 4.523 -4.507 -2.645 187 HD13 LEU 26 HD13 LEU 26 5.475 -4.059 -4.060 188 HD21 LEU 26 HD21 LEU 26 6.814 -4.559 -0.654 189 HD22 LEU 26 HD22 LEU 26 7.364 -6.213 -0.919 190 HD23 LEU 26 HD23 LEU 26 5.640 -5.868 -0.785 191 H THR 27 HN THR 27 6.974 -5.870 -7.193 192 HA THR 27 HA THR 27 9.698 -6.510 -7.053 193 HB THR 27 HB THR 27 8.424 -4.535 -8.950 194 HG1 THR 27 HG1 THR 27 8.364 -7.360 -8.790 195 HG21 THR 27 HG21 THR 27 10.809 -6.369 -9.232 196 HG22 THR 27 HG22 THR 27 10.878 -4.621 -9.003 197 HG23 THR 27 HG23 THR 27 10.180 -5.291 -10.478 198 HA PRO 28 HA PRO 28 10.616 -1.986 -5.899 199 HB2 PRO 28 HB2 PRO 28 8.634 -0.179 -5.647 200 HB3 PRO 28 HB1 PRO 28 9.401 -0.512 -7.204 201 HG2 PRO 28 HG2 PRO 28 6.766 -1.424 -6.154 202 HG3 PRO 28 HG1 PRO 28 7.222 -0.965 -7.803 203 HD2 PRO 28 HD2 PRO 28 6.991 -3.569 -6.869 204 HD3 PRO 28 HD1 PRO 28 7.899 -3.076 -8.311 205 H TYR 29 HN TYR 29 11.123 -2.633 -3.848 206 HA TYR 29 HA TYR 29 9.103 -3.472 -2.001 207 HB2 TYR 29 HB2 TYR 29 11.612 -4.220 -2.214 208 HB3 TYR 29 HB1 TYR 29 11.906 -2.850 -1.147 209 HD1 TYR 29 HD2 TYR 29 10.580 -2.782 1.060 210 HD2 TYR 29 HD1 TYR 29 10.945 -6.273 -1.336 211 HE1 TYR 29 HE2 TYR 29 9.962 -4.164 2.992 212 HE2 TYR 29 HE1 TYR 29 10.311 -7.669 0.585 213 HH TYR 29 HH TYR 29 8.831 -6.538 3.252 214 H ALA 30 HN ALA 30 7.798 -1.601 -1.901 215 HA ALA 30 HA ALA 30 8.858 0.844 -0.803 216 HB1 ALA 30 HB1 ALA 30 5.997 0.042 -1.324 217 HB2 ALA 30 HB2 ALA 30 7.054 0.870 -2.467 218 HB3 ALA 30 HB3 ALA 30 6.576 1.669 -0.969 219 H GLN 31 HN GLN 31 9.696 -0.348 1.138 220 HA GLN 31 HA GLN 31 7.703 -1.059 3.119 221 HB2 GLN 31 HB2 GLN 31 9.711 -1.484 4.581 222 HB3 GLN 31 HB1 GLN 31 9.617 -2.460 3.125 223 HG2 GLN 31 HG2 GLN 31 11.254 -1.032 2.039 224 HG3 GLN 31 HG1 GLN 31 11.325 -0.006 3.473 225 HE21 GLN 31 HE21 GLN 31 11.135 -2.288 5.296 226 HE22 GLN 31 HE22 GLN 31 12.686 -3.048 5.271 227 H ALA 32 HN ALA 32 6.874 1.232 2.871 228 HA ALA 32 HA ALA 32 8.366 3.155 4.506 229 HB1 ALA 32 HB1 ALA 32 6.715 4.790 3.746 230 HB2 ALA 32 HB2 ALA 32 5.832 3.516 2.904 231 HB3 ALA 32 HB3 ALA 32 7.460 3.952 2.385 232 H GLY 33 HN GLY 33 5.284 1.447 4.394 233 HA2 GLY 33 HA2 GLY 33 4.983 1.963 7.273 234 HA3 GLY 33 HA1 GLY 33 3.623 2.208 6.183 235 H GLU 34 HN GLU 34 5.657 -0.111 7.758 236 HA GLU 34 HA GLU 34 4.335 -2.352 6.440 237 HB2 GLU 34 HB2 GLU 34 6.538 -2.374 8.508 238 HB3 GLU 34 HB1 GLU 34 6.009 -3.733 7.528 239 HG2 GLU 34 HG2 GLU 34 7.230 -1.218 6.419 240 HG3 GLU 34 HG1 GLU 34 8.129 -2.690 6.781 241 H ASP 35 HN ASP 35 3.942 -0.436 9.121 242 HA ASP 35 HA ASP 35 2.604 -2.575 10.647 243 HB2 ASP 35 HB2 ASP 35 3.909 -0.081 11.752 244 HB3 ASP 35 HB1 ASP 35 3.145 -1.357 12.691 245 H ASN 36 HN ASN 36 2.606 0.983 10.807 246 HA ASN 36 HA ASN 36 -0.336 0.848 10.934 247 HB2 ASN 36 HB2 ASN 36 0.960 1.540 13.030 248 HB3 ASN 36 HB1 ASN 36 1.382 3.009 12.160 249 HD21 ASN 36 HD21 ASN 36 -1.140 1.209 13.704 250 HD22 ASN 36 HD22 ASN 36 -2.304 2.491 13.749 251 H TRP 37 HN TRP 37 -0.304 1.021 8.579 252 HA TRP 37 HA TRP 37 0.296 3.764 7.679 253 HB2 TRP 37 HB2 TRP 37 1.607 1.648 6.742 254 HB3 TRP 37 HB1 TRP 37 0.175 1.508 5.734 255 HD1 TRP 37 HD1 TRP 37 1.073 5.064 6.451 256 HE1 TRP 37 HE1 TRP 37 2.242 6.095 4.396 257 HE3 TRP 37 HE3 TRP 37 1.836 0.802 3.760 258 HZ2 TRP 37 HZ2 TRP 37 3.340 5.192 1.945 259 HZ3 TRP 37 HZ3 TRP 37 2.954 0.957 1.581 260 HH2 TRP 37 HH2 TRP 37 3.687 3.106 0.706 261 H ARG 38 HN ARG 38 -1.941 1.052 7.527 262 HA ARG 38 HA ARG 38 -3.603 2.150 5.501 263 HB2 ARG 38 HB2 ARG 38 -5.130 0.380 5.945 264 HB3 ARG 38 HB1 ARG 38 -3.510 -0.287 6.097 265 HG2 ARG 38 HG2 ARG 38 -3.693 -0.140 8.538 266 HG3 ARG 38 HG1 ARG 38 -5.324 0.507 8.371 267 HD2 ARG 38 HD2 ARG 38 -5.705 -1.748 8.770 268 HD3 ARG 38 HD1 ARG 38 -5.784 -1.647 7.012 269 HE ARG 38 HE ARG 38 -3.174 -2.292 8.060 270 HH11 ARG 38 HH11 ARG 38 -6.233 -3.591 6.898 271 HH12 ARG 38 HH12 ARG 38 -5.573 -5.168 6.596 272 HH21 ARG 38 HH21 ARG 38 -2.337 -4.358 7.675 273 HH22 ARG 38 HH22 ARG 38 -3.362 -5.602 7.015 274 H SER 39 HN SER 39 -3.492 2.424 8.956 275 HA SER 39 HA SER 39 -6.010 3.626 9.358 276 HB2 SER 39 HB2 SER 39 -4.576 4.605 11.390 277 HB3 SER 39 HB1 SER 39 -5.078 2.913 11.339 278 HG SER 39 HG SER 39 -2.632 3.790 11.512 279 H ARG 40 HN ARG 40 -2.826 4.859 8.468 280 HA ARG 40 HA ARG 40 -3.525 7.604 8.680 281 HB2 ARG 40 HB2 ARG 40 -1.319 6.420 6.993 282 HB3 ARG 40 HB1 ARG 40 -1.406 7.996 7.729 283 HG2 ARG 40 HG2 ARG 40 -1.082 5.410 9.202 284 HG3 ARG 40 HG1 ARG 40 0.178 6.609 8.906 285 HD2 ARG 40 HD2 ARG 40 -2.324 7.003 10.544 286 HD3 ARG 40 HD1 ARG 40 -0.689 6.805 11.169 287 HE ARG 40 HE ARG 40 -0.683 8.985 9.419 288 HH11 ARG 40 HH11 ARG 40 -1.979 8.072 12.543 289 HH12 ARG 40 HH12 ARG 40 -2.105 9.707 13.113 290 HH21 ARG 40 HH21 ARG 40 -0.818 11.146 10.181 291 HH22 ARG 40 HH22 ARG 40 -1.423 11.457 11.783 292 H ILE 41 HN ILE 41 -3.312 5.214 6.096 293 HA ILE 41 HA ILE 41 -3.959 6.874 3.923 294 HB ILE 41 HB ILE 41 -4.506 3.919 4.359 295 HG12 ILE 41 HG12 ILE 41 -2.325 5.319 2.797 296 HG13 ILE 41 HG11 ILE 41 -2.126 4.609 4.394 297 HG21 ILE 41 HG21 ILE 41 -4.763 3.760 1.923 298 HG22 ILE 41 HG22 ILE 41 -4.654 5.516 1.802 299 HG23 ILE 41 HG23 ILE 41 -6.010 4.772 2.653 300 HD11 ILE 41 HD11 ILE 41 -1.261 3.150 2.661 301 HD12 ILE 41 HD12 ILE 41 -2.845 3.114 1.885 302 HD13 ILE 41 HD13 ILE 41 -2.631 2.412 3.489 303 H SER 42 HN SER 42 -5.986 4.968 6.147 304 HA SER 42 HA SER 42 -8.485 5.418 5.028 305 HB2 SER 42 HB2 SER 42 -8.057 3.871 6.904 306 HB3 SER 42 HB1 SER 42 -7.798 5.249 7.972 307 HG SER 42 HG SER 42 -9.933 4.346 8.088 308 H GLY 43 HN GLY 43 -6.622 7.493 7.235 309 HA2 GLY 43 HA2 GLY 43 -8.588 9.488 7.588 310 HA3 GLY 43 HA1 GLY 43 -6.855 9.720 7.762 311 H ARG 44 HN ARG 44 -6.067 9.085 5.142 312 HA ARG 44 HA ARG 44 -6.533 11.546 3.834 313 HB2 ARG 44 HB2 ARG 44 -4.991 9.075 3.364 314 HB3 ARG 44 HB1 ARG 44 -5.419 9.998 1.946 315 HG2 ARG 44 HG2 ARG 44 -3.263 10.694 2.639 316 HG3 ARG 44 HG1 ARG 44 -4.390 11.997 3.017 317 HD2 ARG 44 HD2 ARG 44 -4.500 11.198 5.338 318 HD3 ARG 44 HD1 ARG 44 -3.330 9.933 4.941 319 HE ARG 44 HE ARG 44 -1.974 12.106 4.206 320 HH11 ARG 44 HH11 ARG 44 -3.847 11.503 7.114 321 HH12 ARG 44 HH12 ARG 44 -2.907 12.586 8.096 322 HH21 ARG 44 HH21 ARG 44 -0.705 13.488 5.507 323 HH22 ARG 44 HH22 ARG 44 -1.118 13.704 7.182 324 H LEU 45 HN LEU 45 -7.798 8.292 3.496 325 HA LEU 45 HA LEU 45 -9.172 8.624 1.049 326 HB2 LEU 45 HB2 LEU 45 -8.634 6.537 2.646 327 HB3 LEU 45 HB1 LEU 45 -10.275 6.853 3.169 328 HG LEU 45 HG LEU 45 -9.688 6.537 0.255 329 HD11 LEU 45 HD11 LEU 45 -10.162 4.280 2.198 330 HD12 LEU 45 HD12 LEU 45 -8.626 4.633 1.404 331 HD13 LEU 45 HD13 LEU 45 -10.026 4.141 0.446 332 HD21 LEU 45 HD21 LEU 45 -12.070 5.978 2.013 333 HD22 LEU 45 HD22 LEU 45 -11.986 5.595 0.293 334 HD23 LEU 45 HD23 LEU 45 -11.903 7.276 0.830 335 H ASN 46 HN ASN 46 -9.802 9.556 4.271 336 HA ASN 46 HA ASN 46 -12.617 9.965 4.090 337 HB2 ASN 46 HB2 ASN 46 -11.489 9.555 6.248 338 HB3 ASN 46 HB1 ASN 46 -10.606 11.066 6.076 339 HD21 ASN 46 HD21 ASN 46 -11.608 12.981 6.532 340 HD22 ASN 46 HD22 ASN 46 -13.194 13.075 7.237 341 H ARG 47 HN ARG 47 -9.733 11.941 3.776 342 HA ARG 47 HA ARG 47 -10.833 14.441 3.438 343 HB2 ARG 47 HB2 ARG 47 -8.685 14.936 3.119 344 HB3 ARG 47 HB1 ARG 47 -8.347 13.236 3.291 345 HG2 ARG 47 HG2 ARG 47 -8.531 12.958 0.841 346 HG3 ARG 47 HG1 ARG 47 -8.778 14.709 0.701 347 HD2 ARG 47 HD2 ARG 47 -6.605 15.132 1.694 348 HD3 ARG 47 HD1 ARG 47 -6.355 13.405 1.943 349 HE ARG 47 HE ARG 47 -6.826 13.922 -0.789 350 HH11 ARG 47 HH11 ARG 47 -4.383 14.431 1.669 351 HH12 ARG 47 HH12 ARG 47 -3.059 14.342 0.546 352 HH21 ARG 47 HH21 ARG 47 -5.079 13.806 -2.269 353 HH22 ARG 47 HH22 ARG 47 -3.451 13.984 -1.691 354 H PHE 48 HN PHE 48 -10.727 11.709 1.261 355 HA PHE 48 HA PHE 48 -11.781 13.293 -0.907 356 HB2 PHE 48 HB2 PHE 48 -11.259 10.330 -0.710 357 HB3 PHE 48 HB1 PHE 48 -11.879 11.132 -2.149 358 HD1 PHE 48 HD1 PHE 48 -10.441 12.876 -3.270 359 HD2 PHE 48 HD2 PHE 48 -8.967 10.240 -0.272 360 HE1 PHE 48 HE1 PHE 48 -8.141 13.310 -4.025 361 HE2 PHE 48 HE2 PHE 48 -6.661 10.672 -1.019 362 HZ PHE 48 HZ PHE 48 -6.246 12.207 -2.900 363 H LYS 49 HN LYS 49 -12.801 10.427 0.867 364 HA LYS 49 HA LYS 49 -15.203 11.346 1.843 365 HB2 LYS 49 HB2 LYS 49 -15.428 10.585 -0.960 366 HB3 LYS 49 HB1 LYS 49 -16.443 9.591 0.068 367 HG2 LYS 49 HG2 LYS 49 -17.559 11.517 0.955 368 HG3 LYS 49 HG1 LYS 49 -16.460 12.598 0.097 369 HD2 LYS 49 HD2 LYS 49 -18.304 10.634 -1.253 370 HD3 LYS 49 HD1 LYS 49 -18.693 12.334 -0.981 371 HE2 LYS 49 HE2 LYS 49 -16.372 11.270 -2.593 372 HE3 LYS 49 HE1 LYS 49 -17.849 11.984 -3.241 373 HZ1 LYS 49 HZ1 LYS 49 -17.257 14.048 -2.020 374 HZ2 LYS 49 HZ2 LYS 49 -16.164 13.637 -3.249 375 HZ3 LYS 49 HZ3 LYS 49 -15.760 13.348 -1.627 376 H ARG 50 HN ARG 50 -14.823 10.082 3.589 377 HA ARG 50 HA ARG 50 -14.630 7.194 3.089 378 HB2 ARG 50 HB2 ARG 50 -12.805 8.295 4.439 379 HB3 ARG 50 HB1 ARG 50 -14.014 8.643 5.668 380 HG2 ARG 50 HG2 ARG 50 -14.434 6.242 5.912 381 HG3 ARG 50 HG1 ARG 50 -13.184 5.915 4.710 382 HD2 ARG 50 HD2 ARG 50 -12.244 5.633 6.900 383 HD3 ARG 50 HD1 ARG 50 -11.550 7.077 6.162 384 HE ARG 50 HE ARG 50 -13.758 7.885 7.661 385 HH11 ARG 50 HH11 ARG 50 -10.621 6.421 8.197 386 HH12 ARG 50 HH12 ARG 50 -10.458 7.056 9.807 387 HH21 ARG 50 HH21 ARG 50 -13.558 8.724 9.765 388 HH22 ARG 50 HH22 ARG 50 -12.146 8.374 10.707 389 H TYR 51 HN TYR 51 -16.672 6.491 2.979 390 HA TYR 51 HA TYR 51 -18.784 7.527 4.584 391 HB2 TYR 51 HB2 TYR 51 -18.815 6.216 2.280 392 HB3 TYR 51 HB1 TYR 51 -18.921 4.807 3.335 393 HD1 TYR 51 HD2 TYR 51 -20.592 7.938 2.335 394 HD2 TYR 51 HD1 TYR 51 -20.944 4.295 4.499 395 HE1 TYR 51 HE2 TYR 51 -23.005 8.326 2.579 396 HE2 TYR 51 HE1 TYR 51 -23.359 4.673 4.750 397 HH TYR 51 HH TYR 51 -24.951 6.483 4.721 398 HA PRO 52 HA PRO 52 -17.857 5.539 8.425 399 HB2 PRO 52 HB2 PRO 52 -20.838 5.393 8.576 400 HB3 PRO 52 HB1 PRO 52 -19.679 5.978 9.777 401 HG2 PRO 52 HG2 PRO 52 -21.100 7.697 8.345 402 HG3 PRO 52 HG1 PRO 52 -19.389 8.014 8.693 403 HD2 PRO 52 HD2 PRO 52 -20.671 7.084 6.164 404 HD3 PRO 52 HD1 PRO 52 -19.279 8.162 6.394 405 H LYS 53 HN LYS 53 -17.456 3.491 8.933 406 HA LYS 53 HA LYS 53 -17.964 1.446 7.063 407 HB2 LYS 53 HB2 LYS 53 -16.998 1.218 9.921 408 HB3 LYS 53 HB1 LYS 53 -16.926 -0.064 8.726 409 HG2 LYS 53 HG2 LYS 53 -15.477 2.574 8.555 410 HG3 LYS 53 HG1 LYS 53 -14.765 1.036 9.036 411 HD2 LYS 53 HD2 LYS 53 -14.159 1.100 6.823 412 HD3 LYS 53 HD1 LYS 53 -15.698 0.246 6.703 413 HE2 LYS 53 HE2 LYS 53 -15.616 1.954 4.998 414 HE3 LYS 53 HE1 LYS 53 -16.807 2.410 6.220 415 HZ1 LYS 53 HZ1 LYS 53 -15.006 3.796 7.244 416 HZ2 LYS 53 HZ2 LYS 53 -15.560 4.323 5.739 417 HZ3 LYS 53 HZ3 LYS 53 -14.076 3.508 5.851 418 H ASP 54 HN ASP 54 -19.779 2.548 9.750 419 HA ASP 54 HA ASP 54 -21.168 0.315 10.597 420 HB2 ASP 54 HB2 ASP 54 -21.294 2.767 11.406 421 HB3 ASP 54 HB1 ASP 54 -22.528 2.965 10.167 422 H ALA 55 HN ALA 55 -21.732 2.335 7.756 423 HA ALA 55 HA ALA 55 -24.102 0.943 6.959 424 HB1 ALA 55 HB1 ALA 55 -22.324 2.778 5.365 425 HB2 ALA 55 HB2 ALA 55 -23.718 3.269 6.325 426 HB3 ALA 55 HB3 ALA 55 -23.941 2.243 4.907 427 H LEU 56 HN LEU 56 -20.703 0.842 6.043 428 HA LEU 56 HA LEU 56 -20.990 -0.852 3.800 429 HB2 LEU 56 HB2 LEU 56 -18.615 -0.335 5.602 430 HB3 LEU 56 HB1 LEU 56 -18.529 -1.307 4.150 431 HG LEU 56 HG LEU 56 -17.641 0.844 3.649 432 HD11 LEU 56 HD11 LEU 56 -19.025 -0.158 1.907 433 HD12 LEU 56 HD12 LEU 56 -19.048 1.605 1.849 434 HD13 LEU 56 HD13 LEU 56 -20.423 0.726 2.524 435 HD21 LEU 56 HD21 LEU 56 -18.880 2.917 3.917 436 HD22 LEU 56 HD22 LEU 56 -18.637 2.113 5.468 437 HD23 LEU 56 HD23 LEU 56 -20.207 2.035 4.670 438 H ARG 57 HN ARG 57 -20.356 -1.524 7.219 439 HA ARG 57 HA ARG 57 -19.713 -4.250 6.968 440 HB2 ARG 57 HB2 ARG 57 -20.173 -4.417 9.352 441 HB3 ARG 57 HB1 ARG 57 -19.309 -2.922 9.014 442 HG2 ARG 57 HG2 ARG 57 -21.392 -1.674 9.124 443 HG3 ARG 57 HG1 ARG 57 -22.279 -3.168 9.426 444 HD2 ARG 57 HD2 ARG 57 -21.063 -3.482 11.512 445 HD3 ARG 57 HD1 ARG 57 -20.134 -2.014 11.204 446 HE ARG 57 HE ARG 57 -22.616 -1.057 11.139 447 HH11 ARG 57 HH11 ARG 57 -21.121 -3.266 13.418 448 HH12 ARG 57 HH12 ARG 57 -22.096 -2.736 14.751 449 HH21 ARG 57 HH21 ARG 57 -23.884 -0.363 12.893 450 HH22 ARG 57 HH22 ARG 57 -23.671 -1.098 14.453 451 H LEU 58 HN LEU 58 -22.710 -2.629 6.672 452 HA LEU 58 HA LEU 58 -24.166 -5.184 6.877 453 HB2 LEU 58 HB2 LEU 58 -25.232 -2.377 7.236 454 HB3 LEU 58 HB1 LEU 58 -26.169 -3.853 7.366 455 HG LEU 58 HG LEU 58 -23.905 -3.070 9.205 456 HD11 LEU 58 HD11 LEU 58 -26.891 -3.014 9.613 457 HD12 LEU 58 HD12 LEU 58 -25.820 -1.616 9.507 458 HD13 LEU 58 HD13 LEU 58 -25.684 -2.730 10.868 459 HD21 LEU 58 HD21 LEU 58 -25.873 -5.351 9.369 460 HD22 LEU 58 HD22 LEU 58 -24.645 -4.951 10.569 461 HD23 LEU 58 HD23 LEU 58 -24.164 -5.496 8.963 462 H LYS 59 HN LYS 59 -22.727 -3.637 4.595 463 HA LYS 59 HA LYS 59 -24.808 -4.099 2.634 464 HB2 LYS 59 HB2 LYS 59 -25.264 -1.797 3.239 465 HB3 LYS 59 HB1 LYS 59 -23.576 -1.364 3.003 466 HG2 LYS 59 HG2 LYS 59 -23.764 -1.829 0.634 467 HG3 LYS 59 HG1 LYS 59 -25.433 -2.333 0.854 468 HD2 LYS 59 HD2 LYS 59 -25.409 -0.082 0.004 469 HD3 LYS 59 HD1 LYS 59 -25.963 -0.052 1.677 470 HE2 LYS 59 HE2 LYS 59 -23.785 0.661 2.432 471 HE3 LYS 59 HE1 LYS 59 -23.131 0.501 0.803 472 HZ1 LYS 59 HZ1 LYS 59 -24.784 2.225 0.126 473 HZ2 LYS 59 HZ2 LYS 59 -23.567 2.777 1.156 474 HZ3 LYS 59 HZ3 LYS 59 -25.122 2.481 1.768 475 H ARG 60 HN ARG 60 -21.771 -2.228 2.578 476 HA ARG 60 HA ARG 60 -20.870 -4.050 0.458 477 HB2 ARG 60 HB2 ARG 60 -20.205 -1.124 0.832 478 HB3 ARG 60 HB1 ARG 60 -19.531 -2.162 -0.418 479 HG2 ARG 60 HG2 ARG 60 -22.420 -1.392 -0.089 480 HG3 ARG 60 HG1 ARG 60 -21.311 -0.844 -1.348 481 HD2 ARG 60 HD2 ARG 60 -21.200 -3.003 -2.315 482 HD3 ARG 60 HD1 ARG 60 -21.988 -3.744 -0.924 483 HE ARG 60 HE ARG 60 -23.370 -1.905 -2.782 484 HH11 ARG 60 HH11 ARG 60 -23.323 -4.753 -0.730 485 HH12 ARG 60 HH12 ARG 60 -24.944 -5.236 -1.141 486 HH21 ARG 60 HH21 ARG 60 -25.512 -2.532 -3.303 487 HH22 ARG 60 HH22 ARG 60 -26.168 -3.993 -2.627 488 H GLN 61 HN GLN 61 -19.958 -5.449 1.895 489 HA GLN 61 HA GLN 61 -17.617 -4.478 3.382 490 HB2 GLN 61 HB2 GLN 61 -17.921 -6.454 4.799 491 HB3 GLN 61 HB1 GLN 61 -19.380 -5.475 4.771 492 HG2 GLN 61 HG2 GLN 61 -20.129 -7.084 2.884 493 HG3 GLN 61 HG1 GLN 61 -18.875 -8.143 3.525 494 HE21 GLN 61 HE21 GLN 61 -19.329 -7.076 6.263 495 HE22 GLN 61 HE22 GLN 61 -20.801 -7.812 6.805 496 H GLY 62 HN GLY 62 -15.812 -6.206 3.486 497 HA2 GLY 62 HA2 GLY 62 -15.449 -8.358 1.974 498 HA3 GLY 62 HA1 GLY 62 -15.415 -7.104 0.751 499 H VAL 63 HN VAL 63 -13.376 -9.028 1.722 500 HA VAL 63 HA VAL 63 -11.261 -7.058 2.289 501 HB VAL 63 HB VAL 63 -11.191 -10.038 2.836 502 HG11 VAL 63 HG11 VAL 63 -9.000 -9.102 2.291 503 HG12 VAL 63 HG12 VAL 63 -9.090 -9.572 3.988 504 HG13 VAL 63 HG13 VAL 63 -9.211 -7.870 3.538 505 HG21 VAL 63 HG21 VAL 63 -12.696 -8.929 4.376 506 HG22 VAL 63 HG22 VAL 63 -11.468 -7.720 4.743 507 HG23 VAL 63 HG23 VAL 63 -11.215 -9.401 5.212 508 H GLY 64 HN GLY 64 -9.894 -6.705 0.674 509 HA2 GLY 64 HA2 GLY 64 -9.268 -8.829 -1.215 510 HA3 GLY 64 HA1 GLY 64 -10.073 -7.411 -1.877 511 H GLN 65 HN GLN 65 -7.592 -8.090 -2.794 512 HA GLN 65 HA GLN 65 -5.751 -6.276 -1.412 513 HB2 GLN 65 HB2 GLN 65 -5.264 -8.428 -3.474 514 HB3 GLN 65 HB1 GLN 65 -4.021 -7.306 -2.932 515 HG2 GLN 65 HG2 GLN 65 -4.313 -8.126 -0.639 516 HG3 GLN 65 HG1 GLN 65 -5.502 -9.290 -1.224 517 HE21 GLN 65 HE21 GLN 65 -2.157 -8.442 -1.070 518 HE22 GLN 65 HE22 GLN 65 -1.535 -9.933 -1.681 519 H VAL 66 HN VAL 66 -5.117 -4.440 -2.297 520 HA VAL 66 HA VAL 66 -6.040 -3.834 -5.026 521 HB VAL 66 HB VAL 66 -6.202 -2.159 -2.509 522 HG11 VAL 66 HG11 VAL 66 -7.078 -0.337 -3.805 523 HG12 VAL 66 HG12 VAL 66 -6.850 -1.250 -5.305 524 HG13 VAL 66 HG13 VAL 66 -5.448 -0.732 -4.366 525 HG21 VAL 66 HG21 VAL 66 -8.584 -2.108 -3.033 526 HG22 VAL 66 HG22 VAL 66 -7.996 -3.762 -2.853 527 HG23 VAL 66 HG23 VAL 66 -8.291 -3.100 -4.462 528 H ARG 67 HN ARG 67 -4.321 -3.540 -6.287 529 HA ARG 67 HA ARG 67 -1.815 -2.612 -5.060 530 HB2 ARG 67 HB2 ARG 67 -1.630 -4.786 -6.174 531 HB3 ARG 67 HB1 ARG 67 -2.279 -4.103 -7.659 532 HG2 ARG 67 HG2 ARG 67 -0.334 -2.816 -8.037 533 HG3 ARG 67 HG1 ARG 67 0.263 -3.107 -6.403 534 HD2 ARG 67 HD2 ARG 67 0.640 -5.425 -6.892 535 HD3 ARG 67 HD1 ARG 67 -0.128 -5.261 -8.471 536 HE ARG 67 HE ARG 67 1.923 -3.477 -8.546 537 HH11 ARG 67 HH11 ARG 67 1.726 -6.907 -7.839 538 HH12 ARG 67 HH12 ARG 67 3.312 -7.246 -8.474 539 HH21 ARG 67 HH21 ARG 67 4.005 -3.928 -9.383 540 HH22 ARG 67 HH22 ARG 67 4.589 -5.569 -9.355 541 H PHE 68 HN PHE 68 -1.118 -0.632 -5.504 542 HA PHE 68 HA PHE 68 -2.148 0.753 -7.846 543 HB2 PHE 68 HB2 PHE 68 -2.657 2.735 -6.226 544 HB3 PHE 68 HB1 PHE 68 -3.838 1.449 -6.429 545 HD1 PHE 68 HD1 PHE 68 -0.746 1.654 -4.327 546 HD2 PHE 68 HD2 PHE 68 -4.978 1.241 -4.472 547 HE1 PHE 68 HE1 PHE 68 -0.795 1.296 -1.894 548 HE2 PHE 68 HE2 PHE 68 -5.035 0.880 -2.040 549 HZ PHE 68 HZ PHE 68 -2.944 0.909 -0.749 550 H THR 69 HN THR 69 -1.201 2.850 -8.162 551 HA THR 69 HA THR 69 1.464 3.197 -6.927 552 HB THR 69 HB THR 69 0.564 4.332 -9.585 553 HG1 THR 69 HG1 THR 69 1.270 1.784 -8.937 554 HG21 THR 69 HG21 THR 69 2.972 4.596 -9.949 555 HG22 THR 69 HG22 THR 69 3.291 3.904 -8.358 556 HG23 THR 69 HG23 THR 69 2.455 5.450 -8.494 557 H LEU 70 HN LEU 70 1.752 5.028 -5.805 558 HA LEU 70 HA LEU 70 -0.582 6.815 -5.704 559 HB2 LEU 70 HB2 LEU 70 1.255 5.984 -3.466 560 HB3 LEU 70 HB1 LEU 70 -0.151 7.028 -3.318 561 HG LEU 70 HG LEU 70 -0.291 4.167 -4.267 562 HD11 LEU 70 HD11 LEU 70 -0.847 5.255 -1.513 563 HD12 LEU 70 HD12 LEU 70 0.528 4.244 -1.968 564 HD13 LEU 70 HD13 LEU 70 -1.110 3.596 -2.055 565 HD21 LEU 70 HD21 LEU 70 -2.123 5.611 -5.011 566 HD22 LEU 70 HD22 LEU 70 -2.424 6.091 -3.338 567 HD23 LEU 70 HD23 LEU 70 -2.681 4.419 -3.833 568 H ASP 71 HN ASP 71 -0.305 8.891 -5.897 569 HA ASP 71 HA ASP 71 2.224 9.991 -6.601 570 HB2 ASP 71 HB2 ASP 71 0.182 10.872 -7.588 571 HB3 ASP 71 HB1 ASP 71 -0.435 11.300 -5.992 572 H ARG 72 HN ARG 72 3.244 11.742 -5.561 573 HA ARG 72 HA ARG 72 3.995 11.185 -2.935 574 HB2 ARG 72 HB2 ARG 72 4.396 13.754 -4.474 575 HB3 ARG 72 HB1 ARG 72 5.335 13.215 -3.087 576 HG2 ARG 72 HG2 ARG 72 6.221 11.366 -4.344 577 HG3 ARG 72 HG1 ARG 72 5.184 11.753 -5.716 578 HD2 ARG 72 HD2 ARG 72 7.378 12.569 -6.191 579 HD3 ARG 72 HD1 ARG 72 6.331 13.952 -5.882 580 HE ARG 72 HE ARG 72 7.437 13.505 -3.462 581 HH11 ARG 72 HH11 ARG 72 8.804 13.800 -6.670 582 HH12 ARG 72 HH12 ARG 72 10.290 14.510 -6.112 583 HH21 ARG 72 HH21 ARG 72 9.385 14.419 -2.717 584 HH22 ARG 72 HH22 ARG 72 10.634 14.850 -3.853 585 H GLN 73 HN GLN 73 1.378 13.140 -4.114 586 HA GLN 73 HA GLN 73 1.019 14.269 -1.419 587 HB2 GLN 73 HB2 GLN 73 -0.239 15.062 -4.050 588 HB3 GLN 73 HB1 GLN 73 -0.538 15.842 -2.501 589 HG2 GLN 73 HG2 GLN 73 2.226 15.615 -3.618 590 HG3 GLN 73 HG1 GLN 73 1.143 16.910 -4.108 591 HE21 GLN 73 HE21 GLN 73 1.106 15.583 -0.874 592 HE22 GLN 73 HE22 GLN 73 1.776 16.968 -0.089 593 H GLY 74 HN GLY 74 0.303 11.527 -2.669 594 HA2 GLY 74 HA2 GLY 74 -1.261 9.961 -2.028 595 HA3 GLY 74 HA1 GLY 74 -2.109 11.217 -1.150 596 H HIS 75 HN HIS 75 -1.293 10.834 -4.565 597 HA HIS 75 HA HIS 75 -4.156 11.123 -5.180 598 HB2 HIS 75 HB2 HIS 75 -2.641 12.996 -5.911 599 HB3 HIS 75 HB1 HIS 75 -1.819 11.845 -6.957 600 HD1 HIS 75 HD1 HIS 75 -4.772 14.024 -6.742 601 HD2 HIS 75 HD2 HIS 75 -3.398 10.929 -9.153 602 HE1 HIS 75 HE1 HIS 75 -6.213 14.083 -8.809 603 HE2 HIS 75 HE2 HIS 75 -5.345 12.220 -10.277 604 H VAL 76 HN VAL 76 -5.092 9.399 -6.073 605 HA VAL 76 HA VAL 76 -3.865 6.995 -6.660 606 HB VAL 76 HB VAL 76 -6.263 7.156 -6.330 607 HG11 VAL 76 HG11 VAL 76 -6.330 8.619 -8.967 608 HG12 VAL 76 HG12 VAL 76 -6.717 9.285 -7.380 609 HG13 VAL 76 HG13 VAL 76 -7.746 8.040 -8.088 610 HG21 VAL 76 HG21 VAL 76 -5.469 5.228 -7.544 611 HG22 VAL 76 HG22 VAL 76 -5.556 6.114 -9.067 612 HG23 VAL 76 HG23 VAL 76 -7.035 5.732 -8.183 613 H LEU 77 HN LEU 77 -2.514 6.382 -8.210 614 HA LEU 77 HA LEU 77 -2.520 7.881 -10.739 615 HB2 LEU 77 HB2 LEU 77 -0.289 6.246 -9.542 616 HB3 LEU 77 HB1 LEU 77 -0.203 7.180 -11.024 617 HG LEU 77 HG LEU 77 -0.681 8.385 -8.303 618 HD11 LEU 77 HD11 LEU 77 1.645 9.067 -8.361 619 HD12 LEU 77 HD12 LEU 77 1.872 8.215 -9.891 620 HD13 LEU 77 HD13 LEU 77 1.508 7.307 -8.422 621 HD21 LEU 77 HD21 LEU 77 -0.113 10.486 -9.417 622 HD22 LEU 77 HD22 LEU 77 -1.519 9.731 -10.169 623 HD23 LEU 77 HD23 LEU 77 0.059 9.633 -10.952 624 H ALA 78 HN ALA 78 -2.095 4.666 -9.356 625 HA ALA 78 HA ALA 78 -3.212 3.506 -11.814 626 HB1 ALA 78 HB1 ALA 78 -0.758 3.202 -11.846 627 HB2 ALA 78 HB2 ALA 78 -1.627 1.670 -11.729 628 HB3 ALA 78 HB3 ALA 78 -0.864 2.362 -10.294 629 H VAL 79 HN VAL 79 -4.393 1.577 -11.483 630 HA VAL 79 HA VAL 79 -4.670 0.584 -8.766 631 HB VAL 79 HB VAL 79 -7.229 0.561 -9.106 632 HG11 VAL 79 HG11 VAL 79 -7.471 2.746 -8.037 633 HG12 VAL 79 HG12 VAL 79 -5.825 3.163 -8.509 634 HG13 VAL 79 HG13 VAL 79 -6.109 1.852 -7.364 635 HG21 VAL 79 HG21 VAL 79 -8.139 2.421 -10.397 636 HG22 VAL 79 HG22 VAL 79 -7.229 1.323 -11.435 637 HG23 VAL 79 HG23 VAL 79 -6.517 2.857 -10.932 638 H THR 80 HN THR 80 -4.393 -1.498 -8.927 639 HA THR 80 HA THR 80 -5.627 -2.929 -11.186 640 HB THR 80 HB THR 80 -2.966 -3.593 -9.900 641 HG1 THR 80 HG1 THR 80 -3.672 -2.268 -12.316 642 HG21 THR 80 HG21 THR 80 -2.751 -5.209 -11.746 643 HG22 THR 80 HG22 THR 80 -4.381 -4.802 -12.283 644 HG23 THR 80 HG23 THR 80 -4.135 -5.573 -10.716 645 H LEU 81 HN LEU 81 -6.966 -4.515 -10.575 646 HA LEU 81 HA LEU 81 -7.334 -5.019 -7.778 647 HB2 LEU 81 HB2 LEU 81 -9.236 -4.908 -9.369 648 HB3 LEU 81 HB1 LEU 81 -8.657 -6.386 -10.120 649 HG LEU 81 HG LEU 81 -8.877 -7.465 -7.820 650 HD11 LEU 81 HD11 LEU 81 -9.027 -5.440 -6.496 651 HD12 LEU 81 HD12 LEU 81 -10.488 -6.408 -6.300 652 HD13 LEU 81 HD13 LEU 81 -10.511 -4.978 -7.331 653 HD21 LEU 81 HD21 LEU 81 -11.380 -6.502 -9.207 654 HD22 LEU 81 HD22 LEU 81 -11.263 -7.887 -8.120 655 HD23 LEU 81 HD23 LEU 81 -10.420 -7.908 -9.669 656 H VAL 82 HN VAL 82 -6.037 -6.284 -6.739 657 HA VAL 82 HA VAL 82 -4.873 -8.651 -8.007 658 HB VAL 82 HB VAL 82 -4.115 -8.374 -5.253 659 HG11 VAL 82 HG11 VAL 82 -2.628 -7.953 -7.842 660 HG12 VAL 82 HG12 VAL 82 -2.715 -9.440 -6.894 661 HG13 VAL 82 HG13 VAL 82 -1.864 -8.030 -6.256 662 HG21 VAL 82 HG21 VAL 82 -3.768 -5.853 -6.880 663 HG22 VAL 82 HG22 VAL 82 -3.072 -6.169 -5.287 664 HG23 VAL 82 HG23 VAL 82 -4.823 -6.040 -5.477 665 H SER 83 HN SER 83 -6.726 -7.644 -5.177 666 HA SER 83 HA SER 83 -8.532 -8.517 -4.156 667 HB2 SER 83 HB2 SER 83 -9.293 -8.821 -6.480 668 HB3 SER 83 HB1 SER 83 -8.622 -10.453 -6.473 669 HG SER 83 HG SER 83 -10.543 -10.957 -5.763 670 H SER 84 HN SER 84 -9.504 -10.700 -3.335 671 HA SER 84 HA SER 84 -7.413 -12.574 -2.564 672 HB2 SER 84 HB2 SER 84 -8.947 -10.964 -0.508 673 HB3 SER 84 HB1 SER 84 -7.772 -12.234 -0.168 674 HG SER 84 HG SER 84 -6.327 -10.786 -1.517 675 H ALA 85 HN ALA 85 -10.697 -11.643 -1.435 676 HA ALA 85 HA ALA 85 -11.320 -14.493 -1.352 677 HB1 ALA 85 HB1 ALA 85 -12.818 -12.175 -0.142 678 HB2 ALA 85 HB2 ALA 85 -11.698 -13.247 0.697 679 HB3 ALA 85 HB3 ALA 85 -13.216 -13.880 0.060 680 H GLY 86 HN GLY 86 -13.647 -11.858 -1.857 681 HA2 GLY 86 HA2 GLY 86 -14.299 -12.435 -4.521 682 HA3 GLY 86 HA1 GLY 86 -15.273 -13.461 -3.473 683 H LEU 87 HN LEU 87 -14.765 -10.267 -4.668 684 HA LEU 87 HA LEU 87 -17.122 -9.376 -3.136 685 HB2 LEU 87 HB2 LEU 87 -15.029 -7.513 -4.225 686 HB3 LEU 87 HB1 LEU 87 -16.297 -7.145 -3.093 687 HG LEU 87 HG LEU 87 -14.357 -7.097 -1.819 688 HD11 LEU 87 HD11 LEU 87 -15.478 -9.860 -1.457 689 HD12 LEU 87 HD12 LEU 87 -16.090 -8.375 -0.729 690 HD13 LEU 87 HD13 LEU 87 -14.492 -8.980 -0.290 691 HD21 LEU 87 HD21 LEU 87 -13.465 -9.702 -3.041 692 HD22 LEU 87 HD22 LEU 87 -12.581 -8.734 -1.863 693 HD23 LEU 87 HD23 LEU 87 -12.863 -8.107 -3.487 694 HA PRO 88 HA PRO 88 -18.235 -9.216 -7.609 695 HB2 PRO 88 HB2 PRO 88 -20.876 -10.086 -6.768 696 HB3 PRO 88 HB1 PRO 88 -19.727 -10.903 -7.829 697 HG2 PRO 88 HG2 PRO 88 -20.370 -11.815 -5.347 698 HG3 PRO 88 HG1 PRO 88 -18.798 -12.106 -6.110 699 HD2 PRO 88 HD2 PRO 88 -19.556 -10.076 -4.038 700 HD3 PRO 88 HD1 PRO 88 -18.092 -11.077 -4.152 701 H SER 89 HN SER 89 -21.134 -8.767 -5.636 702 HA SER 89 HA SER 89 -21.752 -6.260 -6.820 703 HB2 SER 89 HB2 SER 89 -22.860 -7.425 -4.254 704 HB3 SER 89 HB1 SER 89 -23.621 -6.211 -5.282 705 HG SER 89 HG SER 89 -24.559 -8.077 -5.882 706 H LEU 90 HN LEU 90 -19.705 -7.208 -4.320 707 HA LEU 90 HA LEU 90 -19.955 -4.917 -2.625 708 HB2 LEU 90 HB2 LEU 90 -17.705 -6.934 -2.711 709 HB3 LEU 90 HB1 LEU 90 -18.142 -5.882 -1.378 710 HG LEU 90 HG LEU 90 -20.029 -7.980 -2.417 711 HD11 LEU 90 HD11 LEU 90 -17.813 -8.944 -1.741 712 HD12 LEU 90 HD12 LEU 90 -19.202 -9.515 -0.805 713 HD13 LEU 90 HD13 LEU 90 -18.111 -8.307 -0.120 714 HD21 LEU 90 HD21 LEU 90 -19.788 -6.542 0.222 715 HD22 LEU 90 HD22 LEU 90 -21.008 -7.745 -0.194 716 HD23 LEU 90 HD23 LEU 90 -20.973 -6.195 -1.036 717 H ASP 91 HN ASP 91 -17.869 -5.891 -5.261 718 HA ASP 91 HA ASP 91 -15.640 -4.301 -4.818 719 HB2 ASP 91 HB2 ASP 91 -15.744 -6.086 -6.510 720 HB3 ASP 91 HB1 ASP 91 -16.841 -5.107 -7.478 721 H ARG 92 HN ARG 92 -18.588 -3.511 -6.607 722 HA ARG 92 HA ARG 92 -17.687 -1.262 -7.917 723 HB2 ARG 92 HB2 ARG 92 -20.133 -0.545 -7.906 724 HB3 ARG 92 HB1 ARG 92 -19.752 -2.109 -8.613 725 HG2 ARG 92 HG2 ARG 92 -20.511 -3.235 -6.622 726 HG3 ARG 92 HG1 ARG 92 -20.782 -1.691 -5.815 727 HD2 ARG 92 HD2 ARG 92 -22.843 -2.773 -6.707 728 HD3 ARG 92 HD1 ARG 92 -22.556 -1.141 -7.312 729 HE ARG 92 HE ARG 92 -21.547 -2.376 -9.323 730 HH11 ARG 92 HH11 ARG 92 -24.204 -3.596 -7.393 731 HH12 ARG 92 HH12 ARG 92 -24.947 -4.443 -8.719 732 HH21 ARG 92 HH21 ARG 92 -22.508 -3.491 -11.069 733 HH22 ARG 92 HH22 ARG 92 -23.961 -4.415 -10.805 734 H GLU 93 HN GLU 93 -19.333 -1.289 -4.719 735 HA GLU 93 HA GLU 93 -19.080 1.567 -4.565 736 HB2 GLU 93 HB2 GLU 93 -20.998 0.314 -3.583 737 HB3 GLU 93 HB1 GLU 93 -19.900 -0.310 -2.357 738 HG2 GLU 93 HG2 GLU 93 -19.592 1.790 -1.390 739 HG3 GLU 93 HG1 GLU 93 -20.206 2.634 -2.809 740 H ILE 94 HN ILE 94 -17.527 -1.158 -2.850 741 HA ILE 94 HA ILE 94 -16.029 0.452 -1.110 742 HB ILE 94 HB ILE 94 -14.642 -1.491 -0.656 743 HG12 ILE 94 HG12 ILE 94 -16.111 -2.846 -2.932 744 HG13 ILE 94 HG11 ILE 94 -14.429 -2.325 -2.976 745 HG21 ILE 94 HG21 ILE 94 -16.813 -1.338 0.413 746 HG22 ILE 94 HG22 ILE 94 -16.395 -3.023 0.092 747 HG23 ILE 94 HG23 ILE 94 -17.558 -2.191 -0.941 748 HD11 ILE 94 HD11 ILE 94 -13.870 -3.894 -1.222 749 HD12 ILE 94 HD12 ILE 94 -14.658 -4.727 -2.564 750 HD13 ILE 94 HD13 ILE 94 -15.560 -4.377 -1.089 751 H GLN 95 HN GLN 95 -15.320 -0.742 -4.371 752 HA GLN 95 HA GLN 95 -12.671 0.357 -4.298 753 HB2 GLN 95 HB2 GLN 95 -14.237 -0.594 -6.673 754 HB3 GLN 95 HB1 GLN 95 -12.533 -0.306 -6.592 755 HG2 GLN 95 HG2 GLN 95 -13.944 -2.389 -4.974 756 HG3 GLN 95 HG1 GLN 95 -13.152 -2.701 -6.515 757 HE21 GLN 95 HE21 GLN 95 -12.617 -3.879 -3.968 758 HE22 GLN 95 HE22 GLN 95 -10.978 -3.502 -3.570 759 H ALA 96 HN ALA 96 -15.846 1.370 -5.446 760 HA ALA 96 HA ALA 96 -15.074 3.676 -6.816 761 HB1 ALA 96 HB1 ALA 96 -17.211 4.663 -6.143 762 HB2 ALA 96 HB2 ALA 96 -17.417 3.405 -4.922 763 HB3 ALA 96 HB3 ALA 96 -17.426 2.983 -6.635 764 H LEU 97 HN LEU 97 -15.542 3.092 -3.383 765 HA LEU 97 HA LEU 97 -14.853 5.615 -2.442 766 HB2 LEU 97 HB2 LEU 97 -16.176 3.902 -1.286 767 HB3 LEU 97 HB1 LEU 97 -14.751 2.885 -1.175 768 HG LEU 97 HG LEU 97 -13.856 5.129 -0.081 769 HD11 LEU 97 HD11 LEU 97 -15.602 5.878 1.545 770 HD12 LEU 97 HD12 LEU 97 -16.778 4.961 0.601 771 HD13 LEU 97 HD13 LEU 97 -15.922 6.323 -0.133 772 HD21 LEU 97 HD21 LEU 97 -14.479 3.949 2.135 773 HD22 LEU 97 HD22 LEU 97 -13.409 3.143 0.986 774 HD23 LEU 97 HD23 LEU 97 -15.118 2.686 1.073 775 H VAL 98 HN VAL 98 -12.988 2.552 -2.498 776 HA VAL 98 HA VAL 98 -10.608 3.946 -1.592 777 HB VAL 98 HB VAL 98 -11.113 1.026 -2.161 778 HG11 VAL 98 HG11 VAL 98 -8.643 2.383 -1.085 779 HG12 VAL 98 HG12 VAL 98 -8.783 1.435 -2.569 780 HG13 VAL 98 HG13 VAL 98 -8.943 0.647 -0.999 781 HG21 VAL 98 HG21 VAL 98 -12.293 1.880 -0.216 782 HG22 VAL 98 HG22 VAL 98 -10.787 2.535 0.429 783 HG23 VAL 98 HG23 VAL 98 -10.995 0.790 0.271 784 H LYS 99 HN LYS 99 -11.536 2.034 -4.447 785 HA LYS 99 HA LYS 99 -8.992 2.183 -5.682 786 HB2 LYS 99 HB2 LYS 99 -10.746 0.433 -6.141 787 HB3 LYS 99 HB1 LYS 99 -11.662 1.641 -7.023 788 HG2 LYS 99 HG2 LYS 99 -9.724 1.884 -8.575 789 HG3 LYS 99 HG1 LYS 99 -8.942 0.546 -7.725 790 HD2 LYS 99 HD2 LYS 99 -11.637 0.381 -9.081 791 HD3 LYS 99 HD1 LYS 99 -10.117 -0.161 -9.795 792 HE2 LYS 99 HE2 LYS 99 -9.842 -1.837 -8.130 793 HE3 LYS 99 HE1 LYS 99 -11.168 -1.187 -7.168 794 HZ1 LYS 99 HZ1 LYS 99 -11.964 -3.095 -8.300 795 HZ2 LYS 99 HZ2 LYS 99 -11.357 -2.571 -9.790 796 HZ3 LYS 99 HZ3 LYS 99 -12.660 -1.753 -9.068 797 H ARG 100 HN ARG 100 -11.708 4.409 -5.580 798 HA ARG 100 HA ARG 100 -10.425 6.072 -7.608 799 HB2 ARG 100 HB2 ARG 100 -12.800 6.162 -7.677 800 HB3 ARG 100 HB1 ARG 100 -12.911 6.439 -5.944 801 HG2 ARG 100 HG2 ARG 100 -13.385 8.449 -7.294 802 HG3 ARG 100 HG1 ARG 100 -12.033 8.662 -6.183 803 HD2 ARG 100 HD2 ARG 100 -11.545 9.639 -8.363 804 HD3 ARG 100 HD1 ARG 100 -10.460 8.295 -8.014 805 HE ARG 100 HE ARG 100 -12.839 7.741 -9.625 806 HH11 ARG 100 HH11 ARG 100 -9.384 8.231 -9.445 807 HH12 ARG 100 HH12 ARG 100 -9.062 7.559 -11.016 808 HH21 ARG 100 HH21 ARG 100 -12.438 6.865 -11.702 809 HH22 ARG 100 HH22 ARG 100 -10.815 6.812 -12.322 810 H ALA 101 HN ALA 101 -11.119 6.264 -4.094 811 HA ALA 101 HA ALA 101 -9.314 8.547 -3.909 812 HB1 ALA 101 HB1 ALA 101 -10.058 8.797 -1.637 813 HB2 ALA 101 HB2 ALA 101 -10.866 7.220 -1.684 814 HB3 ALA 101 HB3 ALA 101 -11.468 8.553 -2.673 815 H SER 102 HN SER 102 -7.645 6.837 -4.696 816 HA SER 102 HA SER 102 -6.514 5.304 -2.506 817 HB2 SER 102 HB2 SER 102 -5.475 5.667 -5.322 818 HB3 SER 102 HB1 SER 102 -4.923 4.473 -4.150 819 HG SER 102 HG SER 102 -7.569 4.252 -4.387 820 HA PRO 103 HA PRO 103 -4.040 8.984 -1.793 821 HB2 PRO 103 HB2 PRO 103 -4.432 9.052 0.859 822 HB3 PRO 103 HB1 PRO 103 -5.689 9.527 -0.288 823 HG2 PRO 103 HG2 PRO 103 -5.567 7.178 1.451 824 HG3 PRO 103 HG1 PRO 103 -6.950 7.844 0.569 825 HD2 PRO 103 HD2 PRO 103 -5.160 5.649 -0.177 826 HD3 PRO 103 HD1 PRO 103 -6.730 6.103 -0.873 827 H LEU 104 HN LEU 104 -2.323 9.534 -0.202 828 HA LEU 104 HA LEU 104 -0.715 7.304 0.778 829 HB2 LEU 104 HB2 LEU 104 -0.052 7.808 -1.592 830 HB3 LEU 104 HB1 LEU 104 0.325 9.441 -1.097 831 HG LEU 104 HG LEU 104 2.066 8.477 0.450 832 HD11 LEU 104 HD11 LEU 104 2.860 6.196 -0.089 833 HD12 LEU 104 HD12 LEU 104 1.433 5.965 -1.100 834 HD13 LEU 104 HD13 LEU 104 1.251 6.206 0.637 835 HD21 LEU 104 HD21 LEU 104 2.327 7.954 -2.508 836 HD22 LEU 104 HD22 LEU 104 3.665 8.095 -1.368 837 HD23 LEU 104 HD23 LEU 104 2.627 9.486 -1.685 838 HA PRO 105 HA PRO 105 -0.849 10.704 3.810 839 HB2 PRO 105 HB2 PRO 105 0.209 8.879 5.759 840 HB3 PRO 105 HB1 PRO 105 -1.403 9.583 5.672 841 HG2 PRO 105 HG2 PRO 105 -0.753 6.913 5.234 842 HG3 PRO 105 HG1 PRO 105 -2.264 7.712 4.805 843 HD2 PRO 105 HD2 PRO 105 -0.061 6.868 3.064 844 HD3 PRO 105 HD1 PRO 105 -1.760 7.214 2.672 845 H THR 106 HN THR 106 1.638 8.442 4.813 846 HA THR 106 HA THR 106 3.553 10.580 5.035 847 HB THR 106 HB THR 106 5.070 8.603 5.736 848 HG1 THR 106 HG1 THR 106 4.114 6.683 5.992 849 HG21 THR 106 HG21 THR 106 4.059 8.550 7.972 850 HG22 THR 106 HG22 THR 106 2.582 9.255 7.320 851 HG23 THR 106 HG23 THR 106 4.078 10.187 7.315 852 HA PRO 107 HA PRO 107 4.916 10.104 0.828 853 HB2 PRO 107 HB2 PRO 107 7.156 11.805 1.737 854 HB3 PRO 107 HB1 PRO 107 5.982 12.085 0.448 855 HG2 PRO 107 HG2 PRO 107 5.864 13.454 2.739 856 HG3 PRO 107 HG1 PRO 107 4.390 12.931 1.901 857 HD2 PRO 107 HD2 PRO 107 5.735 11.732 4.296 858 HD3 PRO 107 HD1 PRO 107 4.004 11.995 3.991 859 HA PRO 108 HA PRO 108 8.116 7.024 1.756 860 HB2 PRO 108 HB2 PRO 108 7.433 5.302 -0.162 861 HB3 PRO 108 HB1 PRO 108 6.434 5.472 1.288 862 HG2 PRO 108 HG2 PRO 108 6.027 6.627 -1.443 863 HG3 PRO 108 HG1 PRO 108 4.837 5.875 -0.366 864 HD2 PRO 108 HD2 PRO 108 5.203 8.590 -0.627 865 HD3 PRO 108 HD1 PRO 108 4.516 7.811 0.811 866 H ALA 109 HN ALA 109 9.131 9.209 0.758 867 HA ALA 109 HA ALA 109 9.940 9.380 -1.875 868 HB1 ALA 109 HB1 ALA 109 11.851 10.669 -1.060 869 HB2 ALA 109 HB2 ALA 109 11.555 10.079 0.576 870 HB3 ALA 109 HB3 ALA 109 10.372 11.121 -0.214 871 H ASP 110 HN ASP 110 11.358 7.532 0.764 872 HA ASP 110 HA ASP 110 13.611 6.620 -0.718 873 HB2 ASP 110 HB2 ASP 110 13.573 6.843 1.750 874 HB3 ASP 110 HB1 ASP 110 12.411 5.523 1.830 875 H ALA 111 HN ALA 111 10.390 5.800 -0.849 876 HA ALA 111 HA ALA 111 10.878 2.981 -1.459 877 HB1 ALA 111 HB1 ALA 111 8.472 2.703 -1.281 878 HB2 ALA 111 HB2 ALA 111 8.270 4.443 -1.078 879 HB3 ALA 111 HB3 ALA 111 9.110 3.502 0.155 880 H TYR 112 HN TYR 112 10.111 6.005 -3.015 881 HA TYR 112 HA TYR 112 9.626 4.462 -5.452 882 HB2 TYR 112 HB2 TYR 112 8.385 6.466 -6.347 883 HB3 TYR 112 HB1 TYR 112 7.607 5.434 -5.175 884 HD1 TYR 112 HD2 TYR 112 9.890 8.380 -4.761 885 HD2 TYR 112 HD1 TYR 112 6.097 6.613 -4.053 886 HE1 TYR 112 HE2 TYR 112 9.222 10.346 -3.442 887 HE2 TYR 112 HE1 TYR 112 5.401 8.544 -2.752 888 HH TYR 112 HH TYR 112 6.473 10.378 -1.459 889 H VAL 113 HN VAL 113 12.042 5.797 -4.210 890 HA VAL 113 HA VAL 113 13.010 7.392 -6.384 891 HB VAL 113 HB VAL 113 15.325 6.687 -5.486 892 HG11 VAL 113 HG11 VAL 113 14.329 8.841 -4.999 893 HG12 VAL 113 HG12 VAL 113 15.146 8.214 -3.568 894 HG13 VAL 113 HG13 VAL 113 13.388 8.135 -3.686 895 HG21 VAL 113 HG21 VAL 113 14.521 4.654 -4.311 896 HG22 VAL 113 HG22 VAL 113 13.661 5.692 -3.172 897 HG23 VAL 113 HG23 VAL 113 15.420 5.753 -3.266 898 H ASN 114 HN ASN 114 12.534 6.407 -8.230 899 HA ASN 114 HA ASN 114 13.820 4.561 -9.658 900 HB2 ASN 114 HB2 ASN 114 13.053 2.374 -9.239 901 HB3 ASN 114 HB1 ASN 114 13.341 3.002 -7.623 902 HD21 ASN 114 HD21 ASN 114 11.540 3.543 -6.313 903 HD22 ASN 114 HD22 ASN 114 9.975 2.887 -6.640 904 H GLY 115 HN GLY 115 10.973 6.033 -8.592 905 HA2 GLY 115 HA2 GLY 115 9.938 6.902 -10.902 906 HA3 GLY 115 HA1 GLY 115 9.320 5.256 -10.834 907 H THR 116 HN THR 116 7.978 4.657 -9.066 908 HA THR 116 HA THR 116 6.891 6.676 -7.331 909 HB THR 116 HB THR 116 4.739 5.371 -8.876 910 HG1 THR 116 HG1 THR 116 6.243 7.500 -10.065 911 HG21 THR 116 HG21 THR 116 4.303 7.019 -7.140 912 HG22 THR 116 HG22 THR 116 3.772 7.627 -8.708 913 HG23 THR 116 HG23 THR 116 5.282 8.204 -8.001 914 H VAL 117 HN VAL 117 4.854 5.431 -6.139 915 HA VAL 117 HA VAL 117 6.089 2.886 -5.385 916 HB VAL 117 HB VAL 117 4.522 3.025 -3.379 917 HG11 VAL 117 HG11 VAL 117 5.947 4.639 -2.173 918 HG12 VAL 117 HG12 VAL 117 6.670 5.102 -3.716 919 HG13 VAL 117 HG13 VAL 117 6.860 3.455 -3.111 920 HG21 VAL 117 HG21 VAL 117 3.735 5.270 -2.751 921 HG22 VAL 117 HG22 VAL 117 2.946 4.663 -4.205 922 HG23 VAL 117 HG23 VAL 117 4.226 5.869 -4.336 923 H GLU 118 HN GLU 118 5.336 1.317 -6.504 924 HA GLU 118 HA GLU 118 2.436 1.020 -6.842 925 HB2 GLU 118 HB2 GLU 118 3.880 0.953 -8.892 926 HB3 GLU 118 HB1 GLU 118 4.692 -0.454 -8.222 927 HG2 GLU 118 HG2 GLU 118 2.435 -1.571 -8.163 928 HG3 GLU 118 HG1 GLU 118 1.845 -0.208 -9.118 929 H LEU 119 HN LEU 119 1.578 -0.196 -5.273 930 HA LEU 119 HA LEU 119 3.028 -2.542 -4.355 931 HB2 LEU 119 HB2 LEU 119 2.895 -1.898 -2.008 932 HB3 LEU 119 HB1 LEU 119 3.886 -0.785 -2.932 933 HG LEU 119 HG LEU 119 1.201 0.236 -2.845 934 HD11 LEU 119 HD11 LEU 119 0.925 -1.151 -0.880 935 HD12 LEU 119 HD12 LEU 119 0.994 0.560 -0.444 936 HD13 LEU 119 HD13 LEU 119 2.398 -0.476 -0.181 937 HD21 LEU 119 HD21 LEU 119 2.324 2.130 -1.785 938 HD22 LEU 119 HD22 LEU 119 3.221 1.562 -3.193 939 HD23 LEU 119 HD23 LEU 119 3.777 1.155 -1.569 940 H THR 120 HN THR 120 1.771 -3.983 -3.097 941 HA THR 120 HA THR 120 -1.082 -3.783 -3.698 942 HB THR 120 HB THR 120 0.546 -6.151 -2.754 943 HG1 THR 120 HG1 THR 120 1.016 -6.354 -4.792 944 HG21 THR 120 HG21 THR 120 -2.300 -5.995 -3.750 945 HG22 THR 120 HG22 THR 120 -1.803 -6.270 -2.080 946 HG23 THR 120 HG23 THR 120 -1.431 -7.470 -3.320 947 H LEU 121 HN LEU 121 -2.361 -3.039 -2.134 948 HA LEU 121 HA LEU 121 -1.770 -3.877 0.628 949 HB2 LEU 121 HB2 LEU 121 -2.804 -1.239 -0.383 950 HB3 LEU 121 HB1 LEU 121 -3.060 -1.758 1.275 951 HG LEU 121 HG LEU 121 -0.403 -1.299 -0.070 952 HD11 LEU 121 HD11 LEU 121 -1.416 0.775 0.485 953 HD12 LEU 121 HD12 LEU 121 -0.201 0.439 1.716 954 HD13 LEU 121 HD13 LEU 121 -1.910 0.181 2.070 955 HD21 LEU 121 HD21 LEU 121 0.584 -1.838 2.093 956 HD22 LEU 121 HD22 LEU 121 -0.322 -3.210 1.446 957 HD23 LEU 121 HD23 LEU 121 -1.015 -2.222 2.733 958 HA PRO 122 HA PRO 122 -5.821 -5.669 0.259 959 HB2 PRO 122 HB2 PRO 122 -5.601 -6.261 3.103 960 HB3 PRO 122 HB1 PRO 122 -5.642 -7.380 1.740 961 HG2 PRO 122 HG2 PRO 122 -3.422 -6.966 3.248 962 HG3 PRO 122 HG1 PRO 122 -3.362 -7.423 1.536 963 HD2 PRO 122 HD2 PRO 122 -2.994 -4.731 2.797 964 HD3 PRO 122 HD1 PRO 122 -2.118 -5.470 1.438 965 H ILE 123 HN ILE 123 -7.488 -4.317 0.214 966 HA ILE 123 HA ILE 123 -7.875 -2.404 2.373 967 HB ILE 123 HB ILE 123 -9.671 -1.444 1.030 968 HG12 ILE 123 HG12 ILE 123 -9.087 -3.512 -1.089 969 HG13 ILE 123 HG11 ILE 123 -10.427 -3.659 0.046 970 HG21 ILE 123 HG21 ILE 123 -7.557 -0.560 0.470 971 HG22 ILE 123 HG22 ILE 123 -8.340 -0.900 -1.082 972 HG23 ILE 123 HG23 ILE 123 -7.110 -1.996 -0.447 973 HD11 ILE 123 HD11 ILE 123 -10.027 -1.444 -1.948 974 HD12 ILE 123 HD12 ILE 123 -11.354 -1.556 -0.790 975 HD13 ILE 123 HD13 ILE 123 -11.187 -2.766 -2.063 976 H ASP 124 HN ASP 124 -8.748 -3.298 4.156 977 HA ASP 124 HA ASP 124 -10.542 -5.564 3.708 978 HB2 ASP 124 HB2 ASP 124 -9.956 -6.398 5.848 979 HB3 ASP 124 HB1 ASP 124 -8.456 -5.892 5.086 980 H PHE 125 HN PHE 125 -12.573 -5.276 3.882 981 HA PHE 125 HA PHE 125 -13.634 -3.573 6.035 982 HB2 PHE 125 HB2 PHE 125 -14.980 -4.575 3.509 983 HB3 PHE 125 HB1 PHE 125 -15.772 -3.627 4.760 984 HD1 PHE 125 HD2 PHE 125 -15.239 -1.261 5.030 985 HD2 PHE 125 HD1 PHE 125 -13.498 -3.586 1.923 986 HE1 PHE 125 HE2 PHE 125 -14.555 0.803 3.877 987 HE2 PHE 125 HE1 PHE 125 -12.803 -1.529 0.764 988 HZ PHE 125 HZ PHE 125 -13.332 0.672 1.742 989 H SER 126 HN SER 126 -15.266 -4.587 7.370 990 HA SER 126 HA SER 126 -14.650 -7.248 8.030 991 HB2 SER 126 HB2 SER 126 -17.172 -5.755 8.768 992 HB3 SER 126 HB1 SER 126 -16.381 -7.043 9.679 993 HG SER 126 HG SER 126 -14.498 -5.465 9.634 994 H LEU 127 HN LEU 127 -15.010 -8.840 6.566 995 HA LEU 127 HA LEU 127 -17.379 -8.750 4.871 996 HB2 LEU 127 HB2 LEU 127 -14.836 -9.451 4.312 997 HB3 LEU 127 HB1 LEU 127 -15.481 -11.030 4.711 998 HG LEU 127 HG LEU 127 -16.618 -9.209 2.581 999 HD11 LEU 127 HD11 LEU 127 -14.895 -11.660 2.278 1000 HD12 LEU 127 HD12 LEU 127 -14.389 -9.997 1.978 1001 HD13 LEU 127 HD13 LEU 127 -15.635 -10.732 0.969 1002 HD21 LEU 127 HD21 LEU 127 -17.203 -12.088 3.242 1003 HD22 LEU 127 HD22 LEU 127 -17.817 -11.210 1.840 1004 HD23 LEU 127 HD23 LEU 127 -18.291 -10.717 3.468 1005 H ARG 128 HN ARG 128 -19.136 -9.399 5.939 1006 HA ARG 128 HA ARG 128 -19.067 -11.837 7.539 1007 HB2 ARG 128 HB2 ARG 128 -21.038 -9.585 7.226 1008 HB3 ARG 128 HB1 ARG 128 -21.457 -11.072 8.053 1009 HG2 ARG 128 HG2 ARG 128 -19.925 -10.684 9.776 1010 HG3 ARG 128 HG1 ARG 128 -19.063 -9.460 8.841 1011 HD2 ARG 128 HD2 ARG 128 -20.473 -8.510 10.640 1012 HD3 ARG 128 HD1 ARG 128 -20.902 -7.934 9.032 1013 HE ARG 128 HE ARG 128 -22.613 -9.984 9.369 1014 HH11 ARG 128 HH11 ARG 128 -21.724 -7.360 11.515 1015 HH12 ARG 128 HH12 ARG 128 -23.317 -7.189 12.182 1016 HH21 ARG 128 HH21 ARG 128 -24.732 -9.735 10.216 1017 HH22 ARG 128 HH22 ARG 128 -25.039 -8.506 11.411 1018 H GLY 129 HN GLY 129 -21.167 -10.361 5.051 1019 HA2 GLY 129 HA2 GLY 129 -21.596 -13.070 3.961 1020 HA3 GLY 129 HA1 GLY 129 -22.948 -11.978 4.225 1021 H ALA 130 HN ALA 130 -23.434 -12.152 1.997 1022 HA ALA 130 HA ALA 130 -23.560 -11.348 -0.106 1023 HB1 ALA 130 HB1 ALA 130 -21.407 -9.402 0.698 1024 HB2 ALA 130 HB2 ALA 130 -23.142 -9.155 0.903 1025 HB3 ALA 130 HB3 ALA 130 -22.456 -9.288 -0.716 1026 H GLY 131 HN GLY 131 -20.109 -11.348 0.813 1027 HA2 GLY 131 HA2 GLY 131 -19.162 -12.162 -1.731 1028 HA3 GLY 131 HA1 GLY 131 -18.276 -12.280 -0.216 1029 H PHE 132 HN PHE 132 -20.231 -13.941 1.096 1030 HA PHE 132 HA PHE 132 -19.582 -16.492 -0.091 1031 HB2 PHE 132 HB2 PHE 132 -20.836 -15.649 2.523 1032 HB3 PHE 132 HB1 PHE 132 -20.719 -17.325 2.027 1033 HD1 PHE 132 HD2 PHE 132 -18.767 -14.330 2.903 1034 HD2 PHE 132 HD1 PHE 132 -18.695 -18.530 2.221 1035 HE1 PHE 132 HE2 PHE 132 -16.489 -14.438 3.824 1036 HE2 PHE 132 HE1 PHE 132 -16.419 -18.645 3.146 1037 HZ PHE 132 HZ PHE 132 -15.312 -16.598 3.948 Start of MODEL 7 1 H1 LYS 2 HT1 LYS 2 25.458 -27.477 -16.830 2 H2 LYS 2 HT2 LYS 2 25.262 -27.464 -18.515 3 H3 LYS 2 HT3 LYS 2 24.166 -26.632 -17.530 4 HA LYS 2 HA LYS 2 25.749 -25.159 -18.645 5 HB2 LYS 2 HB2 LYS 2 26.472 -23.958 -16.541 6 HB3 LYS 2 HB1 LYS 2 24.755 -24.321 -16.645 7 HG2 LYS 2 HG2 LYS 2 24.914 -26.041 -15.051 8 HG3 LYS 2 HG1 LYS 2 26.672 -26.098 -15.169 9 HD2 LYS 2 HD2 LYS 2 25.095 -23.760 -14.099 10 HD3 LYS 2 HD1 LYS 2 25.863 -25.000 -13.104 11 HE2 LYS 2 HE2 LYS 2 28.042 -24.400 -14.098 12 HE3 LYS 2 HE1 LYS 2 27.248 -23.117 -15.010 13 HZ1 LYS 2 HZ1 LYS 2 26.585 -22.111 -12.890 14 HZ2 LYS 2 HZ2 LYS 2 28.268 -22.224 -13.041 15 HZ3 LYS 2 HZ3 LYS 2 27.433 -23.318 -12.049 16 H VAL 3 HN VAL 3 27.202 -27.218 -19.398 17 HA VAL 3 HA VAL 3 29.669 -27.203 -17.867 18 HB VAL 3 HB VAL 3 29.059 -29.393 -18.448 19 HG11 VAL 3 HG11 VAL 3 27.591 -28.623 -20.431 20 HG12 VAL 3 HG12 VAL 3 28.344 -30.214 -20.480 21 HG13 VAL 3 HG13 VAL 3 29.048 -28.886 -21.396 22 HG21 VAL 3 HG21 VAL 3 30.927 -30.177 -19.821 23 HG22 VAL 3 HG22 VAL 3 31.428 -28.963 -18.643 24 HG23 VAL 3 HG23 VAL 3 31.231 -28.519 -20.339 25 H GLN 4 HN GLN 4 29.098 -27.036 -21.397 26 HA GLN 4 HA GLN 4 29.963 -24.630 -22.127 27 HB2 GLN 4 HB2 GLN 4 32.026 -25.002 -20.739 28 HB3 GLN 4 HB1 GLN 4 32.468 -26.310 -21.826 29 HG2 GLN 4 HG2 GLN 4 32.738 -24.801 -23.654 30 HG3 GLN 4 HG1 GLN 4 32.058 -23.467 -22.723 31 HE21 GLN 4 HE21 GLN 4 33.890 -22.225 -23.062 32 HE22 GLN 4 HE22 GLN 4 35.383 -22.538 -22.230 33 H GLU 5 HN GLU 5 28.362 -26.220 -23.370 34 HA GLU 5 HA GLU 5 29.554 -26.669 -25.924 35 HB2 GLU 5 HB2 GLU 5 30.299 -28.716 -24.758 36 HB3 GLU 5 HB1 GLU 5 28.626 -29.103 -24.381 37 HG2 GLU 5 HG2 GLU 5 29.495 -30.393 -26.271 38 HG3 GLU 5 HG1 GLU 5 28.119 -29.385 -26.717 39 H GLN 6 HN GLN 6 28.029 -25.878 -27.213 40 HA GLN 6 HA GLN 6 25.250 -26.692 -26.704 41 HB2 GLN 6 HB2 GLN 6 24.491 -24.467 -27.436 42 HB3 GLN 6 HB1 GLN 6 25.471 -24.392 -25.979 43 HG2 GLN 6 HG2 GLN 6 27.404 -23.715 -27.347 44 HG3 GLN 6 HG1 GLN 6 26.369 -23.723 -28.774 45 HE21 GLN 6 HE21 GLN 6 24.815 -22.119 -29.021 46 HE22 GLN 6 HE22 GLN 6 24.839 -20.664 -28.078 47 H SER 7 HN SER 7 27.749 -27.031 -28.730 48 HA SER 7 HA SER 7 26.447 -26.605 -31.253 49 HB2 SER 7 HB2 SER 7 28.940 -26.578 -30.940 50 HB3 SER 7 HB1 SER 7 28.875 -28.318 -30.663 51 HG SER 7 HG SER 7 27.873 -27.063 -33.005 52 H VAL 8 HN VAL 8 26.877 -29.266 -29.025 53 HA VAL 8 HA VAL 8 25.186 -30.947 -30.753 54 HB VAL 8 HB VAL 8 27.475 -31.814 -30.153 55 HG11 VAL 8 HG11 VAL 8 27.612 -30.967 -27.889 56 HG12 VAL 8 HG12 VAL 8 27.836 -32.715 -27.918 57 HG13 VAL 8 HG13 VAL 8 26.297 -32.033 -27.392 58 HG21 VAL 8 HG21 VAL 8 25.715 -33.320 -30.876 59 HG22 VAL 8 HG22 VAL 8 25.131 -33.463 -29.217 60 HG23 VAL 8 HG23 VAL 8 26.724 -34.086 -29.651 61 H GLY 9 HN GLY 9 24.859 -28.832 -28.413 62 HA2 GLY 9 HA2 GLY 9 23.109 -30.397 -26.663 63 HA3 GLY 9 HA1 GLY 9 23.688 -28.767 -26.346 64 H ALA 10 HN ALA 10 21.357 -28.461 -25.827 65 HA ALA 10 HA ALA 10 19.889 -27.769 -28.286 66 HB1 ALA 10 HB1 ALA 10 18.646 -28.914 -25.788 67 HB2 ALA 10 HB2 ALA 10 18.951 -29.814 -27.272 68 HB3 ALA 10 HB3 ALA 10 17.807 -28.471 -27.274 69 HA PRO 11 HA PRO 11 20.122 -23.780 -26.189 70 HB2 PRO 11 HB2 PRO 11 18.564 -22.959 -28.569 71 HB3 PRO 11 HB1 PRO 11 20.091 -22.321 -27.950 72 HG2 PRO 11 HG2 PRO 11 20.015 -23.812 -30.163 73 HG3 PRO 11 HG1 PRO 11 21.353 -23.947 -29.005 74 HD2 PRO 11 HD2 PRO 11 18.986 -25.744 -29.391 75 HD3 PRO 11 HD1 PRO 11 20.684 -26.170 -29.083 76 HA PRO 12 HA PRO 12 16.158 -23.916 -24.202 77 HB2 PRO 12 HB2 PRO 12 16.731 -21.108 -23.481 78 HB3 PRO 12 HB1 PRO 12 16.424 -22.497 -22.435 79 HG2 PRO 12 HG2 PRO 12 18.876 -21.460 -22.671 80 HG3 PRO 12 HG1 PRO 12 18.626 -23.208 -22.513 81 HD2 PRO 12 HD2 PRO 12 19.231 -21.594 -24.960 82 HD3 PRO 12 HD1 PRO 12 19.861 -23.181 -24.473 83 HA PRO 13 HA PRO 13 13.854 -21.809 -27.424 84 HB2 PRO 13 HB2 PRO 13 11.559 -23.159 -27.118 85 HB3 PRO 13 HB1 PRO 13 12.989 -23.912 -27.836 86 HG2 PRO 13 HG2 PRO 13 11.913 -24.154 -25.055 87 HG3 PRO 13 HG1 PRO 13 12.575 -25.414 -26.113 88 HD2 PRO 13 HD2 PRO 13 13.992 -24.184 -24.102 89 HD3 PRO 13 HD1 PRO 13 14.731 -24.937 -25.530 90 H GLY 14 HN GLY 14 14.196 -20.157 -25.346 91 HA2 GLY 14 HA2 GLY 14 11.861 -18.642 -25.280 92 HA3 GLY 14 HA1 GLY 14 11.886 -19.604 -23.808 93 H ARG 15 HN ARG 15 11.949 -16.825 -23.794 94 HA ARG 15 HA ARG 15 14.536 -16.376 -22.509 95 HB2 ARG 15 HB2 ARG 15 14.629 -15.517 -24.890 96 HB3 ARG 15 HB1 ARG 15 13.356 -14.383 -24.458 97 HG2 ARG 15 HG2 ARG 15 14.824 -13.400 -22.758 98 HG3 ARG 15 HG1 ARG 15 16.103 -14.524 -23.222 99 HD2 ARG 15 HD2 ARG 15 16.619 -12.551 -24.361 100 HD3 ARG 15 HD1 ARG 15 15.845 -13.565 -25.575 101 HE ARG 15 HE ARG 15 14.640 -11.226 -24.248 102 HH11 ARG 15 HH11 ARG 15 14.593 -13.633 -26.805 103 HH12 ARG 15 HH12 ARG 15 13.369 -12.810 -27.719 104 HH21 ARG 15 HH21 ARG 15 13.059 -10.131 -25.485 105 HH22 ARG 15 HH22 ARG 15 12.507 -10.825 -26.984 106 H ALA 16 HN ALA 16 14.366 -15.157 -20.686 107 HA ALA 16 HA ALA 16 11.681 -14.159 -20.015 108 HB1 ALA 16 HB1 ALA 16 12.351 -14.343 -17.687 109 HB2 ALA 16 HB2 ALA 16 13.977 -14.819 -18.172 110 HB3 ALA 16 HB3 ALA 16 12.611 -15.879 -18.517 111 H ASP 17 HN ASP 17 13.702 -12.781 -21.649 112 HA ASP 17 HA ASP 17 14.179 -10.432 -19.946 113 HB2 ASP 17 HB2 ASP 17 15.965 -11.474 -22.157 114 HB3 ASP 17 HB1 ASP 17 16.236 -9.995 -21.242 115 H LYS 18 HN LYS 18 12.019 -9.861 -20.828 116 HA LYS 18 HA LYS 18 12.260 -8.655 -23.499 117 HB2 LYS 18 HB2 LYS 18 9.841 -9.274 -21.801 118 HB3 LYS 18 HB1 LYS 18 9.762 -8.269 -23.242 119 HG2 LYS 18 HG2 LYS 18 10.584 -10.149 -24.583 120 HG3 LYS 18 HG1 LYS 18 10.620 -11.153 -23.130 121 HD2 LYS 18 HD2 LYS 18 8.238 -10.902 -22.851 122 HD3 LYS 18 HD1 LYS 18 8.164 -9.789 -24.217 123 HE2 LYS 18 HE2 LYS 18 8.825 -11.549 -25.737 124 HE3 LYS 18 HE1 LYS 18 9.041 -12.670 -24.391 125 HZ1 LYS 18 HZ1 LYS 18 6.681 -12.511 -23.918 126 HZ2 LYS 18 HZ2 LYS 18 6.932 -13.023 -25.513 127 HZ3 LYS 18 HZ3 LYS 18 6.468 -11.422 -25.198 128 H THR 19 HN THR 19 10.296 -7.705 -20.723 129 HA THR 19 HA THR 19 11.250 -4.980 -20.921 130 HB THR 19 HB THR 19 9.690 -4.700 -18.880 131 HG1 THR 19 HG1 THR 19 8.025 -6.517 -19.064 132 HG21 THR 19 HG21 THR 19 8.529 -5.607 -21.517 133 HG22 THR 19 HG22 THR 19 9.108 -3.981 -21.154 134 HG23 THR 19 HG23 THR 19 7.704 -4.629 -20.303 135 H ALA 20 HN ALA 20 13.449 -6.181 -20.428 136 HA ALA 20 HA ALA 20 13.993 -5.779 -17.581 137 HB1 ALA 20 HB1 ALA 20 13.587 -8.181 -17.894 138 HB2 ALA 20 HB2 ALA 20 15.257 -7.847 -17.433 139 HB3 ALA 20 HB3 ALA 20 14.865 -8.228 -19.110 140 H ALA 21 HN ALA 21 14.839 -3.786 -18.681 141 HA ALA 21 HA ALA 21 17.441 -4.311 -19.948 142 HB1 ALA 21 HB1 ALA 21 15.750 -1.837 -20.231 143 HB2 ALA 21 HB2 ALA 21 15.823 -3.166 -21.388 144 HB3 ALA 21 HB3 ALA 21 17.258 -2.188 -21.078 145 HA PRO 22 HA PRO 22 18.718 -0.812 -17.103 146 HB2 PRO 22 HB2 PRO 22 16.603 0.557 -15.761 147 HB3 PRO 22 HB1 PRO 22 17.589 1.135 -17.104 148 HG2 PRO 22 HG2 PRO 22 14.879 0.584 -17.251 149 HG3 PRO 22 HG1 PRO 22 15.979 0.660 -18.637 150 HD2 PRO 22 HD2 PRO 22 14.957 -1.732 -17.155 151 HD3 PRO 22 HD1 PRO 22 15.228 -1.513 -18.898 152 H GLN 23 HN GLN 23 15.865 -0.959 -14.992 153 HA GLN 23 HA GLN 23 17.657 -2.035 -12.934 154 HB2 GLN 23 HB2 GLN 23 16.034 -1.128 -11.299 155 HB3 GLN 23 HB1 GLN 23 16.735 0.102 -12.340 156 HG2 GLN 23 HG2 GLN 23 14.720 0.207 -13.651 157 HG3 GLN 23 HG1 GLN 23 14.019 -1.133 -12.743 158 HE21 GLN 23 HE21 GLN 23 12.255 0.109 -12.112 159 HE22 GLN 23 HE22 GLN 23 12.390 1.342 -10.899 160 H THR 24 HN THR 24 16.089 -3.591 -14.980 161 HA THR 24 HA THR 24 14.391 -5.162 -13.193 162 HB THR 24 HB THR 24 14.821 -5.783 -16.105 163 HG1 THR 24 HG1 THR 24 13.004 -3.871 -14.987 164 HG21 THR 24 HG21 THR 24 12.466 -6.120 -14.236 165 HG22 THR 24 HG22 THR 24 13.564 -7.398 -14.755 166 HG23 THR 24 HG23 THR 24 12.512 -6.609 -15.930 167 H ARG 25 HN ARG 25 17.440 -4.974 -13.333 168 HA ARG 25 HA ARG 25 17.959 -7.874 -13.358 169 HB2 ARG 25 HB2 ARG 25 19.977 -5.628 -13.129 170 HB3 ARG 25 HB1 ARG 25 20.320 -7.331 -13.377 171 HG2 ARG 25 HG2 ARG 25 18.811 -5.655 -15.358 172 HG3 ARG 25 HG1 ARG 25 20.563 -5.841 -15.386 173 HD2 ARG 25 HD2 ARG 25 19.651 -7.403 -16.937 174 HD3 ARG 25 HD1 ARG 25 20.212 -8.316 -15.540 175 HE ARG 25 HE ARG 25 17.600 -7.913 -14.984 176 HH11 ARG 25 HH11 ARG 25 19.259 -9.155 -17.808 177 HH12 ARG 25 HH12 ARG 25 17.953 -10.215 -18.267 178 HH21 ARG 25 HH21 ARG 25 15.886 -9.307 -15.591 179 HH22 ARG 25 HH22 ARG 25 16.060 -10.309 -17.001 180 H LEU 26 HN LEU 26 18.607 -4.914 -11.522 181 HA LEU 26 HA LEU 26 17.872 -6.329 -9.067 182 HB2 LEU 26 HB2 LEU 26 20.384 -4.744 -9.524 183 HB3 LEU 26 HB1 LEU 26 19.701 -4.923 -7.919 184 HG LEU 26 HG LEU 26 20.596 -7.197 -9.695 185 HD11 LEU 26 HD11 LEU 26 22.388 -7.451 -8.032 186 HD12 LEU 26 HD12 LEU 26 21.844 -5.968 -7.245 187 HD13 LEU 26 HD13 LEU 26 22.479 -5.911 -8.889 188 HD21 LEU 26 HD21 LEU 26 18.737 -7.800 -8.221 189 HD22 LEU 26 HD22 LEU 26 19.637 -7.182 -6.836 190 HD23 LEU 26 HD23 LEU 26 20.237 -8.582 -7.722 191 H THR 27 HN THR 27 15.892 -5.244 -9.420 192 HA THR 27 HA THR 27 15.652 -2.426 -9.481 193 HB THR 27 HB THR 27 13.841 -3.805 -10.287 194 HG1 THR 27 HG1 THR 27 13.428 -1.756 -8.993 195 HG21 THR 27 HG21 THR 27 12.495 -5.216 -8.817 196 HG22 THR 27 HG22 THR 27 13.560 -4.837 -7.463 197 HG23 THR 27 HG23 THR 27 14.175 -5.750 -8.841 198 HA PRO 28 HA PRO 28 16.609 -1.411 -5.255 199 HB2 PRO 28 HB2 PRO 28 14.702 0.819 -5.726 200 HB3 PRO 28 HB1 PRO 28 16.382 0.870 -5.180 201 HG2 PRO 28 HG2 PRO 28 15.739 1.593 -7.657 202 HG3 PRO 28 HG1 PRO 28 17.224 0.681 -7.333 203 HD2 PRO 28 HD2 PRO 28 14.618 -0.274 -8.446 204 HD3 PRO 28 HD1 PRO 28 16.273 -0.724 -8.907 205 H TYR 29 HN TYR 29 15.676 -2.793 -3.873 206 HA TYR 29 HA TYR 29 12.823 -3.134 -3.738 207 HB2 TYR 29 HB2 TYR 29 14.977 -4.298 -1.960 208 HB3 TYR 29 HB1 TYR 29 13.307 -4.843 -2.067 209 HD1 TYR 29 HD1 TYR 29 12.507 -5.728 -4.351 210 HD2 TYR 29 HD2 TYR 29 16.610 -5.248 -3.328 211 HE1 TYR 29 HE1 TYR 29 13.133 -7.298 -6.137 212 HE2 TYR 29 HE2 TYR 29 17.245 -6.813 -5.114 213 HH TYR 29 HH TYR 29 16.228 -8.655 -6.398 214 H ALA 30 HN ALA 30 12.314 -0.935 -3.170 215 HA ALA 30 HA ALA 30 13.099 0.344 -0.806 216 HB1 ALA 30 HB1 ALA 30 10.498 0.600 -2.314 217 HB2 ALA 30 HB2 ALA 30 11.976 1.502 -2.639 218 HB3 ALA 30 HB3 ALA 30 11.112 1.745 -1.121 219 H GLN 31 HN GLN 31 12.275 0.386 1.260 220 HA GLN 31 HA GLN 31 10.107 -1.500 1.874 221 HB2 GLN 31 HB2 GLN 31 12.366 -2.554 2.241 222 HB3 GLN 31 HB1 GLN 31 12.668 -1.334 3.469 223 HG2 GLN 31 HG2 GLN 31 11.958 -3.186 4.672 224 HG3 GLN 31 HG1 GLN 31 10.523 -2.168 4.573 225 HE21 GLN 31 HE21 GLN 31 10.124 -2.929 1.711 226 HE22 GLN 31 HE22 GLN 31 9.451 -4.516 1.769 227 H ALA 32 HN ALA 32 8.722 -0.824 3.422 228 HA ALA 32 HA ALA 32 9.486 1.394 5.172 229 HB1 ALA 32 HB1 ALA 32 6.958 1.350 3.517 230 HB2 ALA 32 HB2 ALA 32 8.317 2.456 3.312 231 HB3 ALA 32 HB3 ALA 32 7.335 2.526 4.775 232 H GLY 33 HN GLY 33 9.141 0.720 7.193 233 HA2 GLY 33 HA2 GLY 33 7.127 -1.404 7.588 234 HA3 GLY 33 HA1 GLY 33 8.613 -1.261 8.511 235 H GLU 34 HN GLU 34 5.529 0.328 7.871 236 HA GLU 34 HA GLU 34 5.446 1.011 10.726 237 HB2 GLU 34 HB2 GLU 34 4.519 2.716 8.412 238 HB3 GLU 34 HB1 GLU 34 3.981 2.979 10.063 239 HG2 GLU 34 HG2 GLU 34 6.519 3.094 10.594 240 HG3 GLU 34 HG1 GLU 34 6.676 3.394 8.862 241 H ASP 35 HN ASP 35 3.389 0.838 11.686 242 HA ASP 35 HA ASP 35 1.640 -1.018 10.231 243 HB2 ASP 35 HB2 ASP 35 1.894 -0.468 13.197 244 HB3 ASP 35 HB1 ASP 35 0.737 -1.586 12.486 245 H ASN 36 HN ASN 36 1.748 2.129 11.684 246 HA ASN 36 HA ASN 36 -1.160 2.330 11.770 247 HB2 ASN 36 HB2 ASN 36 0.370 3.249 13.595 248 HB3 ASN 36 HB1 ASN 36 0.803 4.521 12.455 249 HD21 ASN 36 HD21 ASN 36 -0.101 6.191 13.602 250 HD22 ASN 36 HD22 ASN 36 -1.810 6.366 13.827 251 H TRP 37 HN TRP 37 1.062 2.652 9.380 252 HA TRP 37 HA TRP 37 0.525 5.170 8.262 253 HB2 TRP 37 HB2 TRP 37 1.472 4.329 6.190 254 HB3 TRP 37 HB1 TRP 37 2.437 3.777 7.542 255 HD1 TRP 37 HD1 TRP 37 0.575 1.190 8.253 256 HE1 TRP 37 HE1 TRP 37 0.696 -0.853 6.688 257 HE3 TRP 37 HE3 TRP 37 2.467 3.485 4.097 258 HZ2 TRP 37 HZ2 TRP 37 1.509 -1.408 4.046 259 HZ3 TRP 37 HZ3 TRP 37 2.895 2.123 2.093 260 HH2 TRP 37 HH2 TRP 37 2.427 -0.272 2.070 261 H ARG 38 HN ARG 38 -1.222 2.164 8.085 262 HA ARG 38 HA ARG 38 -2.820 2.761 5.819 263 HB2 ARG 38 HB2 ARG 38 -4.302 0.935 6.755 264 HB3 ARG 38 HB1 ARG 38 -2.637 0.477 6.409 265 HG2 ARG 38 HG2 ARG 38 -2.060 0.576 8.731 266 HG3 ARG 38 HG1 ARG 38 -3.637 1.254 9.141 267 HD2 ARG 38 HD2 ARG 38 -4.728 -0.787 8.478 268 HD3 ARG 38 HD1 ARG 38 -3.193 -1.475 7.937 269 HE ARG 38 HE ARG 38 -3.534 -0.700 10.754 270 HH11 ARG 38 HH11 ARG 38 -3.017 -3.187 8.329 271 HH12 ARG 38 HH12 ARG 38 -2.678 -4.426 9.501 272 HH21 ARG 38 HH21 ARG 38 -3.075 -2.343 12.288 273 HH22 ARG 38 HH22 ARG 38 -2.739 -3.957 11.732 274 H SER 39 HN SER 39 -3.235 3.237 9.278 275 HA SER 39 HA SER 39 -5.937 4.088 9.081 276 HB2 SER 39 HB2 SER 39 -4.531 5.107 11.406 277 HB3 SER 39 HB1 SER 39 -5.832 3.914 11.310 278 HG SER 39 HG SER 39 -3.312 3.469 11.878 279 H ARG 40 HN ARG 40 -2.799 5.684 8.943 280 HA ARG 40 HA ARG 40 -3.762 8.330 8.913 281 HB2 ARG 40 HB2 ARG 40 -1.330 7.271 7.468 282 HB3 ARG 40 HB1 ARG 40 -1.626 8.882 8.048 283 HG2 ARG 40 HG2 ARG 40 -1.432 8.168 10.345 284 HG3 ARG 40 HG1 ARG 40 -1.208 6.497 9.807 285 HD2 ARG 40 HD2 ARG 40 0.780 7.286 8.500 286 HD3 ARG 40 HD1 ARG 40 0.604 8.852 9.288 287 HE ARG 40 HE ARG 40 0.817 7.378 11.424 288 HH11 ARG 40 HH11 ARG 40 2.575 7.021 8.405 289 HH12 ARG 40 HH12 ARG 40 3.966 6.291 9.151 290 HH21 ARG 40 HH21 ARG 40 2.640 6.416 12.406 291 HH22 ARG 40 HH22 ARG 40 4.005 5.951 11.421 292 H ILE 41 HN ILE 41 -3.101 5.901 6.425 293 HA ILE 41 HA ILE 41 -3.749 7.394 4.144 294 HB ILE 41 HB ILE 41 -4.076 4.433 4.694 295 HG12 ILE 41 HG12 ILE 41 -1.993 5.930 3.089 296 HG13 ILE 41 HG11 ILE 41 -1.767 5.351 4.735 297 HG21 ILE 41 HG21 ILE 41 -4.286 5.872 2.054 298 HG22 ILE 41 HG22 ILE 41 -5.605 5.078 2.914 299 HG23 ILE 41 HG23 ILE 41 -4.267 4.122 2.274 300 HD11 ILE 41 HD11 ILE 41 -2.043 3.055 3.973 301 HD12 ILE 41 HD12 ILE 41 -0.732 3.865 3.116 302 HD13 ILE 41 HD13 ILE 41 -2.291 3.628 2.324 303 H SER 42 HN SER 42 -5.776 5.347 6.226 304 HA SER 42 HA SER 42 -8.222 5.718 4.959 305 HB2 SER 42 HB2 SER 42 -7.704 5.441 7.929 306 HB3 SER 42 HB1 SER 42 -9.236 5.128 7.115 307 HG SER 42 HG SER 42 -6.787 3.733 6.724 308 H GLY 43 HN GLY 43 -6.428 7.874 7.051 309 HA2 GLY 43 HA2 GLY 43 -8.548 9.724 7.544 310 HA3 GLY 43 HA1 GLY 43 -6.826 10.048 7.712 311 H ARG 44 HN ARG 44 -5.972 9.529 5.119 312 HA ARG 44 HA ARG 44 -6.627 11.945 3.796 313 HB2 ARG 44 HB2 ARG 44 -4.815 9.664 3.435 314 HB3 ARG 44 HB1 ARG 44 -5.376 10.378 1.949 315 HG2 ARG 44 HG2 ARG 44 -3.567 11.680 2.224 316 HG3 ARG 44 HG1 ARG 44 -4.669 12.604 3.246 317 HD2 ARG 44 HD2 ARG 44 -2.883 10.411 4.270 318 HD3 ARG 44 HD1 ARG 44 -2.419 12.111 4.240 319 HE ARG 44 HE ARG 44 -4.817 11.259 5.703 320 HH11 ARG 44 HH11 ARG 44 -1.673 12.798 5.624 321 HH12 ARG 44 HH12 ARG 44 -1.716 13.259 7.305 322 HH21 ARG 44 HH21 ARG 44 -4.873 11.861 7.920 323 HH22 ARG 44 HH22 ARG 44 -3.530 12.728 8.602 324 H LEU 45 HN LEU 45 -7.575 8.599 3.500 325 HA LEU 45 HA LEU 45 -8.880 8.661 1.021 326 HB2 LEU 45 HB2 LEU 45 -8.279 6.769 2.836 327 HB3 LEU 45 HB1 LEU 45 -9.972 6.986 3.222 328 HG LEU 45 HG LEU 45 -9.041 6.393 0.431 329 HD11 LEU 45 HD11 LEU 45 -9.544 4.039 0.880 330 HD12 LEU 45 HD12 LEU 45 -9.806 4.428 2.581 331 HD13 LEU 45 HD13 LEU 45 -8.204 4.625 1.867 332 HD21 LEU 45 HD21 LEU 45 -11.673 6.075 1.856 333 HD22 LEU 45 HD22 LEU 45 -11.336 5.506 0.219 334 HD23 LEU 45 HD23 LEU 45 -11.287 7.233 0.583 335 H ASN 46 HN ASN 46 -9.835 9.626 4.193 336 HA ASN 46 HA ASN 46 -12.632 9.914 3.738 337 HB2 ASN 46 HB2 ASN 46 -11.766 9.603 5.999 338 HB3 ASN 46 HB1 ASN 46 -10.820 11.079 5.867 339 HD21 ASN 46 HD21 ASN 46 -14.148 10.706 4.742 340 HD22 ASN 46 HD22 ASN 46 -14.837 11.791 5.899 341 H ARG 47 HN ARG 47 -9.826 12.007 3.671 342 HA ARG 47 HA ARG 47 -10.977 14.454 3.182 343 HB2 ARG 47 HB2 ARG 47 -8.804 14.915 3.224 344 HB3 ARG 47 HB1 ARG 47 -8.408 13.225 3.017 345 HG2 ARG 47 HG2 ARG 47 -8.456 13.467 0.602 346 HG3 ARG 47 HG1 ARG 47 -8.923 15.169 0.771 347 HD2 ARG 47 HD2 ARG 47 -6.843 15.688 1.851 348 HD3 ARG 47 HD1 ARG 47 -6.392 13.986 1.897 349 HE ARG 47 HE ARG 47 -6.842 15.186 -0.725 350 HH11 ARG 47 HH11 ARG 47 -4.553 14.216 1.742 351 HH12 ARG 47 HH12 ARG 47 -3.218 14.047 0.639 352 HH21 ARG 47 HH21 ARG 47 -5.081 14.985 -2.191 353 HH22 ARG 47 HH22 ARG 47 -3.524 14.484 -1.608 354 H PHE 48 HN PHE 48 -10.686 11.680 1.045 355 HA PHE 48 HA PHE 48 -11.724 13.314 -1.128 356 HB2 PHE 48 HB2 PHE 48 -10.736 10.472 -1.123 357 HB3 PHE 48 HB1 PHE 48 -11.419 11.266 -2.532 358 HD1 PHE 48 HD2 PHE 48 -10.212 13.154 -3.583 359 HD2 PHE 48 HD1 PHE 48 -8.499 10.822 -0.464 360 HE1 PHE 48 HE2 PHE 48 -7.974 13.965 -4.209 361 HE2 PHE 48 HE1 PHE 48 -6.258 11.623 -1.086 362 HZ PHE 48 HZ PHE 48 -5.993 13.198 -2.962 363 H LYS 49 HN LYS 49 -12.403 10.108 0.251 364 HA LYS 49 HA LYS 49 -15.237 10.552 0.418 365 HB2 LYS 49 HB2 LYS 49 -14.261 8.497 -1.593 366 HB3 LYS 49 HB1 LYS 49 -15.926 8.792 -1.139 367 HG2 LYS 49 HG2 LYS 49 -15.820 11.007 -2.175 368 HG3 LYS 49 HG1 LYS 49 -14.149 10.690 -2.650 369 HD2 LYS 49 HD2 LYS 49 -15.591 10.252 -4.530 370 HD3 LYS 49 HD1 LYS 49 -14.937 8.723 -3.942 371 HE2 LYS 49 HE2 LYS 49 -17.267 8.426 -4.434 372 HE3 LYS 49 HE1 LYS 49 -17.050 8.368 -2.685 373 HZ1 LYS 49 HZ1 LYS 49 -17.805 10.661 -2.545 374 HZ2 LYS 49 HZ2 LYS 49 -18.974 9.699 -3.311 375 HZ3 LYS 49 HZ3 LYS 49 -17.990 10.728 -4.232 376 H ARG 50 HN ARG 50 -15.223 9.690 2.516 377 HA ARG 50 HA ARG 50 -14.299 6.892 2.620 378 HB2 ARG 50 HB2 ARG 50 -13.002 8.487 4.071 379 HB3 ARG 50 HB1 ARG 50 -14.477 8.745 4.993 380 HG2 ARG 50 HG2 ARG 50 -14.541 6.412 5.620 381 HG3 ARG 50 HG1 ARG 50 -13.130 6.078 4.617 382 HD2 ARG 50 HD2 ARG 50 -12.447 6.253 6.919 383 HD3 ARG 50 HD1 ARG 50 -11.811 7.626 6.016 384 HE ARG 50 HE ARG 50 -14.280 8.355 7.154 385 HH11 ARG 50 HH11 ARG 50 -11.012 7.555 8.143 386 HH12 ARG 50 HH12 ARG 50 -11.062 8.545 9.568 387 HH21 ARG 50 HH21 ARG 50 -14.334 9.689 9.013 388 HH22 ARG 50 HH22 ARG 50 -12.945 9.757 10.058 389 H TYR 51 HN TYR 51 -16.083 5.800 2.231 390 HA TYR 51 HA TYR 51 -18.601 6.336 3.481 391 HB2 TYR 51 HB2 TYR 51 -18.092 5.112 1.251 392 HB3 TYR 51 HB1 TYR 51 -17.711 3.723 2.260 393 HD1 TYR 51 HD2 TYR 51 -20.391 5.978 3.293 394 HD2 TYR 51 HD1 TYR 51 -19.454 2.433 1.140 395 HE1 TYR 51 HE2 TYR 51 -22.766 5.362 3.285 396 HE2 TYR 51 HE1 TYR 51 -21.827 1.806 1.125 397 HH TYR 51 HH TYR 51 -24.313 4.001 2.119 398 HA PRO 52 HA PRO 52 -17.021 4.772 7.395 399 HB2 PRO 52 HB2 PRO 52 -19.911 4.784 8.085 400 HB3 PRO 52 HB1 PRO 52 -18.550 5.538 8.923 401 HG2 PRO 52 HG2 PRO 52 -20.271 7.012 7.516 402 HG3 PRO 52 HG1 PRO 52 -18.539 7.385 7.518 403 HD2 PRO 52 HD2 PRO 52 -20.183 6.034 5.422 404 HD3 PRO 52 HD1 PRO 52 -18.853 7.195 5.238 405 H LYS 53 HN LYS 53 -16.656 2.760 8.054 406 HA LYS 53 HA LYS 53 -17.537 0.580 6.529 407 HB2 LYS 53 HB2 LYS 53 -15.801 0.970 8.837 408 HB3 LYS 53 HB1 LYS 53 -16.654 -0.563 8.885 409 HG2 LYS 53 HG2 LYS 53 -14.678 -1.093 7.806 410 HG3 LYS 53 HG1 LYS 53 -15.807 -0.871 6.471 411 HD2 LYS 53 HD2 LYS 53 -14.064 1.368 7.450 412 HD3 LYS 53 HD1 LYS 53 -13.483 0.190 6.276 413 HE2 LYS 53 HE2 LYS 53 -14.895 0.931 4.623 414 HE3 LYS 53 HE1 LYS 53 -16.084 1.550 5.774 415 HZ1 LYS 53 HZ1 LYS 53 -14.514 3.334 6.327 416 HZ2 LYS 53 HZ2 LYS 53 -14.945 3.355 4.687 417 HZ3 LYS 53 HZ3 LYS 53 -13.430 2.746 5.156 418 H ASP 54 HN ASP 54 -18.901 2.050 9.333 419 HA ASP 54 HA ASP 54 -20.457 0.004 10.376 420 HB2 ASP 54 HB2 ASP 54 -21.057 2.953 10.100 421 HB3 ASP 54 HB1 ASP 54 -22.058 1.841 11.029 422 H ALA 55 HN ALA 55 -21.043 2.057 7.562 423 HA ALA 55 HA ALA 55 -23.638 0.970 7.028 424 HB1 ALA 55 HB1 ALA 55 -23.476 2.189 4.910 425 HB2 ALA 55 HB2 ALA 55 -21.782 2.545 5.249 426 HB3 ALA 55 HB3 ALA 55 -23.047 3.211 6.281 427 H LEU 56 HN LEU 56 -20.367 0.338 5.982 428 HA LEU 56 HA LEU 56 -20.998 -1.468 3.894 429 HB2 LEU 56 HB2 LEU 56 -18.492 -1.054 5.537 430 HB3 LEU 56 HB1 LEU 56 -18.589 -2.237 4.247 431 HG LEU 56 HG LEU 56 -17.489 -0.324 3.372 432 HD11 LEU 56 HD11 LEU 56 -19.108 -1.332 1.857 433 HD12 LEU 56 HD12 LEU 56 -18.913 0.399 1.566 434 HD13 LEU 56 HD13 LEU 56 -20.338 -0.201 2.425 435 HD21 LEU 56 HD21 LEU 56 -18.062 1.347 4.963 436 HD22 LEU 56 HD22 LEU 56 -19.760 1.293 4.489 437 HD23 LEU 56 HD23 LEU 56 -18.548 1.920 3.370 438 H ARG 57 HN ARG 57 -20.469 -1.858 7.360 439 HA ARG 57 HA ARG 57 -20.148 -4.598 7.543 440 HB2 ARG 57 HB2 ARG 57 -21.534 -2.685 9.416 441 HB3 ARG 57 HB1 ARG 57 -21.262 -4.376 9.813 442 HG2 ARG 57 HG2 ARG 57 -18.805 -3.932 9.403 443 HG3 ARG 57 HG1 ARG 57 -19.220 -2.218 9.373 444 HD2 ARG 57 HD2 ARG 57 -19.988 -4.014 11.656 445 HD3 ARG 57 HD1 ARG 57 -18.429 -3.201 11.594 446 HE ARG 57 HE ARG 57 -19.862 -1.091 11.403 447 HH11 ARG 57 HH11 ARG 57 -20.878 -3.950 13.136 448 HH12 ARG 57 HH12 ARG 57 -21.746 -3.064 14.342 449 HH21 ARG 57 HH21 ARG 57 -20.981 0.092 13.030 450 HH22 ARG 57 HH22 ARG 57 -21.814 -0.778 14.292 451 H LEU 58 HN LEU 58 -23.142 -2.767 7.208 452 HA LEU 58 HA LEU 58 -24.693 -5.235 7.368 453 HB2 LEU 58 HB2 LEU 58 -25.488 -2.330 7.279 454 HB3 LEU 58 HB1 LEU 58 -26.655 -3.629 7.143 455 HG LEU 58 HG LEU 58 -25.863 -4.447 9.400 456 HD11 LEU 58 HD11 LEU 58 -23.699 -3.283 9.429 457 HD12 LEU 58 HD12 LEU 58 -24.686 -2.881 10.835 458 HD13 LEU 58 HD13 LEU 58 -24.542 -1.737 9.500 459 HD21 LEU 58 HD21 LEU 58 -27.940 -3.207 9.105 460 HD22 LEU 58 HD22 LEU 58 -27.061 -1.684 9.247 461 HD23 LEU 58 HD23 LEU 58 -27.158 -2.779 10.626 462 H LYS 59 HN LYS 59 -23.432 -3.056 5.023 463 HA LYS 59 HA LYS 59 -25.241 -4.198 3.010 464 HB2 LYS 59 HB2 LYS 59 -25.599 -1.824 3.241 465 HB3 LYS 59 HB1 LYS 59 -23.885 -1.499 3.050 466 HG2 LYS 59 HG2 LYS 59 -23.930 -1.843 0.783 467 HG3 LYS 59 HG1 LYS 59 -25.334 -2.902 0.868 468 HD2 LYS 59 HD2 LYS 59 -25.944 -0.782 -0.151 469 HD3 LYS 59 HD1 LYS 59 -26.747 -0.961 1.410 470 HE2 LYS 59 HE2 LYS 59 -25.954 1.065 1.901 471 HE3 LYS 59 HE1 LYS 59 -24.374 0.295 2.046 472 HZ1 LYS 59 HZ1 LYS 59 -25.482 1.582 -0.389 473 HZ2 LYS 59 HZ2 LYS 59 -23.990 0.781 -0.322 474 HZ3 LYS 59 HZ3 LYS 59 -24.246 2.187 0.593 475 H ARG 60 HN ARG 60 -22.118 -2.494 2.615 476 HA ARG 60 HA ARG 60 -21.406 -4.687 0.803 477 HB2 ARG 60 HB2 ARG 60 -20.401 -1.843 0.898 478 HB3 ARG 60 HB1 ARG 60 -19.815 -3.076 -0.212 479 HG2 ARG 60 HG2 ARG 60 -22.633 -2.033 -0.060 480 HG3 ARG 60 HG1 ARG 60 -21.431 -1.622 -1.287 481 HD2 ARG 60 HD2 ARG 60 -21.395 -3.833 -2.125 482 HD3 ARG 60 HD1 ARG 60 -22.325 -4.439 -0.753 483 HE ARG 60 HE ARG 60 -23.516 -2.501 -2.625 484 HH11 ARG 60 HH11 ARG 60 -23.530 -5.622 -1.033 485 HH12 ARG 60 HH12 ARG 60 -25.086 -6.087 -1.652 486 HH21 ARG 60 HH21 ARG 60 -25.569 -3.094 -3.432 487 HH22 ARG 60 HH22 ARG 60 -26.258 -4.632 -3.005 488 H GLN 61 HN GLN 61 -20.700 -5.988 2.547 489 HA GLN 61 HA GLN 61 -18.059 -5.200 3.510 490 HB2 GLN 61 HB2 GLN 61 -18.483 -7.455 4.883 491 HB3 GLN 61 HB1 GLN 61 -18.974 -5.871 5.449 492 HG2 GLN 61 HG2 GLN 61 -20.765 -7.343 5.861 493 HG3 GLN 61 HG1 GLN 61 -21.243 -6.333 4.502 494 HE21 GLN 61 HE21 GLN 61 -21.775 -7.277 2.616 495 HE22 GLN 61 HE22 GLN 61 -21.726 -8.977 2.333 496 H GLY 62 HN GLY 62 -16.302 -6.589 3.251 497 HA2 GLY 62 HA2 GLY 62 -16.008 -8.864 1.836 498 HA3 GLY 62 HA1 GLY 62 -16.348 -7.674 0.586 499 H VAL 63 HN VAL 63 -13.877 -9.277 1.672 500 HA VAL 63 HA VAL 63 -12.085 -6.974 2.005 501 HB VAL 63 HB VAL 63 -11.533 -9.895 2.571 502 HG11 VAL 63 HG11 VAL 63 -9.521 -8.656 1.952 503 HG12 VAL 63 HG12 VAL 63 -9.502 -9.086 3.662 504 HG13 VAL 63 HG13 VAL 63 -9.889 -7.438 3.172 505 HG21 VAL 63 HG21 VAL 63 -11.620 -9.256 4.927 506 HG22 VAL 63 HG22 VAL 63 -13.161 -8.951 4.126 507 HG23 VAL 63 HG23 VAL 63 -12.066 -7.612 4.468 508 H GLY 64 HN GLY 64 -10.864 -6.372 0.371 509 HA2 GLY 64 HA2 GLY 64 -9.919 -8.432 -1.514 510 HA3 GLY 64 HA1 GLY 64 -10.550 -6.897 -2.104 511 H GLN 65 HN GLN 65 -7.970 -7.717 -2.710 512 HA GLN 65 HA GLN 65 -6.414 -5.792 -1.104 513 HB2 GLN 65 HB2 GLN 65 -5.440 -8.223 -2.618 514 HB3 GLN 65 HB1 GLN 65 -4.379 -7.018 -1.901 515 HG2 GLN 65 HG2 GLN 65 -5.304 -7.535 0.309 516 HG3 GLN 65 HG1 GLN 65 -6.338 -8.762 -0.421 517 HE21 GLN 65 HE21 GLN 65 -3.088 -7.920 0.492 518 HE22 GLN 65 HE22 GLN 65 -2.411 -9.504 0.302 519 H VAL 66 HN VAL 66 -5.674 -4.052 -2.128 520 HA VAL 66 HA VAL 66 -6.041 -3.987 -5.050 521 HB VAL 66 HB VAL 66 -6.577 -1.567 -4.796 522 HG11 VAL 66 HG11 VAL 66 -8.797 -1.935 -3.527 523 HG12 VAL 66 HG12 VAL 66 -8.282 -3.626 -3.440 524 HG13 VAL 66 HG13 VAL 66 -8.509 -2.858 -5.012 525 HG21 VAL 66 HG21 VAL 66 -6.671 -2.220 -1.873 526 HG22 VAL 66 HG22 VAL 66 -7.093 -0.680 -2.624 527 HG23 VAL 66 HG23 VAL 66 -5.422 -1.254 -2.661 528 H ARG 67 HN ARG 67 -4.483 -3.100 -6.271 529 HA ARG 67 HA ARG 67 -2.000 -2.251 -4.922 530 HB2 ARG 67 HB2 ARG 67 -1.876 -4.366 -6.276 531 HB3 ARG 67 HB1 ARG 67 -2.338 -3.430 -7.692 532 HG2 ARG 67 HG2 ARG 67 -0.296 -2.020 -7.290 533 HG3 ARG 67 HG1 ARG 67 0.188 -3.219 -6.089 534 HD2 ARG 67 HD2 ARG 67 1.258 -3.688 -8.211 535 HD3 ARG 67 HD1 ARG 67 0.101 -4.962 -7.822 536 HE ARG 67 HE ARG 67 -1.272 -3.138 -9.366 537 HH11 ARG 67 HH11 ARG 67 1.564 -5.136 -9.766 538 HH12 ARG 67 HH12 ARG 67 1.352 -5.324 -11.476 539 HH21 ARG 67 HH21 ARG 67 -1.568 -3.374 -11.621 540 HH22 ARG 67 HH22 ARG 67 -0.436 -4.328 -12.528 541 H PHE 68 HN PHE 68 -1.109 -0.304 -5.534 542 HA PHE 68 HA PHE 68 -2.128 1.089 -7.838 543 HB2 PHE 68 HB2 PHE 68 -2.615 3.117 -6.193 544 HB3 PHE 68 HB1 PHE 68 -3.850 1.942 -6.618 545 HD1 PHE 68 HD2 PHE 68 -1.072 2.071 -4.106 546 HD2 PHE 68 HD1 PHE 68 -5.205 1.427 -4.883 547 HE1 PHE 68 HE2 PHE 68 -1.442 1.575 -1.726 548 HE2 PHE 68 HE1 PHE 68 -5.580 0.932 -2.508 549 HZ PHE 68 HZ PHE 68 -3.705 1.003 -0.927 550 H THR 69 HN THR 69 -0.900 2.753 -8.516 551 HA THR 69 HA THR 69 1.648 3.247 -7.146 552 HB THR 69 HB THR 69 0.683 4.449 -9.752 553 HG1 THR 69 HG1 THR 69 1.450 1.884 -9.183 554 HG21 THR 69 HG21 THR 69 3.450 3.998 -8.623 555 HG22 THR 69 HG22 THR 69 2.600 5.542 -8.671 556 HG23 THR 69 HG23 THR 69 3.069 4.747 -10.174 557 H LEU 70 HN LEU 70 2.008 5.092 -6.030 558 HA LEU 70 HA LEU 70 -0.272 6.951 -5.882 559 HB2 LEU 70 HB2 LEU 70 1.491 6.028 -3.620 560 HB3 LEU 70 HB1 LEU 70 0.100 7.092 -3.492 561 HG LEU 70 HG LEU 70 -0.046 4.231 -4.427 562 HD11 LEU 70 HD11 LEU 70 -0.710 5.383 -1.726 563 HD12 LEU 70 HD12 LEU 70 0.689 4.372 -2.101 564 HD13 LEU 70 HD13 LEU 70 -0.943 3.711 -2.239 565 HD21 LEU 70 HD21 LEU 70 -2.187 6.195 -3.624 566 HD22 LEU 70 HD22 LEU 70 -2.445 4.511 -4.080 567 HD23 LEU 70 HD23 LEU 70 -1.830 5.663 -5.268 568 H ASP 71 HN ASP 71 0.114 9.050 -5.916 569 HA ASP 71 HA ASP 71 2.813 10.005 -6.308 570 HB2 ASP 71 HB2 ASP 71 0.825 10.880 -7.593 571 HB3 ASP 71 HB1 ASP 71 0.253 11.604 -6.091 572 H ARG 72 HN ARG 72 3.608 11.902 -5.027 573 HA ARG 72 HA ARG 72 3.819 11.239 -2.351 574 HB2 ARG 72 HB2 ARG 72 5.058 13.222 -2.035 575 HB3 ARG 72 HB1 ARG 72 5.353 12.753 -3.699 576 HG2 ARG 72 HG2 ARG 72 3.147 14.467 -3.794 577 HG3 ARG 72 HG1 ARG 72 4.271 15.197 -2.650 578 HD2 ARG 72 HD2 ARG 72 4.881 16.071 -4.736 579 HD3 ARG 72 HD1 ARG 72 6.063 14.803 -4.410 580 HE ARG 72 HE ARG 72 3.784 13.919 -5.944 581 HH11 ARG 72 HH11 ARG 72 6.947 15.417 -6.111 582 HH12 ARG 72 HH12 ARG 72 7.256 14.911 -7.745 583 HH21 ARG 72 HH21 ARG 72 4.157 13.254 -8.090 584 HH22 ARG 72 HH22 ARG 72 5.642 13.706 -8.890 585 H GLN 73 HN GLN 73 1.517 13.387 -3.926 586 HA GLN 73 HA GLN 73 0.517 14.379 -1.380 587 HB2 GLN 73 HB2 GLN 73 -1.019 15.725 -2.751 588 HB3 GLN 73 HB1 GLN 73 0.657 15.944 -3.231 589 HG2 GLN 73 HG2 GLN 73 0.360 14.593 -5.170 590 HG3 GLN 73 HG1 GLN 73 -1.242 14.083 -4.638 591 HE21 GLN 73 HE21 GLN 73 -2.962 15.496 -4.829 592 HE22 GLN 73 HE22 GLN 73 -2.898 16.916 -5.808 593 H GLY 74 HN GLY 74 0.220 11.515 -2.584 594 HA2 GLY 74 HA2 GLY 74 -1.323 9.848 -2.209 595 HA3 GLY 74 HA1 GLY 74 -2.375 11.040 -1.468 596 H HIS 75 HN HIS 75 -1.040 11.302 -4.670 597 HA HIS 75 HA HIS 75 -3.736 11.311 -5.769 598 HB2 HIS 75 HB2 HIS 75 -2.354 13.158 -6.482 599 HB3 HIS 75 HB1 HIS 75 -1.048 12.071 -6.936 600 HD1 HIS 75 HD1 HIS 75 -4.361 13.371 -8.128 601 HD2 HIS 75 HD2 HIS 75 -1.280 10.910 -9.452 602 HE1 HIS 75 HE1 HIS 75 -4.810 12.972 -10.574 603 HE2 HIS 75 HE2 HIS 75 -2.810 11.667 -11.394 604 H VAL 76 HN VAL 76 -4.426 9.255 -5.997 605 HA VAL 76 HA VAL 76 -3.099 7.000 -6.734 606 HB VAL 76 HB VAL 76 -5.459 6.999 -6.141 607 HG11 VAL 76 HG11 VAL 76 -7.193 7.633 -7.746 608 HG12 VAL 76 HG12 VAL 76 -5.950 8.223 -8.850 609 HG13 VAL 76 HG13 VAL 76 -6.189 9.011 -7.290 610 HG21 VAL 76 HG21 VAL 76 -4.956 5.842 -8.874 611 HG22 VAL 76 HG22 VAL 76 -6.253 5.363 -7.778 612 HG23 VAL 76 HG23 VAL 76 -4.569 5.081 -7.331 613 H LEU 77 HN LEU 77 -1.938 6.390 -8.396 614 HA LEU 77 HA LEU 77 -2.131 7.903 -10.907 615 HB2 LEU 77 HB2 LEU 77 0.140 6.285 -9.742 616 HB3 LEU 77 HB1 LEU 77 0.182 7.075 -11.309 617 HG LEU 77 HG LEU 77 -0.386 8.710 -8.866 618 HD11 LEU 77 HD11 LEU 77 1.597 7.398 -8.295 619 HD12 LEU 77 HD12 LEU 77 1.993 9.098 -8.541 620 HD13 LEU 77 HD13 LEU 77 2.369 7.912 -9.795 621 HD21 LEU 77 HD21 LEU 77 0.740 10.429 -10.203 622 HD22 LEU 77 HD22 LEU 77 -0.632 9.729 -11.062 623 HD23 LEU 77 HD23 LEU 77 1.013 9.248 -11.484 624 H ALA 78 HN ALA 78 -1.816 4.652 -9.569 625 HA ALA 78 HA ALA 78 -3.051 3.575 -12.013 626 HB1 ALA 78 HB1 ALA 78 -1.587 1.626 -11.942 627 HB2 ALA 78 HB2 ALA 78 -0.735 2.297 -10.550 628 HB3 ALA 78 HB3 ALA 78 -0.638 3.105 -12.116 629 H VAL 79 HN VAL 79 -4.284 1.626 -11.655 630 HA VAL 79 HA VAL 79 -4.732 0.877 -8.866 631 HB VAL 79 HB VAL 79 -7.215 0.801 -9.305 632 HG11 VAL 79 HG11 VAL 79 -6.220 2.510 -7.894 633 HG12 VAL 79 HG12 VAL 79 -7.568 3.169 -8.818 634 HG13 VAL 79 HG13 VAL 79 -5.910 3.515 -9.309 635 HG21 VAL 79 HG21 VAL 79 -7.175 0.968 -11.737 636 HG22 VAL 79 HG22 VAL 79 -6.493 2.591 -11.623 637 HG23 VAL 79 HG23 VAL 79 -8.126 2.276 -11.034 638 H THR 80 HN THR 80 -4.795 -1.246 -8.635 639 HA THR 80 HA THR 80 -5.922 -2.920 -10.752 640 HB THR 80 HB THR 80 -3.259 -3.581 -9.474 641 HG1 THR 80 HG1 THR 80 -3.792 -1.892 -11.511 642 HG21 THR 80 HG21 THR 80 -4.547 -5.518 -10.200 643 HG22 THR 80 HG22 THR 80 -3.143 -5.286 -11.240 644 HG23 THR 80 HG23 THR 80 -4.742 -4.802 -11.804 645 H LEU 81 HN LEU 81 -7.473 -4.132 -9.722 646 HA LEU 81 HA LEU 81 -7.301 -4.674 -6.911 647 HB2 LEU 81 HB2 LEU 81 -9.474 -4.574 -8.114 648 HB3 LEU 81 HB1 LEU 81 -9.033 -6.032 -8.983 649 HG LEU 81 HG LEU 81 -8.822 -7.155 -6.703 650 HD11 LEU 81 HD11 LEU 81 -10.089 -6.148 -4.883 651 HD12 LEU 81 HD12 LEU 81 -10.375 -4.711 -5.865 652 HD13 LEU 81 HD13 LEU 81 -8.735 -5.124 -5.363 653 HD21 LEU 81 HD21 LEU 81 -11.532 -6.183 -7.619 654 HD22 LEU 81 HD22 LEU 81 -11.237 -7.564 -6.564 655 HD23 LEU 81 HD23 LEU 81 -10.671 -7.594 -8.233 656 H VAL 82 HN VAL 82 -5.808 -5.970 -6.117 657 HA VAL 82 HA VAL 82 -4.431 -7.825 -7.872 658 HB VAL 82 HB VAL 82 -3.806 -7.944 -5.002 659 HG11 VAL 82 HG11 VAL 82 -2.136 -7.363 -7.443 660 HG12 VAL 82 HG12 VAL 82 -2.391 -8.952 -6.719 661 HG13 VAL 82 HG13 VAL 82 -1.525 -7.703 -5.823 662 HG21 VAL 82 HG21 VAL 82 -4.477 -5.629 -5.109 663 HG22 VAL 82 HG22 VAL 82 -3.463 -5.368 -6.531 664 HG23 VAL 82 HG23 VAL 82 -2.721 -5.735 -4.970 665 H SER 83 HN SER 83 -6.518 -8.014 -5.032 666 HA SER 83 HA SER 83 -6.931 -10.856 -5.597 667 HB2 SER 83 HB2 SER 83 -5.137 -10.538 -3.819 668 HB3 SER 83 HB1 SER 83 -6.396 -9.854 -2.796 669 HG SER 83 HG SER 83 -5.792 -12.384 -3.083 670 H SER 84 HN SER 84 -8.933 -11.637 -4.942 671 HA SER 84 HA SER 84 -10.771 -9.798 -3.617 672 HB2 SER 84 HB2 SER 84 -11.185 -9.300 -5.929 673 HB3 SER 84 HB1 SER 84 -11.218 -11.011 -6.355 674 HG SER 84 HG SER 84 -13.312 -9.817 -6.062 675 H ALA 85 HN ALA 85 -12.040 -10.835 -2.202 676 HA ALA 85 HA ALA 85 -11.852 -13.733 -2.039 677 HB1 ALA 85 HB1 ALA 85 -13.164 -11.761 -0.168 678 HB2 ALA 85 HB2 ALA 85 -11.528 -12.399 -0.012 679 HB3 ALA 85 HB3 ALA 85 -12.911 -13.480 0.144 680 H GLY 86 HN GLY 86 -13.537 -12.104 -4.040 681 HA2 GLY 86 HA2 GLY 86 -15.388 -12.978 -5.225 682 HA3 GLY 86 HA1 GLY 86 -15.892 -13.810 -3.758 683 H LEU 87 HN LEU 87 -15.404 -10.468 -4.928 684 HA LEU 87 HA LEU 87 -17.805 -9.769 -3.372 685 HB2 LEU 87 HB2 LEU 87 -15.709 -7.830 -4.330 686 HB3 LEU 87 HB1 LEU 87 -17.018 -7.503 -3.231 687 HG LEU 87 HG LEU 87 -15.241 -7.560 -1.797 688 HD11 LEU 87 HD11 LEU 87 -16.099 -10.441 -1.880 689 HD12 LEU 87 HD12 LEU 87 -16.863 -9.138 -0.970 690 HD13 LEU 87 HD13 LEU 87 -15.233 -9.666 -0.552 691 HD21 LEU 87 HD21 LEU 87 -14.032 -9.854 -3.326 692 HD22 LEU 87 HD22 LEU 87 -13.314 -9.020 -1.949 693 HD23 LEU 87 HD23 LEU 87 -13.566 -8.160 -3.469 694 HA PRO 88 HA PRO 88 -19.113 -9.376 -7.742 695 HB2 PRO 88 HB2 PRO 88 -21.779 -9.992 -6.754 696 HB3 PRO 88 HB1 PRO 88 -20.774 -10.909 -7.877 697 HG2 PRO 88 HG2 PRO 88 -21.351 -11.770 -5.362 698 HG3 PRO 88 HG1 PRO 88 -19.859 -12.198 -6.217 699 HD2 PRO 88 HD2 PRO 88 -20.307 -10.130 -4.098 700 HD3 PRO 88 HD1 PRO 88 -18.943 -11.249 -4.313 701 H SER 89 HN SER 89 -21.780 -8.645 -5.546 702 HA SER 89 HA SER 89 -22.300 -6.122 -6.770 703 HB2 SER 89 HB2 SER 89 -23.378 -7.039 -4.105 704 HB3 SER 89 HB1 SER 89 -24.164 -6.026 -5.318 705 HG SER 89 HG SER 89 -24.431 -7.801 -6.628 706 H LEU 90 HN LEU 90 -20.224 -7.193 -4.337 707 HA LEU 90 HA LEU 90 -20.362 -4.915 -2.609 708 HB2 LEU 90 HB2 LEU 90 -18.213 -7.046 -2.643 709 HB3 LEU 90 HB1 LEU 90 -18.696 -6.016 -1.305 710 HG LEU 90 HG LEU 90 -20.634 -7.973 -2.503 711 HD11 LEU 90 HD11 LEU 90 -18.718 -8.555 -0.259 712 HD12 LEU 90 HD12 LEU 90 -18.521 -9.140 -1.911 713 HD13 LEU 90 HD13 LEU 90 -19.920 -9.645 -0.954 714 HD21 LEU 90 HD21 LEU 90 -20.345 -6.743 0.235 715 HD22 LEU 90 HD22 LEU 90 -21.609 -7.868 -0.264 716 HD23 LEU 90 HD23 LEU 90 -21.512 -6.266 -0.997 717 H ASP 91 HN ASP 91 -18.183 -6.034 -5.139 718 HA ASP 91 HA ASP 91 -15.923 -4.547 -4.525 719 HB2 ASP 91 HB2 ASP 91 -15.950 -6.390 -6.132 720 HB3 ASP 91 HB1 ASP 91 -16.912 -5.422 -7.242 721 H ARG 92 HN ARG 92 -18.556 -3.687 -6.742 722 HA ARG 92 HA ARG 92 -17.466 -1.412 -7.846 723 HB2 ARG 92 HB2 ARG 92 -19.836 -0.717 -8.261 724 HB3 ARG 92 HB1 ARG 92 -19.451 -2.359 -8.762 725 HG2 ARG 92 HG2 ARG 92 -20.364 -3.040 -6.450 726 HG3 ARG 92 HG1 ARG 92 -21.093 -1.434 -6.438 727 HD2 ARG 92 HD2 ARG 92 -22.612 -3.180 -7.274 728 HD3 ARG 92 HD1 ARG 92 -22.291 -1.920 -8.471 729 HE ARG 92 HE ARG 92 -20.467 -4.068 -8.784 730 HH11 ARG 92 HH11 ARG 92 -23.826 -3.241 -9.326 731 HH12 ARG 92 HH12 ARG 92 -24.012 -4.350 -10.653 732 HH21 ARG 92 HH21 ARG 92 -20.691 -5.471 -10.558 733 HH22 ARG 92 HH22 ARG 92 -22.215 -5.583 -11.385 734 H GLU 93 HN GLU 93 -19.372 -1.624 -4.850 735 HA GLU 93 HA GLU 93 -19.355 1.196 -4.437 736 HB2 GLU 93 HB2 GLU 93 -20.417 -1.205 -3.095 737 HB3 GLU 93 HB1 GLU 93 -20.091 0.170 -2.065 738 HG2 GLU 93 HG2 GLU 93 -21.568 1.562 -3.372 739 HG3 GLU 93 HG1 GLU 93 -21.794 0.265 -4.544 740 H ILE 94 HN ILE 94 -17.799 -1.562 -2.800 741 HA ILE 94 HA ILE 94 -16.422 -0.022 -0.911 742 HB ILE 94 HB ILE 94 -15.004 -1.948 -0.477 743 HG12 ILE 94 HG12 ILE 94 -16.294 -3.193 -2.913 744 HG13 ILE 94 HG11 ILE 94 -14.618 -2.663 -2.801 745 HG21 ILE 94 HG21 ILE 94 -17.217 -1.930 0.483 746 HG22 ILE 94 HG22 ILE 94 -16.763 -3.579 0.057 747 HG23 ILE 94 HG23 ILE 94 -17.887 -2.682 -0.965 748 HD11 ILE 94 HD11 ILE 94 -14.198 -4.329 -1.079 749 HD12 ILE 94 HD12 ILE 94 -14.817 -5.074 -2.552 750 HD13 ILE 94 HD13 ILE 94 -15.880 -4.851 -1.163 751 H GLN 95 HN GLN 95 -15.450 -0.987 -4.195 752 HA GLN 95 HA GLN 95 -12.871 0.204 -3.818 753 HB2 GLN 95 HB2 GLN 95 -14.083 -0.445 -6.470 754 HB3 GLN 95 HB1 GLN 95 -12.428 -0.309 -6.037 755 HG2 GLN 95 HG2 GLN 95 -14.240 -2.487 -5.093 756 HG3 GLN 95 HG1 GLN 95 -13.102 -2.625 -6.430 757 HE21 GLN 95 HE21 GLN 95 -13.209 -4.219 -4.095 758 HE22 GLN 95 HE22 GLN 95 -11.720 -4.000 -3.248 759 H ALA 96 HN ALA 96 -15.983 1.269 -4.822 760 HA ALA 96 HA ALA 96 -15.347 3.360 -6.516 761 HB1 ALA 96 HB1 ALA 96 -17.653 2.733 -6.032 762 HB2 ALA 96 HB2 ALA 96 -17.404 4.460 -5.778 763 HB3 ALA 96 HB3 ALA 96 -17.492 3.369 -4.395 764 H LEU 97 HN LEU 97 -15.677 3.527 -2.958 765 HA LEU 97 HA LEU 97 -14.477 6.128 -2.968 766 HB2 LEU 97 HB2 LEU 97 -14.689 6.192 -0.601 767 HB3 LEU 97 HB1 LEU 97 -16.167 5.608 -1.307 768 HG LEU 97 HG LEU 97 -15.849 4.473 0.698 769 HD11 LEU 97 HD11 LEU 97 -15.010 2.477 -1.336 770 HD12 LEU 97 HD12 LEU 97 -16.655 3.055 -1.091 771 HD13 LEU 97 HD13 LEU 97 -15.830 2.177 0.193 772 HD21 LEU 97 HD21 LEU 97 -13.869 3.186 1.316 773 HD22 LEU 97 HD22 LEU 97 -13.570 4.918 1.161 774 HD23 LEU 97 HD23 LEU 97 -13.059 3.819 -0.117 775 H VAL 98 HN VAL 98 -13.330 2.925 -1.985 776 HA VAL 98 HA VAL 98 -10.766 3.703 -1.153 777 HB VAL 98 HB VAL 98 -11.805 1.098 -2.236 778 HG11 VAL 98 HG11 VAL 98 -9.039 1.570 -1.123 779 HG12 VAL 98 HG12 VAL 98 -9.414 1.269 -2.819 780 HG13 VAL 98 HG13 VAL 98 -9.723 0.018 -1.617 781 HG21 VAL 98 HG21 VAL 98 -12.612 1.689 -0.051 782 HG22 VAL 98 HG22 VAL 98 -10.977 2.050 0.503 783 HG23 VAL 98 HG23 VAL 98 -11.431 0.389 0.116 784 H LYS 99 HN LYS 99 -11.819 2.666 -4.399 785 HA LYS 99 HA LYS 99 -9.153 2.421 -5.374 786 HB2 LYS 99 HB2 LYS 99 -11.353 1.252 -6.216 787 HB3 LYS 99 HB1 LYS 99 -11.526 2.707 -7.190 788 HG2 LYS 99 HG2 LYS 99 -10.464 1.062 -8.534 789 HG3 LYS 99 HG1 LYS 99 -9.249 2.273 -8.122 790 HD2 LYS 99 HD2 LYS 99 -8.252 0.111 -7.865 791 HD3 LYS 99 HD1 LYS 99 -8.507 0.791 -6.257 792 HE2 LYS 99 HE2 LYS 99 -9.170 -1.505 -6.200 793 HE3 LYS 99 HE1 LYS 99 -10.632 -0.508 -6.116 794 HZ1 LYS 99 HZ1 LYS 99 -11.031 -0.899 -8.437 795 HZ2 LYS 99 HZ2 LYS 99 -10.856 -2.390 -7.661 796 HZ3 LYS 99 HZ3 LYS 99 -9.587 -1.766 -8.603 797 H ARG 100 HN ARG 100 -11.623 4.981 -5.538 798 HA ARG 100 HA ARG 100 -9.970 6.488 -7.364 799 HB2 ARG 100 HB2 ARG 100 -12.401 6.748 -7.481 800 HB3 ARG 100 HB1 ARG 100 -12.424 7.372 -5.836 801 HG2 ARG 100 HG2 ARG 100 -12.588 9.177 -7.464 802 HG3 ARG 100 HG1 ARG 100 -11.092 9.298 -6.535 803 HD2 ARG 100 HD2 ARG 100 -10.016 8.010 -8.481 804 HD3 ARG 100 HD1 ARG 100 -11.475 8.410 -9.379 805 HE ARG 100 HE ARG 100 -10.687 10.817 -8.489 806 HH11 ARG 100 HH11 ARG 100 -8.957 8.224 -10.077 807 HH12 ARG 100 HH12 ARG 100 -7.806 9.272 -10.844 808 HH21 ARG 100 HH21 ARG 100 -9.201 12.228 -9.528 809 HH22 ARG 100 HH22 ARG 100 -7.971 11.560 -10.554 810 H ALA 101 HN ALA 101 -10.538 6.414 -3.903 811 HA ALA 101 HA ALA 101 -8.741 8.712 -3.590 812 HB1 ALA 101 HB1 ALA 101 -9.531 8.887 -1.325 813 HB2 ALA 101 HB2 ALA 101 -10.421 7.370 -1.481 814 HB3 ALA 101 HB3 ALA 101 -10.918 8.781 -2.415 815 H SER 102 HN SER 102 -7.086 7.017 -4.379 816 HA SER 102 HA SER 102 -6.062 5.494 -2.111 817 HB2 SER 102 HB2 SER 102 -4.983 5.586 -4.929 818 HB3 SER 102 HB1 SER 102 -4.557 4.431 -3.672 819 HG SER 102 HG SER 102 -7.218 4.437 -3.997 820 HA PRO 103 HA PRO 103 -3.386 9.086 -1.666 821 HB2 PRO 103 HB2 PRO 103 -4.020 9.528 0.910 822 HB3 PRO 103 HB1 PRO 103 -5.140 9.899 -0.407 823 HG2 PRO 103 HG2 PRO 103 -5.317 7.810 1.629 824 HG3 PRO 103 HG1 PRO 103 -6.568 8.394 0.520 825 HD2 PRO 103 HD2 PRO 103 -4.783 6.068 0.260 826 HD3 PRO 103 HD1 PRO 103 -6.294 6.434 -0.605 827 H LEU 104 HN LEU 104 -1.668 9.703 -0.154 828 HA LEU 104 HA LEU 104 -0.656 7.624 1.627 829 HB2 LEU 104 HB2 LEU 104 0.835 8.874 -0.641 830 HB3 LEU 104 HB1 LEU 104 1.708 8.518 0.838 831 HG LEU 104 HG LEU 104 0.226 6.517 -0.871 832 HD11 LEU 104 HD11 LEU 104 2.286 7.303 -1.906 833 HD12 LEU 104 HD12 LEU 104 2.467 5.641 -1.346 834 HD13 LEU 104 HD13 LEU 104 3.177 6.963 -0.421 835 HD21 LEU 104 HD21 LEU 104 0.151 5.942 1.514 836 HD22 LEU 104 HD22 LEU 104 1.906 6.093 1.601 837 HD23 LEU 104 HD23 LEU 104 1.177 4.832 0.607 838 HA PRO 105 HA PRO 105 -0.311 11.357 4.080 839 HB2 PRO 105 HB2 PRO 105 0.148 9.948 6.416 840 HB3 PRO 105 HB1 PRO 105 -1.436 10.426 5.808 841 HG2 PRO 105 HG2 PRO 105 -0.285 7.784 5.983 842 HG3 PRO 105 HG1 PRO 105 -1.925 8.257 5.538 843 HD2 PRO 105 HD2 PRO 105 0.234 7.403 3.821 844 HD3 PRO 105 HD1 PRO 105 -1.471 7.703 3.419 845 H THR 106 HN THR 106 1.777 8.545 4.399 846 HA THR 106 HA THR 106 4.054 10.205 5.148 847 HB THR 106 HB THR 106 3.958 7.201 4.807 848 HG1 THR 106 HG1 THR 106 3.443 8.784 7.138 849 HG21 THR 106 HG21 THR 106 5.775 8.984 6.438 850 HG22 THR 106 HG22 THR 106 6.197 8.224 4.904 851 HG23 THR 106 HG23 THR 106 5.873 7.227 6.323 852 HA PRO 107 HA PRO 107 4.762 10.202 0.665 853 HB2 PRO 107 HB2 PRO 107 6.689 12.121 0.698 854 HB3 PRO 107 HB1 PRO 107 4.960 12.484 0.754 855 HG2 PRO 107 HG2 PRO 107 6.951 12.390 2.980 856 HG3 PRO 107 HG1 PRO 107 5.638 13.548 2.696 857 HD2 PRO 107 HD2 PRO 107 5.445 11.515 4.484 858 HD3 PRO 107 HD1 PRO 107 4.045 12.159 3.604 859 HA PRO 108 HA PRO 108 8.348 7.523 1.332 860 HB2 PRO 108 HB2 PRO 108 7.776 5.715 -0.530 861 HB3 PRO 108 HB1 PRO 108 6.810 5.807 0.951 862 HG2 PRO 108 HG2 PRO 108 6.197 6.886 -1.777 863 HG3 PRO 108 HG1 PRO 108 5.129 6.019 -0.658 864 HD2 PRO 108 HD2 PRO 108 5.194 8.759 -0.935 865 HD3 PRO 108 HD1 PRO 108 4.649 7.917 0.529 866 H ALA 109 HN ALA 109 9.002 9.840 0.211 867 HA ALA 109 HA ALA 109 9.691 9.917 -2.486 868 HB1 ALA 109 HB1 ALA 109 11.348 11.604 -1.855 869 HB2 ALA 109 HB2 ALA 109 11.180 11.142 -0.162 870 HB3 ALA 109 HB3 ALA 109 9.819 11.868 -1.018 871 H ASP 110 HN ASP 110 11.492 8.719 0.288 872 HA ASP 110 HA ASP 110 13.842 7.988 -1.046 873 HB2 ASP 110 HB2 ASP 110 13.658 8.204 1.402 874 HB3 ASP 110 HB1 ASP 110 12.626 6.781 1.447 875 H ALA 111 HN ALA 111 10.741 6.530 -0.982 876 HA ALA 111 HA ALA 111 11.713 3.872 -1.587 877 HB1 ALA 111 HB1 ALA 111 9.407 3.189 -1.496 878 HB2 ALA 111 HB2 ALA 111 8.873 4.875 -1.486 879 HB3 ALA 111 HB3 ALA 111 9.768 4.222 -0.111 880 H TYR 112 HN TYR 112 10.244 6.593 -3.319 881 HA TYR 112 HA TYR 112 10.118 4.830 -5.656 882 HB2 TYR 112 HB2 TYR 112 8.584 6.539 -6.673 883 HB3 TYR 112 HB1 TYR 112 7.979 5.564 -5.356 884 HD1 TYR 112 HD2 TYR 112 9.901 8.784 -5.386 885 HD2 TYR 112 HD1 TYR 112 6.374 6.690 -4.280 886 HE1 TYR 112 HE2 TYR 112 9.072 10.793 -4.234 887 HE2 TYR 112 HE1 TYR 112 5.527 8.670 -3.139 888 HH TYR 112 HH TYR 112 6.426 10.723 -2.110 889 H VAL 113 HN VAL 113 12.317 6.645 -4.546 890 HA VAL 113 HA VAL 113 13.007 8.159 -6.876 891 HB VAL 113 HB VAL 113 15.392 8.012 -5.949 892 HG11 VAL 113 HG11 VAL 113 13.242 9.190 -4.190 893 HG12 VAL 113 HG12 VAL 113 13.922 9.943 -5.631 894 HG13 VAL 113 HG13 VAL 113 14.940 9.668 -4.218 895 HG21 VAL 113 HG21 VAL 113 15.028 5.970 -4.591 896 HG22 VAL 113 HG22 VAL 113 13.963 6.896 -3.533 897 HG23 VAL 113 HG23 VAL 113 15.670 7.316 -3.653 898 H ASN 114 HN ASN 114 12.756 6.981 -8.598 899 HA ASN 114 HA ASN 114 14.359 5.240 -9.845 900 HB2 ASN 114 HB2 ASN 114 13.981 3.034 -9.216 901 HB3 ASN 114 HB1 ASN 114 13.855 3.808 -7.643 902 HD21 ASN 114 HD21 ASN 114 11.776 4.057 -6.699 903 HD22 ASN 114 HD22 ASN 114 10.436 3.111 -7.235 904 H GLY 115 HN GLY 115 11.241 6.272 -8.895 905 HA2 GLY 115 HA2 GLY 115 10.155 6.811 -11.325 906 HA3 GLY 115 HA1 GLY 115 9.764 5.114 -11.074 907 H THR 116 HN THR 116 8.469 4.536 -9.234 908 HA THR 116 HA THR 116 7.132 6.568 -7.707 909 HB THR 116 HB THR 116 4.854 5.531 -8.631 910 HG1 THR 116 HG1 THR 116 5.953 5.759 -11.132 911 HG21 THR 116 HG21 THR 116 6.348 7.762 -10.013 912 HG22 THR 116 HG22 THR 116 5.359 7.918 -8.561 913 HG23 THR 116 HG23 THR 116 4.607 7.483 -10.096 914 H VAL 117 HN VAL 117 5.270 5.431 -6.396 915 HA VAL 117 HA VAL 117 6.277 2.779 -5.644 916 HB VAL 117 HB VAL 117 5.058 3.038 -3.506 917 HG11 VAL 117 HG11 VAL 117 6.554 4.711 -2.503 918 HG12 VAL 117 HG12 VAL 117 7.059 5.188 -4.126 919 HG13 VAL 117 HG13 VAL 117 7.385 3.555 -3.544 920 HG21 VAL 117 HG21 VAL 117 4.334 5.331 -2.821 921 HG22 VAL 117 HG22 VAL 117 3.304 4.564 -4.026 922 HG23 VAL 117 HG23 VAL 117 4.452 5.817 -4.515 923 H GLU 118 HN GLU 118 5.215 1.246 -6.670 924 HA GLU 118 HA GLU 118 2.280 1.332 -6.576 925 HB2 GLU 118 HB2 GLU 118 3.295 0.946 -8.810 926 HB3 GLU 118 HB1 GLU 118 4.103 -0.484 -8.181 927 HG2 GLU 118 HG2 GLU 118 1.923 -1.506 -7.738 928 HG3 GLU 118 HG1 GLU 118 1.130 -0.073 -8.388 929 H LEU 119 HN LEU 119 1.527 0.379 -4.802 930 HA LEU 119 HA LEU 119 2.866 -2.051 -3.877 931 HB2 LEU 119 HB2 LEU 119 3.040 -1.320 -1.643 932 HB3 LEU 119 HB1 LEU 119 3.706 -0.041 -2.632 933 HG LEU 119 HG LEU 119 1.203 0.912 -2.345 934 HD11 LEU 119 HD11 LEU 119 1.733 -0.665 0.159 935 HD12 LEU 119 HD12 LEU 119 0.460 -0.980 -1.021 936 HD13 LEU 119 HD13 LEU 119 0.439 0.509 -0.076 937 HD21 LEU 119 HD21 LEU 119 3.412 1.185 -0.298 938 HD22 LEU 119 HD22 LEU 119 2.066 2.302 -0.523 939 HD23 LEU 119 HD23 LEU 119 3.273 2.108 -1.796 940 H THR 120 HN THR 120 1.568 -3.364 -2.457 941 HA THR 120 HA THR 120 -1.251 -3.179 -3.229 942 HB THR 120 HB THR 120 0.379 -5.524 -2.235 943 HG1 THR 120 HG1 THR 120 0.711 -4.742 -4.451 944 HG21 THR 120 HG21 THR 120 -1.572 -6.892 -2.724 945 HG22 THR 120 HG22 THR 120 -2.482 -5.458 -3.196 946 HG23 THR 120 HG23 THR 120 -1.973 -5.666 -1.519 947 H LEU 121 HN LEU 121 -2.782 -2.785 -1.767 948 HA LEU 121 HA LEU 121 -2.153 -3.248 1.067 949 HB2 LEU 121 HB2 LEU 121 -3.469 -0.840 -0.168 950 HB3 LEU 121 HB1 LEU 121 -3.617 -1.223 1.538 951 HG LEU 121 HG LEU 121 -1.048 -0.649 0.063 952 HD11 LEU 121 HD11 LEU 121 -0.926 1.336 1.474 953 HD12 LEU 121 HD12 LEU 121 -2.517 0.960 2.144 954 HD13 LEU 121 HD13 LEU 121 -2.348 1.362 0.436 955 HD21 LEU 121 HD21 LEU 121 -1.517 -1.258 2.975 956 HD22 LEU 121 HD22 LEU 121 0.023 -0.812 2.236 957 HD23 LEU 121 HD23 LEU 121 -0.761 -2.334 1.797 958 HA PRO 122 HA PRO 122 -5.990 -5.483 0.867 959 HB2 PRO 122 HB2 PRO 122 -5.760 -5.825 3.741 960 HB3 PRO 122 HB1 PRO 122 -5.569 -7.029 2.466 961 HG2 PRO 122 HG2 PRO 122 -3.504 -6.146 4.005 962 HG3 PRO 122 HG1 PRO 122 -3.302 -6.729 2.344 963 HD2 PRO 122 HD2 PRO 122 -3.434 -3.913 3.360 964 HD3 PRO 122 HD1 PRO 122 -2.369 -4.619 2.123 965 H ILE 123 HN ILE 123 -7.867 -4.471 0.757 966 HA ILE 123 HA ILE 123 -8.520 -2.414 2.733 967 HB ILE 123 HB ILE 123 -10.376 -1.805 1.217 968 HG12 ILE 123 HG12 ILE 123 -9.192 -3.834 -0.689 969 HG13 ILE 123 HG11 ILE 123 -10.697 -4.061 0.201 970 HG21 ILE 123 HG21 ILE 123 -8.413 -0.558 0.895 971 HG22 ILE 123 HG22 ILE 123 -8.920 -1.055 -0.729 972 HG23 ILE 123 HG23 ILE 123 -7.599 -1.897 0.086 973 HD11 ILE 123 HD11 ILE 123 -11.610 -2.064 -0.922 974 HD12 ILE 123 HD12 ILE 123 -11.194 -3.371 -2.030 975 HD13 ILE 123 HD13 ILE 123 -10.131 -1.970 -1.880 976 H ASP 124 HN ASP 124 -9.339 -3.393 4.526 977 HA ASP 124 HA ASP 124 -10.888 -5.830 4.144 978 HB2 ASP 124 HB2 ASP 124 -9.939 -4.456 6.662 979 HB3 ASP 124 HB1 ASP 124 -10.870 -5.947 6.639 980 H PHE 125 HN PHE 125 -12.958 -5.620 3.754 981 HA PHE 125 HA PHE 125 -14.522 -4.035 5.675 982 HB2 PHE 125 HB2 PHE 125 -15.349 -5.085 2.950 983 HB3 PHE 125 HB1 PHE 125 -16.395 -4.201 4.056 984 HD1 PHE 125 HD1 PHE 125 -13.511 -3.970 1.789 985 HD2 PHE 125 HD2 PHE 125 -16.237 -1.819 4.248 986 HE1 PHE 125 HE1 PHE 125 -12.768 -1.860 0.763 987 HE2 PHE 125 HE2 PHE 125 -15.500 0.290 3.222 988 HZ PHE 125 HZ PHE 125 -13.764 0.272 1.478 989 H SER 126 HN SER 126 -15.511 -5.279 7.212 990 HA SER 126 HA SER 126 -14.724 -7.941 7.478 991 HB2 SER 126 HB2 SER 126 -17.125 -6.810 8.891 992 HB3 SER 126 HB1 SER 126 -15.903 -7.926 9.503 993 HG SER 126 HG SER 126 -14.575 -6.300 9.903 994 H LEU 127 HN LEU 127 -15.324 -9.449 5.996 995 HA LEU 127 HA LEU 127 -17.943 -9.549 4.842 996 HB2 LEU 127 HB2 LEU 127 -15.411 -10.964 4.517 997 HB3 LEU 127 HB1 LEU 127 -16.795 -12.033 4.390 998 HG LEU 127 HG LEU 127 -16.505 -9.505 2.775 999 HD11 LEU 127 HD11 LEU 127 -14.702 -11.059 2.212 1000 HD12 LEU 127 HD12 LEU 127 -15.874 -10.890 0.899 1001 HD13 LEU 127 HD13 LEU 127 -15.895 -12.328 1.928 1002 HD21 LEU 127 HD21 LEU 127 -18.341 -11.875 2.557 1003 HD22 LEU 127 HD22 LEU 127 -18.205 -10.591 1.356 1004 HD23 LEU 127 HD23 LEU 127 -18.783 -10.221 2.984 1005 H ARG 128 HN ARG 128 -19.683 -10.225 5.847 1006 HA ARG 128 HA ARG 128 -19.425 -12.412 7.784 1007 HB2 ARG 128 HB2 ARG 128 -21.204 -11.101 9.147 1008 HB3 ARG 128 HB1 ARG 128 -19.515 -10.631 9.258 1009 HG2 ARG 128 HG2 ARG 128 -20.262 -8.562 8.896 1010 HG3 ARG 128 HG1 ARG 128 -20.391 -9.054 7.211 1011 HD2 ARG 128 HD2 ARG 128 -22.614 -9.284 9.231 1012 HD3 ARG 128 HD1 ARG 128 -22.421 -7.934 8.119 1013 HE ARG 128 HE ARG 128 -22.943 -10.718 7.281 1014 HH11 ARG 128 HH11 ARG 128 -23.276 -7.253 6.828 1015 HH12 ARG 128 HH12 ARG 128 -24.306 -7.415 5.435 1016 HH21 ARG 128 HH21 ARG 128 -24.299 -10.910 5.432 1017 HH22 ARG 128 HH22 ARG 128 -24.876 -9.475 4.645 1018 H GLY 129 HN GLY 129 -20.464 -12.177 4.979 1019 HA2 GLY 129 HA2 GLY 129 -22.268 -14.073 4.789 1020 HA3 GLY 129 HA1 GLY 129 -23.294 -12.793 5.413 1021 H ALA 130 HN ALA 130 -20.808 -13.151 2.881 1022 HA ALA 130 HA ALA 130 -22.640 -12.649 0.769 1023 HB1 ALA 130 HB1 ALA 130 -22.502 -10.346 1.589 1024 HB2 ALA 130 HB2 ALA 130 -21.759 -10.498 -0.004 1025 HB3 ALA 130 HB3 ALA 130 -20.745 -10.394 1.434 1026 H GLY 131 HN GLY 131 -21.489 -12.520 -1.341 1027 HA2 GLY 131 HA2 GLY 131 -19.615 -12.855 -2.709 1028 HA3 GLY 131 HA1 GLY 131 -18.667 -13.235 -1.280 1029 H PHE 132 HN PHE 132 -21.290 -14.982 -0.780 1030 HA PHE 132 HA PHE 132 -20.062 -17.408 -1.670 1031 HB2 PHE 132 HB2 PHE 132 -22.031 -18.521 -0.628 1032 HB3 PHE 132 HB1 PHE 132 -21.186 -17.437 0.467 1033 HD1 PHE 132 HD1 PHE 132 -22.187 -15.178 0.945 1034 HD2 PHE 132 HD2 PHE 132 -24.305 -18.248 -1.098 1035 HE1 PHE 132 HE1 PHE 132 -24.311 -14.054 1.463 1036 HE2 PHE 132 HE2 PHE 132 -26.432 -17.128 -0.590 1037 HZ PHE 132 HZ PHE 132 -26.438 -15.027 0.693 Start of MODEL 8 1 H1 LYS 2 HT1 LYS 2 0.151 36.087 33.114 2 H2 LYS 2 HT2 LYS 2 0.554 37.596 32.460 3 H3 LYS 2 HT3 LYS 2 0.604 37.361 34.138 4 HA LYS 2 HA LYS 2 2.415 35.841 33.947 5 HB2 LYS 2 HB2 LYS 2 2.049 36.325 30.988 6 HB3 LYS 2 HB1 LYS 2 3.503 35.612 31.668 7 HG2 LYS 2 HG2 LYS 2 2.231 33.744 32.521 8 HG3 LYS 2 HG1 LYS 2 0.731 34.478 31.958 9 HD2 LYS 2 HD2 LYS 2 1.458 32.733 30.426 10 HD3 LYS 2 HD1 LYS 2 1.526 34.309 29.642 11 HE2 LYS 2 HE2 LYS 2 3.994 33.362 30.979 12 HE3 LYS 2 HE1 LYS 2 3.509 32.524 29.508 13 HZ1 LYS 2 HZ1 LYS 2 4.995 34.334 28.995 14 HZ2 LYS 2 HZ2 LYS 2 3.992 35.449 29.779 15 HZ3 LYS 2 HZ3 LYS 2 3.458 34.670 28.366 16 H VAL 3 HN VAL 3 4.357 36.733 34.423 17 HA VAL 3 HA VAL 3 4.862 39.479 33.468 18 HB VAL 3 HB VAL 3 5.884 39.961 35.709 19 HG11 VAL 3 HG11 VAL 3 2.936 39.337 35.664 20 HG12 VAL 3 HG12 VAL 3 3.700 40.838 35.144 21 HG13 VAL 3 HG13 VAL 3 3.739 40.370 36.844 22 HG21 VAL 3 HG21 VAL 3 5.176 38.576 37.619 23 HG22 VAL 3 HG22 VAL 3 6.211 37.691 36.499 24 HG23 VAL 3 HG23 VAL 3 4.470 37.413 36.495 25 H GLN 4 HN GLN 4 5.850 36.922 32.524 26 HA GLN 4 HA GLN 4 8.728 37.323 33.001 27 HB2 GLN 4 HB2 GLN 4 7.715 35.310 34.229 28 HB3 GLN 4 HB1 GLN 4 7.456 34.607 32.639 29 HG2 GLN 4 HG2 GLN 4 9.906 34.844 32.224 30 HG3 GLN 4 HG1 GLN 4 10.084 35.319 33.911 31 HE21 GLN 4 HE21 GLN 4 11.192 33.039 32.507 32 HE22 GLN 4 HE22 GLN 4 10.617 31.625 33.336 33 H GLU 5 HN GLU 5 7.658 38.572 30.977 34 HA GLU 5 HA GLU 5 7.259 36.847 28.677 35 HB2 GLU 5 HB2 GLU 5 7.087 39.854 28.683 36 HB3 GLU 5 HB1 GLU 5 6.290 38.716 27.607 37 HG2 GLU 5 HG2 GLU 5 5.669 39.171 30.516 38 HG3 GLU 5 HG1 GLU 5 4.695 39.674 29.136 39 H GLN 6 HN GLN 6 9.549 36.198 28.616 40 HA GLN 6 HA GLN 6 11.375 38.221 27.582 41 HB2 GLN 6 HB2 GLN 6 12.332 36.666 29.157 42 HB3 GLN 6 HB1 GLN 6 11.760 35.291 28.222 43 HG2 GLN 6 HG2 GLN 6 13.238 36.037 26.359 44 HG3 GLN 6 HG1 GLN 6 13.890 37.266 27.439 45 HE21 GLN 6 HE21 GLN 6 12.964 34.114 28.565 46 HE22 GLN 6 HE22 GLN 6 14.564 33.530 28.878 47 H SER 7 HN SER 7 10.278 34.992 26.560 48 HA SER 7 HA SER 7 10.996 35.661 23.811 49 HB2 SER 7 HB2 SER 7 11.758 33.505 24.799 50 HB3 SER 7 HB1 SER 7 10.071 33.018 24.968 51 HG SER 7 HG SER 7 10.643 32.180 23.058 52 H VAL 8 HN VAL 8 9.515 36.474 22.510 53 HA VAL 8 HA VAL 8 6.682 35.815 23.009 54 HB VAL 8 HB VAL 8 7.797 38.236 21.571 55 HG11 VAL 8 HG11 VAL 8 5.512 39.089 21.684 56 HG12 VAL 8 HG12 VAL 8 4.982 37.586 22.441 57 HG13 VAL 8 HG13 VAL 8 5.584 37.576 20.781 58 HG21 VAL 8 HG21 VAL 8 8.317 38.314 23.957 59 HG22 VAL 8 HG22 VAL 8 6.621 38.022 24.342 60 HG23 VAL 8 HG23 VAL 8 7.098 39.517 23.536 61 H GLY 9 HN GLY 9 8.906 36.686 20.362 62 HA2 GLY 9 HA2 GLY 9 7.086 35.483 18.438 63 HA3 GLY 9 HA1 GLY 9 8.516 36.433 18.070 64 H ALA 10 HN ALA 10 8.793 33.832 20.331 65 HA ALA 10 HA ALA 10 10.014 32.181 18.224 66 HB1 ALA 10 HB1 ALA 10 11.413 31.172 19.962 67 HB2 ALA 10 HB2 ALA 10 10.679 32.234 21.165 68 HB3 ALA 10 HB3 ALA 10 11.656 32.917 19.865 69 HA PRO 11 HA PRO 11 6.453 29.613 19.170 70 HB2 PRO 11 HB2 PRO 11 7.021 27.748 17.252 71 HB3 PRO 11 HB1 PRO 11 6.185 29.268 16.919 72 HG2 PRO 11 HG2 PRO 11 9.061 28.554 16.520 73 HG3 PRO 11 HG1 PRO 11 7.979 29.483 15.465 74 HD2 PRO 11 HD2 PRO 11 9.801 30.669 17.067 75 HD3 PRO 11 HD1 PRO 11 8.238 31.421 16.692 76 HA PRO 12 HA PRO 12 8.817 26.840 21.820 77 HB2 PRO 12 HB2 PRO 12 6.638 25.815 23.100 78 HB3 PRO 12 HB1 PRO 12 7.364 27.370 23.517 79 HG2 PRO 12 HG2 PRO 12 4.957 26.792 21.839 80 HG3 PRO 12 HG1 PRO 12 5.195 28.058 23.058 81 HD2 PRO 12 HD2 PRO 12 5.377 28.550 20.406 82 HD3 PRO 12 HD1 PRO 12 6.358 29.417 21.605 83 HA PRO 13 HA PRO 13 8.413 23.355 19.024 84 HB2 PRO 13 HB2 PRO 13 10.321 22.125 20.918 85 HB3 PRO 13 HB1 PRO 13 10.471 22.378 19.177 86 HG2 PRO 13 HG2 PRO 13 11.875 23.852 20.911 87 HG3 PRO 13 HG1 PRO 13 11.220 24.554 19.421 88 HD2 PRO 13 HD2 PRO 13 10.194 24.765 22.226 89 HD3 PRO 13 HD1 PRO 13 10.290 26.011 20.963 90 H GLY 14 HN GLY 14 6.542 22.294 19.272 91 HA2 GLY 14 HA2 GLY 14 5.918 21.021 21.832 92 HA3 GLY 14 HA1 GLY 14 4.822 21.213 20.468 93 H ARG 15 HN ARG 15 6.022 20.107 18.389 94 HA ARG 15 HA ARG 15 6.743 17.382 19.247 95 HB2 ARG 15 HB2 ARG 15 4.853 18.171 17.030 96 HB3 ARG 15 HB1 ARG 15 5.480 16.546 17.251 97 HG2 ARG 15 HG2 ARG 15 4.438 16.548 19.523 98 HG3 ARG 15 HG1 ARG 15 3.666 18.077 19.094 99 HD2 ARG 15 HD2 ARG 15 2.176 16.175 18.701 100 HD3 ARG 15 HD1 ARG 15 2.572 17.014 17.201 101 HE ARG 15 HE ARG 15 4.182 14.684 17.906 102 HH11 ARG 15 HH11 ARG 15 1.601 16.026 15.942 103 HH12 ARG 15 HH12 ARG 15 1.661 14.737 14.774 104 HH21 ARG 15 HH21 ARG 15 4.269 13.022 16.381 105 HH22 ARG 15 HH22 ARG 15 3.164 13.017 15.032 106 H ALA 16 HN ALA 16 8.837 17.237 18.722 107 HA ALA 16 HA ALA 16 9.798 18.078 16.121 108 HB1 ALA 16 HB1 ALA 16 11.920 17.044 16.817 109 HB2 ALA 16 HB2 ALA 16 11.137 16.445 18.279 110 HB3 ALA 16 HB3 ALA 16 11.323 18.180 18.028 111 H ASP 17 HN ASP 17 9.558 15.035 17.870 112 HA ASP 17 HA ASP 17 9.087 12.903 17.265 113 HB2 ASP 17 HB2 ASP 17 7.091 14.535 15.719 114 HB3 ASP 17 HB1 ASP 17 7.050 12.774 15.701 115 H LYS 18 HN LYS 18 11.244 12.767 16.235 116 HA LYS 18 HA LYS 18 10.856 11.887 13.473 117 HB2 LYS 18 HB2 LYS 18 12.981 12.848 12.766 118 HB3 LYS 18 HB1 LYS 18 11.890 14.102 13.335 119 HG2 LYS 18 HG2 LYS 18 13.097 14.214 15.444 120 HG3 LYS 18 HG1 LYS 18 14.173 12.921 14.908 121 HD2 LYS 18 HD2 LYS 18 14.855 14.354 12.998 122 HD3 LYS 18 HD1 LYS 18 13.875 15.656 13.673 123 HE2 LYS 18 HE2 LYS 18 15.229 15.623 15.707 124 HE3 LYS 18 HE1 LYS 18 16.205 14.315 15.037 125 HZ1 LYS 18 HZ1 LYS 18 15.984 17.085 13.988 126 HZ2 LYS 18 HZ2 LYS 18 16.815 15.830 13.206 127 HZ3 LYS 18 HZ3 LYS 18 17.341 16.377 14.722 128 H THR 19 HN THR 19 11.862 10.026 12.963 129 HA THR 19 HA THR 19 13.152 8.564 15.112 130 HB THR 19 HB THR 19 12.634 7.565 12.310 131 HG1 THR 19 HG1 THR 19 10.780 7.039 14.328 132 HG21 THR 19 HG21 THR 19 12.473 5.389 13.420 133 HG22 THR 19 HG22 THR 19 12.753 6.155 14.983 134 HG23 THR 19 HG23 THR 19 14.028 6.149 13.764 135 H ALA 20 HN ALA 20 14.027 10.406 12.374 136 HA ALA 20 HA ALA 20 16.557 9.089 11.912 137 HB1 ALA 20 HB1 ALA 20 15.309 10.093 10.055 138 HB2 ALA 20 HB2 ALA 20 16.917 10.797 10.222 139 HB3 ALA 20 HB3 ALA 20 15.503 11.685 10.791 140 H ALA 21 HN ALA 21 16.862 9.506 14.388 141 HA ALA 21 HA ALA 21 18.328 12.041 14.668 142 HB1 ALA 21 HB1 ALA 21 17.803 12.064 17.031 143 HB2 ALA 21 HB2 ALA 21 16.942 10.533 16.880 144 HB3 ALA 21 HB3 ALA 21 16.322 11.977 16.080 145 HA PRO 22 HA PRO 22 21.034 8.975 17.078 146 HB2 PRO 22 HB2 PRO 22 19.958 6.281 16.903 147 HB3 PRO 22 HB1 PRO 22 20.292 7.252 18.337 148 HG2 PRO 22 HG2 PRO 22 17.777 6.624 17.534 149 HG3 PRO 22 HG1 PRO 22 18.167 8.117 18.408 150 HD2 PRO 22 HD2 PRO 22 17.735 7.696 15.467 151 HD3 PRO 22 HD1 PRO 22 17.150 9.009 16.513 152 H GLN 23 HN GLN 23 20.018 6.120 15.279 153 HA GLN 23 HA GLN 23 22.459 6.458 13.666 154 HB2 GLN 23 HB2 GLN 23 22.458 3.970 13.466 155 HB3 GLN 23 HB1 GLN 23 22.688 4.562 15.106 156 HG2 GLN 23 HG2 GLN 23 20.414 4.043 15.666 157 HG3 GLN 23 HG1 GLN 23 20.063 3.602 13.997 158 HE21 GLN 23 HE21 GLN 23 21.698 2.684 16.919 159 HE22 GLN 23 HE22 GLN 23 21.932 1.022 16.498 160 H THR 24 HN THR 24 19.043 5.835 13.540 161 HA THR 24 HA THR 24 19.034 5.019 10.789 162 HB THR 24 HB THR 24 16.506 5.472 11.059 163 HG1 THR 24 HG1 THR 24 16.227 6.643 12.844 164 HG21 THR 24 HG21 THR 24 16.189 3.386 12.287 165 HG22 THR 24 HG22 THR 24 17.856 3.454 12.860 166 HG23 THR 24 HG23 THR 24 17.520 3.234 11.142 167 H ARG 25 HN ARG 25 20.456 7.364 10.983 168 HA ARG 25 HA ARG 25 18.677 9.433 9.905 169 HB2 ARG 25 HB2 ARG 25 20.549 10.967 10.191 170 HB3 ARG 25 HB1 ARG 25 20.242 10.105 11.693 171 HG2 ARG 25 HG2 ARG 25 22.116 8.629 11.257 172 HG3 ARG 25 HG1 ARG 25 22.399 9.420 9.707 173 HD2 ARG 25 HD2 ARG 25 23.962 10.283 11.310 174 HD3 ARG 25 HD1 ARG 25 22.797 11.545 10.918 175 HE ARG 25 HE ARG 25 21.728 10.437 13.126 176 HH11 ARG 25 HH11 ARG 25 24.934 11.607 12.397 177 HH12 ARG 25 HH12 ARG 25 25.294 12.041 14.043 178 HH21 ARG 25 HH21 ARG 25 22.170 11.005 15.281 179 HH22 ARG 25 HH22 ARG 25 23.717 11.691 15.690 180 H LEU 26 HN LEU 26 20.911 7.041 8.966 181 HA LEU 26 HA LEU 26 21.211 8.271 6.309 182 HB2 LEU 26 HB2 LEU 26 23.047 6.307 7.683 183 HB3 LEU 26 HB1 LEU 26 23.281 6.961 6.074 184 HG LEU 26 HG LEU 26 23.301 8.583 8.621 185 HD11 LEU 26 HD11 LEU 26 25.583 7.700 6.862 186 HD12 LEU 26 HD12 LEU 26 25.210 7.059 8.462 187 HD13 LEU 26 HD13 LEU 26 25.700 8.744 8.278 188 HD21 LEU 26 HD21 LEU 26 23.981 9.339 5.781 189 HD22 LEU 26 HD22 LEU 26 24.163 10.372 7.199 190 HD23 LEU 26 HD23 LEU 26 22.557 9.862 6.682 191 H THR 27 HN THR 27 19.270 6.306 7.678 192 HA THR 27 HA THR 27 19.703 3.877 6.148 193 HB THR 27 HB THR 27 17.620 3.126 7.403 194 HG1 THR 27 HG1 THR 27 16.866 5.249 7.906 195 HG21 THR 27 HG21 THR 27 20.026 4.016 9.002 196 HG22 THR 27 HG22 THR 27 19.866 2.494 8.124 197 HG23 THR 27 HG23 THR 27 18.837 2.820 9.519 198 HA PRO 28 HA PRO 28 16.746 5.226 3.002 199 HB2 PRO 28 HB2 PRO 28 17.217 2.535 1.929 200 HB3 PRO 28 HB1 PRO 28 17.523 4.101 1.174 201 HG2 PRO 28 HG2 PRO 28 19.516 2.473 1.991 202 HG3 PRO 28 HG1 PRO 28 19.657 4.242 2.019 203 HD2 PRO 28 HD2 PRO 28 19.096 2.347 4.268 204 HD3 PRO 28 HD1 PRO 28 20.118 3.800 4.246 205 H TYR 29 HN TYR 29 14.763 5.146 3.993 206 HA TYR 29 HA TYR 29 13.902 2.619 5.147 207 HB2 TYR 29 HB2 TYR 29 13.703 5.010 6.240 208 HB3 TYR 29 HB1 TYR 29 12.217 5.085 5.293 209 HD1 TYR 29 HD1 TYR 29 14.007 3.074 7.842 210 HD2 TYR 29 HD2 TYR 29 10.260 3.986 6.046 211 HE1 TYR 29 HE1 TYR 29 12.867 1.743 9.565 212 HE2 TYR 29 HE2 TYR 29 9.108 2.661 7.767 213 HH TYR 29 HH TYR 29 9.658 0.758 9.286 214 H ALA 30 HN ALA 30 14.048 2.595 2.398 215 HA ALA 30 HA ALA 30 11.284 2.594 1.485 216 HB1 ALA 30 HB1 ALA 30 12.120 2.010 -0.647 217 HB2 ALA 30 HB2 ALA 30 13.672 1.494 0.019 218 HB3 ALA 30 HB3 ALA 30 13.243 3.206 0.004 219 H GLN 31 HN GLN 31 13.362 0.666 3.196 220 HA GLN 31 HA GLN 31 12.344 -1.909 2.388 221 HB2 GLN 31 HB2 GLN 31 13.731 -2.672 4.383 222 HB3 GLN 31 HB1 GLN 31 14.611 -1.887 3.078 223 HG2 GLN 31 HG2 GLN 31 14.483 0.241 4.388 224 HG3 GLN 31 HG1 GLN 31 13.819 -0.700 5.724 225 HE21 GLN 31 HE21 GLN 31 16.625 -0.046 3.786 226 HE22 GLN 31 HE22 GLN 31 17.782 -0.788 4.852 227 H ALA 32 HN ALA 32 10.119 -0.821 2.851 228 HA ALA 32 HA ALA 32 9.297 -0.726 5.599 229 HB1 ALA 32 HB1 ALA 32 7.073 -0.288 4.713 230 HB2 ALA 32 HB2 ALA 32 7.620 -0.707 3.091 231 HB3 ALA 32 HB3 ALA 32 8.272 0.720 3.900 232 H GLY 33 HN GLY 33 8.472 -2.297 6.805 233 HA2 GLY 33 HA2 GLY 33 7.113 -4.570 5.674 234 HA3 GLY 33 HA1 GLY 33 8.696 -4.972 6.324 235 H GLU 34 HN GLU 34 6.907 -2.411 7.730 236 HA GLU 34 HA GLU 34 6.368 -4.084 10.078 237 HB2 GLU 34 HB2 GLU 34 6.801 -2.145 11.492 238 HB3 GLU 34 HB1 GLU 34 8.196 -2.487 10.482 239 HG2 GLU 34 HG2 GLU 34 6.159 -0.306 10.033 240 HG3 GLU 34 HG1 GLU 34 7.799 -0.098 10.646 241 H ASP 35 HN ASP 35 5.360 -1.396 8.155 242 HA ASP 35 HA ASP 35 3.356 -0.524 7.605 243 HB2 ASP 35 HB2 ASP 35 2.572 -2.726 7.120 244 HB3 ASP 35 HB1 ASP 35 2.303 -3.067 8.827 245 H ASN 36 HN ASN 36 1.939 0.883 8.351 246 HA ASN 36 HA ASN 36 0.856 1.204 10.883 247 HB2 ASN 36 HB2 ASN 36 3.256 1.393 11.614 248 HB3 ASN 36 HB1 ASN 36 3.434 2.772 10.539 249 HD21 ASN 36 HD21 ASN 36 2.173 1.622 13.539 250 HD22 ASN 36 HD22 ASN 36 1.713 3.164 14.176 251 H TRP 37 HN TRP 37 2.200 2.428 7.990 252 HA TRP 37 HA TRP 37 0.958 4.984 8.018 253 HB2 TRP 37 HB2 TRP 37 1.629 4.762 5.460 254 HB3 TRP 37 HB1 TRP 37 2.830 5.074 6.708 255 HD1 TRP 37 HD1 TRP 37 4.332 2.904 7.494 256 HE1 TRP 37 HE1 TRP 37 5.093 0.849 6.144 257 HE3 TRP 37 HE3 TRP 37 1.008 3.215 3.613 258 HZ2 TRP 37 HZ2 TRP 37 4.384 -0.456 3.739 259 HZ3 TRP 37 HZ3 TRP 37 1.128 1.529 1.824 260 HH2 TRP 37 HH2 TRP 37 2.780 -0.269 1.888 261 H ARG 38 HN ARG 38 -0.297 1.911 7.444 262 HA ARG 38 HA ARG 38 -2.154 2.460 5.394 263 HB2 ARG 38 HB2 ARG 38 -3.401 0.554 6.125 264 HB3 ARG 38 HB1 ARG 38 -1.694 0.157 6.297 265 HG2 ARG 38 HG2 ARG 38 -1.781 0.326 8.634 266 HG3 ARG 38 HG1 ARG 38 -3.313 1.198 8.600 267 HD2 ARG 38 HD2 ARG 38 -3.934 -0.926 9.271 268 HD3 ARG 38 HD1 ARG 38 -4.251 -0.952 7.536 269 HE ARG 38 HE ARG 38 -1.619 -1.876 8.109 270 HH11 ARG 38 HH11 ARG 38 -4.986 -2.881 8.154 271 HH12 ARG 38 HH12 ARG 38 -4.608 -4.573 8.062 272 HH21 ARG 38 HH21 ARG 38 -1.132 -4.064 8.015 273 HH22 ARG 38 HH22 ARG 38 -2.402 -5.257 8.025 274 H SER 39 HN SER 39 -2.232 2.924 8.871 275 HA SER 39 HA SER 39 -4.942 3.687 9.067 276 HB2 SER 39 HB2 SER 39 -2.733 4.559 10.935 277 HB3 SER 39 HB1 SER 39 -4.428 4.231 11.316 278 HG SER 39 HG SER 39 -2.587 2.557 11.701 279 H ARG 40 HN ARG 40 -1.975 5.367 8.339 280 HA ARG 40 HA ARG 40 -2.996 7.996 8.525 281 HB2 ARG 40 HB2 ARG 40 -0.741 7.209 6.697 282 HB3 ARG 40 HB1 ARG 40 -0.948 8.644 7.667 283 HG2 ARG 40 HG2 ARG 40 -0.263 5.925 8.720 284 HG3 ARG 40 HG1 ARG 40 0.839 7.290 8.553 285 HD2 ARG 40 HD2 ARG 40 -0.446 8.555 10.179 286 HD3 ARG 40 HD1 ARG 40 -1.612 7.238 10.308 287 HE ARG 40 HE ARG 40 0.850 6.136 10.898 288 HH11 ARG 40 HH11 ARG 40 -1.246 8.597 12.218 289 HH12 ARG 40 HH12 ARG 40 -0.631 8.448 13.833 290 HH21 ARG 40 HH21 ARG 40 1.659 5.899 13.005 291 HH22 ARG 40 HH22 ARG 40 1.047 6.903 14.287 292 H ILE 41 HN ILE 41 -2.511 5.662 5.908 293 HA ILE 41 HA ILE 41 -3.496 7.196 3.779 294 HB ILE 41 HB ILE 41 -3.583 4.199 4.226 295 HG12 ILE 41 HG12 ILE 41 -1.773 5.919 2.519 296 HG13 ILE 41 HG11 ILE 41 -1.340 5.212 4.070 297 HG21 ILE 41 HG21 ILE 41 -5.336 4.770 2.650 298 HG22 ILE 41 HG22 ILE 41 -3.995 3.987 1.809 299 HG23 ILE 41 HG23 ILE 41 -4.198 5.736 1.704 300 HD11 ILE 41 HD11 ILE 41 -2.025 3.690 1.567 301 HD12 ILE 41 HD12 ILE 41 -1.595 2.979 3.123 302 HD13 ILE 41 HD13 ILE 41 -0.410 3.936 2.233 303 H SER 42 HN SER 42 -5.168 4.879 5.920 304 HA SER 42 HA SER 42 -7.738 5.166 4.879 305 HB2 SER 42 HB2 SER 42 -7.001 3.457 6.567 306 HB3 SER 42 HB1 SER 42 -7.049 4.722 7.796 307 HG SER 42 HG SER 42 -9.071 4.184 7.981 308 H GLY 43 HN GLY 43 -5.940 7.246 7.060 309 HA2 GLY 43 HA2 GLY 43 -8.101 8.921 7.831 310 HA3 GLY 43 HA1 GLY 43 -6.395 9.346 7.877 311 H ARG 44 HN ARG 44 -5.708 9.168 5.209 312 HA ARG 44 HA ARG 44 -6.750 11.588 4.163 313 HB2 ARG 44 HB2 ARG 44 -4.846 9.494 3.205 314 HB3 ARG 44 HB1 ARG 44 -5.469 10.663 2.071 315 HG2 ARG 44 HG2 ARG 44 -3.347 11.416 2.866 316 HG3 ARG 44 HG1 ARG 44 -4.601 12.480 3.502 317 HD2 ARG 44 HD2 ARG 44 -4.496 11.405 5.649 318 HD3 ARG 44 HD1 ARG 44 -3.393 10.173 5.023 319 HE ARG 44 HE ARG 44 -1.913 12.280 4.571 320 HH11 ARG 44 HH11 ARG 44 -4.033 11.859 7.337 321 HH12 ARG 44 HH12 ARG 44 -2.976 12.710 8.426 322 HH21 ARG 44 HH21 ARG 44 -0.529 13.396 6.012 323 HH22 ARG 44 HH22 ARG 44 -0.986 13.564 7.683 324 H LEU 45 HN LEU 45 -7.327 8.180 3.562 325 HA LEU 45 HA LEU 45 -8.992 8.343 1.313 326 HB2 LEU 45 HB2 LEU 45 -8.008 6.335 2.749 327 HB3 LEU 45 HB1 LEU 45 -9.573 6.420 3.525 328 HG LEU 45 HG LEU 45 -9.282 6.097 0.550 329 HD11 LEU 45 HD11 LEU 45 -9.522 3.928 2.629 330 HD12 LEU 45 HD12 LEU 45 -8.086 4.274 1.660 331 HD13 LEU 45 HD13 LEU 45 -9.568 3.700 0.881 332 HD21 LEU 45 HD21 LEU 45 -11.522 5.493 2.476 333 HD22 LEU 45 HD22 LEU 45 -11.540 5.142 0.746 334 HD23 LEU 45 HD23 LEU 45 -11.471 6.813 1.308 335 H ASN 46 HN ASN 46 -9.500 8.974 4.654 336 HA ASN 46 HA ASN 46 -12.342 9.080 4.677 337 HB2 ASN 46 HB2 ASN 46 -11.134 8.658 6.736 338 HB3 ASN 46 HB1 ASN 46 -10.258 10.173 6.580 339 HD21 ASN 46 HD21 ASN 46 -10.922 10.984 8.513 340 HD22 ASN 46 HD22 ASN 46 -12.552 11.480 8.829 341 H ARG 47 HN ARG 47 -9.746 11.444 4.469 342 HA ARG 47 HA ARG 47 -11.255 13.762 4.393 343 HB2 ARG 47 HB2 ARG 47 -9.231 14.678 4.207 344 HB3 ARG 47 HB1 ARG 47 -8.620 13.057 4.379 345 HG2 ARG 47 HG2 ARG 47 -8.590 12.854 1.904 346 HG3 ARG 47 HG1 ARG 47 -9.036 14.568 1.813 347 HD2 ARG 47 HD2 ARG 47 -7.034 15.165 3.075 348 HD3 ARG 47 HD1 ARG 47 -6.590 13.465 3.189 349 HE ARG 47 HE ARG 47 -6.899 14.211 0.483 350 HH11 ARG 47 HH11 ARG 47 -4.745 14.617 3.211 351 HH12 ARG 47 HH12 ARG 47 -3.336 14.894 2.222 352 HH21 ARG 47 HH21 ARG 47 -5.039 14.538 -0.822 353 HH22 ARG 47 HH22 ARG 47 -3.499 14.817 -0.066 354 H PHE 48 HN PHE 48 -10.865 11.287 2.018 355 HA PHE 48 HA PHE 48 -11.967 13.056 -0.014 356 HB2 PHE 48 HB2 PHE 48 -10.775 10.307 -0.210 357 HB3 PHE 48 HB1 PHE 48 -11.642 11.054 -1.545 358 HD1 PHE 48 HD1 PHE 48 -10.781 13.352 -2.336 359 HD2 PHE 48 HD2 PHE 48 -8.502 10.657 0.037 360 HE1 PHE 48 HE1 PHE 48 -8.710 14.459 -3.077 361 HE2 PHE 48 HE2 PHE 48 -6.428 11.761 -0.688 362 HZ PHE 48 HZ PHE 48 -6.531 13.664 -2.250 363 H LYS 49 HN LYS 49 -12.553 9.771 1.209 364 HA LYS 49 HA LYS 49 -15.381 10.200 1.442 365 HB2 LYS 49 HB2 LYS 49 -14.280 8.656 -0.877 366 HB3 LYS 49 HB1 LYS 49 -15.737 8.074 -0.096 367 HG2 LYS 49 HG2 LYS 49 -16.839 10.209 -0.549 368 HG3 LYS 49 HG1 LYS 49 -15.379 10.787 -1.354 369 HD2 LYS 49 HD2 LYS 49 -15.583 9.163 -3.077 370 HD3 LYS 49 HD1 LYS 49 -16.837 8.290 -2.196 371 HE2 LYS 49 HE2 LYS 49 -17.824 9.559 -4.003 372 HE3 LYS 49 HE1 LYS 49 -18.337 10.217 -2.453 373 HZ1 LYS 49 HZ1 LYS 49 -16.707 11.980 -2.693 374 HZ2 LYS 49 HZ2 LYS 49 -17.758 11.960 -4.022 375 HZ3 LYS 49 HZ3 LYS 49 -16.191 11.341 -4.176 376 H ARG 50 HN ARG 50 -15.355 9.374 3.498 377 HA ARG 50 HA ARG 50 -14.759 6.500 3.650 378 HB2 ARG 50 HB2 ARG 50 -13.035 8.149 4.762 379 HB3 ARG 50 HB1 ARG 50 -14.252 8.241 6.025 380 HG2 ARG 50 HG2 ARG 50 -12.822 6.580 6.767 381 HG3 ARG 50 HG1 ARG 50 -14.147 5.676 6.031 382 HD2 ARG 50 HD2 ARG 50 -12.854 5.302 4.036 383 HD3 ARG 50 HD1 ARG 50 -11.569 6.354 4.624 384 HE ARG 50 HE ARG 50 -11.418 4.635 6.513 385 HH11 ARG 50 HH11 ARG 50 -12.215 3.855 3.192 386 HH12 ARG 50 HH12 ARG 50 -11.632 2.227 3.308 387 HH21 ARG 50 HH21 ARG 50 -10.647 2.501 6.655 388 HH22 ARG 50 HH22 ARG 50 -10.763 1.444 5.277 389 H TYR 51 HN TYR 51 -16.758 5.747 3.737 390 HA TYR 51 HA TYR 51 -18.814 7.037 5.333 391 HB2 TYR 51 HB2 TYR 51 -18.894 5.737 2.960 392 HB3 TYR 51 HB1 TYR 51 -19.275 4.400 4.044 393 HD1 TYR 51 HD2 TYR 51 -20.272 7.941 3.383 394 HD2 TYR 51 HD1 TYR 51 -21.511 4.059 4.596 395 HE1 TYR 51 HE2 TYR 51 -22.600 8.720 3.463 396 HE2 TYR 51 HE1 TYR 51 -23.846 4.826 4.679 397 HH TYR 51 HH TYR 51 -24.887 7.710 3.296 398 HA PRO 52 HA PRO 52 -18.031 4.676 9.025 399 HB2 PRO 52 HB2 PRO 52 -21.011 4.568 9.167 400 HB3 PRO 52 HB1 PRO 52 -19.846 5.061 10.401 401 HG2 PRO 52 HG2 PRO 52 -21.260 6.879 9.092 402 HG3 PRO 52 HG1 PRO 52 -19.549 7.164 9.460 403 HD2 PRO 52 HD2 PRO 52 -20.830 6.403 6.872 404 HD3 PRO 52 HD1 PRO 52 -19.451 7.477 7.176 405 H LYS 53 HN LYS 53 -17.694 2.559 9.362 406 HA LYS 53 HA LYS 53 -18.272 0.717 7.309 407 HB2 LYS 53 HB2 LYS 53 -17.376 0.126 10.139 408 HB3 LYS 53 HB1 LYS 53 -17.315 -0.996 8.791 409 HG2 LYS 53 HG2 LYS 53 -15.726 1.548 9.082 410 HG3 LYS 53 HG1 LYS 53 -15.122 -0.097 9.259 411 HD2 LYS 53 HD2 LYS 53 -14.455 0.375 7.112 412 HD3 LYS 53 HD1 LYS 53 -16.035 -0.350 6.800 413 HE2 LYS 53 HE2 LYS 53 -15.670 1.739 5.510 414 HE3 LYS 53 HE1 LYS 53 -17.045 1.833 6.616 415 HZ1 LYS 53 HZ1 LYS 53 -15.702 3.833 6.728 416 HZ2 LYS 53 HZ2 LYS 53 -14.328 2.930 7.148 417 HZ3 LYS 53 HZ3 LYS 53 -15.647 3.011 8.206 418 H ASP 54 HN ASP 54 -19.962 1.547 10.222 419 HA ASP 54 HA ASP 54 -21.587 -0.670 10.604 420 HB2 ASP 54 HB2 ASP 54 -22.038 2.268 11.016 421 HB3 ASP 54 HB1 ASP 54 -23.344 1.125 11.300 422 H ALA 55 HN ALA 55 -21.942 1.987 8.313 423 HA ALA 55 HA ALA 55 -24.451 1.135 7.285 424 HB1 ALA 55 HB1 ALA 55 -24.080 2.757 5.526 425 HB2 ALA 55 HB2 ALA 55 -22.383 2.895 5.986 426 HB3 ALA 55 HB3 ALA 55 -23.643 3.447 7.089 427 H LEU 56 HN LEU 56 -21.104 0.568 6.385 428 HA LEU 56 HA LEU 56 -21.634 -0.755 3.936 429 HB2 LEU 56 HB2 LEU 56 -19.262 -0.805 5.806 430 HB3 LEU 56 HB1 LEU 56 -19.298 -1.718 4.309 431 HG LEU 56 HG LEU 56 -18.064 0.269 3.911 432 HD11 LEU 56 HD11 LEU 56 -20.821 0.688 2.783 433 HD12 LEU 56 HD12 LEU 56 -19.600 -0.405 2.127 434 HD13 LEU 56 HD13 LEU 56 -19.309 1.335 2.142 435 HD21 LEU 56 HD21 LEU 56 -20.399 1.786 5.056 436 HD22 LEU 56 HD22 LEU 56 -19.009 2.515 4.251 437 HD23 LEU 56 HD23 LEU 56 -18.788 1.627 5.759 438 H ARG 57 HN ARG 57 -21.237 -1.878 7.261 439 HA ARG 57 HA ARG 57 -21.399 -4.641 6.710 440 HB2 ARG 57 HB2 ARG 57 -22.189 -3.139 9.211 441 HB3 ARG 57 HB1 ARG 57 -21.949 -4.878 9.102 442 HG2 ARG 57 HG2 ARG 57 -19.613 -4.548 8.562 443 HG3 ARG 57 HG1 ARG 57 -19.836 -2.801 8.579 444 HD2 ARG 57 HD2 ARG 57 -20.509 -2.958 10.958 445 HD3 ARG 57 HD1 ARG 57 -20.136 -4.682 10.916 446 HE ARG 57 HE ARG 57 -17.802 -3.867 10.227 447 HH11 ARG 57 HH11 ARG 57 -19.958 -2.107 12.367 448 HH12 ARG 57 HH12 ARG 57 -18.660 -1.311 13.214 449 HH21 ARG 57 HH21 ARG 57 -16.108 -2.844 11.357 450 HH22 ARG 57 HH22 ARG 57 -16.469 -1.759 12.667 451 H LEU 58 HN LEU 58 -23.758 -2.210 6.542 452 HA LEU 58 HA LEU 58 -25.924 -4.203 6.600 453 HB2 LEU 58 HB2 LEU 58 -26.115 -1.192 6.748 454 HB3 LEU 58 HB1 LEU 58 -27.451 -2.319 6.884 455 HG LEU 58 HG LEU 58 -25.170 -2.077 8.848 456 HD11 LEU 58 HD11 LEU 58 -28.048 -1.189 9.032 457 HD12 LEU 58 HD12 LEU 58 -26.639 -0.138 8.898 458 HD13 LEU 58 HD13 LEU 58 -26.864 -1.129 10.338 459 HD21 LEU 58 HD21 LEU 58 -26.532 -3.563 10.244 460 HD22 LEU 58 HD22 LEU 58 -26.050 -4.342 8.738 461 HD23 LEU 58 HD23 LEU 58 -27.692 -3.730 8.926 462 H LYS 59 HN LYS 59 -23.894 -2.913 4.437 463 HA LYS 59 HA LYS 59 -25.926 -2.784 2.329 464 HB2 LYS 59 HB2 LYS 59 -25.443 -0.474 3.094 465 HB3 LYS 59 HB1 LYS 59 -23.755 -0.706 2.675 466 HG2 LYS 59 HG2 LYS 59 -24.506 -1.146 0.320 467 HG3 LYS 59 HG1 LYS 59 -26.115 -0.630 0.827 468 HD2 LYS 59 HD2 LYS 59 -23.586 1.007 0.873 469 HD3 LYS 59 HD1 LYS 59 -24.978 1.235 -0.186 470 HE2 LYS 59 HE2 LYS 59 -24.964 1.555 2.818 471 HE3 LYS 59 HE1 LYS 59 -24.941 2.865 1.641 472 HZ1 LYS 59 HZ1 LYS 59 -27.162 2.566 2.433 473 HZ2 LYS 59 HZ2 LYS 59 -27.136 0.912 2.085 474 HZ3 LYS 59 HZ3 LYS 59 -27.113 2.040 0.821 475 H ARG 60 HN ARG 60 -22.408 -2.147 2.463 476 HA ARG 60 HA ARG 60 -22.058 -4.301 0.498 477 HB2 ARG 60 HB2 ARG 60 -20.681 -1.607 0.452 478 HB3 ARG 60 HB1 ARG 60 -20.387 -2.932 -0.664 479 HG2 ARG 60 HG2 ARG 60 -22.949 -1.384 -0.372 480 HG3 ARG 60 HG1 ARG 60 -21.782 -1.252 -1.689 481 HD2 ARG 60 HD2 ARG 60 -22.214 -3.565 -2.315 482 HD3 ARG 60 HD1 ARG 60 -23.356 -3.724 -0.979 483 HE ARG 60 HE ARG 60 -23.746 -1.880 -3.258 484 HH11 ARG 60 HH11 ARG 60 -25.001 -4.147 -0.886 485 HH12 ARG 60 HH12 ARG 60 -26.647 -3.976 -1.415 486 HH21 ARG 60 HH21 ARG 60 -25.911 -1.691 -3.964 487 HH22 ARG 60 HH22 ARG 60 -27.158 -2.623 -3.189 488 H GLN 61 HN GLN 61 -21.016 -5.793 1.604 489 HA GLN 61 HA GLN 61 -18.653 -4.990 3.160 490 HB2 GLN 61 HB2 GLN 61 -19.011 -7.091 4.450 491 HB3 GLN 61 HB1 GLN 61 -20.294 -5.913 4.647 492 HG2 GLN 61 HG2 GLN 61 -21.263 -7.373 2.586 493 HG3 GLN 61 HG1 GLN 61 -20.357 -8.597 3.475 494 HE21 GLN 61 HE21 GLN 61 -21.864 -5.813 4.940 495 HE22 GLN 61 HE22 GLN 61 -23.076 -6.679 5.817 496 H GLY 62 HN GLY 62 -16.883 -6.598 3.126 497 HA2 GLY 62 HA2 GLY 62 -16.510 -8.761 1.641 498 HA3 GLY 62 HA1 GLY 62 -16.604 -7.531 0.393 499 H VAL 63 HN VAL 63 -14.429 -9.339 1.392 500 HA VAL 63 HA VAL 63 -12.437 -7.276 1.987 501 HB VAL 63 HB VAL 63 -12.298 -9.078 3.557 502 HG11 VAL 63 HG11 VAL 63 -13.493 -10.792 2.338 503 HG12 VAL 63 HG12 VAL 63 -11.935 -11.415 2.884 504 HG13 VAL 63 HG13 VAL 63 -12.159 -10.950 1.195 505 HG21 VAL 63 HG21 VAL 63 -10.103 -9.400 1.507 506 HG22 VAL 63 HG22 VAL 63 -10.024 -9.909 3.195 507 HG23 VAL 63 HG23 VAL 63 -10.155 -8.197 2.796 508 H GLY 64 HN GLY 64 -11.286 -6.520 0.378 509 HA2 GLY 64 HA2 GLY 64 -10.495 -8.362 -1.778 510 HA3 GLY 64 HA1 GLY 64 -11.165 -6.779 -2.175 511 H GLN 65 HN GLN 65 -8.498 -7.812 -2.755 512 HA GLN 65 HA GLN 65 -6.900 -6.039 -1.039 513 HB2 GLN 65 HB2 GLN 65 -6.380 -8.576 -1.424 514 HB3 GLN 65 HB1 GLN 65 -5.750 -8.033 -2.972 515 HG2 GLN 65 HG2 GLN 65 -4.120 -6.659 -1.897 516 HG3 GLN 65 HG1 GLN 65 -4.831 -6.978 -0.314 517 HE21 GLN 65 HE21 GLN 65 -4.551 -9.008 0.634 518 HE22 GLN 65 HE22 GLN 65 -3.323 -10.101 0.108 519 H VAL 66 HN VAL 66 -5.871 -4.279 -1.967 520 HA VAL 66 HA VAL 66 -6.243 -3.990 -4.876 521 HB VAL 66 HB VAL 66 -6.714 -1.591 -4.557 522 HG11 VAL 66 HG11 VAL 66 -8.497 -3.569 -3.172 523 HG12 VAL 66 HG12 VAL 66 -8.683 -2.841 -4.772 524 HG13 VAL 66 HG13 VAL 66 -8.938 -1.864 -3.314 525 HG21 VAL 66 HG21 VAL 66 -6.750 -2.275 -1.635 526 HG22 VAL 66 HG22 VAL 66 -7.239 -0.735 -2.345 527 HG23 VAL 66 HG23 VAL 66 -5.557 -1.265 -2.452 528 H ARG 67 HN ARG 67 -4.465 -3.415 -5.979 529 HA ARG 67 HA ARG 67 -2.234 -2.288 -4.423 530 HB2 ARG 67 HB2 ARG 67 -0.670 -3.445 -5.671 531 HB3 ARG 67 HB1 ARG 67 -1.976 -4.622 -5.619 532 HG2 ARG 67 HG2 ARG 67 -2.490 -4.353 -7.834 533 HG3 ARG 67 HG1 ARG 67 -1.830 -2.716 -7.905 534 HD2 ARG 67 HD2 ARG 67 -0.345 -4.132 -9.108 535 HD3 ARG 67 HD1 ARG 67 0.443 -3.713 -7.588 536 HE ARG 67 HE ARG 67 -1.013 -6.251 -7.765 537 HH11 ARG 67 HH11 ARG 67 2.062 -4.556 -7.670 538 HH12 ARG 67 HH12 ARG 67 2.959 -5.964 -7.195 539 HH21 ARG 67 HH21 ARG 67 0.183 -8.102 -7.174 540 HH22 ARG 67 HH22 ARG 67 1.901 -7.988 -6.931 541 H PHE 68 HN PHE 68 -1.218 -0.468 -5.236 542 HA PHE 68 HA PHE 68 -2.069 0.673 -7.724 543 HB2 PHE 68 HB2 PHE 68 -2.855 2.805 -6.433 544 HB3 PHE 68 HB1 PHE 68 -3.969 1.476 -6.702 545 HD1 PHE 68 HD1 PHE 68 -1.391 2.362 -4.123 546 HD2 PHE 68 HD2 PHE 68 -5.353 1.064 -4.968 547 HE1 PHE 68 HE1 PHE 68 -1.882 2.287 -1.710 548 HE2 PHE 68 HE2 PHE 68 -5.847 0.979 -2.565 549 HZ PHE 68 HZ PHE 68 -4.116 1.593 -0.934 550 H THR 69 HN THR 69 -0.939 2.497 -8.334 551 HA THR 69 HA THR 69 1.547 3.022 -6.861 552 HB THR 69 HB THR 69 0.744 4.054 -9.593 553 HG1 THR 69 HG1 THR 69 2.317 2.281 -10.205 554 HG21 THR 69 HG21 THR 69 3.173 4.346 -9.850 555 HG22 THR 69 HG22 THR 69 3.405 3.771 -8.197 556 HG23 THR 69 HG23 THR 69 2.538 5.278 -8.493 557 H LEU 70 HN LEU 70 1.863 4.899 -5.826 558 HA LEU 70 HA LEU 70 -0.341 6.849 -5.946 559 HB2 LEU 70 HB2 LEU 70 1.346 6.061 -3.578 560 HB3 LEU 70 HB1 LEU 70 0.046 7.239 -3.566 561 HG LEU 70 HG LEU 70 -0.350 4.334 -4.259 562 HD11 LEU 70 HD11 LEU 70 -0.801 5.742 -1.638 563 HD12 LEU 70 HD12 LEU 70 0.455 4.547 -1.978 564 HD13 LEU 70 HD13 LEU 70 -1.249 4.075 -2.013 565 HD21 LEU 70 HD21 LEU 70 -2.710 4.855 -3.882 566 HD22 LEU 70 HD22 LEU 70 -2.033 5.854 -5.169 567 HD23 LEU 70 HD23 LEU 70 -2.294 6.539 -3.564 568 H ASP 71 HN ASP 71 0.121 8.899 -6.239 569 HA ASP 71 HA ASP 71 2.804 9.723 -6.835 570 HB2 ASP 71 HB2 ASP 71 0.683 10.525 -7.992 571 HB3 ASP 71 HB1 ASP 71 0.349 11.459 -6.533 572 H ARG 72 HN ARG 72 3.937 11.467 -5.751 573 HA ARG 72 HA ARG 72 3.990 11.386 -2.965 574 HB2 ARG 72 HB2 ARG 72 5.882 12.275 -4.148 575 HB3 ARG 72 HB1 ARG 72 4.904 13.544 -4.875 576 HG2 ARG 72 HG2 ARG 72 4.539 14.492 -2.613 577 HG3 ARG 72 HG1 ARG 72 5.638 13.276 -1.965 578 HD2 ARG 72 HD2 ARG 72 6.470 15.140 -4.164 579 HD3 ARG 72 HD1 ARG 72 6.572 15.610 -2.469 580 HE ARG 72 HE ARG 72 7.990 13.513 -2.246 581 HH11 ARG 72 HH11 ARG 72 7.787 15.332 -5.227 582 HH12 ARG 72 HH12 ARG 72 9.440 15.023 -5.674 583 HH21 ARG 72 HH21 ARG 72 10.166 13.093 -2.837 584 HH22 ARG 72 HH22 ARG 72 10.783 13.718 -4.335 585 H GLN 73 HN GLN 73 2.111 13.352 -5.170 586 HA GLN 73 HA GLN 73 1.113 15.127 -3.143 587 HB2 GLN 73 HB2 GLN 73 0.101 14.588 -5.941 588 HB3 GLN 73 HB1 GLN 73 -0.391 15.930 -4.916 589 HG2 GLN 73 HG2 GLN 73 1.814 16.867 -4.981 590 HG3 GLN 73 HG1 GLN 73 2.430 15.460 -5.848 591 HE21 GLN 73 HE21 GLN 73 0.521 18.356 -6.067 592 HE22 GLN 73 HE22 GLN 73 0.442 18.416 -7.793 593 H GLY 74 HN GLY 74 0.638 11.972 -3.421 594 HA2 GLY 74 HA2 GLY 74 -0.895 10.570 -2.441 595 HA3 GLY 74 HA1 GLY 74 -1.735 11.991 -1.856 596 H HIS 75 HN HIS 75 -1.026 11.219 -5.194 597 HA HIS 75 HA HIS 75 -3.922 11.062 -5.684 598 HB2 HIS 75 HB2 HIS 75 -2.906 13.043 -6.707 599 HB3 HIS 75 HB1 HIS 75 -1.721 12.032 -7.525 600 HD1 HIS 75 HD1 HIS 75 -5.446 12.751 -7.530 601 HD2 HIS 75 HD2 HIS 75 -2.515 11.050 -9.945 602 HE1 HIS 75 HE1 HIS 75 -6.566 12.281 -9.734 603 HE2 HIS 75 HE2 HIS 75 -4.842 11.015 -11.072 604 H VAL 76 HN VAL 76 -4.610 9.129 -6.186 605 HA VAL 76 HA VAL 76 -3.247 6.855 -6.809 606 HB VAL 76 HB VAL 76 -5.643 6.910 -6.354 607 HG11 VAL 76 HG11 VAL 76 -7.262 7.503 -8.076 608 HG12 VAL 76 HG12 VAL 76 -5.947 8.041 -9.119 609 HG13 VAL 76 HG13 VAL 76 -6.273 8.883 -7.604 610 HG21 VAL 76 HG21 VAL 76 -4.736 4.930 -7.407 611 HG22 VAL 76 HG22 VAL 76 -4.984 5.643 -9.000 612 HG23 VAL 76 HG23 VAL 76 -6.372 5.237 -7.990 613 H LEU 77 HN LEU 77 -2.082 6.126 -8.454 614 HA LEU 77 HA LEU 77 -2.198 7.598 -10.996 615 HB2 LEU 77 HB2 LEU 77 0.100 6.033 -9.828 616 HB3 LEU 77 HB1 LEU 77 0.124 6.905 -11.350 617 HG LEU 77 HG LEU 77 -0.366 8.265 -8.711 618 HD11 LEU 77 HD11 LEU 77 1.804 7.141 -8.663 619 HD12 LEU 77 HD12 LEU 77 1.969 8.898 -8.708 620 HD13 LEU 77 HD13 LEU 77 2.248 7.946 -10.170 621 HD21 LEU 77 HD21 LEU 77 0.298 10.266 -9.956 622 HD22 LEU 77 HD22 LEU 77 -1.101 9.485 -10.692 623 HD23 LEU 77 HD23 LEU 77 0.496 9.294 -11.414 624 H ALA 78 HN ALA 78 -1.772 4.425 -9.549 625 HA ALA 78 HA ALA 78 -2.896 3.192 -11.976 626 HB1 ALA 78 HB1 ALA 78 -0.680 2.018 -10.288 627 HB2 ALA 78 HB2 ALA 78 -0.449 2.781 -11.863 628 HB3 ALA 78 HB3 ALA 78 -1.399 1.301 -11.733 629 H VAL 79 HN VAL 79 -4.116 1.244 -11.545 630 HA VAL 79 HA VAL 79 -4.595 0.566 -8.761 631 HB VAL 79 HB VAL 79 -7.120 0.578 -9.225 632 HG11 VAL 79 HG11 VAL 79 -7.342 2.910 -8.507 633 HG12 VAL 79 HG12 VAL 79 -5.651 3.191 -8.922 634 HG13 VAL 79 HG13 VAL 79 -6.068 2.068 -7.629 635 HG21 VAL 79 HG21 VAL 79 -6.246 2.553 -11.330 636 HG22 VAL 79 HG22 VAL 79 -7.905 2.282 -10.796 637 HG23 VAL 79 HG23 VAL 79 -7.024 0.995 -11.620 638 H THR 80 HN THR 80 -4.652 -1.564 -8.578 639 HA THR 80 HA THR 80 -6.038 -3.129 -10.619 640 HB THR 80 HB THR 80 -3.296 -3.918 -9.608 641 HG1 THR 80 HG1 THR 80 -3.992 -2.214 -11.580 642 HG21 THR 80 HG21 THR 80 -5.072 -5.095 -11.750 643 HG22 THR 80 HG22 THR 80 -4.729 -5.810 -10.173 644 HG23 THR 80 HG23 THR 80 -3.439 -5.634 -11.364 645 H LEU 81 HN LEU 81 -7.381 -4.548 -9.671 646 HA LEU 81 HA LEU 81 -7.388 -4.779 -6.806 647 HB2 LEU 81 HB2 LEU 81 -9.473 -4.739 -8.160 648 HB3 LEU 81 HB1 LEU 81 -9.027 -6.291 -8.846 649 HG LEU 81 HG LEU 81 -9.003 -7.159 -6.433 650 HD11 LEU 81 HD11 LEU 81 -9.000 -5.032 -5.296 651 HD12 LEU 81 HD12 LEU 81 -10.457 -5.936 -4.881 652 HD13 LEU 81 HD13 LEU 81 -10.543 -4.605 -6.034 653 HD21 LEU 81 HD21 LEU 81 -10.720 -7.750 -8.076 654 HD22 LEU 81 HD22 LEU 81 -11.625 -6.296 -7.653 655 HD23 LEU 81 HD23 LEU 81 -11.405 -7.574 -6.459 656 H VAL 82 HN VAL 82 -5.908 -5.982 -5.856 657 HA VAL 82 HA VAL 82 -4.705 -8.275 -7.128 658 HB VAL 82 HB VAL 82 -4.384 -8.176 -4.235 659 HG11 VAL 82 HG11 VAL 82 -2.904 -9.237 -6.052 660 HG12 VAL 82 HG12 VAL 82 -2.106 -8.382 -4.732 661 HG13 VAL 82 HG13 VAL 82 -2.284 -7.600 -6.304 662 HG21 VAL 82 HG21 VAL 82 -3.114 -6.046 -4.197 663 HG22 VAL 82 HG22 VAL 82 -4.847 -5.831 -4.442 664 HG23 VAL 82 HG23 VAL 82 -3.740 -5.687 -5.809 665 H SER 83 HN SER 83 -7.104 -7.641 -4.694 666 HA SER 83 HA SER 83 -9.035 -8.707 -4.206 667 HB2 SER 83 HB2 SER 83 -9.015 -9.442 -6.568 668 HB3 SER 83 HB1 SER 83 -8.161 -10.904 -6.081 669 HG SER 83 HG SER 83 -10.628 -10.843 -6.259 670 H SER 84 HN SER 84 -9.858 -10.879 -3.301 671 HA SER 84 HA SER 84 -7.879 -12.372 -1.823 672 HB2 SER 84 HB2 SER 84 -9.810 -10.540 -0.376 673 HB3 SER 84 HB1 SER 84 -8.753 -11.725 0.396 674 HG SER 84 HG SER 84 -7.149 -10.354 -1.074 675 H ALA 85 HN ALA 85 -11.358 -11.517 -1.916 676 HA ALA 85 HA ALA 85 -11.912 -14.397 -1.714 677 HB1 ALA 85 HB1 ALA 85 -13.615 -12.175 -0.607 678 HB2 ALA 85 HB2 ALA 85 -12.549 -13.221 0.329 679 HB3 ALA 85 HB3 ALA 85 -13.948 -13.904 -0.498 680 H GLY 86 HN GLY 86 -14.055 -11.627 -2.434 681 HA2 GLY 86 HA2 GLY 86 -14.361 -11.946 -5.147 682 HA3 GLY 86 HA1 GLY 86 -15.406 -13.161 -4.421 683 H LEU 87 HN LEU 87 -15.051 -9.895 -5.260 684 HA LEU 87 HA LEU 87 -17.633 -9.268 -3.975 685 HB2 LEU 87 HB2 LEU 87 -15.601 -7.209 -4.793 686 HB3 LEU 87 HB1 LEU 87 -17.043 -6.955 -3.857 687 HG LEU 87 HG LEU 87 -15.288 -6.745 -2.342 688 HD11 LEU 87 HD11 LEU 87 -16.330 -9.547 -2.096 689 HD12 LEU 87 HD12 LEU 87 -17.076 -8.076 -1.467 690 HD13 LEU 87 HD13 LEU 87 -15.533 -8.631 -0.818 691 HD21 LEU 87 HD21 LEU 87 -14.097 -9.308 -3.380 692 HD22 LEU 87 HD22 LEU 87 -13.452 -8.303 -2.083 693 HD23 LEU 87 HD23 LEU 87 -13.511 -7.684 -3.734 694 HA PRO 88 HA PRO 88 -18.505 -8.846 -8.398 695 HB2 PRO 88 HB2 PRO 88 -21.193 -9.530 -8.067 696 HB3 PRO 88 HB1 PRO 88 -19.889 -10.627 -8.520 697 HG2 PRO 88 HG2 PRO 88 -21.378 -10.599 -6.090 698 HG3 PRO 88 HG1 PRO 88 -20.018 -11.646 -6.513 699 HD2 PRO 88 HD2 PRO 88 -20.080 -9.243 -4.814 700 HD3 PRO 88 HD1 PRO 88 -18.901 -10.569 -4.850 701 H SER 89 HN SER 89 -21.542 -8.210 -6.752 702 HA SER 89 HA SER 89 -21.853 -5.661 -7.968 703 HB2 SER 89 HB2 SER 89 -23.819 -5.572 -6.270 704 HB3 SER 89 HB1 SER 89 -23.853 -6.809 -7.530 705 HG SER 89 HG SER 89 -24.324 -7.698 -5.486 706 H LEU 90 HN LEU 90 -20.301 -6.761 -5.163 707 HA LEU 90 HA LEU 90 -20.573 -4.408 -3.554 708 HB2 LEU 90 HB2 LEU 90 -18.433 -6.535 -3.348 709 HB3 LEU 90 HB1 LEU 90 -18.990 -5.453 -2.086 710 HG LEU 90 HG LEU 90 -20.881 -7.431 -3.305 711 HD11 LEU 90 HD11 LEU 90 -19.079 -8.013 -0.964 712 HD12 LEU 90 HD12 LEU 90 -18.733 -8.552 -2.609 713 HD13 LEU 90 HD13 LEU 90 -20.193 -9.115 -1.779 714 HD21 LEU 90 HD21 LEU 90 -21.814 -5.716 -1.863 715 HD22 LEU 90 HD22 LEU 90 -20.649 -6.110 -0.600 716 HD23 LEU 90 HD23 LEU 90 -21.885 -7.284 -1.054 717 H ASP 91 HN ASP 91 -18.391 -5.523 -6.011 718 HA ASP 91 HA ASP 91 -16.027 -4.262 -5.307 719 HB2 ASP 91 HB2 ASP 91 -16.139 -5.951 -7.048 720 HB3 ASP 91 HB1 ASP 91 -17.106 -4.885 -8.060 721 H ARG 92 HN ARG 92 -18.595 -3.071 -7.443 722 HA ARG 92 HA ARG 92 -17.386 -0.758 -8.332 723 HB2 ARG 92 HB2 ARG 92 -19.694 0.116 -8.680 724 HB3 ARG 92 HB1 ARG 92 -19.473 -1.524 -9.278 725 HG2 ARG 92 HG2 ARG 92 -20.572 -2.418 -7.308 726 HG3 ARG 92 HG1 ARG 92 -20.739 -0.793 -6.643 727 HD2 ARG 92 HD2 ARG 92 -22.824 -1.487 -7.610 728 HD3 ARG 92 HD1 ARG 92 -22.138 -0.184 -8.583 729 HE ARG 92 HE ARG 92 -21.489 -2.844 -9.515 730 HH11 ARG 92 HH11 ARG 92 -23.739 -0.167 -9.700 731 HH12 ARG 92 HH12 ARG 92 -24.412 -0.653 -11.227 732 HH21 ARG 92 HH21 ARG 92 -22.357 -3.500 -11.520 733 HH22 ARG 92 HH22 ARG 92 -23.616 -2.559 -12.272 734 H GLU 93 HN GLU 93 -19.301 -1.190 -5.376 735 HA GLU 93 HA GLU 93 -19.202 1.579 -4.712 736 HB2 GLU 93 HB2 GLU 93 -20.438 -0.885 -3.662 737 HB3 GLU 93 HB1 GLU 93 -20.191 0.428 -2.530 738 HG2 GLU 93 HG2 GLU 93 -21.565 1.891 -3.755 739 HG3 GLU 93 HG1 GLU 93 -21.504 0.864 -5.185 740 H ILE 94 HN ILE 94 -17.857 -1.353 -3.152 741 HA ILE 94 HA ILE 94 -16.553 0.055 -1.115 742 HB ILE 94 HB ILE 94 -15.240 -1.944 -0.674 743 HG12 ILE 94 HG12 ILE 94 -16.442 -3.046 -3.225 744 HG13 ILE 94 HG11 ILE 94 -14.753 -2.605 -2.993 745 HG21 ILE 94 HG21 ILE 94 -18.116 -2.542 -1.341 746 HG22 ILE 94 HG22 ILE 94 -17.508 -1.850 0.163 747 HG23 ILE 94 HG23 ILE 94 -17.089 -3.506 -0.280 748 HD11 ILE 94 HD11 ILE 94 -14.519 -4.339 -1.310 749 HD12 ILE 94 HD12 ILE 94 -15.088 -5.008 -2.841 750 HD13 ILE 94 HD13 ILE 94 -16.218 -4.771 -1.507 751 H GLN 95 HN GLN 95 -15.447 -0.782 -4.388 752 HA GLN 95 HA GLN 95 -12.814 0.194 -3.806 753 HB2 GLN 95 HB2 GLN 95 -13.923 -0.234 -6.551 754 HB3 GLN 95 HB1 GLN 95 -12.282 -0.215 -6.041 755 HG2 GLN 95 HG2 GLN 95 -14.251 -2.327 -5.270 756 HG3 GLN 95 HG1 GLN 95 -13.063 -2.476 -6.563 757 HE21 GLN 95 HE21 GLN 95 -13.379 -4.113 -4.232 758 HE22 GLN 95 HE22 GLN 95 -11.907 -4.004 -3.338 759 H ALA 96 HN ALA 96 -15.770 1.470 -5.203 760 HA ALA 96 HA ALA 96 -14.784 3.831 -6.283 761 HB1 ALA 96 HB1 ALA 96 -17.156 3.223 -6.413 762 HB2 ALA 96 HB2 ALA 96 -16.949 4.855 -5.777 763 HB3 ALA 96 HB3 ALA 96 -17.328 3.524 -4.684 764 H LEU 97 HN LEU 97 -15.506 3.002 -2.958 765 HA LEU 97 HA LEU 97 -14.906 5.392 -1.704 766 HB2 LEU 97 HB2 LEU 97 -16.159 3.549 -0.740 767 HB3 LEU 97 HB1 LEU 97 -14.741 2.516 -0.823 768 HG LEU 97 HG LEU 97 -13.936 4.741 0.554 769 HD11 LEU 97 HD11 LEU 97 -15.546 4.838 2.437 770 HD12 LEU 97 HD12 LEU 97 -16.648 3.833 1.491 771 HD13 LEU 97 HD13 LEU 97 -16.208 5.445 0.918 772 HD21 LEU 97 HD21 LEU 97 -14.056 3.054 2.515 773 HD22 LEU 97 HD22 LEU 97 -13.006 2.719 1.137 774 HD23 LEU 97 HD23 LEU 97 -14.581 1.921 1.263 775 H VAL 98 HN VAL 98 -12.923 2.471 -2.165 776 HA VAL 98 HA VAL 98 -10.608 3.730 -0.968 777 HB VAL 98 HB VAL 98 -11.150 0.966 -2.032 778 HG11 VAL 98 HG11 VAL 98 -8.562 1.811 -0.744 779 HG12 VAL 98 HG12 VAL 98 -8.775 1.680 -2.488 780 HG13 VAL 98 HG13 VAL 98 -8.960 0.250 -1.472 781 HG21 VAL 98 HG21 VAL 98 -12.129 1.508 0.126 782 HG22 VAL 98 HG22 VAL 98 -10.556 2.029 0.730 783 HG23 VAL 98 HG23 VAL 98 -10.826 0.335 0.321 784 H LYS 99 HN LYS 99 -11.443 2.424 -4.149 785 HA LYS 99 HA LYS 99 -8.893 2.698 -5.325 786 HB2 LYS 99 HB2 LYS 99 -11.157 1.412 -6.069 787 HB3 LYS 99 HB1 LYS 99 -11.315 2.860 -7.053 788 HG2 LYS 99 HG2 LYS 99 -10.244 1.245 -8.391 789 HG3 LYS 99 HG1 LYS 99 -9.004 2.414 -7.924 790 HD2 LYS 99 HD2 LYS 99 -8.080 0.214 -7.682 791 HD3 LYS 99 HD1 LYS 99 -8.354 0.871 -6.069 792 HE2 LYS 99 HE2 LYS 99 -9.082 -1.411 -6.086 793 HE3 LYS 99 HE1 LYS 99 -10.511 -0.370 -5.994 794 HZ1 LYS 99 HZ1 LYS 99 -9.489 -1.594 -8.506 795 HZ2 LYS 99 HZ2 LYS 99 -10.918 -0.695 -8.319 796 HZ3 LYS 99 HZ3 LYS 99 -10.772 -2.213 -7.586 797 H ARG 100 HN ARG 100 -11.681 4.869 -5.100 798 HA ARG 100 HA ARG 100 -10.544 6.818 -6.883 799 HB2 ARG 100 HB2 ARG 100 -13.000 6.547 -6.415 800 HB3 ARG 100 HB1 ARG 100 -12.714 7.196 -4.811 801 HG2 ARG 100 HG2 ARG 100 -12.049 8.716 -7.312 802 HG3 ARG 100 HG1 ARG 100 -13.633 8.784 -6.547 803 HD2 ARG 100 HD2 ARG 100 -12.508 9.538 -4.452 804 HD3 ARG 100 HD1 ARG 100 -10.991 9.610 -5.351 805 HE ARG 100 HE ARG 100 -13.341 11.203 -6.158 806 HH11 ARG 100 HH11 ARG 100 -9.954 10.987 -5.262 807 HH12 ARG 100 HH12 ARG 100 -9.615 12.644 -5.666 808 HH21 ARG 100 HH21 ARG 100 -12.886 13.363 -6.710 809 HH22 ARG 100 HH22 ARG 100 -11.283 13.995 -6.492 810 H ALA 101 HN ALA 101 -10.896 6.502 -3.376 811 HA ALA 101 HA ALA 101 -9.193 8.832 -2.965 812 HB1 ALA 101 HB1 ALA 101 -9.815 8.669 -0.629 813 HB2 ALA 101 HB2 ALA 101 -10.633 7.131 -0.932 814 HB3 ALA 101 HB3 ALA 101 -11.258 8.619 -1.647 815 H SER 102 HN SER 102 -7.583 7.090 -4.098 816 HA SER 102 HA SER 102 -6.186 5.684 -1.961 817 HB2 SER 102 HB2 SER 102 -5.551 5.749 -4.909 818 HB3 SER 102 HB1 SER 102 -4.801 4.705 -3.708 819 HG SER 102 HG SER 102 -7.496 4.478 -3.630 820 HA PRO 103 HA PRO 103 -3.624 9.375 -1.858 821 HB2 PRO 103 HB2 PRO 103 -3.774 9.662 0.817 822 HB3 PRO 103 HB1 PRO 103 -5.119 10.080 -0.251 823 HG2 PRO 103 HG2 PRO 103 -4.894 7.882 1.658 824 HG3 PRO 103 HG1 PRO 103 -6.333 8.498 0.832 825 HD2 PRO 103 HD2 PRO 103 -4.621 6.218 0.135 826 HD3 PRO 103 HD1 PRO 103 -6.252 6.619 -0.445 827 H LEU 104 HN LEU 104 -1.710 9.966 -0.440 828 HA LEU 104 HA LEU 104 -0.178 7.683 0.552 829 HB2 LEU 104 HB2 LEU 104 0.416 8.021 -1.841 830 HB3 LEU 104 HB1 LEU 104 0.866 9.673 -1.477 831 HG LEU 104 HG LEU 104 2.636 8.758 0.066 832 HD11 LEU 104 HD11 LEU 104 3.339 6.405 -0.371 833 HD12 LEU 104 HD12 LEU 104 1.825 6.164 -1.245 834 HD13 LEU 104 HD13 LEU 104 1.795 6.544 0.477 835 HD21 LEU 104 HD21 LEU 104 4.167 8.228 -1.752 836 HD22 LEU 104 HD22 LEU 104 3.124 9.582 -2.185 837 HD23 LEU 104 HD23 LEU 104 2.804 7.977 -2.842 838 HA PRO 105 HA PRO 105 -0.121 11.301 3.328 839 HB2 PRO 105 HB2 PRO 105 0.287 9.787 5.609 840 HB3 PRO 105 HB1 PRO 105 -1.278 10.291 4.976 841 HG2 PRO 105 HG2 PRO 105 -0.029 7.651 4.959 842 HG3 PRO 105 HG1 PRO 105 -1.719 8.101 4.716 843 HD2 PRO 105 HD2 PRO 105 0.115 7.303 2.729 844 HD3 PRO 105 HD1 PRO 105 -1.516 7.955 2.488 845 H THR 106 HN THR 106 2.029 8.540 4.021 846 HA THR 106 HA THR 106 4.190 10.383 4.653 847 HB THR 106 HB THR 106 5.432 8.239 5.190 848 HG1 THR 106 HG1 THR 106 4.126 6.831 3.929 849 HG21 THR 106 HG21 THR 106 4.214 7.846 7.288 850 HG22 THR 106 HG22 THR 106 2.836 8.745 6.651 851 HG23 THR 106 HG23 THR 106 4.369 9.567 6.942 852 HA PRO 107 HA PRO 107 5.245 9.951 0.292 853 HB2 PRO 107 HB2 PRO 107 7.192 11.860 0.301 854 HB3 PRO 107 HB1 PRO 107 5.468 12.229 0.184 855 HG2 PRO 107 HG2 PRO 107 7.273 12.331 2.563 856 HG3 PRO 107 HG1 PRO 107 5.994 13.459 2.078 857 HD2 PRO 107 HD2 PRO 107 5.656 11.598 4.015 858 HD3 PRO 107 HD1 PRO 107 4.331 12.150 2.973 859 HA PRO 108 HA PRO 108 8.852 7.386 1.289 860 HB2 PRO 108 HB2 PRO 108 8.236 5.335 -0.275 861 HB3 PRO 108 HB1 PRO 108 7.276 5.644 1.181 862 HG2 PRO 108 HG2 PRO 108 6.664 6.320 -1.671 863 HG3 PRO 108 HG1 PRO 108 5.591 5.633 -0.439 864 HD2 PRO 108 HD2 PRO 108 5.714 8.318 -1.114 865 HD3 PRO 108 HD1 PRO 108 5.101 7.694 0.430 866 H ALA 109 HN ALA 109 9.522 9.508 -0.059 867 HA ALA 109 HA ALA 109 9.978 9.353 -2.809 868 HB1 ALA 109 HB1 ALA 109 10.191 11.422 -1.511 869 HB2 ALA 109 HB2 ALA 109 11.633 11.108 -2.475 870 HB3 ALA 109 HB3 ALA 109 11.644 10.785 -0.740 871 H ASP 110 HN ASP 110 11.909 8.317 -0.076 872 HA ASP 110 HA ASP 110 14.219 7.535 -1.438 873 HB2 ASP 110 HB2 ASP 110 14.139 7.818 0.982 874 HB3 ASP 110 HB1 ASP 110 13.005 6.481 1.125 875 H ALA 111 HN ALA 111 11.126 6.037 -1.203 876 HA ALA 111 HA ALA 111 12.093 3.381 -1.819 877 HB1 ALA 111 HB1 ALA 111 10.285 3.582 -0.256 878 HB2 ALA 111 HB2 ALA 111 9.709 2.758 -1.704 879 HB3 ALA 111 HB3 ALA 111 9.305 4.458 -1.437 880 H TYR 112 HN TYR 112 10.699 6.088 -3.552 881 HA TYR 112 HA TYR 112 10.354 4.285 -5.836 882 HB2 TYR 112 HB2 TYR 112 8.591 5.791 -6.689 883 HB3 TYR 112 HB1 TYR 112 8.216 4.945 -5.207 884 HD1 TYR 112 HD2 TYR 112 10.027 8.180 -5.767 885 HD2 TYR 112 HD1 TYR 112 6.682 6.164 -4.101 886 HE1 TYR 112 HE2 TYR 112 9.282 10.278 -4.728 887 HE2 TYR 112 HE1 TYR 112 5.917 8.230 -3.071 888 HH TYR 112 HH TYR 112 6.803 10.377 -2.361 889 H VAL 113 HN VAL 113 12.553 6.196 -4.933 890 HA VAL 113 HA VAL 113 12.886 7.893 -7.211 891 HB VAL 113 HB VAL 113 15.381 7.814 -6.541 892 HG11 VAL 113 HG11 VAL 113 13.343 8.837 -4.566 893 HG12 VAL 113 HG12 VAL 113 13.886 9.676 -6.021 894 HG13 VAL 113 HG13 VAL 113 15.016 9.378 -4.701 895 HG21 VAL 113 HG21 VAL 113 15.194 5.702 -5.239 896 HG22 VAL 113 HG22 VAL 113 14.227 6.568 -4.045 897 HG23 VAL 113 HG23 VAL 113 15.903 7.033 -4.324 898 H ASN 114 HN ASN 114 12.519 6.788 -8.984 899 HA ASN 114 HA ASN 114 14.019 5.314 -10.560 900 HB2 ASN 114 HB2 ASN 114 13.504 2.897 -10.120 901 HB3 ASN 114 HB1 ASN 114 14.590 3.616 -8.949 902 HD21 ASN 114 HD21 ASN 114 11.069 4.071 -8.867 903 HD22 ASN 114 HD22 ASN 114 10.832 3.139 -7.432 904 H GLY 115 HN GLY 115 11.052 6.042 -9.174 905 HA2 GLY 115 HA2 GLY 115 9.563 6.193 -11.482 906 HA3 GLY 115 HA1 GLY 115 9.311 4.561 -10.879 907 H THR 116 HN THR 116 8.017 4.227 -9.135 908 HA THR 116 HA THR 116 7.081 6.319 -7.434 909 HB THR 116 HB THR 116 4.735 5.138 -8.733 910 HG1 THR 116 HG1 THR 116 5.851 7.191 -10.271 911 HG21 THR 116 HG21 THR 116 3.953 7.448 -8.617 912 HG22 THR 116 HG22 THR 116 5.575 7.983 -8.179 913 HG23 THR 116 HG23 THR 116 4.660 6.947 -7.083 914 H VAL 117 HN VAL 117 5.049 5.238 -6.101 915 HA VAL 117 HA VAL 117 6.109 2.587 -5.411 916 HB VAL 117 HB VAL 117 4.804 2.810 -3.275 917 HG11 VAL 117 HG11 VAL 117 6.354 4.441 -2.227 918 HG12 VAL 117 HG12 VAL 117 6.953 4.828 -3.844 919 HG13 VAL 117 HG13 VAL 117 7.141 3.195 -3.199 920 HG21 VAL 117 HG21 VAL 117 3.148 4.444 -3.851 921 HG22 VAL 117 HG22 VAL 117 4.392 5.641 -4.228 922 HG23 VAL 117 HG23 VAL 117 4.156 5.104 -2.563 923 H GLU 118 HN GLU 118 5.095 1.082 -6.491 924 HA GLU 118 HA GLU 118 2.168 1.047 -6.494 925 HB2 GLU 118 HB2 GLU 118 3.463 0.466 -8.584 926 HB3 GLU 118 HB1 GLU 118 4.091 -0.936 -7.728 927 HG2 GLU 118 HG2 GLU 118 1.657 -1.580 -7.353 928 HG3 GLU 118 HG1 GLU 118 1.278 -0.369 -8.579 929 H LEU 119 HN LEU 119 1.304 0.199 -4.702 930 HA LEU 119 HA LEU 119 2.718 -2.034 -3.442 931 HB2 LEU 119 HB2 LEU 119 2.506 -1.065 -1.256 932 HB3 LEU 119 HB1 LEU 119 3.365 0.044 -2.304 933 HG LEU 119 HG LEU 119 0.763 0.923 -2.524 934 HD11 LEU 119 HD11 LEU 119 1.241 0.030 0.295 935 HD12 LEU 119 HD12 LEU 119 0.008 -0.574 -0.811 936 HD13 LEU 119 HD13 LEU 119 -0.060 1.095 -0.241 937 HD21 LEU 119 HD21 LEU 119 2.855 1.821 -0.547 938 HD22 LEU 119 HD22 LEU 119 1.492 2.778 -1.125 939 HD23 LEU 119 HD23 LEU 119 2.772 2.301 -2.241 940 H THR 120 HN THR 120 1.443 -3.346 -2.095 941 HA THR 120 HA THR 120 -1.351 -3.376 -2.972 942 HB THR 120 HB THR 120 0.442 -5.581 -1.949 943 HG1 THR 120 HG1 THR 120 0.792 -5.872 -4.009 944 HG21 THR 120 HG21 THR 120 -1.423 -7.094 -2.355 945 HG22 THR 120 HG22 THR 120 -2.450 -5.728 -2.784 946 HG23 THR 120 HG23 THR 120 -1.844 -5.892 -1.135 947 H LEU 121 HN LEU 121 -2.931 -3.026 -1.588 948 HA LEU 121 HA LEU 121 -2.484 -3.506 1.278 949 HB2 LEU 121 HB2 LEU 121 -3.867 -1.105 0.064 950 HB3 LEU 121 HB1 LEU 121 -3.837 -1.485 1.776 951 HG LEU 121 HG LEU 121 -1.417 -0.824 0.092 952 HD11 LEU 121 HD11 LEU 121 -1.358 1.263 1.242 953 HD12 LEU 121 HD12 LEU 121 -2.756 0.818 2.228 954 HD13 LEU 121 HD13 LEU 121 -2.941 1.073 0.494 955 HD21 LEU 121 HD21 LEU 121 -1.695 -1.299 3.061 956 HD22 LEU 121 HD22 LEU 121 -0.230 -0.778 2.226 957 HD23 LEU 121 HD23 LEU 121 -0.909 -2.376 1.905 958 HA PRO 122 HA PRO 122 -6.333 -5.627 0.470 959 HB2 PRO 122 HB2 PRO 122 -6.337 -6.585 3.178 960 HB3 PRO 122 HB1 PRO 122 -5.934 -7.472 1.706 961 HG2 PRO 122 HG2 PRO 122 -4.126 -6.821 3.691 962 HG3 PRO 122 HG1 PRO 122 -3.695 -7.199 2.015 963 HD2 PRO 122 HD2 PRO 122 -3.944 -4.540 3.357 964 HD3 PRO 122 HD1 PRO 122 -2.785 -5.081 2.122 965 H ILE 123 HN ILE 123 -8.161 -4.513 0.452 966 HA ILE 123 HA ILE 123 -8.905 -2.900 2.773 967 HB ILE 123 HB ILE 123 -10.601 -1.866 1.356 968 HG12 ILE 123 HG12 ILE 123 -9.612 -3.626 -0.892 969 HG13 ILE 123 HG11 ILE 123 -11.135 -3.860 -0.039 970 HG21 ILE 123 HG21 ILE 123 -7.837 -2.018 0.208 971 HG22 ILE 123 HG22 ILE 123 -8.554 -0.745 1.201 972 HG23 ILE 123 HG23 ILE 123 -9.073 -0.962 -0.478 973 HD11 ILE 123 HD11 ILE 123 -11.526 -2.736 -2.124 974 HD12 ILE 123 HD12 ILE 123 -10.358 -1.482 -1.701 975 HD13 ILE 123 HD13 ILE 123 -11.860 -1.636 -0.785 976 H ASP 124 HN ASP 124 -9.779 -4.287 4.264 977 HA ASP 124 HA ASP 124 -11.727 -6.200 3.211 978 HB2 ASP 124 HB2 ASP 124 -11.306 -7.632 5.052 979 HB3 ASP 124 HB1 ASP 124 -9.739 -7.106 4.456 980 H PHE 125 HN PHE 125 -13.721 -5.798 3.460 981 HA PHE 125 HA PHE 125 -14.676 -4.592 5.969 982 HB2 PHE 125 HB2 PHE 125 -16.138 -4.981 3.337 983 HB3 PHE 125 HB1 PHE 125 -16.789 -4.184 4.760 984 HD1 PHE 125 HD2 PHE 125 -15.916 -1.968 5.422 985 HD2 PHE 125 HD1 PHE 125 -14.691 -3.892 1.831 986 HE1 PHE 125 HE2 PHE 125 -15.050 0.173 4.574 987 HE2 PHE 125 HE1 PHE 125 -13.814 -1.756 0.980 988 HZ PHE 125 HZ PHE 125 -13.995 0.280 2.351 989 H SER 126 HN SER 126 -16.179 -5.883 7.180 990 HA SER 126 HA SER 126 -15.505 -8.587 7.194 991 HB2 SER 126 HB2 SER 126 -17.975 -7.332 8.408 992 HB3 SER 126 HB1 SER 126 -17.194 -8.830 8.921 993 HG SER 126 HG SER 126 -15.253 -7.225 9.071 994 H LEU 127 HN LEU 127 -15.889 -9.872 5.506 995 HA LEU 127 HA LEU 127 -18.320 -9.623 3.943 996 HB2 LEU 127 HB2 LEU 127 -15.758 -10.229 3.280 997 HB3 LEU 127 HB1 LEU 127 -16.443 -11.837 3.390 998 HG LEU 127 HG LEU 127 -17.545 -9.632 1.644 999 HD11 LEU 127 HD11 LEU 127 -16.558 -10.776 -0.221 1000 HD12 LEU 127 HD12 LEU 127 -15.883 -12.008 0.850 1001 HD13 LEU 127 HD13 LEU 127 -15.308 -10.343 0.945 1002 HD21 LEU 127 HD21 LEU 127 -18.143 -12.579 1.633 1003 HD22 LEU 127 HD22 LEU 127 -18.845 -11.344 0.582 1004 HD23 LEU 127 HD23 LEU 127 -19.190 -11.331 2.315 1005 H ARG 128 HN ARG 128 -19.520 -10.262 5.962 1006 HA ARG 128 HA ARG 128 -19.651 -13.163 6.278 1007 HB2 ARG 128 HB2 ARG 128 -21.383 -12.422 8.108 1008 HB3 ARG 128 HB1 ARG 128 -19.659 -12.305 8.411 1009 HG2 ARG 128 HG2 ARG 128 -20.646 -10.314 9.212 1010 HG3 ARG 128 HG1 ARG 128 -19.789 -9.899 7.728 1011 HD2 ARG 128 HD2 ARG 128 -21.914 -8.788 7.734 1012 HD3 ARG 128 HD1 ARG 128 -21.938 -10.054 6.506 1013 HE ARG 128 HE ARG 128 -22.999 -10.836 9.078 1014 HH11 ARG 128 HH11 ARG 128 -23.715 -9.535 5.902 1015 HH12 ARG 128 HH12 ARG 128 -25.409 -9.912 6.003 1016 HH21 ARG 128 HH21 ARG 128 -25.216 -11.340 9.204 1017 HH22 ARG 128 HH22 ARG 128 -26.266 -10.938 7.866 1018 H GLY 129 HN GLY 129 -20.556 -11.680 3.910 1019 HA2 GLY 129 HA2 GLY 129 -22.696 -13.141 3.102 1020 HA3 GLY 129 HA1 GLY 129 -23.429 -11.768 3.923 1021 H ALA 130 HN ALA 130 -24.134 -11.894 1.436 1022 HA ALA 130 HA ALA 130 -24.401 -10.533 -0.358 1023 HB1 ALA 130 HB1 ALA 130 -23.822 -8.651 1.074 1024 HB2 ALA 130 HB2 ALA 130 -23.191 -8.432 -0.560 1025 HB3 ALA 130 HB3 ALA 130 -22.110 -8.919 0.745 1026 H GLY 131 HN GLY 131 -20.927 -11.078 0.275 1027 HA2 GLY 131 HA2 GLY 131 -20.235 -11.151 -2.491 1028 HA3 GLY 131 HA1 GLY 131 -19.230 -11.703 -1.157 1029 H PHE 132 HN PHE 132 -21.437 -13.513 -0.267 1030 HA PHE 132 HA PHE 132 -21.425 -15.472 -2.429 1031 HB2 PHE 132 HB2 PHE 132 -20.943 -17.288 -0.778 1032 HB3 PHE 132 HB1 PHE 132 -19.597 -16.188 -1.032 1033 HD1 PHE 132 HD2 PHE 132 -19.089 -14.463 0.718 1034 HD2 PHE 132 HD1 PHE 132 -21.878 -17.612 1.356 1035 HE1 PHE 132 HE2 PHE 132 -18.928 -14.106 3.146 1036 HE2 PHE 132 HE1 PHE 132 -21.722 -17.261 3.786 1037 HZ PHE 132 HZ PHE 132 -20.248 -15.505 4.685 Start of MODEL 9 1 H1 LYS 2 HT1 LYS 2 27.244 30.921 12.652 2 H2 LYS 2 HT2 LYS 2 27.797 29.321 12.753 3 H3 LYS 2 HT3 LYS 2 26.632 29.745 11.592 4 HA LYS 2 HA LYS 2 28.224 31.171 10.481 5 HB2 LYS 2 HB2 LYS 2 30.156 30.037 12.517 6 HB3 LYS 2 HB1 LYS 2 30.597 31.040 11.142 7 HG2 LYS 2 HG2 LYS 2 29.415 32.917 12.066 8 HG3 LYS 2 HG1 LYS 2 28.802 31.924 13.391 9 HD2 LYS 2 HD2 LYS 2 31.120 31.544 14.140 10 HD3 LYS 2 HD1 LYS 2 31.691 32.600 12.847 11 HE2 LYS 2 HE2 LYS 2 31.552 33.742 15.033 12 HE3 LYS 2 HE1 LYS 2 30.525 34.480 13.804 13 HZ1 LYS 2 HZ1 LYS 2 28.616 33.712 14.809 14 HZ2 LYS 2 HZ2 LYS 2 29.589 34.051 16.160 15 HZ3 LYS 2 HZ3 LYS 2 29.408 32.453 15.626 16 H VAL 3 HN VAL 3 28.547 30.199 8.624 17 HA VAL 3 HA VAL 3 29.286 28.763 7.032 18 HB VAL 3 HB VAL 3 30.574 27.228 9.296 19 HG11 VAL 3 HG11 VAL 3 31.959 26.209 7.540 20 HG12 VAL 3 HG12 VAL 3 30.986 27.023 6.313 21 HG13 VAL 3 HG13 VAL 3 30.252 25.805 7.358 22 HG21 VAL 3 HG21 VAL 3 32.644 28.321 8.555 23 HG22 VAL 3 HG22 VAL 3 31.444 29.491 9.104 24 HG23 VAL 3 HG23 VAL 3 31.723 29.257 7.378 25 H GLN 4 HN GLN 4 28.086 27.069 9.902 26 HA GLN 4 HA GLN 4 27.407 24.666 8.632 27 HB2 GLN 4 HB2 GLN 4 26.059 24.199 10.641 28 HB3 GLN 4 HB1 GLN 4 27.664 24.801 11.032 29 HG2 GLN 4 HG2 GLN 4 26.699 27.036 11.412 30 HG3 GLN 4 HG1 GLN 4 25.096 26.374 11.094 31 HE21 GLN 4 HE21 GLN 4 24.152 25.003 12.597 32 HE22 GLN 4 HE22 GLN 4 24.736 24.867 14.222 33 H GLU 5 HN GLU 5 25.691 27.688 8.719 34 HA GLU 5 HA GLU 5 23.076 26.698 8.259 35 HB2 GLU 5 HB2 GLU 5 24.204 29.348 7.336 36 HB3 GLU 5 HB1 GLU 5 22.509 28.949 7.550 37 HG2 GLU 5 HG2 GLU 5 23.078 30.254 9.400 38 HG3 GLU 5 HG1 GLU 5 23.049 28.598 10.001 39 H GLN 6 HN GLN 6 25.781 27.442 6.196 40 HA GLN 6 HA GLN 6 24.274 27.151 3.756 41 HB2 GLN 6 HB2 GLN 6 27.214 27.539 4.324 42 HB3 GLN 6 HB1 GLN 6 26.588 27.302 2.700 43 HG2 GLN 6 HG2 GLN 6 26.865 29.625 3.009 44 HG3 GLN 6 HG1 GLN 6 25.136 29.301 3.053 45 HE21 GLN 6 HE21 GLN 6 27.381 28.687 5.688 46 HE22 GLN 6 HE22 GLN 6 26.728 29.876 6.763 47 H SER 7 HN SER 7 26.042 25.145 5.895 48 HA SER 7 HA SER 7 26.475 23.032 3.964 49 HB2 SER 7 HB2 SER 7 26.860 22.984 6.964 50 HB3 SER 7 HB1 SER 7 27.553 21.867 5.787 51 HG SER 7 HG SER 7 29.090 23.251 5.393 52 H VAL 8 HN VAL 8 24.058 23.111 3.551 53 HA VAL 8 HA VAL 8 22.245 22.094 5.489 54 HB VAL 8 HB VAL 8 21.934 22.103 2.481 55 HG11 VAL 8 HG11 VAL 8 20.311 20.679 3.597 56 HG12 VAL 8 HG12 VAL 8 19.528 22.127 2.966 57 HG13 VAL 8 HG13 VAL 8 19.881 21.994 4.689 58 HG21 VAL 8 HG21 VAL 8 20.792 24.242 2.754 59 HG22 VAL 8 HG22 VAL 8 22.459 24.340 3.323 60 HG23 VAL 8 HG23 VAL 8 21.137 24.216 4.484 61 H GLY 9 HN GLY 9 23.759 20.616 2.619 62 HA2 GLY 9 HA2 GLY 9 23.846 18.060 3.958 63 HA3 GLY 9 HA1 GLY 9 22.723 18.128 2.605 64 H ALA 10 HN ALA 10 24.882 16.387 2.600 65 HA ALA 10 HA ALA 10 26.520 17.543 0.449 66 HB1 ALA 10 HB1 ALA 10 28.495 16.393 1.294 67 HB2 ALA 10 HB2 ALA 10 27.566 15.775 2.660 68 HB3 ALA 10 HB3 ALA 10 27.858 17.507 2.504 69 HA PRO 11 HA PRO 11 24.710 13.841 -1.450 70 HB2 PRO 11 HB2 PRO 11 26.150 14.970 -3.778 71 HB3 PRO 11 HB1 PRO 11 24.453 14.504 -3.621 72 HG2 PRO 11 HG2 PRO 11 25.171 17.074 -3.707 73 HG3 PRO 11 HG1 PRO 11 23.848 16.522 -2.662 74 HD2 PRO 11 HD2 PRO 11 26.673 17.208 -1.943 75 HD3 PRO 11 HD1 PRO 11 25.168 17.578 -1.074 76 HA PRO 12 HA PRO 12 28.452 11.449 -1.128 77 HB2 PRO 12 HB2 PRO 12 27.417 9.058 -1.897 78 HB3 PRO 12 HB1 PRO 12 27.132 9.758 -0.300 79 HG2 PRO 12 HG2 PRO 12 25.362 9.738 -2.707 80 HG3 PRO 12 HG1 PRO 12 24.937 9.504 -1.003 81 HD2 PRO 12 HD2 PRO 12 24.561 11.852 -2.331 82 HD3 PRO 12 HD1 PRO 12 24.864 11.759 -0.585 83 HA PRO 13 HA PRO 13 29.682 11.619 -5.464 84 HB2 PRO 13 HB2 PRO 13 32.383 11.252 -4.446 85 HB3 PRO 13 HB1 PRO 13 31.683 12.659 -5.250 86 HG2 PRO 13 HG2 PRO 13 32.378 12.653 -2.624 87 HG3 PRO 13 HG1 PRO 13 31.055 13.639 -3.273 88 HD2 PRO 13 HD2 PRO 13 30.928 11.023 -1.815 89 HD3 PRO 13 HD1 PRO 13 29.898 12.462 -1.641 90 H GLY 14 HN GLY 14 30.093 9.171 -3.111 91 HA2 GLY 14 HA2 GLY 14 31.316 7.279 -4.949 92 HA3 GLY 14 HA1 GLY 14 30.852 6.965 -3.283 93 H ARG 15 HN ARG 15 30.300 5.604 -5.956 94 HA ARG 15 HA ARG 15 27.368 5.752 -5.932 95 HB2 ARG 15 HB2 ARG 15 29.225 4.548 -7.986 96 HB3 ARG 15 HB1 ARG 15 27.473 4.593 -8.104 97 HG2 ARG 15 HG2 ARG 15 27.577 7.062 -8.081 98 HG3 ARG 15 HG1 ARG 15 29.339 6.952 -8.094 99 HD2 ARG 15 HD2 ARG 15 29.205 5.675 -10.202 100 HD3 ARG 15 HD1 ARG 15 27.457 5.898 -10.197 101 HE ARG 15 HE ARG 15 28.789 8.401 -10.017 102 HH11 ARG 15 HH11 ARG 15 27.971 5.846 -12.260 103 HH12 ARG 15 HH12 ARG 15 28.016 6.877 -13.657 104 HH21 ARG 15 HH21 ARG 15 28.876 9.756 -11.830 105 HH22 ARG 15 HH22 ARG 15 28.569 9.105 -13.414 106 H ALA 16 HN ALA 16 26.110 3.910 -5.834 107 HA ALA 16 HA ALA 16 27.234 1.306 -5.407 108 HB1 ALA 16 HB1 ALA 16 26.388 0.998 -3.135 109 HB2 ALA 16 HB2 ALA 16 25.893 2.690 -3.084 110 HB3 ALA 16 HB3 ALA 16 27.604 2.274 -3.190 111 H ASP 17 HN ASP 17 25.891 0.438 -6.890 112 HA ASP 17 HA ASP 17 22.997 0.810 -6.468 113 HB2 ASP 17 HB2 ASP 17 23.602 2.097 -8.423 114 HB3 ASP 17 HB1 ASP 17 24.484 0.731 -9.100 115 H LYS 18 HN LYS 18 21.830 -0.986 -6.342 116 HA LYS 18 HA LYS 18 22.955 -3.478 -7.403 117 HB2 LYS 18 HB2 LYS 18 21.838 -3.060 -4.632 118 HB3 LYS 18 HB1 LYS 18 22.030 -4.649 -5.359 119 HG2 LYS 18 HG2 LYS 18 24.458 -4.173 -5.614 120 HG3 LYS 18 HG1 LYS 18 24.206 -2.672 -4.719 121 HD2 LYS 18 HD2 LYS 18 23.469 -3.892 -2.783 122 HD3 LYS 18 HD1 LYS 18 23.524 -5.416 -3.672 123 HE2 LYS 18 HE2 LYS 18 25.957 -5.117 -3.964 124 HE3 LYS 18 HE1 LYS 18 25.872 -3.648 -2.995 125 HZ1 LYS 18 HZ1 LYS 18 25.221 -4.898 -1.100 126 HZ2 LYS 18 HZ2 LYS 18 26.579 -5.670 -1.760 127 HZ3 LYS 18 HZ3 LYS 18 25.031 -6.316 -2.012 128 H THR 19 HN THR 19 21.605 -3.803 -9.027 129 HA THR 19 HA THR 19 19.816 -4.546 -10.152 130 HB THR 19 HB THR 19 17.995 -5.703 -9.030 131 HG1 THR 19 HG1 THR 19 18.947 -4.299 -6.802 132 HG21 THR 19 HG21 THR 19 19.317 -7.400 -7.846 133 HG22 THR 19 HG22 THR 19 20.688 -6.292 -7.800 134 HG23 THR 19 HG23 THR 19 20.093 -6.898 -9.347 135 H ALA 20 HN ALA 20 19.581 -1.769 -8.308 136 HA ALA 20 HA ALA 20 16.845 -1.216 -9.148 137 HB1 ALA 20 HB1 ALA 20 17.005 0.786 -7.758 138 HB2 ALA 20 HB2 ALA 20 18.703 0.430 -7.438 139 HB3 ALA 20 HB3 ALA 20 17.448 -0.660 -6.849 140 H ALA 21 HN ALA 21 18.797 -1.503 -11.107 141 HA ALA 21 HA ALA 21 18.882 1.213 -12.221 142 HB1 ALA 21 HB1 ALA 21 20.781 0.569 -13.566 143 HB2 ALA 21 HB2 ALA 21 20.686 -1.084 -12.962 144 HB3 ALA 21 HB3 ALA 21 21.118 0.231 -11.869 145 HA PRO 22 HA PRO 22 17.209 -1.555 -15.773 146 HB2 PRO 22 HB2 PRO 22 16.651 -4.156 -15.261 147 HB3 PRO 22 HB1 PRO 22 18.221 -3.618 -15.869 148 HG2 PRO 22 HG2 PRO 22 17.405 -4.300 -13.072 149 HG3 PRO 22 HG1 PRO 22 18.895 -4.720 -13.940 150 HD2 PRO 22 HD2 PRO 22 18.760 -2.688 -12.150 151 HD3 PRO 22 HD1 PRO 22 19.851 -2.665 -13.549 152 H GLN 23 HN GLN 23 16.247 -1.934 -12.468 153 HA GLN 23 HA GLN 23 13.433 -1.778 -13.304 154 HB2 GLN 23 HB2 GLN 23 14.697 -3.356 -11.108 155 HB3 GLN 23 HB1 GLN 23 13.059 -2.750 -10.883 156 HG2 GLN 23 HG2 GLN 23 14.010 -4.519 -13.125 157 HG3 GLN 23 HG1 GLN 23 13.026 -5.009 -11.746 158 HE21 GLN 23 HE21 GLN 23 13.082 -3.228 -14.742 159 HE22 GLN 23 HE22 GLN 23 11.366 -3.087 -14.919 160 H THR 24 HN THR 24 15.107 0.453 -13.016 161 HA THR 24 HA THR 24 14.007 1.732 -10.623 162 HB THR 24 HB THR 24 16.427 2.106 -11.178 163 HG1 THR 24 HG1 THR 24 15.940 3.827 -10.046 164 HG21 THR 24 HG21 THR 24 16.275 2.118 -13.609 165 HG22 THR 24 HG22 THR 24 17.013 3.608 -13.022 166 HG23 THR 24 HG23 THR 24 15.331 3.608 -13.555 167 H ARG 25 HN ARG 25 12.396 0.815 -12.852 168 HA ARG 25 HA ARG 25 11.437 3.295 -14.074 169 HB2 ARG 25 HB2 ARG 25 10.541 0.436 -14.528 170 HB3 ARG 25 HB1 ARG 25 10.041 1.836 -15.465 171 HG2 ARG 25 HG2 ARG 25 12.853 0.779 -15.293 172 HG3 ARG 25 HG1 ARG 25 11.725 0.473 -16.616 173 HD2 ARG 25 HD2 ARG 25 12.756 3.177 -15.757 174 HD3 ARG 25 HD1 ARG 25 13.284 2.272 -17.176 175 HE ARG 25 HE ARG 25 10.811 2.446 -17.843 176 HH11 ARG 25 HH11 ARG 25 12.605 4.906 -16.099 177 HH12 ARG 25 HH12 ARG 25 11.592 6.210 -16.648 178 HH21 ARG 25 HH21 ARG 25 9.468 4.162 -18.552 179 HH22 ARG 25 HH22 ARG 25 9.805 5.788 -18.024 180 H LEU 26 HN LEU 26 9.742 0.426 -12.887 181 HA LEU 26 HA LEU 26 8.310 2.045 -10.912 182 HB2 LEU 26 HB2 LEU 26 6.948 0.273 -12.955 183 HB3 LEU 26 HB1 LEU 26 6.156 0.945 -11.546 184 HG LEU 26 HG LEU 26 6.964 3.234 -12.614 185 HD11 LEU 26 HD11 LEU 26 8.182 2.244 -14.465 186 HD12 LEU 26 HD12 LEU 26 6.799 3.164 -15.062 187 HD13 LEU 26 HD13 LEU 26 6.728 1.402 -14.999 188 HD21 LEU 26 HD21 LEU 26 4.772 3.397 -13.699 189 HD22 LEU 26 HD22 LEU 26 4.660 2.631 -12.114 190 HD23 LEU 26 HD23 LEU 26 4.584 1.648 -13.576 191 H THR 27 HN THR 27 10.088 0.670 -9.813 192 HA THR 27 HA THR 27 9.698 -2.131 -9.619 193 HB THR 27 HB THR 27 11.869 -1.193 -9.107 194 HG1 THR 27 HG1 THR 27 12.243 -2.324 -7.178 195 HG21 THR 27 HG21 THR 27 10.540 0.144 -6.750 196 HG22 THR 27 HG22 THR 27 11.192 0.956 -8.174 197 HG23 THR 27 HG23 THR 27 12.275 0.111 -7.065 198 HA PRO 28 HA PRO 28 6.313 -2.005 -6.701 199 HB2 PRO 28 HB2 PRO 28 5.747 -4.618 -6.710 200 HB3 PRO 28 HB1 PRO 28 5.406 -3.604 -8.117 201 HG2 PRO 28 HG2 PRO 28 7.666 -5.502 -7.650 202 HG3 PRO 28 HG1 PRO 28 6.736 -5.206 -9.130 203 HD2 PRO 28 HD2 PRO 28 9.230 -4.127 -8.578 204 HD3 PRO 28 HD1 PRO 28 8.074 -3.469 -9.751 205 H TYR 29 HN TYR 29 9.331 -2.638 -6.075 206 HA TYR 29 HA TYR 29 8.883 -4.000 -3.513 207 HB2 TYR 29 HB2 TYR 29 11.185 -3.836 -5.363 208 HB3 TYR 29 HB1 TYR 29 11.581 -3.776 -3.648 209 HD1 TYR 29 HD2 TYR 29 9.946 -5.824 -6.270 210 HD2 TYR 29 HD1 TYR 29 11.459 -5.714 -2.296 211 HE1 TYR 29 HE2 TYR 29 9.733 -8.272 -6.124 212 HE2 TYR 29 HE1 TYR 29 11.247 -8.157 -2.140 213 HH TYR 29 HH TYR 29 10.653 -10.141 -4.858 214 H ALA 30 HN ALA 30 8.123 -1.271 -4.042 215 HA ALA 30 HA ALA 30 10.028 0.355 -2.577 216 HB1 ALA 30 HB1 ALA 30 7.318 1.056 -3.703 217 HB2 ALA 30 HB2 ALA 30 8.870 1.314 -4.503 218 HB3 ALA 30 HB3 ALA 30 8.482 2.193 -3.023 219 H GLN 31 HN GLN 31 8.442 -1.943 -1.401 220 HA GLN 31 HA GLN 31 6.726 -0.698 0.551 221 HB2 GLN 31 HB2 GLN 31 6.334 -2.997 -0.409 222 HB3 GLN 31 HB1 GLN 31 7.742 -3.546 0.491 223 HG2 GLN 31 HG2 GLN 31 5.731 -4.114 1.686 224 HG3 GLN 31 HG1 GLN 31 6.636 -2.897 2.586 225 HE21 GLN 31 HE21 GLN 31 3.789 -3.558 0.717 226 HE22 GLN 31 HE22 GLN 31 2.935 -2.115 1.133 227 H ALA 32 HN ALA 32 8.476 0.750 1.258 228 HA ALA 32 HA ALA 32 10.621 -0.440 2.812 229 HB1 ALA 32 HB1 ALA 32 11.382 1.861 3.127 230 HB2 ALA 32 HB2 ALA 32 9.918 2.457 2.343 231 HB3 ALA 32 HB3 ALA 32 11.089 1.512 1.424 232 H GLY 33 HN GLY 33 7.441 0.212 3.389 233 HA2 GLY 33 HA2 GLY 33 7.932 0.916 6.212 234 HA3 GLY 33 HA1 GLY 33 6.460 1.305 5.335 235 H GLU 34 HN GLU 34 7.819 -0.775 7.530 236 HA GLU 34 HA GLU 34 6.086 -3.013 6.840 237 HB2 GLU 34 HB2 GLU 34 7.104 -4.131 8.830 238 HB3 GLU 34 HB1 GLU 34 8.256 -3.685 7.584 239 HG2 GLU 34 HG2 GLU 34 7.774 -1.964 9.990 240 HG3 GLU 34 HG1 GLU 34 8.920 -3.304 10.004 241 H ASP 35 HN ASP 35 5.766 -0.149 8.360 242 HA ASP 35 HA ASP 35 3.722 -1.098 10.236 243 HB2 ASP 35 HB2 ASP 35 5.229 0.644 11.089 244 HB3 ASP 35 HB1 ASP 35 4.804 1.689 9.739 245 H ASN 36 HN ASN 36 1.673 -1.232 9.557 246 HA ASN 36 HA ASN 36 1.047 -0.482 6.870 247 HB2 ASN 36 HB2 ASN 36 0.133 -2.516 8.080 248 HB3 ASN 36 HB1 ASN 36 -0.924 -1.415 8.957 249 HD21 ASN 36 HD21 ASN 36 0.046 -1.131 5.581 250 HD22 ASN 36 HD22 ASN 36 -1.532 -1.379 4.923 251 H TRP 37 HN TRP 37 0.363 1.406 6.194 252 HA TRP 37 HA TRP 37 -0.214 3.501 8.088 253 HB2 TRP 37 HB2 TRP 37 -0.367 3.738 5.088 254 HB3 TRP 37 HB1 TRP 37 0.022 4.989 6.258 255 HD1 TRP 37 HD1 TRP 37 2.467 4.287 7.697 256 HE1 TRP 37 HE1 TRP 37 4.688 3.581 6.584 257 HE3 TRP 37 HE3 TRP 37 0.646 2.808 3.163 258 HZ2 TRP 37 HZ2 TRP 37 5.535 2.532 4.091 259 HZ3 TRP 37 HZ3 TRP 37 2.217 1.970 1.471 260 HH2 TRP 37 HH2 TRP 37 4.607 1.835 1.920 261 H ARG 38 HN ARG 38 -2.270 1.358 7.780 262 HA ARG 38 HA ARG 38 -4.266 2.271 5.971 263 HB2 ARG 38 HB2 ARG 38 -5.750 0.593 6.950 264 HB3 ARG 38 HB1 ARG 38 -4.187 -0.085 6.515 265 HG2 ARG 38 HG2 ARG 38 -3.522 -0.221 8.790 266 HG3 ARG 38 HG1 ARG 38 -4.892 0.758 9.318 267 HD2 ARG 38 HD2 ARG 38 -5.155 -1.697 9.737 268 HD3 ARG 38 HD1 ARG 38 -6.441 -0.978 8.768 269 HE ARG 38 HE ARG 38 -4.353 -2.071 7.151 270 HH11 ARG 38 HH11 ARG 38 -7.158 -3.020 9.048 271 HH12 ARG 38 HH12 ARG 38 -7.532 -4.381 8.031 272 HH21 ARG 38 HH21 ARG 38 -4.861 -3.843 5.827 273 HH22 ARG 38 HH22 ARG 38 -6.230 -4.858 6.212 274 H SER 39 HN SER 39 -3.743 2.692 9.416 275 HA SER 39 HA SER 39 -6.226 3.859 10.023 276 HB2 SER 39 HB2 SER 39 -4.750 4.968 11.882 277 HB3 SER 39 HB1 SER 39 -4.980 3.218 11.889 278 HG SER 39 HG SER 39 -2.836 3.363 12.009 279 H ARG 40 HN ARG 40 -3.186 5.164 8.829 280 HA ARG 40 HA ARG 40 -3.959 7.895 8.995 281 HB2 ARG 40 HB2 ARG 40 -1.773 6.602 7.356 282 HB3 ARG 40 HB1 ARG 40 -1.874 8.260 7.871 283 HG2 ARG 40 HG2 ARG 40 -1.618 5.961 9.768 284 HG3 ARG 40 HG1 ARG 40 -0.254 6.897 9.157 285 HD2 ARG 40 HD2 ARG 40 -2.573 7.977 10.752 286 HD3 ARG 40 HD1 ARG 40 -0.951 7.665 11.370 287 HE ARG 40 HE ARG 40 -1.804 9.882 9.705 288 HH11 ARG 40 HH11 ARG 40 0.882 8.053 11.008 289 HH12 ARG 40 HH12 ARG 40 2.033 9.334 10.794 290 HH21 ARG 40 HH21 ARG 40 -0.281 11.591 9.420 291 HH22 ARG 40 HH22 ARG 40 1.378 11.339 9.894 292 H ILE 41 HN ILE 41 -3.625 5.509 6.418 293 HA ILE 41 HA ILE 41 -4.369 7.056 4.213 294 HB ILE 41 HB ILE 41 -4.635 4.101 4.816 295 HG12 ILE 41 HG12 ILE 41 -2.835 5.646 2.940 296 HG13 ILE 41 HG11 ILE 41 -2.375 5.040 4.526 297 HG21 ILE 41 HG21 ILE 41 -6.417 4.619 3.258 298 HG22 ILE 41 HG22 ILE 41 -5.137 3.718 2.449 299 HG23 ILE 41 HG23 ILE 41 -5.279 5.458 2.204 300 HD11 ILE 41 HD11 ILE 41 -1.536 3.607 2.759 301 HD12 ILE 41 HD12 ILE 41 -3.178 3.361 2.163 302 HD13 ILE 41 HD13 ILE 41 -2.716 2.753 3.754 303 H SER 42 HN SER 42 -6.387 5.144 6.485 304 HA SER 42 HA SER 42 -8.852 5.512 5.213 305 HB2 SER 42 HB2 SER 42 -8.260 5.163 8.158 306 HB3 SER 42 HB1 SER 42 -9.860 5.019 7.430 307 HG SER 42 HG SER 42 -7.586 3.374 7.054 308 H GLY 43 HN GLY 43 -7.280 7.496 7.724 309 HA2 GLY 43 HA2 GLY 43 -9.341 9.418 7.951 310 HA3 GLY 43 HA1 GLY 43 -7.647 9.677 8.356 311 H ARG 44 HN ARG 44 -6.644 9.073 5.738 312 HA ARG 44 HA ARG 44 -6.882 11.616 4.505 313 HB2 ARG 44 HB2 ARG 44 -4.960 9.821 4.435 314 HB3 ARG 44 HB1 ARG 44 -5.864 9.203 3.084 315 HG2 ARG 44 HG2 ARG 44 -5.495 11.101 1.806 316 HG3 ARG 44 HG1 ARG 44 -5.059 12.075 3.215 317 HD2 ARG 44 HD2 ARG 44 -3.052 10.725 3.525 318 HD3 ARG 44 HD1 ARG 44 -3.484 9.752 2.121 319 HE ARG 44 HE ARG 44 -2.773 11.467 0.742 320 HH11 ARG 44 HH11 ARG 44 -2.927 12.610 4.056 321 HH12 ARG 44 HH12 ARG 44 -2.035 14.067 3.724 322 HH21 ARG 44 HH21 ARG 44 -1.602 13.383 0.303 323 HH22 ARG 44 HH22 ARG 44 -1.273 14.497 1.604 324 H LEU 45 HN LEU 45 -8.307 8.447 3.947 325 HA LEU 45 HA LEU 45 -9.434 8.955 1.424 326 HB2 LEU 45 HB2 LEU 45 -9.266 6.809 3.166 327 HB3 LEU 45 HB1 LEU 45 -10.962 7.187 3.169 328 HG LEU 45 HG LEU 45 -9.510 6.868 0.583 329 HD11 LEU 45 HD11 LEU 45 -10.055 4.488 0.607 330 HD12 LEU 45 HD12 LEU 45 -10.653 4.636 2.260 331 HD13 LEU 45 HD13 LEU 45 -8.943 4.899 1.912 332 HD21 LEU 45 HD21 LEU 45 -12.341 6.615 1.535 333 HD22 LEU 45 HD22 LEU 45 -11.806 5.935 -0.002 334 HD23 LEU 45 HD23 LEU 45 -11.685 7.675 0.285 335 H ASN 46 HN ASN 46 -10.414 9.641 4.673 336 HA ASN 46 HA ASN 46 -13.090 10.431 4.096 337 HB2 ASN 46 HB2 ASN 46 -12.304 9.742 6.364 338 HB3 ASN 46 HB1 ASN 46 -11.357 11.224 6.450 339 HD21 ASN 46 HD21 ASN 46 -12.353 13.120 6.953 340 HD22 ASN 46 HD22 ASN 46 -14.028 13.234 7.369 341 H ARG 47 HN ARG 47 -9.988 11.987 4.179 342 HA ARG 47 HA ARG 47 -10.874 14.636 3.665 343 HB2 ARG 47 HB2 ARG 47 -8.675 14.432 4.478 344 HB3 ARG 47 HB1 ARG 47 -8.273 13.161 3.338 345 HG2 ARG 47 HG2 ARG 47 -8.281 14.783 1.518 346 HG3 ARG 47 HG1 ARG 47 -8.698 16.062 2.661 347 HD2 ARG 47 HD2 ARG 47 -6.621 15.801 3.813 348 HD3 ARG 47 HD1 ARG 47 -6.225 14.352 2.880 349 HE ARG 47 HE ARG 47 -6.511 16.249 0.970 350 HH11 ARG 47 HH11 ARG 47 -4.673 16.184 3.960 351 HH12 ARG 47 HH12 ARG 47 -3.384 17.159 3.332 352 HH21 ARG 47 HH21 ARG 47 -4.803 17.540 0.155 353 HH22 ARG 47 HH22 ARG 47 -3.449 17.926 1.186 354 H PHE 48 HN PHE 48 -10.321 11.799 1.729 355 HA PHE 48 HA PHE 48 -10.764 13.297 -0.737 356 HB2 PHE 48 HB2 PHE 48 -9.804 10.488 -0.224 357 HB3 PHE 48 HB1 PHE 48 -10.245 11.056 -1.829 358 HD1 PHE 48 HD1 PHE 48 -9.049 13.281 -2.572 359 HD2 PHE 48 HD2 PHE 48 -7.609 10.644 0.440 360 HE1 PHE 48 HE1 PHE 48 -6.775 14.160 -2.895 361 HE2 PHE 48 HE2 PHE 48 -5.333 11.525 0.125 362 HZ PHE 48 HZ PHE 48 -4.913 13.282 -1.543 363 H LYS 49 HN LYS 49 -12.837 12.687 1.299 364 HA LYS 49 HA LYS 49 -15.069 12.318 1.282 365 HB2 LYS 49 HB2 LYS 49 -15.175 13.173 -0.973 366 HB3 LYS 49 HB1 LYS 49 -14.627 11.639 -1.626 367 HG2 LYS 49 HG2 LYS 49 -17.026 11.355 -0.023 368 HG3 LYS 49 HG1 LYS 49 -17.240 12.469 -1.374 369 HD2 LYS 49 HD2 LYS 49 -16.254 10.711 -2.861 370 HD3 LYS 49 HD1 LYS 49 -16.300 9.607 -1.486 371 HE2 LYS 49 HE2 LYS 49 -18.711 9.838 -1.350 372 HE3 LYS 49 HE1 LYS 49 -18.691 11.019 -2.660 373 HZ1 LYS 49 HZ1 LYS 49 -19.314 8.882 -3.523 374 HZ2 LYS 49 HZ2 LYS 49 -17.943 8.147 -2.859 375 HZ3 LYS 49 HZ3 LYS 49 -17.777 9.274 -4.112 376 H ARG 50 HN ARG 50 -15.375 10.740 2.657 377 HA ARG 50 HA ARG 50 -15.247 7.961 1.732 378 HB2 ARG 50 HB2 ARG 50 -13.141 8.445 2.887 379 HB3 ARG 50 HB1 ARG 50 -14.026 9.037 4.283 380 HG2 ARG 50 HG2 ARG 50 -14.999 6.730 4.510 381 HG3 ARG 50 HG1 ARG 50 -13.852 6.211 3.269 382 HD2 ARG 50 HD2 ARG 50 -12.008 7.076 4.670 383 HD3 ARG 50 HD1 ARG 50 -13.176 7.475 5.923 384 HE ARG 50 HE ARG 50 -12.686 4.715 5.013 385 HH11 ARG 50 HH11 ARG 50 -13.310 7.045 7.546 386 HH12 ARG 50 HH12 ARG 50 -13.118 5.899 8.836 387 HH21 ARG 50 HH21 ARG 50 -12.441 3.185 6.725 388 HH22 ARG 50 HH22 ARG 50 -12.658 3.700 8.364 389 H TYR 51 HN TYR 51 -17.341 7.459 1.856 390 HA TYR 51 HA TYR 51 -19.189 8.348 3.772 391 HB2 TYR 51 HB2 TYR 51 -19.454 6.999 1.513 392 HB3 TYR 51 HB1 TYR 51 -19.361 5.602 2.579 393 HD1 TYR 51 HD1 TYR 51 -21.125 5.249 4.307 394 HD2 TYR 51 HD2 TYR 51 -21.407 8.362 1.420 395 HE1 TYR 51 HE1 TYR 51 -23.523 5.491 4.805 396 HE2 TYR 51 HE2 TYR 51 -23.801 8.608 1.909 397 HH TYR 51 HH TYR 51 -25.244 7.457 4.607 398 HA PRO 52 HA PRO 52 -17.843 6.516 7.598 399 HB2 PRO 52 HB2 PRO 52 -20.781 5.946 7.814 400 HB3 PRO 52 HB1 PRO 52 -19.677 6.611 9.026 401 HG2 PRO 52 HG2 PRO 52 -21.314 8.217 7.685 402 HG3 PRO 52 HG1 PRO 52 -19.649 8.715 8.036 403 HD2 PRO 52 HD2 PRO 52 -20.862 7.843 5.468 404 HD3 PRO 52 HD1 PRO 52 -19.521 8.966 5.762 405 H LYS 53 HN LYS 53 -17.141 4.509 8.114 406 HA LYS 53 HA LYS 53 -17.390 2.647 5.956 407 HB2 LYS 53 HB2 LYS 53 -15.375 3.274 7.556 408 HB3 LYS 53 HB1 LYS 53 -16.008 1.942 8.511 409 HG2 LYS 53 HG2 LYS 53 -14.317 1.038 7.148 410 HG3 LYS 53 HG1 LYS 53 -15.844 0.528 6.430 411 HD2 LYS 53 HD2 LYS 53 -14.612 3.056 5.455 412 HD3 LYS 53 HD1 LYS 53 -13.872 1.530 4.970 413 HE2 LYS 53 HE2 LYS 53 -16.792 2.215 4.590 414 HE3 LYS 53 HE1 LYS 53 -15.550 2.391 3.353 415 HZ1 LYS 53 HZ1 LYS 53 -15.117 0.014 3.495 416 HZ2 LYS 53 HZ2 LYS 53 -16.727 0.319 3.082 417 HZ3 LYS 53 HZ3 LYS 53 -16.334 -0.152 4.658 418 H ASP 54 HN ASP 54 -18.840 2.869 9.116 419 HA ASP 54 HA ASP 54 -19.505 0.127 9.405 420 HB2 ASP 54 HB2 ASP 54 -20.668 2.626 10.625 421 HB3 ASP 54 HB1 ASP 54 -21.321 1.027 10.970 422 H ALA 55 HN ALA 55 -21.054 2.823 7.804 423 HA ALA 55 HA ALA 55 -23.491 1.521 7.196 424 HB1 ALA 55 HB1 ALA 55 -23.795 3.269 5.530 425 HB2 ALA 55 HB2 ALA 55 -22.100 3.733 5.694 426 HB3 ALA 55 HB3 ALA 55 -23.210 3.947 7.048 427 H LEU 56 HN LEU 56 -20.324 1.494 5.765 428 HA LEU 56 HA LEU 56 -21.155 0.151 3.359 429 HB2 LEU 56 HB2 LEU 56 -18.426 0.625 4.572 430 HB3 LEU 56 HB1 LEU 56 -18.668 -0.286 3.097 431 HG LEU 56 HG LEU 56 -17.952 1.931 2.552 432 HD11 LEU 56 HD11 LEU 56 -20.890 1.704 1.990 433 HD12 LEU 56 HD12 LEU 56 -19.608 0.898 1.085 434 HD13 LEU 56 HD13 LEU 56 -19.707 2.660 1.093 435 HD21 LEU 56 HD21 LEU 56 -19.172 3.912 3.167 436 HD22 LEU 56 HD22 LEU 56 -18.661 3.041 4.610 437 HD23 LEU 56 HD23 LEU 56 -20.338 2.949 4.070 438 H ARG 57 HN ARG 57 -19.725 -0.832 6.464 439 HA ARG 57 HA ARG 57 -19.255 -3.509 5.555 440 HB2 ARG 57 HB2 ARG 57 -19.242 -2.389 8.357 441 HB3 ARG 57 HB1 ARG 57 -18.663 -3.985 7.891 442 HG2 ARG 57 HG2 ARG 57 -17.030 -2.854 6.365 443 HG3 ARG 57 HG1 ARG 57 -17.528 -1.321 7.083 444 HD2 ARG 57 HD2 ARG 57 -16.387 -3.663 8.601 445 HD3 ARG 57 HD1 ARG 57 -15.489 -2.222 8.126 446 HE ARG 57 HE ARG 57 -17.857 -1.701 9.707 447 HH11 ARG 57 HH11 ARG 57 -14.428 -2.432 9.789 448 HH12 ARG 57 HH12 ARG 57 -14.181 -1.692 11.345 449 HH21 ARG 57 HH21 ARG 57 -17.530 -0.705 11.745 450 HH22 ARG 57 HH22 ARG 57 -15.938 -0.714 12.454 451 H LEU 58 HN LEU 58 -22.013 -1.906 6.608 452 HA LEU 58 HA LEU 58 -23.342 -4.429 7.325 453 HB2 LEU 58 HB2 LEU 58 -23.515 -2.470 8.881 454 HB3 LEU 58 HB1 LEU 58 -24.353 -1.595 7.616 455 HG LEU 58 HG LEU 58 -26.138 -3.339 7.668 456 HD11 LEU 58 HD11 LEU 58 -24.837 -5.168 8.597 457 HD12 LEU 58 HD12 LEU 58 -26.246 -4.828 9.601 458 HD13 LEU 58 HD13 LEU 58 -24.648 -4.282 10.112 459 HD21 LEU 58 HD21 LEU 58 -26.382 -1.219 8.850 460 HD22 LEU 58 HD22 LEU 58 -25.606 -1.915 10.272 461 HD23 LEU 58 HD23 LEU 58 -27.165 -2.534 9.724 462 H LYS 59 HN LYS 59 -22.549 -3.295 4.618 463 HA LYS 59 HA LYS 59 -25.116 -3.678 3.278 464 HB2 LYS 59 HB2 LYS 59 -25.028 -1.280 3.609 465 HB3 LYS 59 HB1 LYS 59 -23.384 -1.214 2.998 466 HG2 LYS 59 HG2 LYS 59 -24.145 -1.796 0.780 467 HG3 LYS 59 HG1 LYS 59 -25.793 -1.980 1.377 468 HD2 LYS 59 HD2 LYS 59 -24.201 0.578 1.476 469 HD3 LYS 59 HD1 LYS 59 -25.412 0.193 0.254 470 HE2 LYS 59 HE2 LYS 59 -25.973 0.299 3.214 471 HE3 LYS 59 HE1 LYS 59 -26.236 1.647 2.112 472 HZ1 LYS 59 HZ1 LYS 59 -27.532 -1.020 1.882 473 HZ2 LYS 59 HZ2 LYS 59 -27.822 0.325 0.891 474 HZ3 LYS 59 HZ3 LYS 59 -28.263 0.369 2.529 475 H ARG 60 HN ARG 60 -21.748 -2.760 2.751 476 HA ARG 60 HA ARG 60 -21.488 -4.875 0.719 477 HB2 ARG 60 HB2 ARG 60 -19.965 -2.271 0.706 478 HB3 ARG 60 HB1 ARG 60 -20.039 -3.478 -0.567 479 HG2 ARG 60 HG2 ARG 60 -22.423 -1.887 0.319 480 HG3 ARG 60 HG1 ARG 60 -21.325 -1.356 -0.954 481 HD2 ARG 60 HD2 ARG 60 -21.819 -3.769 -1.900 482 HD3 ARG 60 HD1 ARG 60 -23.288 -3.587 -0.936 483 HE ARG 60 HE ARG 60 -22.803 -1.278 -2.532 484 HH11 ARG 60 HH11 ARG 60 -24.102 -4.521 -2.637 485 HH12 ARG 60 HH12 ARG 60 -24.997 -4.245 -4.095 486 HH21 ARG 60 HH21 ARG 60 -23.990 -0.895 -4.409 487 HH22 ARG 60 HH22 ARG 60 -24.975 -2.165 -5.088 488 H GLN 61 HN GLN 61 -20.728 -6.204 2.456 489 HA GLN 61 HA GLN 61 -18.210 -5.356 3.684 490 HB2 GLN 61 HB2 GLN 61 -18.542 -7.330 5.178 491 HB3 GLN 61 HB1 GLN 61 -19.790 -6.106 5.307 492 HG2 GLN 61 HG2 GLN 61 -20.163 -8.497 3.554 493 HG3 GLN 61 HG1 GLN 61 -20.466 -8.583 5.288 494 HE21 GLN 61 HE21 GLN 61 -22.198 -7.441 6.161 495 HE22 GLN 61 HE22 GLN 61 -23.466 -6.798 5.172 496 H GLY 62 HN GLY 62 -16.317 -6.384 3.325 497 HA2 GLY 62 HA2 GLY 62 -15.961 -8.959 2.397 498 HA3 GLY 62 HA1 GLY 62 -16.100 -7.945 0.973 499 H VAL 63 HN VAL 63 -13.859 -9.452 1.585 500 HA VAL 63 HA VAL 63 -11.884 -7.372 2.229 501 HB VAL 63 HB VAL 63 -11.701 -9.068 3.895 502 HG11 VAL 63 HG11 VAL 63 -12.946 -10.839 2.787 503 HG12 VAL 63 HG12 VAL 63 -11.398 -11.446 3.377 504 HG13 VAL 63 HG13 VAL 63 -11.612 -11.095 1.661 505 HG21 VAL 63 HG21 VAL 63 -9.564 -9.526 1.811 506 HG22 VAL 63 HG22 VAL 63 -9.446 -9.970 3.514 507 HG23 VAL 63 HG23 VAL 63 -9.565 -8.273 3.052 508 H GLY 64 HN GLY 64 -10.640 -6.734 0.608 509 HA2 GLY 64 HA2 GLY 64 -10.054 -8.676 -1.538 510 HA3 GLY 64 HA1 GLY 64 -10.533 -7.026 -1.922 511 H GLN 65 HN GLN 65 -8.099 -8.223 -2.716 512 HA GLN 65 HA GLN 65 -6.144 -6.744 -1.092 513 HB2 GLN 65 HB2 GLN 65 -5.794 -9.222 -1.676 514 HB3 GLN 65 HB1 GLN 65 -5.526 -8.679 -3.324 515 HG2 GLN 65 HG2 GLN 65 -3.662 -7.288 -2.548 516 HG3 GLN 65 HG1 GLN 65 -3.919 -7.888 -0.911 517 HE21 GLN 65 HE21 GLN 65 -1.892 -8.806 -0.764 518 HE22 GLN 65 HE22 GLN 65 -1.441 -10.222 -1.657 519 H VAL 66 HN VAL 66 -5.324 -4.872 -1.917 520 HA VAL 66 HA VAL 66 -6.148 -4.248 -4.664 521 HB VAL 66 HB VAL 66 -7.746 -3.414 -2.928 522 HG11 VAL 66 HG11 VAL 66 -7.189 -1.419 -1.658 523 HG12 VAL 66 HG12 VAL 66 -5.505 -1.572 -2.168 524 HG13 VAL 66 HG13 VAL 66 -6.240 -2.822 -1.162 525 HG21 VAL 66 HG21 VAL 66 -8.027 -1.210 -3.841 526 HG22 VAL 66 HG22 VAL 66 -7.683 -2.396 -5.106 527 HG23 VAL 66 HG23 VAL 66 -6.420 -1.285 -4.568 528 H ARG 67 HN ARG 67 -4.620 -3.366 -5.893 529 HA ARG 67 HA ARG 67 -2.177 -2.377 -4.571 530 HB2 ARG 67 HB2 ARG 67 -1.874 -4.519 -5.836 531 HB3 ARG 67 HB1 ARG 67 -2.384 -3.683 -7.298 532 HG2 ARG 67 HG2 ARG 67 -0.477 -2.081 -6.897 533 HG3 ARG 67 HG1 ARG 67 0.086 -3.208 -5.664 534 HD2 ARG 67 HD2 ARG 67 -0.383 -3.923 -8.554 535 HD3 ARG 67 HD1 ARG 67 1.183 -3.497 -7.874 536 HE ARG 67 HE ARG 67 -0.164 -5.700 -6.564 537 HH11 ARG 67 HH11 ARG 67 2.198 -4.657 -8.934 538 HH12 ARG 67 HH12 ARG 67 2.916 -6.237 -9.101 539 HH21 ARG 67 HH21 ARG 67 0.796 -7.792 -6.770 540 HH22 ARG 67 HH22 ARG 67 2.132 -8.011 -7.864 541 H PHE 68 HN PHE 68 -1.210 -0.535 -5.422 542 HA PHE 68 HA PHE 68 -2.336 0.828 -7.667 543 HB2 PHE 68 HB2 PHE 68 -2.784 2.890 -6.082 544 HB3 PHE 68 HB1 PHE 68 -4.025 1.677 -6.357 545 HD1 PHE 68 HD2 PHE 68 -1.165 2.293 -4.016 546 HD2 PHE 68 HD1 PHE 68 -5.157 0.912 -4.542 547 HE1 PHE 68 HE2 PHE 68 -1.353 1.904 -1.590 548 HE2 PHE 68 HE1 PHE 68 -5.350 0.523 -2.123 549 HZ PHE 68 HZ PHE 68 -3.447 1.018 -0.643 550 H THR 69 HN THR 69 -1.156 2.650 -8.278 551 HA THR 69 HA THR 69 1.465 2.977 -6.961 552 HB THR 69 HB THR 69 0.564 4.168 -9.595 553 HG1 THR 69 HG1 THR 69 2.090 1.790 -9.164 554 HG21 THR 69 HG21 THR 69 3.295 3.711 -8.391 555 HG22 THR 69 HG22 THR 69 2.468 5.263 -8.512 556 HG23 THR 69 HG23 THR 69 2.973 4.414 -9.974 557 H LEU 70 HN LEU 70 1.891 4.769 -5.847 558 HA LEU 70 HA LEU 70 -0.292 6.728 -5.723 559 HB2 LEU 70 HB2 LEU 70 1.556 5.725 -3.576 560 HB3 LEU 70 HB1 LEU 70 0.459 7.083 -3.369 561 HG LEU 70 HG LEU 70 -0.467 4.322 -4.161 562 HD11 LEU 70 HD11 LEU 70 -1.115 3.978 -1.848 563 HD12 LEU 70 HD12 LEU 70 -0.388 5.523 -1.401 564 HD13 LEU 70 HD13 LEU 70 0.631 4.205 -1.987 565 HD21 LEU 70 HD21 LEU 70 -2.646 5.156 -3.396 566 HD22 LEU 70 HD22 LEU 70 -1.998 6.113 -4.730 567 HD23 LEU 70 HD23 LEU 70 -1.921 6.733 -3.080 568 H ASP 71 HN ASP 71 0.083 8.796 -5.725 569 HA ASP 71 HA ASP 71 2.579 9.751 -6.736 570 HB2 ASP 71 HB2 ASP 71 0.491 10.687 -7.564 571 HB3 ASP 71 HB1 ASP 71 0.026 11.171 -5.935 572 H ARG 72 HN ARG 72 3.620 11.632 -5.806 573 HA ARG 72 HA ARG 72 4.635 11.306 -3.258 574 HB2 ARG 72 HB2 ARG 72 4.424 13.867 -4.858 575 HB3 ARG 72 HB1 ARG 72 5.525 13.584 -3.514 576 HG2 ARG 72 HG2 ARG 72 6.797 12.041 -4.728 577 HG3 ARG 72 HG1 ARG 72 5.552 11.861 -5.965 578 HD2 ARG 72 HD2 ARG 72 7.300 13.194 -6.892 579 HD3 ARG 72 HD1 ARG 72 5.925 14.252 -6.584 580 HE ARG 72 HE ARG 72 8.294 14.091 -4.822 581 HH11 ARG 72 HH11 ARG 72 5.749 15.919 -6.400 582 HH12 ARG 72 HH12 ARG 72 6.313 17.455 -5.811 583 HH21 ARG 72 HH21 ARG 72 9.045 16.118 -4.064 584 HH22 ARG 72 HH22 ARG 72 8.178 17.561 -4.493 585 H GLN 73 HN GLN 73 1.853 13.192 -4.331 586 HA GLN 73 HA GLN 73 1.414 14.338 -1.708 587 HB2 GLN 73 HB2 GLN 73 -0.382 14.321 -4.139 588 HB3 GLN 73 HB1 GLN 73 -0.594 15.313 -2.703 589 HG2 GLN 73 HG2 GLN 73 1.486 16.474 -3.183 590 HG3 GLN 73 HG1 GLN 73 1.725 15.470 -4.612 591 HE21 GLN 73 HE21 GLN 73 1.475 18.352 -4.394 592 HE22 GLN 73 HE22 GLN 73 0.126 18.802 -5.381 593 H GLY 74 HN GLY 74 1.162 11.314 -2.655 594 HA2 GLY 74 HA2 GLY 74 0.004 9.499 -1.851 595 HA3 GLY 74 HA1 GLY 74 -0.840 10.587 -0.760 596 H HIS 75 HN HIS 75 -0.671 10.678 -4.252 597 HA HIS 75 HA HIS 75 -3.603 10.564 -4.341 598 HB2 HIS 75 HB2 HIS 75 -2.754 12.677 -5.117 599 HB3 HIS 75 HB1 HIS 75 -1.572 11.886 -6.150 600 HD1 HIS 75 HD1 HIS 75 -5.385 11.898 -5.871 601 HD2 HIS 75 HD2 HIS 75 -2.356 11.887 -8.719 602 HE1 HIS 75 HE1 HIS 75 -6.551 12.015 -8.097 603 HE2 HIS 75 HE2 HIS 75 -4.695 12.113 -9.808 604 H VAL 76 HN VAL 76 -4.606 9.102 -5.586 605 HA VAL 76 HA VAL 76 -3.350 6.751 -6.387 606 HB VAL 76 HB VAL 76 -5.749 6.901 -5.895 607 HG11 VAL 76 HG11 VAL 76 -7.309 7.790 -7.578 608 HG12 VAL 76 HG12 VAL 76 -5.935 8.400 -8.502 609 HG13 VAL 76 HG13 VAL 76 -6.268 9.037 -6.891 610 HG21 VAL 76 HG21 VAL 76 -5.182 5.920 -8.690 611 HG22 VAL 76 HG22 VAL 76 -6.571 5.470 -7.700 612 HG23 VAL 76 HG23 VAL 76 -4.945 5.009 -7.198 613 H LEU 77 HN LEU 77 -2.283 6.152 -8.159 614 HA LEU 77 HA LEU 77 -2.457 7.857 -10.559 615 HB2 LEU 77 HB2 LEU 77 -0.112 6.199 -9.623 616 HB3 LEU 77 HB1 LEU 77 -0.157 7.181 -11.075 617 HG LEU 77 HG LEU 77 -0.410 8.299 -8.285 618 HD11 LEU 77 HD11 LEU 77 2.013 8.208 -10.074 619 HD12 LEU 77 HD12 LEU 77 1.768 7.221 -8.631 620 HD13 LEU 77 HD13 LEU 77 1.901 8.976 -8.487 621 HD21 LEU 77 HD21 LEU 77 0.096 10.430 -9.394 622 HD22 LEU 77 HD22 LEU 77 -1.395 9.712 -9.999 623 HD23 LEU 77 HD23 LEU 77 0.082 9.613 -10.957 624 H ALA 78 HN ALA 78 -2.088 4.600 -9.294 625 HA ALA 78 HA ALA 78 -3.130 3.527 -11.830 626 HB1 ALA 78 HB1 ALA 78 -1.657 1.621 -11.663 627 HB2 ALA 78 HB2 ALA 78 -0.998 2.220 -10.140 628 HB3 ALA 78 HB3 ALA 78 -0.693 3.098 -11.643 629 H VAL 79 HN VAL 79 -4.435 1.671 -11.625 630 HA VAL 79 HA VAL 79 -5.291 1.047 -8.889 631 HB VAL 79 HB VAL 79 -7.648 0.955 -9.668 632 HG11 VAL 79 HG11 VAL 79 -8.043 3.357 -9.689 633 HG12 VAL 79 HG12 VAL 79 -6.340 3.642 -10.050 634 HG13 VAL 79 HG13 VAL 79 -6.806 2.930 -8.505 635 HG21 VAL 79 HG21 VAL 79 -8.288 2.060 -11.762 636 HG22 VAL 79 HG22 VAL 79 -7.273 0.648 -12.059 637 HG23 VAL 79 HG23 VAL 79 -6.585 2.269 -12.170 638 H THR 80 HN THR 80 -5.241 -1.075 -8.518 639 HA THR 80 HA THR 80 -5.759 -2.922 -10.722 640 HB THR 80 HB THR 80 -3.262 -3.082 -9.017 641 HG1 THR 80 HG1 THR 80 -3.782 -1.759 -11.291 642 HG21 THR 80 HG21 THR 80 -4.212 -4.818 -11.301 643 HG22 THR 80 HG22 THR 80 -4.153 -5.288 -9.604 644 HG23 THR 80 HG23 THR 80 -2.656 -4.961 -10.477 645 H LEU 81 HN LEU 81 -7.313 -4.233 -10.002 646 HA LEU 81 HA LEU 81 -7.391 -5.006 -7.199 647 HB2 LEU 81 HB2 LEU 81 -9.498 -4.674 -8.495 648 HB3 LEU 81 HB1 LEU 81 -9.055 -6.050 -9.492 649 HG LEU 81 HG LEU 81 -9.015 -7.441 -7.392 650 HD11 LEU 81 HD11 LEU 81 -10.220 -6.590 -5.452 651 HD12 LEU 81 HD12 LEU 81 -10.373 -5.016 -6.230 652 HD13 LEU 81 HD13 LEU 81 -8.779 -5.630 -5.788 653 HD21 LEU 81 HD21 LEU 81 -10.880 -7.548 -8.948 654 HD22 LEU 81 HD22 LEU 81 -11.629 -6.149 -8.176 655 HD23 LEU 81 HD23 LEU 81 -11.460 -7.664 -7.287 656 H VAL 82 HN VAL 82 -5.967 -6.425 -6.555 657 HA VAL 82 HA VAL 82 -4.592 -8.051 -8.520 658 HB VAL 82 HB VAL 82 -3.640 -8.460 -5.836 659 HG11 VAL 82 HG11 VAL 82 -1.576 -7.509 -6.815 660 HG12 VAL 82 HG12 VAL 82 -2.488 -7.086 -8.263 661 HG13 VAL 82 HG13 VAL 82 -2.285 -8.779 -7.810 662 HG21 VAL 82 HG21 VAL 82 -2.960 -6.156 -5.328 663 HG22 VAL 82 HG22 VAL 82 -4.717 -6.331 -5.331 664 HG23 VAL 82 HG23 VAL 82 -3.902 -5.580 -6.706 665 H SER 83 HN SER 83 -6.330 -8.520 -5.469 666 HA SER 83 HA SER 83 -7.053 -11.206 -6.347 667 HB2 SER 83 HB2 SER 83 -5.789 -10.634 -3.655 668 HB3 SER 83 HB1 SER 83 -6.437 -12.192 -4.178 669 HG SER 83 HG SER 83 -4.009 -11.179 -4.578 670 H SER 84 HN SER 84 -9.211 -11.105 -6.334 671 HA SER 84 HA SER 84 -10.514 -9.829 -4.030 672 HB2 SER 84 HB2 SER 84 -11.198 -8.992 -6.253 673 HB3 SER 84 HB1 SER 84 -11.698 -10.623 -6.706 674 HG SER 84 HG SER 84 -13.301 -8.989 -5.780 675 H ALA 85 HN ALA 85 -11.778 -10.998 -2.674 676 HA ALA 85 HA ALA 85 -11.569 -13.874 -2.776 677 HB1 ALA 85 HB1 ALA 85 -13.040 -12.100 -0.828 678 HB2 ALA 85 HB2 ALA 85 -11.375 -12.658 -0.656 679 HB3 ALA 85 HB3 ALA 85 -12.704 -13.819 -0.619 680 H GLY 86 HN GLY 86 -13.583 -11.650 -4.143 681 HA2 GLY 86 HA2 GLY 86 -15.320 -13.139 -5.492 682 HA3 GLY 86 HA1 GLY 86 -16.066 -13.133 -3.894 683 H LEU 87 HN LEU 87 -16.811 -11.238 -3.020 684 HA LEU 87 HA LEU 87 -17.918 -9.243 -3.040 685 HB2 LEU 87 HB2 LEU 87 -15.385 -8.420 -4.419 686 HB3 LEU 87 HB1 LEU 87 -16.512 -7.317 -3.689 687 HG LEU 87 HG LEU 87 -14.700 -7.469 -2.209 688 HD11 LEU 87 HD11 LEU 87 -16.838 -9.306 -1.182 689 HD12 LEU 87 HD12 LEU 87 -16.823 -7.543 -1.089 690 HD13 LEU 87 HD13 LEU 87 -15.623 -8.486 -0.203 691 HD21 LEU 87 HD21 LEU 87 -13.770 -9.548 -1.351 692 HD22 LEU 87 HD22 LEU 87 -13.616 -9.448 -3.104 693 HD23 LEU 87 HD23 LEU 87 -14.860 -10.469 -2.386 694 HA PRO 88 HA PRO 88 -18.905 -9.592 -7.678 695 HB2 PRO 88 HB2 PRO 88 -21.647 -10.106 -6.703 696 HB3 PRO 88 HB1 PRO 88 -20.715 -10.961 -7.937 697 HG2 PRO 88 HG2 PRO 88 -21.178 -12.058 -5.534 698 HG3 PRO 88 HG1 PRO 88 -19.644 -12.303 -6.388 699 HD2 PRO 88 HD2 PRO 88 -20.270 -10.470 -4.103 700 HD3 PRO 88 HD1 PRO 88 -18.827 -11.468 -4.385 701 H SER 89 HN SER 89 -21.690 -8.625 -5.708 702 HA SER 89 HA SER 89 -21.905 -6.098 -7.049 703 HB2 SER 89 HB2 SER 89 -23.847 -7.446 -6.170 704 HB3 SER 89 HB1 SER 89 -23.332 -7.017 -4.541 705 HG SER 89 HG SER 89 -23.735 -4.981 -6.438 706 H LEU 90 HN LEU 90 -20.127 -7.280 -4.441 707 HA LEU 90 HA LEU 90 -20.187 -4.983 -2.730 708 HB2 LEU 90 HB2 LEU 90 -18.220 -7.270 -2.725 709 HB3 LEU 90 HB1 LEU 90 -18.578 -6.175 -1.403 710 HG LEU 90 HG LEU 90 -20.785 -7.867 -2.498 711 HD11 LEU 90 HD11 LEU 90 -20.139 -9.754 -1.267 712 HD12 LEU 90 HD12 LEU 90 -18.899 -8.860 -0.388 713 HD13 LEU 90 HD13 LEU 90 -18.659 -9.243 -2.098 714 HD21 LEU 90 HD21 LEU 90 -21.498 -7.767 -0.153 715 HD22 LEU 90 HD22 LEU 90 -21.277 -6.157 -0.841 716 HD23 LEU 90 HD23 LEU 90 -20.053 -6.830 0.237 717 H ASP 91 HN ASP 91 -17.923 -6.258 -5.130 718 HA ASP 91 HA ASP 91 -15.632 -4.878 -4.412 719 HB2 ASP 91 HB2 ASP 91 -15.548 -6.656 -6.034 720 HB3 ASP 91 HB1 ASP 91 -16.581 -5.761 -7.143 721 H ARG 92 HN ARG 92 -18.187 -3.878 -6.654 722 HA ARG 92 HA ARG 92 -16.998 -1.565 -7.604 723 HB2 ARG 92 HB2 ARG 92 -19.217 -0.815 -8.236 724 HB3 ARG 92 HB1 ARG 92 -19.050 -2.533 -8.552 725 HG2 ARG 92 HG2 ARG 92 -21.067 -2.641 -7.581 726 HG3 ARG 92 HG1 ARG 92 -20.133 -2.604 -6.084 727 HD2 ARG 92 HD2 ARG 92 -21.962 -1.012 -5.978 728 HD3 ARG 92 HD1 ARG 92 -20.415 -0.167 -5.982 729 HE ARG 92 HE ARG 92 -21.659 -0.475 -8.581 730 HH11 ARG 92 HH11 ARG 92 -21.380 1.565 -5.731 731 HH12 ARG 92 HH12 ARG 92 -21.740 3.025 -6.596 732 HH21 ARG 92 HH21 ARG 92 -22.170 1.444 -9.704 733 HH22 ARG 92 HH22 ARG 92 -22.202 2.960 -8.850 734 H GLU 93 HN GLU 93 -18.715 -2.078 -4.574 735 HA GLU 93 HA GLU 93 -18.953 0.734 -4.023 736 HB2 GLU 93 HB2 GLU 93 -20.308 -1.452 -3.169 737 HB3 GLU 93 HB1 GLU 93 -19.257 -1.153 -1.789 738 HG2 GLU 93 HG2 GLU 93 -21.301 -0.006 -1.419 739 HG3 GLU 93 HG1 GLU 93 -20.064 1.201 -1.774 740 H ILE 94 HN ILE 94 -17.065 -1.930 -2.549 741 HA ILE 94 HA ILE 94 -15.842 -0.195 -0.660 742 HB ILE 94 HB ILE 94 -14.273 -2.097 -0.221 743 HG12 ILE 94 HG12 ILE 94 -15.989 -3.506 -2.282 744 HG13 ILE 94 HG11 ILE 94 -14.282 -3.107 -2.460 745 HG21 ILE 94 HG21 ILE 94 -16.280 -1.829 1.087 746 HG22 ILE 94 HG22 ILE 94 -16.013 -3.543 0.774 747 HG23 ILE 94 HG23 ILE 94 -17.235 -2.659 -0.142 748 HD11 ILE 94 HD11 ILE 94 -13.742 -4.613 -0.620 749 HD12 ILE 94 HD12 ILE 94 -14.594 -5.448 -1.918 750 HD13 ILE 94 HD13 ILE 94 -15.452 -5.009 -0.442 751 H GLN 95 HN GLN 95 -14.867 -1.375 -3.831 752 HA GLN 95 HA GLN 95 -12.225 -0.295 -3.600 753 HB2 GLN 95 HB2 GLN 95 -13.658 -1.121 -6.102 754 HB3 GLN 95 HB1 GLN 95 -11.951 -0.968 -5.852 755 HG2 GLN 95 HG2 GLN 95 -13.576 -2.919 -4.297 756 HG3 GLN 95 HG1 GLN 95 -12.911 -3.320 -5.879 757 HE21 GLN 95 HE21 GLN 95 -12.426 -4.549 -3.359 758 HE22 GLN 95 HE22 GLN 95 -10.735 -4.381 -3.028 759 H ALA 96 HN ALA 96 -15.319 0.790 -4.841 760 HA ALA 96 HA ALA 96 -14.481 3.017 -6.279 761 HB1 ALA 96 HB1 ALA 96 -16.858 2.911 -4.420 762 HB2 ALA 96 HB2 ALA 96 -16.848 2.342 -6.088 763 HB3 ALA 96 HB3 ALA 96 -16.611 4.055 -5.740 764 H LEU 97 HN LEU 97 -15.008 2.662 -2.792 765 HA LEU 97 HA LEU 97 -14.371 5.253 -2.050 766 HB2 LEU 97 HB2 LEU 97 -15.576 3.522 -0.718 767 HB3 LEU 97 HB1 LEU 97 -14.047 2.683 -0.499 768 HG LEU 97 HG LEU 97 -13.646 5.331 0.181 769 HD11 LEU 97 HD11 LEU 97 -15.263 5.521 2.110 770 HD12 LEU 97 HD12 LEU 97 -16.164 4.191 1.369 771 HD13 LEU 97 HD13 LEU 97 -15.966 5.717 0.504 772 HD21 LEU 97 HD21 LEU 97 -13.075 4.454 2.376 773 HD22 LEU 97 HD22 LEU 97 -12.445 3.414 1.099 774 HD23 LEU 97 HD23 LEU 97 -13.896 2.937 1.986 775 H VAL 98 HN VAL 98 -12.419 2.297 -1.846 776 HA VAL 98 HA VAL 98 -10.070 3.819 -1.122 777 HB VAL 98 HB VAL 98 -10.431 0.843 -1.452 778 HG11 VAL 98 HG11 VAL 98 -8.338 0.672 -0.147 779 HG12 VAL 98 HG12 VAL 98 -8.141 2.419 -0.285 780 HG13 VAL 98 HG13 VAL 98 -8.107 1.410 -1.731 781 HG21 VAL 98 HG21 VAL 98 -11.787 1.499 0.340 782 HG22 VAL 98 HG22 VAL 98 -10.620 2.695 0.902 783 HG23 VAL 98 HG23 VAL 98 -10.284 0.971 1.100 784 H LYS 99 HN LYS 99 -10.958 1.634 -3.790 785 HA LYS 99 HA LYS 99 -8.401 1.726 -5.012 786 HB2 LYS 99 HB2 LYS 99 -9.942 -0.146 -5.389 787 HB3 LYS 99 HB1 LYS 99 -11.081 0.918 -6.199 788 HG2 LYS 99 HG2 LYS 99 -9.191 1.382 -7.859 789 HG3 LYS 99 HG1 LYS 99 -8.381 -0.008 -7.135 790 HD2 LYS 99 HD2 LYS 99 -11.159 -0.083 -8.305 791 HD3 LYS 99 HD1 LYS 99 -9.702 -0.544 -9.183 792 HE2 LYS 99 HE2 LYS 99 -9.271 -2.325 -7.605 793 HE3 LYS 99 HE1 LYS 99 -10.638 -1.813 -6.613 794 HZ1 LYS 99 HZ1 LYS 99 -11.170 -3.721 -8.044 795 HZ2 LYS 99 HZ2 LYS 99 -10.843 -2.786 -9.418 796 HZ3 LYS 99 HZ3 LYS 99 -12.137 -2.378 -8.402 797 H ARG 100 HN ARG 100 -11.269 3.779 -5.283 798 HA ARG 100 HA ARG 100 -10.082 5.179 -7.535 799 HB2 ARG 100 HB2 ARG 100 -12.536 4.998 -7.365 800 HB3 ARG 100 HB1 ARG 100 -12.497 5.917 -5.869 801 HG2 ARG 100 HG2 ARG 100 -11.403 7.075 -8.406 802 HG3 ARG 100 HG1 ARG 100 -13.131 7.117 -8.055 803 HD2 ARG 100 HD2 ARG 100 -12.768 8.395 -6.070 804 HD3 ARG 100 HD1 ARG 100 -11.022 8.168 -6.177 805 HE ARG 100 HE ARG 100 -11.657 9.426 -8.507 806 HH11 ARG 100 HH11 ARG 100 -12.289 10.126 -5.128 807 HH12 ARG 100 HH12 ARG 100 -12.172 11.848 -5.328 808 HH21 ARG 100 HH21 ARG 100 -11.541 11.703 -8.777 809 HH22 ARG 100 HH22 ARG 100 -11.770 12.749 -7.401 810 H ALA 101 HN ALA 101 -10.818 5.951 -4.127 811 HA ALA 101 HA ALA 101 -9.068 8.284 -4.351 812 HB1 ALA 101 HB1 ALA 101 -10.039 9.051 -2.295 813 HB2 ALA 101 HB2 ALA 101 -10.842 7.500 -2.041 814 HB3 ALA 101 HB3 ALA 101 -11.340 8.545 -3.374 815 H SER 102 HN SER 102 -7.327 6.516 -4.543 816 HA SER 102 HA SER 102 -6.529 5.241 -2.102 817 HB2 SER 102 HB2 SER 102 -4.941 5.609 -4.650 818 HB3 SER 102 HB1 SER 102 -4.633 4.432 -3.372 819 HG SER 102 HG SER 102 -7.098 4.006 -4.030 820 HA PRO 103 HA PRO 103 -4.249 8.911 -0.879 821 HB2 PRO 103 HB2 PRO 103 -4.927 8.678 1.765 822 HB3 PRO 103 HB1 PRO 103 -5.995 9.353 0.521 823 HG2 PRO 103 HG2 PRO 103 -6.296 6.884 1.989 824 HG3 PRO 103 HG1 PRO 103 -7.422 7.637 0.851 825 HD2 PRO 103 HD2 PRO 103 -5.453 5.479 0.398 826 HD3 PRO 103 HD1 PRO 103 -6.923 5.880 -0.518 827 H LEU 104 HN LEU 104 -2.167 9.107 -0.279 828 HA LEU 104 HA LEU 104 -1.054 7.164 1.644 829 HB2 LEU 104 HB2 LEU 104 -0.190 7.463 -0.960 830 HB3 LEU 104 HB1 LEU 104 0.888 8.534 -0.086 831 HG LEU 104 HG LEU 104 0.526 5.571 0.371 832 HD11 LEU 104 HD11 LEU 104 2.874 7.185 -0.612 833 HD12 LEU 104 HD12 LEU 104 1.856 6.121 -1.583 834 HD13 LEU 104 HD13 LEU 104 2.871 5.447 -0.309 835 HD21 LEU 104 HD21 LEU 104 0.853 6.705 2.505 836 HD22 LEU 104 HD22 LEU 104 2.281 7.515 1.862 837 HD23 LEU 104 HD23 LEU 104 2.276 5.762 2.058 838 HA PRO 105 HA PRO 105 -0.958 11.104 3.838 839 HB2 PRO 105 HB2 PRO 105 0.140 9.544 6.041 840 HB3 PRO 105 HB1 PRO 105 -1.383 10.428 5.951 841 HG2 PRO 105 HG2 PRO 105 -1.196 7.700 5.980 842 HG3 PRO 105 HG1 PRO 105 -2.531 8.607 5.277 843 HD2 PRO 105 HD2 PRO 105 -0.326 7.183 3.932 844 HD3 PRO 105 HD1 PRO 105 -1.989 7.502 3.380 845 H THR 106 HN THR 106 1.540 8.794 4.760 846 HA THR 106 HA THR 106 3.501 10.900 4.963 847 HB THR 106 HB THR 106 3.516 9.102 6.613 848 HG1 THR 106 HG1 THR 106 5.515 9.994 6.345 849 HG21 THR 106 HG21 THR 106 4.264 7.278 4.326 850 HG22 THR 106 HG22 THR 106 2.741 7.255 5.215 851 HG23 THR 106 HG23 THR 106 4.246 6.838 6.034 852 HA PRO 107 HA PRO 107 4.787 10.533 0.704 853 HB2 PRO 107 HB2 PRO 107 6.989 12.292 1.516 854 HB3 PRO 107 HB1 PRO 107 5.682 12.593 0.369 855 HG2 PRO 107 HG2 PRO 107 5.803 13.840 2.754 856 HG3 PRO 107 HG1 PRO 107 4.260 13.401 1.996 857 HD2 PRO 107 HD2 PRO 107 5.749 12.022 4.202 858 HD3 PRO 107 HD1 PRO 107 4.007 12.339 4.044 859 HA PRO 108 HA PRO 108 8.121 7.597 1.681 860 HB2 PRO 108 HB2 PRO 108 7.484 5.755 -0.105 861 HB3 PRO 108 HB1 PRO 108 6.432 6.011 1.299 862 HG2 PRO 108 HG2 PRO 108 6.117 7.040 -1.505 863 HG3 PRO 108 HG1 PRO 108 4.905 6.259 -0.473 864 HD2 PRO 108 HD2 PRO 108 5.149 8.982 -0.758 865 HD3 PRO 108 HD1 PRO 108 4.477 8.200 0.688 866 H ALA 109 HN ALA 109 8.994 9.798 0.583 867 HA ALA 109 HA ALA 109 9.705 9.875 -2.092 868 HB1 ALA 109 HB1 ALA 109 10.003 11.766 -0.572 869 HB2 ALA 109 HB2 ALA 109 11.498 11.393 -1.430 870 HB3 ALA 109 HB3 ALA 109 11.301 10.901 0.251 871 H ASP 110 HN ASP 110 11.425 8.462 0.645 872 HA ASP 110 HA ASP 110 13.635 7.628 -0.947 873 HB2 ASP 110 HB2 ASP 110 12.881 6.848 1.869 874 HB3 ASP 110 HB1 ASP 110 14.434 6.526 1.101 875 H ALA 111 HN ALA 111 10.652 6.527 -1.053 876 HA ALA 111 HA ALA 111 11.421 3.703 -1.321 877 HB1 ALA 111 HB1 ALA 111 8.685 4.960 -1.120 878 HB2 ALA 111 HB2 ALA 111 9.531 4.087 0.161 879 HB3 ALA 111 HB3 ALA 111 9.007 3.232 -1.291 880 H TYR 112 HN TYR 112 9.996 6.462 -3.016 881 HA TYR 112 HA TYR 112 9.907 4.794 -5.419 882 HB2 TYR 112 HB2 TYR 112 8.377 6.532 -6.391 883 HB3 TYR 112 HB1 TYR 112 7.754 5.506 -5.123 884 HD1 TYR 112 HD2 TYR 112 9.718 8.687 -4.883 885 HD2 TYR 112 HD1 TYR 112 6.079 6.627 -4.147 886 HE1 TYR 112 HE2 TYR 112 8.855 10.646 -3.670 887 HE2 TYR 112 HE1 TYR 112 5.196 8.553 -2.950 888 HH TYR 112 HH TYR 112 6.016 10.517 -1.763 889 H VAL 113 HN VAL 113 12.107 6.462 -4.213 890 HA VAL 113 HA VAL 113 12.789 8.278 -6.306 891 HB VAL 113 HB VAL 113 15.200 7.900 -5.460 892 HG11 VAL 113 HG11 VAL 113 13.109 8.968 -3.567 893 HG12 VAL 113 HG12 VAL 113 13.855 9.852 -4.898 894 HG13 VAL 113 HG13 VAL 113 14.832 9.343 -3.521 895 HG21 VAL 113 HG21 VAL 113 15.460 6.914 -3.274 896 HG22 VAL 113 HG22 VAL 113 14.734 5.725 -4.356 897 HG23 VAL 113 HG23 VAL 113 13.733 6.575 -3.177 898 H ASN 114 HN ASN 114 12.391 7.304 -8.138 899 HA ASN 114 HA ASN 114 14.130 5.895 -9.655 900 HB2 ASN 114 HB2 ASN 114 13.616 3.593 -9.554 901 HB3 ASN 114 HB1 ASN 114 13.703 4.055 -7.861 902 HD21 ASN 114 HD21 ASN 114 11.734 4.221 -6.663 903 HD22 ASN 114 HD22 ASN 114 10.309 3.407 -7.199 904 H GLY 115 HN GLY 115 10.793 6.219 -8.638 905 HA2 GLY 115 HA2 GLY 115 9.900 7.366 -11.039 906 HA3 GLY 115 HA1 GLY 115 9.501 5.652 -11.058 907 H THR 116 HN THR 116 8.320 4.835 -9.118 908 HA THR 116 HA THR 116 6.786 6.684 -7.551 909 HB THR 116 HB THR 116 4.615 5.472 -8.505 910 HG1 THR 116 HG1 THR 116 5.886 5.862 -10.967 911 HG21 THR 116 HG21 THR 116 4.195 7.442 -9.911 912 HG22 THR 116 HG22 THR 116 5.900 7.877 -9.792 913 HG23 THR 116 HG23 THR 116 4.885 7.879 -8.347 914 H VAL 117 HN VAL 117 5.004 5.332 -6.317 915 HA VAL 117 HA VAL 117 6.271 2.789 -5.586 916 HB VAL 117 HB VAL 117 4.867 2.914 -3.497 917 HG11 VAL 117 HG11 VAL 117 6.859 5.128 -3.925 918 HG12 VAL 117 HG12 VAL 117 7.218 3.468 -3.448 919 HG13 VAL 117 HG13 VAL 117 6.312 4.521 -2.362 920 HG21 VAL 117 HG21 VAL 117 4.044 5.145 -2.803 921 HG22 VAL 117 HG22 VAL 117 3.153 4.469 -4.165 922 HG23 VAL 117 HG23 VAL 117 4.352 5.737 -4.439 923 H GLU 118 HN GLU 118 5.387 1.200 -6.728 924 HA GLU 118 HA GLU 118 2.458 0.977 -6.698 925 HB2 GLU 118 HB2 GLU 118 3.754 0.602 -8.865 926 HB3 GLU 118 HB1 GLU 118 4.417 -0.845 -8.113 927 HG2 GLU 118 HG2 GLU 118 1.996 -1.546 -7.738 928 HG3 GLU 118 HG1 GLU 118 1.579 -0.264 -8.874 929 H LEU 119 HN LEU 119 1.722 -0.039 -4.928 930 HA LEU 119 HA LEU 119 3.162 -2.385 -3.983 931 HB2 LEU 119 HB2 LEU 119 3.429 -1.651 -1.761 932 HB3 LEU 119 HB1 LEU 119 4.020 -0.347 -2.765 933 HG LEU 119 HG LEU 119 1.505 0.532 -2.369 934 HD11 LEU 119 HD11 LEU 119 0.821 -1.351 -1.051 935 HD12 LEU 119 HD12 LEU 119 0.888 0.096 -0.043 936 HD13 LEU 119 HD13 LEU 119 2.175 -1.106 0.054 937 HD21 LEU 119 HD21 LEU 119 2.391 1.927 -0.573 938 HD22 LEU 119 HD22 LEU 119 3.553 1.783 -1.893 939 HD23 LEU 119 HD23 LEU 119 3.779 0.851 -0.413 940 H THR 120 HN THR 120 1.892 -3.792 -2.713 941 HA THR 120 HA THR 120 -0.961 -3.457 -3.263 942 HB THR 120 HB THR 120 0.512 -5.959 -2.430 943 HG1 THR 120 HG1 THR 120 1.241 -5.580 -4.448 944 HG21 THR 120 HG21 THR 120 -1.494 -7.112 -3.159 945 HG22 THR 120 HG22 THR 120 -2.242 -5.577 -3.599 946 HG23 THR 120 HG23 THR 120 -1.887 -5.931 -1.906 947 H LEU 121 HN LEU 121 -2.362 -3.079 -1.703 948 HA LEU 121 HA LEU 121 -1.662 -3.820 1.060 949 HB2 LEU 121 HB2 LEU 121 -3.066 -1.317 0.104 950 HB3 LEU 121 HB1 LEU 121 -3.004 -1.822 1.782 951 HG LEU 121 HG LEU 121 -0.624 -1.091 0.070 952 HD11 LEU 121 HD11 LEU 121 -2.000 0.831 0.713 953 HD12 LEU 121 HD12 LEU 121 -0.420 0.845 1.492 954 HD13 LEU 121 HD13 LEU 121 -1.852 0.364 2.408 955 HD21 LEU 121 HD21 LEU 121 -0.122 -2.860 1.688 956 HD22 LEU 121 HD22 LEU 121 -0.771 -1.858 2.988 957 HD23 LEU 121 HD23 LEU 121 0.674 -1.344 2.117 958 HA PRO 122 HA PRO 122 -5.546 -5.961 0.489 959 HB2 PRO 122 HB2 PRO 122 -5.660 -7.114 2.938 960 HB3 PRO 122 HB1 PRO 122 -4.647 -7.736 1.630 961 HG2 PRO 122 HG2 PRO 122 -3.892 -6.082 3.993 962 HG3 PRO 122 HG1 PRO 122 -3.025 -7.410 3.217 963 HD2 PRO 122 HD2 PRO 122 -2.419 -4.770 2.828 964 HD3 PRO 122 HD1 PRO 122 -2.073 -6.048 1.646 965 H ILE 123 HN ILE 123 -7.391 -4.939 0.603 966 HA ILE 123 HA ILE 123 -7.995 -3.295 2.947 967 HB ILE 123 HB ILE 123 -10.020 -2.554 1.571 968 HG12 ILE 123 HG12 ILE 123 -8.391 -3.411 -0.836 969 HG13 ILE 123 HG11 ILE 123 -9.696 -4.416 -0.177 970 HG21 ILE 123 HG21 ILE 123 -8.176 -1.091 1.998 971 HG22 ILE 123 HG22 ILE 123 -8.700 -0.894 0.323 972 HG23 ILE 123 HG23 ILE 123 -7.244 -1.820 0.689 973 HD11 ILE 123 HD11 ILE 123 -9.947 -1.591 -1.179 974 HD12 ILE 123 HD12 ILE 123 -11.257 -2.568 -0.520 975 HD13 ILE 123 HD13 ILE 123 -10.467 -3.049 -2.021 976 H ASP 124 HN ASP 124 -8.692 -4.642 4.484 977 HA ASP 124 HA ASP 124 -10.636 -6.708 3.745 978 HB2 ASP 124 HB2 ASP 124 -10.056 -7.639 6.048 979 HB3 ASP 124 HB1 ASP 124 -8.802 -7.715 4.817 980 H PHE 125 HN PHE 125 -12.650 -6.418 4.169 981 HA PHE 125 HA PHE 125 -13.426 -4.985 6.618 982 HB2 PHE 125 HB2 PHE 125 -14.990 -5.363 4.057 983 HB3 PHE 125 HB1 PHE 125 -15.596 -4.554 5.493 984 HD1 PHE 125 HD2 PHE 125 -14.095 -2.564 6.338 985 HD2 PHE 125 HD1 PHE 125 -14.055 -4.122 2.380 986 HE1 PHE 125 HE2 PHE 125 -13.118 -0.458 5.525 987 HE2 PHE 125 HE1 PHE 125 -13.076 -2.017 1.559 988 HZ PHE 125 HZ PHE 125 -12.607 -0.183 3.134 989 H SER 126 HN SER 126 -15.088 -6.009 7.880 990 HA SER 126 HA SER 126 -14.888 -8.795 8.078 991 HB2 SER 126 HB2 SER 126 -17.185 -7.108 9.091 992 HB3 SER 126 HB1 SER 126 -16.600 -8.634 9.758 993 HG SER 126 HG SER 126 -15.893 -6.666 10.868 994 H LEU 127 HN LEU 127 -15.460 -10.066 6.402 995 HA LEU 127 HA LEU 127 -17.731 -9.402 4.737 996 HB2 LEU 127 HB2 LEU 127 -15.372 -10.554 4.178 997 HB3 LEU 127 HB1 LEU 127 -16.332 -11.999 4.421 998 HG LEU 127 HG LEU 127 -17.075 -9.811 2.479 999 HD11 LEU 127 HD11 LEU 127 -16.235 -11.232 0.722 1000 HD12 LEU 127 HD12 LEU 127 -15.712 -12.430 1.909 1001 HD13 LEU 127 HD13 LEU 127 -14.946 -10.842 1.861 1002 HD21 LEU 127 HD21 LEU 127 -18.950 -11.178 3.199 1003 HD22 LEU 127 HD22 LEU 127 -18.060 -12.640 2.772 1004 HD23 LEU 127 HD23 LEU 127 -18.539 -11.498 1.513 1005 H ARG 128 HN ARG 128 -19.255 -9.594 6.522 1006 HA ARG 128 HA ARG 128 -20.426 -12.255 6.451 1007 HB2 ARG 128 HB2 ARG 128 -21.098 -11.848 8.920 1008 HB3 ARG 128 HB1 ARG 128 -19.488 -12.444 8.554 1009 HG2 ARG 128 HG2 ARG 128 -18.490 -10.374 8.997 1010 HG3 ARG 128 HG1 ARG 128 -20.036 -9.526 8.952 1011 HD2 ARG 128 HD2 ARG 128 -20.730 -10.533 10.999 1012 HD3 ARG 128 HD1 ARG 128 -19.359 -11.641 10.985 1013 HE ARG 128 HE ARG 128 -17.967 -9.916 11.698 1014 HH11 ARG 128 HH11 ARG 128 -21.233 -8.753 11.185 1015 HH12 ARG 128 HH12 ARG 128 -20.988 -7.288 12.083 1016 HH21 ARG 128 HH21 ARG 128 -17.640 -8.027 12.883 1017 HH22 ARG 128 HH22 ARG 128 -18.931 -6.872 13.070 1018 H GLY 129 HN GLY 129 -22.191 -11.873 5.340 1019 HA2 GLY 129 HA2 GLY 129 -24.514 -10.857 6.089 1020 HA3 GLY 129 HA1 GLY 129 -23.664 -9.370 5.684 1021 H ALA 130 HN ALA 130 -22.384 -9.710 3.496 1022 HA ALA 130 HA ALA 130 -24.190 -10.981 1.549 1023 HB1 ALA 130 HB1 ALA 130 -24.323 -8.563 1.340 1024 HB2 ALA 130 HB2 ALA 130 -23.506 -9.248 -0.066 1025 HB3 ALA 130 HB3 ALA 130 -22.567 -8.456 1.199 1026 H GLY 131 HN GLY 131 -22.641 -10.909 -0.689 1027 HA2 GLY 131 HA2 GLY 131 -20.562 -11.541 -1.606 1028 HA3 GLY 131 HA1 GLY 131 -19.981 -11.894 0.016 1029 H PHE 132 HN PHE 132 -23.013 -13.165 -0.408 1030 HA PHE 132 HA PHE 132 -21.958 -15.840 -0.714 1031 HB2 PHE 132 HB2 PHE 132 -24.359 -16.519 -0.315 1032 HB3 PHE 132 HB1 PHE 132 -23.601 -15.638 1.003 1033 HD1 PHE 132 HD1 PHE 132 -24.212 -13.262 1.403 1034 HD2 PHE 132 HD2 PHE 132 -26.271 -15.674 -1.436 1035 HE1 PHE 132 HE1 PHE 132 -26.084 -11.668 1.407 1036 HE2 PHE 132 HE2 PHE 132 -28.141 -14.080 -1.434 1037 HZ PHE 132 HZ PHE 132 -28.049 -12.074 -0.013 Start of MODEL 10 1 H1 LYS 2 HT1 LYS 2 36.012 20.450 30.446 2 H2 LYS 2 HT2 LYS 2 37.700 20.403 30.285 3 H3 LYS 2 HT3 LYS 2 36.984 20.201 31.810 4 HA LYS 2 HA LYS 2 36.614 18.358 29.533 5 HB2 LYS 2 HB2 LYS 2 38.918 18.261 30.227 6 HB3 LYS 2 HB1 LYS 2 38.460 18.221 31.922 7 HG2 LYS 2 HG2 LYS 2 37.574 16.012 31.701 8 HG3 LYS 2 HG1 LYS 2 37.778 16.057 29.950 9 HD2 LYS 2 HD2 LYS 2 40.122 15.960 30.110 10 HD3 LYS 2 HD1 LYS 2 40.101 16.370 31.826 11 HE2 LYS 2 HE2 LYS 2 38.851 13.851 30.762 12 HE3 LYS 2 HE1 LYS 2 40.555 13.936 31.216 13 HZ1 LYS 2 HZ1 LYS 2 39.955 14.496 33.443 14 HZ2 LYS 2 HZ2 LYS 2 39.084 13.109 33.011 15 HZ3 LYS 2 HZ3 LYS 2 38.310 14.622 33.045 16 H VAL 3 HN VAL 3 34.459 18.004 29.838 17 HA VAL 3 HA VAL 3 33.717 16.806 32.431 18 HB VAL 3 HB VAL 3 31.404 17.619 32.072 19 HG11 VAL 3 HG11 VAL 3 32.940 18.849 33.526 20 HG12 VAL 3 HG12 VAL 3 31.813 19.938 32.715 21 HG13 VAL 3 HG13 VAL 3 33.479 19.811 32.148 22 HG21 VAL 3 HG21 VAL 3 32.624 19.201 29.807 23 HG22 VAL 3 HG22 VAL 3 30.986 19.397 30.430 24 HG23 VAL 3 HG23 VAL 3 31.457 17.887 29.652 25 H GLN 4 HN GLN 4 34.386 16.109 29.368 26 HA GLN 4 HA GLN 4 32.207 14.159 29.021 27 HB2 GLN 4 HB2 GLN 4 32.665 15.938 27.239 28 HB3 GLN 4 HB1 GLN 4 34.162 15.082 26.911 29 HG2 GLN 4 HG2 GLN 4 32.489 14.437 25.316 30 HG3 GLN 4 HG1 GLN 4 32.864 13.069 26.363 31 HE21 GLN 4 HE21 GLN 4 30.890 12.117 25.811 32 HE22 GLN 4 HE22 GLN 4 29.400 12.666 26.508 33 H GLU 5 HN GLU 5 34.020 13.494 30.871 34 HA GLU 5 HA GLU 5 36.303 12.128 29.823 35 HB2 GLU 5 HB2 GLU 5 36.336 13.112 32.054 36 HB3 GLU 5 HB1 GLU 5 35.024 12.060 32.561 37 HG2 GLU 5 HG2 GLU 5 36.424 10.126 32.372 38 HG3 GLU 5 HG1 GLU 5 37.728 11.083 31.671 39 H GLN 6 HN GLN 6 36.289 10.237 28.872 40 HA GLN 6 HA GLN 6 35.734 8.157 28.175 41 HB2 GLN 6 HB2 GLN 6 35.905 7.629 30.628 42 HB3 GLN 6 HB1 GLN 6 34.171 7.890 30.754 43 HG2 GLN 6 HG2 GLN 6 34.653 5.535 30.597 44 HG3 GLN 6 HG1 GLN 6 33.786 6.077 29.159 45 HE21 GLN 6 HE21 GLN 6 34.521 4.367 27.928 46 HE22 GLN 6 HE22 GLN 6 36.163 4.254 27.383 47 H SER 7 HN SER 7 34.528 9.490 26.631 48 HA SER 7 HA SER 7 31.710 9.867 27.001 49 HB2 SER 7 HB2 SER 7 33.122 11.447 25.711 50 HB3 SER 7 HB1 SER 7 33.389 10.191 24.504 51 HG SER 7 HG SER 7 31.203 10.226 24.017 52 H VAL 8 HN VAL 8 30.042 8.722 26.184 53 HA VAL 8 HA VAL 8 30.661 6.223 24.779 54 HB VAL 8 HB VAL 8 28.332 5.572 25.243 55 HG11 VAL 8 HG11 VAL 8 30.098 5.018 26.847 56 HG12 VAL 8 HG12 VAL 8 28.548 5.277 27.649 57 HG13 VAL 8 HG13 VAL 8 29.789 6.530 27.703 58 HG21 VAL 8 HG21 VAL 8 27.335 7.819 25.227 59 HG22 VAL 8 HG22 VAL 8 28.142 8.179 26.752 60 HG23 VAL 8 HG23 VAL 8 26.909 6.921 26.682 61 H GLY 9 HN GLY 9 28.781 5.639 23.143 62 HA2 GLY 9 HA2 GLY 9 27.392 7.612 21.757 63 HA3 GLY 9 HA1 GLY 9 28.979 7.489 21.011 64 H ALA 10 HN ALA 10 26.536 6.906 19.715 65 HA ALA 10 HA ALA 10 26.573 3.974 19.498 66 HB1 ALA 10 HB1 ALA 10 24.528 5.947 18.487 67 HB2 ALA 10 HB2 ALA 10 24.396 4.992 19.964 68 HB3 ALA 10 HB3 ALA 10 24.413 4.188 18.395 69 HA PRO 11 HA PRO 11 28.458 4.710 15.494 70 HB2 PRO 11 HB2 PRO 11 29.508 2.162 15.349 71 HB3 PRO 11 HB1 PRO 11 30.290 3.528 16.143 72 HG2 PRO 11 HG2 PRO 11 29.205 1.158 17.347 73 HG3 PRO 11 HG1 PRO 11 30.031 2.508 18.135 74 HD2 PRO 11 HD2 PRO 11 27.146 1.944 17.918 75 HD3 PRO 11 HD1 PRO 11 28.013 2.970 19.079 76 HA PRO 12 HA PRO 12 24.720 3.025 13.492 77 HB2 PRO 12 HB2 PRO 12 26.038 4.498 11.265 78 HB3 PRO 12 HB1 PRO 12 24.348 4.510 11.783 79 HG2 PRO 12 HG2 PRO 12 25.946 6.547 12.374 80 HG3 PRO 12 HG1 PRO 12 24.768 5.951 13.559 81 HD2 PRO 12 HD2 PRO 12 27.723 5.539 13.447 82 HD3 PRO 12 HD1 PRO 12 26.668 5.776 14.854 83 HA PRO 13 HA PRO 13 27.272 0.735 10.088 84 HB2 PRO 13 HB2 PRO 13 29.976 0.822 10.174 85 HB3 PRO 13 HB1 PRO 13 29.010 1.997 9.275 86 HG2 PRO 13 HG2 PRO 13 30.243 2.245 11.993 87 HG3 PRO 13 HG1 PRO 13 30.222 3.418 10.663 88 HD2 PRO 13 HD2 PRO 13 28.526 3.582 12.757 89 HD3 PRO 13 HD1 PRO 13 28.066 4.094 11.120 90 H GLY 14 HN GLY 14 26.441 -0.188 12.510 91 HA2 GLY 14 HA2 GLY 14 28.425 -1.854 13.758 92 HA3 GLY 14 HA1 GLY 14 26.681 -1.938 14.003 93 H ARG 15 HN ARG 15 25.819 -2.346 11.421 94 HA ARG 15 HA ARG 15 27.075 -4.907 10.676 95 HB2 ARG 15 HB2 ARG 15 24.153 -4.200 10.336 96 HB3 ARG 15 HB1 ARG 15 24.906 -5.762 10.044 97 HG2 ARG 15 HG2 ARG 15 25.414 -5.932 12.450 98 HG3 ARG 15 HG1 ARG 15 24.564 -4.408 12.711 99 HD2 ARG 15 HD2 ARG 15 23.430 -7.020 11.737 100 HD3 ARG 15 HD1 ARG 15 23.042 -6.156 13.226 101 HE ARG 15 HE ARG 15 22.351 -5.149 10.535 102 HH11 ARG 15 HH11 ARG 15 21.578 -5.658 13.918 103 HH12 ARG 15 HH12 ARG 15 20.016 -4.894 13.792 104 HH21 ARG 15 HH21 ARG 15 20.321 -4.182 10.371 105 HH22 ARG 15 HH22 ARG 15 19.288 -4.081 11.768 106 H ALA 16 HN ALA 16 28.348 -3.210 9.410 107 HA ALA 16 HA ALA 16 26.962 -2.071 7.123 108 HB1 ALA 16 HB1 ALA 16 28.680 -0.773 8.306 109 HB2 ALA 16 HB2 ALA 16 29.088 -1.019 6.608 110 HB3 ALA 16 HB3 ALA 16 29.888 -1.978 7.854 111 H ASP 17 HN ASP 17 26.386 -4.339 6.489 112 HA ASP 17 HA ASP 17 28.540 -5.873 5.275 113 HB2 ASP 17 HB2 ASP 17 25.572 -6.457 5.421 114 HB3 ASP 17 HB1 ASP 17 26.806 -7.560 4.819 115 H LYS 18 HN LYS 18 28.480 -6.559 3.069 116 HA LYS 18 HA LYS 18 27.241 -4.532 1.322 117 HB2 LYS 18 HB2 LYS 18 29.744 -6.179 0.890 118 HB3 LYS 18 HB1 LYS 18 29.046 -5.103 -0.308 119 HG2 LYS 18 HG2 LYS 18 30.835 -3.928 0.660 120 HG3 LYS 18 HG1 LYS 18 29.375 -3.234 1.366 121 HD2 LYS 18 HD2 LYS 18 29.695 -4.579 3.375 122 HD3 LYS 18 HD1 LYS 18 31.130 -5.320 2.664 123 HE2 LYS 18 HE2 LYS 18 32.255 -3.177 2.625 124 HE3 LYS 18 HE1 LYS 18 30.805 -2.377 3.231 125 HZ1 LYS 18 HZ1 LYS 18 32.545 -2.864 4.937 126 HZ2 LYS 18 HZ2 LYS 18 32.216 -4.515 4.729 127 HZ3 LYS 18 HZ3 LYS 18 31.006 -3.475 5.297 128 H THR 19 HN THR 19 25.299 -5.842 1.395 129 HA THR 19 HA THR 19 25.321 -8.473 0.246 130 HB THR 19 HB THR 19 22.884 -6.731 0.610 131 HG1 THR 19 HG1 THR 19 23.154 -6.836 2.707 132 HG21 THR 19 HG21 THR 19 22.559 -8.860 -0.552 133 HG22 THR 19 HG22 THR 19 21.790 -8.892 1.035 134 HG23 THR 19 HG23 THR 19 23.328 -9.717 0.785 135 H ALA 20 HN ALA 20 26.051 -8.427 -1.846 136 HA ALA 20 HA ALA 20 24.365 -6.972 -3.768 137 HB1 ALA 20 HB1 ALA 20 26.341 -6.415 -5.105 138 HB2 ALA 20 HB2 ALA 20 27.379 -7.134 -3.875 139 HB3 ALA 20 HB3 ALA 20 26.431 -5.696 -3.498 140 H ALA 21 HN ALA 21 23.350 -8.469 -4.838 141 HA ALA 21 HA ALA 21 24.815 -10.602 -6.157 142 HB1 ALA 21 HB1 ALA 21 23.371 -12.369 -5.277 143 HB2 ALA 21 HB2 ALA 21 22.542 -11.196 -4.253 144 HB3 ALA 21 HB3 ALA 21 24.242 -11.570 -3.967 145 HA PRO 22 HA PRO 22 21.670 -10.199 -9.345 146 HB2 PRO 22 HB2 PRO 22 20.390 -12.684 -9.337 147 HB3 PRO 22 HB1 PRO 22 21.816 -12.256 -10.285 148 HG2 PRO 22 HG2 PRO 22 21.634 -13.704 -7.682 149 HG3 PRO 22 HG1 PRO 22 22.736 -13.975 -9.044 150 HD2 PRO 22 HD2 PRO 22 23.566 -12.742 -6.826 151 HD3 PRO 22 HD1 PRO 22 24.126 -12.214 -8.428 152 H GLN 23 HN GLN 23 20.731 -11.391 -6.214 153 HA GLN 23 HA GLN 23 17.914 -10.961 -6.623 154 HB2 GLN 23 HB2 GLN 23 19.552 -11.705 -4.213 155 HB3 GLN 23 HB1 GLN 23 17.821 -11.411 -4.122 156 HG2 GLN 23 HG2 GLN 23 17.438 -13.202 -5.740 157 HG3 GLN 23 HG1 GLN 23 19.174 -13.506 -5.807 158 HE21 GLN 23 HE21 GLN 23 16.898 -15.206 -4.953 159 HE22 GLN 23 HE22 GLN 23 17.307 -15.723 -3.352 160 H THR 24 HN THR 24 20.586 -9.034 -5.470 161 HA THR 24 HA THR 24 18.879 -7.306 -3.896 162 HB THR 24 HB THR 24 20.949 -5.963 -3.542 163 HG1 THR 24 HG1 THR 24 22.174 -6.375 -5.332 164 HG21 THR 24 HG21 THR 24 22.090 -7.651 -2.177 165 HG22 THR 24 HG22 THR 24 21.183 -8.922 -2.997 166 HG23 THR 24 HG23 THR 24 20.340 -7.744 -1.991 167 H ARG 25 HN ARG 25 18.491 -7.574 -6.832 168 HA ARG 25 HA ARG 25 18.434 -4.677 -7.364 169 HB2 ARG 25 HB2 ARG 25 18.584 -5.165 -9.773 170 HB3 ARG 25 HB1 ARG 25 20.009 -5.722 -8.909 171 HG2 ARG 25 HG2 ARG 25 19.123 -8.007 -8.943 172 HG3 ARG 25 HG1 ARG 25 17.714 -7.437 -9.841 173 HD2 ARG 25 HD2 ARG 25 19.095 -6.780 -11.693 174 HD3 ARG 25 HD1 ARG 25 20.560 -7.144 -10.782 175 HE ARG 25 HE ARG 25 18.785 -9.395 -11.101 176 HH11 ARG 25 HH11 ARG 25 21.411 -7.570 -12.560 177 HH12 ARG 25 HH12 ARG 25 21.998 -8.928 -13.482 178 HH21 ARG 25 HH21 ARG 25 19.558 -11.161 -12.306 179 HH22 ARG 25 HH22 ARG 25 20.953 -10.967 -13.327 180 H LEU 26 HN LEU 26 16.698 -7.348 -6.616 181 HA LEU 26 HA LEU 26 14.221 -6.212 -7.670 182 HB2 LEU 26 HB2 LEU 26 15.131 -9.057 -8.112 183 HB3 LEU 26 HB1 LEU 26 13.463 -8.546 -8.289 184 HG LEU 26 HG LEU 26 15.762 -7.434 -9.905 185 HD11 LEU 26 HD11 LEU 26 15.405 -9.790 -10.422 186 HD12 LEU 26 HD12 LEU 26 14.862 -8.762 -11.749 187 HD13 LEU 26 HD13 LEU 26 13.683 -9.486 -10.655 188 HD21 LEU 26 HD21 LEU 26 14.027 -6.464 -11.289 189 HD22 LEU 26 HD22 LEU 26 13.838 -5.919 -9.623 190 HD23 LEU 26 HD23 LEU 26 12.778 -7.173 -10.266 191 H THR 27 HN THR 27 15.310 -6.192 -5.045 192 HA THR 27 HA THR 27 13.595 -8.125 -3.646 193 HB THR 27 HB THR 27 16.001 -8.178 -3.032 194 HG1 THR 27 HG1 THR 27 15.108 -8.854 -1.252 195 HG21 THR 27 HG21 THR 27 16.968 -6.353 -1.716 196 HG22 THR 27 HG22 THR 27 15.507 -5.396 -1.963 197 HG23 THR 27 HG23 THR 27 16.534 -5.807 -3.337 198 HA PRO 28 HA PRO 28 10.891 -4.774 -2.698 199 HB2 PRO 28 HB2 PRO 28 9.686 -6.374 -0.598 200 HB3 PRO 28 HB1 PRO 28 9.046 -5.983 -2.194 201 HG2 PRO 28 HG2 PRO 28 9.816 -8.490 -1.477 202 HG3 PRO 28 HG1 PRO 28 9.894 -7.892 -3.145 203 HD2 PRO 28 HD2 PRO 28 12.086 -8.110 -1.107 204 HD3 PRO 28 HD1 PRO 28 12.114 -8.520 -2.837 205 H TYR 29 HN TYR 29 13.172 -4.031 -1.590 206 HA TYR 29 HA TYR 29 12.306 -3.171 1.082 207 HB2 TYR 29 HB2 TYR 29 14.084 -4.827 1.394 208 HB3 TYR 29 HB1 TYR 29 15.139 -3.917 0.314 209 HD1 TYR 29 HD2 TYR 29 13.296 -3.671 3.540 210 HD2 TYR 29 HD1 TYR 29 16.512 -2.204 1.165 211 HE1 TYR 29 HE2 TYR 29 14.098 -2.341 5.449 212 HE2 TYR 29 HE1 TYR 29 17.318 -0.872 3.067 213 HH TYR 29 HH TYR 29 16.237 -1.323 6.233 214 H ALA 30 HN ALA 30 11.808 -1.122 0.838 215 HA ALA 30 HA ALA 30 13.468 0.605 -0.843 216 HB1 ALA 30 HB1 ALA 30 10.791 1.112 0.459 217 HB2 ALA 30 HB2 ALA 30 11.066 0.708 -1.234 218 HB3 ALA 30 HB3 ALA 30 11.644 2.243 -0.589 219 H GLN 31 HN GLN 31 11.742 1.018 2.218 220 HA GLN 31 HA GLN 31 13.995 1.398 3.844 221 HB2 GLN 31 HB2 GLN 31 14.215 3.514 2.560 222 HB3 GLN 31 HB1 GLN 31 12.588 3.967 3.056 223 HG2 GLN 31 HG2 GLN 31 13.259 4.116 5.347 224 HG3 GLN 31 HG1 GLN 31 14.844 3.438 4.976 225 HE21 GLN 31 HE21 GLN 31 16.365 4.696 3.944 226 HE22 GLN 31 HE22 GLN 31 16.242 6.417 3.850 227 H ALA 32 HN ALA 32 10.709 2.549 3.271 228 HA ALA 32 HA ALA 32 9.948 1.733 5.973 229 HB1 ALA 32 HB1 ALA 32 7.811 2.836 5.497 230 HB2 ALA 32 HB2 ALA 32 8.361 3.197 3.860 231 HB3 ALA 32 HB3 ALA 32 9.169 3.932 5.246 232 H GLY 33 HN GLY 33 7.560 0.718 5.883 233 HA2 GLY 33 HA2 GLY 33 6.186 -0.797 4.515 234 HA3 GLY 33 HA1 GLY 33 7.681 -1.459 3.874 235 H GLU 34 HN GLU 34 8.154 -0.751 6.990 236 HA GLU 34 HA GLU 34 7.683 -3.487 7.893 237 HB2 GLU 34 HB2 GLU 34 9.218 -1.196 9.147 238 HB3 GLU 34 HB1 GLU 34 9.057 -2.792 9.865 239 HG2 GLU 34 HG2 GLU 34 10.309 -2.279 7.178 240 HG3 GLU 34 HG1 GLU 34 11.213 -2.384 8.688 241 H ASP 35 HN ASP 35 6.402 -0.426 7.956 242 HA ASP 35 HA ASP 35 4.837 -0.892 10.395 243 HB2 ASP 35 HB2 ASP 35 4.510 1.568 10.414 244 HB3 ASP 35 HB1 ASP 35 6.204 1.111 10.531 245 H ASN 36 HN ASN 36 2.605 -0.007 10.322 246 HA ASN 36 HA ASN 36 1.381 -0.690 7.741 247 HB2 ASN 36 HB2 ASN 36 0.739 -1.884 9.903 248 HB3 ASN 36 HB1 ASN 36 -0.008 -0.372 10.405 249 HD21 ASN 36 HD21 ASN 36 -1.215 -2.949 9.974 250 HD22 ASN 36 HD22 ASN 36 -2.430 -2.736 8.763 251 H TRP 37 HN TRP 37 0.750 0.952 6.484 252 HA TRP 37 HA TRP 37 0.356 3.585 7.727 253 HB2 TRP 37 HB2 TRP 37 0.475 3.472 4.792 254 HB3 TRP 37 HB1 TRP 37 1.299 4.548 5.913 255 HD1 TRP 37 HD1 TRP 37 3.509 3.340 7.189 256 HE1 TRP 37 HE1 TRP 37 5.292 1.826 6.121 257 HE3 TRP 37 HE3 TRP 37 0.914 1.870 3.045 258 HZ2 TRP 37 HZ2 TRP 37 5.555 0.224 3.795 259 HZ3 TRP 37 HZ3 TRP 37 1.996 0.346 1.450 260 HH2 TRP 37 HH2 TRP 37 4.264 -0.453 1.814 261 H ARG 38 HN ARG 38 -1.602 1.135 6.907 262 HA ARG 38 HA ARG 38 -3.229 2.322 4.896 263 HB2 ARG 38 HB2 ARG 38 -4.701 0.510 5.081 264 HB3 ARG 38 HB1 ARG 38 -3.096 -0.154 5.352 265 HG2 ARG 38 HG2 ARG 38 -3.484 -0.432 7.651 266 HG3 ARG 38 HG1 ARG 38 -4.913 0.609 7.617 267 HD2 ARG 38 HD2 ARG 38 -5.978 -1.047 6.096 268 HD3 ARG 38 HD1 ARG 38 -4.608 -2.119 6.373 269 HE ARG 38 HE ARG 38 -5.657 -1.397 8.854 270 HH11 ARG 38 HH11 ARG 38 -6.578 -3.230 6.016 271 HH12 ARG 38 HH12 ARG 38 -7.717 -4.235 6.867 272 HH21 ARG 38 HH21 ARG 38 -7.154 -2.694 9.976 273 HH22 ARG 38 HH22 ARG 38 -8.050 -3.922 9.123 274 H SER 39 HN SER 39 -3.355 2.320 8.396 275 HA SER 39 HA SER 39 -5.948 3.472 8.561 276 HB2 SER 39 HB2 SER 39 -5.128 4.070 10.922 277 HB3 SER 39 HB1 SER 39 -5.180 2.355 10.496 278 HG SER 39 HG SER 39 -3.134 2.281 10.894 279 H ARG 40 HN ARG 40 -2.684 4.708 8.227 280 HA ARG 40 HA ARG 40 -3.268 7.448 8.526 281 HB2 ARG 40 HB2 ARG 40 -1.149 6.255 6.734 282 HB3 ARG 40 HB1 ARG 40 -1.144 7.787 7.558 283 HG2 ARG 40 HG2 ARG 40 -1.010 5.149 8.956 284 HG3 ARG 40 HG1 ARG 40 0.389 6.147 8.558 285 HD2 ARG 40 HD2 ARG 40 -0.814 7.999 9.858 286 HD3 ARG 40 HD1 ARG 40 -1.839 6.709 10.487 287 HE ARG 40 HE ARG 40 0.689 5.805 10.942 288 HH11 ARG 40 HH11 ARG 40 -1.079 8.722 11.750 289 HH12 ARG 40 HH12 ARG 40 -0.137 9.054 13.177 290 HH21 ARG 40 HH21 ARG 40 1.947 6.239 12.814 291 HH22 ARG 40 HH22 ARG 40 1.621 7.666 13.755 292 H ILE 41 HN ILE 41 -3.024 5.247 5.774 293 HA ILE 41 HA ILE 41 -3.663 6.983 3.694 294 HB ILE 41 HB ILE 41 -4.262 4.027 4.002 295 HG12 ILE 41 HG12 ILE 41 -2.080 5.441 2.450 296 HG13 ILE 41 HG11 ILE 41 -1.862 4.688 4.025 297 HG21 ILE 41 HG21 ILE 41 -4.417 5.722 1.515 298 HG22 ILE 41 HG22 ILE 41 -5.773 4.963 2.352 299 HG23 ILE 41 HG23 ILE 41 -4.550 3.964 1.567 300 HD11 ILE 41 HD11 ILE 41 -2.630 3.272 1.481 301 HD12 ILE 41 HD12 ILE 41 -2.420 2.513 3.058 302 HD13 ILE 41 HD13 ILE 41 -1.043 3.256 2.248 303 H SER 42 HN SER 42 -5.782 5.000 5.764 304 HA SER 42 HA SER 42 -8.224 5.555 4.569 305 HB2 SER 42 HB2 SER 42 -7.912 3.854 6.321 306 HB3 SER 42 HB1 SER 42 -7.683 5.129 7.516 307 HG SER 42 HG SER 42 -9.812 4.463 7.607 308 H GLY 43 HN GLY 43 -6.422 7.498 6.934 309 HA2 GLY 43 HA2 GLY 43 -8.439 9.431 7.386 310 HA3 GLY 43 HA1 GLY 43 -6.710 9.699 7.576 311 H ARG 44 HN ARG 44 -5.862 9.234 4.986 312 HA ARG 44 HA ARG 44 -6.464 11.671 3.693 313 HB2 ARG 44 HB2 ARG 44 -4.807 9.268 3.110 314 HB3 ARG 44 HB1 ARG 44 -5.164 10.375 1.815 315 HG2 ARG 44 HG2 ARG 44 -3.037 10.944 2.701 316 HG3 ARG 44 HG1 ARG 44 -4.171 12.208 3.172 317 HD2 ARG 44 HD2 ARG 44 -3.564 9.900 4.990 318 HD3 ARG 44 HD1 ARG 44 -2.504 11.311 4.920 319 HE ARG 44 HE ARG 44 -5.214 12.093 5.296 320 HH11 ARG 44 HH11 ARG 44 -2.423 10.811 6.982 321 HH12 ARG 44 HH12 ARG 44 -2.928 11.399 8.533 322 HH21 ARG 44 HH21 ARG 44 -5.884 12.855 7.336 323 HH22 ARG 44 HH22 ARG 44 -4.900 12.554 8.738 324 H LEU 45 HN LEU 45 -7.543 8.361 3.338 325 HA LEU 45 HA LEU 45 -8.887 8.556 0.886 326 HB2 LEU 45 HB2 LEU 45 -8.359 6.554 2.526 327 HB3 LEU 45 HB1 LEU 45 -9.954 6.912 3.150 328 HG LEU 45 HG LEU 45 -9.614 6.453 0.216 329 HD11 LEU 45 HD11 LEU 45 -9.917 4.060 0.549 330 HD12 LEU 45 HD12 LEU 45 -9.845 4.281 2.298 331 HD13 LEU 45 HD13 LEU 45 -8.421 4.608 1.307 332 HD21 LEU 45 HD21 LEU 45 -11.813 5.924 2.212 333 HD22 LEU 45 HD22 LEU 45 -11.881 5.481 0.504 334 HD23 LEU 45 HD23 LEU 45 -11.783 7.180 0.973 335 H ASN 46 HN ASN 46 -9.710 9.563 4.095 336 HA ASN 46 HA ASN 46 -12.466 10.128 3.654 337 HB2 ASN 46 HB2 ASN 46 -11.624 9.744 5.922 338 HB3 ASN 46 HB1 ASN 46 -10.564 11.142 5.782 339 HD21 ASN 46 HD21 ASN 46 -11.391 13.177 6.073 340 HD22 ASN 46 HD22 ASN 46 -13.011 13.476 6.592 341 H ARG 47 HN ARG 47 -9.450 11.889 3.471 342 HA ARG 47 HA ARG 47 -10.319 14.443 2.931 343 HB2 ARG 47 HB2 ARG 47 -8.098 14.614 2.857 344 HB3 ARG 47 HB1 ARG 47 -7.927 12.889 2.624 345 HG2 ARG 47 HG2 ARG 47 -8.172 13.175 0.206 346 HG3 ARG 47 HG1 ARG 47 -8.324 14.929 0.443 347 HD2 ARG 47 HD2 ARG 47 -6.100 14.995 1.447 348 HD3 ARG 47 HD1 ARG 47 -5.947 13.252 1.245 349 HE ARG 47 HE ARG 47 -6.443 14.662 -1.215 350 HH11 ARG 47 HH11 ARG 47 -3.994 13.606 1.047 351 HH12 ARG 47 HH12 ARG 47 -2.716 13.614 -0.123 352 HH21 ARG 47 HH21 ARG 47 -4.736 14.699 -2.775 353 HH22 ARG 47 HH22 ARG 47 -3.134 14.232 -2.277 354 H PHE 48 HN PHE 48 -10.528 11.580 0.945 355 HA PHE 48 HA PHE 48 -11.520 13.234 -1.227 356 HB2 PHE 48 HB2 PHE 48 -10.867 10.298 -1.157 357 HB3 PHE 48 HB1 PHE 48 -11.564 11.112 -2.550 358 HD1 PHE 48 HD2 PHE 48 -10.245 12.875 -3.722 359 HD2 PHE 48 HD1 PHE 48 -8.554 10.394 -0.708 360 HE1 PHE 48 HE2 PHE 48 -7.991 13.454 -4.516 361 HE2 PHE 48 HE1 PHE 48 -6.295 10.966 -1.499 362 HZ PHE 48 HZ PHE 48 -6.011 12.497 -3.405 363 H LYS 49 HN LYS 49 -12.498 10.214 0.386 364 HA LYS 49 HA LYS 49 -15.156 11.064 0.939 365 HB2 LYS 49 HB2 LYS 49 -14.749 9.286 -1.475 366 HB3 LYS 49 HB1 LYS 49 -16.230 9.241 -0.538 367 HG2 LYS 49 HG2 LYS 49 -15.145 11.635 -2.008 368 HG3 LYS 49 HG1 LYS 49 -16.476 10.605 -2.534 369 HD2 LYS 49 HD2 LYS 49 -16.481 12.130 0.064 370 HD3 LYS 49 HD1 LYS 49 -17.144 12.776 -1.437 371 HE2 LYS 49 HE2 LYS 49 -18.030 10.219 -0.109 372 HE3 LYS 49 HE1 LYS 49 -18.855 11.768 0.039 373 HZ1 LYS 49 HZ1 LYS 49 -18.561 10.070 -2.370 374 HZ2 LYS 49 HZ2 LYS 49 -18.995 11.701 -2.478 375 HZ3 LYS 49 HZ3 LYS 49 -19.990 10.617 -1.632 376 H ARG 50 HN ARG 50 -15.242 10.054 2.909 377 HA ARG 50 HA ARG 50 -14.650 7.172 2.876 378 HB2 ARG 50 HB2 ARG 50 -12.923 8.525 4.116 379 HB3 ARG 50 HB1 ARG 50 -14.184 8.948 5.268 380 HG2 ARG 50 HG2 ARG 50 -14.469 6.646 5.891 381 HG3 ARG 50 HG1 ARG 50 -13.354 6.126 4.626 382 HD2 ARG 50 HD2 ARG 50 -12.187 6.078 6.707 383 HD3 ARG 50 HD1 ARG 50 -11.565 7.431 5.766 384 HE ARG 50 HE ARG 50 -13.554 8.488 7.356 385 HH11 ARG 50 HH11 ARG 50 -10.564 6.743 7.884 386 HH12 ARG 50 HH12 ARG 50 -10.252 7.488 9.425 387 HH21 ARG 50 HH21 ARG 50 -13.153 9.481 9.356 388 HH22 ARG 50 HH22 ARG 50 -11.711 9.078 10.249 389 H TYR 51 HN TYR 51 -16.459 6.140 3.020 390 HA TYR 51 HA TYR 51 -18.776 7.193 4.372 391 HB2 TYR 51 HB2 TYR 51 -18.409 5.510 2.244 392 HB3 TYR 51 HB1 TYR 51 -18.745 4.358 3.534 393 HD1 TYR 51 HD2 TYR 51 -20.090 7.259 1.686 394 HD2 TYR 51 HD1 TYR 51 -20.944 4.098 4.403 395 HE1 TYR 51 HE2 TYR 51 -22.491 7.697 1.426 396 HE2 TYR 51 HE1 TYR 51 -23.354 4.531 4.156 397 HH TYR 51 HH TYR 51 -24.621 6.513 1.698 398 HA PRO 52 HA PRO 52 -17.837 5.476 8.367 399 HB2 PRO 52 HB2 PRO 52 -20.448 5.050 9.191 400 HB3 PRO 52 HB1 PRO 52 -19.583 6.582 9.329 401 HG2 PRO 52 HG2 PRO 52 -21.552 5.692 7.268 402 HG3 PRO 52 HG1 PRO 52 -21.349 7.288 8.014 403 HD2 PRO 52 HD2 PRO 52 -20.463 6.769 5.532 404 HD3 PRO 52 HD1 PRO 52 -19.579 7.849 6.631 405 H LYS 53 HN LYS 53 -17.366 3.478 9.025 406 HA LYS 53 HA LYS 53 -17.665 1.341 7.237 407 HB2 LYS 53 HB2 LYS 53 -16.803 1.373 10.126 408 HB3 LYS 53 HB1 LYS 53 -16.715 -0.052 9.105 409 HG2 LYS 53 HG2 LYS 53 -15.267 2.548 8.634 410 HG3 LYS 53 HG1 LYS 53 -14.561 1.068 9.285 411 HD2 LYS 53 HD2 LYS 53 -13.961 0.871 7.080 412 HD3 LYS 53 HD1 LYS 53 -15.511 0.030 7.058 413 HE2 LYS 53 HE2 LYS 53 -15.482 1.497 5.180 414 HE3 LYS 53 HE1 LYS 53 -16.570 2.203 6.376 415 HZ1 LYS 53 HZ1 LYS 53 -14.665 3.619 7.097 416 HZ2 LYS 53 HZ2 LYS 53 -15.200 3.922 5.519 417 HZ3 LYS 53 HZ3 LYS 53 -13.783 3.028 5.772 418 H ASP 54 HN ASP 54 -19.702 2.339 9.837 419 HA ASP 54 HA ASP 54 -20.947 -0.018 10.577 420 HB2 ASP 54 HB2 ASP 54 -21.388 2.074 11.724 421 HB3 ASP 54 HB1 ASP 54 -22.124 2.752 10.275 422 H ALA 55 HN ALA 55 -21.736 2.123 7.855 423 HA ALA 55 HA ALA 55 -23.982 0.621 6.974 424 HB1 ALA 55 HB1 ALA 55 -23.882 2.003 4.971 425 HB2 ALA 55 HB2 ALA 55 -22.284 2.581 5.438 426 HB3 ALA 55 HB3 ALA 55 -23.688 2.986 6.424 427 H LEU 56 HN LEU 56 -20.561 0.408 6.365 428 HA LEU 56 HA LEU 56 -20.790 -1.222 4.010 429 HB2 LEU 56 HB2 LEU 56 -18.471 -0.679 5.877 430 HB3 LEU 56 HB1 LEU 56 -18.340 -1.669 4.442 431 HG LEU 56 HG LEU 56 -17.430 0.488 3.968 432 HD11 LEU 56 HD11 LEU 56 -18.672 -0.551 2.164 433 HD12 LEU 56 HD12 LEU 56 -18.777 1.209 2.092 434 HD13 LEU 56 HD13 LEU 56 -20.143 0.267 2.697 435 HD21 LEU 56 HD21 LEU 56 -20.062 1.659 4.829 436 HD22 LEU 56 HD22 LEU 56 -18.721 2.545 4.106 437 HD23 LEU 56 HD23 LEU 56 -18.528 1.793 5.688 438 H ARG 57 HN ARG 57 -20.244 -1.796 7.456 439 HA ARG 57 HA ARG 57 -19.616 -4.547 7.138 440 HB2 ARG 57 HB2 ARG 57 -20.447 -2.994 9.586 441 HB3 ARG 57 HB1 ARG 57 -19.868 -4.654 9.610 442 HG2 ARG 57 HG2 ARG 57 -17.762 -3.852 8.542 443 HG3 ARG 57 HG1 ARG 57 -18.348 -2.206 8.761 444 HD2 ARG 57 HD2 ARG 57 -18.406 -2.479 11.145 445 HD3 ARG 57 HD1 ARG 57 -17.999 -4.190 11.002 446 HE ARG 57 HE ARG 57 -15.830 -3.355 10.008 447 HH11 ARG 57 HH11 ARG 57 -17.694 -1.433 12.271 448 HH12 ARG 57 HH12 ARG 57 -16.299 -0.631 12.930 449 HH21 ARG 57 HH21 ARG 57 -13.999 -2.282 10.850 450 HH22 ARG 57 HH22 ARG 57 -14.187 -1.102 12.111 451 H LEU 58 HN LEU 58 -22.585 -2.919 7.058 452 HA LEU 58 HA LEU 58 -23.979 -5.448 7.588 453 HB2 LEU 58 HB2 LEU 58 -26.036 -4.075 7.808 454 HB3 LEU 58 HB1 LEU 58 -24.821 -3.756 9.026 455 HG LEU 58 HG LEU 58 -24.159 -1.753 7.508 456 HD11 LEU 58 HD11 LEU 58 -26.965 -2.281 6.546 457 HD12 LEU 58 HD12 LEU 58 -25.494 -2.351 5.575 458 HD13 LEU 58 HD13 LEU 58 -26.035 -0.813 6.247 459 HD21 LEU 58 HD21 LEU 58 -26.738 -1.782 9.070 460 HD22 LEU 58 HD22 LEU 58 -25.818 -0.344 8.630 461 HD23 LEU 58 HD23 LEU 58 -25.120 -1.535 9.727 462 H LYS 59 HN LYS 59 -22.626 -4.079 5.068 463 HA LYS 59 HA LYS 59 -24.502 -5.215 3.211 464 HB2 LYS 59 HB2 LYS 59 -25.667 -3.198 3.273 465 HB3 LYS 59 HB1 LYS 59 -24.210 -2.243 3.497 466 HG2 LYS 59 HG2 LYS 59 -23.697 -2.250 1.252 467 HG3 LYS 59 HG1 LYS 59 -24.645 -3.697 0.935 468 HD2 LYS 59 HD2 LYS 59 -25.782 -1.791 -0.001 469 HD3 LYS 59 HD1 LYS 59 -26.703 -2.390 1.376 470 HE2 LYS 59 HE2 LYS 59 -26.694 -0.043 1.574 471 HE3 LYS 59 HE1 LYS 59 -25.540 -0.637 2.764 472 HZ1 LYS 59 HZ1 LYS 59 -23.746 -0.105 1.200 473 HZ2 LYS 59 HZ2 LYS 59 -24.656 1.263 1.599 474 HZ3 LYS 59 HZ3 LYS 59 -24.876 0.509 0.103 475 H ARG 60 HN ARG 60 -21.922 -2.733 2.945 476 HA ARG 60 HA ARG 60 -20.863 -4.335 0.759 477 HB2 ARG 60 HB2 ARG 60 -20.121 -1.571 1.711 478 HB3 ARG 60 HB1 ARG 60 -19.356 -2.399 0.356 479 HG2 ARG 60 HG2 ARG 60 -22.239 -1.583 0.589 480 HG3 ARG 60 HG1 ARG 60 -21.015 -0.915 -0.496 481 HD2 ARG 60 HD2 ARG 60 -20.873 -2.988 -1.701 482 HD3 ARG 60 HD1 ARG 60 -21.930 -3.789 -0.536 483 HE ARG 60 HE ARG 60 -22.985 -1.496 -2.028 484 HH11 ARG 60 HH11 ARG 60 -22.943 -4.955 -1.453 485 HH12 ARG 60 HH12 ARG 60 -24.407 -5.263 -2.337 486 HH21 ARG 60 HH21 ARG 60 -24.891 -1.895 -3.233 487 HH22 ARG 60 HH22 ARG 60 -25.515 -3.515 -3.339 488 H GLN 61 HN GLN 61 -20.203 -6.005 1.957 489 HA GLN 61 HA GLN 61 -17.913 -5.629 3.742 490 HB2 GLN 61 HB2 GLN 61 -19.644 -8.057 3.258 491 HB3 GLN 61 HB1 GLN 61 -18.458 -7.863 4.539 492 HG2 GLN 61 HG2 GLN 61 -19.824 -6.522 5.785 493 HG3 GLN 61 HG1 GLN 61 -20.701 -5.923 4.376 494 HE21 GLN 61 HE21 GLN 61 -22.682 -6.335 5.340 495 HE22 GLN 61 HE22 GLN 61 -23.320 -7.938 5.502 496 H GLY 62 HN GLY 62 -16.098 -7.148 3.403 497 HA2 GLY 62 HA2 GLY 62 -15.707 -9.054 1.590 498 HA3 GLY 62 HA1 GLY 62 -15.685 -7.628 0.562 499 H VAL 63 HN VAL 63 -13.703 -9.739 1.786 500 HA VAL 63 HA VAL 63 -11.636 -7.779 2.493 501 HB VAL 63 HB VAL 63 -11.561 -10.794 2.776 502 HG11 VAL 63 HG11 VAL 63 -9.637 -8.665 3.716 503 HG12 VAL 63 HG12 VAL 63 -9.341 -9.865 2.459 504 HG13 VAL 63 HG13 VAL 63 -9.541 -10.374 4.134 505 HG21 VAL 63 HG21 VAL 63 -11.770 -10.383 5.181 506 HG22 VAL 63 HG22 VAL 63 -13.177 -9.787 4.301 507 HG23 VAL 63 HG23 VAL 63 -11.950 -8.656 4.871 508 H GLY 64 HN GLY 64 -10.258 -7.217 0.964 509 HA2 GLY 64 HA2 GLY 64 -9.418 -9.165 -1.038 510 HA3 GLY 64 HA1 GLY 64 -10.239 -7.726 -1.628 511 H GLN 65 HN GLN 65 -7.697 -8.285 -2.440 512 HA GLN 65 HA GLN 65 -6.006 -6.446 -0.908 513 HB2 GLN 65 HB2 GLN 65 -5.331 -8.447 -3.073 514 HB3 GLN 65 HB1 GLN 65 -4.161 -7.360 -2.333 515 HG2 GLN 65 HG2 GLN 65 -4.627 -8.391 -0.142 516 HG3 GLN 65 HG1 GLN 65 -5.732 -9.513 -0.931 517 HE21 GLN 65 HE21 GLN 65 -2.417 -8.626 -0.436 518 HE22 GLN 65 HE22 GLN 65 -1.721 -10.066 -1.090 519 H VAL 66 HN VAL 66 -5.457 -4.519 -1.725 520 HA VAL 66 HA VAL 66 -6.338 -3.894 -4.463 521 HB VAL 66 HB VAL 66 -6.877 -2.424 -1.891 522 HG11 VAL 66 HG11 VAL 66 -7.205 -1.217 -4.630 523 HG12 VAL 66 HG12 VAL 66 -5.920 -0.799 -3.496 524 HG13 VAL 66 HG13 VAL 66 -7.605 -0.485 -3.072 525 HG21 VAL 66 HG21 VAL 66 -8.642 -3.183 -4.215 526 HG22 VAL 66 HG22 VAL 66 -9.160 -2.407 -2.717 527 HG23 VAL 66 HG23 VAL 66 -8.522 -4.051 -2.683 528 H ARG 67 HN ARG 67 -4.681 -3.230 -5.656 529 HA ARG 67 HA ARG 67 -2.310 -2.137 -4.291 530 HB2 ARG 67 HB2 ARG 67 -1.802 -4.229 -5.386 531 HB3 ARG 67 HB1 ARG 67 -2.575 -3.698 -6.872 532 HG2 ARG 67 HG2 ARG 67 -0.827 -1.873 -6.974 533 HG3 ARG 67 HG1 ARG 67 0.009 -2.740 -5.687 534 HD2 ARG 67 HD2 ARG 67 -0.819 -4.134 -8.202 535 HD3 ARG 67 HD1 ARG 67 0.670 -3.193 -8.140 536 HE ARG 67 HE ARG 67 0.198 -5.370 -6.214 537 HH11 ARG 67 HH11 ARG 67 2.107 -3.848 -8.739 538 HH12 ARG 67 HH12 ARG 67 3.382 -5.032 -8.650 539 HH21 ARG 67 HH21 ARG 67 1.898 -6.929 -6.107 540 HH22 ARG 67 HH22 ARG 67 3.272 -6.766 -7.172 541 H PHE 68 HN PHE 68 -1.436 -0.182 -4.986 542 HA PHE 68 HA PHE 68 -2.205 0.941 -7.499 543 HB2 PHE 68 HB2 PHE 68 -3.111 3.074 -6.399 544 HB3 PHE 68 HB1 PHE 68 -4.168 1.683 -6.525 545 HD1 PHE 68 HD2 PHE 68 -1.931 3.467 -4.144 546 HD2 PHE 68 HD1 PHE 68 -5.272 0.883 -4.660 547 HE1 PHE 68 HE2 PHE 68 -2.454 3.657 -1.745 548 HE2 PHE 68 HE1 PHE 68 -5.798 1.081 -2.266 549 HZ PHE 68 HZ PHE 68 -4.385 2.467 -0.806 550 H THR 69 HN THR 69 -1.113 2.831 -8.079 551 HA THR 69 HA THR 69 1.414 3.315 -6.637 552 HB THR 69 HB THR 69 0.568 4.338 -9.363 553 HG1 THR 69 HG1 THR 69 1.321 1.855 -8.604 554 HG21 THR 69 HG21 THR 69 2.372 5.606 -8.310 555 HG22 THR 69 HG22 THR 69 2.977 4.680 -9.684 556 HG23 THR 69 HG23 THR 69 3.274 4.113 -8.040 557 H LEU 70 HN LEU 70 1.972 5.354 -5.929 558 HA LEU 70 HA LEU 70 -0.306 7.199 -5.733 559 HB2 LEU 70 HB2 LEU 70 1.637 6.373 -3.591 560 HB3 LEU 70 HB1 LEU 70 0.407 7.614 -3.412 561 HG LEU 70 HG LEU 70 -0.226 4.751 -4.108 562 HD11 LEU 70 HD11 LEU 70 -0.388 6.049 -1.389 563 HD12 LEU 70 HD12 LEU 70 0.929 4.994 -1.903 564 HD13 LEU 70 HD13 LEU 70 -0.715 4.365 -1.799 565 HD21 LEU 70 HD21 LEU 70 -1.918 7.032 -3.087 566 HD22 LEU 70 HD22 LEU 70 -2.479 5.396 -3.434 567 HD23 LEU 70 HD23 LEU 70 -1.892 6.424 -4.744 568 H ASP 71 HN ASP 71 0.030 9.254 -5.973 569 HA ASP 71 HA ASP 71 2.544 10.340 -6.756 570 HB2 ASP 71 HB2 ASP 71 0.442 11.244 -7.618 571 HB3 ASP 71 HB1 ASP 71 -0.079 11.650 -5.982 572 H ARG 72 HN ARG 72 3.615 12.067 -5.641 573 HA ARG 72 HA ARG 72 4.401 11.424 -3.056 574 HB2 ARG 72 HB2 ARG 72 5.762 12.671 -4.663 575 HB3 ARG 72 HB1 ARG 72 4.671 14.041 -4.538 576 HG2 ARG 72 HG2 ARG 72 5.285 14.321 -2.196 577 HG3 ARG 72 HG1 ARG 72 6.373 12.935 -2.314 578 HD2 ARG 72 HD2 ARG 72 7.644 14.108 -4.059 579 HD3 ARG 72 HD1 ARG 72 6.574 15.498 -3.888 580 HE ARG 72 HE ARG 72 7.818 14.721 -1.424 581 HH11 ARG 72 HH11 ARG 72 8.195 16.580 -4.361 582 HH12 ARG 72 HH12 ARG 72 9.375 17.655 -3.674 583 HH21 ARG 72 HH21 ARG 72 9.361 16.112 -0.516 584 HH22 ARG 72 HH22 ARG 72 10.050 17.387 -1.482 585 H GLN 73 HN GLN 73 1.832 13.523 -4.165 586 HA GLN 73 HA GLN 73 1.381 14.473 -1.420 587 HB2 GLN 73 HB2 GLN 73 0.047 15.322 -3.994 588 HB3 GLN 73 HB1 GLN 73 -0.208 16.046 -2.412 589 HG2 GLN 73 HG2 GLN 73 2.214 16.637 -2.381 590 HG3 GLN 73 HG1 GLN 73 2.306 16.081 -4.053 591 HE21 GLN 73 HE21 GLN 73 -0.475 17.678 -2.693 592 HE22 GLN 73 HE22 GLN 73 -0.314 19.155 -3.585 593 H GLY 74 HN GLY 74 0.749 11.760 -2.779 594 HA2 GLY 74 HA2 GLY 74 -0.753 10.123 -2.179 595 HA3 GLY 74 HA1 GLY 74 -1.595 11.311 -1.211 596 H HIS 75 HN HIS 75 -0.918 11.237 -4.662 597 HA HIS 75 HA HIS 75 -3.816 11.295 -5.164 598 HB2 HIS 75 HB2 HIS 75 -2.891 13.283 -6.056 599 HB3 HIS 75 HB1 HIS 75 -1.470 12.450 -6.665 600 HD1 HIS 75 HD1 HIS 75 -5.126 13.004 -7.474 601 HD2 HIS 75 HD2 HIS 75 -1.681 11.455 -9.218 602 HE1 HIS 75 HE1 HIS 75 -5.701 12.613 -9.889 603 HE2 HIS 75 HE2 HIS 75 -3.561 11.812 -10.956 604 H VAL 76 HN VAL 76 -4.636 9.450 -5.904 605 HA VAL 76 HA VAL 76 -3.290 7.176 -6.603 606 HB VAL 76 HB VAL 76 -5.686 7.203 -6.172 607 HG11 VAL 76 HG11 VAL 76 -7.290 7.905 -7.885 608 HG12 VAL 76 HG12 VAL 76 -5.959 8.548 -8.846 609 HG13 VAL 76 HG13 VAL 76 -6.328 9.247 -7.271 610 HG21 VAL 76 HG21 VAL 76 -6.411 5.651 -7.937 611 HG22 VAL 76 HG22 VAL 76 -4.787 5.292 -7.351 612 HG23 VAL 76 HG23 VAL 76 -5.005 6.111 -8.898 613 H LEU 77 HN LEU 77 -1.847 6.802 -8.108 614 HA LEU 77 HA LEU 77 -1.997 8.215 -10.673 615 HB2 LEU 77 HB2 LEU 77 0.221 6.534 -9.492 616 HB3 LEU 77 HB1 LEU 77 0.294 7.369 -11.032 617 HG LEU 77 HG LEU 77 -0.068 8.790 -8.397 618 HD11 LEU 77 HD11 LEU 77 2.076 7.578 -8.466 619 HD12 LEU 77 HD12 LEU 77 2.285 9.330 -8.498 620 HD13 LEU 77 HD13 LEU 77 2.467 8.393 -9.983 621 HD21 LEU 77 HD21 LEU 77 0.602 10.754 -9.688 622 HD22 LEU 77 HD22 LEU 77 -0.852 10.013 -10.358 623 HD23 LEU 77 HD23 LEU 77 0.706 9.762 -11.143 624 H ALA 78 HN ALA 78 -1.706 5.022 -9.251 625 HA ALA 78 HA ALA 78 -2.887 3.837 -11.668 626 HB1 ALA 78 HB1 ALA 78 -0.605 2.659 -10.075 627 HB2 ALA 78 HB2 ALA 78 -0.460 3.392 -11.676 628 HB3 ALA 78 HB3 ALA 78 -1.402 1.915 -11.464 629 H VAL 79 HN VAL 79 -3.939 1.740 -11.169 630 HA VAL 79 HA VAL 79 -4.199 0.937 -8.460 631 HB VAL 79 HB VAL 79 -5.798 2.755 -8.358 632 HG11 VAL 79 HG11 VAL 79 -7.207 1.436 -10.675 633 HG12 VAL 79 HG12 VAL 79 -6.353 2.979 -10.713 634 HG13 VAL 79 HG13 VAL 79 -7.816 2.804 -9.743 635 HG21 VAL 79 HG21 VAL 79 -7.788 1.498 -7.665 636 HG22 VAL 79 HG22 VAL 79 -6.297 0.752 -7.088 637 HG23 VAL 79 HG23 VAL 79 -7.151 0.065 -8.469 638 H THR 80 HN THR 80 -4.163 -1.153 -8.569 639 HA THR 80 HA THR 80 -5.387 -2.505 -10.882 640 HB THR 80 HB THR 80 -2.857 -3.359 -9.457 641 HG1 THR 80 HG1 THR 80 -1.745 -2.478 -11.172 642 HG21 THR 80 HG21 THR 80 -4.112 -4.325 -12.034 643 HG22 THR 80 HG22 THR 80 -4.134 -5.189 -10.496 644 HG23 THR 80 HG23 THR 80 -2.605 -4.910 -11.330 645 H LEU 81 HN LEU 81 -7.121 -3.581 -10.110 646 HA LEU 81 HA LEU 81 -7.309 -4.426 -7.406 647 HB2 LEU 81 HB2 LEU 81 -9.281 -3.965 -8.867 648 HB3 LEU 81 HB1 LEU 81 -8.917 -5.440 -9.747 649 HG LEU 81 HG LEU 81 -9.167 -6.690 -7.572 650 HD11 LEU 81 HD11 LEU 81 -8.837 -4.830 -6.053 651 HD12 LEU 81 HD12 LEU 81 -10.411 -5.579 -5.779 652 HD13 LEU 81 HD13 LEU 81 -10.301 -4.052 -6.655 653 HD21 LEU 81 HD21 LEU 81 -11.619 -6.646 -7.633 654 HD22 LEU 81 HD22 LEU 81 -10.924 -6.688 -9.252 655 HD23 LEU 81 HD23 LEU 81 -11.565 -5.177 -8.607 656 H VAL 82 HN VAL 82 -5.919 -5.817 -6.676 657 HA VAL 82 HA VAL 82 -5.043 -8.101 -8.218 658 HB VAL 82 HB VAL 82 -4.020 -8.440 -5.679 659 HG11 VAL 82 HG11 VAL 82 -2.785 -8.544 -7.809 660 HG12 VAL 82 HG12 VAL 82 -1.944 -7.554 -6.615 661 HG13 VAL 82 HG13 VAL 82 -2.845 -6.781 -7.917 662 HG21 VAL 82 HG21 VAL 82 -5.037 -6.275 -5.004 663 HG22 VAL 82 HG22 VAL 82 -4.074 -5.470 -6.245 664 HG23 VAL 82 HG23 VAL 82 -3.276 -6.275 -4.890 665 H SER 83 HN SER 83 -6.530 -7.597 -5.018 666 HA SER 83 HA SER 83 -8.239 -8.623 -3.956 667 HB2 SER 83 HB2 SER 83 -9.408 -8.137 -6.046 668 HB3 SER 83 HB1 SER 83 -8.883 -9.680 -6.715 669 HG SER 83 HG SER 83 -10.728 -10.325 -5.922 670 H SER 84 HN SER 84 -9.427 -11.016 -4.007 671 HA SER 84 HA SER 84 -7.420 -13.102 -4.040 672 HB2 SER 84 HB2 SER 84 -8.711 -12.258 -1.434 673 HB3 SER 84 HB1 SER 84 -7.571 -13.586 -1.654 674 HG SER 84 HG SER 84 -6.269 -11.636 -2.622 675 H ALA 85 HN ALA 85 -10.542 -12.407 -2.434 676 HA ALA 85 HA ALA 85 -11.499 -15.038 -3.224 677 HB1 ALA 85 HB1 ALA 85 -11.842 -14.242 -0.915 678 HB2 ALA 85 HB2 ALA 85 -13.352 -14.648 -1.730 679 HB3 ALA 85 HB3 ALA 85 -12.882 -12.958 -1.533 680 H GLY 86 HN GLY 86 -12.226 -11.646 -3.805 681 HA2 GLY 86 HA2 GLY 86 -13.025 -10.920 -5.938 682 HA3 GLY 86 HA1 GLY 86 -13.807 -12.482 -6.133 683 H LEU 87 HN LEU 87 -14.155 -9.266 -5.108 684 HA LEU 87 HA LEU 87 -16.785 -9.849 -3.914 685 HB2 LEU 87 HB2 LEU 87 -15.262 -7.235 -3.931 686 HB3 LEU 87 HB1 LEU 87 -16.754 -7.549 -3.082 687 HG LEU 87 HG LEU 87 -15.111 -7.581 -1.416 688 HD11 LEU 87 HD11 LEU 87 -15.561 -10.451 -2.209 689 HD12 LEU 87 HD12 LEU 87 -16.624 -9.455 -1.210 690 HD13 LEU 87 HD13 LEU 87 -15.017 -9.890 -0.627 691 HD21 LEU 87 HD21 LEU 87 -13.406 -9.377 -3.134 692 HD22 LEU 87 HD22 LEU 87 -13.005 -8.760 -1.532 693 HD23 LEU 87 HD23 LEU 87 -13.154 -7.648 -2.893 694 HA PRO 88 HA PRO 88 -17.981 -8.728 -8.106 695 HB2 PRO 88 HB2 PRO 88 -20.599 -9.814 -7.491 696 HB3 PRO 88 HB1 PRO 88 -19.363 -10.454 -8.574 697 HG2 PRO 88 HG2 PRO 88 -20.070 -11.657 -6.230 698 HG3 PRO 88 HG1 PRO 88 -18.462 -11.806 -6.963 699 HD2 PRO 88 HD2 PRO 88 -19.365 -10.048 -4.709 700 HD3 PRO 88 HD1 PRO 88 -17.855 -10.972 -4.881 701 H SER 89 HN SER 89 -21.003 -8.656 -6.282 702 HA SER 89 HA SER 89 -21.715 -6.115 -7.317 703 HB2 SER 89 HB2 SER 89 -22.943 -7.520 -4.934 704 HB3 SER 89 HB1 SER 89 -23.708 -6.324 -5.979 705 HG SER 89 HG SER 89 -23.995 -8.804 -6.281 706 H LEU 90 HN LEU 90 -19.868 -7.119 -4.665 707 HA LEU 90 HA LEU 90 -20.350 -4.894 -2.932 708 HB2 LEU 90 HB2 LEU 90 -18.072 -6.878 -2.958 709 HB3 LEU 90 HB1 LEU 90 -18.499 -5.807 -1.635 710 HG LEU 90 HG LEU 90 -20.466 -7.843 -2.648 711 HD11 LEU 90 HD11 LEU 90 -19.634 -9.437 -1.073 712 HD12 LEU 90 HD12 LEU 90 -18.413 -8.302 -0.498 713 HD13 LEU 90 HD13 LEU 90 -18.306 -8.958 -2.133 714 HD21 LEU 90 HD21 LEU 90 -20.048 -6.501 0.017 715 HD22 LEU 90 HD22 LEU 90 -21.318 -7.663 -0.367 716 HD23 LEU 90 HD23 LEU 90 -21.290 -6.091 -1.166 717 H ASP 91 HN ASP 91 -18.142 -5.623 -5.529 718 HA ASP 91 HA ASP 91 -15.954 -4.042 -4.902 719 HB2 ASP 91 HB2 ASP 91 -15.966 -5.652 -6.750 720 HB3 ASP 91 HB1 ASP 91 -17.099 -4.644 -7.641 721 H ARG 92 HN ARG 92 -18.862 -3.144 -6.712 722 HA ARG 92 HA ARG 92 -17.980 -0.740 -7.720 723 HB2 ARG 92 HB2 ARG 92 -20.401 -0.115 -7.860 724 HB3 ARG 92 HB1 ARG 92 -19.995 -1.679 -8.549 725 HG2 ARG 92 HG2 ARG 92 -20.804 -2.769 -6.493 726 HG3 ARG 92 HG1 ARG 92 -21.278 -1.190 -5.869 727 HD2 ARG 92 HD2 ARG 92 -23.163 -2.427 -6.856 728 HD3 ARG 92 HD1 ARG 92 -22.849 -0.903 -7.686 729 HE ARG 92 HE ARG 92 -21.512 -2.469 -9.280 730 HH11 ARG 92 HH11 ARG 92 -24.544 -3.217 -7.692 731 HH12 ARG 92 HH12 ARG 92 -25.085 -4.274 -8.959 732 HH21 ARG 92 HH21 ARG 92 -22.245 -3.856 -10.949 733 HH22 ARG 92 HH22 ARG 92 -23.788 -4.638 -10.789 734 H GLU 93 HN GLU 93 -19.574 -1.273 -4.569 735 HA GLU 93 HA GLU 93 -19.589 1.553 -4.035 736 HB2 GLU 93 HB2 GLU 93 -21.222 -0.320 -3.204 737 HB3 GLU 93 HB1 GLU 93 -20.053 -0.474 -1.901 738 HG2 GLU 93 HG2 GLU 93 -20.366 1.815 -1.265 739 HG3 GLU 93 HG1 GLU 93 -21.398 2.107 -2.663 740 H ILE 94 HN ILE 94 -17.832 -1.227 -2.605 741 HA ILE 94 HA ILE 94 -16.379 0.363 -0.783 742 HB ILE 94 HB ILE 94 -14.953 -1.597 -0.404 743 HG12 ILE 94 HG12 ILE 94 -16.564 -2.905 -2.609 744 HG13 ILE 94 HG11 ILE 94 -14.875 -2.423 -2.736 745 HG21 ILE 94 HG21 ILE 94 -17.898 -2.221 -0.544 746 HG22 ILE 94 HG22 ILE 94 -17.055 -1.422 0.783 747 HG23 ILE 94 HG23 ILE 94 -16.708 -3.111 0.408 748 HD11 ILE 94 HD11 ILE 94 -15.087 -4.810 -2.338 749 HD12 ILE 94 HD12 ILE 94 -15.982 -4.495 -0.852 750 HD13 ILE 94 HD13 ILE 94 -14.291 -4.016 -0.979 751 H GLN 95 HN GLN 95 -15.627 -0.786 -4.054 752 HA GLN 95 HA GLN 95 -12.932 0.181 -3.874 753 HB2 GLN 95 HB2 GLN 95 -14.489 -0.724 -6.277 754 HB3 GLN 95 HB1 GLN 95 -12.786 -0.422 -6.209 755 HG2 GLN 95 HG2 GLN 95 -14.190 -2.526 -4.603 756 HG3 GLN 95 HG1 GLN 95 -13.350 -2.815 -6.125 757 HE21 GLN 95 HE21 GLN 95 -12.823 -4.027 -3.618 758 HE22 GLN 95 HE22 GLN 95 -11.214 -3.593 -3.158 759 H ALA 96 HN ALA 96 -16.009 1.398 -5.067 760 HA ALA 96 HA ALA 96 -15.069 3.657 -6.403 761 HB1 ALA 96 HB1 ALA 96 -17.472 3.140 -6.214 762 HB2 ALA 96 HB2 ALA 96 -17.123 4.795 -5.715 763 HB3 ALA 96 HB3 ALA 96 -17.418 3.552 -4.501 764 H LEU 97 HN LEU 97 -15.491 2.981 -2.995 765 HA LEU 97 HA LEU 97 -14.718 5.445 -1.974 766 HB2 LEU 97 HB2 LEU 97 -16.074 3.714 -0.876 767 HB3 LEU 97 HB1 LEU 97 -14.672 2.658 -0.833 768 HG LEU 97 HG LEU 97 -13.771 4.910 0.340 769 HD11 LEU 97 HD11 LEU 97 -15.452 5.447 2.076 770 HD12 LEU 97 HD12 LEU 97 -16.612 4.436 1.209 771 HD13 LEU 97 HD13 LEU 97 -15.970 5.894 0.449 772 HD21 LEU 97 HD21 LEU 97 -14.244 3.491 2.483 773 HD22 LEU 97 HD22 LEU 97 -13.118 2.920 1.253 774 HD23 LEU 97 HD23 LEU 97 -14.767 2.276 1.305 775 H VAL 98 HN VAL 98 -12.945 2.331 -2.135 776 HA VAL 98 HA VAL 98 -10.492 3.647 -1.301 777 HB VAL 98 HB VAL 98 -11.015 0.736 -1.915 778 HG11 VAL 98 HG11 VAL 98 -8.659 1.316 -2.167 779 HG12 VAL 98 HG12 VAL 98 -8.918 0.305 -0.746 780 HG13 VAL 98 HG13 VAL 98 -8.658 2.039 -0.560 781 HG21 VAL 98 HG21 VAL 98 -12.322 1.518 -0.021 782 HG22 VAL 98 HG22 VAL 98 -10.873 2.197 0.719 783 HG23 VAL 98 HG23 VAL 98 -11.027 0.451 0.522 784 H LYS 99 HN LYS 99 -11.571 1.759 -4.110 785 HA LYS 99 HA LYS 99 -9.095 1.809 -5.465 786 HB2 LYS 99 HB2 LYS 99 -10.822 0.114 -5.908 787 HB3 LYS 99 HB1 LYS 99 -11.892 1.341 -6.564 788 HG2 LYS 99 HG2 LYS 99 -10.193 1.750 -8.353 789 HG3 LYS 99 HG1 LYS 99 -9.284 0.373 -7.727 790 HD2 LYS 99 HD2 LYS 99 -12.116 0.305 -8.780 791 HD3 LYS 99 HD1 LYS 99 -10.682 -0.284 -9.619 792 HE2 LYS 99 HE2 LYS 99 -10.360 -2.018 -8.005 793 HE3 LYS 99 HE1 LYS 99 -11.600 -1.344 -6.948 794 HZ1 LYS 99 HZ1 LYS 99 -12.605 -3.143 -8.054 795 HZ2 LYS 99 HZ2 LYS 99 -11.964 -2.702 -9.559 796 HZ3 LYS 99 HZ3 LYS 99 -13.188 -1.768 -8.855 797 H ARG 100 HN ARG 100 -11.709 4.151 -5.273 798 HA ARG 100 HA ARG 100 -10.505 5.711 -7.429 799 HB2 ARG 100 HB2 ARG 100 -13.012 5.582 -7.003 800 HB3 ARG 100 HB1 ARG 100 -12.728 6.560 -5.573 801 HG2 ARG 100 HG2 ARG 100 -11.930 7.439 -8.329 802 HG3 ARG 100 HG1 ARG 100 -13.513 7.771 -7.635 803 HD2 ARG 100 HD2 ARG 100 -12.384 8.926 -5.748 804 HD3 ARG 100 HD1 ARG 100 -10.841 8.669 -6.563 805 HE ARG 100 HE ARG 100 -12.883 10.052 -8.098 806 HH11 ARG 100 HH11 ARG 100 -10.037 10.322 -6.071 807 HH12 ARG 100 HH12 ARG 100 -9.686 11.943 -6.578 808 HH21 ARG 100 HH21 ARG 100 -12.421 12.170 -8.758 809 HH22 ARG 100 HH22 ARG 100 -11.037 12.996 -8.097 810 H ALA 101 HN ALA 101 -11.174 6.152 -3.936 811 HA ALA 101 HA ALA 101 -9.297 8.353 -3.839 812 HB1 ALA 101 HB1 ALA 101 -9.941 8.647 -1.548 813 HB2 ALA 101 HB2 ALA 101 -10.749 7.069 -1.521 814 HB3 ALA 101 HB3 ALA 101 -11.402 8.382 -2.509 815 H SER 102 HN SER 102 -7.541 6.879 -4.609 816 HA SER 102 HA SER 102 -6.330 5.403 -2.394 817 HB2 SER 102 HB2 SER 102 -5.318 5.603 -5.231 818 HB3 SER 102 HB1 SER 102 -4.849 4.431 -4.004 819 HG SER 102 HG SER 102 -7.430 4.189 -4.184 820 HA PRO 103 HA PRO 103 -3.860 9.139 -2.013 821 HB2 PRO 103 HB2 PRO 103 -4.347 9.516 0.583 822 HB3 PRO 103 HB1 PRO 103 -5.568 9.866 -0.644 823 HG2 PRO 103 HG2 PRO 103 -5.505 7.710 1.346 824 HG3 PRO 103 HG1 PRO 103 -6.869 8.311 0.391 825 HD2 PRO 103 HD2 PRO 103 -5.127 6.015 -0.115 826 HD3 PRO 103 HD1 PRO 103 -6.673 6.443 -0.885 827 H LEU 104 HN LEU 104 -2.187 9.780 -0.366 828 HA LEU 104 HA LEU 104 -0.768 7.569 0.891 829 HB2 LEU 104 HB2 LEU 104 0.188 7.645 -1.329 830 HB3 LEU 104 HB1 LEU 104 0.384 9.382 -1.232 831 HG LEU 104 HG LEU 104 1.818 7.914 0.866 832 HD11 LEU 104 HD11 LEU 104 2.693 7.643 -2.008 833 HD12 LEU 104 HD12 LEU 104 2.010 6.341 -1.035 834 HD13 LEU 104 HD13 LEU 104 3.554 7.064 -0.581 835 HD21 LEU 104 HD21 LEU 104 3.596 9.459 0.184 836 HD22 LEU 104 HD22 LEU 104 2.080 10.309 0.478 837 HD23 LEU 104 HD23 LEU 104 2.608 9.995 -1.175 838 HA PRO 105 HA PRO 105 -0.639 10.982 3.825 839 HB2 PRO 105 HB2 PRO 105 0.663 9.124 5.631 840 HB3 PRO 105 HB1 PRO 105 -0.936 9.852 5.755 841 HG2 PRO 105 HG2 PRO 105 -0.490 7.199 5.256 842 HG3 PRO 105 HG1 PRO 105 -1.945 8.077 4.792 843 HD2 PRO 105 HD2 PRO 105 0.339 7.216 3.113 844 HD3 PRO 105 HD1 PRO 105 -1.385 7.381 2.699 845 H THR 106 HN THR 106 2.016 8.746 4.427 846 HA THR 106 HA THR 106 3.871 10.966 4.641 847 HB THR 106 HB THR 106 5.405 8.771 5.053 848 HG1 THR 106 HG1 THR 106 4.084 7.227 6.134 849 HG21 THR 106 HG21 THR 106 3.516 10.024 7.051 850 HG22 THR 106 HG22 THR 106 5.110 10.635 6.605 851 HG23 THR 106 HG23 THR 106 4.960 9.092 7.446 852 HA PRO 107 HA PRO 107 5.123 10.495 0.339 853 HB2 PRO 107 HB2 PRO 107 7.201 12.423 1.164 854 HB3 PRO 107 HB1 PRO 107 5.991 12.559 -0.115 855 HG2 PRO 107 HG2 PRO 107 5.787 13.985 2.135 856 HG3 PRO 107 HG1 PRO 107 4.350 13.310 1.341 857 HD2 PRO 107 HD2 PRO 107 5.835 12.306 3.743 858 HD3 PRO 107 HD1 PRO 107 4.084 12.419 3.469 859 HA PRO 108 HA PRO 108 8.598 7.800 1.508 860 HB2 PRO 108 HB2 PRO 108 7.989 5.758 -0.077 861 HB3 PRO 108 HB1 PRO 108 6.989 6.111 1.340 862 HG2 PRO 108 HG2 PRO 108 6.479 6.721 -1.538 863 HG3 PRO 108 HG1 PRO 108 5.343 6.169 -0.295 864 HD2 PRO 108 HD2 PRO 108 5.699 8.812 -1.126 865 HD3 PRO 108 HD1 PRO 108 4.909 8.299 0.376 866 H ALA 109 HN ALA 109 9.596 9.786 0.238 867 HA ALA 109 HA ALA 109 10.207 9.614 -2.476 868 HB1 ALA 109 HB1 ALA 109 10.690 11.605 -1.163 869 HB2 ALA 109 HB2 ALA 109 12.150 11.031 -1.971 870 HB3 ALA 109 HB3 ALA 109 11.915 10.724 -0.251 871 H ASP 110 HN ASP 110 11.787 8.204 0.330 872 HA ASP 110 HA ASP 110 13.998 7.137 -1.113 873 HB2 ASP 110 HB2 ASP 110 12.930 6.519 1.640 874 HB3 ASP 110 HB1 ASP 110 14.437 5.875 0.998 875 H ALA 111 HN ALA 111 10.845 6.264 -1.197 876 HA ALA 111 HA ALA 111 11.434 3.401 -1.429 877 HB1 ALA 111 HB1 ALA 111 9.079 2.991 -1.158 878 HB2 ALA 111 HB2 ALA 111 8.739 4.726 -1.179 879 HB3 ALA 111 HB3 ALA 111 9.660 4.018 0.151 880 H TYR 112 HN TYR 112 10.328 6.194 -3.257 881 HA TYR 112 HA TYR 112 9.880 4.358 -5.494 882 HB2 TYR 112 HB2 TYR 112 8.738 6.341 -6.624 883 HB3 TYR 112 HB1 TYR 112 7.904 5.424 -5.395 884 HD1 TYR 112 HD2 TYR 112 10.196 8.398 -5.343 885 HD2 TYR 112 HD1 TYR 112 6.502 6.649 -4.203 886 HE1 TYR 112 HE2 TYR 112 9.577 10.470 -4.166 887 HE2 TYR 112 HE1 TYR 112 5.856 8.690 -3.047 888 HH TYR 112 HH TYR 112 6.964 10.642 -2.008 889 H VAL 113 HN VAL 113 12.337 5.798 -4.422 890 HA VAL 113 HA VAL 113 13.350 7.044 -6.785 891 HB VAL 113 HB VAL 113 15.643 6.409 -5.785 892 HG11 VAL 113 HG11 VAL 113 15.517 8.210 -4.127 893 HG12 VAL 113 HG12 VAL 113 13.755 8.157 -4.206 894 HG13 VAL 113 HG13 VAL 113 14.689 8.640 -5.623 895 HG21 VAL 113 HG21 VAL 113 14.756 4.585 -4.332 896 HG22 VAL 113 HG22 VAL 113 13.964 5.816 -3.345 897 HG23 VAL 113 HG23 VAL 113 15.722 5.781 -3.470 898 H ASN 114 HN ASN 114 12.881 5.860 -8.483 899 HA ASN 114 HA ASN 114 14.144 3.785 -9.617 900 HB2 ASN 114 HB2 ASN 114 13.238 1.723 -8.967 901 HB3 ASN 114 HB1 ASN 114 13.368 2.548 -7.419 902 HD21 ASN 114 HD21 ASN 114 11.472 3.270 -6.388 903 HD22 ASN 114 HD22 ASN 114 9.916 2.672 -6.837 904 H GLY 115 HN GLY 115 11.217 5.393 -8.816 905 HA2 GLY 115 HA2 GLY 115 10.348 6.117 -11.270 906 HA3 GLY 115 HA1 GLY 115 9.693 4.493 -11.096 907 H THR 116 HN THR 116 8.415 4.075 -9.120 908 HA THR 116 HA THR 116 7.209 6.289 -7.756 909 HB THR 116 HB THR 116 4.926 5.062 -8.790 910 HG1 THR 116 HG1 THR 116 6.608 4.365 -10.482 911 HG21 THR 116 HG21 THR 116 6.241 7.667 -9.578 912 HG22 THR 116 HG22 THR 116 5.124 7.417 -8.237 913 HG23 THR 116 HG23 THR 116 4.560 7.239 -9.897 914 H VAL 117 HN VAL 117 5.245 5.346 -6.397 915 HA VAL 117 HA VAL 117 6.157 2.747 -5.374 916 HB VAL 117 HB VAL 117 4.747 3.330 -3.338 917 HG11 VAL 117 HG11 VAL 117 6.465 4.757 -2.350 918 HG12 VAL 117 HG12 VAL 117 7.126 5.065 -3.957 919 HG13 VAL 117 HG13 VAL 117 7.162 3.435 -3.285 920 HG21 VAL 117 HG21 VAL 117 4.705 6.014 -4.706 921 HG22 VAL 117 HG22 VAL 117 4.454 5.814 -2.973 922 HG23 VAL 117 HG23 VAL 117 3.336 5.068 -4.113 923 H GLU 118 HN GLU 118 5.042 1.158 -6.300 924 HA GLU 118 HA GLU 118 2.116 1.372 -6.184 925 HB2 GLU 118 HB2 GLU 118 3.201 0.810 -8.424 926 HB3 GLU 118 HB1 GLU 118 3.678 -0.724 -7.704 927 HG2 GLU 118 HG2 GLU 118 1.335 -1.250 -7.283 928 HG3 GLU 118 HG1 GLU 118 0.866 0.291 -7.997 929 H LEU 119 HN LEU 119 1.324 0.504 -4.416 930 HA LEU 119 HA LEU 119 2.709 -1.806 -3.236 931 HB2 LEU 119 HB2 LEU 119 1.518 -0.664 -1.079 932 HB3 LEU 119 HB1 LEU 119 3.191 -0.421 -1.539 933 HG LEU 119 HG LEU 119 2.361 1.612 -2.847 934 HD11 LEU 119 HD11 LEU 119 -0.052 1.233 -1.087 935 HD12 LEU 119 HD12 LEU 119 -0.007 1.111 -2.848 936 HD13 LEU 119 HD13 LEU 119 0.312 2.657 -2.066 937 HD21 LEU 119 HD21 LEU 119 3.655 1.758 -0.789 938 HD22 LEU 119 HD22 LEU 119 2.167 1.649 0.152 939 HD23 LEU 119 HD23 LEU 119 2.450 3.043 -0.891 940 H THR 120 HN THR 120 1.418 -3.376 -2.223 941 HA THR 120 HA THR 120 -1.400 -3.258 -3.015 942 HB THR 120 HB THR 120 0.151 -5.665 -2.053 943 HG1 THR 120 HG1 THR 120 0.997 -5.457 -4.007 944 HG21 THR 120 HG21 THR 120 -1.739 -6.913 -2.964 945 HG22 THR 120 HG22 THR 120 -2.521 -5.412 -3.443 946 HG23 THR 120 HG23 THR 120 -2.286 -5.780 -1.734 947 H LEU 121 HN LEU 121 -2.841 -2.804 -1.577 948 HA LEU 121 HA LEU 121 -2.172 -3.073 1.285 949 HB2 LEU 121 HB2 LEU 121 -4.175 -1.089 0.219 950 HB3 LEU 121 HB1 LEU 121 -3.359 -1.082 1.763 951 HG LEU 121 HG LEU 121 -2.516 0.752 0.491 952 HD11 LEU 121 HD11 LEU 121 -0.108 0.142 0.174 953 HD12 LEU 121 HD12 LEU 121 -0.558 -1.508 0.617 954 HD13 LEU 121 HD13 LEU 121 -0.798 -0.186 1.764 955 HD21 LEU 121 HD21 LEU 121 -1.908 -1.189 -1.716 956 HD22 LEU 121 HD22 LEU 121 -1.551 0.537 -1.710 957 HD23 LEU 121 HD23 LEU 121 -3.224 -0.015 -1.700 958 HA PRO 122 HA PRO 122 -5.774 -5.715 0.995 959 HB2 PRO 122 HB2 PRO 122 -5.534 -6.172 3.845 960 HB3 PRO 122 HB1 PRO 122 -5.226 -7.292 2.516 961 HG2 PRO 122 HG2 PRO 122 -3.268 -6.280 4.140 962 HG3 PRO 122 HG1 PRO 122 -2.987 -6.816 2.475 963 HD2 PRO 122 HD2 PRO 122 -3.328 -4.044 3.546 964 HD3 PRO 122 HD1 PRO 122 -2.233 -4.639 2.278 965 H ILE 123 HN ILE 123 -7.715 -4.804 0.883 966 HA ILE 123 HA ILE 123 -8.566 -3.072 3.093 967 HB ILE 123 HB ILE 123 -10.056 -1.947 1.690 968 HG12 ILE 123 HG12 ILE 123 -9.801 -4.116 -0.406 969 HG13 ILE 123 HG11 ILE 123 -11.160 -3.926 0.693 970 HG21 ILE 123 HG21 ILE 123 -8.794 -1.415 -0.433 971 HG22 ILE 123 HG22 ILE 123 -7.645 -2.668 0.043 972 HG23 ILE 123 HG23 ILE 123 -7.880 -1.256 1.071 973 HD11 ILE 123 HD11 ILE 123 -11.681 -1.767 -0.280 974 HD12 ILE 123 HD12 ILE 123 -11.658 -3.032 -1.509 975 HD13 ILE 123 HD13 ILE 123 -10.301 -1.916 -1.370 976 H ASP 124 HN ASP 124 -9.775 -4.063 4.584 977 HA ASP 124 HA ASP 124 -11.371 -6.346 3.659 978 HB2 ASP 124 HB2 ASP 124 -11.009 -7.462 5.777 979 HB3 ASP 124 HB1 ASP 124 -9.461 -7.056 5.049 980 H PHE 125 HN PHE 125 -13.404 -6.118 3.795 981 HA PHE 125 HA PHE 125 -14.564 -4.691 6.089 982 HB2 PHE 125 HB2 PHE 125 -15.751 -5.305 3.369 983 HB3 PHE 125 HB1 PHE 125 -16.635 -4.566 4.694 984 HD1 PHE 125 HD2 PHE 125 -16.134 -2.273 5.392 985 HD2 PHE 125 HD1 PHE 125 -14.165 -4.069 2.074 986 HE1 PHE 125 HE2 PHE 125 -15.375 -0.055 4.645 987 HE2 PHE 125 HE1 PHE 125 -13.407 -1.852 1.319 988 HZ PHE 125 HZ PHE 125 -14.012 0.156 2.606 989 H SER 126 HN SER 126 -15.743 -5.908 7.497 990 HA SER 126 HA SER 126 -15.316 -8.672 7.542 991 HB2 SER 126 HB2 SER 126 -17.409 -7.084 9.053 992 HB3 SER 126 HB1 SER 126 -16.802 -8.681 9.487 993 HG SER 126 HG SER 126 -14.951 -7.836 10.153 994 H LEU 127 HN LEU 127 -16.095 -9.910 5.899 995 HA LEU 127 HA LEU 127 -18.739 -9.549 4.831 996 HB2 LEU 127 HB2 LEU 127 -16.403 -11.155 4.189 997 HB3 LEU 127 HB1 LEU 127 -17.887 -12.079 4.049 998 HG LEU 127 HG LEU 127 -17.375 -9.449 2.652 999 HD11 LEU 127 HD11 LEU 127 -17.269 -12.260 1.572 1000 HD12 LEU 127 HD12 LEU 127 -15.889 -11.189 1.818 1001 HD13 LEU 127 HD13 LEU 127 -17.124 -10.778 0.625 1002 HD21 LEU 127 HD21 LEU 127 -19.771 -10.007 3.119 1003 HD22 LEU 127 HD22 LEU 127 -19.554 -11.485 2.177 1004 HD23 LEU 127 HD23 LEU 127 -19.373 -9.912 1.402 1005 H ARG 128 HN ARG 128 -20.082 -9.726 6.558 1006 HA ARG 128 HA ARG 128 -20.178 -12.075 8.205 1007 HB2 ARG 128 HB2 ARG 128 -22.035 -9.707 7.913 1008 HB3 ARG 128 HB1 ARG 128 -22.162 -10.939 9.155 1009 HG2 ARG 128 HG2 ARG 128 -20.195 -10.243 10.214 1010 HG3 ARG 128 HG1 ARG 128 -19.676 -9.301 8.814 1011 HD2 ARG 128 HD2 ARG 128 -20.514 -7.897 10.666 1012 HD3 ARG 128 HD1 ARG 128 -21.444 -7.705 9.181 1013 HE ARG 128 HE ARG 128 -22.374 -9.445 11.369 1014 HH11 ARG 128 HH11 ARG 128 -22.890 -6.835 9.089 1015 HH12 ARG 128 HH12 ARG 128 -24.560 -6.627 9.520 1016 HH21 ARG 128 HH21 ARG 128 -24.571 -9.167 11.938 1017 HH22 ARG 128 HH22 ARG 128 -25.519 -7.951 11.124 1018 H GLY 129 HN GLY 129 -22.066 -10.664 5.558 1019 HA2 GLY 129 HA2 GLY 129 -22.964 -13.228 4.684 1020 HA3 GLY 129 HA1 GLY 129 -24.240 -12.362 5.529 1021 H ALA 130 HN ALA 130 -21.707 -11.345 3.249 1022 HA ALA 130 HA ALA 130 -23.837 -10.387 1.455 1023 HB1 ALA 130 HB1 ALA 130 -22.317 -8.549 0.773 1024 HB2 ALA 130 HB2 ALA 130 -21.193 -9.050 2.039 1025 HB3 ALA 130 HB3 ALA 130 -22.798 -8.456 2.470 1026 H GLY 131 HN GLY 131 -21.886 -9.562 -0.543 1027 HA2 GLY 131 HA2 GLY 131 -20.303 -10.608 -2.018 1028 HA3 GLY 131 HA1 GLY 131 -20.800 -12.172 -1.372 1029 H PHE 132 HN PHE 132 -23.555 -10.626 -1.579 1030 HA PHE 132 HA PHE 132 -24.193 -11.813 -4.158 1031 HB2 PHE 132 HB2 PHE 132 -26.516 -11.751 -3.406 1032 HB3 PHE 132 HB1 PHE 132 -25.492 -12.532 -2.203 1033 HD1 PHE 132 HD2 PHE 132 -24.892 -11.321 -0.121 1034 HD2 PHE 132 HD1 PHE 132 -27.752 -9.796 -2.880 1035 HE1 PHE 132 HE2 PHE 132 -25.762 -9.817 1.618 1036 HE2 PHE 132 HE1 PHE 132 -28.620 -8.282 -1.144 1037 HZ PHE 132 HZ PHE 132 -27.626 -8.293 1.106 Start of MODEL 11 1 H1 LYS 2 HT1 LYS 2 23.965 -3.722 3.649 2 H2 LYS 2 HT2 LYS 2 24.518 -2.216 3.101 3 H3 LYS 2 HT3 LYS 2 22.884 -2.420 3.505 4 HA LYS 2 HA LYS 2 24.127 -1.210 5.204 5 HB2 LYS 2 HB2 LYS 2 22.134 -2.756 5.666 6 HB3 LYS 2 HB1 LYS 2 23.316 -3.929 6.233 7 HG2 LYS 2 HG2 LYS 2 22.457 -2.784 8.131 8 HG3 LYS 2 HG1 LYS 2 24.108 -2.218 7.871 9 HD2 LYS 2 HD2 LYS 2 23.254 -0.224 6.751 10 HD3 LYS 2 HD1 LYS 2 21.601 -0.794 6.983 11 HE2 LYS 2 HE2 LYS 2 22.014 -0.760 9.444 12 HE3 LYS 2 HE1 LYS 2 23.579 -0.014 9.120 13 HZ1 LYS 2 HZ1 LYS 2 22.434 1.837 8.059 14 HZ2 LYS 2 HZ2 LYS 2 21.906 1.643 9.661 15 HZ3 LYS 2 HZ3 LYS 2 20.931 1.113 8.375 16 H VAL 3 HN VAL 3 26.385 -1.126 4.754 17 HA VAL 3 HA VAL 3 28.036 -3.380 5.539 18 HB VAL 3 HB VAL 3 29.951 -1.938 4.935 19 HG11 VAL 3 HG11 VAL 3 28.901 -3.339 3.237 20 HG12 VAL 3 HG12 VAL 3 29.498 -1.836 2.534 21 HG13 VAL 3 HG13 VAL 3 27.775 -2.039 2.849 22 HG21 VAL 3 HG21 VAL 3 29.027 0.228 5.550 23 HG22 VAL 3 HG22 VAL 3 27.833 0.104 4.259 24 HG23 VAL 3 HG23 VAL 3 29.547 0.236 3.865 25 H GLN 4 HN GLN 4 26.548 -0.841 7.084 26 HA GLN 4 HA GLN 4 28.581 -0.295 9.049 27 HB2 GLN 4 HB2 GLN 4 25.655 0.471 9.046 28 HB3 GLN 4 HB1 GLN 4 26.900 1.134 10.095 29 HG2 GLN 4 HG2 GLN 4 26.823 2.781 8.549 30 HG3 GLN 4 HG1 GLN 4 28.022 1.742 7.783 31 HE21 GLN 4 HE21 GLN 4 26.288 3.685 6.560 32 HE22 GLN 4 HE22 GLN 4 25.306 2.841 5.405 33 H GLU 5 HN GLU 5 28.709 -2.703 9.440 34 HA GLU 5 HA GLU 5 27.026 -3.295 11.775 35 HB2 GLU 5 HB2 GLU 5 26.303 -4.772 9.988 36 HB3 GLU 5 HB1 GLU 5 27.964 -5.247 9.661 37 HG2 GLU 5 HG2 GLU 5 26.663 -6.938 10.908 38 HG3 GLU 5 HG1 GLU 5 28.120 -6.404 11.744 39 H GLN 6 HN GLN 6 28.531 -2.559 13.216 40 HA GLN 6 HA GLN 6 31.298 -3.332 12.974 41 HB2 GLN 6 HB2 GLN 6 30.448 -1.090 13.817 42 HB3 GLN 6 HB1 GLN 6 29.994 -1.923 15.299 43 HG2 GLN 6 HG2 GLN 6 32.284 -2.509 15.728 44 HG3 GLN 6 HG1 GLN 6 32.786 -1.835 14.177 45 HE21 GLN 6 HE21 GLN 6 31.826 -1.143 17.426 46 HE22 GLN 6 HE22 GLN 6 32.192 0.554 17.386 47 H SER 7 HN SER 7 31.061 -5.608 13.108 48 HA SER 7 HA SER 7 30.366 -6.644 15.765 49 HB2 SER 7 HB2 SER 7 30.719 -8.135 13.147 50 HB3 SER 7 HB1 SER 7 30.217 -8.852 14.677 51 HG SER 7 HG SER 7 28.753 -6.675 13.707 52 H VAL 8 HN VAL 8 32.216 -6.292 16.924 53 HA VAL 8 HA VAL 8 34.788 -7.094 15.831 54 HB VAL 8 HB VAL 8 34.173 -6.035 18.594 55 HG11 VAL 8 HG11 VAL 8 36.297 -7.223 18.457 56 HG12 VAL 8 HG12 VAL 8 36.566 -5.491 18.657 57 HG13 VAL 8 HG13 VAL 8 36.771 -6.239 17.073 58 HG21 VAL 8 HG21 VAL 8 35.049 -4.559 16.113 59 HG22 VAL 8 HG22 VAL 8 34.984 -3.867 17.734 60 HG23 VAL 8 HG23 VAL 8 33.501 -4.398 16.942 61 H GLY 9 HN GLY 9 34.616 -9.301 15.636 62 HA2 GLY 9 HA2 GLY 9 35.441 -10.895 17.722 63 HA3 GLY 9 HA1 GLY 9 33.688 -10.974 17.746 64 H ALA 10 HN ALA 10 33.035 -12.775 16.861 65 HA ALA 10 HA ALA 10 34.705 -14.186 14.987 66 HB1 ALA 10 HB1 ALA 10 33.123 -16.002 15.194 67 HB2 ALA 10 HB2 ALA 10 31.994 -14.952 16.051 68 HB3 ALA 10 HB3 ALA 10 33.542 -15.370 16.786 69 HA PRO 11 HA PRO 11 30.908 -13.767 12.045 70 HB2 PRO 11 HB2 PRO 11 29.075 -11.822 12.558 71 HB3 PRO 11 HB1 PRO 11 28.926 -13.476 13.163 72 HG2 PRO 11 HG2 PRO 11 29.942 -11.035 14.563 73 HG3 PRO 11 HG1 PRO 11 28.839 -12.290 15.162 74 HD2 PRO 11 HD2 PRO 11 31.452 -12.260 15.813 75 HD3 PRO 11 HD1 PRO 11 30.563 -13.778 15.579 76 HA PRO 12 HA PRO 12 32.957 -10.337 9.952 77 HB2 PRO 12 HB2 PRO 12 31.461 -11.425 7.650 78 HB3 PRO 12 HB1 PRO 12 33.199 -11.182 7.842 79 HG2 PRO 12 HG2 PRO 12 32.133 -13.633 7.861 80 HG3 PRO 12 HG1 PRO 12 33.499 -13.209 8.913 81 HD2 PRO 12 HD2 PRO 12 30.585 -13.430 9.592 82 HD3 PRO 12 HD1 PRO 12 31.999 -13.999 10.505 83 HA PRO 13 HA PRO 13 29.715 -7.362 10.179 84 HB2 PRO 13 HB2 PRO 13 31.245 -5.884 8.112 85 HB3 PRO 13 HB1 PRO 13 30.765 -5.383 9.738 86 HG2 PRO 13 HG2 PRO 13 33.294 -6.013 9.211 87 HG3 PRO 13 HG1 PRO 13 32.540 -6.491 10.745 88 HD2 PRO 13 HD2 PRO 13 33.058 -8.137 8.296 89 HD3 PRO 13 HD1 PRO 13 33.283 -8.562 10.006 90 H GLY 14 HN GLY 14 28.143 -8.748 9.081 91 HA2 GLY 14 HA2 GLY 14 26.265 -8.446 7.724 92 HA3 GLY 14 HA1 GLY 14 27.179 -7.312 6.744 93 H ARG 15 HN ARG 15 25.872 -10.384 6.895 94 HA ARG 15 HA ARG 15 27.533 -11.261 4.618 95 HB2 ARG 15 HB2 ARG 15 26.842 -13.538 5.092 96 HB3 ARG 15 HB1 ARG 15 27.532 -12.822 6.538 97 HG2 ARG 15 HG2 ARG 15 25.304 -12.455 7.443 98 HG3 ARG 15 HG1 ARG 15 24.590 -13.134 5.979 99 HD2 ARG 15 HD2 ARG 15 24.606 -14.818 7.699 100 HD3 ARG 15 HD1 ARG 15 25.763 -15.263 6.447 101 HE ARG 15 HE ARG 15 27.115 -13.825 8.448 102 HH11 ARG 15 HH11 ARG 15 25.558 -16.933 7.938 103 HH12 ARG 15 HH12 ARG 15 26.493 -17.734 9.166 104 HH21 ARG 15 HH21 ARG 15 28.350 -14.889 10.037 105 HH22 ARG 15 HH22 ARG 15 28.076 -16.572 10.368 106 H ALA 16 HN ALA 16 26.577 -11.795 2.706 107 HA ALA 16 HA ALA 16 23.661 -11.387 2.523 108 HB1 ALA 16 HB1 ALA 16 23.983 -10.427 0.307 109 HB2 ALA 16 HB2 ALA 16 25.726 -10.642 0.450 110 HB3 ALA 16 HB3 ALA 16 24.886 -9.514 1.515 111 H ASP 17 HN ASP 17 23.235 -13.578 2.700 112 HA ASP 17 HA ASP 17 24.575 -15.588 1.221 113 HB2 ASP 17 HB2 ASP 17 22.877 -17.098 2.016 114 HB3 ASP 17 HB1 ASP 17 23.283 -15.998 3.327 115 H LYS 18 HN LYS 18 21.924 -13.474 0.519 116 HA LYS 18 HA LYS 18 21.400 -14.903 -1.999 117 HB2 LYS 18 HB2 LYS 18 19.822 -12.733 -0.597 118 HB3 LYS 18 HB1 LYS 18 19.358 -13.506 -2.108 119 HG2 LYS 18 HG2 LYS 18 18.986 -15.580 -1.051 120 HG3 LYS 18 HG1 LYS 18 19.797 -15.058 0.425 121 HD2 LYS 18 HD2 LYS 18 18.008 -13.424 0.811 122 HD3 LYS 18 HD1 LYS 18 17.189 -13.986 -0.648 123 HE2 LYS 18 HE2 LYS 18 16.202 -15.004 1.323 124 HE3 LYS 18 HE1 LYS 18 17.002 -16.226 0.334 125 HZ1 LYS 18 HZ1 LYS 18 17.600 -16.671 2.549 126 HZ2 LYS 18 HZ2 LYS 18 17.935 -15.046 2.889 127 HZ3 LYS 18 HZ3 LYS 18 18.967 -15.930 1.870 128 H THR 19 HN THR 19 23.361 -14.163 -2.948 129 HA THR 19 HA THR 19 23.783 -11.310 -3.240 130 HB THR 19 HB THR 19 25.358 -13.499 -4.594 131 HG1 THR 19 HG1 THR 19 25.123 -12.939 -1.917 132 HG21 THR 19 HG21 THR 19 26.043 -10.703 -3.675 133 HG22 THR 19 HG22 THR 19 25.854 -11.245 -5.342 134 HG23 THR 19 HG23 THR 19 27.194 -11.848 -4.369 135 H ALA 20 HN ALA 20 21.567 -11.262 -4.348 136 HA ALA 20 HA ALA 20 21.626 -12.060 -7.148 137 HB1 ALA 20 HB1 ALA 20 19.571 -12.406 -5.859 138 HB2 ALA 20 HB2 ALA 20 19.303 -11.294 -7.203 139 HB3 ALA 20 HB3 ALA 20 19.465 -10.671 -5.562 140 H ALA 21 HN ALA 21 23.577 -10.264 -6.583 141 HA ALA 21 HA ALA 21 22.852 -7.548 -6.854 142 HB1 ALA 21 HB1 ALA 21 25.213 -7.104 -7.156 143 HB2 ALA 21 HB2 ALA 21 25.522 -8.816 -7.440 144 HB3 ALA 21 HB3 ALA 21 24.970 -8.274 -5.855 145 HA PRO 22 HA PRO 22 23.845 -7.884 -11.508 146 HB2 PRO 22 HB2 PRO 22 24.372 -10.237 -12.679 147 HB3 PRO 22 HB1 PRO 22 25.629 -9.325 -11.832 148 HG2 PRO 22 HG2 PRO 22 24.048 -11.686 -10.902 149 HG3 PRO 22 HG1 PRO 22 25.775 -11.342 -10.695 150 HD2 PRO 22 HD2 PRO 22 23.873 -10.911 -8.759 151 HD3 PRO 22 HD1 PRO 22 25.415 -10.040 -8.854 152 H GLN 23 HN GLN 23 21.441 -8.822 -9.910 153 HA GLN 23 HA GLN 23 19.799 -9.622 -12.214 154 HB2 GLN 23 HB2 GLN 23 19.491 -10.710 -9.411 155 HB3 GLN 23 HB1 GLN 23 18.449 -11.071 -10.779 156 HG2 GLN 23 HG2 GLN 23 20.249 -12.209 -11.905 157 HG3 GLN 23 HG1 GLN 23 21.374 -11.757 -10.625 158 HE21 GLN 23 HE21 GLN 23 20.647 -14.403 -11.579 159 HE22 GLN 23 HE22 GLN 23 20.016 -15.247 -10.202 160 H THR 24 HN THR 24 19.457 -8.712 -8.801 161 HA THR 24 HA THR 24 18.276 -7.082 -7.761 162 HB THR 24 HB THR 24 17.840 -5.846 -10.487 163 HG1 THR 24 HG1 THR 24 19.900 -5.400 -10.382 164 HG21 THR 24 HG21 THR 24 16.358 -4.964 -8.749 165 HG22 THR 24 HG22 THR 24 17.563 -3.765 -9.221 166 HG23 THR 24 HG23 THR 24 17.751 -4.657 -7.712 167 H ARG 25 HN ARG 25 16.810 -8.424 -10.682 168 HA ARG 25 HA ARG 25 14.717 -9.218 -11.130 169 HB2 ARG 25 HB2 ARG 25 14.357 -9.129 -8.130 170 HB3 ARG 25 HB1 ARG 25 13.356 -10.028 -9.273 171 HG2 ARG 25 HG2 ARG 25 16.296 -10.415 -9.090 172 HG3 ARG 25 HG1 ARG 25 15.176 -11.321 -8.048 173 HD2 ARG 25 HD2 ARG 25 14.028 -12.162 -10.039 174 HD3 ARG 25 HD1 ARG 25 15.128 -11.252 -11.066 175 HE ARG 25 HE ARG 25 16.455 -13.118 -9.319 176 HH11 ARG 25 HH11 ARG 25 14.812 -12.685 -12.378 177 HH12 ARG 25 HH12 ARG 25 15.602 -14.036 -13.140 178 HH21 ARG 25 HH21 ARG 25 17.486 -14.927 -10.318 179 HH22 ARG 25 HH22 ARG 25 17.105 -15.309 -11.975 180 H LEU 26 HN LEU 26 15.418 -6.371 -10.278 181 HA LEU 26 HA LEU 26 14.486 -4.295 -10.288 182 HB2 LEU 26 HB2 LEU 26 12.244 -5.809 -11.621 183 HB3 LEU 26 HB1 LEU 26 12.190 -4.077 -11.367 184 HG LEU 26 HG LEU 26 12.858 -4.418 -13.615 185 HD11 LEU 26 HD11 LEU 26 15.322 -3.805 -11.996 186 HD12 LEU 26 HD12 LEU 26 14.071 -2.655 -12.470 187 HD13 LEU 26 HD13 LEU 26 15.078 -3.419 -13.700 188 HD21 LEU 26 HD21 LEU 26 13.527 -6.748 -13.485 189 HD22 LEU 26 HD22 LEU 26 14.981 -6.298 -12.595 190 HD23 LEU 26 HD23 LEU 26 14.780 -5.786 -14.271 191 H THR 27 HN THR 27 14.345 -5.808 -7.927 192 HA THR 27 HA THR 27 11.747 -4.947 -6.834 193 HB THR 27 HB THR 27 12.146 -6.684 -5.035 194 HG1 THR 27 HG1 THR 27 14.187 -7.421 -6.875 195 HG21 THR 27 HG21 THR 27 10.532 -7.018 -6.829 196 HG22 THR 27 HG22 THR 27 11.337 -8.535 -6.425 197 HG23 THR 27 HG23 THR 27 11.804 -7.646 -7.876 198 HA PRO 28 HA PRO 28 14.606 -2.298 -4.498 199 HB2 PRO 28 HB2 PRO 28 12.788 -0.352 -4.034 200 HB3 PRO 28 HB1 PRO 28 13.670 -0.469 -5.561 201 HG2 PRO 28 HG2 PRO 28 10.887 -1.344 -4.907 202 HG3 PRO 28 HG1 PRO 28 11.491 -0.528 -6.361 203 HD2 PRO 28 HD2 PRO 28 11.008 -3.213 -6.230 204 HD3 PRO 28 HD1 PRO 28 12.225 -2.491 -7.304 205 H TYR 29 HN TYR 29 14.713 -1.944 -2.269 206 HA TYR 29 HA TYR 29 13.065 -3.680 -0.686 207 HB2 TYR 29 HB2 TYR 29 14.518 -2.805 1.212 208 HB3 TYR 29 HB1 TYR 29 15.347 -3.663 -0.078 209 HD1 TYR 29 HD2 TYR 29 14.766 -0.359 1.448 210 HD2 TYR 29 HD1 TYR 29 16.933 -2.549 -1.486 211 HE1 TYR 29 HE2 TYR 29 16.310 1.536 1.184 212 HE2 TYR 29 HE1 TYR 29 18.485 -0.662 -1.758 213 HH TYR 29 HH TYR 29 18.399 2.111 0.371 214 H ALA 30 HN ALA 30 11.292 -2.068 -1.648 215 HA ALA 30 HA ALA 30 10.863 0.241 0.073 216 HB1 ALA 30 HB1 ALA 30 9.018 0.769 -1.411 217 HB2 ALA 30 HB2 ALA 30 9.214 -0.778 -2.234 218 HB3 ALA 30 HB3 ALA 30 10.482 0.442 -2.341 219 H GLN 31 HN GLN 31 10.202 -2.994 0.243 220 HA GLN 31 HA GLN 31 7.519 -2.814 1.300 221 HB2 GLN 31 HB2 GLN 31 7.830 -5.259 1.769 222 HB3 GLN 31 HB1 GLN 31 8.021 -4.808 0.083 223 HG2 GLN 31 HG2 GLN 31 10.433 -4.929 0.298 224 HG3 GLN 31 HG1 GLN 31 10.277 -5.299 2.014 225 HE21 GLN 31 HE21 GLN 31 11.333 -7.253 1.822 226 HE22 GLN 31 HE22 GLN 31 10.605 -8.634 1.067 227 H ALA 32 HN ALA 32 8.687 -1.114 2.786 228 HA ALA 32 HA ALA 32 9.289 -2.465 5.336 229 HB1 ALA 32 HB1 ALA 32 10.425 0.148 4.340 230 HB2 ALA 32 HB2 ALA 32 11.290 -1.386 4.444 231 HB3 ALA 32 HB3 ALA 32 10.741 -0.581 5.915 232 H GLY 33 HN GLY 33 6.755 -1.486 4.112 233 HA2 GLY 33 HA2 GLY 33 6.011 0.828 5.697 234 HA3 GLY 33 HA1 GLY 33 4.968 -0.071 4.601 235 H GLU 34 HN GLU 34 6.619 -0.339 7.708 236 HA GLU 34 HA GLU 34 5.044 -2.521 8.636 237 HB2 GLU 34 HB2 GLU 34 6.845 -0.596 10.118 238 HB3 GLU 34 HB1 GLU 34 6.159 -2.061 10.807 239 HG2 GLU 34 HG2 GLU 34 7.976 -2.010 8.413 240 HG3 GLU 34 HG1 GLU 34 8.511 -2.289 10.070 241 H ASP 35 HN ASP 35 2.993 -1.403 8.046 242 HA ASP 35 HA ASP 35 1.434 -0.681 10.218 243 HB2 ASP 35 HB2 ASP 35 2.819 1.400 10.269 244 HB3 ASP 35 HB1 ASP 35 2.303 1.757 8.627 245 H ASN 36 HN ASN 36 2.158 -0.658 6.866 246 HA ASN 36 HA ASN 36 0.973 -0.820 4.947 247 HB2 ASN 36 HB2 ASN 36 -1.368 -1.328 6.792 248 HB3 ASN 36 HB1 ASN 36 -1.511 -1.307 5.038 249 HD21 ASN 36 HD21 ASN 36 -0.532 -3.084 7.792 250 HD22 ASN 36 HD22 ASN 36 -0.054 -4.525 6.968 251 H TRP 37 HN TRP 37 0.915 1.546 7.051 252 HA TRP 37 HA TRP 37 0.269 3.711 7.170 253 HB2 TRP 37 HB2 TRP 37 -0.221 3.551 4.197 254 HB3 TRP 37 HB1 TRP 37 0.200 4.971 5.143 255 HD1 TRP 37 HD1 TRP 37 2.736 3.860 6.677 256 HE1 TRP 37 HE1 TRP 37 4.903 3.367 5.380 257 HE3 TRP 37 HE3 TRP 37 0.766 3.407 1.987 258 HZ2 TRP 37 HZ2 TRP 37 5.671 2.866 2.696 259 HZ3 TRP 37 HZ3 TRP 37 2.277 2.929 0.110 260 HH2 TRP 37 HH2 TRP 37 4.679 2.663 0.453 261 H ARG 38 HN ARG 38 -1.825 1.600 7.364 262 HA ARG 38 HA ARG 38 -4.047 2.367 5.792 263 HB2 ARG 38 HB2 ARG 38 -5.333 0.934 7.478 264 HB3 ARG 38 HB1 ARG 38 -4.136 0.153 6.450 265 HG2 ARG 38 HG2 ARG 38 -2.512 0.326 8.337 266 HG3 ARG 38 HG1 ARG 38 -3.833 0.919 9.347 267 HD2 ARG 38 HD2 ARG 38 -4.995 -1.120 9.203 268 HD3 ARG 38 HD1 ARG 38 -4.006 -1.684 7.854 269 HE ARG 38 HE ARG 38 -2.188 -1.407 9.817 270 HH11 ARG 38 HH11 ARG 38 -5.303 -2.999 9.705 271 HH12 ARG 38 HH12 ARG 38 -4.874 -4.207 10.882 272 HH21 ARG 38 HH21 ARG 38 -1.591 -3.022 11.326 273 HH22 ARG 38 HH22 ARG 38 -2.760 -4.230 11.799 274 H SER 39 HN SER 39 -3.202 3.017 9.173 275 HA SER 39 HA SER 39 -5.571 4.452 9.766 276 HB2 SER 39 HB2 SER 39 -4.062 5.420 11.622 277 HB3 SER 39 HB1 SER 39 -4.315 3.674 11.616 278 HG SER 39 HG SER 39 -2.201 3.657 11.646 279 H ARG 40 HN ARG 40 -2.432 5.332 8.482 280 HA ARG 40 HA ARG 40 -2.799 8.126 8.517 281 HB2 ARG 40 HB2 ARG 40 -1.051 6.999 6.413 282 HB3 ARG 40 HB1 ARG 40 -0.734 8.201 7.633 283 HG2 ARG 40 HG2 ARG 40 -0.716 5.241 8.105 284 HG3 ARG 40 HG1 ARG 40 0.699 6.261 7.896 285 HD2 ARG 40 HD2 ARG 40 0.295 7.407 9.924 286 HD3 ARG 40 HD1 ARG 40 -1.320 6.716 10.076 287 HE ARG 40 HE ARG 40 0.015 4.497 10.212 288 HH11 ARG 40 HH11 ARG 40 1.051 7.576 11.522 289 HH12 ARG 40 HH12 ARG 40 1.944 6.866 12.825 290 HH21 ARG 40 HH21 ARG 40 1.149 3.549 11.936 291 HH22 ARG 40 HH22 ARG 40 1.986 4.569 13.085 292 H ILE 41 HN ILE 41 -3.122 5.646 6.014 293 HA ILE 41 HA ILE 41 -3.982 7.321 3.937 294 HB ILE 41 HB ILE 41 -4.308 4.373 4.462 295 HG12 ILE 41 HG12 ILE 41 -2.764 5.921 2.373 296 HG13 ILE 41 HG11 ILE 41 -2.080 5.219 3.832 297 HG21 ILE 41 HG21 ILE 41 -6.289 4.993 3.233 298 HG22 ILE 41 HG22 ILE 41 -5.184 4.107 2.183 299 HG23 ILE 41 HG23 ILE 41 -5.314 5.860 2.046 300 HD11 ILE 41 HD11 ILE 41 -1.621 3.853 1.874 301 HD12 ILE 41 HD12 ILE 41 -3.351 3.688 1.574 302 HD13 ILE 41 HD13 ILE 41 -2.637 2.990 3.029 303 H SER 42 HN SER 42 -5.752 5.596 6.480 304 HA SER 42 HA SER 42 -8.349 6.033 5.605 305 HB2 SER 42 HB2 SER 42 -7.239 5.970 8.417 306 HB3 SER 42 HB1 SER 42 -8.966 5.985 8.048 307 HG SER 42 HG SER 42 -7.039 4.002 7.441 308 H GLY 43 HN GLY 43 -6.178 8.255 7.316 309 HA2 GLY 43 HA2 GLY 43 -8.087 10.330 7.685 310 HA3 GLY 43 HA1 GLY 43 -6.339 10.529 7.672 311 H ARG 44 HN ARG 44 -5.746 9.688 5.112 312 HA ARG 44 HA ARG 44 -6.352 12.003 3.607 313 HB2 ARG 44 HB2 ARG 44 -4.827 9.479 3.137 314 HB3 ARG 44 HB1 ARG 44 -5.182 10.536 1.795 315 HG2 ARG 44 HG2 ARG 44 -2.987 11.016 2.637 316 HG3 ARG 44 HG1 ARG 44 -4.056 12.381 2.964 317 HD2 ARG 44 HD2 ARG 44 -4.341 11.624 5.260 318 HD3 ARG 44 HD1 ARG 44 -3.317 10.223 4.938 319 HE ARG 44 HE ARG 44 -1.753 12.374 4.287 320 HH11 ARG 44 HH11 ARG 44 -3.556 11.444 7.143 321 HH12 ARG 44 HH12 ARG 44 -2.417 12.145 8.245 322 HH21 ARG 44 HH21 ARG 44 -0.263 13.313 5.732 323 HH22 ARG 44 HH22 ARG 44 -0.553 13.227 7.446 324 H LEU 45 HN LEU 45 -7.572 8.721 3.649 325 HA LEU 45 HA LEU 45 -9.065 8.749 1.265 326 HB2 LEU 45 HB2 LEU 45 -8.511 6.954 3.240 327 HB3 LEU 45 HB1 LEU 45 -10.179 7.331 3.601 328 HG LEU 45 HG LEU 45 -9.230 6.364 0.914 329 HD11 LEU 45 HD11 LEU 45 -10.449 4.810 3.186 330 HD12 LEU 45 HD12 LEU 45 -8.790 4.673 2.594 331 HD13 LEU 45 HD13 LEU 45 -10.138 4.185 1.565 332 HD21 LEU 45 HD21 LEU 45 -11.959 6.672 2.136 333 HD22 LEU 45 HD22 LEU 45 -11.641 5.770 0.655 334 HD23 LEU 45 HD23 LEU 45 -11.314 7.505 0.721 335 H ASN 46 HN ASN 46 -9.609 9.978 4.437 336 HA ASN 46 HA ASN 46 -12.381 10.606 4.215 337 HB2 ASN 46 HB2 ASN 46 -11.509 10.338 6.428 338 HB3 ASN 46 HB1 ASN 46 -10.200 11.471 6.126 339 HD21 ASN 46 HD21 ASN 46 -13.567 11.114 6.876 340 HD22 ASN 46 HD22 ASN 46 -13.857 12.762 7.301 341 H ARG 47 HN ARG 47 -9.360 12.191 3.570 342 HA ARG 47 HA ARG 47 -10.216 14.773 3.021 343 HB2 ARG 47 HB2 ARG 47 -7.977 14.817 2.902 344 HB3 ARG 47 HB1 ARG 47 -7.882 13.108 2.530 345 HG2 ARG 47 HG2 ARG 47 -8.256 13.584 0.166 346 HG3 ARG 47 HG1 ARG 47 -8.364 15.313 0.534 347 HD2 ARG 47 HD2 ARG 47 -6.076 15.300 1.366 348 HD3 ARG 47 HD1 ARG 47 -5.964 13.565 1.082 349 HE ARG 47 HE ARG 47 -6.613 15.055 -1.287 350 HH11 ARG 47 HH11 ARG 47 -3.951 14.076 0.795 351 HH12 ARG 47 HH12 ARG 47 -2.790 14.070 -0.504 352 HH21 ARG 47 HH21 ARG 47 -5.064 15.060 -2.967 353 HH22 ARG 47 HH22 ARG 47 -3.421 14.630 -2.623 354 H PHE 48 HN PHE 48 -10.841 11.828 1.316 355 HA PHE 48 HA PHE 48 -11.950 13.436 -0.858 356 HB2 PHE 48 HB2 PHE 48 -11.029 10.573 -0.909 357 HB3 PHE 48 HB1 PHE 48 -11.902 11.340 -2.229 358 HD1 PHE 48 HD1 PHE 48 -10.850 13.334 -3.363 359 HD2 PHE 48 HD2 PHE 48 -8.712 10.781 -0.715 360 HE1 PHE 48 HE1 PHE 48 -8.728 14.120 -4.325 361 HE2 PHE 48 HE2 PHE 48 -6.582 11.571 -1.664 362 HZ PHE 48 HZ PHE 48 -6.590 13.240 -3.473 363 H LYS 49 HN LYS 49 -12.567 10.343 0.794 364 HA LYS 49 HA LYS 49 -15.366 10.919 1.153 365 HB2 LYS 49 HB2 LYS 49 -14.521 8.732 -0.771 366 HB3 LYS 49 HB1 LYS 49 -16.123 8.869 -0.074 367 HG2 LYS 49 HG2 LYS 49 -16.280 11.134 -1.165 368 HG3 LYS 49 HG1 LYS 49 -14.807 10.713 -2.042 369 HD2 LYS 49 HD2 LYS 49 -15.901 8.740 -2.964 370 HD3 LYS 49 HD1 LYS 49 -17.365 9.119 -2.057 371 HE2 LYS 49 HE2 LYS 49 -17.394 11.328 -3.292 372 HE3 LYS 49 HE1 LYS 49 -16.148 10.650 -4.340 373 HZ1 LYS 49 HZ1 LYS 49 -18.914 9.649 -3.949 374 HZ2 LYS 49 HZ2 LYS 49 -17.724 8.792 -4.792 375 HZ3 LYS 49 HZ3 LYS 49 -18.244 10.296 -5.368 376 H ARG 50 HN ARG 50 -15.326 10.290 3.304 377 HA ARG 50 HA ARG 50 -14.176 7.633 3.805 378 HB2 ARG 50 HB2 ARG 50 -13.331 9.602 5.139 379 HB3 ARG 50 HB1 ARG 50 -14.921 9.678 5.892 380 HG2 ARG 50 HG2 ARG 50 -13.346 8.473 7.296 381 HG3 ARG 50 HG1 ARG 50 -14.634 7.406 6.735 382 HD2 ARG 50 HD2 ARG 50 -13.159 6.520 5.008 383 HD3 ARG 50 HD1 ARG 50 -11.872 7.603 5.540 384 HE ARG 50 HE ARG 50 -12.795 6.006 7.700 385 HH11 ARG 50 HH11 ARG 50 -10.875 5.830 4.779 386 HH12 ARG 50 HH12 ARG 50 -9.853 4.561 5.368 387 HH21 ARG 50 HH21 ARG 50 -11.445 4.343 8.491 388 HH22 ARG 50 HH22 ARG 50 -10.158 3.731 7.498 389 H TYR 51 HN TYR 51 -15.703 6.211 3.418 390 HA TYR 51 HA TYR 51 -18.448 6.647 4.270 391 HB2 TYR 51 HB2 TYR 51 -17.256 5.296 2.148 392 HB3 TYR 51 HB1 TYR 51 -17.780 4.004 3.220 393 HD1 TYR 51 HD1 TYR 51 -20.201 3.782 3.789 394 HD2 TYR 51 HD2 TYR 51 -18.813 6.553 0.876 395 HE1 TYR 51 HE1 TYR 51 -22.475 3.951 2.873 396 HE2 TYR 51 HE2 TYR 51 -21.087 6.731 -0.047 397 HH TYR 51 HH TYR 51 -23.155 5.272 -0.120 398 HA PRO 52 HA PRO 52 -17.572 4.524 8.137 399 HB2 PRO 52 HB2 PRO 52 -20.167 4.265 8.943 400 HB3 PRO 52 HB1 PRO 52 -19.240 5.759 9.113 401 HG2 PRO 52 HG2 PRO 52 -21.241 5.003 7.020 402 HG3 PRO 52 HG1 PRO 52 -21.027 6.548 7.864 403 HD2 PRO 52 HD2 PRO 52 -20.112 6.145 5.356 404 HD3 PRO 52 HD1 PRO 52 -19.266 7.191 6.515 405 H LYS 53 HN LYS 53 -17.295 2.413 8.533 406 HA LYS 53 HA LYS 53 -17.927 0.505 6.560 407 HB2 LYS 53 HB2 LYS 53 -17.058 0.053 9.424 408 HB3 LYS 53 HB1 LYS 53 -17.079 -1.176 8.174 409 HG2 LYS 53 HG2 LYS 53 -15.379 1.311 8.157 410 HG3 LYS 53 HG1 LYS 53 -14.832 -0.309 8.580 411 HD2 LYS 53 HD2 LYS 53 -14.176 -0.262 6.399 412 HD3 LYS 53 HD1 LYS 53 -15.825 -0.847 6.176 413 HE2 LYS 53 HE2 LYS 53 -15.232 0.985 4.616 414 HE3 LYS 53 HE1 LYS 53 -16.599 1.378 5.671 415 HZ1 LYS 53 HZ1 LYS 53 -15.055 3.220 5.518 416 HZ2 LYS 53 HZ2 LYS 53 -13.783 2.248 6.079 417 HZ3 LYS 53 HZ3 LYS 53 -15.084 2.622 7.101 418 H ASP 54 HN ASP 54 -19.690 1.554 9.353 419 HA ASP 54 HA ASP 54 -21.315 -0.657 9.838 420 HB2 ASP 54 HB2 ASP 54 -21.301 1.304 11.296 421 HB3 ASP 54 HB1 ASP 54 -22.025 2.280 10.020 422 H ALA 55 HN ALA 55 -21.696 1.968 7.497 423 HA ALA 55 HA ALA 55 -24.186 1.120 6.462 424 HB1 ALA 55 HB1 ALA 55 -23.331 3.384 6.146 425 HB2 ALA 55 HB2 ALA 55 -23.714 2.625 4.601 426 HB3 ALA 55 HB3 ALA 55 -22.034 2.759 5.128 427 H LEU 56 HN LEU 56 -20.892 0.217 5.816 428 HA LEU 56 HA LEU 56 -21.460 -1.211 3.392 429 HB2 LEU 56 HB2 LEU 56 -19.071 -1.112 5.227 430 HB3 LEU 56 HB1 LEU 56 -19.140 -2.209 3.864 431 HG LEU 56 HG LEU 56 -17.867 -0.329 3.196 432 HD11 LEU 56 HD11 LEU 56 -20.626 0.025 2.059 433 HD12 LEU 56 HD12 LEU 56 -19.456 -1.189 1.545 434 HD13 LEU 56 HD13 LEU 56 -19.106 0.524 1.318 435 HD21 LEU 56 HD21 LEU 56 -18.718 1.971 3.272 436 HD22 LEU 56 HD22 LEU 56 -18.542 1.267 4.879 437 HD23 LEU 56 HD23 LEU 56 -20.141 1.402 4.147 438 H ARG 57 HN ARG 57 -20.972 -2.055 6.788 439 HA ARG 57 HA ARG 57 -21.135 -4.824 6.575 440 HB2 ARG 57 HB2 ARG 57 -22.054 -3.000 8.799 441 HB3 ARG 57 HB1 ARG 57 -21.937 -4.750 8.942 442 HG2 ARG 57 HG2 ARG 57 -19.539 -4.619 8.492 443 HG3 ARG 57 HG1 ARG 57 -19.663 -2.868 8.354 444 HD2 ARG 57 HD2 ARG 57 -20.298 -2.661 10.648 445 HD3 ARG 57 HD1 ARG 57 -20.439 -4.409 10.823 446 HE ARG 57 HE ARG 57 -17.844 -4.025 10.067 447 HH11 ARG 57 HH11 ARG 57 -19.843 -2.699 12.621 448 HH12 ARG 57 HH12 ARG 57 -18.534 -2.574 13.759 449 HH21 ARG 57 HH21 ARG 57 -16.109 -3.885 11.572 450 HH22 ARG 57 HH22 ARG 57 -16.421 -3.274 13.175 451 H LEU 58 HN LEU 58 -23.652 -2.418 6.458 452 HA LEU 58 HA LEU 58 -25.695 -4.512 6.479 453 HB2 LEU 58 HB2 LEU 58 -26.020 -1.513 6.505 454 HB3 LEU 58 HB1 LEU 58 -27.310 -2.690 6.668 455 HG LEU 58 HG LEU 58 -25.072 -2.197 8.638 456 HD11 LEU 58 HD11 LEU 58 -26.788 -0.488 8.686 457 HD12 LEU 58 HD12 LEU 58 -26.898 -1.506 10.122 458 HD13 LEU 58 HD13 LEU 58 -28.043 -1.722 8.797 459 HD21 LEU 58 HD21 LEU 58 -25.634 -4.576 8.532 460 HD22 LEU 58 HD22 LEU 58 -27.338 -4.186 8.769 461 HD23 LEU 58 HD23 LEU 58 -26.173 -3.853 10.049 462 H LYS 59 HN LYS 59 -23.757 -3.715 4.225 463 HA LYS 59 HA LYS 59 -25.777 -3.802 2.131 464 HB2 LYS 59 HB2 LYS 59 -25.353 -1.420 2.373 465 HB3 LYS 59 HB1 LYS 59 -23.622 -1.679 2.231 466 HG2 LYS 59 HG2 LYS 59 -24.098 -2.624 -0.069 467 HG3 LYS 59 HG1 LYS 59 -25.725 -1.977 0.120 468 HD2 LYS 59 HD2 LYS 59 -23.220 -0.325 0.361 469 HD3 LYS 59 HD1 LYS 59 -24.156 -0.489 -1.125 470 HE2 LYS 59 HE2 LYS 59 -26.110 0.451 0.007 471 HE3 LYS 59 HE1 LYS 59 -25.171 0.615 1.492 472 HZ1 LYS 59 HZ1 LYS 59 -24.470 1.943 -1.071 473 HZ2 LYS 59 HZ2 LYS 59 -23.750 2.190 0.435 474 HZ3 LYS 59 HZ3 LYS 59 -25.344 2.691 0.178 475 H ARG 60 HN ARG 60 -22.258 -3.165 2.068 476 HA ARG 60 HA ARG 60 -21.919 -5.685 0.580 477 HB2 ARG 60 HB2 ARG 60 -20.425 -3.125 -0.012 478 HB3 ARG 60 HB1 ARG 60 -20.365 -4.623 -0.922 479 HG2 ARG 60 HG2 ARG 60 -22.782 -2.841 -0.688 480 HG3 ARG 60 HG1 ARG 60 -21.649 -2.844 -2.038 481 HD2 ARG 60 HD2 ARG 60 -22.207 -5.248 -2.404 482 HD3 ARG 60 HD1 ARG 60 -23.462 -5.090 -1.172 483 HE ARG 60 HE ARG 60 -23.689 -3.092 -3.207 484 HH11 ARG 60 HH11 ARG 60 -24.498 -6.425 -2.419 485 HH12 ARG 60 HH12 ARG 60 -25.783 -6.511 -3.579 486 HH21 ARG 60 HH21 ARG 60 -25.381 -3.224 -4.730 487 HH22 ARG 60 HH22 ARG 60 -26.283 -4.696 -4.899 488 H GLN 61 HN GLN 61 -20.977 -6.808 2.300 489 HA GLN 61 HA GLN 61 -18.595 -5.666 3.549 490 HB2 GLN 61 HB2 GLN 61 -19.691 -8.446 3.973 491 HB3 GLN 61 HB1 GLN 61 -18.614 -7.538 5.014 492 HG2 GLN 61 HG2 GLN 61 -20.365 -6.037 5.651 493 HG3 GLN 61 HG1 GLN 61 -21.470 -6.756 4.479 494 HE21 GLN 61 HE21 GLN 61 -22.956 -7.251 6.115 495 HE22 GLN 61 HE22 GLN 61 -22.691 -8.558 7.221 496 H GLY 62 HN GLY 62 -16.710 -5.878 2.462 497 HA2 GLY 62 HA2 GLY 62 -16.025 -8.486 1.394 498 HA3 GLY 62 HA1 GLY 62 -16.143 -7.201 0.208 499 H VAL 63 HN VAL 63 -14.012 -8.917 1.869 500 HA VAL 63 HA VAL 63 -12.115 -6.707 2.190 501 HB VAL 63 HB VAL 63 -12.256 -8.102 4.169 502 HG11 VAL 63 HG11 VAL 63 -11.659 -10.463 4.154 503 HG12 VAL 63 HG12 VAL 63 -11.497 -10.421 2.399 504 HG13 VAL 63 HG13 VAL 63 -13.074 -10.158 3.145 505 HG21 VAL 63 HG21 VAL 63 -9.698 -8.607 2.652 506 HG22 VAL 63 HG22 VAL 63 -9.905 -8.760 4.397 507 HG23 VAL 63 HG23 VAL 63 -10.075 -7.184 3.624 508 H GLY 64 HN GLY 64 -10.369 -6.527 0.918 509 HA2 GLY 64 HA2 GLY 64 -9.562 -8.653 -0.868 510 HA3 GLY 64 HA1 GLY 64 -10.373 -7.307 -1.659 511 H GLN 65 HN GLN 65 -7.820 -7.873 -2.368 512 HA GLN 65 HA GLN 65 -6.147 -5.964 -0.914 513 HB2 GLN 65 HB2 GLN 65 -5.503 -8.038 -3.009 514 HB3 GLN 65 HB1 GLN 65 -4.324 -6.885 -2.390 515 HG2 GLN 65 HG2 GLN 65 -4.804 -7.795 -0.098 516 HG3 GLN 65 HG1 GLN 65 -5.735 -9.067 -0.886 517 HE21 GLN 65 HE21 GLN 65 -3.345 -9.273 0.734 518 HE22 GLN 65 HE22 GLN 65 -2.137 -10.026 -0.244 519 H VAL 66 HN VAL 66 -5.277 -4.197 -1.870 520 HA VAL 66 HA VAL 66 -6.379 -3.456 -4.494 521 HB VAL 66 HB VAL 66 -6.434 -1.925 -1.889 522 HG11 VAL 66 HG11 VAL 66 -5.726 -0.383 -3.671 523 HG12 VAL 66 HG12 VAL 66 -7.327 -0.014 -3.017 524 HG13 VAL 66 HG13 VAL 66 -7.176 -0.817 -4.588 525 HG21 VAL 66 HG21 VAL 66 -8.600 -2.726 -3.820 526 HG22 VAL 66 HG22 VAL 66 -8.832 -1.826 -2.321 527 HG23 VAL 66 HG23 VAL 66 -8.251 -3.490 -2.268 528 H ARG 67 HN ARG 67 -4.731 -3.056 -5.830 529 HA ARG 67 HA ARG 67 -2.171 -2.197 -4.675 530 HB2 ARG 67 HB2 ARG 67 -2.139 -4.382 -5.883 531 HB3 ARG 67 HB1 ARG 67 -2.672 -3.548 -7.340 532 HG2 ARG 67 HG2 ARG 67 -0.645 -2.324 -7.491 533 HG3 ARG 67 HG1 ARG 67 -0.135 -2.847 -5.887 534 HD2 ARG 67 HD2 ARG 67 1.105 -4.132 -7.428 535 HD3 ARG 67 HD1 ARG 67 -0.138 -5.200 -6.786 536 HE ARG 67 HE ARG 67 -1.343 -4.424 -8.983 537 HH11 ARG 67 HH11 ARG 67 2.031 -5.211 -8.536 538 HH12 ARG 67 HH12 ARG 67 2.259 -5.779 -10.161 539 HH21 ARG 67 HH21 ARG 67 -1.048 -5.182 -11.141 540 HH22 ARG 67 HH22 ARG 67 0.509 -5.762 -11.629 541 H PHE 68 HN PHE 68 -1.330 -0.290 -5.247 542 HA PHE 68 HA PHE 68 -2.401 1.140 -7.525 543 HB2 PHE 68 HB2 PHE 68 -2.725 3.159 -5.869 544 HB3 PHE 68 HB1 PHE 68 -4.010 1.992 -6.137 545 HD1 PHE 68 HD1 PHE 68 -0.970 2.025 -3.940 546 HD2 PHE 68 HD2 PHE 68 -5.198 1.657 -4.246 547 HE1 PHE 68 HE1 PHE 68 -1.113 1.608 -1.518 548 HE2 PHE 68 HE2 PHE 68 -5.344 1.241 -1.832 549 HZ PHE 68 HZ PHE 68 -3.306 1.215 -0.466 550 H THR 69 HN THR 69 -1.201 2.836 -8.221 551 HA THR 69 HA THR 69 1.436 3.253 -6.977 552 HB THR 69 HB THR 69 0.467 4.393 -9.605 553 HG1 THR 69 HG1 THR 69 0.995 1.810 -9.007 554 HG21 THR 69 HG21 THR 69 2.445 5.434 -8.660 555 HG22 THR 69 HG22 THR 69 2.894 4.472 -10.070 556 HG23 THR 69 HG23 THR 69 3.202 3.855 -8.446 557 H LEU 70 HN LEU 70 1.790 5.061 -5.856 558 HA LEU 70 HA LEU 70 -0.450 6.967 -5.751 559 HB2 LEU 70 HB2 LEU 70 1.390 6.127 -3.517 560 HB3 LEU 70 HB1 LEU 70 0.002 7.194 -3.381 561 HG LEU 70 HG LEU 70 -0.182 4.310 -4.235 562 HD11 LEU 70 HD11 LEU 70 -0.704 5.519 -1.524 563 HD12 LEU 70 HD12 LEU 70 0.657 4.476 -1.948 564 HD13 LEU 70 HD13 LEU 70 -0.989 3.840 -1.995 565 HD21 LEU 70 HD21 LEU 70 -2.297 6.273 -3.352 566 HD22 LEU 70 HD22 LEU 70 -2.561 4.590 -3.816 567 HD23 LEU 70 HD23 LEU 70 -2.003 5.761 -5.015 568 H ASP 71 HN ASP 71 -0.065 9.042 -5.923 569 HA ASP 71 HA ASP 71 2.529 10.005 -6.624 570 HB2 ASP 71 HB2 ASP 71 0.450 10.948 -7.576 571 HB3 ASP 71 HB1 ASP 71 -0.004 11.530 -5.973 572 H ARG 72 HN ARG 72 3.714 11.644 -5.490 573 HA ARG 72 HA ARG 72 4.318 11.101 -2.868 574 HB2 ARG 72 HB2 ARG 72 5.803 12.388 -4.248 575 HB3 ARG 72 HB1 ARG 72 4.620 13.676 -4.412 576 HG2 ARG 72 HG2 ARG 72 4.823 13.992 -1.909 577 HG3 ARG 72 HG1 ARG 72 6.235 12.932 -1.997 578 HD2 ARG 72 HD2 ARG 72 6.867 15.298 -2.113 579 HD3 ARG 72 HD1 ARG 72 7.285 14.434 -3.591 580 HE ARG 72 HE ARG 72 4.842 15.463 -4.157 581 HH11 ARG 72 HH11 ARG 72 7.816 16.872 -2.962 582 HH12 ARG 72 HH12 ARG 72 7.519 18.424 -3.686 583 HH21 ARG 72 HH21 ARG 72 4.430 17.509 -5.080 584 HH22 ARG 72 HH22 ARG 72 5.582 18.793 -4.871 585 H GLN 73 HN GLN 73 1.967 13.453 -4.093 586 HA GLN 73 HA GLN 73 1.404 14.404 -1.395 587 HB2 GLN 73 HB2 GLN 73 0.337 15.212 -4.099 588 HB3 GLN 73 HB1 GLN 73 -0.176 15.943 -2.583 589 HG2 GLN 73 HG2 GLN 73 2.034 16.763 -2.163 590 HG3 GLN 73 HG1 GLN 73 2.666 15.893 -3.557 591 HE21 GLN 73 HE21 GLN 73 -0.411 17.544 -3.613 592 HE22 GLN 73 HE22 GLN 73 0.084 18.803 -4.695 593 H GLY 74 HN GLY 74 0.661 11.682 -2.690 594 HA2 GLY 74 HA2 GLY 74 -0.942 10.143 -2.084 595 HA3 GLY 74 HA1 GLY 74 -1.773 11.412 -1.210 596 H HIS 75 HN HIS 75 -0.936 11.138 -4.632 597 HA HIS 75 HA HIS 75 -3.801 11.399 -5.230 598 HB2 HIS 75 HB2 HIS 75 -2.565 13.262 -6.126 599 HB3 HIS 75 HB1 HIS 75 -1.364 12.190 -6.833 600 HD1 HIS 75 HD1 HIS 75 -4.913 13.379 -7.337 601 HD2 HIS 75 HD2 HIS 75 -1.984 11.184 -9.315 602 HE1 HIS 75 HE1 HIS 75 -5.777 13.036 -9.677 603 HE2 HIS 75 HE2 HIS 75 -4.087 11.516 -10.778 604 H VAL 76 HN VAL 76 -4.697 9.513 -5.694 605 HA VAL 76 HA VAL 76 -3.591 7.157 -6.486 606 HB VAL 76 HB VAL 76 -5.912 7.266 -5.904 607 HG11 VAL 76 HG11 VAL 76 -6.456 9.482 -6.719 608 HG12 VAL 76 HG12 VAL 76 -7.603 8.304 -7.358 609 HG13 VAL 76 HG13 VAL 76 -6.314 8.929 -8.388 610 HG21 VAL 76 HG21 VAL 76 -5.316 5.444 -7.383 611 HG22 VAL 76 HG22 VAL 76 -5.615 6.460 -8.794 612 HG23 VAL 76 HG23 VAL 76 -6.951 6.002 -7.737 613 H LEU 77 HN LEU 77 -2.265 6.695 -8.097 614 HA LEU 77 HA LEU 77 -2.534 8.125 -10.644 615 HB2 LEU 77 HB2 LEU 77 -0.271 6.425 -9.592 616 HB3 LEU 77 HB1 LEU 77 -0.270 7.274 -11.127 617 HG LEU 77 HG LEU 77 -0.576 8.727 -8.513 618 HD11 LEU 77 HD11 LEU 77 1.988 8.135 -9.981 619 HD12 LEU 77 HD12 LEU 77 1.488 7.409 -8.452 620 HD13 LEU 77 HD13 LEU 77 1.807 9.143 -8.541 621 HD21 LEU 77 HD21 LEU 77 0.208 10.629 -9.806 622 HD22 LEU 77 HD22 LEU 77 -1.216 9.917 -10.566 623 HD23 LEU 77 HD23 LEU 77 0.389 9.609 -11.233 624 H ALA 78 HN ALA 78 -2.289 4.929 -9.216 625 HA ALA 78 HA ALA 78 -3.628 3.795 -11.564 626 HB1 ALA 78 HB1 ALA 78 -1.182 3.389 -11.794 627 HB2 ALA 78 HB2 ALA 78 -2.128 1.907 -11.650 628 HB3 ALA 78 HB3 ALA 78 -1.223 2.516 -10.261 629 H VAL 79 HN VAL 79 -4.983 2.043 -11.069 630 HA VAL 79 HA VAL 79 -4.971 1.032 -8.340 631 HB VAL 79 HB VAL 79 -7.561 1.194 -8.381 632 HG11 VAL 79 HG11 VAL 79 -6.131 2.303 -6.745 633 HG12 VAL 79 HG12 VAL 79 -7.487 3.331 -7.211 634 HG13 VAL 79 HG13 VAL 79 -5.880 3.642 -7.865 635 HG21 VAL 79 HG21 VAL 79 -6.855 3.495 -10.201 636 HG22 VAL 79 HG22 VAL 79 -8.437 3.189 -9.483 637 HG23 VAL 79 HG23 VAL 79 -7.769 2.057 -10.658 638 H THR 80 HN THR 80 -4.905 -1.052 -8.480 639 HA THR 80 HA THR 80 -6.504 -2.416 -10.545 640 HB THR 80 HB THR 80 -3.783 -3.344 -9.614 641 HG1 THR 80 HG1 THR 80 -4.456 -1.899 -11.997 642 HG21 THR 80 HG21 THR 80 -5.503 -4.113 -11.978 643 HG22 THR 80 HG22 THR 80 -5.230 -5.087 -10.534 644 HG23 THR 80 HG23 THR 80 -3.892 -4.749 -11.635 645 H LEU 81 HN LEU 81 -7.893 -3.850 -9.660 646 HA LEU 81 HA LEU 81 -7.796 -4.432 -6.871 647 HB2 LEU 81 HB2 LEU 81 -9.916 -4.349 -8.158 648 HB3 LEU 81 HB1 LEU 81 -9.432 -5.813 -8.996 649 HG LEU 81 HG LEU 81 -9.343 -6.970 -6.766 650 HD11 LEU 81 HD11 LEU 81 -9.102 -5.015 -5.353 651 HD12 LEU 81 HD12 LEU 81 -10.537 -5.935 -4.899 652 HD13 LEU 81 HD13 LEU 81 -10.702 -4.448 -5.832 653 HD21 LEU 81 HD21 LEU 81 -11.992 -5.806 -7.621 654 HD22 LEU 81 HD22 LEU 81 -11.783 -7.216 -6.584 655 HD23 LEU 81 HD23 LEU 81 -11.236 -7.264 -8.260 656 H VAL 82 HN VAL 82 -6.552 -5.829 -5.925 657 HA VAL 82 HA VAL 82 -5.297 -7.981 -7.466 658 HB VAL 82 HB VAL 82 -4.527 -7.747 -4.655 659 HG11 VAL 82 HG11 VAL 82 -3.034 -7.609 -7.266 660 HG12 VAL 82 HG12 VAL 82 -3.183 -9.003 -6.193 661 HG13 VAL 82 HG13 VAL 82 -2.263 -7.583 -5.682 662 HG21 VAL 82 HG21 VAL 82 -5.106 -5.412 -5.026 663 HG22 VAL 82 HG22 VAL 82 -4.075 -5.374 -6.456 664 HG23 VAL 82 HG23 VAL 82 -3.361 -5.613 -4.860 665 H SER 83 HN SER 83 -7.203 -7.341 -4.590 666 HA SER 83 HA SER 83 -8.894 -8.474 -3.621 667 HB2 SER 83 HB2 SER 83 -9.520 -8.851 -5.995 668 HB3 SER 83 HB1 SER 83 -8.676 -10.396 -5.938 669 HG SER 83 HG SER 83 -10.840 -10.771 -5.510 670 H SER 84 HN SER 84 -9.541 -10.936 -3.072 671 HA SER 84 HA SER 84 -7.256 -12.531 -2.316 672 HB2 SER 84 HB2 SER 84 -8.956 -11.216 -0.178 673 HB3 SER 84 HB1 SER 84 -7.669 -12.391 0.104 674 HG SER 84 HG SER 84 -6.560 -10.548 -1.335 675 H ALA 85 HN ALA 85 -10.648 -11.933 -1.404 676 HA ALA 85 HA ALA 85 -11.129 -14.819 -1.502 677 HB1 ALA 85 HB1 ALA 85 -13.153 -14.363 -0.231 678 HB2 ALA 85 HB2 ALA 85 -12.849 -12.630 -0.344 679 HB3 ALA 85 HB3 ALA 85 -11.745 -13.660 0.568 680 H GLY 86 HN GLY 86 -13.042 -11.903 -2.299 681 HA2 GLY 86 HA2 GLY 86 -13.501 -12.251 -4.949 682 HA3 GLY 86 HA1 GLY 86 -14.606 -13.393 -4.194 683 H LEU 87 HN LEU 87 -14.099 -10.167 -5.090 684 HA LEU 87 HA LEU 87 -16.483 -9.355 -3.555 685 HB2 LEU 87 HB2 LEU 87 -14.408 -7.448 -4.597 686 HB3 LEU 87 HB1 LEU 87 -15.691 -7.105 -3.474 687 HG LEU 87 HG LEU 87 -13.795 -7.061 -2.154 688 HD11 LEU 87 HD11 LEU 87 -14.799 -9.882 -1.916 689 HD12 LEU 87 HD12 LEU 87 -15.497 -8.452 -1.152 690 HD13 LEU 87 HD13 LEU 87 -13.883 -8.999 -0.693 691 HD21 LEU 87 HD21 LEU 87 -11.954 -8.616 -2.238 692 HD22 LEU 87 HD22 LEU 87 -12.246 -7.948 -3.844 693 HD23 LEU 87 HD23 LEU 87 -12.783 -9.583 -3.455 694 HA PRO 88 HA PRO 88 -17.483 -9.061 -8.080 695 HB2 PRO 88 HB2 PRO 88 -20.068 -10.203 -7.381 696 HB3 PRO 88 HB1 PRO 88 -18.843 -10.829 -8.485 697 HG2 PRO 88 HG2 PRO 88 -19.436 -12.009 -6.110 698 HG3 PRO 88 HG1 PRO 88 -17.832 -12.087 -6.861 699 HD2 PRO 88 HD2 PRO 88 -18.795 -10.338 -4.626 700 HD3 PRO 88 HD1 PRO 88 -17.242 -11.184 -4.809 701 H SER 89 HN SER 89 -20.487 -9.011 -6.235 702 HA SER 89 HA SER 89 -21.270 -6.483 -7.235 703 HB2 SER 89 HB2 SER 89 -22.349 -7.885 -4.781 704 HB3 SER 89 HB1 SER 89 -23.186 -6.706 -5.791 705 HG SER 89 HG SER 89 -22.953 -9.383 -6.111 706 H LEU 90 HN LEU 90 -19.193 -7.410 -4.753 707 HA LEU 90 HA LEU 90 -19.643 -5.235 -2.945 708 HB2 LEU 90 HB2 LEU 90 -17.198 -7.007 -3.111 709 HB3 LEU 90 HB1 LEU 90 -17.775 -6.099 -1.727 710 HG LEU 90 HG LEU 90 -19.340 -8.364 -2.946 711 HD11 LEU 90 HD11 LEU 90 -18.427 -9.806 -1.272 712 HD12 LEU 90 HD12 LEU 90 -17.503 -8.478 -0.570 713 HD13 LEU 90 HD13 LEU 90 -17.090 -9.083 -2.177 714 HD21 LEU 90 HD21 LEU 90 -19.467 -7.008 -0.257 715 HD22 LEU 90 HD22 LEU 90 -20.484 -8.345 -0.795 716 HD23 LEU 90 HD23 LEU 90 -20.604 -6.771 -1.583 717 H ASP 91 HN ASP 91 -17.570 -5.848 -5.688 718 HA ASP 91 HA ASP 91 -15.454 -4.129 -5.198 719 HB2 ASP 91 HB2 ASP 91 -15.313 -5.700 -6.996 720 HB3 ASP 91 HB1 ASP 91 -16.720 -5.011 -7.794 721 H ARG 92 HN ARG 92 -18.470 -3.410 -6.950 722 HA ARG 92 HA ARG 92 -17.780 -0.870 -7.794 723 HB2 ARG 92 HB2 ARG 92 -20.189 -0.422 -8.011 724 HB3 ARG 92 HB1 ARG 92 -19.724 -1.982 -8.672 725 HG2 ARG 92 HG2 ARG 92 -20.445 -2.506 -6.032 726 HG3 ARG 92 HG1 ARG 92 -21.643 -1.351 -6.622 727 HD2 ARG 92 HD2 ARG 92 -20.861 -3.926 -7.977 728 HD3 ARG 92 HD1 ARG 92 -22.323 -3.674 -7.024 729 HE ARG 92 HE ARG 92 -22.735 -1.830 -8.810 730 HH11 ARG 92 HH11 ARG 92 -21.175 -4.912 -9.380 731 HH12 ARG 92 HH12 ARG 92 -21.824 -5.098 -10.980 732 HH21 ARG 92 HH21 ARG 92 -23.579 -2.056 -10.942 733 HH22 ARG 92 HH22 ARG 92 -23.173 -3.472 -11.872 734 H GLU 93 HN GLU 93 -19.388 -1.725 -4.713 735 HA GLU 93 HA GLU 93 -19.680 1.043 -3.992 736 HB2 GLU 93 HB2 GLU 93 -21.272 -0.747 -3.309 737 HB3 GLU 93 HB1 GLU 93 -20.030 -1.395 -2.250 738 HG2 GLU 93 HG2 GLU 93 -21.464 -0.117 -0.896 739 HG3 GLU 93 HG1 GLU 93 -19.993 0.834 -1.099 740 H ILE 94 HN ILE 94 -17.714 -1.648 -2.696 741 HA ILE 94 HA ILE 94 -16.594 -0.029 -0.641 742 HB ILE 94 HB ILE 94 -15.120 -1.885 -0.133 743 HG12 ILE 94 HG12 ILE 94 -16.169 -3.196 -2.653 744 HG13 ILE 94 HG11 ILE 94 -14.555 -2.522 -2.460 745 HG21 ILE 94 HG21 ILE 94 -16.819 -3.649 0.226 746 HG22 ILE 94 HG22 ILE 94 -17.922 -2.756 -0.823 747 HG23 ILE 94 HG23 ILE 94 -17.375 -2.042 0.695 748 HD11 ILE 94 HD11 ILE 94 -14.565 -4.945 -2.237 749 HD12 ILE 94 HD12 ILE 94 -15.690 -4.818 -0.885 750 HD13 ILE 94 HD13 ILE 94 -14.059 -4.161 -0.741 751 H GLN 95 HN GLN 95 -15.565 -0.929 -3.862 752 HA GLN 95 HA GLN 95 -13.005 0.319 -3.513 753 HB2 GLN 95 HB2 GLN 95 -14.341 -0.687 -6.005 754 HB3 GLN 95 HB1 GLN 95 -12.687 -0.223 -5.835 755 HG2 GLN 95 HG2 GLN 95 -13.925 -2.477 -4.296 756 HG3 GLN 95 HG1 GLN 95 -13.084 -2.686 -5.832 757 HE21 GLN 95 HE21 GLN 95 -12.475 -3.797 -3.241 758 HE22 GLN 95 HE22 GLN 95 -10.879 -3.269 -2.843 759 H ALA 96 HN ALA 96 -16.163 1.275 -4.473 760 HA ALA 96 HA ALA 96 -15.605 3.415 -6.148 761 HB1 ALA 96 HB1 ALA 96 -17.664 4.455 -5.379 762 HB2 ALA 96 HB2 ALA 96 -17.694 3.397 -3.968 763 HB3 ALA 96 HB3 ALA 96 -17.901 2.718 -5.582 764 H LEU 97 HN LEU 97 -15.900 3.510 -2.578 765 HA LEU 97 HA LEU 97 -14.732 6.125 -2.599 766 HB2 LEU 97 HB2 LEU 97 -14.956 6.226 -0.243 767 HB3 LEU 97 HB1 LEU 97 -16.420 5.598 -0.942 768 HG LEU 97 HG LEU 97 -16.113 4.484 1.060 769 HD11 LEU 97 HD11 LEU 97 -16.824 2.973 -0.637 770 HD12 LEU 97 HD12 LEU 97 -15.855 2.159 0.584 771 HD13 LEU 97 HD13 LEU 97 -15.151 2.545 -0.977 772 HD21 LEU 97 HD21 LEU 97 -13.882 5.066 1.592 773 HD22 LEU 97 HD22 LEU 97 -13.261 3.984 0.348 774 HD23 LEU 97 HD23 LEU 97 -14.082 3.322 1.761 775 H VAL 98 HN VAL 98 -13.487 2.966 -1.535 776 HA VAL 98 HA VAL 98 -10.939 3.997 -0.829 777 HB VAL 98 HB VAL 98 -11.822 1.177 -1.421 778 HG11 VAL 98 HG11 VAL 98 -9.670 0.445 -0.478 779 HG12 VAL 98 HG12 VAL 98 -9.132 2.125 -0.426 780 HG13 VAL 98 HG13 VAL 98 -9.454 1.349 -1.978 781 HG21 VAL 98 HG21 VAL 98 -11.774 0.877 0.937 782 HG22 VAL 98 HG22 VAL 98 -12.632 2.394 0.647 783 HG23 VAL 98 HG23 VAL 98 -10.953 2.414 1.185 784 H LYS 99 HN LYS 99 -11.986 2.321 -3.826 785 HA LYS 99 HA LYS 99 -9.316 2.289 -4.864 786 HB2 LYS 99 HB2 LYS 99 -11.132 0.582 -5.427 787 HB3 LYS 99 HB1 LYS 99 -11.846 1.809 -6.459 788 HG2 LYS 99 HG2 LYS 99 -9.618 1.912 -7.664 789 HG3 LYS 99 HG1 LYS 99 -9.173 0.463 -6.761 790 HD2 LYS 99 HD2 LYS 99 -11.595 0.688 -8.545 791 HD3 LYS 99 HD1 LYS 99 -10.050 -0.003 -9.040 792 HE2 LYS 99 HE2 LYS 99 -10.252 -1.711 -7.311 793 HE3 LYS 99 HE1 LYS 99 -11.777 -1.007 -6.778 794 HZ1 LYS 99 HZ1 LYS 99 -12.374 -2.793 -8.148 795 HZ2 LYS 99 HZ2 LYS 99 -11.195 -2.422 -9.312 796 HZ3 LYS 99 HZ3 LYS 99 -12.560 -1.434 -9.149 797 H ARG 100 HN ARG 100 -11.898 4.619 -4.899 798 HA ARG 100 HA ARG 100 -10.617 6.099 -7.050 799 HB2 ARG 100 HB2 ARG 100 -13.031 6.258 -6.862 800 HB3 ARG 100 HB1 ARG 100 -12.892 6.871 -5.219 801 HG2 ARG 100 HG2 ARG 100 -13.371 8.624 -6.901 802 HG3 ARG 100 HG1 ARG 100 -11.880 8.906 -6.000 803 HD2 ARG 100 HD2 ARG 100 -11.594 9.370 -8.391 804 HD3 ARG 100 HD1 ARG 100 -10.573 8.034 -7.860 805 HE ARG 100 HE ARG 100 -12.733 6.739 -8.769 806 HH11 ARG 100 HH11 ARG 100 -10.800 9.295 -10.194 807 HH12 ARG 100 HH12 ARG 100 -11.117 8.789 -11.826 808 HH21 ARG 100 HH21 ARG 100 -13.113 6.060 -10.893 809 HH22 ARG 100 HH22 ARG 100 -12.459 6.965 -12.224 810 H ALA 101 HN ALA 101 -11.036 6.421 -3.535 811 HA ALA 101 HA ALA 101 -9.175 8.661 -3.545 812 HB1 ALA 101 HB1 ALA 101 -9.778 9.002 -1.242 813 HB2 ALA 101 HB2 ALA 101 -10.663 7.473 -1.213 814 HB3 ALA 101 HB3 ALA 101 -11.243 8.811 -2.206 815 H SER 102 HN SER 102 -7.562 6.966 -4.341 816 HA SER 102 HA SER 102 -6.359 5.512 -2.122 817 HB2 SER 102 HB2 SER 102 -5.520 5.560 -5.027 818 HB3 SER 102 HB1 SER 102 -4.951 4.443 -3.786 819 HG SER 102 HG SER 102 -7.596 4.332 -3.793 820 HA PRO 103 HA PRO 103 -3.675 9.108 -1.915 821 HB2 PRO 103 HB2 PRO 103 -3.899 9.450 0.721 822 HB3 PRO 103 HB1 PRO 103 -5.239 9.822 -0.369 823 HG2 PRO 103 HG2 PRO 103 -4.954 7.610 1.552 824 HG3 PRO 103 HG1 PRO 103 -6.421 8.283 0.823 825 HD2 PRO 103 HD2 PRO 103 -4.880 5.947 0.014 826 HD3 PRO 103 HD1 PRO 103 -6.463 6.500 -0.578 827 H LEU 104 HN LEU 104 -1.816 9.664 -0.416 828 HA LEU 104 HA LEU 104 -0.313 7.355 0.561 829 HB2 LEU 104 HB2 LEU 104 0.315 7.673 -1.809 830 HB3 LEU 104 HB1 LEU 104 0.730 9.340 -1.471 831 HG LEU 104 HG LEU 104 2.521 8.508 0.075 832 HD11 LEU 104 HD11 LEU 104 3.261 6.146 -0.304 833 HD12 LEU 104 HD12 LEU 104 1.717 5.856 -1.110 834 HD13 LEU 104 HD13 LEU 104 1.750 6.307 0.595 835 HD21 LEU 104 HD21 LEU 104 2.662 7.639 -2.809 836 HD22 LEU 104 HD22 LEU 104 4.044 7.880 -1.739 837 HD23 LEU 104 HD23 LEU 104 3.024 9.248 -2.185 838 HA PRO 105 HA PRO 105 -0.220 10.986 3.434 839 HB2 PRO 105 HB2 PRO 105 0.338 9.306 5.593 840 HB3 PRO 105 HB1 PRO 105 -1.242 9.956 5.158 841 HG2 PRO 105 HG2 PRO 105 -0.127 7.260 4.723 842 HG3 PRO 105 HG1 PRO 105 -1.805 7.777 4.887 843 HD2 PRO 105 HD2 PRO 105 -0.665 7.054 2.508 844 HD3 PRO 105 HD1 PRO 105 -2.058 8.148 2.662 845 H THR 106 HN THR 106 1.900 8.137 3.872 846 HA THR 106 HA THR 106 4.133 9.825 4.568 847 HB THR 106 HB THR 106 4.157 6.861 3.949 848 HG1 THR 106 HG1 THR 106 4.079 6.692 6.311 849 HG21 THR 106 HG21 THR 106 6.365 7.889 3.931 850 HG22 THR 106 HG22 THR 106 6.184 6.861 5.353 851 HG23 THR 106 HG23 THR 106 6.062 8.613 5.510 852 HA PRO 107 HA PRO 107 5.287 10.153 0.203 853 HB2 PRO 107 HB2 PRO 107 7.333 12.010 1.078 854 HB3 PRO 107 HB1 PRO 107 5.877 12.344 0.140 855 HG2 PRO 107 HG2 PRO 107 6.261 13.212 2.704 856 HG3 PRO 107 HG1 PRO 107 4.666 12.921 1.989 857 HD2 PRO 107 HD2 PRO 107 6.262 11.188 3.837 858 HD3 PRO 107 HD1 PRO 107 4.514 11.505 3.816 859 HA PRO 108 HA PRO 108 8.712 7.369 1.289 860 HB2 PRO 108 HB2 PRO 108 8.050 5.357 -0.284 861 HB3 PRO 108 HB1 PRO 108 7.005 5.776 1.078 862 HG2 PRO 108 HG2 PRO 108 6.664 6.392 -1.829 863 HG3 PRO 108 HG1 PRO 108 5.442 5.893 -0.646 864 HD2 PRO 108 HD2 PRO 108 5.989 8.522 -1.444 865 HD3 PRO 108 HD1 PRO 108 5.067 8.043 -0.006 866 H ALA 109 HN ALA 109 9.769 9.352 0.013 867 HA ALA 109 HA ALA 109 10.452 9.079 -2.682 868 HB1 ALA 109 HB1 ALA 109 12.078 10.290 -0.447 869 HB2 ALA 109 HB2 ALA 109 10.877 11.124 -1.435 870 HB3 ALA 109 HB3 ALA 109 12.364 10.527 -2.171 871 H ASP 110 HN ASP 110 12.019 7.874 0.227 872 HA ASP 110 HA ASP 110 14.214 6.636 -1.049 873 HB2 ASP 110 HB2 ASP 110 14.575 5.527 1.109 874 HB3 ASP 110 HB1 ASP 110 14.226 7.240 1.329 875 H ALA 111 HN ALA 111 11.002 5.842 -1.173 876 HA ALA 111 HA ALA 111 11.460 2.950 -1.304 877 HB1 ALA 111 HB1 ALA 111 9.055 2.719 -1.182 878 HB2 ALA 111 HB2 ALA 111 8.855 4.470 -1.301 879 HB3 ALA 111 HB3 ALA 111 9.625 3.762 0.123 880 H TYR 112 HN TYR 112 10.483 5.714 -3.256 881 HA TYR 112 HA TYR 112 10.017 3.848 -5.466 882 HB2 TYR 112 HB2 TYR 112 8.546 5.547 -6.491 883 HB3 TYR 112 HB1 TYR 112 7.967 4.826 -5.009 884 HD1 TYR 112 HD2 TYR 112 10.342 7.697 -5.334 885 HD2 TYR 112 HD1 TYR 112 6.449 6.362 -4.282 886 HE1 TYR 112 HE2 TYR 112 9.823 9.923 -4.430 887 HE2 TYR 112 HE1 TYR 112 5.910 8.563 -3.393 888 HH TYR 112 HH TYR 112 7.845 11.302 -3.974 889 H VAL 113 HN VAL 113 12.451 5.373 -4.580 890 HA VAL 113 HA VAL 113 13.097 7.072 -6.775 891 HB VAL 113 HB VAL 113 15.537 6.519 -6.097 892 HG11 VAL 113 HG11 VAL 113 15.425 8.034 -4.193 893 HG12 VAL 113 HG12 VAL 113 13.682 7.786 -4.086 894 HG13 VAL 113 HG13 VAL 113 14.374 8.584 -5.498 895 HG21 VAL 113 HG21 VAL 113 14.955 4.421 -4.888 896 HG22 VAL 113 HG22 VAL 113 14.143 5.400 -3.665 897 HG23 VAL 113 HG23 VAL 113 15.880 5.565 -3.917 898 H ASN 114 HN ASN 114 12.544 6.118 -8.588 899 HA ASN 114 HA ASN 114 13.987 4.476 -10.176 900 HB2 ASN 114 HB2 ASN 114 13.368 2.242 -9.884 901 HB3 ASN 114 HB1 ASN 114 13.494 2.778 -8.217 902 HD21 ASN 114 HD21 ASN 114 11.569 3.071 -7.003 903 HD22 ASN 114 HD22 ASN 114 10.079 2.359 -7.505 904 H GLY 115 HN GLY 115 10.944 5.477 -8.910 905 HA2 GLY 115 HA2 GLY 115 9.902 6.464 -11.276 906 HA3 GLY 115 HA1 GLY 115 9.298 4.821 -11.123 907 H THR 116 HN THR 116 8.085 4.282 -9.183 908 HA THR 116 HA THR 116 7.051 6.351 -7.502 909 HB THR 116 HB THR 116 4.795 5.102 -8.920 910 HG1 THR 116 HG1 THR 116 6.587 6.858 -10.266 911 HG21 THR 116 HG21 THR 116 4.473 6.828 -7.257 912 HG22 THR 116 HG22 THR 116 3.959 7.434 -8.831 913 HG23 THR 116 HG23 THR 116 5.511 7.930 -8.154 914 H VAL 117 HN VAL 117 5.062 5.263 -6.201 915 HA VAL 117 HA VAL 117 6.031 2.579 -5.535 916 HB VAL 117 HB VAL 117 4.694 2.850 -3.410 917 HG11 VAL 117 HG11 VAL 117 6.946 4.766 -3.944 918 HG12 VAL 117 HG12 VAL 117 7.051 3.126 -3.297 919 HG13 VAL 117 HG13 VAL 117 6.305 4.411 -2.340 920 HG21 VAL 117 HG21 VAL 117 3.142 4.573 -4.040 921 HG22 VAL 117 HG22 VAL 117 4.462 5.704 -4.356 922 HG23 VAL 117 HG23 VAL 117 4.139 5.160 -2.709 923 H GLU 118 HN GLU 118 4.967 1.104 -6.651 924 HA GLU 118 HA GLU 118 2.032 1.164 -6.511 925 HB2 GLU 118 HB2 GLU 118 3.013 0.899 -8.798 926 HB3 GLU 118 HB1 GLU 118 3.791 -0.583 -8.256 927 HG2 GLU 118 HG2 GLU 118 1.536 -1.494 -7.735 928 HG3 GLU 118 HG1 GLU 118 0.843 -0.049 -8.470 929 H LEU 119 HN LEU 119 1.281 0.045 -4.848 930 HA LEU 119 HA LEU 119 2.706 -2.384 -4.030 931 HB2 LEU 119 HB2 LEU 119 2.450 -1.708 -1.653 932 HB3 LEU 119 HB1 LEU 119 3.571 -0.712 -2.561 933 HG LEU 119 HG LEU 119 0.841 0.360 -2.518 934 HD11 LEU 119 HD11 LEU 119 0.817 -0.631 -0.322 935 HD12 LEU 119 HD12 LEU 119 0.995 1.119 -0.188 936 HD13 LEU 119 HD13 LEU 119 2.396 0.073 0.042 937 HD21 LEU 119 HD21 LEU 119 2.052 2.409 -1.964 938 HD22 LEU 119 HD22 LEU 119 2.766 1.599 -3.359 939 HD23 LEU 119 HD23 LEU 119 3.541 1.484 -1.778 940 H THR 120 HN THR 120 1.471 -3.844 -2.804 941 HA THR 120 HA THR 120 -1.392 -3.655 -3.343 942 HB THR 120 HB THR 120 0.325 -6.012 -2.536 943 HG1 THR 120 HG1 THR 120 -0.238 -6.671 -4.722 944 HG21 THR 120 HG21 THR 120 -1.940 -6.240 -1.663 945 HG22 THR 120 HG22 THR 120 -1.662 -7.377 -2.984 946 HG23 THR 120 HG23 THR 120 -2.604 -5.912 -3.264 947 H LEU 121 HN LEU 121 -2.557 -2.813 -1.737 948 HA LEU 121 HA LEU 121 -1.920 -3.672 1.008 949 HB2 LEU 121 HB2 LEU 121 -3.160 -1.102 0.032 950 HB3 LEU 121 HB1 LEU 121 -3.148 -1.591 1.717 951 HG LEU 121 HG LEU 121 -0.764 -0.951 -0.006 952 HD11 LEU 121 HD11 LEU 121 -1.935 0.995 0.846 953 HD12 LEU 121 HD12 LEU 121 -0.385 0.802 1.657 954 HD13 LEU 121 HD13 LEU 121 -1.876 0.337 2.478 955 HD21 LEU 121 HD21 LEU 121 -0.814 -1.947 2.836 956 HD22 LEU 121 HD22 LEU 121 0.613 -1.451 1.924 957 HD23 LEU 121 HD23 LEU 121 -0.300 -2.881 1.432 958 HA PRO 122 HA PRO 122 -5.915 -5.598 0.659 959 HB2 PRO 122 HB2 PRO 122 -5.543 -6.371 3.445 960 HB3 PRO 122 HB1 PRO 122 -5.597 -7.395 2.009 961 HG2 PRO 122 HG2 PRO 122 -3.328 -6.991 3.447 962 HG3 PRO 122 HG1 PRO 122 -3.325 -7.315 1.704 963 HD2 PRO 122 HD2 PRO 122 -3.035 -4.706 3.148 964 HD3 PRO 122 HD1 PRO 122 -2.171 -5.306 1.714 965 H ILE 123 HN ILE 123 -7.629 -4.313 0.767 966 HA ILE 123 HA ILE 123 -8.021 -2.591 3.091 967 HB ILE 123 HB ILE 123 -9.800 -1.509 1.843 968 HG12 ILE 123 HG12 ILE 123 -9.299 -3.437 -0.419 969 HG13 ILE 123 HG11 ILE 123 -10.612 -3.641 0.738 970 HG21 ILE 123 HG21 ILE 123 -7.281 -1.975 0.257 971 HG22 ILE 123 HG22 ILE 123 -7.696 -0.594 1.274 972 HG23 ILE 123 HG23 ILE 123 -8.521 -0.836 -0.273 973 HD11 ILE 123 HD11 ILE 123 -11.407 -2.604 -1.304 974 HD12 ILE 123 HD12 ILE 123 -10.230 -1.304 -1.116 975 HD13 ILE 123 HD13 ILE 123 -11.537 -1.484 0.052 976 H ASP 124 HN ASP 124 -9.214 -3.357 4.766 977 HA ASP 124 HA ASP 124 -10.659 -5.843 4.236 978 HB2 ASP 124 HB2 ASP 124 -9.135 -6.327 5.883 979 HB3 ASP 124 HB1 ASP 124 -9.274 -4.745 6.640 980 H PHE 125 HN PHE 125 -12.694 -5.702 3.957 981 HA PHE 125 HA PHE 125 -14.293 -4.358 6.027 982 HB2 PHE 125 HB2 PHE 125 -15.125 -5.367 3.290 983 HB3 PHE 125 HB1 PHE 125 -16.214 -4.659 4.472 984 HD1 PHE 125 HD2 PHE 125 -13.048 -3.803 2.669 985 HD2 PHE 125 HD1 PHE 125 -16.794 -2.465 4.180 986 HE1 PHE 125 HE2 PHE 125 -12.649 -1.585 1.692 987 HE2 PHE 125 HE1 PHE 125 -16.401 -0.249 3.192 988 HZ PHE 125 HZ PHE 125 -14.325 0.193 1.951 989 H SER 126 HN SER 126 -15.324 -5.779 7.437 990 HA SER 126 HA SER 126 -14.523 -8.458 7.517 991 HB2 SER 126 HB2 SER 126 -17.019 -7.318 8.784 992 HB3 SER 126 HB1 SER 126 -16.090 -8.718 9.324 993 HG SER 126 HG SER 126 -14.286 -7.153 9.538 994 H LEU 127 HN LEU 127 -14.942 -9.776 5.867 995 HA LEU 127 HA LEU 127 -17.349 -9.684 4.336 996 HB2 LEU 127 HB2 LEU 127 -14.725 -10.729 4.049 997 HB3 LEU 127 HB1 LEU 127 -15.833 -12.074 3.869 998 HG LEU 127 HG LEU 127 -16.096 -9.522 2.284 999 HD11 LEU 127 HD11 LEU 127 -14.785 -12.101 1.440 1000 HD12 LEU 127 HD12 LEU 127 -13.935 -10.599 1.807 1001 HD13 LEU 127 HD13 LEU 127 -15.045 -10.671 0.435 1002 HD21 LEU 127 HD21 LEU 127 -18.110 -10.866 2.464 1003 HD22 LEU 127 HD22 LEU 127 -17.222 -12.283 1.902 1004 HD23 LEU 127 HD23 LEU 127 -17.458 -10.907 0.824 1005 H ARG 128 HN ARG 128 -18.614 -10.042 6.449 1006 HA ARG 128 HA ARG 128 -18.770 -12.786 7.345 1007 HB2 ARG 128 HB2 ARG 128 -20.640 -10.505 7.983 1008 HB3 ARG 128 HB1 ARG 128 -20.383 -11.971 8.906 1009 HG2 ARG 128 HG2 ARG 128 -18.236 -11.251 9.626 1010 HG3 ARG 128 HG1 ARG 128 -18.253 -9.897 8.493 1011 HD2 ARG 128 HD2 ARG 128 -20.213 -8.976 9.698 1012 HD3 ARG 128 HD1 ARG 128 -20.061 -10.276 10.876 1013 HE ARG 128 HE ARG 128 -17.611 -9.134 10.919 1014 HH11 ARG 128 HH11 ARG 128 -20.856 -7.846 11.211 1015 HH12 ARG 128 HH12 ARG 128 -20.381 -6.540 12.260 1016 HH21 ARG 128 HH21 ARG 128 -16.976 -7.447 12.299 1017 HH22 ARG 128 HH22 ARG 128 -18.166 -6.318 12.885 1018 H GLY 129 HN GLY 129 -20.941 -10.442 5.788 1019 HA2 GLY 129 HA2 GLY 129 -22.241 -12.666 4.358 1020 HA3 GLY 129 HA1 GLY 129 -23.225 -11.502 5.238 1021 H ALA 130 HN ALA 130 -21.912 -12.245 2.267 1022 HA ALA 130 HA ALA 130 -22.066 -9.438 1.380 1023 HB1 ALA 130 HB1 ALA 130 -20.155 -11.553 0.416 1024 HB2 ALA 130 HB2 ALA 130 -19.754 -10.186 1.455 1025 HB3 ALA 130 HB3 ALA 130 -20.276 -9.907 -0.207 1026 H GLY 131 HN GLY 131 -22.398 -9.225 -0.985 1027 HA2 GLY 131 HA2 GLY 131 -24.338 -11.200 -1.943 1028 HA3 GLY 131 HA1 GLY 131 -24.131 -9.566 -2.562 1029 H PHE 132 HN PHE 132 -22.597 -12.730 -2.377 1030 HA PHE 132 HA PHE 132 -21.174 -12.104 -4.868 1031 HB2 PHE 132 HB2 PHE 132 -19.439 -13.721 -4.167 1032 HB3 PHE 132 HB1 PHE 132 -19.574 -12.366 -3.058 1033 HD1 PHE 132 HD1 PHE 132 -20.783 -12.715 -0.870 1034 HD2 PHE 132 HD2 PHE 132 -19.688 -15.926 -3.437 1035 HE1 PHE 132 HE1 PHE 132 -20.995 -14.286 1.008 1036 HE2 PHE 132 HE2 PHE 132 -19.909 -17.502 -1.564 1037 HZ PHE 132 HZ PHE 132 -20.561 -16.684 0.662 Start of MODEL 12 1 H1 LYS 2 HT1 LYS 2 18.269 -13.483 14.897 2 H2 LYS 2 HT2 LYS 2 17.530 -14.999 14.746 3 H3 LYS 2 HT3 LYS 2 17.145 -13.995 16.059 4 HA LYS 2 HA LYS 2 16.592 -13.371 13.218 5 HB2 LYS 2 HB2 LYS 2 14.777 -14.354 15.426 6 HB3 LYS 2 HB1 LYS 2 14.194 -13.658 13.920 7 HG2 LYS 2 HG2 LYS 2 15.281 -15.455 12.669 8 HG3 LYS 2 HG1 LYS 2 15.866 -16.150 14.182 9 HD2 LYS 2 HD2 LYS 2 13.627 -16.574 14.926 10 HD3 LYS 2 HD1 LYS 2 12.954 -15.701 13.550 11 HE2 LYS 2 HE2 LYS 2 13.876 -17.381 12.032 12 HE3 LYS 2 HE1 LYS 2 14.567 -18.245 13.405 13 HZ1 LYS 2 HZ1 LYS 2 12.414 -18.759 14.213 14 HZ2 LYS 2 HZ2 LYS 2 12.411 -19.141 12.558 15 HZ3 LYS 2 HZ3 LYS 2 11.664 -17.720 13.105 16 H VAL 3 HN VAL 3 17.918 -11.439 14.275 17 HA VAL 3 HA VAL 3 16.269 -9.679 15.879 18 HB VAL 3 HB VAL 3 18.946 -9.157 14.562 19 HG11 VAL 3 HG11 VAL 3 17.711 -7.097 15.004 20 HG12 VAL 3 HG12 VAL 3 19.097 -7.246 16.083 21 HG13 VAL 3 HG13 VAL 3 17.474 -7.593 16.681 22 HG21 VAL 3 HG21 VAL 3 19.044 -10.940 16.242 23 HG22 VAL 3 HG22 VAL 3 18.293 -9.865 17.423 24 HG23 VAL 3 HG23 VAL 3 19.895 -9.494 16.783 25 H GLN 4 HN GLN 4 17.777 -9.511 12.660 26 HA GLN 4 HA GLN 4 17.303 -8.305 10.797 27 HB2 GLN 4 HB2 GLN 4 14.462 -8.798 11.705 28 HB3 GLN 4 HB1 GLN 4 14.939 -8.272 10.097 29 HG2 GLN 4 HG2 GLN 4 16.283 -10.382 9.912 30 HG3 GLN 4 HG1 GLN 4 15.524 -10.909 11.414 31 HE21 GLN 4 HE21 GLN 4 13.913 -9.004 8.971 32 HE22 GLN 4 HE22 GLN 4 12.795 -10.228 8.467 33 H GLU 5 HN GLU 5 18.257 -6.472 12.078 34 HA GLU 5 HA GLU 5 16.621 -4.156 11.687 35 HB2 GLU 5 HB2 GLU 5 15.789 -4.742 13.897 36 HB3 GLU 5 HB1 GLU 5 17.433 -4.865 14.514 37 HG2 GLU 5 HG2 GLU 5 17.764 -2.478 14.070 38 HG3 GLU 5 HG1 GLU 5 16.104 -2.364 13.497 39 H GLN 6 HN GLN 6 19.510 -5.342 13.386 40 HA GLN 6 HA GLN 6 21.637 -4.571 13.536 41 HB2 GLN 6 HB2 GLN 6 21.487 -4.669 11.025 42 HB3 GLN 6 HB1 GLN 6 21.043 -2.968 11.040 43 HG2 GLN 6 HG2 GLN 6 23.197 -2.497 12.201 44 HG3 GLN 6 HG1 GLN 6 23.637 -4.185 11.944 45 HE21 GLN 6 HE21 GLN 6 21.812 -2.252 9.662 46 HE22 GLN 6 HE22 GLN 6 23.045 -2.197 8.442 47 H SER 7 HN SER 7 21.027 -3.501 15.445 48 HA SER 7 HA SER 7 20.039 -0.818 15.448 49 HB2 SER 7 HB2 SER 7 21.407 -2.125 17.790 50 HB3 SER 7 HB1 SER 7 20.036 -1.014 17.784 51 HG SER 7 HG SER 7 18.760 -2.691 16.881 52 H VAL 8 HN VAL 8 23.148 -2.333 15.468 53 HA VAL 8 HA VAL 8 24.579 0.059 16.239 54 HB VAL 8 HB VAL 8 26.622 -1.244 15.854 55 HG11 VAL 8 HG11 VAL 8 24.535 -2.738 17.439 56 HG12 VAL 8 HG12 VAL 8 25.534 -1.406 18.021 57 HG13 VAL 8 HG13 VAL 8 26.280 -2.945 17.588 58 HG21 VAL 8 HG21 VAL 8 25.790 -2.563 13.933 59 HG22 VAL 8 HG22 VAL 8 24.801 -3.511 15.045 60 HG23 VAL 8 HG23 VAL 8 26.559 -3.558 15.168 61 H GLY 9 HN GLY 9 26.298 0.920 14.859 62 HA2 GLY 9 HA2 GLY 9 26.595 0.498 12.146 63 HA3 GLY 9 HA1 GLY 9 25.279 1.658 12.315 64 H ALA 10 HN ALA 10 27.798 2.173 11.091 65 HA ALA 10 HA ALA 10 28.974 4.066 13.017 66 HB1 ALA 10 HB1 ALA 10 31.062 3.886 11.759 67 HB2 ALA 10 HB2 ALA 10 30.303 2.742 10.652 68 HB3 ALA 10 HB3 ALA 10 30.537 2.307 12.345 69 HA PRO 11 HA PRO 11 27.410 6.835 9.776 70 HB2 PRO 11 HB2 PRO 11 26.191 8.578 11.453 71 HB3 PRO 11 HB1 PRO 11 25.428 7.082 10.912 72 HG2 PRO 11 HG2 PRO 11 26.466 7.787 13.556 73 HG3 PRO 11 HG1 PRO 11 25.353 6.491 13.100 74 HD2 PRO 11 HD2 PRO 11 28.197 6.338 13.622 75 HD3 PRO 11 HD1 PRO 11 27.053 5.019 13.306 76 HA PRO 12 HA PRO 12 31.268 9.090 10.724 77 HB2 PRO 12 HB2 PRO 12 30.939 9.907 7.903 78 HB3 PRO 12 HB1 PRO 12 32.321 9.145 8.697 79 HG2 PRO 12 HG2 PRO 12 30.769 7.776 7.003 80 HG3 PRO 12 HG1 PRO 12 31.452 7.012 8.451 81 HD2 PRO 12 HD2 PRO 12 28.676 8.033 7.977 82 HD3 PRO 12 HD1 PRO 12 29.207 6.550 8.798 83 HA PRO 13 HA PRO 13 28.792 12.803 11.420 84 HB2 PRO 13 HB2 PRO 13 31.113 13.654 12.996 85 HB3 PRO 13 HB1 PRO 13 29.448 13.380 13.512 86 HG2 PRO 13 HG2 PRO 13 31.448 11.722 14.226 87 HG3 PRO 13 HG1 PRO 13 29.800 11.139 13.926 88 HD2 PRO 13 HD2 PRO 13 32.204 11.026 12.141 89 HD3 PRO 13 HD1 PRO 13 30.971 9.784 12.450 90 H GLY 14 HN GLY 14 28.840 13.892 9.515 91 HA2 GLY 14 HA2 GLY 14 29.909 16.142 8.869 92 HA3 GLY 14 HA1 GLY 14 31.367 15.172 8.710 93 H ARG 15 HN ARG 15 28.414 13.646 7.887 94 HA ARG 15 HA ARG 15 27.601 12.799 5.953 95 HB2 ARG 15 HB2 ARG 15 28.462 15.533 5.061 96 HB3 ARG 15 HB1 ARG 15 27.731 14.401 3.936 97 HG2 ARG 15 HG2 ARG 15 26.417 15.193 6.514 98 HG3 ARG 15 HG1 ARG 15 26.197 16.090 5.012 99 HD2 ARG 15 HD2 ARG 15 24.366 14.542 5.284 100 HD3 ARG 15 HD1 ARG 15 25.374 14.016 3.938 101 HE ARG 15 HE ARG 15 25.898 12.797 6.532 102 HH11 ARG 15 HH11 ARG 15 24.376 12.536 3.384 103 HH12 ARG 15 HH12 ARG 15 24.229 10.801 3.464 104 HH21 ARG 15 HH21 ARG 15 25.709 10.513 6.626 105 HH22 ARG 15 HH22 ARG 15 24.963 9.666 5.298 106 H ALA 16 HN ALA 16 30.223 11.994 6.620 107 HA ALA 16 HA ALA 16 31.715 11.884 4.136 108 HB1 ALA 16 HB1 ALA 16 32.944 12.057 6.239 109 HB2 ALA 16 HB2 ALA 16 33.334 10.549 5.412 110 HB3 ALA 16 HB3 ALA 16 32.234 10.540 6.791 111 H ASP 17 HN ASP 17 29.405 10.930 3.473 112 HA ASP 17 HA ASP 17 29.594 7.994 3.604 113 HB2 ASP 17 HB2 ASP 17 27.589 8.725 4.731 114 HB3 ASP 17 HB1 ASP 17 27.156 9.769 3.380 115 H LYS 18 HN LYS 18 30.299 7.182 1.776 116 HA LYS 18 HA LYS 18 29.249 8.272 -0.753 117 HB2 LYS 18 HB2 LYS 18 32.096 7.484 -0.131 118 HB3 LYS 18 HB1 LYS 18 31.490 7.680 -1.769 119 HG2 LYS 18 HG2 LYS 18 30.986 10.014 -1.324 120 HG3 LYS 18 HG1 LYS 18 31.538 9.826 0.341 121 HD2 LYS 18 HD2 LYS 18 33.781 9.386 -0.388 122 HD3 LYS 18 HD1 LYS 18 33.271 9.334 -2.076 123 HE2 LYS 18 HE2 LYS 18 33.097 11.755 -0.288 124 HE3 LYS 18 HE1 LYS 18 34.375 11.457 -1.468 125 HZ1 LYS 18 HZ1 LYS 18 31.477 11.724 -2.102 126 HZ2 LYS 18 HZ2 LYS 18 32.730 11.480 -3.221 127 HZ3 LYS 18 HZ3 LYS 18 32.653 12.925 -2.341 128 H THR 19 HN THR 19 28.898 5.870 1.172 129 HA THR 19 HA THR 19 29.880 3.554 -0.049 130 HB THR 19 HB THR 19 27.377 3.734 1.622 131 HG1 THR 19 HG1 THR 19 28.624 3.981 3.362 132 HG21 THR 19 HG21 THR 19 28.050 1.494 2.365 133 HG22 THR 19 HG22 THR 19 29.442 1.554 1.283 134 HG23 THR 19 HG23 THR 19 27.807 1.545 0.619 135 H ALA 20 HN ALA 20 26.457 4.598 0.014 136 HA ALA 20 HA ALA 20 26.008 2.948 -2.347 137 HB1 ALA 20 HB1 ALA 20 24.484 2.675 -0.445 138 HB2 ALA 20 HB2 ALA 20 23.631 3.235 -1.883 139 HB3 ALA 20 HB3 ALA 20 24.011 4.369 -0.587 140 H ALA 21 HN ALA 21 27.521 5.163 -2.855 141 HA ALA 21 HA ALA 21 26.094 7.455 -3.634 142 HB1 ALA 21 HB1 ALA 21 28.077 8.107 -4.861 143 HB2 ALA 21 HB2 ALA 21 28.704 6.460 -4.768 144 HB3 ALA 21 HB3 ALA 21 28.530 7.421 -3.300 145 HA PRO 22 HA PRO 22 25.611 5.684 -7.993 146 HB2 PRO 22 HB2 PRO 22 26.783 3.442 -8.813 147 HB3 PRO 22 HB1 PRO 22 27.721 4.930 -8.631 148 HG2 PRO 22 HG2 PRO 22 27.566 2.556 -6.828 149 HG3 PRO 22 HG1 PRO 22 28.972 3.543 -7.264 150 HD2 PRO 22 HD2 PRO 22 27.470 3.796 -4.926 151 HD3 PRO 22 HD1 PRO 22 28.571 5.022 -5.583 152 H GLN 23 HN GLN 23 25.064 3.886 -5.254 153 HA GLN 23 HA GLN 23 23.546 1.761 -6.516 154 HB2 GLN 23 HB2 GLN 23 24.029 2.364 -3.598 155 HB3 GLN 23 HB1 GLN 23 23.223 0.931 -4.220 156 HG2 GLN 23 HG2 GLN 23 25.295 0.306 -5.394 157 HG3 GLN 23 HG1 GLN 23 26.090 1.715 -4.692 158 HE21 GLN 23 HE21 GLN 23 24.773 -1.434 -4.083 159 HE22 GLN 23 HE22 GLN 23 25.441 -1.628 -2.494 160 H THR 24 HN THR 24 22.981 4.803 -4.933 161 HA THR 24 HA THR 24 20.188 4.264 -4.417 162 HB THR 24 HB THR 24 21.518 6.982 -4.363 163 HG1 THR 24 HG1 THR 24 22.775 5.683 -3.035 164 HG21 THR 24 HG21 THR 24 19.834 7.427 -2.619 165 HG22 THR 24 HG22 THR 24 19.193 5.798 -2.830 166 HG23 THR 24 HG23 THR 24 19.077 6.969 -4.145 167 H ARG 25 HN ARG 25 20.844 3.799 -7.062 168 HA ARG 25 HA ARG 25 19.453 5.936 -8.508 169 HB2 ARG 25 HB2 ARG 25 20.021 4.543 -10.538 170 HB3 ARG 25 HB1 ARG 25 21.406 5.207 -9.682 171 HG2 ARG 25 HG2 ARG 25 21.951 3.114 -8.740 172 HG3 ARG 25 HG1 ARG 25 20.405 2.412 -9.219 173 HD2 ARG 25 HD2 ARG 25 22.310 1.701 -10.640 174 HD3 ARG 25 HD1 ARG 25 21.015 2.493 -11.532 175 HE ARG 25 HE ARG 25 23.152 4.258 -10.720 176 HH11 ARG 25 HH11 ARG 25 22.051 2.021 -13.183 177 HH12 ARG 25 HH12 ARG 25 22.941 2.804 -14.461 178 HH21 ARG 25 HH21 ARG 25 24.326 5.266 -12.395 179 HH22 ARG 25 HH22 ARG 25 24.239 4.628 -14.012 180 H LEU 26 HN LEU 26 19.195 2.671 -7.358 181 HA LEU 26 HA LEU 26 16.366 2.666 -7.589 182 HB2 LEU 26 HB2 LEU 26 16.857 2.181 -9.918 183 HB3 LEU 26 HB1 LEU 26 17.926 0.873 -9.453 184 HG LEU 26 HG LEU 26 16.011 -0.374 -8.547 185 HD11 LEU 26 HD11 LEU 26 14.587 1.488 -7.918 186 HD12 LEU 26 HD12 LEU 26 13.730 0.393 -9.002 187 HD13 LEU 26 HD13 LEU 26 14.370 1.919 -9.613 188 HD21 LEU 26 HD21 LEU 26 14.956 -0.905 -10.689 189 HD22 LEU 26 HD22 LEU 26 16.704 -0.742 -10.849 190 HD23 LEU 26 HD23 LEU 26 15.645 0.560 -11.389 191 H THR 27 HN THR 27 16.700 2.246 -5.356 192 HA THR 27 HA THR 27 17.859 -0.064 -4.290 193 HB THR 27 HB THR 27 15.318 1.250 -3.297 194 HG1 THR 27 HG1 THR 27 18.044 2.013 -2.925 195 HG21 THR 27 HG21 THR 27 17.546 -0.185 -1.845 196 HG22 THR 27 HG22 THR 27 15.937 -0.833 -2.158 197 HG23 THR 27 HG23 THR 27 16.136 0.559 -1.092 198 HA PRO 28 HA PRO 28 15.221 -2.954 -6.391 199 HB2 PRO 28 HB2 PRO 28 16.321 -5.231 -5.501 200 HB3 PRO 28 HB1 PRO 28 17.161 -4.157 -6.626 201 HG2 PRO 28 HG2 PRO 28 17.501 -4.435 -3.667 202 HG3 PRO 28 HG1 PRO 28 18.739 -4.267 -4.926 203 HD2 PRO 28 HD2 PRO 28 17.860 -2.197 -3.359 204 HD3 PRO 28 HD1 PRO 28 18.529 -1.986 -4.989 205 H TYR 29 HN TYR 29 14.539 -1.995 -3.526 206 HA TYR 29 HA TYR 29 12.236 -3.573 -3.221 207 HB2 TYR 29 HB2 TYR 29 13.993 -5.174 -2.330 208 HB3 TYR 29 HB1 TYR 29 14.252 -4.028 -1.016 209 HD1 TYR 29 HD2 TYR 29 11.656 -6.132 -2.634 210 HD2 TYR 29 HD1 TYR 29 12.856 -4.060 0.885 211 HE1 TYR 29 HE2 TYR 29 9.784 -7.146 -1.410 212 HE2 TYR 29 HE1 TYR 29 10.980 -5.067 2.121 213 HH TYR 29 HH TYR 29 8.799 -6.064 1.671 214 H ALA 30 HN ALA 30 10.978 -1.887 -2.799 215 HA ALA 30 HA ALA 30 11.839 0.292 -1.116 216 HB1 ALA 30 HB1 ALA 30 9.656 1.266 -1.618 217 HB2 ALA 30 HB2 ALA 30 9.151 -0.239 -2.387 218 HB3 ALA 30 HB3 ALA 30 10.454 0.717 -3.092 219 H GLN 31 HN GLN 31 11.703 0.248 1.025 220 HA GLN 31 HA GLN 31 10.031 -1.743 2.319 221 HB2 GLN 31 HB2 GLN 31 12.329 -1.485 3.092 222 HB3 GLN 31 HB1 GLN 31 12.040 0.211 3.455 223 HG2 GLN 31 HG2 GLN 31 10.437 -0.418 5.176 224 HG3 GLN 31 HG1 GLN 31 10.678 -2.120 4.792 225 HE21 GLN 31 HE21 GLN 31 11.338 -2.566 6.889 226 HE22 GLN 31 HE22 GLN 31 12.890 -2.089 7.486 227 H ALA 32 HN ALA 32 7.949 -1.017 2.112 228 HA ALA 32 HA ALA 32 7.270 1.618 3.161 229 HB1 ALA 32 HB1 ALA 32 5.482 -0.509 1.983 230 HB2 ALA 32 HB2 ALA 32 6.172 0.852 1.100 231 HB3 ALA 32 HB3 ALA 32 5.010 1.141 2.394 232 H GLY 33 HN GLY 33 6.859 1.879 5.251 233 HA2 GLY 33 HA2 GLY 33 6.609 -0.439 6.966 234 HA3 GLY 33 HA1 GLY 33 6.714 1.237 7.480 235 H GLU 34 HN GLU 34 4.471 -0.961 5.794 236 HA GLU 34 HA GLU 34 2.195 0.565 6.704 237 HB2 GLU 34 HB2 GLU 34 2.456 -0.842 4.499 238 HB3 GLU 34 HB1 GLU 34 1.960 -2.183 5.521 239 HG2 GLU 34 HG2 GLU 34 0.393 0.342 5.017 240 HG3 GLU 34 HG1 GLU 34 0.070 -1.240 4.315 241 H ASP 35 HN ASP 35 2.720 0.388 8.971 242 HA ASP 35 HA ASP 35 1.583 -2.087 10.100 243 HB2 ASP 35 HB2 ASP 35 3.869 -1.811 10.877 244 HB3 ASP 35 HB1 ASP 35 3.535 -0.150 11.366 245 H ASN 36 HN ASN 36 1.791 1.406 10.350 246 HA ASN 36 HA ASN 36 -1.011 1.441 11.196 247 HB2 ASN 36 HB2 ASN 36 -0.516 3.397 12.670 248 HB3 ASN 36 HB1 ASN 36 0.217 1.899 13.231 249 HD21 ASN 36 HD21 ASN 36 2.441 1.661 13.164 250 HD22 ASN 36 HD22 ASN 36 3.507 3.008 12.939 251 H TRP 37 HN TRP 37 0.193 1.649 8.650 252 HA TRP 37 HA TRP 37 0.233 4.480 7.957 253 HB2 TRP 37 HB2 TRP 37 1.702 2.392 7.021 254 HB3 TRP 37 HB1 TRP 37 0.399 2.401 5.849 255 HD1 TRP 37 HD1 TRP 37 1.535 5.767 7.190 256 HE1 TRP 37 HE1 TRP 37 2.848 6.981 5.335 257 HE3 TRP 37 HE3 TRP 37 1.880 1.946 3.841 258 HZ2 TRP 37 HZ2 TRP 37 3.890 6.376 2.774 259 HZ3 TRP 37 HZ3 TRP 37 3.048 2.333 1.718 260 HH2 TRP 37 HH2 TRP 37 4.026 4.497 1.213 261 H ARG 38 HN ARG 38 -1.797 1.716 7.849 262 HA ARG 38 HA ARG 38 -3.489 2.429 5.711 263 HB2 ARG 38 HB2 ARG 38 -4.997 0.736 6.560 264 HB3 ARG 38 HB1 ARG 38 -3.340 0.142 6.619 265 HG2 ARG 38 HG2 ARG 38 -3.384 0.956 9.072 266 HG3 ARG 38 HG1 ARG 38 -5.136 0.966 8.869 267 HD2 ARG 38 HD2 ARG 38 -4.551 -1.140 9.804 268 HD3 ARG 38 HD1 ARG 38 -4.964 -1.422 8.113 269 HE ARG 38 HE ARG 38 -2.520 -1.473 7.678 270 HH11 ARG 38 HH11 ARG 38 -3.682 -2.039 10.934 271 HH12 ARG 38 HH12 ARG 38 -2.291 -2.969 11.403 272 HH21 ARG 38 HH21 ARG 38 -0.712 -2.690 8.267 273 HH22 ARG 38 HH22 ARG 38 -0.581 -3.340 9.883 274 H SER 39 HN SER 39 -3.462 3.251 9.107 275 HA SER 39 HA SER 39 -6.064 4.396 9.155 276 HB2 SER 39 HB2 SER 39 -5.038 5.557 11.251 277 HB3 SER 39 HB1 SER 39 -5.253 3.805 11.271 278 HG SER 39 HG SER 39 -3.201 3.773 11.710 279 H ARG 40 HN ARG 40 -2.836 5.536 8.399 280 HA ARG 40 HA ARG 40 -3.475 8.290 8.252 281 HB2 ARG 40 HB2 ARG 40 -1.307 7.032 6.598 282 HB3 ARG 40 HB1 ARG 40 -1.339 8.557 7.442 283 HG2 ARG 40 HG2 ARG 40 -1.070 5.878 8.742 284 HG3 ARG 40 HG1 ARG 40 0.226 7.042 8.475 285 HD2 ARG 40 HD2 ARG 40 -0.959 8.653 9.912 286 HD3 ARG 40 HD1 ARG 40 -2.204 7.440 10.215 287 HE ARG 40 HE ARG 40 -0.094 6.089 10.996 288 HH11 ARG 40 HH11 ARG 40 -0.914 9.432 11.614 289 HH12 ARG 40 HH12 ARG 40 0.013 9.526 13.082 290 HH21 ARG 40 HH21 ARG 40 1.106 6.180 12.928 291 HH22 ARG 40 HH22 ARG 40 1.165 7.662 13.837 292 H ILE 41 HN ILE 41 -3.140 5.679 5.901 293 HA ILE 41 HA ILE 41 -3.864 7.025 3.554 294 HB ILE 41 HB ILE 41 -4.320 4.147 4.431 295 HG12 ILE 41 HG12 ILE 41 -2.290 5.377 2.559 296 HG13 ILE 41 HG11 ILE 41 -1.980 4.909 4.227 297 HG21 ILE 41 HG21 ILE 41 -4.694 5.335 1.690 298 HG22 ILE 41 HG22 ILE 41 -5.950 4.641 2.719 299 HG23 ILE 41 HG23 ILE 41 -4.678 3.611 2.056 300 HD11 ILE 41 HD11 ILE 41 -1.133 3.254 2.663 301 HD12 ILE 41 HD12 ILE 41 -2.750 3.048 1.991 302 HD13 ILE 41 HD13 ILE 41 -2.423 2.582 3.659 303 H SER 42 HN SER 42 -5.895 5.296 5.962 304 HA SER 42 HA SER 42 -8.380 5.777 4.751 305 HB2 SER 42 HB2 SER 42 -7.715 5.402 7.680 306 HB3 SER 42 HB1 SER 42 -9.343 5.348 7.005 307 HG SER 42 HG SER 42 -7.178 3.583 6.517 308 H GLY 43 HN GLY 43 -6.464 7.798 6.937 309 HA2 GLY 43 HA2 GLY 43 -8.437 9.800 7.331 310 HA3 GLY 43 HA1 GLY 43 -6.698 10.024 7.496 311 H ARG 44 HN ARG 44 -5.968 9.289 4.895 312 HA ARG 44 HA ARG 44 -6.390 11.680 3.437 313 HB2 ARG 44 HB2 ARG 44 -4.478 9.872 3.390 314 HB3 ARG 44 HB1 ARG 44 -5.502 9.132 2.189 315 HG2 ARG 44 HG2 ARG 44 -4.938 10.605 0.625 316 HG3 ARG 44 HG1 ARG 44 -5.023 11.972 1.749 317 HD2 ARG 44 HD2 ARG 44 -2.847 9.956 2.027 318 HD3 ARG 44 HD1 ARG 44 -2.716 11.216 0.774 319 HE ARG 44 HE ARG 44 -3.135 11.858 3.637 320 HH11 ARG 44 HH11 ARG 44 -1.323 12.267 0.658 321 HH12 ARG 44 HH12 ARG 44 -0.432 13.641 1.240 322 HH21 ARG 44 HH21 ARG 44 -1.961 13.651 4.397 323 HH22 ARG 44 HH22 ARG 44 -0.791 14.419 3.371 324 H LEU 45 HN LEU 45 -7.782 8.472 3.381 325 HA LEU 45 HA LEU 45 -9.295 8.686 1.020 326 HB2 LEU 45 HB2 LEU 45 -8.756 6.790 2.949 327 HB3 LEU 45 HB1 LEU 45 -10.458 7.108 3.180 328 HG LEU 45 HG LEU 45 -9.321 6.428 0.487 329 HD11 LEU 45 HD11 LEU 45 -10.384 4.535 2.582 330 HD12 LEU 45 HD12 LEU 45 -8.713 4.634 2.019 331 HD13 LEU 45 HD13 LEU 45 -9.986 4.103 0.917 332 HD21 LEU 45 HD21 LEU 45 -12.090 6.260 1.670 333 HD22 LEU 45 HD22 LEU 45 -11.638 5.649 0.076 334 HD23 LEU 45 HD23 LEU 45 -11.538 7.379 0.422 335 H ASN 46 HN ASN 46 -9.682 9.869 4.200 336 HA ASN 46 HA ASN 46 -12.464 10.483 4.157 337 HB2 ASN 46 HB2 ASN 46 -11.268 10.263 6.278 338 HB3 ASN 46 HB1 ASN 46 -10.195 11.586 5.843 339 HD21 ASN 46 HD21 ASN 46 -13.685 11.507 5.333 340 HD22 ASN 46 HD22 ASN 46 -14.045 12.793 6.423 341 H ARG 47 HN ARG 47 -9.494 12.130 3.332 342 HA ARG 47 HA ARG 47 -10.425 14.643 2.663 343 HB2 ARG 47 HB2 ARG 47 -8.224 14.735 2.297 344 HB3 ARG 47 HB1 ARG 47 -8.111 12.998 2.133 345 HG2 ARG 47 HG2 ARG 47 -8.661 13.152 -0.238 346 HG3 ARG 47 HG1 ARG 47 -8.832 14.911 -0.082 347 HD2 ARG 47 HD2 ARG 47 -6.479 15.069 0.613 348 HD3 ARG 47 HD1 ARG 47 -6.311 13.324 0.425 349 HE ARG 47 HE ARG 47 -7.249 14.517 -1.980 350 HH11 ARG 47 HH11 ARG 47 -4.341 14.194 -0.047 351 HH12 ARG 47 HH12 ARG 47 -3.266 14.296 -1.406 352 HH21 ARG 47 HH21 ARG 47 -5.839 14.657 -3.772 353 HH22 ARG 47 HH22 ARG 47 -4.123 14.575 -3.524 354 H PHE 48 HN PHE 48 -10.884 11.583 1.049 355 HA PHE 48 HA PHE 48 -12.079 12.952 -1.224 356 HB2 PHE 48 HB2 PHE 48 -11.453 10.025 -0.837 357 HB3 PHE 48 HB1 PHE 48 -12.131 10.726 -2.302 358 HD1 PHE 48 HD1 PHE 48 -10.759 12.438 -3.553 359 HD2 PHE 48 HD2 PHE 48 -9.148 9.974 -0.482 360 HE1 PHE 48 HE1 PHE 48 -8.492 12.861 -4.408 361 HE2 PHE 48 HE2 PHE 48 -6.878 10.393 -1.329 362 HZ PHE 48 HZ PHE 48 -6.548 11.836 -3.293 363 H LYS 49 HN LYS 49 -12.837 10.203 0.858 364 HA LYS 49 HA LYS 49 -15.398 10.987 1.680 365 HB2 LYS 49 HB2 LYS 49 -15.279 9.405 -0.850 366 HB3 LYS 49 HB1 LYS 49 -16.481 8.933 0.338 367 HG2 LYS 49 HG2 LYS 49 -17.415 11.204 0.272 368 HG3 LYS 49 HG1 LYS 49 -16.222 11.645 -0.953 369 HD2 LYS 49 HD2 LYS 49 -18.322 9.491 -1.223 370 HD3 LYS 49 HD1 LYS 49 -18.387 11.091 -1.960 371 HE2 LYS 49 HE2 LYS 49 -16.463 10.610 -3.318 372 HE3 LYS 49 HE1 LYS 49 -16.203 9.080 -2.485 373 HZ1 LYS 49 HZ1 LYS 49 -18.538 9.761 -4.193 374 HZ2 LYS 49 HZ2 LYS 49 -18.335 8.302 -3.353 375 HZ3 LYS 49 HZ3 LYS 49 -17.268 8.715 -4.605 376 H ARG 50 HN ARG 50 -14.990 10.075 3.669 377 HA ARG 50 HA ARG 50 -14.110 7.266 3.653 378 HB2 ARG 50 HB2 ARG 50 -12.541 8.881 4.751 379 HB3 ARG 50 HB1 ARG 50 -13.798 9.221 5.935 380 HG2 ARG 50 HG2 ARG 50 -13.791 6.831 6.571 381 HG3 ARG 50 HG1 ARG 50 -12.451 6.570 5.454 382 HD2 ARG 50 HD2 ARG 50 -11.596 6.823 7.691 383 HD3 ARG 50 HD1 ARG 50 -11.119 8.216 6.722 384 HE ARG 50 HE ARG 50 -13.515 8.854 8.006 385 HH11 ARG 50 HH11 ARG 50 -10.197 8.134 8.895 386 HH12 ARG 50 HH12 ARG 50 -10.232 9.134 10.309 387 HH21 ARG 50 HH21 ARG 50 -13.546 10.167 9.855 388 HH22 ARG 50 HH22 ARG 50 -12.130 10.292 10.858 389 H TYR 51 HN TYR 51 -15.890 6.105 3.749 390 HA TYR 51 HA TYR 51 -17.996 6.749 5.656 391 HB2 TYR 51 HB2 TYR 51 -18.015 5.628 3.151 392 HB3 TYR 51 HB1 TYR 51 -18.109 4.205 4.174 393 HD1 TYR 51 HD1 TYR 51 -19.721 7.502 3.584 394 HD2 TYR 51 HD2 TYR 51 -20.182 3.532 5.039 395 HE1 TYR 51 HE1 TYR 51 -22.136 7.875 3.824 396 HE2 TYR 51 HE2 TYR 51 -22.603 3.900 5.285 397 HH TYR 51 HH TYR 51 -24.188 6.593 3.905 398 HA PRO 52 HA PRO 52 -15.929 4.356 8.799 399 HB2 PRO 52 HB2 PRO 52 -18.170 3.921 10.362 400 HB3 PRO 52 HB1 PRO 52 -17.155 5.365 10.425 401 HG2 PRO 52 HG2 PRO 52 -19.755 4.931 9.020 402 HG3 PRO 52 HG1 PRO 52 -19.170 6.364 9.885 403 HD2 PRO 52 HD2 PRO 52 -19.177 6.233 7.204 404 HD3 PRO 52 HD1 PRO 52 -17.891 7.076 8.092 405 H LYS 53 HN LYS 53 -15.510 2.231 9.090 406 HA LYS 53 HA LYS 53 -16.465 0.464 7.116 407 HB2 LYS 53 HB2 LYS 53 -14.926 -0.195 9.630 408 HB3 LYS 53 HB1 LYS 53 -15.113 -1.250 8.241 409 HG2 LYS 53 HG2 LYS 53 -13.714 1.418 8.222 410 HG3 LYS 53 HG1 LYS 53 -12.920 -0.150 8.328 411 HD2 LYS 53 HD2 LYS 53 -12.740 0.269 6.079 412 HD3 LYS 53 HD1 LYS 53 -14.263 -0.619 6.116 413 HE2 LYS 53 HE2 LYS 53 -14.493 1.335 4.699 414 HE3 LYS 53 HE1 LYS 53 -15.481 1.522 6.150 415 HZ1 LYS 53 HZ1 LYS 53 -14.320 3.556 5.669 416 HZ2 LYS 53 HZ2 LYS 53 -12.819 2.766 5.674 417 HZ3 LYS 53 HZ3 LYS 53 -13.715 2.905 7.110 418 H ASP 54 HN ASP 54 -17.525 1.016 10.382 419 HA ASP 54 HA ASP 54 -18.858 -1.409 10.870 420 HB2 ASP 54 HB2 ASP 54 -18.472 0.214 12.645 421 HB3 ASP 54 HB1 ASP 54 -19.506 1.385 11.835 422 H ALA 55 HN ALA 55 -19.813 1.483 9.126 423 HA ALA 55 HA ALA 55 -22.502 0.654 8.678 424 HB1 ALA 55 HB1 ALA 55 -21.832 3.008 8.604 425 HB2 ALA 55 HB2 ALA 55 -22.616 2.500 7.109 426 HB3 ALA 55 HB3 ALA 55 -20.863 2.682 7.166 427 H LEU 56 HN LEU 56 -19.467 0.116 7.055 428 HA LEU 56 HA LEU 56 -20.637 -0.784 4.590 429 HB2 LEU 56 HB2 LEU 56 -17.851 -1.004 5.729 430 HB3 LEU 56 HB1 LEU 56 -18.297 -1.718 4.194 431 HG LEU 56 HG LEU 56 -17.181 0.338 3.760 432 HD11 LEU 56 HD11 LEU 56 -18.828 1.572 2.502 433 HD12 LEU 56 HD12 LEU 56 -20.131 0.788 3.400 434 HD13 LEU 56 HD13 LEU 56 -19.097 -0.163 2.332 435 HD21 LEU 56 HD21 LEU 56 -17.881 2.464 4.624 436 HD22 LEU 56 HD22 LEU 56 -17.526 1.368 5.953 437 HD23 LEU 56 HD23 LEU 56 -19.200 1.707 5.515 438 H ARG 57 HN ARG 57 -19.269 -2.381 7.459 439 HA ARG 57 HA ARG 57 -19.552 -5.004 6.416 440 HB2 ARG 57 HB2 ARG 57 -19.260 -5.777 8.729 441 HB3 ARG 57 HB1 ARG 57 -18.060 -4.578 8.274 442 HG2 ARG 57 HG2 ARG 57 -19.382 -2.860 9.457 443 HG3 ARG 57 HG1 ARG 57 -20.493 -4.126 9.986 444 HD2 ARG 57 HD2 ARG 57 -18.809 -3.561 11.694 445 HD3 ARG 57 HD1 ARG 57 -18.715 -5.245 11.175 446 HE ARG 57 HE ARG 57 -16.845 -4.410 9.671 447 HH11 ARG 57 HH11 ARG 57 -17.594 -3.033 12.799 448 HH12 ARG 57 HH12 ARG 57 -16.000 -2.375 13.032 449 HH21 ARG 57 HH21 ARG 57 -14.720 -3.611 10.002 450 HH22 ARG 57 HH22 ARG 57 -14.347 -2.770 11.479 451 H LEU 58 HN LEU 58 -21.837 -2.780 7.456 452 HA LEU 58 HA LEU 58 -23.864 -4.891 7.779 453 HB2 LEU 58 HB2 LEU 58 -23.483 -3.263 9.673 454 HB3 LEU 58 HB1 LEU 58 -24.066 -1.997 8.612 455 HG LEU 58 HG LEU 58 -26.251 -3.138 8.470 456 HD11 LEU 58 HD11 LEU 58 -26.763 -4.980 9.971 457 HD12 LEU 58 HD12 LEU 58 -25.092 -5.006 10.534 458 HD13 LEU 58 HD13 LEU 58 -25.465 -5.425 8.862 459 HD21 LEU 58 HD21 LEU 58 -25.270 -2.570 11.266 460 HD22 LEU 58 HD22 LEU 58 -26.961 -2.634 10.765 461 HD23 LEU 58 HD23 LEU 58 -25.896 -1.387 10.116 462 H LYS 59 HN LYS 59 -22.610 -3.282 5.375 463 HA LYS 59 HA LYS 59 -25.113 -3.025 3.930 464 HB2 LYS 59 HB2 LYS 59 -24.863 -0.805 4.893 465 HB3 LYS 59 HB1 LYS 59 -23.230 -0.680 4.266 466 HG2 LYS 59 HG2 LYS 59 -24.196 -0.847 1.965 467 HG3 LYS 59 HG1 LYS 59 -25.791 -0.731 2.706 468 HD2 LYS 59 HD2 LYS 59 -23.583 1.314 2.862 469 HD3 LYS 59 HD1 LYS 59 -25.077 1.455 1.937 470 HE2 LYS 59 HE2 LYS 59 -24.910 1.223 4.944 471 HE3 LYS 59 HE1 LYS 59 -25.110 2.733 4.056 472 HZ1 LYS 59 HZ1 LYS 59 -27.223 1.954 4.849 473 HZ2 LYS 59 HZ2 LYS 59 -27.016 0.454 4.092 474 HZ3 LYS 59 HZ3 LYS 59 -27.196 1.860 3.157 475 H ARG 60 HN ARG 60 -21.873 -1.703 3.274 476 HA ARG 60 HA ARG 60 -21.743 -3.463 0.919 477 HB2 ARG 60 HB2 ARG 60 -20.421 -0.773 1.339 478 HB3 ARG 60 HB1 ARG 60 -20.306 -1.761 -0.109 479 HG2 ARG 60 HG2 ARG 60 -22.830 -0.528 0.967 480 HG3 ARG 60 HG1 ARG 60 -21.864 0.098 -0.370 481 HD2 ARG 60 HD2 ARG 60 -22.240 -2.101 -1.526 482 HD3 ARG 60 HD1 ARG 60 -23.397 -2.488 -0.252 483 HE ARG 60 HE ARG 60 -23.784 -0.001 -1.736 484 HH11 ARG 60 HH11 ARG 60 -24.786 -3.296 -1.110 485 HH12 ARG 60 HH12 ARG 60 -26.301 -3.136 -1.949 486 HH21 ARG 60 HH21 ARG 60 -25.780 0.236 -2.796 487 HH22 ARG 60 HH22 ARG 60 -26.873 -1.111 -2.894 488 H GLN 61 HN GLN 61 -20.775 -5.127 2.130 489 HA GLN 61 HA GLN 61 -18.203 -4.556 3.388 490 HB2 GLN 61 HB2 GLN 61 -18.355 -6.914 4.193 491 HB3 GLN 61 HB1 GLN 61 -19.676 -5.890 4.733 492 HG2 GLN 61 HG2 GLN 61 -19.946 -7.643 2.318 493 HG3 GLN 61 HG1 GLN 61 -20.222 -8.262 3.945 494 HE21 GLN 61 HE21 GLN 61 -21.335 -5.736 4.887 495 HE22 GLN 61 HE22 GLN 61 -22.919 -5.638 4.208 496 H GLY 62 HN GLY 62 -16.476 -6.323 3.010 497 HA2 GLY 62 HA2 GLY 62 -16.249 -8.070 1.015 498 HA3 GLY 62 HA1 GLY 62 -16.153 -6.560 0.130 499 H VAL 63 HN VAL 63 -14.345 -8.923 1.367 500 HA VAL 63 HA VAL 63 -12.102 -7.139 1.973 501 HB VAL 63 HB VAL 63 -12.465 -8.780 3.714 502 HG11 VAL 63 HG11 VAL 63 -12.265 -11.184 3.311 503 HG12 VAL 63 HG12 VAL 63 -12.139 -10.882 1.578 504 HG13 VAL 63 HG13 VAL 63 -13.628 -10.486 2.436 505 HG21 VAL 63 HG21 VAL 63 -10.028 -9.433 2.057 506 HG22 VAL 63 HG22 VAL 63 -10.249 -9.857 3.754 507 HG23 VAL 63 HG23 VAL 63 -10.163 -8.163 3.274 508 H GLY 64 HN GLY 64 -10.584 -6.837 0.514 509 HA2 GLY 64 HA2 GLY 64 -10.017 -8.930 -1.449 510 HA3 GLY 64 HA1 GLY 64 -10.544 -7.370 -2.065 511 H GLN 65 HN GLN 65 -8.109 -8.384 -2.790 512 HA GLN 65 HA GLN 65 -6.175 -6.883 -1.155 513 HB2 GLN 65 HB2 GLN 65 -5.735 -9.314 -1.606 514 HB3 GLN 65 HB1 GLN 65 -5.634 -8.931 -3.319 515 HG2 GLN 65 HG2 GLN 65 -3.728 -7.494 -2.907 516 HG3 GLN 65 HG1 GLN 65 -3.846 -7.811 -1.177 517 HE21 GLN 65 HE21 GLN 65 -3.193 -9.807 -0.370 518 HE22 GLN 65 HE22 GLN 65 -2.240 -10.906 -1.308 519 H VAL 66 HN VAL 66 -5.354 -5.034 -1.940 520 HA VAL 66 HA VAL 66 -5.996 -4.324 -4.728 521 HB VAL 66 HB VAL 66 -6.525 -2.734 -2.211 522 HG11 VAL 66 HG11 VAL 66 -7.266 -0.899 -3.567 523 HG12 VAL 66 HG12 VAL 66 -6.851 -1.775 -5.046 524 HG13 VAL 66 HG13 VAL 66 -5.578 -1.257 -3.938 525 HG21 VAL 66 HG21 VAL 66 -8.823 -2.726 -2.982 526 HG22 VAL 66 HG22 VAL 66 -8.224 -4.381 -2.828 527 HG23 VAL 66 HG23 VAL 66 -8.359 -3.636 -4.422 528 H ARG 67 HN ARG 67 -4.185 -3.748 -5.773 529 HA ARG 67 HA ARG 67 -2.029 -2.541 -4.181 530 HB2 ARG 67 HB2 ARG 67 -0.401 -3.586 -5.448 531 HB3 ARG 67 HB1 ARG 67 -1.637 -4.834 -5.379 532 HG2 ARG 67 HG2 ARG 67 -2.137 -4.654 -7.593 533 HG3 ARG 67 HG1 ARG 67 -1.661 -2.955 -7.682 534 HD2 ARG 67 HD2 ARG 67 -0.077 -4.363 -8.885 535 HD3 ARG 67 HD1 ARG 67 0.687 -3.600 -7.490 536 HE ARG 67 HE ARG 67 -0.239 -6.107 -6.691 537 HH11 ARG 67 HH11 ARG 67 2.191 -4.719 -8.805 538 HH12 ARG 67 HH12 ARG 67 3.222 -6.120 -8.737 539 HH21 ARG 67 HH21 ARG 67 1.136 -7.927 -6.576 540 HH22 ARG 67 HH22 ARG 67 2.635 -7.931 -7.454 541 H PHE 68 HN PHE 68 -0.946 -0.745 -5.058 542 HA PHE 68 HA PHE 68 -1.937 0.444 -7.479 543 HB2 PHE 68 HB2 PHE 68 -2.577 2.569 -6.036 544 HB3 PHE 68 HB1 PHE 68 -3.744 1.298 -6.366 545 HD1 PHE 68 HD2 PHE 68 -1.052 1.877 -3.813 546 HD2 PHE 68 HD1 PHE 68 -5.094 0.817 -4.619 547 HE1 PHE 68 HE2 PHE 68 -1.464 1.604 -1.402 548 HE2 PHE 68 HE1 PHE 68 -5.510 0.550 -2.213 549 HZ PHE 68 HZ PHE 68 -3.697 0.946 -0.604 550 H THR 69 HN THR 69 -0.867 2.348 -8.075 551 HA THR 69 HA THR 69 1.646 2.901 -6.624 552 HB THR 69 HB THR 69 1.067 3.899 -9.400 553 HG1 THR 69 HG1 THR 69 1.561 1.263 -8.589 554 HG21 THR 69 HG21 THR 69 3.061 4.750 -8.306 555 HG22 THR 69 HG22 THR 69 3.537 3.620 -9.580 556 HG23 THR 69 HG23 THR 69 3.566 3.102 -7.896 557 H LEU 70 HN LEU 70 1.892 4.873 -5.739 558 HA LEU 70 HA LEU 70 -0.494 6.582 -5.914 559 HB2 LEU 70 HB2 LEU 70 1.211 6.033 -3.494 560 HB3 LEU 70 HB1 LEU 70 -0.277 6.966 -3.542 561 HG LEU 70 HG LEU 70 -0.119 4.034 -4.237 562 HD11 LEU 70 HD11 LEU 70 -1.212 3.713 -2.008 563 HD12 LEU 70 HD12 LEU 70 -0.809 5.393 -1.634 564 HD13 LEU 70 HD13 LEU 70 0.475 4.222 -1.937 565 HD21 LEU 70 HD21 LEU 70 -1.985 5.298 -5.238 566 HD22 LEU 70 HD22 LEU 70 -2.487 5.801 -3.621 567 HD23 LEU 70 HD23 LEU 70 -2.529 4.093 -4.065 568 H ASP 71 HN ASP 71 -0.248 8.657 -6.246 569 HA ASP 71 HA ASP 71 2.284 9.749 -6.902 570 HB2 ASP 71 HB2 ASP 71 0.207 10.517 -7.971 571 HB3 ASP 71 HB1 ASP 71 -0.369 11.126 -6.420 572 H ARG 72 HN ARG 72 3.316 11.457 -5.940 573 HA ARG 72 HA ARG 72 3.901 11.098 -3.238 574 HB2 ARG 72 HB2 ARG 72 4.577 13.509 -4.927 575 HB3 ARG 72 HB1 ARG 72 5.444 12.929 -3.509 576 HG2 ARG 72 HG2 ARG 72 6.031 10.875 -4.730 577 HG3 ARG 72 HG1 ARG 72 5.208 11.505 -6.155 578 HD2 ARG 72 HD2 ARG 72 6.759 13.434 -6.138 579 HD3 ARG 72 HD1 ARG 72 7.621 12.683 -4.792 580 HE ARG 72 HE ARG 72 7.314 11.067 -7.186 581 HH11 ARG 72 HH11 ARG 72 9.382 13.140 -5.264 582 HH12 ARG 72 HH12 ARG 72 10.841 12.670 -6.098 583 HH21 ARG 72 HH21 ARG 72 9.205 10.435 -8.264 584 HH22 ARG 72 HH22 ARG 72 10.738 11.131 -7.824 585 H GLN 73 HN GLN 73 1.476 13.057 -4.720 586 HA GLN 73 HA GLN 73 1.098 14.563 -2.223 587 HB2 GLN 73 HB2 GLN 73 -0.400 14.876 -4.831 588 HB3 GLN 73 HB1 GLN 73 -0.414 15.977 -3.461 589 HG2 GLN 73 HG2 GLN 73 1.977 16.426 -3.825 590 HG3 GLN 73 HG1 GLN 73 1.931 15.382 -5.244 591 HE21 GLN 73 HE21 GLN 73 2.628 18.162 -5.128 592 HE22 GLN 73 HE22 GLN 73 1.493 19.011 -6.130 593 H GLY 74 HN GLY 74 0.308 11.656 -3.338 594 HA2 GLY 74 HA2 GLY 74 -1.118 10.135 -2.309 595 HA3 GLY 74 HA1 GLY 74 -1.983 11.469 -1.582 596 H HIS 75 HN HIS 75 -1.289 10.939 -4.989 597 HA HIS 75 HA HIS 75 -4.188 10.722 -5.470 598 HB2 HIS 75 HB2 HIS 75 -3.318 12.754 -6.447 599 HB3 HIS 75 HB1 HIS 75 -1.989 11.882 -7.200 600 HD1 HIS 75 HD1 HIS 75 -5.803 11.945 -7.393 601 HD2 HIS 75 HD2 HIS 75 -2.468 11.247 -9.785 602 HE1 HIS 75 HE1 HIS 75 -6.692 11.598 -9.720 603 HE2 HIS 75 HE2 HIS 75 -4.654 11.305 -11.174 604 H VAL 76 HN VAL 76 -4.864 8.789 -6.185 605 HA VAL 76 HA VAL 76 -3.274 6.615 -6.753 606 HB VAL 76 HB VAL 76 -5.672 6.405 -6.343 607 HG11 VAL 76 HG11 VAL 76 -6.034 7.564 -9.097 608 HG12 VAL 76 HG12 VAL 76 -6.480 8.332 -7.572 609 HG13 VAL 76 HG13 VAL 76 -7.309 6.867 -8.097 610 HG21 VAL 76 HG21 VAL 76 -4.844 5.286 -9.018 611 HG22 VAL 76 HG22 VAL 76 -6.172 4.690 -8.019 612 HG23 VAL 76 HG23 VAL 76 -4.509 4.570 -7.441 613 H LEU 77 HN LEU 77 -1.890 6.179 -8.308 614 HA LEU 77 HA LEU 77 -2.156 7.536 -10.900 615 HB2 LEU 77 HB2 LEU 77 0.195 6.057 -9.711 616 HB3 LEU 77 HB1 LEU 77 0.190 6.880 -11.261 617 HG LEU 77 HG LEU 77 -0.329 8.324 -8.674 618 HD11 LEU 77 HD11 LEU 77 2.301 7.895 -10.078 619 HD12 LEU 77 HD12 LEU 77 1.840 7.275 -8.490 620 HD13 LEU 77 HD13 LEU 77 2.020 9.013 -8.741 621 HD21 LEU 77 HD21 LEU 77 -1.049 9.450 -10.719 622 HD22 LEU 77 HD22 LEU 77 0.568 9.265 -11.396 623 HD23 LEU 77 HD23 LEU 77 0.317 10.282 -9.977 624 H ALA 78 HN ALA 78 -1.709 4.433 -9.360 625 HA ALA 78 HA ALA 78 -2.903 3.115 -11.687 626 HB1 ALA 78 HB1 ALA 78 -0.455 2.109 -10.228 627 HB2 ALA 78 HB2 ALA 78 -0.458 2.799 -11.854 628 HB3 ALA 78 HB3 ALA 78 -1.300 1.280 -11.538 629 H VAL 79 HN VAL 79 -4.064 1.209 -11.105 630 HA VAL 79 HA VAL 79 -4.044 0.353 -8.356 631 HB VAL 79 HB VAL 79 -5.623 2.207 -8.200 632 HG11 VAL 79 HG11 VAL 79 -7.225 0.769 -10.309 633 HG12 VAL 79 HG12 VAL 79 -6.377 2.300 -10.517 634 HG13 VAL 79 HG13 VAL 79 -7.747 2.194 -9.410 635 HG21 VAL 79 HG21 VAL 79 -6.003 0.257 -6.806 636 HG22 VAL 79 HG22 VAL 79 -6.973 -0.483 -8.079 637 HG23 VAL 79 HG23 VAL 79 -7.538 0.985 -7.280 638 H THR 80 HN THR 80 -4.190 -1.760 -8.347 639 HA THR 80 HA THR 80 -5.554 -3.101 -10.587 640 HB THR 80 HB THR 80 -2.937 -4.008 -9.361 641 HG1 THR 80 HG1 THR 80 -3.426 -2.714 -11.865 642 HG21 THR 80 HG21 THR 80 -2.856 -5.547 -11.257 643 HG22 THR 80 HG22 THR 80 -4.401 -4.928 -11.843 644 HG23 THR 80 HG23 THR 80 -4.325 -5.804 -10.313 645 H LEU 81 HN LEU 81 -7.023 -4.544 -9.916 646 HA LEU 81 HA LEU 81 -7.202 -5.283 -7.146 647 HB2 LEU 81 HB2 LEU 81 -9.198 -5.026 -8.624 648 HB3 LEU 81 HB1 LEU 81 -8.682 -6.454 -9.504 649 HG LEU 81 HG LEU 81 -8.802 -7.697 -7.293 650 HD11 LEU 81 HD11 LEU 81 -8.815 -5.790 -5.806 651 HD12 LEU 81 HD12 LEU 81 -10.284 -6.741 -5.596 652 HD13 LEU 81 HD13 LEU 81 -10.334 -5.228 -6.501 653 HD21 LEU 81 HD21 LEU 81 -11.238 -7.992 -7.457 654 HD22 LEU 81 HD22 LEU 81 -10.457 -7.998 -9.038 655 HD23 LEU 81 HD23 LEU 81 -11.328 -6.565 -8.491 656 H VAL 82 HN VAL 82 -5.834 -6.657 -6.313 657 HA VAL 82 HA VAL 82 -4.243 -8.352 -8.037 658 HB VAL 82 HB VAL 82 -3.813 -8.598 -5.147 659 HG11 VAL 82 HG11 VAL 82 -2.134 -7.924 -7.540 660 HG12 VAL 82 HG12 VAL 82 -2.098 -9.384 -6.546 661 HG13 VAL 82 HG13 VAL 82 -1.497 -7.853 -5.898 662 HG21 VAL 82 HG21 VAL 82 -4.648 -6.331 -5.125 663 HG22 VAL 82 HG22 VAL 82 -3.562 -5.891 -6.443 664 HG23 VAL 82 HG23 VAL 82 -2.902 -6.331 -4.865 665 H SER 83 HN SER 83 -6.513 -8.711 -5.364 666 HA SER 83 HA SER 83 -7.271 -11.320 -6.343 667 HB2 SER 83 HB2 SER 83 -6.243 -11.013 -3.509 668 HB3 SER 83 HB1 SER 83 -6.925 -12.476 -4.216 669 HG SER 83 HG SER 83 -4.954 -11.607 -5.791 670 H SER 84 HN SER 84 -9.413 -11.654 -6.004 671 HA SER 84 HA SER 84 -10.749 -9.928 -4.022 672 HB2 SER 84 HB2 SER 84 -11.242 -9.216 -6.331 673 HB3 SER 84 HB1 SER 84 -11.837 -10.833 -6.702 674 HG SER 84 HG SER 84 -13.201 -8.810 -5.719 675 H ALA 85 HN ALA 85 -12.159 -10.900 -2.651 676 HA ALA 85 HA ALA 85 -11.987 -13.775 -2.492 677 HB1 ALA 85 HB1 ALA 85 -11.757 -12.416 -0.479 678 HB2 ALA 85 HB2 ALA 85 -13.126 -13.521 -0.350 679 HB3 ALA 85 HB3 ALA 85 -13.402 -11.814 -0.692 680 H GLY 86 HN GLY 86 -14.218 -11.505 -3.739 681 HA2 GLY 86 HA2 GLY 86 -15.919 -12.741 -5.190 682 HA3 GLY 86 HA1 GLY 86 -16.392 -13.496 -3.676 683 H LEU 87 HN LEU 87 -15.832 -10.237 -4.983 684 HA LEU 87 HA LEU 87 -18.222 -9.340 -3.507 685 HB2 LEU 87 HB2 LEU 87 -15.927 -7.552 -4.294 686 HB3 LEU 87 HB1 LEU 87 -17.259 -7.162 -3.245 687 HG LEU 87 HG LEU 87 -15.460 -7.373 -1.790 688 HD11 LEU 87 HD11 LEU 87 -17.363 -8.648 -1.019 689 HD12 LEU 87 HD12 LEU 87 -15.853 -9.394 -0.495 690 HD13 LEU 87 HD13 LEU 87 -16.756 -10.084 -1.844 691 HD21 LEU 87 HD21 LEU 87 -13.797 -9.121 -1.847 692 HD22 LEU 87 HD22 LEU 87 -13.873 -8.301 -3.407 693 HD23 LEU 87 HD23 LEU 87 -14.612 -9.889 -3.208 694 HA PRO 88 HA PRO 88 -19.035 -8.772 -7.988 695 HB2 PRO 88 HB2 PRO 88 -21.807 -9.344 -7.400 696 HB3 PRO 88 HB1 PRO 88 -20.667 -10.293 -8.354 697 HG2 PRO 88 HG2 PRO 88 -21.667 -11.091 -5.935 698 HG3 PRO 88 HG1 PRO 88 -20.115 -11.633 -6.594 699 HD2 PRO 88 HD2 PRO 88 -20.672 -9.547 -4.523 700 HD3 PRO 88 HD1 PRO 88 -19.356 -10.741 -4.601 701 H SER 89 HN SER 89 -21.902 -8.046 -6.040 702 HA SER 89 HA SER 89 -22.250 -5.490 -7.246 703 HB2 SER 89 HB2 SER 89 -23.564 -6.531 -4.726 704 HB3 SER 89 HB1 SER 89 -24.186 -5.304 -5.831 705 HG SER 89 HG SER 89 -24.524 -6.870 -7.375 706 H LEU 90 HN LEU 90 -20.416 -6.655 -4.640 707 HA LEU 90 HA LEU 90 -20.520 -4.302 -3.014 708 HB2 LEU 90 HB2 LEU 90 -18.530 -6.583 -2.899 709 HB3 LEU 90 HB1 LEU 90 -18.863 -5.402 -1.643 710 HG LEU 90 HG LEU 90 -20.991 -7.269 -2.648 711 HD11 LEU 90 HD11 LEU 90 -20.432 -8.830 -0.963 712 HD12 LEU 90 HD12 LEU 90 -19.230 -7.746 -0.262 713 HD13 LEU 90 HD13 LEU 90 -18.935 -8.481 -1.843 714 HD21 LEU 90 HD21 LEU 90 -20.626 -5.722 -0.080 715 HD22 LEU 90 HD22 LEU 90 -21.974 -6.799 -0.447 716 HD23 LEU 90 HD23 LEU 90 -21.744 -5.323 -1.386 717 H ASP 91 HN ASP 91 -18.357 -5.573 -5.473 718 HA ASP 91 HA ASP 91 -16.052 -4.117 -4.941 719 HB2 ASP 91 HB2 ASP 91 -16.192 -5.955 -6.601 720 HB3 ASP 91 HB1 ASP 91 -17.101 -4.895 -7.672 721 H ARG 92 HN ARG 92 -18.784 -3.243 -7.014 722 HA ARG 92 HA ARG 92 -17.759 -0.918 -8.105 723 HB2 ARG 92 HB2 ARG 92 -20.103 -0.261 -8.509 724 HB3 ARG 92 HB1 ARG 92 -19.804 -1.941 -8.928 725 HG2 ARG 92 HG2 ARG 92 -20.812 -2.653 -6.827 726 HG3 ARG 92 HG1 ARG 92 -21.099 -0.969 -6.394 727 HD2 ARG 92 HD2 ARG 92 -23.121 -1.978 -7.242 728 HD3 ARG 92 HD1 ARG 92 -22.555 -0.728 -8.351 729 HE ARG 92 HE ARG 92 -21.537 -3.232 -9.165 730 HH11 ARG 92 HH11 ARG 92 -24.560 -1.480 -8.996 731 HH12 ARG 92 HH12 ARG 92 -25.271 -2.308 -10.341 732 HH21 ARG 92 HH21 ARG 92 -22.459 -4.321 -10.942 733 HH22 ARG 92 HH22 ARG 92 -24.072 -3.921 -11.461 734 H GLU 93 HN GLU 93 -19.446 -1.345 -5.015 735 HA GLU 93 HA GLU 93 -19.592 1.479 -4.515 736 HB2 GLU 93 HB2 GLU 93 -21.223 -0.264 -3.666 737 HB3 GLU 93 HB1 GLU 93 -19.988 -0.731 -2.506 738 HG2 GLU 93 HG2 GLU 93 -21.321 0.723 -1.305 739 HG3 GLU 93 HG1 GLU 93 -19.981 1.743 -1.827 740 H ILE 94 HN ILE 94 -17.761 -1.205 -3.031 741 HA ILE 94 HA ILE 94 -16.453 0.516 -1.186 742 HB ILE 94 HB ILE 94 -15.146 -1.439 -0.529 743 HG12 ILE 94 HG12 ILE 94 -16.533 -2.854 -2.820 744 HG13 ILE 94 HG11 ILE 94 -14.828 -2.416 -2.781 745 HG21 ILE 94 HG21 ILE 94 -17.025 -2.869 0.165 746 HG22 ILE 94 HG22 ILE 94 -18.072 -2.013 -0.966 747 HG23 ILE 94 HG23 ILE 94 -17.360 -1.154 0.399 748 HD11 ILE 94 HD11 ILE 94 -16.202 -4.354 -0.933 749 HD12 ILE 94 HD12 ILE 94 -14.496 -3.908 -0.874 750 HD13 ILE 94 HD13 ILE 94 -15.137 -4.763 -2.278 751 H GLN 95 HN GLN 95 -15.585 -0.821 -4.322 752 HA GLN 95 HA GLN 95 -12.870 0.068 -4.085 753 HB2 GLN 95 HB2 GLN 95 -14.378 -0.938 -6.477 754 HB3 GLN 95 HB1 GLN 95 -12.667 -0.680 -6.381 755 HG2 GLN 95 HG2 GLN 95 -14.134 -2.597 -4.611 756 HG3 GLN 95 HG1 GLN 95 -13.406 -3.062 -6.146 757 HE21 GLN 95 HE21 GLN 95 -12.849 -4.066 -3.540 758 HE22 GLN 95 HE22 GLN 95 -11.184 -3.740 -3.213 759 H ALA 96 HN ALA 96 -15.873 1.315 -5.459 760 HA ALA 96 HA ALA 96 -14.794 3.474 -6.862 761 HB1 ALA 96 HB1 ALA 96 -17.236 3.524 -5.076 762 HB2 ALA 96 HB2 ALA 96 -17.218 3.047 -6.774 763 HB3 ALA 96 HB3 ALA 96 -16.841 4.710 -6.321 764 H LEU 97 HN LEU 97 -15.400 2.999 -3.451 765 HA LEU 97 HA LEU 97 -14.566 5.457 -2.474 766 HB2 LEU 97 HB2 LEU 97 -16.032 3.831 -1.372 767 HB3 LEU 97 HB1 LEU 97 -14.697 2.702 -1.254 768 HG LEU 97 HG LEU 97 -13.871 5.092 -0.121 769 HD11 LEU 97 HD11 LEU 97 -16.200 5.731 0.133 770 HD12 LEU 97 HD12 LEU 97 -15.515 5.340 1.711 771 HD13 LEU 97 HD13 LEU 97 -16.558 4.176 0.888 772 HD21 LEU 97 HD21 LEU 97 -13.953 3.611 1.978 773 HD22 LEU 97 HD22 LEU 97 -12.924 3.123 0.631 774 HD23 LEU 97 HD23 LEU 97 -14.496 2.348 0.866 775 H VAL 98 HN VAL 98 -12.895 2.288 -2.415 776 HA VAL 98 HA VAL 98 -10.414 3.558 -1.606 777 HB VAL 98 HB VAL 98 -11.111 0.653 -2.046 778 HG11 VAL 98 HG11 VAL 98 -8.730 1.023 -2.481 779 HG12 VAL 98 HG12 VAL 98 -8.975 0.119 -0.986 780 HG13 VAL 98 HG13 VAL 98 -8.570 1.836 -0.924 781 HG21 VAL 98 HG21 VAL 98 -12.222 1.616 -0.135 782 HG22 VAL 98 HG22 VAL 98 -10.702 2.297 0.447 783 HG23 VAL 98 HG23 VAL 98 -10.933 0.546 0.415 784 H LYS 99 HN LYS 99 -11.490 1.593 -4.365 785 HA LYS 99 HA LYS 99 -8.964 1.463 -5.622 786 HB2 LYS 99 HB2 LYS 99 -10.704 -0.200 -6.047 787 HB3 LYS 99 HB1 LYS 99 -11.752 1.020 -6.744 788 HG2 LYS 99 HG2 LYS 99 -10.104 1.323 -8.570 789 HG3 LYS 99 HG1 LYS 99 -9.155 0.000 -7.887 790 HD2 LYS 99 HD2 LYS 99 -12.010 -0.191 -8.863 791 HD3 LYS 99 HD1 LYS 99 -10.589 -0.772 -9.727 792 HE2 LYS 99 HE2 LYS 99 -10.160 -2.435 -8.065 793 HE3 LYS 99 HE1 LYS 99 -11.363 -1.740 -6.981 794 HZ1 LYS 99 HZ1 LYS 99 -12.284 -3.682 -8.002 795 HZ2 LYS 99 HZ2 LYS 99 -11.879 -3.143 -9.554 796 HZ3 LYS 99 HZ3 LYS 99 -13.074 -2.340 -8.660 797 H ARG 100 HN ARG 100 -11.520 3.905 -5.705 798 HA ARG 100 HA ARG 100 -10.087 5.228 -7.885 799 HB2 ARG 100 HB2 ARG 100 -12.505 5.193 -8.090 800 HB3 ARG 100 HB1 ARG 100 -12.675 5.990 -6.531 801 HG2 ARG 100 HG2 ARG 100 -13.001 7.547 -8.380 802 HG3 ARG 100 HG1 ARG 100 -11.595 7.983 -7.407 803 HD2 ARG 100 HD2 ARG 100 -10.182 6.761 -9.100 804 HD3 ARG 100 HD1 ARG 100 -11.627 6.637 -10.105 805 HE ARG 100 HE ARG 100 -11.368 9.309 -9.469 806 HH11 ARG 100 HH11 ARG 100 -9.450 6.895 -11.143 807 HH12 ARG 100 HH12 ARG 100 -8.649 8.060 -12.157 808 HH21 ARG 100 HH21 ARG 100 -10.305 10.830 -10.770 809 HH22 ARG 100 HH22 ARG 100 -9.137 10.304 -11.947 810 H ALA 101 HN ALA 101 -10.786 5.664 -4.440 811 HA ALA 101 HA ALA 101 -9.073 8.050 -4.477 812 HB1 ALA 101 HB1 ALA 101 -9.958 8.671 -2.364 813 HB2 ALA 101 HB2 ALA 101 -10.697 7.079 -2.128 814 HB3 ALA 101 HB3 ALA 101 -11.330 8.174 -3.363 815 H SER 102 HN SER 102 -7.442 6.151 -4.940 816 HA SER 102 HA SER 102 -6.487 4.873 -2.539 817 HB2 SER 102 HB2 SER 102 -5.069 5.009 -5.199 818 HB3 SER 102 HB1 SER 102 -4.855 3.819 -3.919 819 HG SER 102 HG SER 102 -7.375 3.686 -4.476 820 HA PRO 103 HA PRO 103 -4.158 8.600 -1.801 821 HB2 PRO 103 HB2 PRO 103 -4.560 8.524 0.902 822 HB3 PRO 103 HB1 PRO 103 -5.765 9.077 -0.269 823 HG2 PRO 103 HG2 PRO 103 -5.830 6.710 1.382 824 HG3 PRO 103 HG1 PRO 103 -7.087 7.342 0.307 825 HD2 PRO 103 HD2 PRO 103 -5.085 5.223 -0.180 826 HD3 PRO 103 HD1 PRO 103 -6.645 5.513 -0.983 827 H LEU 104 HN LEU 104 -2.219 9.193 -0.959 828 HA LEU 104 HA LEU 104 -0.576 7.167 0.419 829 HB2 LEU 104 HB2 LEU 104 0.053 7.608 -1.986 830 HB3 LEU 104 HB1 LEU 104 0.359 9.274 -1.545 831 HG LEU 104 HG LEU 104 2.092 8.373 0.092 832 HD11 LEU 104 HD11 LEU 104 3.024 6.138 -0.619 833 HD12 LEU 104 HD12 LEU 104 1.513 5.884 -1.499 834 HD13 LEU 104 HD13 LEU 104 1.491 6.088 0.253 835 HD21 LEU 104 HD21 LEU 104 2.665 9.475 -2.008 836 HD22 LEU 104 HD22 LEU 104 2.501 7.943 -2.865 837 HD23 LEU 104 HD23 LEU 104 3.776 8.149 -1.665 838 HA PRO 105 HA PRO 105 -1.076 10.725 3.183 839 HB2 PRO 105 HB2 PRO 105 -0.070 9.281 5.388 840 HB3 PRO 105 HB1 PRO 105 -1.754 9.630 5.005 841 HG2 PRO 105 HG2 PRO 105 -0.402 7.126 4.885 842 HG3 PRO 105 HG1 PRO 105 -2.083 7.485 4.499 843 HD2 PRO 105 HD2 PRO 105 0.092 6.919 2.685 844 HD3 PRO 105 HD1 PRO 105 -1.640 7.117 2.338 845 H THR 106 HN THR 106 1.529 8.890 4.651 846 HA THR 106 HA THR 106 3.253 11.191 4.532 847 HB THR 106 HB THR 106 3.901 8.390 5.484 848 HG1 THR 106 HG1 THR 106 2.586 10.579 6.679 849 HG21 THR 106 HG21 THR 106 5.208 11.058 6.038 850 HG22 THR 106 HG22 THR 106 5.881 9.752 5.062 851 HG23 THR 106 HG23 THR 106 5.648 9.530 6.797 852 HA PRO 107 HA PRO 107 4.490 9.985 0.407 853 HB2 PRO 107 HB2 PRO 107 6.403 12.214 0.736 854 HB3 PRO 107 HB1 PRO 107 5.157 11.972 -0.492 855 HG2 PRO 107 HG2 PRO 107 4.864 13.810 1.426 856 HG3 PRO 107 HG1 PRO 107 3.484 12.864 0.836 857 HD2 PRO 107 HD2 PRO 107 5.089 12.516 3.342 858 HD3 PRO 107 HD1 PRO 107 3.332 12.396 3.103 859 HA PRO 108 HA PRO 108 8.116 7.726 1.940 860 HB2 PRO 108 HB2 PRO 108 7.876 5.642 0.264 861 HB3 PRO 108 HB1 PRO 108 6.809 5.824 1.664 862 HG2 PRO 108 HG2 PRO 108 6.302 6.541 -1.202 863 HG3 PRO 108 HG1 PRO 108 5.248 5.662 -0.079 864 HD2 PRO 108 HD2 PRO 108 4.951 8.305 -0.598 865 HD3 PRO 108 HD1 PRO 108 4.563 7.596 0.981 866 H ALA 109 HN ALA 109 8.855 9.874 0.663 867 HA ALA 109 HA ALA 109 9.786 9.702 -1.968 868 HB1 ALA 109 HB1 ALA 109 10.991 11.259 0.318 869 HB2 ALA 109 HB2 ALA 109 9.668 11.803 -0.713 870 HB3 ALA 109 HB3 ALA 109 11.272 11.550 -1.399 871 H ASP 110 HN ASP 110 11.153 8.647 1.043 872 HA ASP 110 HA ASP 110 13.754 8.022 0.140 873 HB2 ASP 110 HB2 ASP 110 13.030 8.357 2.516 874 HB3 ASP 110 HB1 ASP 110 12.204 6.807 2.436 875 H ALA 111 HN ALA 111 10.832 6.658 -0.685 876 HA ALA 111 HA ALA 111 11.960 3.960 -1.027 877 HB1 ALA 111 HB1 ALA 111 9.697 3.112 -0.931 878 HB2 ALA 111 HB2 ALA 111 9.056 4.755 -0.843 879 HB3 ALA 111 HB3 ALA 111 10.021 4.109 0.489 880 H TYR 112 HN TYR 112 10.765 6.706 -2.771 881 HA TYR 112 HA TYR 112 10.453 5.008 -5.133 882 HB2 TYR 112 HB2 TYR 112 8.449 6.218 -5.850 883 HB3 TYR 112 HB1 TYR 112 8.246 5.300 -4.376 884 HD1 TYR 112 HD2 TYR 112 9.784 8.676 -4.513 885 HD2 TYR 112 HD1 TYR 112 6.331 6.378 -3.597 886 HE1 TYR 112 HE2 TYR 112 8.778 10.627 -3.411 887 HE2 TYR 112 HE1 TYR 112 5.319 8.305 -2.501 888 HH TYR 112 HH TYR 112 6.596 11.469 -2.758 889 H VAL 113 HN VAL 113 12.432 7.044 -4.223 890 HA VAL 113 HA VAL 113 12.206 9.225 -6.051 891 HB VAL 113 HB VAL 113 14.766 9.441 -5.634 892 HG11 VAL 113 HG11 VAL 113 12.760 9.761 -3.407 893 HG12 VAL 113 HG12 VAL 113 13.101 10.925 -4.685 894 HG13 VAL 113 HG13 VAL 113 14.335 10.551 -3.481 895 HG21 VAL 113 HG21 VAL 113 15.607 8.382 -3.644 896 HG22 VAL 113 HG22 VAL 113 15.013 7.129 -4.736 897 HG23 VAL 113 HG23 VAL 113 14.051 7.615 -3.339 898 H ASN 114 HN ASN 114 11.806 8.510 -7.955 899 HA ASN 114 HA ASN 114 13.441 7.964 -9.972 900 HB2 ASN 114 HB2 ASN 114 13.324 5.488 -10.346 901 HB3 ASN 114 HB1 ASN 114 14.357 5.949 -9.006 902 HD21 ASN 114 HD21 ASN 114 10.804 5.726 -8.845 903 HD22 ASN 114 HD22 ASN 114 10.794 4.394 -7.746 904 H GLY 115 HN GLY 115 10.524 7.637 -8.321 905 HA2 GLY 115 HA2 GLY 115 8.911 8.477 -10.411 906 HA3 GLY 115 HA1 GLY 115 8.837 6.721 -10.405 907 H THR 116 HN THR 116 7.902 5.644 -8.642 908 HA THR 116 HA THR 116 6.594 7.053 -6.534 909 HB THR 116 HB THR 116 4.956 7.757 -8.004 910 HG1 THR 116 HG1 THR 116 3.530 6.963 -6.717 911 HG21 THR 116 HG21 THR 116 5.065 5.096 -9.374 912 HG22 THR 116 HG22 THR 116 5.704 6.617 -9.995 913 HG23 THR 116 HG23 THR 116 3.963 6.410 -9.789 914 H VAL 117 HN VAL 117 4.795 5.442 -5.658 915 HA VAL 117 HA VAL 117 6.329 2.968 -5.183 916 HB VAL 117 HB VAL 117 4.899 2.845 -3.058 917 HG11 VAL 117 HG11 VAL 117 6.386 4.375 -1.825 918 HG12 VAL 117 HG12 VAL 117 6.956 5.020 -3.365 919 HG13 VAL 117 HG13 VAL 117 7.251 3.330 -2.954 920 HG21 VAL 117 HG21 VAL 117 4.141 5.064 -2.202 921 HG22 VAL 117 HG22 VAL 117 3.207 4.464 -3.570 922 HG23 VAL 117 HG23 VAL 117 4.416 5.730 -3.816 923 H GLU 118 HN GLU 118 5.520 1.206 -6.064 924 HA GLU 118 HA GLU 118 2.600 0.941 -6.319 925 HB2 GLU 118 HB2 GLU 118 4.130 0.551 -8.345 926 HB3 GLU 118 HB1 GLU 118 4.673 -0.902 -7.516 927 HG2 GLU 118 HG2 GLU 118 2.249 -1.597 -7.413 928 HG3 GLU 118 HG1 GLU 118 1.919 -0.260 -8.515 929 H LEU 119 HN LEU 119 1.702 -0.068 -4.659 930 HA LEU 119 HA LEU 119 3.191 -2.223 -3.325 931 HB2 LEU 119 HB2 LEU 119 2.408 -1.355 -1.146 932 HB3 LEU 119 HB1 LEU 119 3.513 -0.264 -1.963 933 HG LEU 119 HG LEU 119 0.677 0.275 -2.512 934 HD11 LEU 119 HD11 LEU 119 0.324 1.353 -0.326 935 HD12 LEU 119 HD12 LEU 119 1.794 0.574 0.262 936 HD13 LEU 119 HD13 LEU 119 0.412 -0.407 -0.238 937 HD21 LEU 119 HD21 LEU 119 1.410 2.567 -2.128 938 HD22 LEU 119 HD22 LEU 119 2.502 1.735 -3.238 939 HD23 LEU 119 HD23 LEU 119 2.973 1.980 -1.555 940 H THR 120 HN THR 120 1.889 -3.731 -2.199 941 HA THR 120 HA THR 120 -0.892 -3.792 -3.160 942 HB THR 120 HB THR 120 0.832 -6.105 -2.248 943 HG1 THR 120 HG1 THR 120 1.575 -5.508 -4.241 944 HG21 THR 120 HG21 THR 120 -0.983 -7.487 -3.117 945 HG22 THR 120 HG22 THR 120 -1.901 -6.040 -3.522 946 HG23 THR 120 HG23 THR 120 -1.555 -6.423 -1.835 947 H LEU 121 HN LEU 121 -2.438 -3.523 -1.711 948 HA LEU 121 HA LEU 121 -1.904 -4.208 1.105 949 HB2 LEU 121 HB2 LEU 121 -3.407 -1.784 0.114 950 HB3 LEU 121 HB1 LEU 121 -3.230 -2.257 1.790 951 HG LEU 121 HG LEU 121 -1.052 -1.279 -0.053 952 HD11 LEU 121 HD11 LEU 121 -2.625 0.391 0.902 953 HD12 LEU 121 HD12 LEU 121 -0.946 0.609 1.390 954 HD13 LEU 121 HD13 LEU 121 -2.107 -0.113 2.510 955 HD21 LEU 121 HD21 LEU 121 -0.869 -2.240 2.799 956 HD22 LEU 121 HD22 LEU 121 0.434 -1.487 1.877 957 HD23 LEU 121 HD23 LEU 121 -0.205 -3.058 1.384 958 HA PRO 122 HA PRO 122 -5.876 -6.242 0.501 959 HB2 PRO 122 HB2 PRO 122 -5.724 -6.904 3.338 960 HB3 PRO 122 HB1 PRO 122 -5.683 -7.988 1.945 961 HG2 PRO 122 HG2 PRO 122 -3.527 -7.545 3.540 962 HG3 PRO 122 HG1 PRO 122 -3.393 -7.953 1.820 963 HD2 PRO 122 HD2 PRO 122 -3.162 -5.285 3.161 964 HD3 PRO 122 HD1 PRO 122 -2.211 -5.959 1.819 965 H ILE 123 HN ILE 123 -7.615 -4.940 0.476 966 HA ILE 123 HA ILE 123 -8.026 -3.067 2.687 967 HB ILE 123 HB ILE 123 -9.602 -1.892 1.332 968 HG12 ILE 123 HG12 ILE 123 -9.388 -4.077 -0.740 969 HG13 ILE 123 HG11 ILE 123 -10.737 -3.900 0.379 970 HG21 ILE 123 HG21 ILE 123 -7.419 -1.275 0.691 971 HG22 ILE 123 HG22 ILE 123 -8.310 -1.497 -0.824 972 HG23 ILE 123 HG23 ILE 123 -7.197 -2.744 -0.253 973 HD11 ILE 123 HD11 ILE 123 -11.341 -2.978 -1.745 974 HD12 ILE 123 HD12 ILE 123 -9.902 -1.961 -1.760 975 HD13 ILE 123 HD13 ILE 123 -11.177 -1.667 -0.577 976 H ASP 124 HN ASP 124 -9.529 -3.499 4.239 977 HA ASP 124 HA ASP 124 -11.221 -5.840 3.678 978 HB2 ASP 124 HB2 ASP 124 -9.637 -6.437 5.357 979 HB3 ASP 124 HB1 ASP 124 -9.941 -4.957 6.260 980 H PHE 125 HN PHE 125 -13.225 -5.315 3.369 981 HA PHE 125 HA PHE 125 -14.523 -3.739 5.489 982 HB2 PHE 125 HB2 PHE 125 -15.647 -4.598 2.800 983 HB3 PHE 125 HB1 PHE 125 -16.477 -3.614 3.998 984 HD1 PHE 125 HD2 PHE 125 -13.790 -3.679 1.503 985 HD2 PHE 125 HD1 PHE 125 -16.010 -1.281 4.224 986 HE1 PHE 125 HE2 PHE 125 -12.885 -1.652 0.448 987 HE2 PHE 125 HE1 PHE 125 -15.107 0.751 3.173 988 HZ PHE 125 HZ PHE 125 -13.542 0.567 1.281 989 H SER 126 HN SER 126 -15.519 -4.997 7.007 990 HA SER 126 HA SER 126 -14.924 -7.710 7.077 991 HB2 SER 126 HB2 SER 126 -17.146 -6.374 8.628 992 HB3 SER 126 HB1 SER 126 -16.186 -7.777 9.112 993 HG SER 126 HG SER 126 -14.364 -6.090 8.714 994 H LEU 127 HN LEU 127 -15.620 -9.103 5.620 995 HA LEU 127 HA LEU 127 -18.091 -8.839 4.237 996 HB2 LEU 127 HB2 LEU 127 -15.694 -10.354 3.974 997 HB3 LEU 127 HB1 LEU 127 -17.048 -11.467 3.919 998 HG LEU 127 HG LEU 127 -16.717 -9.045 2.149 999 HD11 LEU 127 HD11 LEU 127 -16.419 -11.972 1.512 1000 HD12 LEU 127 HD12 LEU 127 -15.106 -10.799 1.623 1001 HD13 LEU 127 HD13 LEU 127 -16.332 -10.636 0.359 1002 HD21 LEU 127 HD21 LEU 127 -18.753 -11.260 2.044 1003 HD22 LEU 127 HD22 LEU 127 -18.629 -9.888 0.944 1004 HD23 LEU 127 HD23 LEU 127 -19.056 -9.629 2.634 1005 H ARG 128 HN ARG 128 -19.779 -8.942 5.582 1006 HA ARG 128 HA ARG 128 -20.367 -11.550 6.771 1007 HB2 ARG 128 HB2 ARG 128 -20.650 -8.786 7.907 1008 HB3 ARG 128 HB1 ARG 128 -21.622 -10.114 8.491 1009 HG2 ARG 128 HG2 ARG 128 -19.667 -11.307 9.210 1010 HG3 ARG 128 HG1 ARG 128 -18.619 -10.090 8.479 1011 HD2 ARG 128 HD2 ARG 128 -18.951 -9.913 10.982 1012 HD3 ARG 128 HD1 ARG 128 -19.262 -8.449 10.046 1013 HE ARG 128 HE ARG 128 -21.663 -9.892 10.341 1014 HH11 ARG 128 HH11 ARG 128 -19.409 -8.072 12.324 1015 HH12 ARG 128 HH12 ARG 128 -20.653 -7.453 13.372 1016 HH21 ARG 128 HH21 ARG 128 -23.270 -9.129 11.733 1017 HH22 ARG 128 HH22 ARG 128 -22.849 -8.070 13.046 1018 H GLY 129 HN GLY 129 -21.164 -10.516 4.162 1019 HA2 GLY 129 HA2 GLY 129 -24.043 -10.497 4.501 1020 HA3 GLY 129 HA1 GLY 129 -23.362 -8.998 3.895 1021 H ALA 130 HN ALA 130 -23.064 -8.791 1.771 1022 HA ALA 130 HA ALA 130 -24.363 -10.798 0.174 1023 HB1 ALA 130 HB1 ALA 130 -24.845 -8.390 -0.032 1024 HB2 ALA 130 HB2 ALA 130 -24.403 -9.144 -1.563 1025 HB3 ALA 130 HB3 ALA 130 -23.229 -8.150 -0.699 1026 H GLY 131 HN GLY 131 -21.928 -11.856 0.998 1027 HA2 GLY 131 HA2 GLY 131 -20.517 -12.024 -1.598 1028 HA3 GLY 131 HA1 GLY 131 -19.764 -12.396 -0.051 1029 H PHE 132 HN PHE 132 -23.002 -13.284 -0.997 1030 HA PHE 132 HA PHE 132 -22.227 -16.114 -0.849 1031 HB2 PHE 132 HB2 PHE 132 -24.516 -16.575 -0.070 1032 HB3 PHE 132 HB1 PHE 132 -23.671 -15.475 1.010 1033 HD1 PHE 132 HD1 PHE 132 -24.234 -13.044 0.952 1034 HD2 PHE 132 HD2 PHE 132 -26.533 -15.960 -1.120 1035 HE1 PHE 132 HE1 PHE 132 -26.103 -11.453 0.804 1036 HE2 PHE 132 HE2 PHE 132 -28.410 -14.375 -1.273 1037 HZ PHE 132 HZ PHE 132 -28.195 -12.119 -0.311 Start of MODEL 13 1 H1 LYS 2 HT1 LYS 2 12.672 -5.363 -24.578 2 H2 LYS 2 HT2 LYS 2 12.262 -5.386 -26.222 3 H3 LYS 2 HT3 LYS 2 13.885 -5.532 -25.753 4 HA LYS 2 HA LYS 2 12.999 -7.667 -26.406 5 HB2 LYS 2 HB2 LYS 2 13.933 -7.085 -23.662 6 HB3 LYS 2 HB1 LYS 2 13.190 -8.661 -23.881 7 HG2 LYS 2 HG2 LYS 2 15.595 -8.794 -24.147 8 HG3 LYS 2 HG1 LYS 2 14.782 -9.167 -25.667 9 HD2 LYS 2 HD2 LYS 2 15.203 -6.859 -26.425 10 HD3 LYS 2 HD1 LYS 2 16.075 -6.544 -24.924 11 HE2 LYS 2 HE2 LYS 2 17.728 -8.210 -25.484 12 HE3 LYS 2 HE1 LYS 2 16.824 -8.679 -26.922 13 HZ1 LYS 2 HZ1 LYS 2 18.650 -7.247 -27.514 14 HZ2 LYS 2 HZ2 LYS 2 18.115 -6.047 -26.440 15 HZ3 LYS 2 HZ3 LYS 2 17.184 -6.441 -27.804 16 H VAL 3 HN VAL 3 10.601 -6.539 -26.629 17 HA VAL 3 HA VAL 3 8.859 -7.766 -24.625 18 HB VAL 3 HB VAL 3 7.006 -6.544 -25.693 19 HG11 VAL 3 HG11 VAL 3 8.236 -5.533 -23.845 20 HG12 VAL 3 HG12 VAL 3 7.679 -4.308 -24.984 21 HG13 VAL 3 HG13 VAL 3 9.369 -4.809 -24.988 22 HG21 VAL 3 HG21 VAL 3 7.826 -6.456 -27.974 23 HG22 VAL 3 HG22 VAL 3 9.154 -5.408 -27.478 24 HG23 VAL 3 HG23 VAL 3 7.491 -4.826 -27.385 25 H GLN 4 HN GLN 4 9.898 -8.161 -27.906 26 HA GLN 4 HA GLN 4 7.751 -9.945 -28.634 27 HB2 GLN 4 HB2 GLN 4 10.394 -9.321 -29.968 28 HB3 GLN 4 HB1 GLN 4 9.162 -10.374 -30.658 29 HG2 GLN 4 HG2 GLN 4 8.734 -7.479 -29.953 30 HG3 GLN 4 HG1 GLN 4 9.144 -8.069 -31.563 31 HE21 GLN 4 HE21 GLN 4 7.534 -10.460 -31.338 32 HE22 GLN 4 HE22 GLN 4 5.884 -9.958 -31.482 33 H GLU 5 HN GLU 5 10.952 -10.164 -27.319 34 HA GLU 5 HA GLU 5 11.249 -12.982 -27.715 35 HB2 GLU 5 HB2 GLU 5 12.762 -11.124 -25.869 36 HB3 GLU 5 HB1 GLU 5 13.251 -12.751 -26.322 37 HG2 GLU 5 HG2 GLU 5 14.530 -11.586 -27.781 38 HG3 GLU 5 HG1 GLU 5 13.073 -11.730 -28.757 39 H GLN 6 HN GLN 6 9.065 -11.517 -25.923 40 HA GLN 6 HA GLN 6 9.359 -13.119 -23.501 41 HB2 GLN 6 HB2 GLN 6 7.249 -11.097 -24.295 42 HB3 GLN 6 HB1 GLN 6 7.331 -11.909 -22.736 43 HG2 GLN 6 HG2 GLN 6 9.466 -10.854 -22.274 44 HG3 GLN 6 HG1 GLN 6 9.447 -10.085 -23.860 45 HE21 GLN 6 HE21 GLN 6 6.565 -9.541 -23.718 46 HE22 GLN 6 HE22 GLN 6 6.395 -8.208 -22.626 47 H SER 7 HN SER 7 8.387 -13.745 -26.504 48 HA SER 7 HA SER 7 5.920 -15.151 -25.858 49 HB2 SER 7 HB2 SER 7 6.231 -13.804 -27.994 50 HB3 SER 7 HB1 SER 7 7.348 -15.061 -28.527 51 HG SER 7 HG SER 7 4.568 -15.225 -28.068 52 H VAL 8 HN VAL 8 6.219 -17.284 -27.703 53 HA VAL 8 HA VAL 8 6.779 -19.477 -27.712 54 HB VAL 8 HB VAL 8 9.491 -18.634 -26.662 55 HG11 VAL 8 HG11 VAL 8 9.120 -21.034 -26.610 56 HG12 VAL 8 HG12 VAL 8 10.280 -20.625 -27.875 57 HG13 VAL 8 HG13 VAL 8 8.613 -21.012 -28.299 58 HG21 VAL 8 HG21 VAL 8 8.526 -18.748 -29.517 59 HG22 VAL 8 HG22 VAL 8 10.189 -18.458 -29.005 60 HG23 VAL 8 HG23 VAL 8 8.927 -17.289 -28.613 61 H GLY 9 HN GLY 9 5.195 -19.157 -25.810 62 HA2 GLY 9 HA2 GLY 9 6.448 -20.166 -23.334 63 HA3 GLY 9 HA1 GLY 9 4.933 -19.274 -23.394 64 H ALA 10 HN ALA 10 5.287 -21.470 -25.923 65 HA ALA 10 HA ALA 10 3.142 -23.100 -25.117 66 HB1 ALA 10 HB1 ALA 10 3.688 -24.502 -27.036 67 HB2 ALA 10 HB2 ALA 10 5.244 -23.688 -27.201 68 HB3 ALA 10 HB3 ALA 10 3.748 -22.793 -27.464 69 HA PRO 11 HA PRO 11 6.323 -26.476 -23.888 70 HB2 PRO 11 HB2 PRO 11 8.943 -25.856 -23.683 71 HB3 PRO 11 HB1 PRO 11 8.216 -26.385 -25.203 72 HG2 PRO 11 HG2 PRO 11 8.887 -23.618 -24.286 73 HG3 PRO 11 HG1 PRO 11 9.121 -24.359 -25.881 74 HD2 PRO 11 HD2 PRO 11 7.044 -22.696 -25.293 75 HD3 PRO 11 HD1 PRO 11 6.950 -23.981 -26.511 76 HA PRO 12 HA PRO 12 6.068 -24.899 -19.693 77 HB2 PRO 12 HB2 PRO 12 6.752 -27.691 -19.005 78 HB3 PRO 12 HB1 PRO 12 5.340 -26.735 -18.544 79 HG2 PRO 12 HG2 PRO 12 5.157 -28.730 -20.325 80 HG3 PRO 12 HG1 PRO 12 4.191 -27.250 -20.479 81 HD2 PRO 12 HD2 PRO 12 6.670 -28.058 -21.950 82 HD3 PRO 12 HD1 PRO 12 5.214 -27.239 -22.556 83 HA PRO 13 HA PRO 13 10.417 -24.383 -18.951 84 HB2 PRO 13 HB2 PRO 13 10.276 -23.012 -16.638 85 HB3 PRO 13 HB1 PRO 13 9.785 -22.300 -18.180 86 HG2 PRO 13 HG2 PRO 13 8.092 -23.468 -16.006 87 HG3 PRO 13 HG1 PRO 13 7.829 -22.001 -16.968 88 HD2 PRO 13 HD2 PRO 13 6.602 -24.400 -17.473 89 HD3 PRO 13 HD1 PRO 13 6.905 -23.167 -18.709 90 H GLY 14 HN GLY 14 9.374 -26.951 -18.239 91 HA2 GLY 14 HA2 GLY 14 10.023 -28.778 -17.015 92 HA3 GLY 14 HA1 GLY 14 11.286 -27.775 -16.312 93 H ARG 15 HN ARG 15 11.133 -27.314 -14.235 94 HA ARG 15 HA ARG 15 8.509 -27.172 -12.960 95 HB2 ARG 15 HB2 ARG 15 9.150 -29.479 -12.608 96 HB3 ARG 15 HB1 ARG 15 10.746 -28.993 -12.049 97 HG2 ARG 15 HG2 ARG 15 9.699 -27.864 -10.133 98 HG3 ARG 15 HG1 ARG 15 8.125 -28.443 -10.681 99 HD2 ARG 15 HD2 ARG 15 8.725 -30.705 -10.294 100 HD3 ARG 15 HD1 ARG 15 10.426 -30.284 -10.060 101 HE ARG 15 HE ARG 15 9.155 -28.843 -8.151 102 HH11 ARG 15 HH11 ARG 15 9.153 -32.278 -8.954 103 HH12 ARG 15 HH12 ARG 15 8.858 -32.763 -7.305 104 HH21 ARG 15 HH21 ARG 15 8.730 -29.481 -6.058 105 HH22 ARG 15 HH22 ARG 15 8.607 -31.170 -5.654 106 H ALA 16 HN ALA 16 8.398 -25.465 -11.655 107 HA ALA 16 HA ALA 16 10.855 -24.482 -10.376 108 HB1 ALA 16 HB1 ALA 16 8.887 -22.720 -11.841 109 HB2 ALA 16 HB2 ALA 16 10.511 -23.132 -12.394 110 HB3 ALA 16 HB3 ALA 16 10.295 -22.174 -10.930 111 H ASP 17 HN ASP 17 10.251 -25.148 -8.368 112 HA ASP 17 HA ASP 17 7.654 -24.550 -7.249 113 HB2 ASP 17 HB2 ASP 17 10.195 -25.466 -5.865 114 HB3 ASP 17 HB1 ASP 17 8.584 -25.457 -5.158 115 H LYS 18 HN LYS 18 10.723 -23.071 -7.497 116 HA LYS 18 HA LYS 18 10.348 -21.270 -5.263 117 HB2 LYS 18 HB2 LYS 18 12.583 -20.402 -5.996 118 HB3 LYS 18 HB1 LYS 18 12.558 -22.115 -5.602 119 HG2 LYS 18 HG2 LYS 18 12.327 -22.579 -8.058 120 HG3 LYS 18 HG1 LYS 18 12.627 -20.864 -8.337 121 HD2 LYS 18 HD2 LYS 18 14.690 -22.091 -8.597 122 HD3 LYS 18 HD1 LYS 18 14.786 -21.093 -7.146 123 HE2 LYS 18 HE2 LYS 18 14.335 -23.007 -5.747 124 HE3 LYS 18 HE1 LYS 18 14.061 -24.020 -7.162 125 HZ1 LYS 18 HZ1 LYS 18 16.644 -22.691 -6.547 126 HZ2 LYS 18 HZ2 LYS 18 16.346 -23.848 -7.756 127 HZ3 LYS 18 HZ3 LYS 18 16.273 -24.293 -6.117 128 H THR 19 HN THR 19 9.995 -19.087 -5.393 129 HA THR 19 HA THR 19 9.006 -18.133 -7.992 130 HB THR 19 HB THR 19 7.370 -18.053 -6.161 131 HG1 THR 19 HG1 THR 19 8.091 -15.995 -7.706 132 HG21 THR 19 HG21 THR 19 9.288 -16.138 -4.834 133 HG22 THR 19 HG22 THR 19 8.910 -17.768 -4.280 134 HG23 THR 19 HG23 THR 19 7.664 -16.520 -4.279 135 H ALA 20 HN ALA 20 11.459 -17.680 -5.622 136 HA ALA 20 HA ALA 20 12.236 -15.055 -6.559 137 HB1 ALA 20 HB1 ALA 20 13.638 -16.953 -4.676 138 HB2 ALA 20 HB2 ALA 20 12.556 -15.642 -4.209 139 HB3 ALA 20 HB3 ALA 20 14.098 -15.279 -4.983 140 H ALA 21 HN ALA 21 12.609 -15.453 -8.773 141 HA ALA 21 HA ALA 21 15.165 -16.711 -9.347 142 HB1 ALA 21 HB1 ALA 21 14.311 -18.148 -11.093 143 HB2 ALA 21 HB2 ALA 21 12.665 -17.596 -10.776 144 HB3 ALA 21 HB3 ALA 21 13.535 -18.530 -9.557 145 HA PRO 22 HA PRO 22 13.827 -14.288 -13.286 146 HB2 PRO 22 HB2 PRO 22 11.445 -12.737 -12.566 147 HB3 PRO 22 HB1 PRO 22 11.725 -13.780 -13.963 148 HG2 PRO 22 HG2 PRO 22 10.044 -14.473 -11.978 149 HG3 PRO 22 HG1 PRO 22 11.004 -15.672 -12.865 150 HD2 PRO 22 HD2 PRO 22 11.497 -14.475 -10.159 151 HD3 PRO 22 HD1 PRO 22 11.670 -16.162 -10.690 152 H GLN 23 HN GLN 23 12.086 -11.854 -11.460 153 HA GLN 23 HA GLN 23 14.589 -10.319 -11.193 154 HB2 GLN 23 HB2 GLN 23 13.083 -9.683 -13.156 155 HB3 GLN 23 HB1 GLN 23 11.959 -9.069 -11.957 156 HG2 GLN 23 HG2 GLN 23 13.231 -7.239 -12.752 157 HG3 GLN 23 HG1 GLN 23 13.793 -7.600 -11.119 158 HE21 GLN 23 HE21 GLN 23 14.553 -7.703 -14.506 159 HE22 GLN 23 HE22 GLN 23 16.251 -8.011 -14.318 160 H THR 24 HN THR 24 13.142 -11.896 -9.267 161 HA THR 24 HA THR 24 11.664 -10.220 -7.517 162 HB THR 24 HB THR 24 12.408 -12.101 -5.836 163 HG1 THR 24 HG1 THR 24 14.028 -13.075 -6.986 164 HG21 THR 24 HG21 THR 24 10.637 -13.562 -6.703 165 HG22 THR 24 HG22 THR 24 10.666 -12.693 -8.237 166 HG23 THR 24 HG23 THR 24 10.151 -11.867 -6.768 167 H ARG 25 HN ARG 25 14.931 -10.390 -8.314 168 HA ARG 25 HA ARG 25 16.045 -9.596 -5.797 169 HB2 ARG 25 HB2 ARG 25 18.079 -9.129 -7.048 170 HB3 ARG 25 HB1 ARG 25 17.404 -10.671 -7.554 171 HG2 ARG 25 HG2 ARG 25 16.478 -9.632 -9.546 172 HG3 ARG 25 HG1 ARG 25 17.110 -8.067 -9.032 173 HD2 ARG 25 HD2 ARG 25 19.392 -8.999 -9.108 174 HD3 ARG 25 HD1 ARG 25 18.727 -10.521 -9.705 175 HE ARG 25 HE ARG 25 17.785 -8.888 -11.543 176 HH11 ARG 25 HH11 ARG 25 20.955 -8.895 -10.060 177 HH12 ARG 25 HH12 ARG 25 21.759 -8.263 -11.466 178 HH21 ARG 25 HH21 ARG 25 18.843 -8.060 -13.409 179 HH22 ARG 25 HH22 ARG 25 20.552 -7.769 -13.355 180 H LEU 26 HN LEU 26 14.240 -8.015 -8.190 181 HA LEU 26 HA LEU 26 15.027 -5.395 -7.098 182 HB2 LEU 26 HB2 LEU 26 13.844 -6.054 -9.798 183 HB3 LEU 26 HB1 LEU 26 14.108 -4.429 -9.198 184 HG LEU 26 HG LEU 26 16.238 -6.478 -9.810 185 HD11 LEU 26 HD11 LEU 26 16.899 -4.883 -11.548 186 HD12 LEU 26 HD12 LEU 26 15.521 -3.863 -11.131 187 HD13 LEU 26 HD13 LEU 26 15.256 -5.475 -11.795 188 HD21 LEU 26 HD21 LEU 26 17.835 -4.697 -9.292 189 HD22 LEU 26 HD22 LEU 26 16.875 -5.141 -7.881 190 HD23 LEU 26 HD23 LEU 26 16.508 -3.662 -8.767 191 H THR 27 HN THR 27 13.285 -6.965 -5.672 192 HA THR 27 HA THR 27 10.582 -6.178 -6.248 193 HB THR 27 HB THR 27 11.072 -8.300 -5.077 194 HG1 THR 27 HG1 THR 27 9.578 -7.733 -3.173 195 HG21 THR 27 HG21 THR 27 12.977 -7.566 -3.720 196 HG22 THR 27 HG22 THR 27 11.724 -8.296 -2.719 197 HG23 THR 27 HG23 THR 27 11.906 -6.542 -2.761 198 HA PRO 28 HA PRO 28 10.990 -2.248 -4.257 199 HB2 PRO 28 HB2 PRO 28 8.270 -1.627 -4.672 200 HB3 PRO 28 HB1 PRO 28 9.616 -1.254 -5.748 201 HG2 PRO 28 HG2 PRO 28 7.515 -3.036 -6.277 202 HG3 PRO 28 HG1 PRO 28 9.025 -2.894 -7.189 203 HD2 PRO 28 HD2 PRO 28 8.250 -4.866 -5.098 204 HD3 PRO 28 HD1 PRO 28 9.296 -5.074 -6.520 205 H TYR 29 HN TYR 29 11.222 -3.380 -2.125 206 HA TYR 29 HA TYR 29 8.788 -3.076 -0.503 207 HB2 TYR 29 HB2 TYR 29 9.735 -5.278 -0.256 208 HB3 TYR 29 HB1 TYR 29 11.338 -4.614 0.042 209 HD1 TYR 29 HD1 TYR 29 7.879 -4.527 1.452 210 HD2 TYR 29 HD2 TYR 29 12.059 -4.377 2.236 211 HE1 TYR 29 HE1 TYR 29 7.419 -4.494 3.866 212 HE2 TYR 29 HE2 TYR 29 11.609 -4.343 4.655 213 HH TYR 29 HH TYR 29 8.458 -4.932 5.961 214 H ALA 30 HN ALA 30 8.650 -1.078 0.277 215 HA ALA 30 HA ALA 30 10.783 -0.086 1.962 216 HB1 ALA 30 HB1 ALA 30 11.036 2.037 0.868 217 HB2 ALA 30 HB2 ALA 30 9.801 1.621 -0.323 218 HB3 ALA 30 HB3 ALA 30 11.343 0.759 -0.312 219 H GLN 31 HN GLN 31 9.946 0.787 3.710 220 HA GLN 31 HA GLN 31 8.447 1.526 5.245 221 HB2 GLN 31 HB2 GLN 31 8.791 3.545 3.725 222 HB3 GLN 31 HB1 GLN 31 7.246 3.135 2.995 223 HG2 GLN 31 HG2 GLN 31 6.125 3.429 5.117 224 HG3 GLN 31 HG1 GLN 31 7.664 3.738 5.916 225 HE21 GLN 31 HE21 GLN 31 8.627 5.306 3.592 226 HE22 GLN 31 HE22 GLN 31 7.830 6.834 3.718 227 H ALA 32 HN ALA 32 7.623 -0.785 4.995 228 HA ALA 32 HA ALA 32 4.744 -0.655 4.450 229 HB1 ALA 32 HB1 ALA 32 4.771 -2.766 3.257 230 HB2 ALA 32 HB2 ALA 32 6.524 -2.866 3.440 231 HB3 ALA 32 HB3 ALA 32 5.811 -1.589 2.451 232 H GLY 33 HN GLY 33 5.827 -0.496 6.964 233 HA2 GLY 33 HA2 GLY 33 4.858 -3.063 8.065 234 HA3 GLY 33 HA1 GLY 33 6.308 -2.309 8.711 235 H GLU 34 HN GLU 34 3.295 -0.792 7.683 236 HA GLU 34 HA GLU 34 2.140 0.923 8.610 237 HB2 GLU 34 HB2 GLU 34 1.037 -0.934 9.739 238 HB3 GLU 34 HB1 GLU 34 2.249 -0.912 11.012 239 HG2 GLU 34 HG2 GLU 34 0.189 0.130 11.759 240 HG3 GLU 34 HG1 GLU 34 1.503 1.300 11.709 241 H ASP 35 HN ASP 35 4.384 1.894 8.339 242 HA ASP 35 HA ASP 35 5.639 2.844 10.759 243 HB2 ASP 35 HB2 ASP 35 5.991 3.814 7.910 244 HB3 ASP 35 HB1 ASP 35 7.094 4.076 9.257 245 H ASN 36 HN ASN 36 2.949 3.317 10.751 246 HA ASN 36 HA ASN 36 1.259 4.793 10.837 247 HB2 ASN 36 HB2 ASN 36 3.603 6.566 11.437 248 HB3 ASN 36 HB1 ASN 36 1.991 7.256 11.277 249 HD21 ASN 36 HD21 ASN 36 4.114 5.367 13.215 250 HD22 ASN 36 HD22 ASN 36 3.056 5.200 14.576 251 H TRP 37 HN TRP 37 1.334 4.084 8.423 252 HA TRP 37 HA TRP 37 1.113 6.612 6.967 253 HB2 TRP 37 HB2 TRP 37 1.706 5.375 4.841 254 HB3 TRP 37 HB1 TRP 37 3.024 5.698 5.950 255 HD1 TRP 37 HD1 TRP 37 3.670 3.459 7.571 256 HE1 TRP 37 HE1 TRP 37 3.913 1.023 6.789 257 HE3 TRP 37 HE3 TRP 37 0.959 3.722 3.253 258 HZ2 TRP 37 HZ2 TRP 37 3.062 -0.579 4.638 259 HZ3 TRP 37 HZ3 TRP 37 0.733 1.693 1.882 260 HH2 TRP 37 HH2 TRP 37 1.769 -0.415 2.564 261 H ARG 38 HN ARG 38 -0.041 3.211 6.984 262 HA ARG 38 HA ARG 38 -2.098 3.826 5.114 263 HB2 ARG 38 HB2 ARG 38 -2.990 1.622 5.518 264 HB3 ARG 38 HB1 ARG 38 -1.246 1.542 5.303 265 HG2 ARG 38 HG2 ARG 38 -1.365 0.195 7.097 266 HG3 ARG 38 HG1 ARG 38 -1.393 1.717 7.990 267 HD2 ARG 38 HD2 ARG 38 -3.892 1.642 7.870 268 HD3 ARG 38 HD1 ARG 38 -3.755 0.026 7.180 269 HE ARG 38 HE ARG 38 -2.549 0.598 9.801 270 HH11 ARG 38 HH11 ARG 38 -4.906 -1.125 7.846 271 HH12 ARG 38 HH12 ARG 38 -5.387 -2.192 9.132 272 HH21 ARG 38 HH21 ARG 38 -3.203 -0.785 11.502 273 HH22 ARG 38 HH22 ARG 38 -4.422 -2.002 11.209 274 H SER 39 HN SER 39 -2.011 3.692 8.633 275 HA SER 39 HA SER 39 -4.806 4.042 8.980 276 HB2 SER 39 HB2 SER 39 -3.812 5.042 11.271 277 HB3 SER 39 HB1 SER 39 -3.877 3.309 10.944 278 HG SER 39 HG SER 39 -1.753 3.252 10.623 279 H ARG 40 HN ARG 40 -2.094 6.199 8.542 280 HA ARG 40 HA ARG 40 -3.520 8.611 8.935 281 HB2 ARG 40 HB2 ARG 40 -0.978 8.009 7.415 282 HB3 ARG 40 HB1 ARG 40 -1.528 9.579 7.930 283 HG2 ARG 40 HG2 ARG 40 -0.981 7.381 9.879 284 HG3 ARG 40 HG1 ARG 40 0.268 8.503 9.338 285 HD2 ARG 40 HD2 ARG 40 -2.335 9.388 10.563 286 HD3 ARG 40 HD1 ARG 40 -0.870 9.097 11.503 287 HE ARG 40 HE ARG 40 0.017 10.817 9.649 288 HH11 ARG 40 HH11 ARG 40 -2.884 10.891 11.618 289 HH12 ARG 40 HH12 ARG 40 -2.878 12.624 11.777 290 HH21 ARG 40 HH21 ARG 40 0.016 13.069 9.826 291 HH22 ARG 40 HH22 ARG 40 -1.217 13.871 10.755 292 H ILE 41 HN ILE 41 -2.799 6.480 6.239 293 HA ILE 41 HA ILE 41 -3.808 8.015 4.116 294 HB ILE 41 HB ILE 41 -3.714 5.020 4.564 295 HG12 ILE 41 HG12 ILE 41 -2.154 6.807 2.695 296 HG13 ILE 41 HG11 ILE 41 -1.569 6.180 4.233 297 HG21 ILE 41 HG21 ILE 41 -4.593 6.433 2.054 298 HG22 ILE 41 HG22 ILE 41 -5.602 5.448 3.111 299 HG23 ILE 41 HG23 ILE 41 -4.284 4.704 2.209 300 HD11 ILE 41 HD11 ILE 41 -2.337 4.535 1.832 301 HD12 ILE 41 HD12 ILE 41 -1.780 3.900 3.380 302 HD13 ILE 41 HD13 ILE 41 -0.697 4.877 2.388 303 H SER 42 HN SER 42 -5.387 5.793 6.412 304 HA SER 42 HA SER 42 -7.980 5.860 5.430 305 HB2 SER 42 HB2 SER 42 -7.172 5.910 8.346 306 HB3 SER 42 HB1 SER 42 -8.705 5.327 7.692 307 HG SER 42 HG SER 42 -7.588 3.679 6.631 308 H GLY 43 HN GLY 43 -6.359 8.214 7.544 309 HA2 GLY 43 HA2 GLY 43 -8.535 10.014 7.772 310 HA3 GLY 43 HA1 GLY 43 -6.837 10.436 7.947 311 H ARG 44 HN ARG 44 -6.043 9.621 5.314 312 HA ARG 44 HA ARG 44 -6.612 11.974 3.856 313 HB2 ARG 44 HB2 ARG 44 -4.784 9.835 3.804 314 HB3 ARG 44 HB1 ARG 44 -5.617 9.805 2.289 315 HG2 ARG 44 HG2 ARG 44 -3.796 11.144 1.840 316 HG3 ARG 44 HG1 ARG 44 -5.053 12.332 2.204 317 HD2 ARG 44 HD2 ARG 44 -4.251 12.560 4.458 318 HD3 ARG 44 HD1 ARG 44 -3.088 11.250 4.210 319 HE ARG 44 HE ARG 44 -2.194 12.859 2.391 320 HH11 ARG 44 HH11 ARG 44 -3.475 13.810 5.518 321 HH12 ARG 44 HH12 ARG 44 -2.533 15.277 5.589 322 HH21 ARG 44 HH21 ARG 44 -0.936 14.762 2.515 323 HH22 ARG 44 HH22 ARG 44 -1.082 15.806 3.893 324 H LEU 45 HN LEU 45 -7.753 8.666 3.828 325 HA LEU 45 HA LEU 45 -9.217 8.739 1.417 326 HB2 LEU 45 HB2 LEU 45 -8.508 6.872 3.317 327 HB3 LEU 45 HB1 LEU 45 -10.234 7.012 3.550 328 HG LEU 45 HG LEU 45 -9.066 6.523 0.833 329 HD11 LEU 45 HD11 LEU 45 -9.841 4.440 2.869 330 HD12 LEU 45 HD12 LEU 45 -8.205 4.778 2.305 331 HD13 LEU 45 HD13 LEU 45 -9.405 4.130 1.189 332 HD21 LEU 45 HD21 LEU 45 -11.759 6.011 2.078 333 HD22 LEU 45 HD22 LEU 45 -11.284 5.441 0.477 334 HD23 LEU 45 HD23 LEU 45 -11.370 7.174 0.811 335 H ASN 46 HN ASN 46 -9.767 9.826 4.606 336 HA ASN 46 HA ASN 46 -12.602 10.029 4.559 337 HB2 ASN 46 HB2 ASN 46 -11.353 9.921 6.683 338 HB3 ASN 46 HB1 ASN 46 -10.574 11.452 6.308 339 HD21 ASN 46 HD21 ASN 46 -11.638 13.343 6.680 340 HD22 ASN 46 HD22 ASN 46 -13.195 13.430 7.445 341 H ARG 47 HN ARG 47 -9.918 12.150 3.767 342 HA ARG 47 HA ARG 47 -11.318 14.476 3.237 343 HB2 ARG 47 HB2 ARG 47 -9.300 15.188 2.614 344 HB3 ARG 47 HB1 ARG 47 -8.736 13.638 3.162 345 HG2 ARG 47 HG2 ARG 47 -8.916 12.784 0.842 346 HG3 ARG 47 HG1 ARG 47 -9.349 14.417 0.320 347 HD2 ARG 47 HD2 ARG 47 -7.241 15.288 0.981 348 HD3 ARG 47 HD1 ARG 47 -6.828 13.812 1.850 349 HE ARG 47 HE ARG 47 -7.221 13.202 -0.863 350 HH11 ARG 47 HH11 ARG 47 -4.983 14.984 1.169 351 HH12 ARG 47 HH12 ARG 47 -3.609 14.678 0.139 352 HH21 ARG 47 HH21 ARG 47 -5.397 12.750 -2.189 353 HH22 ARG 47 HH22 ARG 47 -3.840 13.374 -1.748 354 H PHE 48 HN PHE 48 -11.349 11.463 1.566 355 HA PHE 48 HA PHE 48 -12.764 12.743 -0.646 356 HB2 PHE 48 HB2 PHE 48 -11.335 10.113 -0.481 357 HB3 PHE 48 HB1 PHE 48 -12.514 10.430 -1.744 358 HD1 PHE 48 HD2 PHE 48 -12.113 12.416 -3.280 359 HD2 PHE 48 HD1 PHE 48 -9.123 10.817 -0.704 360 HE1 PHE 48 HE2 PHE 48 -10.368 13.473 -4.653 361 HE2 PHE 48 HE1 PHE 48 -7.374 11.865 -2.082 362 HZ PHE 48 HZ PHE 48 -7.993 13.194 -4.057 363 H LYS 49 HN LYS 49 -12.870 9.764 1.246 364 HA LYS 49 HA LYS 49 -15.650 9.952 1.865 365 HB2 LYS 49 HB2 LYS 49 -14.761 8.324 -0.463 366 HB3 LYS 49 HB1 LYS 49 -15.872 7.550 0.650 367 HG2 LYS 49 HG2 LYS 49 -17.417 9.493 0.309 368 HG3 LYS 49 HG1 LYS 49 -16.330 10.031 -0.978 369 HD2 LYS 49 HD2 LYS 49 -16.648 7.918 -2.153 370 HD3 LYS 49 HD1 LYS 49 -17.685 7.333 -0.852 371 HE2 LYS 49 HE2 LYS 49 -19.233 9.216 -1.317 372 HE3 LYS 49 HE1 LYS 49 -18.231 9.646 -2.702 373 HZ1 LYS 49 HZ1 LYS 49 -19.639 7.049 -2.337 374 HZ2 LYS 49 HZ2 LYS 49 -18.699 7.488 -3.680 375 HZ3 LYS 49 HZ3 LYS 49 -20.136 8.308 -3.356 376 H ARG 50 HN ARG 50 -15.029 9.415 4.029 377 HA ARG 50 HA ARG 50 -13.993 6.662 4.215 378 HB2 ARG 50 HB2 ARG 50 -12.695 8.541 5.393 379 HB3 ARG 50 HB1 ARG 50 -14.032 8.564 6.542 380 HG2 ARG 50 HG2 ARG 50 -13.666 6.204 7.033 381 HG3 ARG 50 HG1 ARG 50 -12.346 6.161 5.869 382 HD2 ARG 50 HD2 ARG 50 -11.325 6.348 7.958 383 HD3 ARG 50 HD1 ARG 50 -11.250 7.969 7.270 384 HE ARG 50 HE ARG 50 -13.452 8.202 8.703 385 HH11 ARG 50 HH11 ARG 50 -10.448 6.612 9.562 386 HH12 ARG 50 HH12 ARG 50 -10.654 6.846 11.270 387 HH21 ARG 50 HH21 ARG 50 -13.728 8.515 10.950 388 HH22 ARG 50 HH22 ARG 50 -12.528 7.921 12.062 389 H TYR 51 HN TYR 51 -15.610 5.396 4.228 390 HA TYR 51 HA TYR 51 -18.126 6.157 5.466 391 HB2 TYR 51 HB2 TYR 51 -17.641 5.236 3.042 392 HB3 TYR 51 HB1 TYR 51 -17.624 3.681 3.852 393 HD1 TYR 51 HD2 TYR 51 -19.956 5.303 5.731 394 HD2 TYR 51 HD1 TYR 51 -19.408 3.898 1.754 395 HE1 TYR 51 HE2 TYR 51 -22.391 5.151 5.448 396 HE2 TYR 51 HE1 TYR 51 -21.832 3.743 1.463 397 HH TYR 51 HH TYR 51 -24.056 5.099 3.682 398 HA PRO 52 HA PRO 52 -16.920 3.612 9.036 399 HB2 PRO 52 HB2 PRO 52 -19.866 3.789 9.466 400 HB3 PRO 52 HB1 PRO 52 -18.545 4.093 10.599 401 HG2 PRO 52 HG2 PRO 52 -19.903 6.112 9.527 402 HG3 PRO 52 HG1 PRO 52 -18.150 6.223 9.773 403 HD2 PRO 52 HD2 PRO 52 -19.688 5.770 7.256 404 HD3 PRO 52 HD1 PRO 52 -18.188 6.682 7.514 405 H LYS 53 HN LYS 53 -16.800 1.437 9.176 406 HA LYS 53 HA LYS 53 -17.758 -0.129 7.040 407 HB2 LYS 53 HB2 LYS 53 -16.067 -0.533 9.366 408 HB3 LYS 53 HB1 LYS 53 -17.080 -1.933 9.058 409 HG2 LYS 53 HG2 LYS 53 -15.185 -2.425 7.842 410 HG3 LYS 53 HG1 LYS 53 -16.229 -1.708 6.617 411 HD2 LYS 53 HD2 LYS 53 -14.189 -0.113 8.150 412 HD3 LYS 53 HD1 LYS 53 -13.807 -0.948 6.646 413 HE2 LYS 53 HE2 LYS 53 -14.978 0.520 5.367 414 HE3 LYS 53 HE1 LYS 53 -16.197 0.800 6.624 415 HZ1 LYS 53 HZ1 LYS 53 -14.963 2.782 6.407 416 HZ2 LYS 53 HZ2 LYS 53 -13.478 1.971 6.430 417 HZ3 LYS 53 HZ3 LYS 53 -14.412 2.062 7.840 418 H ASP 54 HN ASP 54 -19.095 0.564 10.177 419 HA ASP 54 HA ASP 54 -20.890 -1.549 10.454 420 HB2 ASP 54 HB2 ASP 54 -20.602 0.073 12.227 421 HB3 ASP 54 HB1 ASP 54 -21.233 1.359 11.200 422 H ALA 55 HN ALA 55 -21.222 1.457 8.624 423 HA ALA 55 HA ALA 55 -23.866 0.943 7.727 424 HB1 ALA 55 HB1 ALA 55 -23.490 2.771 6.165 425 HB2 ALA 55 HB2 ALA 55 -21.763 2.736 6.525 426 HB3 ALA 55 HB3 ALA 55 -22.918 3.197 7.778 427 H LEU 56 HN LEU 56 -20.692 0.107 6.585 428 HA LEU 56 HA LEU 56 -21.552 -0.854 4.032 429 HB2 LEU 56 HB2 LEU 56 -19.001 -1.185 5.612 430 HB3 LEU 56 HB1 LEU 56 -19.264 -2.031 4.098 431 HG LEU 56 HG LEU 56 -17.952 -0.115 3.620 432 HD11 LEU 56 HD11 LEU 56 -19.751 -0.612 2.023 433 HD12 LEU 56 HD12 LEU 56 -19.306 1.096 2.048 434 HD13 LEU 56 HD13 LEU 56 -20.783 0.557 2.852 435 HD21 LEU 56 HD21 LEU 56 -20.026 1.477 5.108 436 HD22 LEU 56 HD22 LEU 56 -18.691 2.162 4.178 437 HD23 LEU 56 HD23 LEU 56 -18.360 1.178 5.604 438 H ARG 57 HN ARG 57 -21.148 -2.245 7.231 439 HA ARG 57 HA ARG 57 -21.279 -4.951 6.525 440 HB2 ARG 57 HB2 ARG 57 -22.138 -3.558 9.058 441 HB3 ARG 57 HB1 ARG 57 -22.095 -5.305 8.875 442 HG2 ARG 57 HG2 ARG 57 -19.666 -5.094 8.320 443 HG3 ARG 57 HG1 ARG 57 -19.782 -3.394 8.765 444 HD2 ARG 57 HD2 ARG 57 -20.406 -5.733 10.564 445 HD3 ARG 57 HD1 ARG 57 -18.935 -4.764 10.609 446 HE ARG 57 HE ARG 57 -21.554 -3.504 11.059 447 HH11 ARG 57 HH11 ARG 57 -18.342 -4.341 12.190 448 HH12 ARG 57 HH12 ARG 57 -18.457 -3.341 13.612 449 HH21 ARG 57 HH21 ARG 57 -21.674 -2.155 12.903 450 HH22 ARG 57 HH22 ARG 57 -20.329 -2.111 14.008 451 H LEU 58 HN LEU 58 -23.706 -2.538 6.562 452 HA LEU 58 HA LEU 58 -25.790 -4.581 6.237 453 HB2 LEU 58 HB2 LEU 58 -25.917 -1.688 7.036 454 HB3 LEU 58 HB1 LEU 58 -27.333 -2.515 6.418 455 HG LEU 58 HG LEU 58 -27.091 -4.179 8.279 456 HD11 LEU 58 HD11 LEU 58 -25.072 -2.200 9.328 457 HD12 LEU 58 HD12 LEU 58 -24.718 -3.834 8.772 458 HD13 LEU 58 HD13 LEU 58 -25.719 -3.590 10.203 459 HD21 LEU 58 HD21 LEU 58 -27.440 -1.287 9.049 460 HD22 LEU 58 HD22 LEU 58 -27.979 -2.674 9.996 461 HD23 LEU 58 HD23 LEU 58 -28.687 -2.359 8.412 462 H LYS 59 HN LYS 59 -23.703 -3.365 4.286 463 HA LYS 59 HA LYS 59 -25.553 -3.288 2.067 464 HB2 LYS 59 HB2 LYS 59 -25.504 -0.937 2.660 465 HB3 LYS 59 HB1 LYS 59 -23.748 -0.933 2.664 466 HG2 LYS 59 HG2 LYS 59 -23.645 -1.161 0.316 467 HG3 LYS 59 HG1 LYS 59 -25.354 -1.572 0.211 468 HD2 LYS 59 HD2 LYS 59 -24.953 0.718 -0.533 469 HD3 LYS 59 HD1 LYS 59 -25.950 0.688 0.921 470 HE2 LYS 59 HE2 LYS 59 -24.000 1.234 2.282 471 HE3 LYS 59 HE1 LYS 59 -22.978 1.218 0.844 472 HZ1 LYS 59 HZ1 LYS 59 -23.721 3.468 1.593 473 HZ2 LYS 59 HZ2 LYS 59 -25.303 3.032 1.167 474 HZ3 LYS 59 HZ3 LYS 59 -24.098 3.102 -0.022 475 H ARG 60 HN ARG 60 -22.181 -2.121 2.194 476 HA ARG 60 HA ARG 60 -21.521 -4.370 0.420 477 HB2 ARG 60 HB2 ARG 60 -20.614 -1.496 0.166 478 HB3 ARG 60 HB1 ARG 60 -19.989 -2.830 -0.794 479 HG2 ARG 60 HG2 ARG 60 -22.855 -1.910 -0.745 480 HG3 ARG 60 HG1 ARG 60 -21.677 -1.546 -2.008 481 HD2 ARG 60 HD2 ARG 60 -21.547 -3.800 -2.676 482 HD3 ARG 60 HD1 ARG 60 -22.365 -4.359 -1.218 483 HE ARG 60 HE ARG 60 -23.701 -2.851 -3.388 484 HH11 ARG 60 HH11 ARG 60 -23.725 -5.272 -0.856 485 HH12 ARG 60 HH12 ARG 60 -25.342 -5.806 -1.186 486 HH21 ARG 60 HH21 ARG 60 -25.842 -3.542 -3.824 487 HH22 ARG 60 HH22 ARG 60 -26.548 -4.819 -2.874 488 H GLN 61 HN GLN 61 -20.678 -5.495 2.234 489 HA GLN 61 HA GLN 61 -18.050 -4.469 3.024 490 HB2 GLN 61 HB2 GLN 61 -18.431 -6.604 4.686 491 HB3 GLN 61 HB1 GLN 61 -18.675 -4.924 5.113 492 HG2 GLN 61 HG2 GLN 61 -20.558 -6.078 5.880 493 HG3 GLN 61 HG1 GLN 61 -21.067 -5.205 4.443 494 HE21 GLN 61 HE21 GLN 61 -21.972 -6.300 2.817 495 HE22 GLN 61 HE22 GLN 61 -22.140 -8.017 2.754 496 H GLY 62 HN GLY 62 -16.508 -5.247 1.886 497 HA2 GLY 62 HA2 GLY 62 -16.313 -8.141 1.540 498 HA3 GLY 62 HA1 GLY 62 -16.201 -7.136 0.100 499 H VAL 63 HN VAL 63 -14.249 -8.903 1.655 500 HA VAL 63 HA VAL 63 -12.169 -6.893 2.139 501 HB VAL 63 HB VAL 63 -12.512 -8.434 3.999 502 HG11 VAL 63 HG11 VAL 63 -11.813 -10.627 2.053 503 HG12 VAL 63 HG12 VAL 63 -13.393 -10.345 2.781 504 HG13 VAL 63 HG13 VAL 63 -12.029 -10.821 3.793 505 HG21 VAL 63 HG21 VAL 63 -10.268 -7.598 3.645 506 HG22 VAL 63 HG22 VAL 63 -9.923 -8.925 2.536 507 HG23 VAL 63 HG23 VAL 63 -10.202 -9.256 4.246 508 H GLY 64 HN GLY 64 -10.306 -6.869 0.975 509 HA2 GLY 64 HA2 GLY 64 -9.609 -8.929 -0.885 510 HA3 GLY 64 HA1 GLY 64 -10.394 -7.566 -1.677 511 H GLN 65 HN GLN 65 -7.851 -8.161 -2.397 512 HA GLN 65 HA GLN 65 -6.175 -6.261 -0.922 513 HB2 GLN 65 HB2 GLN 65 -5.485 -8.257 -3.085 514 HB3 GLN 65 HB1 GLN 65 -4.330 -7.155 -2.347 515 HG2 GLN 65 HG2 GLN 65 -4.772 -8.199 -0.161 516 HG3 GLN 65 HG1 GLN 65 -5.859 -9.340 -0.952 517 HE21 GLN 65 HE21 GLN 65 -2.542 -8.383 -0.471 518 HE22 GLN 65 HE22 GLN 65 -1.831 -9.820 -1.131 519 H VAL 66 HN VAL 66 -5.347 -4.438 -1.898 520 HA VAL 66 HA VAL 66 -6.457 -3.769 -4.539 521 HB VAL 66 HB VAL 66 -6.602 -2.169 -1.980 522 HG11 VAL 66 HG11 VAL 66 -5.925 -0.669 -3.807 523 HG12 VAL 66 HG12 VAL 66 -7.546 -0.334 -3.188 524 HG13 VAL 66 HG13 VAL 66 -7.344 -1.189 -4.724 525 HG21 VAL 66 HG21 VAL 66 -8.709 -3.126 -3.906 526 HG22 VAL 66 HG22 VAL 66 -9.004 -2.146 -2.469 527 HG23 VAL 66 HG23 VAL 66 -8.375 -3.787 -2.304 528 H ARG 67 HN ARG 67 -4.815 -3.284 -5.891 529 HA ARG 67 HA ARG 67 -2.333 -2.282 -4.641 530 HB2 ARG 67 HB2 ARG 67 -2.142 -4.553 -5.672 531 HB3 ARG 67 HB1 ARG 67 -2.596 -3.846 -7.217 532 HG2 ARG 67 HG2 ARG 67 -0.606 -2.267 -6.862 533 HG3 ARG 67 HG1 ARG 67 -0.092 -3.425 -5.637 534 HD2 ARG 67 HD2 ARG 67 -0.644 -4.070 -8.526 535 HD3 ARG 67 HD1 ARG 67 0.954 -3.809 -7.834 536 HE ARG 67 HE ARG 67 -0.496 -5.860 -6.468 537 HH11 ARG 67 HH11 ARG 67 1.537 -5.121 -9.213 538 HH12 ARG 67 HH12 ARG 67 2.014 -6.772 -9.475 539 HH21 ARG 67 HH21 ARG 67 0.146 -8.047 -6.781 540 HH22 ARG 67 HH22 ARG 67 1.220 -8.439 -8.096 541 H PHE 68 HN PHE 68 -1.300 -0.541 -5.559 542 HA PHE 68 HA PHE 68 -2.264 0.658 -7.975 543 HB2 PHE 68 HB2 PHE 68 -2.737 2.857 -6.567 544 HB3 PHE 68 HB1 PHE 68 -3.995 1.667 -6.863 545 HD1 PHE 68 HD2 PHE 68 -1.213 1.936 -4.369 546 HD2 PHE 68 HD1 PHE 68 -5.383 1.465 -5.072 547 HE1 PHE 68 HE2 PHE 68 -1.595 1.724 -1.947 548 HE2 PHE 68 HE1 PHE 68 -5.771 1.256 -2.653 549 HZ PHE 68 HZ PHE 68 -3.878 1.386 -1.089 550 H THR 69 HN THR 69 -1.024 2.405 -8.679 551 HA THR 69 HA THR 69 1.539 2.826 -7.299 552 HB THR 69 HB THR 69 0.654 3.764 -10.042 553 HG1 THR 69 HG1 THR 69 1.446 1.335 -9.171 554 HG21 THR 69 HG21 THR 69 3.059 4.140 -10.400 555 HG22 THR 69 HG22 THR 69 3.376 3.672 -8.730 556 HG23 THR 69 HG23 THR 69 2.436 5.123 -9.076 557 H LEU 70 HN LEU 70 1.847 4.632 -6.165 558 HA LEU 70 HA LEU 70 -0.343 6.592 -6.238 559 HB2 LEU 70 HB2 LEU 70 1.390 5.770 -3.914 560 HB3 LEU 70 HB1 LEU 70 0.081 6.938 -3.856 561 HG LEU 70 HG LEU 70 -0.268 4.024 -4.550 562 HD11 LEU 70 HD11 LEU 70 -0.851 5.475 -1.973 563 HD12 LEU 70 HD12 LEU 70 0.458 4.321 -2.232 564 HD13 LEU 70 HD13 LEU 70 -1.222 3.787 -2.326 565 HD21 LEU 70 HD21 LEU 70 -2.269 6.196 -3.938 566 HD22 LEU 70 HD22 LEU 70 -2.638 4.505 -4.280 567 HD23 LEU 70 HD23 LEU 70 -1.931 5.526 -5.535 568 H ASP 71 HN ASP 71 0.068 8.745 -6.012 569 HA ASP 71 HA ASP 71 2.777 9.623 -6.618 570 HB2 ASP 71 HB2 ASP 71 0.850 10.514 -7.931 571 HB3 ASP 71 HB1 ASP 71 0.208 11.223 -6.448 572 H ARG 72 HN ARG 72 3.478 11.698 -5.432 573 HA ARG 72 HA ARG 72 3.971 11.010 -2.800 574 HB2 ARG 72 HB2 ARG 72 4.919 13.243 -2.537 575 HB3 ARG 72 HB1 ARG 72 5.362 12.562 -4.094 576 HG2 ARG 72 HG2 ARG 72 3.350 13.881 -5.005 577 HG3 ARG 72 HG1 ARG 72 3.444 14.775 -3.486 578 HD2 ARG 72 HD2 ARG 72 5.642 14.464 -5.523 579 HD3 ARG 72 HD1 ARG 72 4.682 15.913 -5.240 580 HE ARG 72 HE ARG 72 5.790 15.469 -2.821 581 HH11 ARG 72 HH11 ARG 72 7.105 15.630 -6.064 582 HH12 ARG 72 HH12 ARG 72 8.661 16.200 -5.546 583 HH21 ARG 72 HH21 ARG 72 7.851 16.216 -2.122 584 HH22 ARG 72 HH22 ARG 72 9.081 16.565 -3.310 585 H GLN 73 HN GLN 73 1.421 13.117 -4.070 586 HA GLN 73 HA GLN 73 0.556 13.822 -1.379 587 HB2 GLN 73 HB2 GLN 73 -1.027 15.305 -2.473 588 HB3 GLN 73 HB1 GLN 73 0.583 15.546 -3.138 589 HG2 GLN 73 HG2 GLN 73 0.019 14.309 -5.110 590 HG3 GLN 73 HG1 GLN 73 -1.541 13.849 -4.429 591 HE21 GLN 73 HE21 GLN 73 -3.186 15.383 -4.301 592 HE22 GLN 73 HE22 GLN 73 -3.137 16.859 -5.205 593 H GLY 74 HN GLY 74 0.260 11.116 -2.948 594 HA2 GLY 74 HA2 GLY 74 -1.254 9.382 -2.790 595 HA3 GLY 74 HA1 GLY 74 -2.301 10.435 -1.866 596 H HIS 75 HN HIS 75 -1.010 10.815 -5.102 597 HA HIS 75 HA HIS 75 -3.752 10.976 -6.111 598 HB2 HIS 75 HB2 HIS 75 -2.323 12.853 -6.726 599 HB3 HIS 75 HB1 HIS 75 -1.100 11.757 -7.356 600 HD1 HIS 75 HD1 HIS 75 -4.550 13.072 -8.136 601 HD2 HIS 75 HD2 HIS 75 -1.462 10.971 -9.965 602 HE1 HIS 75 HE1 HIS 75 -5.157 12.956 -10.574 603 HE2 HIS 75 HE2 HIS 75 -3.380 11.501 -11.621 604 H VAL 76 HN VAL 76 -4.387 8.872 -6.328 605 HA VAL 76 HA VAL 76 -2.983 6.681 -7.100 606 HB VAL 76 HB VAL 76 -5.307 6.545 -6.434 607 HG11 VAL 76 HG11 VAL 76 -7.145 7.127 -7.926 608 HG12 VAL 76 HG12 VAL 76 -5.993 7.766 -9.100 609 HG13 VAL 76 HG13 VAL 76 -6.169 8.541 -7.525 610 HG21 VAL 76 HG21 VAL 76 -6.105 4.890 -8.043 611 HG22 VAL 76 HG22 VAL 76 -4.390 4.684 -7.691 612 HG23 VAL 76 HG23 VAL 76 -4.892 5.439 -9.202 613 H LEU 77 HN LEU 77 -1.683 6.312 -8.705 614 HA LEU 77 HA LEU 77 -2.000 7.731 -11.246 615 HB2 LEU 77 HB2 LEU 77 0.297 6.046 -10.236 616 HB3 LEU 77 HB1 LEU 77 0.301 7.049 -11.674 617 HG LEU 77 HG LEU 77 -0.155 8.258 -8.965 618 HD11 LEU 77 HD11 LEU 77 2.523 7.814 -10.275 619 HD12 LEU 77 HD12 LEU 77 1.921 6.947 -8.859 620 HD13 LEU 77 HD13 LEU 77 2.214 8.686 -8.770 621 HD21 LEU 77 HD21 LEU 77 0.762 10.241 -10.065 622 HD22 LEU 77 HD22 LEU 77 -0.657 9.627 -10.914 623 HD23 LEU 77 HD23 LEU 77 0.959 9.324 -11.557 624 H ALA 78 HN ALA 78 -1.892 4.544 -9.823 625 HA ALA 78 HA ALA 78 -2.873 3.405 -12.342 626 HB1 ALA 78 HB1 ALA 78 -1.447 1.453 -12.075 627 HB2 ALA 78 HB2 ALA 78 -0.732 2.154 -10.621 628 HB3 ALA 78 HB3 ALA 78 -0.470 2.916 -12.193 629 H VAL 79 HN VAL 79 -4.373 1.771 -12.081 630 HA VAL 79 HA VAL 79 -5.082 1.101 -9.310 631 HB VAL 79 HB VAL 79 -7.425 0.731 -10.179 632 HG11 VAL 79 HG11 VAL 79 -8.033 3.093 -10.099 633 HG12 VAL 79 HG12 VAL 79 -6.344 3.541 -10.343 634 HG13 VAL 79 HG13 VAL 79 -6.831 2.700 -8.871 635 HG21 VAL 79 HG21 VAL 79 -8.077 1.886 -12.235 636 HG22 VAL 79 HG22 VAL 79 -6.910 0.604 -12.560 637 HG23 VAL 79 HG23 VAL 79 -6.388 2.289 -12.544 638 H THR 80 HN THR 80 -5.059 -0.986 -8.809 639 HA THR 80 HA THR 80 -5.186 -2.936 -10.997 640 HB THR 80 HB THR 80 -3.242 -2.951 -8.686 641 HG1 THR 80 HG1 THR 80 -3.084 -1.963 -11.132 642 HG21 THR 80 HG21 THR 80 -2.403 -5.063 -9.620 643 HG22 THR 80 HG22 THR 80 -3.718 -5.059 -10.795 644 HG23 THR 80 HG23 THR 80 -4.073 -5.214 -9.075 645 H LEU 81 HN LEU 81 -6.773 -4.279 -10.719 646 HA LEU 81 HA LEU 81 -8.105 -4.622 -8.199 647 HB2 LEU 81 HB2 LEU 81 -9.416 -4.655 -10.255 648 HB3 LEU 81 HB1 LEU 81 -8.500 -6.036 -10.835 649 HG LEU 81 HG LEU 81 -9.329 -7.287 -8.794 650 HD11 LEU 81 HD11 LEU 81 -10.016 -5.391 -7.461 651 HD12 LEU 81 HD12 LEU 81 -11.394 -6.448 -7.765 652 HD13 LEU 81 HD13 LEU 81 -11.219 -4.943 -8.668 653 HD21 LEU 81 HD21 LEU 81 -11.370 -6.372 -10.824 654 HD22 LEU 81 HD22 LEU 81 -11.486 -7.821 -9.824 655 HD23 LEU 81 HD23 LEU 81 -10.213 -7.685 -11.039 656 H VAL 82 HN VAL 82 -7.379 -5.878 -6.716 657 HA VAL 82 HA VAL 82 -5.857 -8.310 -7.421 658 HB VAL 82 HB VAL 82 -5.549 -6.997 -4.780 659 HG11 VAL 82 HG11 VAL 82 -4.220 -8.917 -5.058 660 HG12 VAL 82 HG12 VAL 82 -3.114 -7.549 -5.285 661 HG13 VAL 82 HG13 VAL 82 -3.731 -8.436 -6.684 662 HG21 VAL 82 HG21 VAL 82 -3.995 -5.340 -5.586 663 HG22 VAL 82 HG22 VAL 82 -5.567 -5.124 -6.364 664 HG23 VAL 82 HG23 VAL 82 -4.243 -5.883 -7.247 665 H SER 83 HN SER 83 -8.285 -6.770 -5.580 666 HA SER 83 HA SER 83 -9.011 -8.468 -3.593 667 HB2 SER 83 HB2 SER 83 -10.017 -6.225 -4.271 668 HB3 SER 83 HB1 SER 83 -11.020 -7.126 -5.408 669 HG SER 83 HG SER 83 -12.223 -7.021 -3.609 670 H SER 84 HN SER 84 -9.615 -10.513 -3.491 671 HA SER 84 HA SER 84 -10.791 -11.834 -5.814 672 HB2 SER 84 HB2 SER 84 -8.167 -12.563 -4.526 673 HB3 SER 84 HB1 SER 84 -9.010 -13.595 -5.686 674 HG SER 84 HG SER 84 -7.706 -11.129 -6.072 675 H ALA 85 HN ALA 85 -12.027 -11.292 -3.362 676 HA ALA 85 HA ALA 85 -12.130 -13.972 -2.140 677 HB1 ALA 85 HB1 ALA 85 -11.456 -12.234 -0.558 678 HB2 ALA 85 HB2 ALA 85 -13.027 -12.913 -0.131 679 HB3 ALA 85 HB3 ALA 85 -12.930 -11.335 -0.912 680 H GLY 86 HN GLY 86 -13.527 -12.558 -4.511 681 HA2 GLY 86 HA2 GLY 86 -15.561 -13.014 -5.532 682 HA3 GLY 86 HA1 GLY 86 -16.101 -13.773 -4.039 683 H LEU 87 HN LEU 87 -15.137 -10.505 -5.128 684 HA LEU 87 HA LEU 87 -17.441 -9.495 -3.574 685 HB2 LEU 87 HB2 LEU 87 -15.072 -7.873 -4.479 686 HB3 LEU 87 HB1 LEU 87 -16.321 -7.382 -3.371 687 HG LEU 87 HG LEU 87 -14.470 -7.754 -2.012 688 HD11 LEU 87 HD11 LEU 87 -16.043 -10.311 -1.968 689 HD12 LEU 87 HD12 LEU 87 -16.410 -8.826 -1.088 690 HD13 LEU 87 HD13 LEU 87 -14.962 -9.752 -0.692 691 HD21 LEU 87 HD21 LEU 87 -13.067 -8.847 -3.699 692 HD22 LEU 87 HD22 LEU 87 -13.940 -10.357 -3.424 693 HD23 LEU 87 HD23 LEU 87 -12.981 -9.643 -2.128 694 HA PRO 88 HA PRO 88 -18.523 -8.746 -7.980 695 HB2 PRO 88 HB2 PRO 88 -21.249 -9.422 -7.295 696 HB3 PRO 88 HB1 PRO 88 -20.129 -10.293 -8.342 697 HG2 PRO 88 HG2 PRO 88 -20.993 -11.245 -5.929 698 HG3 PRO 88 HG1 PRO 88 -19.441 -11.686 -6.664 699 HD2 PRO 88 HD2 PRO 88 -20.014 -9.675 -4.512 700 HD3 PRO 88 HD1 PRO 88 -18.683 -10.848 -4.632 701 H SER 89 HN SER 89 -21.356 -8.177 -5.924 702 HA SER 89 HA SER 89 -21.795 -5.564 -6.948 703 HB2 SER 89 HB2 SER 89 -23.466 -5.447 -5.031 704 HB3 SER 89 HB1 SER 89 -23.692 -6.789 -6.156 705 HG SER 89 HG SER 89 -23.122 -8.178 -4.652 706 H LEU 90 HN LEU 90 -19.764 -6.798 -4.536 707 HA LEU 90 HA LEU 90 -19.808 -4.560 -2.762 708 HB2 LEU 90 HB2 LEU 90 -17.726 -6.746 -2.982 709 HB3 LEU 90 HB1 LEU 90 -17.987 -5.669 -1.621 710 HG LEU 90 HG LEU 90 -20.066 -7.625 -2.583 711 HD11 LEU 90 HD11 LEU 90 -18.146 -7.976 -0.299 712 HD12 LEU 90 HD12 LEU 90 -17.939 -8.717 -1.888 713 HD13 LEU 90 HD13 LEU 90 -19.342 -9.132 -0.893 714 HD21 LEU 90 HD21 LEU 90 -19.722 -6.103 -0.003 715 HD22 LEU 90 HD22 LEU 90 -21.003 -7.264 -0.357 716 HD23 LEU 90 HD23 LEU 90 -20.905 -5.755 -1.265 717 H ASP 91 HN ASP 91 -17.776 -5.590 -5.443 718 HA ASP 91 HA ASP 91 -15.512 -4.058 -5.006 719 HB2 ASP 91 HB2 ASP 91 -15.493 -5.739 -6.706 720 HB3 ASP 91 HB1 ASP 91 -16.804 -4.963 -7.583 721 H ARG 92 HN ARG 92 -18.400 -3.157 -6.861 722 HA ARG 92 HA ARG 92 -17.462 -0.781 -7.921 723 HB2 ARG 92 HB2 ARG 92 -19.885 -0.157 -8.111 724 HB3 ARG 92 HB1 ARG 92 -19.458 -1.728 -8.778 725 HG2 ARG 92 HG2 ARG 92 -20.166 -2.560 -6.384 726 HG3 ARG 92 HG1 ARG 92 -21.092 -1.054 -6.391 727 HD2 ARG 92 HD2 ARG 92 -22.402 -2.952 -7.233 728 HD3 ARG 92 HD1 ARG 92 -22.176 -1.699 -8.450 729 HE ARG 92 HE ARG 92 -20.216 -3.814 -8.546 730 HH11 ARG 92 HH11 ARG 92 -23.340 -2.740 -9.708 731 HH12 ARG 92 HH12 ARG 92 -23.295 -3.744 -11.125 732 HH21 ARG 92 HH21 ARG 92 -20.130 -5.105 -10.406 733 HH22 ARG 92 HH22 ARG 92 -21.462 -5.082 -11.529 734 H GLU 93 HN GLU 93 -19.168 -1.246 -4.827 735 HA GLU 93 HA GLU 93 -19.110 1.558 -4.222 736 HB2 GLU 93 HB2 GLU 93 -20.885 0.112 -3.358 737 HB3 GLU 93 HB1 GLU 93 -19.699 -0.818 -2.453 738 HG2 GLU 93 HG2 GLU 93 -20.746 0.621 -0.913 739 HG3 GLU 93 HG1 GLU 93 -19.146 1.293 -1.210 740 H ILE 94 HN ILE 94 -17.370 -1.286 -2.947 741 HA ILE 94 HA ILE 94 -15.957 0.264 -1.028 742 HB ILE 94 HB ILE 94 -14.656 -1.734 -0.533 743 HG12 ILE 94 HG12 ILE 94 -16.118 -3.066 -2.823 744 HG13 ILE 94 HG11 ILE 94 -14.446 -2.528 -2.905 745 HG21 ILE 94 HG21 ILE 94 -17.583 -2.316 -0.948 746 HG22 ILE 94 HG22 ILE 94 -16.868 -1.503 0.445 747 HG23 ILE 94 HG23 ILE 94 -16.501 -3.198 0.127 748 HD11 ILE 94 HD11 ILE 94 -15.546 -4.614 -1.033 749 HD12 ILE 94 HD12 ILE 94 -13.869 -4.073 -1.103 750 HD13 ILE 94 HD13 ILE 94 -14.583 -4.913 -2.481 751 H GLN 95 HN GLN 95 -15.169 -0.802 -4.309 752 HA GLN 95 HA GLN 95 -12.448 0.059 -4.022 753 HB2 GLN 95 HB2 GLN 95 -13.919 -0.601 -6.554 754 HB3 GLN 95 HB1 GLN 95 -12.210 -0.460 -6.346 755 HG2 GLN 95 HG2 GLN 95 -13.821 -2.517 -4.889 756 HG3 GLN 95 HG1 GLN 95 -13.118 -2.807 -6.479 757 HE21 GLN 95 HE21 GLN 95 -12.525 -2.438 -3.112 758 HE22 GLN 95 HE22 GLN 95 -10.873 -2.928 -3.136 759 H ALA 96 HN ALA 96 -15.458 1.374 -5.311 760 HA ALA 96 HA ALA 96 -14.416 3.700 -6.447 761 HB1 ALA 96 HB1 ALA 96 -16.933 3.465 -4.792 762 HB2 ALA 96 HB2 ALA 96 -16.811 3.165 -6.525 763 HB3 ALA 96 HB3 ALA 96 -16.537 4.786 -5.889 764 H LEU 97 HN LEU 97 -15.183 2.900 -3.117 765 HA LEU 97 HA LEU 97 -14.600 5.262 -1.849 766 HB2 LEU 97 HB2 LEU 97 -15.798 3.209 -1.047 767 HB3 LEU 97 HB1 LEU 97 -14.226 2.449 -0.856 768 HG LEU 97 HG LEU 97 -14.103 4.904 0.398 769 HD11 LEU 97 HD11 LEU 97 -15.903 4.677 2.092 770 HD12 LEU 97 HD12 LEU 97 -16.577 3.352 1.138 771 HD13 LEU 97 HD13 LEU 97 -16.518 4.984 0.467 772 HD21 LEU 97 HD21 LEU 97 -13.888 3.452 2.452 773 HD22 LEU 97 HD22 LEU 97 -12.785 3.091 1.123 774 HD23 LEU 97 HD23 LEU 97 -14.210 2.080 1.389 775 H VAL 98 HN VAL 98 -12.569 2.345 -2.011 776 HA VAL 98 HA VAL 98 -10.246 3.849 -1.139 777 HB VAL 98 HB VAL 98 -10.631 0.903 -1.653 778 HG11 VAL 98 HG11 VAL 98 -8.222 2.322 -0.517 779 HG12 VAL 98 HG12 VAL 98 -8.306 1.548 -2.099 780 HG13 VAL 98 HG13 VAL 98 -8.438 0.575 -0.633 781 HG21 VAL 98 HG21 VAL 98 -10.632 0.679 0.720 782 HG22 VAL 98 HG22 VAL 98 -11.781 1.958 0.311 783 HG23 VAL 98 HG23 VAL 98 -10.184 2.370 0.936 784 H LYS 99 HN LYS 99 -11.103 1.905 -4.002 785 HA LYS 99 HA LYS 99 -8.526 2.052 -5.162 786 HB2 LYS 99 HB2 LYS 99 -10.058 0.232 -5.722 787 HB3 LYS 99 HB1 LYS 99 -11.197 1.357 -6.447 788 HG2 LYS 99 HG2 LYS 99 -9.318 1.953 -8.067 789 HG3 LYS 99 HG1 LYS 99 -8.483 0.528 -7.443 790 HD2 LYS 99 HD2 LYS 99 -11.247 0.514 -8.661 791 HD3 LYS 99 HD1 LYS 99 -9.766 0.074 -9.513 792 HE2 LYS 99 HE2 LYS 99 -9.390 -1.763 -7.986 793 HE3 LYS 99 HE1 LYS 99 -10.791 -1.292 -7.027 794 HZ1 LYS 99 HZ1 LYS 99 -11.419 -3.092 -8.426 795 HZ2 LYS 99 HZ2 LYS 99 -10.792 -2.336 -9.810 796 HZ3 LYS 99 HZ3 LYS 99 -12.167 -1.700 -9.043 797 H ARG 100 HN ARG 100 -11.329 4.190 -5.339 798 HA ARG 100 HA ARG 100 -10.036 5.710 -7.470 799 HB2 ARG 100 HB2 ARG 100 -12.463 5.464 -7.567 800 HB3 ARG 100 HB1 ARG 100 -12.623 6.219 -5.989 801 HG2 ARG 100 HG2 ARG 100 -13.187 7.782 -7.750 802 HG3 ARG 100 HG1 ARG 100 -11.736 8.307 -6.894 803 HD2 ARG 100 HD2 ARG 100 -10.373 7.286 -8.711 804 HD3 ARG 100 HD1 ARG 100 -11.869 6.950 -9.584 805 HE ARG 100 HE ARG 100 -12.068 9.585 -9.147 806 HH11 ARG 100 HH11 ARG 100 -9.474 7.626 -10.452 807 HH12 ARG 100 HH12 ARG 100 -8.787 8.931 -11.380 808 HH21 ARG 100 HH21 ARG 100 -11.191 11.284 -10.388 809 HH22 ARG 100 HH22 ARG 100 -9.770 11.005 -11.349 810 H ALA 101 HN ALA 101 -10.524 5.827 -4.020 811 HA ALA 101 HA ALA 101 -9.110 8.403 -3.916 812 HB1 ALA 101 HB1 ALA 101 -10.038 8.764 -1.754 813 HB2 ALA 101 HB2 ALA 101 -10.639 7.106 -1.665 814 HB3 ALA 101 HB3 ALA 101 -11.357 8.245 -2.808 815 H SER 102 HN SER 102 -7.217 6.881 -4.457 816 HA SER 102 HA SER 102 -6.193 5.554 -2.076 817 HB2 SER 102 HB2 SER 102 -4.907 5.629 -4.795 818 HB3 SER 102 HB1 SER 102 -4.606 4.487 -3.490 819 HG SER 102 HG SER 102 -7.161 4.312 -3.943 820 HA PRO 103 HA PRO 103 -3.860 9.370 -1.617 821 HB2 PRO 103 HB2 PRO 103 -4.536 9.651 1.018 822 HB3 PRO 103 HB1 PRO 103 -5.589 10.117 -0.331 823 HG2 PRO 103 HG2 PRO 103 -5.979 8.001 1.585 824 HG3 PRO 103 HG1 PRO 103 -7.053 8.497 0.267 825 HD2 PRO 103 HD2 PRO 103 -5.048 6.309 0.350 826 HD3 PRO 103 HD1 PRO 103 -6.527 6.456 -0.627 827 H LEU 104 HN LEU 104 -2.191 10.137 -0.171 828 HA LEU 104 HA LEU 104 -0.898 8.244 1.594 829 HB2 LEU 104 HB2 LEU 104 0.362 9.383 -0.883 830 HB3 LEU 104 HB1 LEU 104 1.350 9.059 0.528 831 HG LEU 104 HG LEU 104 -0.308 6.999 -0.938 832 HD11 LEU 104 HD11 LEU 104 1.606 7.713 -2.265 833 HD12 LEU 104 HD12 LEU 104 1.860 6.084 -1.638 834 HD13 LEU 104 HD13 LEU 104 2.675 7.456 -0.888 835 HD21 LEU 104 HD21 LEU 104 -0.082 6.514 1.446 836 HD22 LEU 104 HD22 LEU 104 1.665 6.702 1.323 837 HD23 LEU 104 HD23 LEU 104 0.860 5.385 0.474 838 HA PRO 105 HA PRO 105 -0.527 12.222 3.633 839 HB2 PRO 105 HB2 PRO 105 0.242 11.004 6.034 840 HB3 PRO 105 HB1 PRO 105 -1.391 11.486 5.580 841 HG2 PRO 105 HG2 PRO 105 -0.382 8.849 5.912 842 HG3 PRO 105 HG1 PRO 105 -1.991 9.334 5.374 843 HD2 PRO 105 HD2 PRO 105 0.274 8.342 3.806 844 HD3 PRO 105 HD1 PRO 105 -1.454 8.411 3.390 845 H THR 106 HN THR 106 1.745 9.593 4.301 846 HA THR 106 HA THR 106 3.955 11.458 4.547 847 HB THR 106 HB THR 106 4.010 8.438 4.698 848 HG1 THR 106 HG1 THR 106 3.594 8.635 6.848 849 HG21 THR 106 HG21 THR 106 6.065 8.799 5.981 850 HG22 THR 106 HG22 THR 106 5.904 10.539 5.751 851 HG23 THR 106 HG23 THR 106 6.195 9.489 4.364 852 HA PRO 107 HA PRO 107 4.622 10.961 0.114 853 HB2 PRO 107 HB2 PRO 107 7.005 12.602 0.712 854 HB3 PRO 107 HB1 PRO 107 5.694 12.902 -0.430 855 HG2 PRO 107 HG2 PRO 107 5.910 14.314 1.829 856 HG3 PRO 107 HG1 PRO 107 4.326 13.843 1.181 857 HD2 PRO 107 HD2 PRO 107 5.889 12.630 3.434 858 HD3 PRO 107 HD1 PRO 107 4.144 12.954 3.317 859 HA PRO 108 HA PRO 108 7.594 7.730 1.078 860 HB2 PRO 108 HB2 PRO 108 6.819 5.972 -0.769 861 HB3 PRO 108 HB1 PRO 108 5.813 6.312 0.646 862 HG2 PRO 108 HG2 PRO 108 5.547 7.325 -2.156 863 HG3 PRO 108 HG1 PRO 108 4.285 6.772 -1.044 864 HD2 PRO 108 HD2 PRO 108 4.925 9.420 -1.491 865 HD3 PRO 108 HD1 PRO 108 4.132 8.812 -0.024 866 H ALA 109 HN ALA 109 8.661 9.900 -0.283 867 HA ALA 109 HA ALA 109 9.725 9.296 -2.815 868 HB1 ALA 109 HB1 ALA 109 10.950 10.965 -0.615 869 HB2 ALA 109 HB2 ALA 109 9.829 11.541 -1.850 870 HB3 ALA 109 HB3 ALA 109 11.433 10.974 -2.312 871 H ASP 110 HN ASP 110 10.740 8.521 0.434 872 HA ASP 110 HA ASP 110 13.201 7.258 -0.299 873 HB2 ASP 110 HB2 ASP 110 13.335 6.594 2.017 874 HB3 ASP 110 HB1 ASP 110 12.755 8.253 1.948 875 H ALA 111 HN ALA 111 10.183 6.378 -1.025 876 HA ALA 111 HA ALA 111 10.695 3.510 -0.629 877 HB1 ALA 111 HB1 ALA 111 8.311 3.158 -0.730 878 HB2 ALA 111 HB2 ALA 111 8.039 4.868 -1.085 879 HB3 ALA 111 HB3 ALA 111 8.673 4.379 0.490 880 H TYR 112 HN TYR 112 10.292 5.997 -3.007 881 HA TYR 112 HA TYR 112 10.013 3.914 -5.036 882 HB2 TYR 112 HB2 TYR 112 8.523 5.341 -6.367 883 HB3 TYR 112 HB1 TYR 112 7.857 4.785 -4.851 884 HD1 TYR 112 HD2 TYR 112 10.049 7.755 -5.447 885 HD2 TYR 112 HD1 TYR 112 6.202 6.291 -4.396 886 HE1 TYR 112 HE2 TYR 112 9.323 10.043 -4.928 887 HE2 TYR 112 HE1 TYR 112 5.458 8.557 -3.882 888 HH TYR 112 HH TYR 112 7.239 11.324 -4.774 889 H VAL 113 HN VAL 113 12.236 5.719 -4.076 890 HA VAL 113 HA VAL 113 12.955 7.231 -6.395 891 HB VAL 113 HB VAL 113 15.345 7.047 -5.429 892 HG11 VAL 113 HG11 VAL 113 13.995 9.036 -5.222 893 HG12 VAL 113 HG12 VAL 113 14.841 8.735 -3.704 894 HG13 VAL 113 HG13 VAL 113 13.127 8.342 -3.852 895 HG21 VAL 113 HG21 VAL 113 15.538 6.437 -3.098 896 HG22 VAL 113 HG22 VAL 113 14.902 5.065 -4.008 897 HG23 VAL 113 HG23 VAL 113 13.822 6.049 -3.020 898 H ASN 114 HN ASN 114 12.717 6.032 -8.112 899 HA ASN 114 HA ASN 114 14.398 4.450 -9.407 900 HB2 ASN 114 HB2 ASN 114 13.647 2.082 -9.003 901 HB3 ASN 114 HB1 ASN 114 14.581 2.770 -7.689 902 HD21 ASN 114 HD21 ASN 114 11.140 3.434 -8.226 903 HD22 ASN 114 HD22 ASN 114 10.593 2.594 -6.820 904 H GLY 115 HN GLY 115 11.302 5.457 -8.589 905 HA2 GLY 115 HA2 GLY 115 10.327 5.762 -11.112 906 HA3 GLY 115 HA1 GLY 115 9.861 4.122 -10.690 907 H THR 116 HN THR 116 8.448 3.799 -8.902 908 HA THR 116 HA THR 116 7.061 5.993 -7.685 909 HB THR 116 HB THR 116 4.836 4.926 -8.721 910 HG1 THR 116 HG1 THR 116 6.213 3.525 -10.088 911 HG21 THR 116 HG21 THR 116 6.498 7.037 -10.096 912 HG22 THR 116 HG22 THR 116 5.388 7.298 -8.749 913 HG23 THR 116 HG23 THR 116 4.766 6.785 -10.318 914 H VAL 117 HN VAL 117 4.998 4.947 -6.494 915 HA VAL 117 HA VAL 117 6.008 2.430 -5.367 916 HB VAL 117 HB VAL 117 4.366 2.875 -3.482 917 HG11 VAL 117 HG11 VAL 117 6.617 4.824 -3.897 918 HG12 VAL 117 HG12 VAL 117 6.713 3.233 -3.141 919 HG13 VAL 117 HG13 VAL 117 5.802 4.530 -2.362 920 HG21 VAL 117 HG21 VAL 117 3.613 5.172 -3.130 921 HG22 VAL 117 HG22 VAL 117 2.938 4.498 -4.613 922 HG23 VAL 117 HG23 VAL 117 4.283 5.638 -4.694 923 H GLU 118 HN GLU 118 5.165 0.789 -6.425 924 HA GLU 118 HA GLU 118 2.234 0.681 -6.662 925 HB2 GLU 118 HB2 GLU 118 3.702 0.260 -8.729 926 HB3 GLU 118 HB1 GLU 118 4.217 -1.220 -7.932 927 HG2 GLU 118 HG2 GLU 118 1.797 -1.877 -7.812 928 HG3 GLU 118 HG1 GLU 118 1.450 -0.486 -8.841 929 H LEU 119 HN LEU 119 1.404 -0.254 -4.898 930 HA LEU 119 HA LEU 119 2.706 -2.630 -3.829 931 HB2 LEU 119 HB2 LEU 119 2.722 -1.795 -1.556 932 HB3 LEU 119 HB1 LEU 119 3.691 -0.767 -2.591 933 HG LEU 119 HG LEU 119 1.152 0.437 -2.547 934 HD11 LEU 119 HD11 LEU 119 1.995 -0.441 0.199 935 HD12 LEU 119 HD12 LEU 119 0.555 -0.973 -0.670 936 HD13 LEU 119 HD13 LEU 119 0.716 0.713 -0.178 937 HD21 LEU 119 HD21 LEU 119 3.307 1.594 -2.624 938 HD22 LEU 119 HD22 LEU 119 3.642 1.089 -0.967 939 HD23 LEU 119 HD23 LEU 119 2.309 2.194 -1.298 940 H THR 120 HN THR 120 1.364 -3.989 -2.682 941 HA THR 120 HA THR 120 -1.457 -3.584 -3.301 942 HB THR 120 HB THR 120 -0.040 -6.056 -2.295 943 HG1 THR 120 HG1 THR 120 0.571 -6.161 -4.319 944 HG21 THR 120 HG21 THR 120 -2.425 -5.932 -1.712 945 HG22 THR 120 HG22 THR 120 -2.087 -7.218 -2.875 946 HG23 THR 120 HG23 THR 120 -2.815 -5.708 -3.419 947 H LEU 121 HN LEU 121 -2.724 -2.737 -1.806 948 HA LEU 121 HA LEU 121 -2.151 -3.353 1.010 949 HB2 LEU 121 HB2 LEU 121 -3.577 -1.014 -0.251 950 HB3 LEU 121 HB1 LEU 121 -3.598 -1.337 1.477 951 HG LEU 121 HG LEU 121 -1.186 -0.708 -0.213 952 HD11 LEU 121 HD11 LEU 121 -2.655 1.190 0.440 953 HD12 LEU 121 HD12 LEU 121 -1.012 1.283 1.067 954 HD13 LEU 121 HD13 LEU 121 -2.337 0.789 2.128 955 HD21 LEU 121 HD21 LEU 121 -0.736 -2.464 1.448 956 HD22 LEU 121 HD22 LEU 121 -1.338 -1.393 2.719 957 HD23 LEU 121 HD23 LEU 121 0.109 -0.957 1.813 958 HA PRO 122 HA PRO 122 -5.938 -5.676 0.760 959 HB2 PRO 122 HB2 PRO 122 -5.563 -6.218 3.591 960 HB3 PRO 122 HB1 PRO 122 -5.467 -7.338 2.232 961 HG2 PRO 122 HG2 PRO 122 -3.308 -6.585 3.711 962 HG3 PRO 122 HG1 PRO 122 -3.206 -7.076 2.012 963 HD2 PRO 122 HD2 PRO 122 -3.190 -4.327 3.197 964 HD3 PRO 122 HD1 PRO 122 -2.250 -4.977 1.836 965 H ILE 123 HN ILE 123 -7.762 -4.544 0.778 966 HA ILE 123 HA ILE 123 -8.278 -2.734 3.025 967 HB ILE 123 HB ILE 123 -9.964 -1.665 1.718 968 HG12 ILE 123 HG12 ILE 123 -9.582 -3.722 -0.460 969 HG13 ILE 123 HG11 ILE 123 -10.886 -3.798 0.726 970 HG21 ILE 123 HG21 ILE 123 -7.809 -0.892 1.097 971 HG22 ILE 123 HG22 ILE 123 -8.710 -1.086 -0.414 972 HG23 ILE 123 HG23 ILE 123 -7.525 -2.298 0.071 973 HD11 ILE 123 HD11 ILE 123 -11.639 -2.815 -1.361 974 HD12 ILE 123 HD12 ILE 123 -10.412 -1.554 -1.218 975 HD13 ILE 123 HD13 ILE 123 -11.724 -1.649 -0.043 976 H ASP 124 HN ASP 124 -9.533 -3.445 4.640 977 HA ASP 124 HA ASP 124 -10.948 -5.967 4.131 978 HB2 ASP 124 HB2 ASP 124 -9.154 -6.216 5.723 979 HB3 ASP 124 HB1 ASP 124 -9.760 -4.871 6.681 980 H PHE 125 HN PHE 125 -13.018 -5.805 3.987 981 HA PHE 125 HA PHE 125 -14.436 -4.320 6.085 982 HB2 PHE 125 HB2 PHE 125 -15.440 -5.301 3.408 983 HB3 PHE 125 HB1 PHE 125 -16.442 -4.538 4.632 984 HD1 PHE 125 HD2 PHE 125 -13.460 -3.913 2.490 985 HD2 PHE 125 HD1 PHE 125 -16.748 -2.245 4.614 986 HE1 PHE 125 HE2 PHE 125 -12.959 -1.710 1.524 987 HE2 PHE 125 HE1 PHE 125 -16.255 -0.036 3.646 988 HZ PHE 125 HZ PHE 125 -14.357 0.232 2.099 989 H SER 126 HN SER 126 -15.809 -5.569 7.408 990 HA SER 126 HA SER 126 -15.170 -8.319 7.609 991 HB2 SER 126 HB2 SER 126 -17.515 -6.869 8.853 992 HB3 SER 126 HB1 SER 126 -16.772 -8.368 9.417 993 HG SER 126 HG SER 126 -14.775 -6.828 9.383 994 H LEU 127 HN LEU 127 -15.701 -9.619 5.982 995 HA LEU 127 HA LEU 127 -18.142 -9.352 4.488 996 HB2 LEU 127 HB2 LEU 127 -15.650 -10.841 4.283 997 HB3 LEU 127 HB1 LEU 127 -17.038 -11.836 3.882 998 HG LEU 127 HG LEU 127 -16.566 -9.149 2.595 999 HD11 LEU 127 HD11 LEU 127 -14.638 -10.566 2.121 1000 HD12 LEU 127 HD12 LEU 127 -15.639 -10.325 0.686 1001 HD13 LEU 127 HD13 LEU 127 -15.715 -11.852 1.572 1002 HD21 LEU 127 HD21 LEU 127 -18.036 -10.036 0.877 1003 HD22 LEU 127 HD22 LEU 127 -18.826 -10.044 2.453 1004 HD23 LEU 127 HD23 LEU 127 -18.194 -11.546 1.777 1005 H ARG 128 HN ARG 128 -19.652 -9.579 6.218 1006 HA ARG 128 HA ARG 128 -19.851 -12.188 7.477 1007 HB2 ARG 128 HB2 ARG 128 -21.564 -9.724 7.798 1008 HB3 ARG 128 HB1 ARG 128 -21.585 -11.146 8.817 1009 HG2 ARG 128 HG2 ARG 128 -19.269 -10.662 9.509 1010 HG3 ARG 128 HG1 ARG 128 -19.314 -9.197 8.525 1011 HD2 ARG 128 HD2 ARG 128 -19.773 -8.583 10.790 1012 HD3 ARG 128 HD1 ARG 128 -21.266 -8.436 9.863 1013 HE ARG 128 HE ARG 128 -20.902 -10.965 11.234 1014 HH11 ARG 128 HH11 ARG 128 -22.308 -7.759 11.320 1015 HH12 ARG 128 HH12 ARG 128 -23.401 -8.130 12.618 1016 HH21 ARG 128 HH21 ARG 128 -22.332 -11.448 12.942 1017 HH22 ARG 128 HH22 ARG 128 -23.400 -10.224 13.553 1018 H GLY 129 HN GLY 129 -21.838 -9.998 5.506 1019 HA2 GLY 129 HA2 GLY 129 -23.378 -12.350 4.614 1020 HA3 GLY 129 HA1 GLY 129 -24.190 -10.873 5.118 1021 H ALA 130 HN ALA 130 -21.686 -12.003 2.882 1022 HA ALA 130 HA ALA 130 -22.972 -10.878 0.613 1023 HB1 ALA 130 HB1 ALA 130 -22.089 -8.793 1.523 1024 HB2 ALA 130 HB2 ALA 130 -21.277 -9.215 0.015 1025 HB3 ALA 130 HB3 ALA 130 -20.467 -9.485 1.558 1026 H GLY 131 HN GLY 131 -20.898 -10.675 -1.147 1027 HA2 GLY 131 HA2 GLY 131 -19.052 -11.833 -2.057 1028 HA3 GLY 131 HA1 GLY 131 -19.230 -13.054 -0.803 1029 H PHE 132 HN PHE 132 -22.011 -11.947 -2.485 1030 HA PHE 132 HA PHE 132 -21.990 -14.109 -4.403 1031 HB2 PHE 132 HB2 PHE 132 -24.065 -15.122 -3.602 1032 HB3 PHE 132 HB1 PHE 132 -22.838 -15.183 -2.343 1033 HD1 PHE 132 HD1 PHE 132 -23.007 -13.728 -0.371 1034 HD2 PHE 132 HD2 PHE 132 -26.086 -13.875 -3.308 1035 HE1 PHE 132 HE1 PHE 132 -24.559 -12.661 1.208 1036 HE2 PHE 132 HE2 PHE 132 -27.643 -12.798 -1.732 1037 HZ PHE 132 HZ PHE 132 -26.879 -12.190 0.529 Start of MODEL 14 1 H1 LYS 2 HT1 LYS 2 -17.421 -27.012 1.384 2 H2 LYS 2 HT2 LYS 2 -18.319 -25.996 2.403 3 H3 LYS 2 HT3 LYS 2 -17.707 -27.466 2.993 4 HA LYS 2 HA LYS 2 -15.997 -25.282 1.991 5 HB2 LYS 2 HB2 LYS 2 -16.893 -25.877 4.813 6 HB3 LYS 2 HB1 LYS 2 -15.502 -24.871 4.430 7 HG2 LYS 2 HG2 LYS 2 -16.980 -23.344 3.183 8 HG3 LYS 2 HG1 LYS 2 -18.364 -24.331 3.655 9 HD2 LYS 2 HD2 LYS 2 -18.160 -22.406 5.120 10 HD3 LYS 2 HD1 LYS 2 -17.855 -23.894 6.016 11 HE2 LYS 2 HE2 LYS 2 -16.256 -22.195 6.654 12 HE3 LYS 2 HE1 LYS 2 -15.437 -23.501 5.801 13 HZ1 LYS 2 HZ1 LYS 2 -15.355 -22.160 3.824 14 HZ2 LYS 2 HZ2 LYS 2 -14.708 -21.267 5.114 15 HZ3 LYS 2 HZ3 LYS 2 -16.270 -20.937 4.556 16 H VAL 3 HN VAL 3 -15.292 -27.542 1.003 17 HA VAL 3 HA VAL 3 -13.572 -28.998 2.870 18 HB VAL 3 HB VAL 3 -14.000 -29.437 -0.097 19 HG11 VAL 3 HG11 VAL 3 -11.845 -30.279 0.727 20 HG12 VAL 3 HG12 VAL 3 -12.927 -31.593 0.266 21 HG13 VAL 3 HG13 VAL 3 -12.690 -31.203 1.969 22 HG21 VAL 3 HG21 VAL 3 -15.181 -30.877 2.276 23 HG22 VAL 3 HG22 VAL 3 -15.389 -31.338 0.587 24 HG23 VAL 3 HG23 VAL 3 -16.047 -29.811 1.171 25 H GLN 4 HN GLN 4 -13.191 -27.515 -0.342 26 HA GLN 4 HA GLN 4 -10.484 -26.663 0.421 27 HB2 GLN 4 HB2 GLN 4 -11.854 -26.609 -2.277 28 HB3 GLN 4 HB1 GLN 4 -10.203 -26.092 -1.969 29 HG2 GLN 4 HG2 GLN 4 -9.672 -28.388 -1.233 30 HG3 GLN 4 HG1 GLN 4 -11.303 -28.875 -1.697 31 HE21 GLN 4 HE21 GLN 4 -8.742 -29.789 -2.724 32 HE22 GLN 4 HE22 GLN 4 -8.765 -29.455 -4.428 33 H GLU 5 HN GLU 5 -13.687 -25.655 0.004 34 HA GLU 5 HA GLU 5 -13.200 -22.840 -0.269 35 HB2 GLU 5 HB2 GLU 5 -15.740 -23.907 0.896 36 HB3 GLU 5 HB1 GLU 5 -15.504 -22.580 -0.230 37 HG2 GLU 5 HG2 GLU 5 -16.502 -24.140 -1.574 38 HG3 GLU 5 HG1 GLU 5 -14.798 -24.480 -1.874 39 H GLN 6 HN GLN 6 -11.559 -23.574 1.620 40 HA GLN 6 HA GLN 6 -12.281 -22.128 3.946 41 HB2 GLN 6 HB2 GLN 6 -13.504 -24.227 4.433 42 HB3 GLN 6 HB1 GLN 6 -12.015 -25.139 4.225 43 HG2 GLN 6 HG2 GLN 6 -11.037 -24.025 6.145 44 HG3 GLN 6 HG1 GLN 6 -12.488 -23.042 6.334 45 HE21 GLN 6 HE21 GLN 6 -11.117 -26.224 6.659 46 HE22 GLN 6 HE22 GLN 6 -12.368 -26.878 7.665 47 H SER 7 HN SER 7 -10.413 -21.082 3.301 48 HA SER 7 HA SER 7 -8.012 -22.300 2.551 49 HB2 SER 7 HB2 SER 7 -8.290 -19.567 3.809 50 HB3 SER 7 HB1 SER 7 -7.062 -20.104 2.663 51 HG SER 7 HG SER 7 -8.641 -20.237 1.062 52 H VAL 8 HN VAL 8 -6.577 -23.387 3.697 53 HA VAL 8 HA VAL 8 -6.435 -22.966 6.603 54 HB VAL 8 HB VAL 8 -5.171 -25.046 6.721 55 HG11 VAL 8 HG11 VAL 8 -7.573 -25.217 6.860 56 HG12 VAL 8 HG12 VAL 8 -6.929 -26.612 5.996 57 HG13 VAL 8 HG13 VAL 8 -7.700 -25.301 5.103 58 HG21 VAL 8 HG21 VAL 8 -3.990 -24.911 4.590 59 HG22 VAL 8 HG22 VAL 8 -5.502 -25.199 3.727 60 HG23 VAL 8 HG23 VAL 8 -4.823 -26.457 4.758 61 H GLY 9 HN GLY 9 -4.056 -23.361 7.427 62 HA2 GLY 9 HA2 GLY 9 -2.374 -21.505 5.871 63 HA3 GLY 9 HA1 GLY 9 -2.341 -21.641 7.622 64 H ALA 10 HN ALA 10 -1.597 -23.364 4.621 65 HA ALA 10 HA ALA 10 0.535 -24.776 6.091 66 HB1 ALA 10 HB1 ALA 10 -0.357 -26.685 5.373 67 HB2 ALA 10 HB2 ALA 10 0.011 -26.187 3.723 68 HB3 ALA 10 HB3 ALA 10 -1.560 -25.813 4.423 69 HA PRO 11 HA PRO 11 2.619 -22.200 2.929 70 HB2 PRO 11 HB2 PRO 11 4.543 -21.441 4.900 71 HB3 PRO 11 HB1 PRO 11 3.256 -20.451 4.214 72 HG2 PRO 11 HG2 PRO 11 3.380 -21.286 6.849 73 HG3 PRO 11 HG1 PRO 11 1.908 -20.758 6.019 74 HD2 PRO 11 HD2 PRO 11 2.888 -23.530 6.564 75 HD3 PRO 11 HD1 PRO 11 1.231 -22.888 6.611 76 HA PRO 12 HA PRO 12 5.805 -25.227 2.092 77 HB2 PRO 12 HB2 PRO 12 7.034 -23.093 0.461 78 HB3 PRO 12 HB1 PRO 12 6.456 -24.689 -0.032 79 HG2 PRO 12 HG2 PRO 12 5.127 -22.466 -0.703 80 HG3 PRO 12 HG1 PRO 12 4.272 -23.964 -0.289 81 HD2 PRO 12 HD2 PRO 12 4.738 -21.523 1.387 82 HD3 PRO 12 HD1 PRO 12 3.269 -22.508 1.217 83 HA PRO 13 HA PRO 13 8.602 -23.610 5.213 84 HB2 PRO 13 HB2 PRO 13 9.864 -25.958 5.719 85 HB3 PRO 13 HB1 PRO 13 8.256 -25.575 6.346 86 HG2 PRO 13 HG2 PRO 13 9.021 -27.237 3.976 87 HG3 PRO 13 HG1 PRO 13 7.787 -27.550 5.210 88 HD2 PRO 13 HD2 PRO 13 7.199 -26.568 2.753 89 HD3 PRO 13 HD1 PRO 13 6.249 -26.173 4.198 90 H GLY 14 HN GLY 14 9.721 -22.331 3.591 91 HA2 GLY 14 HA2 GLY 14 11.829 -21.614 2.962 92 HA3 GLY 14 HA1 GLY 14 12.471 -23.174 3.451 93 H ARG 15 HN ARG 15 10.163 -22.037 0.969 94 HA ARG 15 HA ARG 15 11.470 -23.802 -0.963 95 HB2 ARG 15 HB2 ARG 15 8.972 -23.762 -0.792 96 HB3 ARG 15 HB1 ARG 15 9.008 -22.091 -1.340 97 HG2 ARG 15 HG2 ARG 15 8.472 -23.580 -3.173 98 HG3 ARG 15 HG1 ARG 15 10.032 -22.799 -3.445 99 HD2 ARG 15 HD2 ARG 15 10.130 -25.168 -4.025 100 HD3 ARG 15 HD1 ARG 15 11.178 -24.812 -2.650 101 HE ARG 15 HE ARG 15 8.477 -25.942 -2.285 102 HH11 ARG 15 HH11 ARG 15 11.941 -26.034 -1.722 103 HH12 ARG 15 HH12 ARG 15 11.848 -27.353 -0.596 104 HH21 ARG 15 HH21 ARG 15 8.349 -27.654 -0.789 105 HH22 ARG 15 HH22 ARG 15 9.802 -28.271 -0.048 106 H ALA 16 HN ALA 16 13.356 -22.789 -1.492 107 HA ALA 16 HA ALA 16 13.146 -20.550 -3.286 108 HB1 ALA 16 HB1 ALA 16 14.703 -20.224 -0.724 109 HB2 ALA 16 HB2 ALA 16 13.224 -19.366 -1.158 110 HB3 ALA 16 HB3 ALA 16 14.703 -19.098 -2.081 111 H ASP 17 HN ASP 17 15.076 -20.137 -4.428 112 HA ASP 17 HA ASP 17 17.446 -21.723 -3.895 113 HB2 ASP 17 HB2 ASP 17 16.051 -23.211 -5.344 114 HB3 ASP 17 HB1 ASP 17 16.043 -21.951 -6.570 115 H LYS 18 HN LYS 18 15.917 -19.899 -6.515 116 HA LYS 18 HA LYS 18 18.178 -18.006 -6.475 117 HB2 LYS 18 HB2 LYS 18 16.121 -18.468 -8.651 118 HB3 LYS 18 HB1 LYS 18 17.529 -17.423 -8.754 119 HG2 LYS 18 HG2 LYS 18 17.833 -20.361 -8.267 120 HG3 LYS 18 HG1 LYS 18 17.600 -19.728 -9.894 121 HD2 LYS 18 HD2 LYS 18 19.901 -19.862 -9.692 122 HD3 LYS 18 HD1 LYS 18 19.576 -18.167 -9.335 123 HE2 LYS 18 HE2 LYS 18 21.128 -18.838 -7.711 124 HE3 LYS 18 HE1 LYS 18 19.573 -18.885 -6.878 125 HZ1 LYS 18 HZ1 LYS 18 20.881 -20.859 -6.394 126 HZ2 LYS 18 HZ2 LYS 18 20.990 -21.222 -8.049 127 HZ3 LYS 18 HZ3 LYS 18 19.487 -21.280 -7.267 128 H THR 19 HN THR 19 17.634 -16.410 -5.127 129 HA THR 19 HA THR 19 14.974 -15.832 -4.386 130 HB THR 19 HB THR 19 17.361 -14.040 -3.955 131 HG1 THR 19 HG1 THR 19 16.640 -15.832 -1.961 132 HG21 THR 19 HG21 THR 19 14.847 -14.494 -2.341 133 HG22 THR 19 HG22 THR 19 15.186 -13.081 -3.344 134 HG23 THR 19 HG23 THR 19 16.166 -13.406 -1.913 135 H ALA 20 HN ALA 20 17.303 -13.652 -6.002 136 HA ALA 20 HA ALA 20 14.993 -12.126 -6.982 137 HB1 ALA 20 HB1 ALA 20 17.878 -11.297 -6.705 138 HB2 ALA 20 HB2 ALA 20 16.558 -10.867 -5.617 139 HB3 ALA 20 HB3 ALA 20 16.566 -10.269 -7.277 140 H ALA 21 HN ALA 21 15.117 -14.226 -8.493 141 HA ALA 21 HA ALA 21 16.167 -13.130 -10.986 142 HB1 ALA 21 HB1 ALA 21 17.006 -15.262 -11.766 143 HB2 ALA 21 HB2 ALA 21 16.530 -16.032 -10.254 144 HB3 ALA 21 HB3 ALA 21 17.802 -14.812 -10.258 145 HA PRO 22 HA PRO 22 12.332 -15.644 -12.116 146 HB2 PRO 22 HB2 PRO 22 11.559 -17.623 -10.214 147 HB3 PRO 22 HB1 PRO 22 12.302 -17.888 -11.792 148 HG2 PRO 22 HG2 PRO 22 13.496 -18.440 -9.352 149 HG3 PRO 22 HG1 PRO 22 14.357 -18.228 -10.885 150 HD2 PRO 22 HD2 PRO 22 13.947 -16.275 -8.653 151 HD3 PRO 22 HD1 PRO 22 15.378 -16.542 -9.673 152 H GLN 23 HN GLN 23 12.598 -15.069 -8.679 153 HA GLN 23 HA GLN 23 9.781 -14.542 -8.329 154 HB2 GLN 23 HB2 GLN 23 12.138 -14.202 -6.469 155 HB3 GLN 23 HB1 GLN 23 10.466 -13.925 -6.012 156 HG2 GLN 23 HG2 GLN 23 9.956 -16.271 -6.488 157 HG3 GLN 23 HG1 GLN 23 11.647 -16.542 -6.911 158 HE21 GLN 23 HE21 GLN 23 13.205 -16.539 -5.277 159 HE22 GLN 23 HE22 GLN 23 12.781 -16.694 -3.608 160 H THR 24 HN THR 24 10.714 -12.329 -6.375 161 HA THR 24 HA THR 24 10.984 -10.073 -6.309 162 HB THR 24 HB THR 24 11.708 -10.172 -9.246 163 HG1 THR 24 HG1 THR 24 13.884 -10.246 -8.421 164 HG21 THR 24 HG21 THR 24 12.359 -8.165 -7.079 165 HG22 THR 24 HG22 THR 24 11.202 -7.933 -8.390 166 HG23 THR 24 HG23 THR 24 12.920 -8.101 -8.751 167 H ARG 25 HN ARG 25 9.189 -11.463 -8.966 168 HA ARG 25 HA ARG 25 7.587 -9.329 -9.734 169 HB2 ARG 25 HB2 ARG 25 6.033 -11.016 -10.573 170 HB3 ARG 25 HB1 ARG 25 7.695 -11.466 -10.928 171 HG2 ARG 25 HG2 ARG 25 7.605 -12.933 -8.875 172 HG3 ARG 25 HG1 ARG 25 5.867 -12.626 -8.846 173 HD2 ARG 25 HD2 ARG 25 5.796 -13.461 -11.223 174 HD3 ARG 25 HD1 ARG 25 7.468 -13.979 -11.009 175 HE ARG 25 HE ARG 25 5.199 -14.995 -9.407 176 HH11 ARG 25 HH11 ARG 25 8.322 -15.455 -10.941 177 HH12 ARG 25 HH12 ARG 25 8.380 -17.162 -10.607 178 HH21 ARG 25 HH21 ARG 25 5.304 -17.241 -8.924 179 HH22 ARG 25 HH22 ARG 25 6.680 -18.169 -9.455 180 H LEU 26 HN LEU 26 7.296 -11.467 -6.951 181 HA LEU 26 HA LEU 26 5.046 -9.803 -6.018 182 HB2 LEU 26 HB2 LEU 26 5.683 -12.678 -5.350 183 HB3 LEU 26 HB1 LEU 26 4.441 -11.732 -4.554 184 HG LEU 26 HG LEU 26 4.476 -12.513 -7.473 185 HD11 LEU 26 HD11 LEU 26 2.733 -13.414 -5.183 186 HD12 LEU 26 HD12 LEU 26 3.982 -14.373 -5.980 187 HD13 LEU 26 HD13 LEU 26 2.543 -13.881 -6.873 188 HD21 LEU 26 HD21 LEU 26 3.449 -10.328 -7.170 189 HD22 LEU 26 HD22 LEU 26 2.429 -10.969 -5.881 190 HD23 LEU 26 HD23 LEU 26 2.221 -11.541 -7.535 191 H THR 27 HN THR 27 7.964 -9.388 -5.790 192 HA THR 27 HA THR 27 8.125 -9.276 -2.865 193 HB THR 27 HB THR 27 10.469 -9.783 -4.711 194 HG1 THR 27 HG1 THR 27 9.025 -11.619 -3.060 195 HG21 THR 27 HG21 THR 27 10.980 -8.666 -2.586 196 HG22 THR 27 HG22 THR 27 11.673 -10.287 -2.661 197 HG23 THR 27 HG23 THR 27 10.217 -9.990 -1.708 198 HA PRO 28 HA PRO 28 8.706 -5.055 -4.685 199 HB2 PRO 28 HB2 PRO 28 6.909 -4.119 -2.614 200 HB3 PRO 28 HB1 PRO 28 6.693 -4.068 -4.364 201 HG2 PRO 28 HG2 PRO 28 5.203 -5.645 -2.703 202 HG3 PRO 28 HG1 PRO 28 5.526 -6.036 -4.402 203 HD2 PRO 28 HD2 PRO 28 6.843 -7.094 -1.930 204 HD3 PRO 28 HD1 PRO 28 6.365 -7.956 -3.409 205 H TYR 29 HN TYR 29 10.782 -4.785 -3.952 206 HA TYR 29 HA TYR 29 11.364 -4.637 -1.132 207 HB2 TYR 29 HB2 TYR 29 12.997 -5.597 -2.691 208 HB3 TYR 29 HB1 TYR 29 13.108 -4.060 -3.539 209 HD1 TYR 29 HD2 TYR 29 13.272 -5.102 0.058 210 HD2 TYR 29 HD1 TYR 29 15.105 -2.994 -3.150 211 HE1 TYR 29 HE2 TYR 29 15.091 -4.404 1.561 212 HE2 TYR 29 HE1 TYR 29 16.926 -2.298 -1.659 213 HH TYR 29 HH TYR 29 17.423 -2.016 0.626 214 H ALA 30 HN ALA 30 9.966 -2.918 -0.543 215 HA ALA 30 HA ALA 30 11.198 -0.295 -0.998 216 HB1 ALA 30 HB1 ALA 30 8.999 0.762 -1.187 217 HB2 ALA 30 HB2 ALA 30 8.232 -0.824 -1.120 218 HB3 ALA 30 HB3 ALA 30 9.267 -0.403 -2.483 219 H GLN 31 HN GLN 31 9.106 -2.329 0.952 220 HA GLN 31 HA GLN 31 8.647 -2.442 3.156 221 HB2 GLN 31 HB2 GLN 31 11.107 -2.533 3.346 222 HB3 GLN 31 HB1 GLN 31 11.154 -0.780 3.469 223 HG2 GLN 31 HG2 GLN 31 9.860 -0.899 5.546 224 HG3 GLN 31 HG1 GLN 31 9.845 -2.659 5.427 225 HE21 GLN 31 HE21 GLN 31 10.947 -0.892 7.487 226 HE22 GLN 31 HE22 GLN 31 12.618 -1.309 7.623 227 H ALA 32 HN ALA 32 10.134 0.681 3.720 228 HA ALA 32 HA ALA 32 9.329 2.696 4.362 229 HB1 ALA 32 HB1 ALA 32 7.365 3.571 3.197 230 HB2 ALA 32 HB2 ALA 32 7.020 1.953 2.582 231 HB3 ALA 32 HB3 ALA 32 8.496 2.787 2.096 232 H GLY 33 HN GLY 33 8.270 0.048 5.691 233 HA2 GLY 33 HA2 GLY 33 7.351 -0.112 7.844 234 HA3 GLY 33 HA1 GLY 33 6.669 1.495 7.645 235 H GLU 34 HN GLU 34 6.031 -1.787 7.679 236 HA GLU 34 HA GLU 34 3.682 -1.742 5.980 237 HB2 GLU 34 HB2 GLU 34 5.147 -3.744 6.228 238 HB3 GLU 34 HB1 GLU 34 4.673 -3.849 7.915 239 HG2 GLU 34 HG2 GLU 34 2.293 -4.088 7.089 240 HG3 GLU 34 HG1 GLU 34 2.984 -4.309 5.482 241 H ASP 35 HN ASP 35 4.325 -0.581 8.969 242 HA ASP 35 HA ASP 35 2.083 -1.714 10.394 243 HB2 ASP 35 HB2 ASP 35 3.012 -0.230 12.276 244 HB3 ASP 35 HB1 ASP 35 3.990 -1.587 11.729 245 H ASN 36 HN ASN 36 2.916 1.580 11.103 246 HA ASN 36 HA ASN 36 0.058 2.116 11.107 247 HB2 ASN 36 HB2 ASN 36 1.544 2.546 13.092 248 HB3 ASN 36 HB1 ASN 36 2.302 3.838 12.170 249 HD21 ASN 36 HD21 ASN 36 1.678 5.427 13.580 250 HD22 ASN 36 HD22 ASN 36 0.040 5.949 13.744 251 H TRP 37 HN TRP 37 0.185 2.179 8.657 252 HA TRP 37 HA TRP 37 0.368 5.022 7.970 253 HB2 TRP 37 HB2 TRP 37 1.130 4.455 5.683 254 HB3 TRP 37 HB1 TRP 37 2.303 4.046 6.918 255 HD1 TRP 37 HD1 TRP 37 0.528 1.170 7.500 256 HE1 TRP 37 HE1 TRP 37 1.081 -0.772 5.908 257 HE3 TRP 37 HE3 TRP 37 2.709 3.821 3.710 258 HZ2 TRP 37 HZ2 TRP 37 2.290 -1.133 3.380 259 HZ3 TRP 37 HZ3 TRP 37 3.542 2.601 1.746 260 HH2 TRP 37 HH2 TRP 37 3.335 0.178 1.587 261 H ARG 38 HN ARG 38 -1.322 2.034 7.742 262 HA ARG 38 HA ARG 38 -3.088 2.743 5.628 263 HB2 ARG 38 HB2 ARG 38 -4.468 0.860 6.368 264 HB3 ARG 38 HB1 ARG 38 -2.778 0.397 6.238 265 HG2 ARG 38 HG2 ARG 38 -2.507 0.344 8.577 266 HG3 ARG 38 HG1 ARG 38 -4.027 1.197 8.850 267 HD2 ARG 38 HD2 ARG 38 -4.337 -1.130 9.367 268 HD3 ARG 38 HD1 ARG 38 -5.235 -0.748 7.902 269 HE ARG 38 HE ARG 38 -2.567 -1.885 7.573 270 HH11 ARG 38 HH11 ARG 38 -6.040 -2.329 7.477 271 HH12 ARG 38 HH12 ARG 38 -5.961 -3.873 6.675 272 HH21 ARG 38 HH21 ARG 38 -2.441 -3.897 6.508 273 HH22 ARG 38 HH22 ARG 38 -3.898 -4.773 6.129 274 H SER 39 HN SER 39 -3.028 3.227 9.059 275 HA SER 39 HA SER 39 -5.662 4.077 9.494 276 HB2 SER 39 HB2 SER 39 -4.573 5.323 11.437 277 HB3 SER 39 HB1 SER 39 -4.265 3.584 11.373 278 HG SER 39 HG SER 39 -2.278 4.435 11.642 279 H ARG 40 HN ARG 40 -2.753 5.747 8.414 280 HA ARG 40 HA ARG 40 -3.890 8.346 8.482 281 HB2 ARG 40 HB2 ARG 40 -1.528 7.549 6.799 282 HB3 ARG 40 HB1 ARG 40 -1.839 9.042 7.645 283 HG2 ARG 40 HG2 ARG 40 -1.070 6.434 8.894 284 HG3 ARG 40 HG1 ARG 40 -0.071 7.882 8.760 285 HD2 ARG 40 HD2 ARG 40 -2.643 7.658 10.321 286 HD3 ARG 40 HD1 ARG 40 -1.024 7.594 11.011 287 HE ARG 40 HE ARG 40 -1.361 9.981 9.521 288 HH11 ARG 40 HH11 ARG 40 -2.409 8.456 12.483 289 HH12 ARG 40 HH12 ARG 40 -2.504 9.938 13.380 290 HH21 ARG 40 HH21 ARG 40 -1.516 11.954 10.682 291 HH22 ARG 40 HH22 ARG 40 -2.045 11.937 12.332 292 H ILE 41 HN ILE 41 -3.330 5.885 6.025 293 HA ILE 41 HA ILE 41 -4.215 7.293 3.759 294 HB ILE 41 HB ILE 41 -4.352 4.336 4.438 295 HG12 ILE 41 HG12 ILE 41 -2.450 5.906 2.690 296 HG13 ILE 41 HG11 ILE 41 -2.099 5.334 4.315 297 HG21 ILE 41 HG21 ILE 41 -4.822 5.672 1.778 298 HG22 ILE 41 HG22 ILE 41 -6.020 4.810 2.745 299 HG23 ILE 41 HG23 ILE 41 -4.659 3.937 2.036 300 HD11 ILE 41 HD11 ILE 41 -2.672 3.606 1.922 301 HD12 ILE 41 HD12 ILE 41 -2.317 3.030 3.551 302 HD13 ILE 41 HD13 ILE 41 -1.089 3.908 2.638 303 H SER 42 HN SER 42 -5.997 5.123 5.985 304 HA SER 42 HA SER 42 -8.520 5.373 4.810 305 HB2 SER 42 HB2 SER 42 -7.855 4.933 7.734 306 HB3 SER 42 HB1 SER 42 -9.408 4.592 6.968 307 HG SER 42 HG SER 42 -6.915 3.311 6.561 308 H GLY 43 HN GLY 43 -6.993 7.300 7.378 309 HA2 GLY 43 HA2 GLY 43 -9.160 9.051 7.822 310 HA3 GLY 43 HA1 GLY 43 -7.473 9.401 8.178 311 H ARG 44 HN ARG 44 -6.511 9.111 5.487 312 HA ARG 44 HA ARG 44 -7.017 11.714 4.516 313 HB2 ARG 44 HB2 ARG 44 -5.022 9.902 4.190 314 HB3 ARG 44 HB1 ARG 44 -5.890 9.715 2.691 315 HG2 ARG 44 HG2 ARG 44 -5.671 12.099 2.243 316 HG3 ARG 44 HG1 ARG 44 -4.799 12.299 3.766 317 HD2 ARG 44 HD2 ARG 44 -3.261 10.435 2.807 318 HD3 ARG 44 HD1 ARG 44 -3.947 10.932 1.256 319 HE ARG 44 HE ARG 44 -2.220 12.544 2.988 320 HH11 ARG 44 HH11 ARG 44 -4.126 12.365 0.044 321 HH12 ARG 44 HH12 ARG 44 -3.354 13.739 -0.674 322 HH21 ARG 44 HH21 ARG 44 -1.218 14.327 2.039 323 HH22 ARG 44 HH22 ARG 44 -1.696 14.851 0.451 324 H LEU 45 HN LEU 45 -8.265 8.520 3.774 325 HA LEU 45 HA LEU 45 -9.509 9.101 1.335 326 HB2 LEU 45 HB2 LEU 45 -9.274 6.918 3.092 327 HB3 LEU 45 HB1 LEU 45 -10.976 7.226 2.950 328 HG LEU 45 HG LEU 45 -9.311 7.033 0.489 329 HD11 LEU 45 HD11 LEU 45 -8.709 5.066 1.783 330 HD12 LEU 45 HD12 LEU 45 -9.747 4.618 0.427 331 HD13 LEU 45 HD13 LEU 45 -10.414 4.706 2.057 332 HD21 LEU 45 HD21 LEU 45 -12.179 6.622 1.233 333 HD22 LEU 45 HD22 LEU 45 -11.510 5.961 -0.257 334 HD23 LEU 45 HD23 LEU 45 -11.490 7.708 0.022 335 H ASN 46 HN ASN 46 -10.418 9.608 4.659 336 HA ASN 46 HA ASN 46 -13.092 10.490 4.143 337 HB2 ASN 46 HB2 ASN 46 -12.466 9.732 6.384 338 HB3 ASN 46 HB1 ASN 46 -11.284 11.032 6.513 339 HD21 ASN 46 HD21 ASN 46 -14.661 10.199 6.591 340 HD22 ASN 46 HD22 ASN 46 -15.221 11.716 7.206 341 H ARG 47 HN ARG 47 -9.953 11.973 4.377 342 HA ARG 47 HA ARG 47 -10.731 14.677 4.099 343 HB2 ARG 47 HB2 ARG 47 -8.534 13.909 4.923 344 HB3 ARG 47 HB1 ARG 47 -8.164 13.272 3.333 345 HG2 ARG 47 HG2 ARG 47 -8.132 15.515 2.414 346 HG3 ARG 47 HG1 ARG 47 -8.585 16.182 3.988 347 HD2 ARG 47 HD2 ARG 47 -6.549 15.305 4.974 348 HD3 ARG 47 HD1 ARG 47 -6.105 14.555 3.446 349 HE ARG 47 HE ARG 47 -6.305 17.170 2.791 350 HH11 ARG 47 HH11 ARG 47 -4.656 15.446 5.354 351 HH12 ARG 47 HH12 ARG 47 -3.319 16.556 5.437 352 HH21 ARG 47 HH21 ARG 47 -4.536 18.666 2.897 353 HH22 ARG 47 HH22 ARG 47 -3.256 18.389 4.039 354 H PHE 48 HN PHE 48 -10.250 12.036 1.867 355 HA PHE 48 HA PHE 48 -10.749 13.730 -0.439 356 HB2 PHE 48 HB2 PHE 48 -10.108 10.816 -0.109 357 HB3 PHE 48 HB1 PHE 48 -10.755 11.416 -1.630 358 HD1 PHE 48 HD1 PHE 48 -9.481 13.364 -2.737 359 HD2 PHE 48 HD2 PHE 48 -7.837 10.870 0.292 360 HE1 PHE 48 HE1 PHE 48 -7.214 13.982 -3.465 361 HE2 PHE 48 HE2 PHE 48 -5.568 11.487 -0.428 362 HZ PHE 48 HZ PHE 48 -5.255 13.043 -2.310 363 H LYS 49 HN LYS 49 -12.593 12.816 1.889 364 HA LYS 49 HA LYS 49 -14.782 12.472 2.270 365 HB2 LYS 49 HB2 LYS 49 -15.181 14.150 0.522 366 HB3 LYS 49 HB1 LYS 49 -15.133 12.889 -0.702 367 HG2 LYS 49 HG2 LYS 49 -17.416 13.446 -0.231 368 HG3 LYS 49 HG1 LYS 49 -17.085 11.822 0.374 369 HD2 LYS 49 HD2 LYS 49 -18.361 12.974 2.036 370 HD3 LYS 49 HD1 LYS 49 -16.705 12.829 2.633 371 HE2 LYS 49 HE2 LYS 49 -16.302 15.147 1.734 372 HE3 LYS 49 HE1 LYS 49 -18.038 15.258 1.451 373 HZ1 LYS 49 HZ1 LYS 49 -17.590 16.255 3.532 374 HZ2 LYS 49 HZ2 LYS 49 -16.652 14.941 4.051 375 HZ3 LYS 49 HZ3 LYS 49 -18.331 14.761 3.867 376 H ARG 50 HN ARG 50 -14.850 10.438 2.965 377 HA ARG 50 HA ARG 50 -15.475 8.376 0.961 378 HB2 ARG 50 HB2 ARG 50 -14.672 6.687 2.585 379 HB3 ARG 50 HB1 ARG 50 -13.398 7.787 2.089 380 HG2 ARG 50 HG2 ARG 50 -13.810 9.065 4.209 381 HG3 ARG 50 HG1 ARG 50 -14.878 7.751 4.704 382 HD2 ARG 50 HD2 ARG 50 -12.196 6.966 3.765 383 HD3 ARG 50 HD1 ARG 50 -12.248 7.855 5.284 384 HE ARG 50 HE ARG 50 -14.003 6.012 5.865 385 HH11 ARG 50 HH11 ARG 50 -11.098 5.587 3.962 386 HH12 ARG 50 HH12 ARG 50 -10.793 3.971 4.534 387 HH21 ARG 50 HH21 ARG 50 -13.572 3.883 6.672 388 HH22 ARG 50 HH22 ARG 50 -12.194 3.009 6.064 389 H TYR 51 HN TYR 51 -17.414 7.481 1.094 390 HA TYR 51 HA TYR 51 -19.419 8.554 2.721 391 HB2 TYR 51 HB2 TYR 51 -19.574 7.218 0.494 392 HB3 TYR 51 HB1 TYR 51 -19.570 5.789 1.532 393 HD1 TYR 51 HD1 TYR 51 -21.474 5.355 3.041 394 HD2 TYR 51 HD2 TYR 51 -21.479 8.673 0.384 395 HE1 TYR 51 HE1 TYR 51 -23.891 5.624 3.391 396 HE2 TYR 51 HE2 TYR 51 -23.894 8.953 0.727 397 HH TYR 51 HH TYR 51 -25.840 7.548 1.418 398 HA PRO 52 HA PRO 52 -18.671 6.765 6.712 399 HB2 PRO 52 HB2 PRO 52 -21.425 6.375 7.259 400 HB3 PRO 52 HB1 PRO 52 -20.425 7.742 7.746 401 HG2 PRO 52 HG2 PRO 52 -22.292 7.486 5.454 402 HG3 PRO 52 HG1 PRO 52 -21.852 8.920 6.399 403 HD2 PRO 52 HD2 PRO 52 -20.920 8.555 3.917 404 HD3 PRO 52 HD1 PRO 52 -19.901 9.273 5.185 405 H LYS 53 HN LYS 53 -18.235 4.750 7.326 406 HA LYS 53 HA LYS 53 -18.704 2.635 5.505 407 HB2 LYS 53 HB2 LYS 53 -17.567 2.633 8.303 408 HB3 LYS 53 HB1 LYS 53 -17.644 1.200 7.291 409 HG2 LYS 53 HG2 LYS 53 -16.158 3.727 6.606 410 HG3 LYS 53 HG1 LYS 53 -15.434 2.271 7.286 411 HD2 LYS 53 HD2 LYS 53 -15.001 1.999 5.036 412 HD3 LYS 53 HD1 LYS 53 -16.515 1.108 5.207 413 HE2 LYS 53 HE2 LYS 53 -16.630 2.512 3.238 414 HE3 LYS 53 HE1 LYS 53 -17.740 3.114 4.467 415 HZ1 LYS 53 HZ1 LYS 53 -16.008 4.739 5.100 416 HZ2 LYS 53 HZ2 LYS 53 -16.596 4.949 3.529 417 HZ3 LYS 53 HZ3 LYS 53 -15.083 4.227 3.776 418 H ASP 54 HN ASP 54 -20.514 3.764 8.192 419 HA ASP 54 HA ASP 54 -21.751 1.481 9.137 420 HB2 ASP 54 HB2 ASP 54 -22.932 4.236 8.721 421 HB3 ASP 54 HB1 ASP 54 -23.679 2.969 9.689 422 H ALA 55 HN ALA 55 -22.581 3.402 6.269 423 HA ALA 55 HA ALA 55 -24.810 1.744 5.567 424 HB1 ALA 55 HB1 ALA 55 -23.299 3.735 3.885 425 HB2 ALA 55 HB2 ALA 55 -24.703 4.088 4.890 426 HB3 ALA 55 HB3 ALA 55 -24.863 3.021 3.496 427 H LEU 56 HN LEU 56 -21.400 1.837 4.745 428 HA LEU 56 HA LEU 56 -21.613 0.094 2.477 429 HB2 LEU 56 HB2 LEU 56 -19.246 1.015 4.110 430 HB3 LEU 56 HB1 LEU 56 -19.088 -0.071 2.751 431 HG LEU 56 HG LEU 56 -18.487 2.107 2.018 432 HD11 LEU 56 HD11 LEU 56 -21.267 1.497 1.060 433 HD12 LEU 56 HD12 LEU 56 -19.771 0.796 0.448 434 HD13 LEU 56 HD13 LEU 56 -20.084 2.516 0.245 435 HD21 LEU 56 HD21 LEU 56 -19.953 4.029 2.167 436 HD22 LEU 56 HD22 LEU 56 -19.575 3.399 3.770 437 HD23 LEU 56 HD23 LEU 56 -21.147 3.069 3.041 438 H ARG 57 HN ARG 57 -20.694 -0.310 5.862 439 HA ARG 57 HA ARG 57 -19.825 -3.017 5.511 440 HB2 ARG 57 HB2 ARG 57 -20.361 -1.384 7.994 441 HB3 ARG 57 HB1 ARG 57 -19.636 -2.987 7.992 442 HG2 ARG 57 HG2 ARG 57 -18.288 -1.165 6.176 443 HG3 ARG 57 HG1 ARG 57 -18.291 -0.587 7.848 444 HD2 ARG 57 HD2 ARG 57 -17.382 -3.310 6.924 445 HD3 ARG 57 HD1 ARG 57 -16.322 -1.967 7.351 446 HE ARG 57 HE ARG 57 -17.993 -2.417 9.529 447 HH11 ARG 57 HH11 ARG 57 -15.456 -4.051 7.779 448 HH12 ARG 57 HH12 ARG 57 -14.931 -4.997 9.137 449 HH21 ARG 57 HH21 ARG 57 -17.357 -3.686 11.328 450 HH22 ARG 57 HH22 ARG 57 -16.043 -4.821 11.156 451 H LEU 58 HN LEU 58 -22.831 -1.517 6.007 452 HA LEU 58 HA LEU 58 -24.136 -3.889 7.052 453 HB2 LEU 58 HB2 LEU 58 -24.889 -1.596 7.650 454 HB3 LEU 58 HB1 LEU 58 -25.288 -1.308 5.970 455 HG LEU 58 HG LEU 58 -26.973 -3.144 6.107 456 HD11 LEU 58 HD11 LEU 58 -26.308 -3.041 9.046 457 HD12 LEU 58 HD12 LEU 58 -26.034 -4.401 7.955 458 HD13 LEU 58 HD13 LEU 58 -27.680 -3.892 8.335 459 HD21 LEU 58 HD21 LEU 58 -27.602 -0.792 6.340 460 HD22 LEU 58 HD22 LEU 58 -27.326 -0.891 8.079 461 HD23 LEU 58 HD23 LEU 58 -28.617 -1.836 7.337 462 H LYS 59 HN LYS 59 -22.955 -2.865 4.144 463 HA LYS 59 HA LYS 59 -25.039 -4.204 2.552 464 HB2 LYS 59 HB2 LYS 59 -24.805 -1.768 2.173 465 HB3 LYS 59 HB1 LYS 59 -23.123 -2.014 1.729 466 HG2 LYS 59 HG2 LYS 59 -23.917 -3.481 -0.130 467 HG3 LYS 59 HG1 LYS 59 -25.559 -2.980 0.273 468 HD2 LYS 59 HD2 LYS 59 -23.303 -1.166 -0.546 469 HD3 LYS 59 HD1 LYS 59 -24.668 -1.646 -1.554 470 HE2 LYS 59 HE2 LYS 59 -24.948 -0.168 1.055 471 HE3 LYS 59 HE1 LYS 59 -24.853 0.630 -0.514 472 HZ1 LYS 59 HZ1 LYS 59 -26.839 -0.551 -1.201 473 HZ2 LYS 59 HZ2 LYS 59 -27.140 0.342 0.205 474 HZ3 LYS 59 HZ3 LYS 59 -26.932 -1.338 0.297 475 H ARG 60 HN ARG 60 -21.556 -3.424 2.473 476 HA ARG 60 HA ARG 60 -21.066 -6.008 1.139 477 HB2 ARG 60 HB2 ARG 60 -19.548 -3.461 0.556 478 HB3 ARG 60 HB1 ARG 60 -19.425 -4.994 -0.293 479 HG2 ARG 60 HG2 ARG 60 -21.866 -3.238 -0.267 480 HG3 ARG 60 HG1 ARG 60 -20.650 -3.265 -1.543 481 HD2 ARG 60 HD2 ARG 60 -21.156 -5.599 -1.993 482 HD3 ARG 60 HD1 ARG 60 -22.333 -5.610 -0.679 483 HE ARG 60 HE ARG 60 -22.776 -3.612 -2.744 484 HH11 ARG 60 HH11 ARG 60 -23.510 -6.853 -1.604 485 HH12 ARG 60 HH12 ARG 60 -25.013 -6.948 -2.465 486 HH21 ARG 60 HH21 ARG 60 -24.767 -3.756 -3.862 487 HH22 ARG 60 HH22 ARG 60 -25.720 -5.203 -3.740 488 H GLN 61 HN GLN 61 -19.762 -7.232 2.347 489 HA GLN 61 HA GLN 61 -17.502 -5.929 3.708 490 HB2 GLN 61 HB2 GLN 61 -18.859 -8.463 4.656 491 HB3 GLN 61 HB1 GLN 61 -17.591 -7.565 5.472 492 HG2 GLN 61 HG2 GLN 61 -19.120 -5.699 5.815 493 HG3 GLN 61 HG1 GLN 61 -20.398 -6.602 5.002 494 HE21 GLN 61 HE21 GLN 61 -21.343 -8.357 6.037 495 HE22 GLN 61 HE22 GLN 61 -21.168 -8.615 7.739 496 H GLY 62 HN GLY 62 -15.719 -6.452 2.601 497 HA2 GLY 62 HA2 GLY 62 -15.287 -9.248 1.895 498 HA3 GLY 62 HA1 GLY 62 -15.266 -8.080 0.581 499 H VAL 63 HN VAL 63 -13.186 -9.869 1.845 500 HA VAL 63 HA VAL 63 -11.197 -7.812 2.492 501 HB VAL 63 HB VAL 63 -11.295 -9.532 4.179 502 HG11 VAL 63 HG11 VAL 63 -10.836 -11.887 3.702 503 HG12 VAL 63 HG12 VAL 63 -10.798 -11.528 1.976 504 HG13 VAL 63 HG13 VAL 63 -12.296 -11.332 2.885 505 HG21 VAL 63 HG21 VAL 63 -9.094 -8.644 3.659 506 HG22 VAL 63 HG22 VAL 63 -8.861 -9.904 2.445 507 HG23 VAL 63 HG23 VAL 63 -8.988 -10.336 4.151 508 H GLY 64 HN GLY 64 -9.641 -7.326 1.074 509 HA2 GLY 64 HA2 GLY 64 -8.915 -9.191 -1.022 510 HA3 GLY 64 HA1 GLY 64 -9.774 -7.757 -1.564 511 H GLN 65 HN GLN 65 -7.304 -8.243 -2.508 512 HA GLN 65 HA GLN 65 -5.484 -6.475 -1.035 513 HB2 GLN 65 HB2 GLN 65 -4.968 -8.293 -3.408 514 HB3 GLN 65 HB1 GLN 65 -3.753 -7.332 -2.586 515 HG2 GLN 65 HG2 GLN 65 -5.367 -9.440 -1.188 516 HG3 GLN 65 HG1 GLN 65 -3.865 -9.799 -2.032 517 HE21 GLN 65 HE21 GLN 65 -2.416 -7.483 -1.291 518 HE22 GLN 65 HE22 GLN 65 -2.096 -7.573 0.396 519 H VAL 66 HN VAL 66 -5.030 -4.492 -1.828 520 HA VAL 66 HA VAL 66 -6.074 -3.829 -4.499 521 HB VAL 66 HB VAL 66 -6.463 -2.397 -1.880 522 HG11 VAL 66 HG11 VAL 66 -5.584 -0.765 -3.561 523 HG12 VAL 66 HG12 VAL 66 -7.206 -0.423 -2.957 524 HG13 VAL 66 HG13 VAL 66 -6.991 -1.135 -4.562 525 HG21 VAL 66 HG21 VAL 66 -8.349 -3.101 -4.123 526 HG22 VAL 66 HG22 VAL 66 -8.786 -2.368 -2.577 527 HG23 VAL 66 HG23 VAL 66 -8.145 -4.011 -2.626 528 H ARG 67 HN ARG 67 -4.433 -3.284 -5.762 529 HA ARG 67 HA ARG 67 -2.048 -2.075 -4.557 530 HB2 ARG 67 HB2 ARG 67 -1.688 -4.116 -5.912 531 HB3 ARG 67 HB1 ARG 67 -2.415 -3.314 -7.298 532 HG2 ARG 67 HG2 ARG 67 -0.612 -1.579 -7.118 533 HG3 ARG 67 HG1 ARG 67 0.159 -2.611 -5.913 534 HD2 ARG 67 HD2 ARG 67 -0.481 -3.399 -8.751 535 HD3 ARG 67 HD1 ARG 67 1.106 -2.916 -8.159 536 HE ARG 67 HE ARG 67 -0.006 -5.117 -6.702 537 HH11 ARG 67 HH11 ARG 67 1.813 -4.160 -9.534 538 HH12 ARG 67 HH12 ARG 67 2.538 -5.728 -9.752 539 HH21 ARG 67 HH21 ARG 67 0.962 -7.184 -6.978 540 HH22 ARG 67 HH22 ARG 67 2.058 -7.444 -8.303 541 H PHE 68 HN PHE 68 -1.280 -0.095 -5.281 542 HA PHE 68 HA PHE 68 -2.542 1.253 -7.463 543 HB2 PHE 68 HB2 PHE 68 -3.122 3.237 -5.852 544 HB3 PHE 68 HB1 PHE 68 -4.261 1.922 -6.091 545 HD1 PHE 68 HD1 PHE 68 -1.280 2.435 -3.874 546 HD2 PHE 68 HD2 PHE 68 -5.401 1.436 -4.191 547 HE1 PHE 68 HE1 PHE 68 -1.378 2.075 -1.443 548 HE2 PHE 68 HE2 PHE 68 -5.506 1.076 -1.763 549 HZ PHE 68 HZ PHE 68 -3.498 1.395 -0.386 550 H THR 69 HN THR 69 -1.502 3.125 -8.082 551 HA THR 69 HA THR 69 1.129 3.618 -6.849 552 HB THR 69 HB THR 69 0.129 4.736 -9.476 553 HG1 THR 69 HG1 THR 69 1.602 2.917 -10.261 554 HG21 THR 69 HG21 THR 69 2.541 4.951 -9.929 555 HG22 THR 69 HG22 THR 69 2.890 4.306 -8.323 556 HG23 THR 69 HG23 THR 69 2.062 5.854 -8.491 557 H LEU 70 HN LEU 70 1.461 5.409 -5.757 558 HA LEU 70 HA LEU 70 -0.725 7.379 -5.687 559 HB2 LEU 70 HB2 LEU 70 1.037 6.445 -3.425 560 HB3 LEU 70 HB1 LEU 70 -0.267 7.613 -3.305 561 HG LEU 70 HG LEU 70 -0.728 4.776 -4.206 562 HD11 LEU 70 HD11 LEU 70 -1.461 4.298 -1.910 563 HD12 LEU 70 HD12 LEU 70 -0.883 5.891 -1.406 564 HD13 LEU 70 HD13 LEU 70 0.261 4.680 -1.996 565 HD21 LEU 70 HD21 LEU 70 -3.037 5.263 -3.537 566 HD22 LEU 70 HD22 LEU 70 -2.472 6.374 -4.784 567 HD23 LEU 70 HD23 LEU 70 -2.564 6.907 -3.106 568 H ASP 71 HN ASP 71 -0.217 9.458 -5.841 569 HA ASP 71 HA ASP 71 2.451 10.227 -6.548 570 HB2 ASP 71 HB2 ASP 71 0.326 11.229 -7.497 571 HB3 ASP 71 HB1 ASP 71 0.098 12.021 -5.937 572 H ARG 72 HN ARG 72 3.770 11.717 -5.435 573 HA ARG 72 HA ARG 72 4.093 11.399 -2.703 574 HB2 ARG 72 HB2 ARG 72 5.886 12.208 -4.079 575 HB3 ARG 72 HB1 ARG 72 4.973 13.643 -4.520 576 HG2 ARG 72 HG2 ARG 72 5.061 14.374 -2.160 577 HG3 ARG 72 HG1 ARG 72 6.077 12.979 -1.800 578 HD2 ARG 72 HD2 ARG 72 7.350 15.076 -2.143 579 HD3 ARG 72 HD1 ARG 72 7.802 13.787 -3.258 580 HE ARG 72 HE ARG 72 7.022 15.040 -5.009 581 HH11 ARG 72 HH11 ARG 72 5.870 16.458 -2.004 582 HH12 ARG 72 HH12 ARG 72 5.377 17.940 -2.760 583 HH21 ARG 72 HH21 ARG 72 6.308 16.974 -5.989 584 HH22 ARG 72 HH22 ARG 72 5.590 18.226 -5.016 585 H GLN 73 HN GLN 73 2.003 13.617 -4.420 586 HA GLN 73 HA GLN 73 1.475 15.214 -2.058 587 HB2 GLN 73 HB2 GLN 73 0.003 15.186 -4.695 588 HB3 GLN 73 HB1 GLN 73 -0.103 16.423 -3.449 589 HG2 GLN 73 HG2 GLN 73 2.263 16.964 -3.814 590 HG3 GLN 73 HG1 GLN 73 2.327 15.749 -5.088 591 HE21 GLN 73 HE21 GLN 73 2.799 17.140 -6.734 592 HE22 GLN 73 HE22 GLN 73 1.689 18.331 -7.318 593 H GLY 74 HN GLY 74 0.623 12.197 -2.968 594 HA2 GLY 74 HA2 GLY 74 -0.795 10.765 -1.801 595 HA3 GLY 74 HA1 GLY 74 -1.621 12.160 -1.135 596 H HIS 75 HN HIS 75 -1.078 11.959 -4.541 597 HA HIS 75 HA HIS 75 -3.974 11.832 -4.932 598 HB2 HIS 75 HB2 HIS 75 -2.692 13.703 -5.945 599 HB3 HIS 75 HB1 HIS 75 -1.778 12.540 -6.895 600 HD1 HIS 75 HD1 HIS 75 -5.154 14.151 -6.637 601 HD2 HIS 75 HD2 HIS 75 -3.080 11.565 -9.153 602 HE1 HIS 75 HE1 HIS 75 -6.562 13.943 -8.714 603 HE2 HIS 75 HE2 HIS 75 -5.282 12.394 -10.238 604 H VAL 76 HN VAL 76 -4.800 9.885 -5.281 605 HA VAL 76 HA VAL 76 -3.653 7.561 -6.120 606 HB VAL 76 HB VAL 76 -5.924 7.576 -5.366 607 HG11 VAL 76 HG11 VAL 76 -6.633 9.136 -7.847 608 HG12 VAL 76 HG12 VAL 76 -6.583 9.774 -6.202 609 HG13 VAL 76 HG13 VAL 76 -7.766 8.537 -6.633 610 HG21 VAL 76 HG21 VAL 76 -5.353 5.757 -6.878 611 HG22 VAL 76 HG22 VAL 76 -5.850 6.730 -8.262 612 HG23 VAL 76 HG23 VAL 76 -7.045 6.219 -7.068 613 H LEU 77 HN LEU 77 -2.585 6.956 -7.867 614 HA LEU 77 HA LEU 77 -2.960 8.493 -10.350 615 HB2 LEU 77 HB2 LEU 77 -0.587 6.835 -9.497 616 HB3 LEU 77 HB1 LEU 77 -0.696 7.822 -10.943 617 HG LEU 77 HG LEU 77 -0.807 8.911 -8.134 618 HD11 LEU 77 HD11 LEU 77 1.364 7.895 -8.625 619 HD12 LEU 77 HD12 LEU 77 1.465 9.649 -8.477 620 HD13 LEU 77 HD13 LEU 77 1.498 8.893 -10.072 621 HD21 LEU 77 HD21 LEU 77 -0.476 10.290 -10.796 622 HD22 LEU 77 HD22 LEU 77 -0.470 11.065 -9.211 623 HD23 LEU 77 HD23 LEU 77 -1.938 10.290 -9.806 624 H ALA 78 HN ALA 78 -2.265 5.235 -9.142 625 HA ALA 78 HA ALA 78 -3.627 4.129 -11.508 626 HB1 ALA 78 HB1 ALA 78 -1.951 2.400 -11.702 627 HB2 ALA 78 HB2 ALA 78 -1.093 3.027 -10.293 628 HB3 ALA 78 HB3 ALA 78 -1.162 3.977 -11.781 629 H VAL 79 HN VAL 79 -4.601 2.073 -11.153 630 HA VAL 79 HA VAL 79 -4.492 0.989 -8.447 631 HB VAL 79 HB VAL 79 -7.098 1.408 -9.936 632 HG11 VAL 79 HG11 VAL 79 -6.526 0.187 -7.237 633 HG12 VAL 79 HG12 VAL 79 -7.089 -0.662 -8.678 634 HG13 VAL 79 HG13 VAL 79 -8.133 0.519 -7.886 635 HG21 VAL 79 HG21 VAL 79 -6.259 3.501 -8.961 636 HG22 VAL 79 HG22 VAL 79 -6.132 2.710 -7.388 637 HG23 VAL 79 HG23 VAL 79 -7.713 2.933 -8.138 638 H THR 80 HN THR 80 -4.028 -1.074 -8.556 639 HA THR 80 HA THR 80 -4.729 -2.580 -10.990 640 HB THR 80 HB THR 80 -2.326 -3.010 -9.193 641 HG1 THR 80 HG1 THR 80 -2.738 -1.484 -11.497 642 HG21 THR 80 HG21 THR 80 -3.165 -5.056 -10.297 643 HG22 THR 80 HG22 THR 80 -1.581 -4.572 -10.906 644 HG23 THR 80 HG23 THR 80 -3.031 -4.249 -11.857 645 H LEU 81 HN LEU 81 -6.476 -3.769 -10.417 646 HA LEU 81 HA LEU 81 -6.969 -4.568 -7.744 647 HB2 LEU 81 HB2 LEU 81 -8.740 -4.223 -9.465 648 HB3 LEU 81 HB1 LEU 81 -8.220 -5.713 -10.236 649 HG LEU 81 HG LEU 81 -8.710 -6.904 -8.073 650 HD11 LEU 81 HD11 LEU 81 -10.225 -5.776 -6.497 651 HD12 LEU 81 HD12 LEU 81 -10.004 -4.267 -7.385 652 HD13 LEU 81 HD13 LEU 81 -8.635 -5.018 -6.566 653 HD21 LEU 81 HD21 LEU 81 -10.246 -6.992 -9.967 654 HD22 LEU 81 HD22 LEU 81 -11.011 -5.495 -9.431 655 HD23 LEU 81 HD23 LEU 81 -11.133 -6.950 -8.442 656 H VAL 82 HN VAL 82 -5.829 -5.965 -6.719 657 HA VAL 82 HA VAL 82 -4.612 -8.237 -8.100 658 HB VAL 82 HB VAL 82 -3.725 -8.280 -5.470 659 HG11 VAL 82 HG11 VAL 82 -1.626 -7.422 -6.392 660 HG12 VAL 82 HG12 VAL 82 -2.476 -6.864 -7.831 661 HG13 VAL 82 HG13 VAL 82 -2.358 -8.593 -7.493 662 HG21 VAL 82 HG21 VAL 82 -3.890 -5.413 -6.405 663 HG22 VAL 82 HG22 VAL 82 -3.065 -5.991 -4.954 664 HG23 VAL 82 HG23 VAL 82 -4.824 -6.111 -5.077 665 H SER 83 HN SER 83 -6.325 -7.540 -5.058 666 HA SER 83 HA SER 83 -8.019 -8.578 -3.982 667 HB2 SER 83 HB2 SER 83 -9.062 -8.556 -6.218 668 HB3 SER 83 HB1 SER 83 -8.375 -10.149 -6.544 669 HG SER 83 HG SER 83 -10.544 -10.266 -5.795 670 H SER 84 HN SER 84 -8.919 -10.952 -3.519 671 HA SER 84 HA SER 84 -6.659 -12.770 -3.156 672 HB2 SER 84 HB2 SER 84 -8.415 -11.795 -0.889 673 HB3 SER 84 HB1 SER 84 -7.180 -13.047 -0.763 674 HG SER 84 HG SER 84 -5.639 -11.451 -1.388 675 H ALA 85 HN ALA 85 -10.025 -12.499 -1.965 676 HA ALA 85 HA ALA 85 -10.346 -15.328 -2.626 677 HB1 ALA 85 HB1 ALA 85 -12.236 -15.317 -1.105 678 HB2 ALA 85 HB2 ALA 85 -12.072 -13.576 -0.889 679 HB3 ALA 85 HB3 ALA 85 -10.802 -14.660 -0.321 680 H GLY 86 HN GLY 86 -12.724 -12.666 -2.529 681 HA2 GLY 86 HA2 GLY 86 -13.428 -12.808 -5.254 682 HA3 GLY 86 HA1 GLY 86 -14.459 -13.890 -4.325 683 H LEU 87 HN LEU 87 -13.726 -10.612 -5.108 684 HA LEU 87 HA LEU 87 -16.070 -9.777 -3.510 685 HB2 LEU 87 HB2 LEU 87 -13.896 -7.884 -4.354 686 HB3 LEU 87 HB1 LEU 87 -15.153 -7.614 -3.183 687 HG LEU 87 HG LEU 87 -13.195 -7.777 -1.936 688 HD11 LEU 87 HD11 LEU 87 -13.401 -9.837 -0.628 689 HD12 LEU 87 HD12 LEU 87 -14.485 -10.490 -1.857 690 HD13 LEU 87 HD13 LEU 87 -14.954 -9.061 -0.935 691 HD21 LEU 87 HD21 LEU 87 -11.731 -8.643 -3.670 692 HD22 LEU 87 HD22 LEU 87 -12.442 -10.246 -3.487 693 HD23 LEU 87 HD23 LEU 87 -11.524 -9.532 -2.162 694 HA PRO 88 HA PRO 88 -16.795 -8.957 -8.046 695 HB2 PRO 88 HB2 PRO 88 -19.240 -10.508 -7.850 696 HB3 PRO 88 HB1 PRO 88 -17.818 -10.816 -8.849 697 HG2 PRO 88 HG2 PRO 88 -18.536 -12.396 -6.748 698 HG3 PRO 88 HG1 PRO 88 -16.860 -12.196 -7.291 699 HD2 PRO 88 HD2 PRO 88 -18.284 -10.868 -5.007 700 HD3 PRO 88 HD1 PRO 88 -16.643 -11.553 -5.065 701 H SER 89 HN SER 89 -19.737 -9.516 -6.107 702 HA SER 89 HA SER 89 -20.939 -7.084 -7.007 703 HB2 SER 89 HB2 SER 89 -22.178 -9.189 -6.344 704 HB3 SER 89 HB1 SER 89 -21.792 -8.809 -4.668 705 HG SER 89 HG SER 89 -23.362 -7.426 -4.662 706 H LEU 90 HN LEU 90 -18.773 -7.921 -4.550 707 HA LEU 90 HA LEU 90 -19.415 -5.873 -2.655 708 HB2 LEU 90 HB2 LEU 90 -16.916 -7.531 -2.998 709 HB3 LEU 90 HB1 LEU 90 -17.285 -6.525 -1.609 710 HG LEU 90 HG LEU 90 -19.075 -8.786 -2.442 711 HD11 LEU 90 HD11 LEU 90 -16.694 -9.524 -2.043 712 HD12 LEU 90 HD12 LEU 90 -17.911 -10.245 -0.980 713 HD13 LEU 90 HD13 LEU 90 -16.884 -8.938 -0.387 714 HD21 LEU 90 HD21 LEU 90 -18.637 -7.352 0.166 715 HD22 LEU 90 HD22 LEU 90 -19.789 -8.655 -0.128 716 HD23 LEU 90 HD23 LEU 90 -19.993 -7.101 -0.936 717 H ASP 91 HN ASP 91 -17.400 -6.126 -5.465 718 HA ASP 91 HA ASP 91 -15.365 -4.333 -4.908 719 HB2 ASP 91 HB2 ASP 91 -15.450 -5.815 -6.897 720 HB3 ASP 91 HB1 ASP 91 -16.666 -4.759 -7.604 721 H ARG 92 HN ARG 92 -18.552 -3.656 -6.288 722 HA ARG 92 HA ARG 92 -18.079 -1.097 -7.195 723 HB2 ARG 92 HB2 ARG 92 -20.533 -0.750 -7.008 724 HB3 ARG 92 HB1 ARG 92 -20.085 -2.255 -7.799 725 HG2 ARG 92 HG2 ARG 92 -20.443 -3.399 -5.589 726 HG3 ARG 92 HG1 ARG 92 -21.135 -1.884 -5.006 727 HD2 ARG 92 HD2 ARG 92 -22.935 -3.280 -5.716 728 HD3 ARG 92 HD1 ARG 92 -22.753 -1.992 -6.909 729 HE ARG 92 HE ARG 92 -21.238 -3.971 -7.944 730 HH11 ARG 92 HH11 ARG 92 -24.542 -3.868 -6.771 731 HH12 ARG 92 HH12 ARG 92 -25.084 -5.155 -7.804 732 HH21 ARG 92 HH21 ARG 92 -21.941 -5.673 -9.283 733 HH22 ARG 92 HH22 ARG 92 -23.596 -6.201 -9.215 734 H GLU 93 HN GLU 93 -19.286 -1.979 -3.934 735 HA GLU 93 HA GLU 93 -19.545 0.758 -3.173 736 HB2 GLU 93 HB2 GLU 93 -20.075 -1.891 -2.021 737 HB3 GLU 93 HB1 GLU 93 -19.707 -0.637 -0.864 738 HG2 GLU 93 HG2 GLU 93 -22.055 -0.686 -1.084 739 HG3 GLU 93 HG1 GLU 93 -21.505 0.747 -1.950 740 H ILE 94 HN ILE 94 -17.372 -1.868 -2.076 741 HA ILE 94 HA ILE 94 -16.083 -0.164 -0.192 742 HB ILE 94 HB ILE 94 -14.398 -2.008 0.018 743 HG12 ILE 94 HG12 ILE 94 -16.236 -3.426 -1.922 744 HG13 ILE 94 HG11 ILE 94 -14.591 -2.905 -2.267 745 HG21 ILE 94 HG21 ILE 94 -16.326 -1.862 1.487 746 HG22 ILE 94 HG22 ILE 94 -15.974 -3.550 1.114 747 HG23 ILE 94 HG23 ILE 94 -17.315 -2.734 0.311 748 HD11 ILE 94 HD11 ILE 94 -14.698 -5.288 -1.788 749 HD12 ILE 94 HD12 ILE 94 -15.385 -4.942 -0.200 750 HD13 ILE 94 HD13 ILE 94 -13.739 -4.433 -0.580 751 H GLN 95 HN GLN 95 -15.364 -1.112 -3.488 752 HA GLN 95 HA GLN 95 -12.804 0.191 -3.434 753 HB2 GLN 95 HB2 GLN 95 -14.404 -0.770 -5.782 754 HB3 GLN 95 HB1 GLN 95 -12.732 -0.332 -5.761 755 HG2 GLN 95 HG2 GLN 95 -13.859 -2.613 -4.175 756 HG3 GLN 95 HG1 GLN 95 -13.151 -2.786 -5.782 757 HE21 GLN 95 HE21 GLN 95 -12.328 -4.025 -3.343 758 HE22 GLN 95 HE22 GLN 95 -10.705 -3.518 -3.040 759 H ALA 96 HN ALA 96 -16.080 1.054 -4.018 760 HA ALA 96 HA ALA 96 -15.817 3.213 -5.723 761 HB1 ALA 96 HB1 ALA 96 -17.997 2.440 -4.887 762 HB2 ALA 96 HB2 ALA 96 -17.795 4.180 -4.691 763 HB3 ALA 96 HB3 ALA 96 -17.616 3.111 -3.301 764 H LEU 97 HN LEU 97 -15.665 3.336 -2.130 765 HA LEU 97 HA LEU 97 -14.542 5.963 -2.355 766 HB2 LEU 97 HB2 LEU 97 -14.405 6.107 0.005 767 HB3 LEU 97 HB1 LEU 97 -15.946 5.443 -0.448 768 HG LEU 97 HG LEU 97 -15.342 4.380 1.500 769 HD11 LEU 97 HD11 LEU 97 -15.036 2.034 1.023 770 HD12 LEU 97 HD12 LEU 97 -14.676 2.440 -0.647 771 HD13 LEU 97 HD13 LEU 97 -16.264 2.800 0.022 772 HD21 LEU 97 HD21 LEU 97 -13.033 5.032 1.680 773 HD22 LEU 97 HD22 LEU 97 -12.595 3.844 0.453 774 HD23 LEU 97 HD23 LEU 97 -13.228 3.307 2.005 775 H VAL 98 HN VAL 98 -13.086 2.854 -1.370 776 HA VAL 98 HA VAL 98 -10.504 3.916 -0.978 777 HB VAL 98 HB VAL 98 -11.310 1.080 -1.621 778 HG11 VAL 98 HG11 VAL 98 -9.115 0.421 -0.763 779 HG12 VAL 98 HG12 VAL 98 -8.669 2.119 -0.584 780 HG13 VAL 98 HG13 VAL 98 -8.959 1.447 -2.188 781 HG21 VAL 98 HG21 VAL 98 -12.271 1.635 0.429 782 HG22 VAL 98 HG22 VAL 98 -10.897 2.628 0.910 783 HG23 VAL 98 HG23 VAL 98 -10.747 0.866 0.882 784 H LYS 99 HN LYS 99 -11.852 2.284 -3.858 785 HA LYS 99 HA LYS 99 -9.312 2.275 -5.186 786 HB2 LYS 99 HB2 LYS 99 -11.040 0.516 -5.558 787 HB3 LYS 99 HB1 LYS 99 -12.061 1.707 -6.341 788 HG2 LYS 99 HG2 LYS 99 -10.278 2.032 -8.047 789 HG3 LYS 99 HG1 LYS 99 -9.379 0.716 -7.289 790 HD2 LYS 99 HD2 LYS 99 -12.154 0.491 -8.457 791 HD3 LYS 99 HD1 LYS 99 -10.666 -0.040 -9.241 792 HE2 LYS 99 HE2 LYS 99 -10.273 -1.653 -7.467 793 HE3 LYS 99 HE1 LYS 99 -11.702 -1.082 -6.603 794 HZ1 LYS 99 HZ1 LYS 99 -13.033 -1.776 -8.557 795 HZ2 LYS 99 HZ2 LYS 99 -12.273 -3.065 -7.778 796 HZ3 LYS 99 HZ3 LYS 99 -11.643 -2.462 -9.236 797 H ARG 100 HN ARG 100 -12.121 4.399 -5.170 798 HA ARG 100 HA ARG 100 -11.220 5.906 -7.449 799 HB2 ARG 100 HB2 ARG 100 -13.553 5.910 -7.045 800 HB3 ARG 100 HB1 ARG 100 -13.343 6.341 -5.361 801 HG2 ARG 100 HG2 ARG 100 -12.517 8.242 -7.516 802 HG3 ARG 100 HG1 ARG 100 -14.210 8.104 -7.040 803 HD2 ARG 100 HD2 ARG 100 -13.251 8.382 -4.626 804 HD3 ARG 100 HD1 ARG 100 -11.860 9.071 -5.461 805 HE ARG 100 HE ARG 100 -13.998 10.392 -6.526 806 HH11 ARG 100 HH11 ARG 100 -12.810 9.861 -3.277 807 HH12 ARG 100 HH12 ARG 100 -13.462 11.336 -2.642 808 HH21 ARG 100 HH21 ARG 100 -14.893 12.334 -5.699 809 HH22 ARG 100 HH22 ARG 100 -14.670 12.739 -4.019 810 H ALA 101 HN ALA 101 -10.990 6.250 -3.929 811 HA ALA 101 HA ALA 101 -9.252 8.589 -4.367 812 HB1 ALA 101 HB1 ALA 101 -9.985 9.512 -2.303 813 HB2 ALA 101 HB2 ALA 101 -10.873 8.044 -1.894 814 HB3 ALA 101 HB3 ALA 101 -11.420 9.064 -3.227 815 H SER 102 HN SER 102 -7.582 6.846 -4.603 816 HA SER 102 HA SER 102 -6.721 5.623 -2.144 817 HB2 SER 102 HB2 SER 102 -5.258 5.785 -4.781 818 HB3 SER 102 HB1 SER 102 -4.914 4.682 -3.452 819 HG SER 102 HG SER 102 -7.423 4.291 -3.965 820 HA PRO 103 HA PRO 103 -4.431 9.352 -1.199 821 HB2 PRO 103 HB2 PRO 103 -4.804 8.987 1.537 822 HB3 PRO 103 HB1 PRO 103 -5.931 9.797 0.440 823 HG2 PRO 103 HG2 PRO 103 -6.330 7.344 1.823 824 HG3 PRO 103 HG1 PRO 103 -7.408 8.104 0.642 825 HD2 PRO 103 HD2 PRO 103 -5.412 5.931 0.264 826 HD3 PRO 103 HD1 PRO 103 -6.942 6.230 -0.593 827 H LEU 104 HN LEU 104 -2.334 9.685 -0.801 828 HA LEU 104 HA LEU 104 -0.798 7.655 0.693 829 HB2 LEU 104 HB2 LEU 104 -0.158 7.903 -1.692 830 HB3 LEU 104 HB1 LEU 104 0.160 9.603 -1.415 831 HG LEU 104 HG LEU 104 1.946 8.911 0.224 832 HD11 LEU 104 HD11 LEU 104 2.841 6.609 -0.063 833 HD12 LEU 104 HD12 LEU 104 1.382 6.199 -0.967 834 HD13 LEU 104 HD13 LEU 104 1.264 6.666 0.730 835 HD21 LEU 104 HD21 LEU 104 3.567 8.359 -1.528 836 HD22 LEU 104 HD22 LEU 104 2.481 9.658 -2.024 837 HD23 LEU 104 HD23 LEU 104 2.241 8.023 -2.640 838 HA PRO 105 HA PRO 105 -0.871 11.443 3.235 839 HB2 PRO 105 HB2 PRO 105 -0.891 10.216 5.648 840 HB3 PRO 105 HB1 PRO 105 -2.339 10.449 4.666 841 HG2 PRO 105 HG2 PRO 105 -0.749 7.998 5.137 842 HG3 PRO 105 HG1 PRO 105 -2.474 8.178 4.796 843 HD2 PRO 105 HD2 PRO 105 -0.504 7.412 2.957 844 HD3 PRO 105 HD1 PRO 105 -2.160 7.930 2.574 845 H THR 106 HN THR 106 1.216 8.653 3.895 846 HA THR 106 HA THR 106 3.249 10.482 4.947 847 HB THR 106 HB THR 106 3.213 7.456 5.071 848 HG1 THR 106 HG1 THR 106 2.628 7.929 7.342 849 HG21 THR 106 HG21 THR 106 4.841 9.513 6.575 850 HG22 THR 106 HG22 THR 106 5.437 8.458 5.294 851 HG23 THR 106 HG23 THR 106 4.899 7.765 6.824 852 HA PRO 107 HA PRO 107 4.912 10.216 0.789 853 HB2 PRO 107 HB2 PRO 107 7.141 11.709 2.039 854 HB3 PRO 107 HB1 PRO 107 6.146 12.131 0.642 855 HG2 PRO 107 HG2 PRO 107 5.837 13.387 2.974 856 HG3 PRO 107 HG1 PRO 107 4.441 12.994 1.953 857 HD2 PRO 107 HD2 PRO 107 5.436 11.613 4.417 858 HD3 PRO 107 HD1 PRO 107 3.767 11.978 3.929 859 HA PRO 108 HA PRO 108 7.923 6.967 1.788 860 HB2 PRO 108 HB2 PRO 108 7.141 5.221 -0.043 861 HB3 PRO 108 HB1 PRO 108 6.120 5.527 1.368 862 HG2 PRO 108 HG2 PRO 108 5.844 6.544 -1.430 863 HG3 PRO 108 HG1 PRO 108 4.583 5.978 -0.322 864 HD2 PRO 108 HD2 PRO 108 5.279 8.642 -0.773 865 HD3 PRO 108 HD1 PRO 108 4.364 8.040 0.623 866 H ALA 109 HN ALA 109 9.163 8.980 0.799 867 HA ALA 109 HA ALA 109 9.852 9.063 -1.901 868 HB1 ALA 109 HB1 ALA 109 11.567 9.773 0.472 869 HB2 ALA 109 HB2 ALA 109 10.440 10.850 -0.358 870 HB3 ALA 109 HB3 ALA 109 11.871 10.250 -1.199 871 H ASP 110 HN ASP 110 11.163 7.196 0.760 872 HA ASP 110 HA ASP 110 13.332 6.087 -0.724 873 HB2 ASP 110 HB2 ASP 110 12.085 5.135 1.860 874 HB3 ASP 110 HB1 ASP 110 13.645 4.629 1.224 875 H ALA 111 HN ALA 111 10.153 5.646 -1.109 876 HA ALA 111 HA ALA 111 10.400 2.779 -1.711 877 HB1 ALA 111 HB1 ALA 111 7.994 2.629 -1.533 878 HB2 ALA 111 HB2 ALA 111 7.879 4.367 -1.254 879 HB3 ALA 111 HB3 ALA 111 8.667 3.330 -0.061 880 H TYR 112 HN TYR 112 9.679 5.945 -3.107 881 HA TYR 112 HA TYR 112 9.085 4.515 -5.587 882 HB2 TYR 112 HB2 TYR 112 8.332 6.824 -6.455 883 HB3 TYR 112 HB1 TYR 112 7.294 5.805 -5.496 884 HD1 TYR 112 HD2 TYR 112 9.824 8.481 -4.740 885 HD2 TYR 112 HD1 TYR 112 5.925 6.901 -4.172 886 HE1 TYR 112 HE2 TYR 112 9.273 10.370 -3.254 887 HE2 TYR 112 HE1 TYR 112 5.348 8.760 -2.711 888 HH TYR 112 HH TYR 112 6.457 10.409 -1.306 889 H VAL 113 HN VAL 113 11.698 5.407 -4.334 890 HA VAL 113 HA VAL 113 12.916 6.774 -6.533 891 HB VAL 113 HB VAL 113 15.077 5.693 -5.601 892 HG11 VAL 113 HG11 VAL 113 13.436 7.516 -3.841 893 HG12 VAL 113 HG12 VAL 113 14.425 8.019 -5.211 894 HG13 VAL 113 HG13 VAL 113 15.189 7.323 -3.782 895 HG21 VAL 113 HG21 VAL 113 13.290 5.158 -3.228 896 HG22 VAL 113 HG22 VAL 113 15.012 4.806 -3.382 897 HG23 VAL 113 HG23 VAL 113 13.839 3.902 -4.341 898 H ASN 114 HN ASN 114 12.242 5.841 -8.351 899 HA ASN 114 HA ASN 114 13.274 3.870 -9.784 900 HB2 ASN 114 HB2 ASN 114 12.212 1.778 -9.449 901 HB3 ASN 114 HB1 ASN 114 12.676 2.291 -7.835 902 HD21 ASN 114 HD21 ASN 114 10.569 4.125 -7.365 903 HD22 ASN 114 HD22 ASN 114 9.101 3.223 -7.224 904 H GLY 115 HN GLY 115 10.763 5.835 -8.838 905 HA2 GLY 115 HA2 GLY 115 9.799 6.724 -11.130 906 HA3 GLY 115 HA1 GLY 115 8.973 5.176 -11.042 907 H THR 116 HN THR 116 7.610 4.778 -9.192 908 HA THR 116 HA THR 116 6.771 6.947 -7.501 909 HB THR 116 HB THR 116 4.573 5.730 -9.147 910 HG1 THR 116 HG1 THR 116 6.431 7.675 -10.015 911 HG21 THR 116 HG21 THR 116 3.828 7.087 -7.357 912 HG22 THR 116 HG22 THR 116 3.666 8.084 -8.799 913 HG23 THR 116 HG23 THR 116 5.025 8.330 -7.703 914 H VAL 117 HN VAL 117 4.696 5.869 -6.157 915 HA VAL 117 HA VAL 117 5.751 3.211 -5.525 916 HB VAL 117 HB VAL 117 4.319 3.373 -3.445 917 HG11 VAL 117 HG11 VAL 117 5.832 4.955 -2.279 918 HG12 VAL 117 HG12 VAL 117 6.518 5.376 -3.852 919 HG13 VAL 117 HG13 VAL 117 6.658 3.726 -3.241 920 HG21 VAL 117 HG21 VAL 117 3.606 5.605 -2.709 921 HG22 VAL 117 HG22 VAL 117 2.746 5.073 -4.154 922 HG23 VAL 117 HG23 VAL 117 4.049 6.256 -4.291 923 H GLU 118 HN GLU 118 4.823 1.794 -6.780 924 HA GLU 118 HA GLU 118 1.898 1.587 -6.685 925 HB2 GLU 118 HB2 GLU 118 3.107 1.412 -8.921 926 HB3 GLU 118 HB1 GLU 118 3.835 -0.072 -8.320 927 HG2 GLU 118 HG2 GLU 118 1.497 -0.939 -7.971 928 HG3 GLU 118 HG1 GLU 118 0.934 0.479 -8.857 929 H LEU 119 HN LEU 119 1.282 0.469 -4.947 930 HA LEU 119 HA LEU 119 2.881 -1.845 -4.168 931 HB2 LEU 119 HB2 LEU 119 3.077 -1.154 -1.882 932 HB3 LEU 119 HB1 LEU 119 3.734 0.100 -2.909 933 HG LEU 119 HG LEU 119 1.149 0.966 -2.542 934 HD11 LEU 119 HD11 LEU 119 0.695 0.769 -0.173 935 HD12 LEU 119 HD12 LEU 119 2.101 -0.277 0.023 936 HD13 LEU 119 HD13 LEU 119 0.727 -0.815 -0.945 937 HD21 LEU 119 HD21 LEU 119 3.570 1.584 -0.849 938 HD22 LEU 119 HD22 LEU 119 2.135 2.595 -1.011 939 HD23 LEU 119 HD23 LEU 119 3.185 2.323 -2.405 940 H THR 120 HN THR 120 1.792 -3.380 -2.951 941 HA THR 120 HA THR 120 -1.080 -3.287 -3.415 942 HB THR 120 HB THR 120 0.646 -5.628 -2.594 943 HG1 THR 120 HG1 THR 120 1.286 -5.353 -4.620 944 HG21 THR 120 HG21 THR 120 -1.762 -5.785 -2.041 945 HG22 THR 120 HG22 THR 120 -1.235 -6.991 -3.219 946 HG23 THR 120 HG23 THR 120 -2.136 -5.570 -3.751 947 H LEU 121 HN LEU 121 -2.270 -2.558 -1.801 948 HA LEU 121 HA LEU 121 -1.568 -3.387 0.934 949 HB2 LEU 121 HB2 LEU 121 -2.950 -0.917 -0.089 950 HB3 LEU 121 HB1 LEU 121 -3.106 -1.437 1.582 951 HG LEU 121 HG LEU 121 -0.542 -0.698 0.178 952 HD11 LEU 121 HD11 LEU 121 -1.793 1.255 0.663 953 HD12 LEU 121 HD12 LEU 121 -0.522 1.122 1.873 954 HD13 LEU 121 HD13 LEU 121 -2.182 0.682 2.285 955 HD21 LEU 121 HD21 LEU 121 -0.224 -2.525 1.767 956 HD22 LEU 121 HD22 LEU 121 -1.024 -1.577 3.022 957 HD23 LEU 121 HD23 LEU 121 0.514 -1.029 2.353 958 HA PRO 122 HA PRO 122 -5.353 -5.668 0.584 959 HB2 PRO 122 HB2 PRO 122 -5.097 -6.401 3.358 960 HB3 PRO 122 HB1 PRO 122 -4.830 -7.405 1.932 961 HG2 PRO 122 HG2 PRO 122 -2.847 -6.581 3.669 962 HG3 PRO 122 HG1 PRO 122 -2.578 -7.094 1.994 963 HD2 PRO 122 HD2 PRO 122 -2.689 -4.348 3.144 964 HD3 PRO 122 HD1 PRO 122 -1.703 -4.976 1.806 965 H ILE 123 HN ILE 123 -7.175 -4.497 0.615 966 HA ILE 123 HA ILE 123 -7.775 -2.921 2.992 967 HB ILE 123 HB ILE 123 -9.621 -1.952 1.777 968 HG12 ILE 123 HG12 ILE 123 -8.973 -3.764 -0.558 969 HG13 ILE 123 HG11 ILE 123 -10.309 -4.035 0.559 970 HG21 ILE 123 HG21 ILE 123 -8.424 -1.014 -0.239 971 HG22 ILE 123 HG22 ILE 123 -7.104 -2.126 0.128 972 HG23 ILE 123 HG23 ILE 123 -7.556 -0.881 1.294 973 HD11 ILE 123 HD11 ILE 123 -9.966 -1.616 -1.196 974 HD12 ILE 123 HD12 ILE 123 -11.309 -1.915 -0.089 975 HD13 ILE 123 HD13 ILE 123 -11.066 -2.964 -1.487 976 H ASP 124 HN ASP 124 -8.333 -4.309 4.565 977 HA ASP 124 HA ASP 124 -9.954 -6.601 3.774 978 HB2 ASP 124 HB2 ASP 124 -9.309 -7.552 5.980 979 HB3 ASP 124 HB1 ASP 124 -7.942 -7.202 4.929 980 H PHE 125 HN PHE 125 -11.974 -6.524 3.995 981 HA PHE 125 HA PHE 125 -13.116 -5.455 6.485 982 HB2 PHE 125 HB2 PHE 125 -14.472 -6.043 3.841 983 HB3 PHE 125 HB1 PHE 125 -15.276 -5.417 5.270 984 HD1 PHE 125 HD1 PHE 125 -13.024 -4.631 2.488 985 HD2 PHE 125 HD2 PHE 125 -15.035 -3.092 5.915 986 HE1 PHE 125 HE1 PHE 125 -12.553 -2.343 1.733 987 HE2 PHE 125 HE2 PHE 125 -14.561 -0.803 5.160 988 HZ PHE 125 HZ PHE 125 -13.321 -0.425 3.066 989 H SER 126 HN SER 126 -14.306 -6.937 7.751 990 HA SER 126 HA SER 126 -13.640 -9.658 7.435 991 HB2 SER 126 HB2 SER 126 -15.832 -8.438 9.124 992 HB3 SER 126 HB1 SER 126 -15.157 -10.058 9.316 993 HG SER 126 HG SER 126 -13.102 -9.027 9.710 994 H LEU 127 HN LEU 127 -14.285 -10.727 5.711 995 HA LEU 127 HA LEU 127 -16.734 -10.238 4.324 996 HB2 LEU 127 HB2 LEU 127 -14.280 -11.272 3.683 997 HB3 LEU 127 HB1 LEU 127 -15.262 -12.720 3.749 998 HG LEU 127 HG LEU 127 -15.936 -10.323 2.047 999 HD11 LEU 127 HD11 LEU 127 -15.076 -11.584 0.168 1000 HD12 LEU 127 HD12 LEU 127 -14.570 -12.885 1.249 1001 HD13 LEU 127 HD13 LEU 127 -13.807 -11.298 1.358 1002 HD21 LEU 127 HD21 LEU 127 -17.846 -11.716 2.570 1003 HD22 LEU 127 HD22 LEU 127 -16.960 -13.154 2.055 1004 HD23 LEU 127 HD23 LEU 127 -17.385 -11.912 0.875 1005 H ARG 128 HN ARG 128 -17.821 -10.723 6.576 1006 HA ARG 128 HA ARG 128 -18.257 -13.497 7.154 1007 HB2 ARG 128 HB2 ARG 128 -19.617 -10.995 8.166 1008 HB3 ARG 128 HB1 ARG 128 -19.890 -12.608 8.791 1009 HG2 ARG 128 HG2 ARG 128 -17.553 -12.753 9.482 1010 HG3 ARG 128 HG1 ARG 128 -17.270 -11.129 8.851 1011 HD2 ARG 128 HD2 ARG 128 -19.213 -11.842 11.042 1012 HD3 ARG 128 HD1 ARG 128 -17.610 -11.150 11.289 1013 HE ARG 128 HE ARG 128 -18.417 -9.162 10.079 1014 HH11 ARG 128 HH11 ARG 128 -20.757 -11.364 11.488 1015 HH12 ARG 128 HH12 ARG 128 -22.005 -10.158 11.606 1016 HH21 ARG 128 HH21 ARG 128 -20.045 -7.591 10.210 1017 HH22 ARG 128 HH22 ARG 128 -21.608 -8.005 10.842 1018 H GLY 129 HN GLY 129 -20.107 -10.862 5.673 1019 HA2 GLY 129 HA2 GLY 129 -21.445 -12.547 3.873 1020 HA3 GLY 129 HA1 GLY 129 -22.492 -12.275 5.256 1021 H ALA 130 HN ALA 130 -21.980 -11.309 2.253 1022 HA ALA 130 HA ALA 130 -23.377 -8.791 2.707 1023 HB1 ALA 130 HB1 ALA 130 -20.984 -8.204 2.502 1024 HB2 ALA 130 HB2 ALA 130 -21.957 -7.557 1.182 1025 HB3 ALA 130 HB3 ALA 130 -20.950 -8.981 0.916 1026 H GLY 131 HN GLY 131 -25.069 -10.287 1.991 1027 HA2 GLY 131 HA2 GLY 131 -26.465 -10.981 0.220 1028 HA3 GLY 131 HA1 GLY 131 -25.135 -10.705 -0.907 1029 H PHE 132 HN PHE 132 -23.958 -12.177 1.760 1030 HA PHE 132 HA PHE 132 -24.016 -14.825 0.544 1031 HB2 PHE 132 HB2 PHE 132 -22.023 -13.538 2.423 1032 HB3 PHE 132 HB1 PHE 132 -21.930 -15.176 1.822 1033 HD1 PHE 132 HD1 PHE 132 -21.710 -15.520 -0.695 1034 HD2 PHE 132 HD2 PHE 132 -21.106 -11.770 1.221 1035 HE1 PHE 132 HE1 PHE 132 -20.451 -14.726 -2.655 1036 HE2 PHE 132 HE2 PHE 132 -19.848 -10.964 -0.734 1037 HZ PHE 132 HZ PHE 132 -19.519 -12.445 -2.679 Start of MODEL 15 1 H1 LYS 2 HT1 LYS 2 32.591 6.610 -20.641 2 H2 LYS 2 HT2 LYS 2 33.393 7.960 -21.290 3 H3 LYS 2 HT3 LYS 2 31.948 8.164 -20.424 4 HA LYS 2 HA LYS 2 34.489 7.142 -19.297 5 HB2 LYS 2 HB2 LYS 2 33.139 9.835 -19.050 6 HB3 LYS 2 HB1 LYS 2 34.469 9.306 -18.029 7 HG2 LYS 2 HG2 LYS 2 35.875 9.071 -20.035 8 HG3 LYS 2 HG1 LYS 2 34.544 9.693 -21.012 9 HD2 LYS 2 HD2 LYS 2 35.892 11.166 -18.751 10 HD3 LYS 2 HD1 LYS 2 36.200 11.431 -20.468 11 HE2 LYS 2 HE2 LYS 2 33.837 12.060 -20.766 12 HE3 LYS 2 HE1 LYS 2 33.579 11.847 -19.034 13 HZ1 LYS 2 HZ1 LYS 2 35.459 13.787 -20.271 14 HZ2 LYS 2 HZ2 LYS 2 35.193 13.589 -18.608 15 HZ3 LYS 2 HZ3 LYS 2 33.947 14.174 -19.603 16 H VAL 3 HN VAL 3 31.956 5.828 -19.142 17 HA VAL 3 HA VAL 3 31.559 6.010 -16.233 18 HB VAL 3 HB VAL 3 29.134 5.532 -16.557 19 HG11 VAL 3 HG11 VAL 3 29.884 7.801 -16.063 20 HG12 VAL 3 HG12 VAL 3 28.475 7.814 -17.123 21 HG13 VAL 3 HG13 VAL 3 30.078 8.119 -17.789 22 HG21 VAL 3 HG21 VAL 3 28.102 5.959 -18.731 23 HG22 VAL 3 HG22 VAL 3 29.253 4.625 -18.822 24 HG23 VAL 3 HG23 VAL 3 29.697 6.216 -19.441 25 H GLN 4 HN GLN 4 33.107 4.257 -17.997 26 HA GLN 4 HA GLN 4 33.488 2.100 -18.560 27 HB2 GLN 4 HB2 GLN 4 31.699 1.652 -16.171 28 HB3 GLN 4 HB1 GLN 4 32.468 0.334 -17.046 29 HG2 GLN 4 HG2 GLN 4 34.668 1.327 -16.545 30 HG3 GLN 4 HG1 GLN 4 33.861 2.583 -15.606 31 HE21 GLN 4 HE21 GLN 4 35.799 0.491 -14.842 32 HE22 GLN 4 HE22 GLN 4 35.051 -0.374 -13.538 33 H GLU 5 HN GLU 5 32.267 2.797 -20.480 34 HA GLU 5 HA GLU 5 29.571 2.398 -20.928 35 HB2 GLU 5 HB2 GLU 5 31.883 2.157 -22.861 36 HB3 GLU 5 HB1 GLU 5 30.198 2.178 -23.352 37 HG2 GLU 5 HG2 GLU 5 31.034 4.355 -23.685 38 HG3 GLU 5 HG1 GLU 5 29.998 4.424 -22.263 39 H GLN 6 HN GLN 6 32.233 0.103 -21.505 40 HA GLN 6 HA GLN 6 30.221 -2.032 -21.313 41 HB2 GLN 6 HB2 GLN 6 31.003 -1.806 -23.649 42 HB3 GLN 6 HB1 GLN 6 32.655 -2.082 -23.107 43 HG2 GLN 6 HG2 GLN 6 32.137 -4.312 -22.431 44 HG3 GLN 6 HG1 GLN 6 30.416 -4.047 -22.700 45 HE21 GLN 6 HE21 GLN 6 29.611 -4.020 -24.778 46 HE22 GLN 6 HE22 GLN 6 30.509 -4.645 -26.124 47 H SER 7 HN SER 7 30.517 -2.893 -19.405 48 HA SER 7 HA SER 7 33.266 -3.452 -18.510 49 HB2 SER 7 HB2 SER 7 32.176 -3.310 -16.170 50 HB3 SER 7 HB1 SER 7 32.464 -1.800 -17.037 51 HG SER 7 HG SER 7 30.405 -1.504 -16.618 52 H VAL 8 HN VAL 8 33.299 -5.530 -19.374 53 HA VAL 8 HA VAL 8 31.191 -7.395 -18.643 54 HB VAL 8 HB VAL 8 32.373 -9.032 -20.021 55 HG11 VAL 8 HG11 VAL 8 32.054 -6.350 -21.362 56 HG12 VAL 8 HG12 VAL 8 30.791 -7.555 -21.105 57 HG13 VAL 8 HG13 VAL 8 32.136 -7.903 -22.191 58 HG21 VAL 8 HG21 VAL 8 34.413 -6.864 -20.523 59 HG22 VAL 8 HG22 VAL 8 34.373 -8.458 -21.275 60 HG23 VAL 8 HG23 VAL 8 34.675 -8.307 -19.545 61 H GLY 9 HN GLY 9 34.345 -6.462 -17.634 62 HA2 GLY 9 HA2 GLY 9 34.539 -8.814 -15.869 63 HA3 GLY 9 HA1 GLY 9 35.867 -7.740 -16.282 64 H ALA 10 HN ALA 10 32.690 -6.587 -15.395 65 HA ALA 10 HA ALA 10 33.856 -5.474 -12.930 66 HB1 ALA 10 HB1 ALA 10 31.563 -4.407 -14.570 67 HB2 ALA 10 HB2 ALA 10 33.207 -3.768 -14.551 68 HB3 ALA 10 HB3 ALA 10 32.210 -3.681 -13.099 69 HA PRO 11 HA PRO 11 30.833 -8.166 -10.985 70 HB2 PRO 11 HB2 PRO 11 32.119 -7.498 -8.488 71 HB3 PRO 11 HB1 PRO 11 32.179 -9.022 -9.374 72 HG2 PRO 11 HG2 PRO 11 34.324 -7.349 -9.044 73 HG3 PRO 11 HG1 PRO 11 34.154 -8.491 -10.388 74 HD2 PRO 11 HD2 PRO 11 33.637 -5.545 -10.320 75 HD3 PRO 11 HD1 PRO 11 34.380 -6.528 -11.600 76 HA PRO 12 HA PRO 12 28.161 -4.789 -9.647 77 HB2 PRO 12 HB2 PRO 12 26.239 -6.955 -9.155 78 HB3 PRO 12 HB1 PRO 12 26.119 -5.582 -10.259 79 HG2 PRO 12 HG2 PRO 12 26.460 -8.099 -11.151 80 HG3 PRO 12 HG1 PRO 12 27.172 -6.700 -11.978 81 HD2 PRO 12 HD2 PRO 12 28.466 -8.661 -10.118 82 HD3 PRO 12 HD1 PRO 12 29.088 -7.967 -11.631 83 HA PRO 13 HA PRO 13 29.357 -5.490 -5.366 84 HB2 PRO 13 HB2 PRO 13 28.123 -2.812 -5.072 85 HB3 PRO 13 HB1 PRO 13 29.734 -3.367 -4.608 86 HG2 PRO 13 HG2 PRO 13 29.400 -1.776 -6.716 87 HG3 PRO 13 HG1 PRO 13 30.593 -3.090 -6.744 88 HD2 PRO 13 HD2 PRO 13 27.866 -2.975 -7.978 89 HD3 PRO 13 HD1 PRO 13 29.374 -3.642 -8.639 90 H GLY 14 HN GLY 14 28.230 -6.517 -3.870 91 HA2 GLY 14 HA2 GLY 14 26.531 -7.048 -2.413 92 HA3 GLY 14 HA1 GLY 14 25.680 -5.607 -2.950 93 H ARG 15 HN ARG 15 24.356 -5.731 -4.818 94 HA ARG 15 HA ARG 15 23.144 -8.349 -5.084 95 HB2 ARG 15 HB2 ARG 15 22.322 -5.676 -6.226 96 HB3 ARG 15 HB1 ARG 15 21.386 -7.161 -6.352 97 HG2 ARG 15 HG2 ARG 15 21.250 -7.219 -3.876 98 HG3 ARG 15 HG1 ARG 15 22.061 -5.651 -3.836 99 HD2 ARG 15 HD2 ARG 15 19.685 -5.320 -3.647 100 HD3 ARG 15 HD1 ARG 15 20.228 -4.720 -5.213 101 HE ARG 15 HE ARG 15 19.412 -6.963 -6.068 102 HH11 ARG 15 HH11 ARG 15 18.010 -5.337 -3.296 103 HH12 ARG 15 HH12 ARG 15 16.445 -6.080 -3.490 104 HH21 ARG 15 HH21 ARG 15 17.362 -7.953 -6.312 105 HH22 ARG 15 HH22 ARG 15 16.076 -7.568 -5.208 106 H ALA 16 HN ALA 16 25.107 -9.171 -6.194 107 HA ALA 16 HA ALA 16 25.490 -8.494 -8.946 108 HB1 ALA 16 HB1 ALA 16 26.808 -10.536 -9.062 109 HB2 ALA 16 HB2 ALA 16 26.188 -11.044 -7.491 110 HB3 ALA 16 HB3 ALA 16 27.224 -9.621 -7.613 111 H ASP 17 HN ASP 17 23.264 -10.335 -7.148 112 HA ASP 17 HA ASP 17 22.258 -11.845 -9.413 113 HB2 ASP 17 HB2 ASP 17 22.337 -12.801 -7.094 114 HB3 ASP 17 HB1 ASP 17 21.137 -11.608 -6.610 115 H LYS 18 HN LYS 18 21.438 -10.359 -10.829 116 HA LYS 18 HA LYS 18 18.990 -9.013 -9.967 117 HB2 LYS 18 HB2 LYS 18 20.919 -7.386 -9.891 118 HB3 LYS 18 HB1 LYS 18 21.117 -7.632 -11.620 119 HG2 LYS 18 HG2 LYS 18 19.906 -5.598 -11.239 120 HG3 LYS 18 HG1 LYS 18 18.823 -6.782 -11.970 121 HD2 LYS 18 HD2 LYS 18 17.841 -7.263 -9.805 122 HD3 LYS 18 HD1 LYS 18 18.979 -6.168 -9.019 123 HE2 LYS 18 HE2 LYS 18 16.863 -5.052 -9.262 124 HE3 LYS 18 HE1 LYS 18 18.033 -4.301 -10.347 125 HZ1 LYS 18 HZ1 LYS 18 15.970 -6.288 -11.130 126 HZ2 LYS 18 HZ2 LYS 18 17.090 -5.572 -12.180 127 HZ3 LYS 18 HZ3 LYS 18 15.902 -4.625 -11.433 128 H THR 19 HN THR 19 18.681 -11.241 -11.204 129 HA THR 19 HA THR 19 18.861 -11.009 -14.066 130 HB THR 19 HB THR 19 19.186 -13.207 -13.140 131 HG1 THR 19 HG1 THR 19 18.206 -13.303 -15.135 132 HG21 THR 19 HG21 THR 19 17.383 -14.436 -12.005 133 HG22 THR 19 HG22 THR 19 16.394 -12.975 -12.013 134 HG23 THR 19 HG23 THR 19 17.897 -13.019 -11.089 135 H ALA 20 HN ALA 20 17.513 -9.905 -15.235 136 HA ALA 20 HA ALA 20 14.763 -9.549 -14.268 137 HB1 ALA 20 HB1 ALA 20 16.317 -7.842 -16.213 138 HB2 ALA 20 HB2 ALA 20 16.038 -7.472 -14.512 139 HB3 ALA 20 HB3 ALA 20 14.679 -7.530 -15.635 140 H ALA 21 HN ALA 21 15.487 -11.904 -15.481 141 HA ALA 21 HA ALA 21 14.671 -11.858 -18.244 142 HB1 ALA 21 HB1 ALA 21 14.904 -14.288 -18.160 143 HB2 ALA 21 HB2 ALA 21 15.130 -14.212 -16.412 144 HB3 ALA 21 HB3 ALA 21 16.324 -13.487 -17.490 145 HA PRO 22 HA PRO 22 10.632 -13.794 -16.459 146 HB2 PRO 22 HB2 PRO 22 10.695 -13.425 -13.563 147 HB3 PRO 22 HB1 PRO 22 10.442 -14.906 -14.489 148 HG2 PRO 22 HG2 PRO 22 12.680 -14.467 -13.040 149 HG3 PRO 22 HG1 PRO 22 12.683 -15.414 -14.539 150 HD2 PRO 22 HD2 PRO 22 13.482 -12.557 -14.106 151 HD3 PRO 22 HD1 PRO 22 14.292 -13.819 -15.060 152 H GLN 23 HN GLN 23 9.013 -12.747 -14.278 153 HA GLN 23 HA GLN 23 8.367 -10.203 -15.398 154 HB2 GLN 23 HB2 GLN 23 6.603 -10.100 -13.748 155 HB3 GLN 23 HB1 GLN 23 6.673 -11.722 -14.418 156 HG2 GLN 23 HG2 GLN 23 7.881 -12.489 -12.440 157 HG3 GLN 23 HG1 GLN 23 7.796 -10.862 -11.763 158 HE21 GLN 23 HE21 GLN 23 5.802 -10.070 -11.063 159 HE22 GLN 23 HE22 GLN 23 4.465 -11.124 -10.729 160 H THR 24 HN THR 24 10.696 -11.125 -13.175 161 HA THR 24 HA THR 24 10.691 -9.045 -11.304 162 HB THR 24 HB THR 24 13.196 -9.556 -11.167 163 HG1 THR 24 HG1 THR 24 14.003 -11.040 -12.497 164 HG21 THR 24 HG21 THR 24 11.549 -10.562 -9.667 165 HG22 THR 24 HG22 THR 24 12.800 -11.729 -10.094 166 HG23 THR 24 HG23 THR 24 11.213 -11.815 -10.860 167 H ARG 25 HN ARG 25 11.382 -8.982 -14.634 168 HA ARG 25 HA ARG 25 13.241 -6.873 -14.764 169 HB2 ARG 25 HB2 ARG 25 12.455 -6.588 -17.089 170 HB3 ARG 25 HB1 ARG 25 12.796 -8.267 -16.698 171 HG2 ARG 25 HG2 ARG 25 10.412 -8.696 -16.420 172 HG3 ARG 25 HG1 ARG 25 10.064 -7.003 -16.781 173 HD2 ARG 25 HD2 ARG 25 9.693 -8.332 -18.755 174 HD3 ARG 25 HD1 ARG 25 11.096 -7.297 -18.998 175 HE ARG 25 HE ARG 25 11.439 -10.110 -18.203 176 HH11 ARG 25 HH11 ARG 25 12.064 -7.453 -20.402 177 HH12 ARG 25 HH12 ARG 25 13.127 -8.380 -21.420 178 HH21 ARG 25 HH21 ARG 25 12.829 -11.335 -19.562 179 HH22 ARG 25 HH22 ARG 25 13.544 -10.584 -20.957 180 H LEU 26 HN LEU 26 9.836 -6.918 -14.115 181 HA LEU 26 HA LEU 26 9.825 -3.974 -14.165 182 HB2 LEU 26 HB2 LEU 26 7.578 -5.832 -14.951 183 HB3 LEU 26 HB1 LEU 26 7.405 -4.099 -14.750 184 HG LEU 26 HG LEU 26 9.164 -5.458 -16.797 185 HD11 LEU 26 HD11 LEU 26 6.545 -3.995 -17.094 186 HD12 LEU 26 HD12 LEU 26 6.803 -5.728 -17.297 187 HD13 LEU 26 HD13 LEU 26 7.545 -4.588 -18.419 188 HD21 LEU 26 HD21 LEU 26 10.080 -3.314 -16.057 189 HD22 LEU 26 HD22 LEU 26 8.532 -2.534 -16.378 190 HD23 LEU 26 HD23 LEU 26 9.473 -3.208 -17.708 191 H THR 27 HN THR 27 10.603 -5.047 -11.901 192 HA THR 27 HA THR 27 8.223 -5.217 -10.189 193 HB THR 27 HB THR 27 9.919 -6.036 -8.446 194 HG1 THR 27 HG1 THR 27 11.466 -6.558 -10.791 195 HG21 THR 27 HG21 THR 27 8.283 -7.495 -9.538 196 HG22 THR 27 HG22 THR 27 9.815 -8.330 -9.281 197 HG23 THR 27 HG23 THR 27 9.397 -7.733 -10.887 198 HA PRO 28 HA PRO 28 9.318 -1.105 -8.761 199 HB2 PRO 28 HB2 PRO 28 7.188 -1.592 -6.797 200 HB3 PRO 28 HB1 PRO 28 7.303 -0.341 -8.036 201 HG2 PRO 28 HG2 PRO 28 5.550 -2.373 -8.231 202 HG3 PRO 28 HG1 PRO 28 6.333 -1.663 -9.656 203 HD2 PRO 28 HD2 PRO 28 6.983 -4.204 -8.202 204 HD3 PRO 28 HD1 PRO 28 6.936 -3.886 -9.951 205 H TYR 29 HN TYR 29 11.070 -0.925 -7.524 206 HA TYR 29 HA TYR 29 11.350 -2.608 -5.155 207 HB2 TYR 29 HB2 TYR 29 13.373 -0.817 -6.520 208 HB3 TYR 29 HB1 TYR 29 13.702 -1.859 -5.142 209 HD1 TYR 29 HD1 TYR 29 13.075 -4.405 -5.522 210 HD2 TYR 29 HD2 TYR 29 13.862 -1.615 -8.633 211 HE1 TYR 29 HE1 TYR 29 13.609 -6.262 -7.045 212 HE2 TYR 29 HE2 TYR 29 14.398 -3.461 -10.164 213 HH TYR 29 HH TYR 29 13.596 -6.630 -9.569 214 H ALA 30 HN ALA 30 10.817 -1.839 -3.245 215 HA ALA 30 HA ALA 30 11.339 0.918 -2.528 216 HB1 ALA 30 HB1 ALA 30 8.522 -0.170 -2.522 217 HB2 ALA 30 HB2 ALA 30 9.145 1.092 -3.586 218 HB3 ALA 30 HB3 ALA 30 9.027 1.380 -1.849 219 H GLN 31 HN GLN 31 9.578 -2.013 -1.536 220 HA GLN 31 HA GLN 31 9.505 -3.181 0.408 221 HB2 GLN 31 HB2 GLN 31 11.937 -3.430 -0.191 222 HB3 GLN 31 HB1 GLN 31 12.284 -2.077 0.874 223 HG2 GLN 31 HG2 GLN 31 12.735 -4.209 1.954 224 HG3 GLN 31 HG1 GLN 31 11.447 -3.331 2.776 225 HE21 GLN 31 HE21 GLN 31 10.625 -5.193 3.707 226 HE22 GLN 31 HE22 GLN 31 9.774 -6.391 2.792 227 H ALA 32 HN ALA 32 8.079 -0.998 0.646 228 HA ALA 32 HA ALA 32 8.859 0.438 3.057 229 HB1 ALA 32 HB1 ALA 32 7.993 1.760 1.217 230 HB2 ALA 32 HB2 ALA 32 6.874 1.815 2.577 231 HB3 ALA 32 HB3 ALA 32 6.518 0.795 1.186 232 H GLY 33 HN GLY 33 8.600 -1.996 3.882 233 HA2 GLY 33 HA2 GLY 33 5.878 -2.783 4.439 234 HA3 GLY 33 HA1 GLY 33 7.339 -3.598 4.982 235 H GLU 34 HN GLU 34 5.677 -0.503 5.471 236 HA GLU 34 HA GLU 34 6.623 -0.336 8.198 237 HB2 GLU 34 HB2 GLU 34 4.815 1.438 6.551 238 HB3 GLU 34 HB1 GLU 34 5.268 1.785 8.214 239 HG2 GLU 34 HG2 GLU 34 7.141 1.555 5.870 240 HG3 GLU 34 HG1 GLU 34 6.635 3.046 6.665 241 H ASP 35 HN ASP 35 4.868 0.423 9.837 242 HA ASP 35 HA ASP 35 2.422 -1.181 9.510 243 HB2 ASP 35 HB2 ASP 35 4.065 -2.323 11.040 244 HB3 ASP 35 HB1 ASP 35 3.954 -0.928 12.110 245 H ASN 36 HN ASN 36 0.593 -0.356 10.640 246 HA ASN 36 HA ASN 36 -0.778 1.219 11.548 247 HB2 ASN 36 HB2 ASN 36 0.821 1.636 13.318 248 HB3 ASN 36 HB1 ASN 36 1.796 2.648 12.256 249 HD21 ASN 36 HD21 ASN 36 -1.151 2.431 14.107 250 HD22 ASN 36 HD22 ASN 36 -1.499 4.124 14.110 251 H TRP 37 HN TRP 37 1.453 1.847 9.083 252 HA TRP 37 HA TRP 37 0.734 4.402 8.241 253 HB2 TRP 37 HB2 TRP 37 1.573 3.735 6.019 254 HB3 TRP 37 HB1 TRP 37 2.669 3.261 7.305 255 HD1 TRP 37 HD1 TRP 37 1.023 0.491 8.028 256 HE1 TRP 37 HE1 TRP 37 1.326 -1.507 6.431 257 HE3 TRP 37 HE3 TRP 37 2.666 3.010 3.892 258 HZ2 TRP 37 HZ2 TRP 37 2.160 -1.951 3.768 259 HZ3 TRP 37 HZ3 TRP 37 3.203 1.723 1.862 260 HH2 TRP 37 HH2 TRP 37 2.954 -0.705 1.804 261 H ARG 38 HN ARG 38 -0.950 1.389 7.967 262 HA ARG 38 HA ARG 38 -2.727 2.119 5.882 263 HB2 ARG 38 HB2 ARG 38 -4.125 0.231 6.720 264 HB3 ARG 38 HB1 ARG 38 -2.459 -0.215 6.373 265 HG2 ARG 38 HG2 ARG 38 -2.311 -1.078 8.406 266 HG3 ARG 38 HG1 ARG 38 -2.520 0.539 9.079 267 HD2 ARG 38 HD2 ARG 38 -4.181 -0.795 10.081 268 HD3 ARG 38 HD1 ARG 38 -5.012 0.162 8.859 269 HE ARG 38 HE ARG 38 -4.694 -1.970 7.445 270 HH11 ARG 38 HH11 ARG 38 -5.372 -1.849 10.884 271 HH12 ARG 38 HH12 ARG 38 -6.094 -3.436 10.924 272 HH21 ARG 38 HH21 ARG 38 -5.670 -4.033 7.486 273 HH22 ARG 38 HH22 ARG 38 -6.250 -4.682 8.994 274 H SER 39 HN SER 39 -2.757 2.518 9.367 275 HA SER 39 HA SER 39 -5.433 3.414 9.591 276 HB2 SER 39 HB2 SER 39 -3.075 4.133 11.354 277 HB3 SER 39 HB1 SER 39 -4.781 4.197 11.795 278 HG SER 39 HG SER 39 -4.042 2.290 12.601 279 H ARG 40 HN ARG 40 -2.355 4.968 8.901 280 HA ARG 40 HA ARG 40 -3.302 7.627 8.934 281 HB2 ARG 40 HB2 ARG 40 -0.973 6.549 7.342 282 HB3 ARG 40 HB1 ARG 40 -1.200 8.147 7.997 283 HG2 ARG 40 HG2 ARG 40 -0.754 5.680 9.632 284 HG3 ARG 40 HG1 ARG 40 0.463 6.902 9.259 285 HD2 ARG 40 HD2 ARG 40 -0.972 8.584 10.403 286 HD3 ARG 40 HD1 ARG 40 -2.050 7.273 10.880 287 HE ARG 40 HE ARG 40 0.269 6.383 11.839 288 HH11 ARG 40 HH11 ARG 40 -1.285 9.503 12.080 289 HH12 ARG 40 HH12 ARG 40 -0.466 9.943 13.548 290 HH21 ARG 40 HH21 ARG 40 1.352 6.957 13.769 291 HH22 ARG 40 HH22 ARG 40 1.040 8.501 14.504 292 H ILE 41 HN ILE 41 -2.816 5.182 6.433 293 HA ILE 41 HA ILE 41 -3.554 6.679 4.189 294 HB ILE 41 HB ILE 41 -3.844 3.721 4.774 295 HG12 ILE 41 HG12 ILE 41 -1.881 5.217 3.027 296 HG13 ILE 41 HG11 ILE 41 -1.547 4.688 4.672 297 HG21 ILE 41 HG21 ILE 41 -5.483 4.292 3.074 298 HG22 ILE 41 HG22 ILE 41 -4.145 3.396 2.352 299 HG23 ILE 41 HG23 ILE 41 -4.247 5.143 2.144 300 HD11 ILE 41 HD11 ILE 41 -0.585 3.186 3.020 301 HD12 ILE 41 HD12 ILE 41 -2.188 2.891 2.349 302 HD13 ILE 41 HD13 ILE 41 -1.812 2.370 3.991 303 H SER 42 HN SER 42 -5.501 4.698 6.417 304 HA SER 42 HA SER 42 -7.995 4.964 5.228 305 HB2 SER 42 HB2 SER 42 -7.462 3.482 7.161 306 HB3 SER 42 HB1 SER 42 -7.426 4.902 8.205 307 HG SER 42 HG SER 42 -9.471 4.301 8.431 308 H GLY 43 HN GLY 43 -6.291 7.196 7.373 309 HA2 GLY 43 HA2 GLY 43 -8.429 9.054 7.650 310 HA3 GLY 43 HA1 GLY 43 -6.729 9.376 7.958 311 H ARG 44 HN ARG 44 -5.763 8.748 5.350 312 HA ARG 44 HA ARG 44 -6.220 11.201 4.025 313 HB2 ARG 44 HB2 ARG 44 -4.561 8.815 3.718 314 HB3 ARG 44 HB1 ARG 44 -5.026 9.550 2.209 315 HG2 ARG 44 HG2 ARG 44 -2.981 10.526 2.722 316 HG3 ARG 44 HG1 ARG 44 -4.169 11.735 3.205 317 HD2 ARG 44 HD2 ARG 44 -3.054 9.715 5.126 318 HD3 ARG 44 HD1 ARG 44 -2.260 11.263 4.820 319 HE ARG 44 HE ARG 44 -4.895 11.848 5.453 320 HH11 ARG 44 HH11 ARG 44 -2.151 10.336 7.003 321 HH12 ARG 44 HH12 ARG 44 -2.624 10.797 8.602 322 HH21 ARG 44 HH21 ARG 44 -5.536 12.460 7.542 323 HH22 ARG 44 HH22 ARG 44 -4.564 12.010 8.919 324 H LEU 45 HN LEU 45 -7.400 7.928 3.649 325 HA LEU 45 HA LEU 45 -8.718 8.280 1.167 326 HB2 LEU 45 HB2 LEU 45 -8.139 6.186 2.797 327 HB3 LEU 45 HB1 LEU 45 -9.844 6.391 3.135 328 HG LEU 45 HG LEU 45 -8.798 6.097 0.337 329 HD11 LEU 45 HD11 LEU 45 -9.773 3.919 2.177 330 HD12 LEU 45 HD12 LEU 45 -8.092 4.164 1.689 331 HD13 LEU 45 HD13 LEU 45 -9.311 3.730 0.486 332 HD21 LEU 45 HD21 LEU 45 -11.501 5.764 1.623 333 HD22 LEU 45 HD22 LEU 45 -11.136 5.260 -0.027 334 HD23 LEU 45 HD23 LEU 45 -11.026 6.964 0.422 335 H ASN 46 HN ASN 46 -9.435 9.049 4.408 336 HA ASN 46 HA ASN 46 -12.249 9.425 4.217 337 HB2 ASN 46 HB2 ASN 46 -11.289 9.045 6.390 338 HB3 ASN 46 HB1 ASN 46 -10.174 10.386 6.195 339 HD21 ASN 46 HD21 ASN 46 -10.877 12.463 6.533 340 HD22 ASN 46 HD22 ASN 46 -12.401 12.824 7.272 341 H ARG 47 HN ARG 47 -9.399 11.408 3.863 342 HA ARG 47 HA ARG 47 -10.497 13.899 3.449 343 HB2 ARG 47 HB2 ARG 47 -8.318 14.280 3.235 344 HB3 ARG 47 HB1 ARG 47 -8.014 12.567 3.083 345 HG2 ARG 47 HG2 ARG 47 -8.355 12.716 0.647 346 HG3 ARG 47 HG1 ARG 47 -8.597 14.466 0.818 347 HD2 ARG 47 HD2 ARG 47 -6.361 14.716 1.731 348 HD3 ARG 47 HD1 ARG 47 -6.109 12.974 1.645 349 HE ARG 47 HE ARG 47 -6.761 14.127 -0.893 350 HH11 ARG 47 HH11 ARG 47 -4.132 13.614 1.377 351 HH12 ARG 47 HH12 ARG 47 -2.910 13.609 0.138 352 HH21 ARG 47 HH21 ARG 47 -5.136 14.151 -2.508 353 HH22 ARG 47 HH22 ARG 47 -3.475 13.912 -2.050 354 H PHE 48 HN PHE 48 -10.465 11.083 1.362 355 HA PHE 48 HA PHE 48 -11.577 12.658 -0.810 356 HB2 PHE 48 HB2 PHE 48 -10.754 9.766 -0.692 357 HB3 PHE 48 HB1 PHE 48 -11.468 10.525 -2.107 358 HD1 PHE 48 HD2 PHE 48 -10.227 12.440 -3.190 359 HD2 PHE 48 HD1 PHE 48 -8.460 9.872 -0.295 360 HE1 PHE 48 HE2 PHE 48 -7.989 13.098 -3.975 361 HE2 PHE 48 HE1 PHE 48 -6.219 10.523 -1.073 362 HZ PHE 48 HZ PHE 48 -5.983 12.138 -2.918 363 H LYS 49 HN LYS 49 -12.371 9.619 0.859 364 HA LYS 49 HA LYS 49 -15.176 10.276 0.989 365 HB2 LYS 49 HB2 LYS 49 -14.202 8.051 -0.812 366 HB3 LYS 49 HB1 LYS 49 -15.841 8.134 -0.196 367 HG2 LYS 49 HG2 LYS 49 -16.105 10.314 -1.343 368 HG3 LYS 49 HG1 LYS 49 -14.500 10.084 -2.046 369 HD2 LYS 49 HD2 LYS 49 -15.285 7.963 -3.043 370 HD3 LYS 49 HD1 LYS 49 -16.896 8.290 -2.405 371 HE2 LYS 49 HE2 LYS 49 -16.744 8.927 -4.746 372 HE3 LYS 49 HE1 LYS 49 -17.010 10.339 -3.724 373 HZ1 LYS 49 HZ1 LYS 49 -14.716 10.925 -3.904 374 HZ2 LYS 49 HZ2 LYS 49 -15.315 10.672 -5.469 375 HZ3 LYS 49 HZ3 LYS 49 -14.349 9.490 -4.732 376 H ARG 50 HN ARG 50 -15.700 9.586 2.986 377 HA ARG 50 HA ARG 50 -14.887 6.856 3.682 378 HB2 ARG 50 HB2 ARG 50 -13.732 9.047 4.891 379 HB3 ARG 50 HB1 ARG 50 -15.018 8.616 6.013 380 HG2 ARG 50 HG2 ARG 50 -12.973 7.498 6.637 381 HG3 ARG 50 HG1 ARG 50 -14.150 6.308 6.076 382 HD2 ARG 50 HD2 ARG 50 -13.067 6.219 3.909 383 HD3 ARG 50 HD1 ARG 50 -11.928 7.468 4.405 384 HE ARG 50 HE ARG 50 -11.252 5.764 6.178 385 HH11 ARG 50 HH11 ARG 50 -12.418 4.926 2.998 386 HH12 ARG 50 HH12 ARG 50 -11.537 3.436 2.921 387 HH21 ARG 50 HH21 ARG 50 -10.074 3.812 6.102 388 HH22 ARG 50 HH22 ARG 50 -10.197 2.798 4.694 389 H TYR 51 HN TYR 51 -16.764 5.922 3.485 390 HA TYR 51 HA TYR 51 -19.221 7.066 4.491 391 HB2 TYR 51 HB2 TYR 51 -18.694 5.540 2.369 392 HB3 TYR 51 HB1 TYR 51 -18.961 4.248 3.528 393 HD1 TYR 51 HD2 TYR 51 -21.212 4.120 4.687 394 HD2 TYR 51 HD1 TYR 51 -20.467 6.698 1.391 395 HE1 TYR 51 HE2 TYR 51 -23.629 4.293 4.281 396 HE2 TYR 51 HE1 TYR 51 -22.880 6.881 0.977 397 HH TYR 51 HH TYR 51 -24.933 5.432 1.445 398 HA PRO 52 HA PRO 52 -18.641 5.377 8.591 399 HB2 PRO 52 HB2 PRO 52 -21.610 5.263 8.633 400 HB3 PRO 52 HB1 PRO 52 -20.498 6.063 9.752 401 HG2 PRO 52 HG2 PRO 52 -21.925 7.484 8.014 402 HG3 PRO 52 HG1 PRO 52 -20.244 7.918 8.378 403 HD2 PRO 52 HD2 PRO 52 -21.364 6.510 5.988 404 HD3 PRO 52 HD1 PRO 52 -20.082 7.735 6.077 405 H LYS 53 HN LYS 53 -18.337 3.356 9.317 406 HA LYS 53 HA LYS 53 -18.700 1.205 7.541 407 HB2 LYS 53 HB2 LYS 53 -18.021 1.111 10.485 408 HB3 LYS 53 HB1 LYS 53 -17.844 -0.223 9.362 409 HG2 LYS 53 HG2 LYS 53 -16.350 2.385 9.232 410 HG3 LYS 53 HG1 LYS 53 -15.720 0.869 9.870 411 HD2 LYS 53 HD2 LYS 53 -14.868 0.753 7.763 412 HD3 LYS 53 HD1 LYS 53 -16.437 0.005 7.461 413 HE2 LYS 53 HE2 LYS 53 -15.755 1.766 5.801 414 HE3 LYS 53 HE1 LYS 53 -17.321 2.021 6.560 415 HZ1 LYS 53 HZ1 LYS 53 -14.764 3.384 7.239 416 HZ2 LYS 53 HZ2 LYS 53 -16.190 3.540 8.143 417 HZ3 LYS 53 HZ3 LYS 53 -16.150 4.074 6.538 418 H ASP 54 HN ASP 54 -20.671 2.315 10.208 419 HA ASP 54 HA ASP 54 -22.065 -0.055 10.763 420 HB2 ASP 54 HB2 ASP 54 -22.165 2.064 12.108 421 HB3 ASP 54 HB1 ASP 54 -23.206 2.744 10.861 422 H ALA 55 HN ALA 55 -22.451 2.328 8.242 423 HA ALA 55 HA ALA 55 -24.932 1.320 7.250 424 HB1 ALA 55 HB1 ALA 55 -24.567 2.820 5.372 425 HB2 ALA 55 HB2 ALA 55 -22.906 3.089 5.899 426 HB3 ALA 55 HB3 ALA 55 -24.249 3.642 6.899 427 H LEU 56 HN LEU 56 -21.541 0.832 6.451 428 HA LEU 56 HA LEU 56 -21.945 -0.587 4.046 429 HB2 LEU 56 HB2 LEU 56 -19.637 -0.564 5.984 430 HB3 LEU 56 HB1 LEU 56 -19.620 -1.505 4.507 431 HG LEU 56 HG LEU 56 -18.401 0.471 4.085 432 HD11 LEU 56 HD11 LEU 56 -19.610 1.509 2.289 433 HD12 LEU 56 HD12 LEU 56 -21.140 0.911 2.934 434 HD13 LEU 56 HD13 LEU 56 -19.946 -0.225 2.301 435 HD21 LEU 56 HD21 LEU 56 -19.145 1.832 5.912 436 HD22 LEU 56 HD22 LEU 56 -20.748 1.982 5.190 437 HD23 LEU 56 HD23 LEU 56 -19.349 2.709 4.402 438 H ARG 57 HN ARG 57 -21.600 -1.624 7.390 439 HA ARG 57 HA ARG 57 -21.540 -4.378 6.980 440 HB2 ARG 57 HB2 ARG 57 -22.705 -2.810 9.280 441 HB3 ARG 57 HB1 ARG 57 -22.378 -4.539 9.311 442 HG2 ARG 57 HG2 ARG 57 -20.018 -4.132 9.005 443 HG3 ARG 57 HG1 ARG 57 -20.312 -2.401 8.865 444 HD2 ARG 57 HD2 ARG 57 -21.111 -2.311 11.143 445 HD3 ARG 57 HD1 ARG 57 -20.950 -4.061 11.297 446 HE ARG 57 HE ARG 57 -18.511 -3.708 10.985 447 HH11 ARG 57 HH11 ARG 57 -20.535 -1.115 12.182 448 HH12 ARG 57 HH12 ARG 57 -19.235 -0.285 12.980 449 HH21 ARG 57 HH21 ARG 57 -16.794 -2.623 12.033 450 HH22 ARG 57 HH22 ARG 57 -17.102 -1.118 12.857 451 H LEU 58 HN LEU 58 -24.174 -2.170 6.673 452 HA LEU 58 HA LEU 58 -26.105 -4.379 6.646 453 HB2 LEU 58 HB2 LEU 58 -26.557 -1.392 6.648 454 HB3 LEU 58 HB1 LEU 58 -27.823 -2.606 6.660 455 HG LEU 58 HG LEU 58 -25.799 -2.139 8.853 456 HD11 LEU 58 HD11 LEU 58 -27.495 -0.386 8.692 457 HD12 LEU 58 HD12 LEU 58 -27.710 -1.365 10.143 458 HD13 LEU 58 HD13 LEU 58 -28.765 -1.610 8.751 459 HD21 LEU 58 HD21 LEU 58 -27.084 -3.776 10.125 460 HD22 LEU 58 HD22 LEU 58 -26.421 -4.501 8.661 461 HD23 LEU 58 HD23 LEU 58 -28.127 -4.057 8.730 462 H LYS 59 HN LYS 59 -24.190 -2.643 4.559 463 HA LYS 59 HA LYS 59 -26.110 -2.879 2.341 464 HB2 LYS 59 HB2 LYS 59 -25.468 -0.574 2.698 465 HB3 LYS 59 HB1 LYS 59 -23.764 -0.998 2.684 466 HG2 LYS 59 HG2 LYS 59 -24.003 -1.695 0.318 467 HG3 LYS 59 HG1 LYS 59 -25.675 -1.127 0.361 468 HD2 LYS 59 HD2 LYS 59 -23.277 0.606 0.957 469 HD3 LYS 59 HD1 LYS 59 -24.064 0.507 -0.617 470 HE2 LYS 59 HE2 LYS 59 -25.403 1.366 1.947 471 HE3 LYS 59 HE1 LYS 59 -24.800 2.460 0.701 472 HZ1 LYS 59 HZ1 LYS 59 -27.023 0.504 0.477 473 HZ2 LYS 59 HZ2 LYS 59 -26.340 1.284 -0.863 474 HZ3 LYS 59 HZ3 LYS 59 -27.107 2.193 0.338 475 H ARG 60 HN ARG 60 -22.549 -2.753 2.666 476 HA ARG 60 HA ARG 60 -22.271 -5.342 1.504 477 HB2 ARG 60 HB2 ARG 60 -20.968 -4.635 -0.456 478 HB3 ARG 60 HB1 ARG 60 -22.648 -4.136 -0.542 479 HG2 ARG 60 HG2 ARG 60 -21.449 -2.310 -1.323 480 HG3 ARG 60 HG1 ARG 60 -21.810 -1.891 0.357 481 HD2 ARG 60 HD2 ARG 60 -19.609 -2.816 0.989 482 HD3 ARG 60 HD1 ARG 60 -19.246 -3.019 -0.725 483 HE ARG 60 HE ARG 60 -19.932 -0.402 -0.560 484 HH11 ARG 60 HH11 ARG 60 -17.757 -2.332 1.380 485 HH12 ARG 60 HH12 ARG 60 -16.602 -1.061 1.588 486 HH21 ARG 60 HH21 ARG 60 -18.447 1.280 -0.289 487 HH22 ARG 60 HH22 ARG 60 -16.996 1.019 0.620 488 H GLN 61 HN GLN 61 -20.328 -6.274 1.854 489 HA GLN 61 HA GLN 61 -18.197 -4.670 3.063 490 HB2 GLN 61 HB2 GLN 61 -19.500 -7.119 4.261 491 HB3 GLN 61 HB1 GLN 61 -17.897 -6.577 4.736 492 HG2 GLN 61 HG2 GLN 61 -20.281 -4.766 4.885 493 HG3 GLN 61 HG1 GLN 61 -19.869 -5.881 6.188 494 HE21 GLN 61 HE21 GLN 61 -18.025 -5.546 7.385 495 HE22 GLN 61 HE22 GLN 61 -17.165 -4.041 7.379 496 H GLY 62 HN GLY 62 -16.214 -6.355 3.379 497 HA2 GLY 62 HA2 GLY 62 -15.829 -8.656 2.123 498 HA3 GLY 62 HA1 GLY 62 -15.926 -7.573 0.749 499 H VAL 63 HN VAL 63 -13.750 -9.272 1.807 500 HA VAL 63 HA VAL 63 -11.727 -7.199 2.289 501 HB VAL 63 HB VAL 63 -11.577 -10.195 2.700 502 HG11 VAL 63 HG11 VAL 63 -9.385 -9.751 3.727 503 HG12 VAL 63 HG12 VAL 63 -9.505 -8.065 3.225 504 HG13 VAL 63 HG13 VAL 63 -9.416 -9.342 2.011 505 HG21 VAL 63 HG21 VAL 63 -11.441 -9.647 5.076 506 HG22 VAL 63 HG22 VAL 63 -12.943 -9.047 4.369 507 HG23 VAL 63 HG23 VAL 63 -11.615 -7.932 4.695 508 H GLY 64 HN GLY 64 -10.501 -6.617 0.621 509 HA2 GLY 64 HA2 GLY 64 -9.760 -8.678 -1.343 510 HA3 GLY 64 HA1 GLY 64 -10.415 -7.148 -1.913 511 H GLN 65 HN GLN 65 -7.897 -8.035 -2.674 512 HA GLN 65 HA GLN 65 -6.115 -6.260 -1.153 513 HB2 GLN 65 HB2 GLN 65 -5.448 -8.510 -3.059 514 HB3 GLN 65 HB1 GLN 65 -4.257 -7.437 -2.337 515 HG2 GLN 65 HG2 GLN 65 -5.063 -8.203 -0.092 516 HG3 GLN 65 HG1 GLN 65 -6.039 -9.408 -0.929 517 HE21 GLN 65 HE21 GLN 65 -3.854 -9.751 0.962 518 HE22 GLN 65 HE22 GLN 65 -2.656 -10.706 0.146 519 H VAL 66 HN VAL 66 -5.421 -4.453 -2.043 520 HA VAL 66 HA VAL 66 -6.201 -3.970 -4.833 521 HB VAL 66 HB VAL 66 -7.821 -3.067 -3.195 522 HG11 VAL 66 HG11 VAL 66 -6.351 -2.567 -1.363 523 HG12 VAL 66 HG12 VAL 66 -7.268 -1.137 -1.837 524 HG13 VAL 66 HG13 VAL 66 -5.571 -1.294 -2.301 525 HG21 VAL 66 HG21 VAL 66 -8.055 -0.883 -4.092 526 HG22 VAL 66 HG22 VAL 66 -7.564 -1.998 -5.368 527 HG23 VAL 66 HG23 VAL 66 -6.386 -0.883 -4.668 528 H ARG 67 HN ARG 67 -4.654 -3.175 -6.087 529 HA ARG 67 HA ARG 67 -2.163 -2.229 -4.819 530 HB2 ARG 67 HB2 ARG 67 -1.870 -4.380 -5.937 531 HB3 ARG 67 HB1 ARG 67 -2.576 -3.742 -7.411 532 HG2 ARG 67 HG2 ARG 67 -0.684 -2.272 -7.726 533 HG3 ARG 67 HG1 ARG 67 0.007 -2.799 -6.189 534 HD2 ARG 67 HD2 ARG 67 0.468 -4.951 -7.001 535 HD3 ARG 67 HD1 ARG 67 -0.616 -4.757 -8.377 536 HE ARG 67 HE ARG 67 1.175 -2.901 -8.940 537 HH11 ARG 67 HH11 ARG 67 1.762 -6.153 -7.731 538 HH12 ARG 67 HH12 ARG 67 3.255 -6.322 -8.605 539 HH21 ARG 67 HH21 ARG 67 3.100 -3.134 -10.063 540 HH22 ARG 67 HH22 ARG 67 4.010 -4.619 -9.949 541 H PHE 68 HN PHE 68 -1.304 -0.313 -5.501 542 HA PHE 68 HA PHE 68 -2.299 1.014 -7.843 543 HB2 PHE 68 HB2 PHE 68 -3.026 3.025 -6.370 544 HB3 PHE 68 HB1 PHE 68 -4.135 1.684 -6.604 545 HD1 PHE 68 HD1 PHE 68 -1.357 2.553 -4.233 546 HD2 PHE 68 HD2 PHE 68 -5.317 1.080 -4.774 547 HE1 PHE 68 HE1 PHE 68 -1.604 2.308 -1.797 548 HE2 PHE 68 HE2 PHE 68 -5.563 0.841 -2.340 549 HZ PHE 68 HZ PHE 68 -3.710 1.453 -0.852 550 H THR 69 HN THR 69 -1.252 3.002 -8.286 551 HA THR 69 HA THR 69 1.356 3.307 -6.946 552 HB THR 69 HB THR 69 0.422 4.636 -9.503 553 HG1 THR 69 HG1 THR 69 0.946 2.098 -9.178 554 HG21 THR 69 HG21 THR 69 2.846 4.986 -9.841 555 HG22 THR 69 HG22 THR 69 3.151 4.285 -8.251 556 HG23 THR 69 HG23 THR 69 2.248 5.795 -8.392 557 H LEU 70 HN LEU 70 1.842 5.080 -5.817 558 HA LEU 70 HA LEU 70 -0.302 7.071 -5.475 559 HB2 LEU 70 HB2 LEU 70 1.707 6.083 -3.457 560 HB3 LEU 70 HB1 LEU 70 0.450 7.275 -3.160 561 HG LEU 70 HG LEU 70 -0.046 4.400 -3.937 562 HD11 LEU 70 HD11 LEU 70 -0.392 5.706 -1.248 563 HD12 LEU 70 HD12 LEU 70 0.959 4.661 -1.689 564 HD13 LEU 70 HD13 LEU 70 -0.683 4.015 -1.658 565 HD21 LEU 70 HD21 LEU 70 -2.362 4.898 -3.368 566 HD22 LEU 70 HD22 LEU 70 -1.787 5.941 -4.674 567 HD23 LEU 70 HD23 LEU 70 -1.923 6.574 -3.032 568 H ASP 71 HN ASP 71 0.217 9.197 -5.416 569 HA ASP 71 HA ASP 71 2.973 9.878 -6.108 570 HB2 ASP 71 HB2 ASP 71 0.809 10.762 -7.330 571 HB3 ASP 71 HB1 ASP 71 0.779 11.916 -5.994 572 H ARG 72 HN ARG 72 3.646 12.078 -5.126 573 HA ARG 72 HA ARG 72 4.415 11.556 -2.546 574 HB2 ARG 72 HB2 ARG 72 5.417 13.171 -4.171 575 HB3 ARG 72 HB1 ARG 72 4.141 14.302 -3.754 576 HG2 ARG 72 HG2 ARG 72 4.952 14.297 -1.424 577 HG3 ARG 72 HG1 ARG 72 6.277 13.238 -1.922 578 HD2 ARG 72 HD2 ARG 72 5.746 16.084 -2.718 579 HD3 ARG 72 HD1 ARG 72 7.197 15.395 -1.988 580 HE ARG 72 HE ARG 72 6.705 14.209 -4.516 581 HH11 ARG 72 HH11 ARG 72 7.817 17.217 -3.100 582 HH12 ARG 72 HH12 ARG 72 8.820 17.632 -4.457 583 HH21 ARG 72 HH21 ARG 72 7.991 14.772 -6.308 584 HH22 ARG 72 HH22 ARG 72 8.921 16.238 -6.283 585 H GLN 73 HN GLN 73 1.701 13.636 -3.570 586 HA GLN 73 HA GLN 73 1.038 14.163 -0.777 587 HB2 GLN 73 HB2 GLN 73 -0.107 15.209 -3.366 588 HB3 GLN 73 HB1 GLN 73 -0.673 15.687 -1.772 589 HG2 GLN 73 HG2 GLN 73 2.176 16.010 -2.643 590 HG3 GLN 73 HG1 GLN 73 0.946 17.240 -2.912 591 HE21 GLN 73 HE21 GLN 73 2.856 15.566 -0.532 592 HE22 GLN 73 HE22 GLN 73 2.548 16.663 0.775 593 H GLY 74 HN GLY 74 0.674 11.501 -2.092 594 HA2 GLY 74 HA2 GLY 74 -0.838 9.789 -1.906 595 HA3 GLY 74 HA1 GLY 74 -1.830 10.860 -0.932 596 H HIS 75 HN HIS 75 -0.758 11.090 -4.291 597 HA HIS 75 HA HIS 75 -3.560 11.418 -5.070 598 HB2 HIS 75 HB2 HIS 75 -1.914 13.168 -5.761 599 HB3 HIS 75 HB1 HIS 75 -1.066 11.947 -6.703 600 HD1 HIS 75 HD1 HIS 75 -4.317 13.854 -6.602 601 HD2 HIS 75 HD2 HIS 75 -2.141 11.434 -9.193 602 HE1 HIS 75 HE1 HIS 75 -5.486 14.009 -8.825 603 HE2 HIS 75 HE2 HIS 75 -4.278 12.372 -10.307 604 H VAL 76 HN VAL 76 -4.545 9.639 -5.698 605 HA VAL 76 HA VAL 76 -3.557 7.216 -6.464 606 HB VAL 76 HB VAL 76 -5.908 7.510 -6.077 607 HG11 VAL 76 HG11 VAL 76 -6.196 9.768 -6.915 608 HG12 VAL 76 HG12 VAL 76 -7.380 8.684 -7.645 609 HG13 VAL 76 HG13 VAL 76 -5.971 9.202 -8.572 610 HG21 VAL 76 HG21 VAL 76 -5.431 6.701 -8.943 611 HG22 VAL 76 HG22 VAL 76 -6.865 6.315 -7.991 612 HG23 VAL 76 HG23 VAL 76 -5.294 5.661 -7.527 613 H LEU 77 HN LEU 77 -2.328 6.535 -8.083 614 HA LEU 77 HA LEU 77 -2.279 8.137 -10.541 615 HB2 LEU 77 HB2 LEU 77 -0.064 6.506 -9.312 616 HB3 LEU 77 HB1 LEU 77 0.041 7.338 -10.853 617 HG LEU 77 HG LEU 77 -0.420 8.710 -8.205 618 HD11 LEU 77 HD11 LEU 77 2.097 8.558 -9.848 619 HD12 LEU 77 HD12 LEU 77 1.800 7.657 -8.361 620 HD13 LEU 77 HD13 LEU 77 1.876 9.419 -8.321 621 HD21 LEU 77 HD21 LEU 77 0.063 10.749 -9.454 622 HD22 LEU 77 HD22 LEU 77 -1.338 9.914 -10.125 623 HD23 LEU 77 HD23 LEU 77 0.222 9.810 -10.940 624 H ALA 78 HN ALA 78 -1.996 4.866 -9.244 625 HA ALA 78 HA ALA 78 -3.060 3.852 -11.797 626 HB1 ALA 78 HB1 ALA 78 -0.954 2.450 -10.146 627 HB2 ALA 78 HB2 ALA 78 -0.628 3.361 -11.624 628 HB3 ALA 78 HB3 ALA 78 -1.632 1.913 -11.685 629 H VAL 79 HN VAL 79 -4.173 1.764 -11.549 630 HA VAL 79 HA VAL 79 -5.090 1.137 -8.865 631 HB VAL 79 HB VAL 79 -7.493 1.202 -9.637 632 HG11 VAL 79 HG11 VAL 79 -6.623 2.888 -8.130 633 HG12 VAL 79 HG12 VAL 79 -7.754 3.620 -9.268 634 HG13 VAL 79 HG13 VAL 79 -6.018 3.827 -9.495 635 HG21 VAL 79 HG21 VAL 79 -7.111 1.307 -12.044 636 HG22 VAL 79 HG22 VAL 79 -6.358 2.892 -11.864 637 HG23 VAL 79 HG23 VAL 79 -8.071 2.682 -11.499 638 H THR 80 HN THR 80 -4.951 -1.009 -8.706 639 HA THR 80 HA THR 80 -5.736 -2.664 -10.994 640 HB THR 80 HB THR 80 -3.112 -3.002 -9.522 641 HG1 THR 80 HG1 THR 80 -2.222 -1.923 -11.130 642 HG21 THR 80 HG21 THR 80 -2.642 -4.730 -11.192 643 HG22 THR 80 HG22 THR 80 -4.241 -4.494 -11.896 644 HG23 THR 80 HG23 THR 80 -4.084 -5.132 -10.259 645 H LEU 81 HN LEU 81 -6.938 -4.362 -10.392 646 HA LEU 81 HA LEU 81 -7.198 -5.033 -7.586 647 HB2 LEU 81 HB2 LEU 81 -9.184 -5.065 -9.021 648 HB3 LEU 81 HB1 LEU 81 -8.440 -6.292 -10.034 649 HG LEU 81 HG LEU 81 -8.373 -7.783 -7.996 650 HD11 LEU 81 HD11 LEU 81 -10.217 -5.669 -6.896 651 HD12 LEU 81 HD12 LEU 81 -8.612 -6.075 -6.291 652 HD13 LEU 81 HD13 LEU 81 -9.920 -7.252 -6.179 653 HD21 LEU 81 HD21 LEU 81 -10.022 -8.073 -9.766 654 HD22 LEU 81 HD22 LEU 81 -11.073 -6.883 -8.998 655 HD23 LEU 81 HD23 LEU 81 -10.731 -8.413 -8.188 656 H VAL 82 HN VAL 82 -5.962 -6.457 -6.601 657 HA VAL 82 HA VAL 82 -4.154 -8.082 -8.223 658 HB VAL 82 HB VAL 82 -3.782 -8.184 -5.326 659 HG11 VAL 82 HG11 VAL 82 -2.019 -7.357 -7.624 660 HG12 VAL 82 HG12 VAL 82 -2.100 -8.956 -6.881 661 HG13 VAL 82 HG13 VAL 82 -1.480 -7.583 -5.961 662 HG21 VAL 82 HG21 VAL 82 -3.005 -5.880 -5.074 663 HG22 VAL 82 HG22 VAL 82 -4.728 -5.945 -5.449 664 HG23 VAL 82 HG23 VAL 82 -3.569 -5.511 -6.706 665 H SER 83 HN SER 83 -6.084 -8.461 -5.254 666 HA SER 83 HA SER 83 -6.781 -11.160 -6.108 667 HB2 SER 83 HB2 SER 83 -5.428 -10.479 -3.495 668 HB3 SER 83 HB1 SER 83 -6.255 -12.011 -3.791 669 HG SER 83 HG SER 83 -4.029 -10.966 -5.222 670 H SER 84 HN SER 84 -8.915 -11.146 -6.124 671 HA SER 84 HA SER 84 -10.345 -9.777 -3.946 672 HB2 SER 84 HB2 SER 84 -10.876 -9.060 -6.272 673 HB3 SER 84 HB1 SER 84 -11.397 -10.703 -6.639 674 HG SER 84 HG SER 84 -13.016 -9.000 -5.943 675 H ALA 85 HN ALA 85 -11.065 -11.046 -2.385 676 HA ALA 85 HA ALA 85 -10.830 -13.868 -2.508 677 HB1 ALA 85 HB1 ALA 85 -11.719 -13.859 -0.241 678 HB2 ALA 85 HB2 ALA 85 -12.190 -12.169 -0.421 679 HB3 ALA 85 HB3 ALA 85 -10.484 -12.615 -0.436 680 H GLY 86 HN GLY 86 -13.651 -11.704 -2.433 681 HA2 GLY 86 HA2 GLY 86 -15.231 -13.420 -4.023 682 HA3 GLY 86 HA1 GLY 86 -15.632 -13.663 -2.330 683 H LEU 87 HN LEU 87 -14.985 -10.909 -4.491 684 HA LEU 87 HA LEU 87 -17.323 -9.576 -3.289 685 HB2 LEU 87 HB2 LEU 87 -14.905 -8.241 -4.475 686 HB3 LEU 87 HB1 LEU 87 -16.251 -7.436 -3.733 687 HG LEU 87 HG LEU 87 -14.523 -7.283 -2.181 688 HD11 LEU 87 HD11 LEU 87 -16.589 -7.934 -1.151 689 HD12 LEU 87 HD12 LEU 87 -15.223 -8.645 -0.287 690 HD13 LEU 87 HD13 LEU 87 -16.194 -9.640 -1.373 691 HD21 LEU 87 HD21 LEU 87 -13.961 -10.219 -2.553 692 HD22 LEU 87 HD22 LEU 87 -13.131 -9.134 -1.439 693 HD23 LEU 87 HD23 LEU 87 -12.988 -8.888 -3.179 694 HA PRO 88 HA PRO 88 -18.295 -9.847 -7.769 695 HB2 PRO 88 HB2 PRO 88 -21.044 -10.249 -6.959 696 HB3 PRO 88 HB1 PRO 88 -19.981 -11.357 -7.827 697 HG2 PRO 88 HG2 PRO 88 -20.859 -11.780 -5.269 698 HG3 PRO 88 HG1 PRO 88 -19.349 -12.445 -5.916 699 HD2 PRO 88 HD2 PRO 88 -19.777 -10.054 -4.166 700 HD3 PRO 88 HD1 PRO 88 -18.493 -11.281 -4.105 701 H SER 89 HN SER 89 -21.239 -8.869 -6.154 702 HA SER 89 HA SER 89 -21.396 -6.380 -7.478 703 HB2 SER 89 HB2 SER 89 -22.855 -7.095 -4.932 704 HB3 SER 89 HB1 SER 89 -23.406 -6.062 -6.253 705 HG SER 89 HG SER 89 -23.369 -7.990 -7.586 706 H LEU 90 HN LEU 90 -19.697 -7.421 -4.766 707 HA LEU 90 HA LEU 90 -19.740 -5.021 -3.215 708 HB2 LEU 90 HB2 LEU 90 -17.763 -7.304 -3.050 709 HB3 LEU 90 HB1 LEU 90 -18.172 -6.152 -1.794 710 HG LEU 90 HG LEU 90 -20.301 -7.949 -2.876 711 HD11 LEU 90 HD11 LEU 90 -18.517 -8.730 -0.595 712 HD12 LEU 90 HD12 LEU 90 -18.182 -9.244 -2.252 713 HD13 LEU 90 HD13 LEU 90 -19.697 -9.719 -1.462 714 HD21 LEU 90 HD21 LEU 90 -19.747 -6.513 -0.307 715 HD22 LEU 90 HD22 LEU 90 -21.019 -7.722 -0.477 716 HD23 LEU 90 HD23 LEU 90 -21.069 -6.251 -1.447 717 H ASP 91 HN ASP 91 -17.715 -6.369 -5.713 718 HA ASP 91 HA ASP 91 -15.292 -5.102 -5.225 719 HB2 ASP 91 HB2 ASP 91 -15.571 -6.908 -6.867 720 HB3 ASP 91 HB1 ASP 91 -16.520 -5.837 -7.893 721 H ARG 92 HN ARG 92 -17.995 -4.032 -7.234 722 HA ARG 92 HA ARG 92 -16.815 -1.816 -8.379 723 HB2 ARG 92 HB2 ARG 92 -19.128 -0.955 -8.683 724 HB3 ARG 92 HB1 ARG 92 -18.935 -2.634 -9.167 725 HG2 ARG 92 HG2 ARG 92 -19.902 -3.342 -7.022 726 HG3 ARG 92 HG1 ARG 92 -20.137 -1.648 -6.593 727 HD2 ARG 92 HD2 ARG 92 -22.204 -2.557 -7.405 728 HD3 ARG 92 HD1 ARG 92 -21.589 -1.382 -8.567 729 HE ARG 92 HE ARG 92 -20.677 -3.536 -9.711 730 HH11 ARG 92 HH11 ARG 92 -23.729 -3.209 -8.012 731 HH12 ARG 92 HH12 ARG 92 -24.539 -4.408 -8.975 732 HH21 ARG 92 HH21 ARG 92 -21.753 -5.089 -11.001 733 HH22 ARG 92 HH22 ARG 92 -23.433 -5.439 -10.700 734 H GLU 93 HN GLU 93 -18.668 -1.916 -5.314 735 HA GLU 93 HA GLU 93 -18.395 0.921 -5.008 736 HB2 GLU 93 HB2 GLU 93 -20.356 -0.533 -4.214 737 HB3 GLU 93 HB1 GLU 93 -19.334 -0.912 -2.833 738 HG2 GLU 93 HG2 GLU 93 -19.139 1.484 -2.338 739 HG3 GLU 93 HG1 GLU 93 -20.211 1.835 -3.691 740 H ILE 94 HN ILE 94 -16.892 -1.927 -3.462 741 HA ILE 94 HA ILE 94 -15.596 -0.500 -1.421 742 HB ILE 94 HB ILE 94 -14.023 -2.382 -1.223 743 HG12 ILE 94 HG12 ILE 94 -15.425 -3.487 -3.666 744 HG13 ILE 94 HG11 ILE 94 -13.753 -2.937 -3.595 745 HG21 ILE 94 HG21 ILE 94 -16.871 -3.287 -1.580 746 HG22 ILE 94 HG22 ILE 94 -16.215 -2.493 -0.149 747 HG23 ILE 94 HG23 ILE 94 -15.627 -4.089 -0.619 748 HD11 ILE 94 HD11 ILE 94 -13.879 -5.353 -3.518 749 HD12 ILE 94 HD12 ILE 94 -14.909 -5.271 -2.087 750 HD13 ILE 94 HD13 ILE 94 -13.238 -4.714 -2.006 751 H GLN 95 HN GLN 95 -14.596 -1.234 -4.732 752 HA GLN 95 HA GLN 95 -12.010 -0.042 -4.362 753 HB2 GLN 95 HB2 GLN 95 -13.313 -0.770 -6.957 754 HB3 GLN 95 HB1 GLN 95 -11.624 -0.619 -6.607 755 HG2 GLN 95 HG2 GLN 95 -13.325 -2.679 -5.286 756 HG3 GLN 95 HG1 GLN 95 -12.519 -2.975 -6.825 757 HE21 GLN 95 HE21 GLN 95 -12.239 -4.304 -4.282 758 HE22 GLN 95 HE22 GLN 95 -10.573 -4.152 -3.834 759 H ALA 96 HN ALA 96 -15.118 0.907 -5.726 760 HA ALA 96 HA ALA 96 -14.343 3.297 -6.924 761 HB1 ALA 96 HB1 ALA 96 -16.850 2.835 -5.301 762 HB2 ALA 96 HB2 ALA 96 -16.651 2.446 -7.010 763 HB3 ALA 96 HB3 ALA 96 -16.597 4.126 -6.477 764 H LEU 97 HN LEU 97 -15.285 2.686 -3.568 765 HA LEU 97 HA LEU 97 -14.880 5.222 -2.549 766 HB2 LEU 97 HB2 LEU 97 -16.210 3.463 -1.504 767 HB3 LEU 97 HB1 LEU 97 -14.771 2.488 -1.272 768 HG LEU 97 HG LEU 97 -14.383 5.028 -0.130 769 HD11 LEU 97 HD11 LEU 97 -16.812 5.157 0.070 770 HD12 LEU 97 HD12 LEU 97 -16.077 4.942 1.659 771 HD13 LEU 97 HD13 LEU 97 -16.840 3.572 0.849 772 HD21 LEU 97 HD21 LEU 97 -14.193 3.574 1.969 773 HD22 LEU 97 HD22 LEU 97 -13.067 3.274 0.642 774 HD23 LEU 97 HD23 LEU 97 -14.466 2.216 0.874 775 H VAL 98 HN VAL 98 -12.801 2.340 -2.285 776 HA VAL 98 HA VAL 98 -10.651 3.927 -1.164 777 HB VAL 98 HB VAL 98 -10.906 0.971 -1.685 778 HG11 VAL 98 HG11 VAL 98 -8.609 2.481 -0.442 779 HG12 VAL 98 HG12 VAL 98 -8.577 1.579 -1.957 780 HG13 VAL 98 HG13 VAL 98 -8.800 0.729 -0.429 781 HG21 VAL 98 HG21 VAL 98 -11.033 0.780 0.713 782 HG22 VAL 98 HG22 VAL 98 -12.238 1.950 0.173 783 HG23 VAL 98 HG23 VAL 98 -10.736 2.507 0.906 784 H LYS 99 HN LYS 99 -11.067 1.893 -4.073 785 HA LYS 99 HA LYS 99 -8.366 2.089 -4.863 786 HB2 LYS 99 HB2 LYS 99 -9.660 0.240 -5.682 787 HB3 LYS 99 HB1 LYS 99 -10.837 1.304 -6.441 788 HG2 LYS 99 HG2 LYS 99 -8.889 2.130 -7.876 789 HG3 LYS 99 HG1 LYS 99 -8.011 0.724 -7.277 790 HD2 LYS 99 HD2 LYS 99 -10.691 0.578 -8.649 791 HD3 LYS 99 HD1 LYS 99 -9.150 0.390 -9.485 792 HE2 LYS 99 HE2 LYS 99 -8.627 -1.553 -8.140 793 HE3 LYS 99 HE1 LYS 99 -10.094 -1.323 -7.191 794 HZ1 LYS 99 HZ1 LYS 99 -10.005 -1.941 -10.098 795 HZ2 LYS 99 HZ2 LYS 99 -11.409 -1.731 -9.176 796 HZ3 LYS 99 HZ3 LYS 99 -10.383 -3.041 -8.866 797 H ARG 100 HN ARG 100 -11.226 4.052 -5.719 798 HA ARG 100 HA ARG 100 -9.688 5.498 -7.695 799 HB2 ARG 100 HB2 ARG 100 -12.107 5.191 -7.981 800 HB3 ARG 100 HB1 ARG 100 -12.401 6.132 -6.527 801 HG2 ARG 100 HG2 ARG 100 -12.740 7.373 -8.660 802 HG3 ARG 100 HG1 ARG 100 -11.595 8.120 -7.546 803 HD2 ARG 100 HD2 ARG 100 -10.768 8.202 -9.842 804 HD3 ARG 100 HD1 ARG 100 -9.730 7.206 -8.826 805 HE ARG 100 HE ARG 100 -11.753 5.740 -10.290 806 HH11 ARG 100 HH11 ARG 100 -8.469 6.975 -10.310 807 HH12 ARG 100 HH12 ARG 100 -7.916 5.876 -11.540 808 HH21 ARG 100 HH21 ARG 100 -11.028 4.292 -11.922 809 HH22 ARG 100 HH22 ARG 100 -9.367 4.351 -12.440 810 H ALA 101 HN ALA 101 -10.086 5.658 -4.331 811 HA ALA 101 HA ALA 101 -8.910 8.359 -4.291 812 HB1 ALA 101 HB1 ALA 101 -9.752 8.631 -2.043 813 HB2 ALA 101 HB2 ALA 101 -10.378 6.976 -2.048 814 HB3 ALA 101 HB3 ALA 101 -11.078 8.186 -3.127 815 H SER 102 HN SER 102 -7.131 6.526 -4.905 816 HA SER 102 HA SER 102 -5.944 5.106 -2.783 817 HB2 SER 102 HB2 SER 102 -4.713 6.074 -5.373 818 HB3 SER 102 HB1 SER 102 -4.005 4.873 -4.292 819 HG SER 102 HG SER 102 -6.615 4.465 -5.232 820 HA PRO 103 HA PRO 103 -4.077 8.780 -1.060 821 HB2 PRO 103 HB2 PRO 103 -4.491 8.010 1.510 822 HB3 PRO 103 HB1 PRO 103 -5.762 8.673 0.480 823 HG2 PRO 103 HG2 PRO 103 -5.489 5.979 1.511 824 HG3 PRO 103 HG1 PRO 103 -6.842 6.690 0.618 825 HD2 PRO 103 HD2 PRO 103 -4.614 5.026 -0.367 826 HD3 PRO 103 HD1 PRO 103 -6.208 5.330 -1.097 827 H LEU 104 HN LEU 104 -2.208 9.309 0.050 828 HA LEU 104 HA LEU 104 -0.507 7.192 1.137 829 HB2 LEU 104 HB2 LEU 104 0.237 7.498 -1.190 830 HB3 LEU 104 HB1 LEU 104 0.383 9.223 -0.924 831 HG LEU 104 HG LEU 104 2.038 8.240 1.019 832 HD11 LEU 104 HD11 LEU 104 2.444 6.488 -1.402 833 HD12 LEU 104 HD12 LEU 104 1.761 5.943 0.129 834 HD13 LEU 104 HD13 LEU 104 3.428 6.521 0.062 835 HD21 LEU 104 HD21 LEU 104 2.748 8.946 -1.826 836 HD22 LEU 104 HD22 LEU 104 3.852 8.955 -0.450 837 HD23 LEU 104 HD23 LEU 104 2.499 10.086 -0.503 838 HA PRO 105 HA PRO 105 -0.432 10.691 4.023 839 HB2 PRO 105 HB2 PRO 105 0.630 8.914 5.999 840 HB3 PRO 105 HB1 PRO 105 -0.983 9.619 5.921 841 HG2 PRO 105 HG2 PRO 105 -0.370 6.935 5.582 842 HG3 PRO 105 HG1 PRO 105 -1.868 7.727 5.099 843 HD2 PRO 105 HD2 PRO 105 0.407 6.866 3.429 844 HD3 PRO 105 HD1 PRO 105 -1.313 7.057 3.012 845 H THR 106 HN THR 106 2.039 8.172 4.325 846 HA THR 106 HA THR 106 4.069 10.191 4.829 847 HB THR 106 HB THR 106 4.447 7.197 4.712 848 HG1 THR 106 HG1 THR 106 4.094 7.288 6.999 849 HG21 THR 106 HG21 THR 106 5.978 9.379 6.140 850 HG22 THR 106 HG22 THR 106 6.504 8.531 4.685 851 HG23 THR 106 HG23 THR 106 6.336 7.654 6.206 852 HA PRO 107 HA PRO 107 5.037 10.060 0.403 853 HB2 PRO 107 HB2 PRO 107 6.840 12.095 0.501 854 HB3 PRO 107 HB1 PRO 107 5.094 12.351 0.429 855 HG2 PRO 107 HG2 PRO 107 6.926 12.441 2.794 856 HG3 PRO 107 HG1 PRO 107 5.576 13.514 2.379 857 HD2 PRO 107 HD2 PRO 107 5.362 11.536 4.214 858 HD3 PRO 107 HD1 PRO 107 4.000 12.057 3.202 859 HA PRO 108 HA PRO 108 8.832 7.721 1.302 860 HB2 PRO 108 HB2 PRO 108 8.378 5.695 -0.347 861 HB3 PRO 108 HB1 PRO 108 7.401 5.875 1.117 862 HG2 PRO 108 HG2 PRO 108 6.725 6.583 -1.713 863 HG3 PRO 108 HG1 PRO 108 5.704 5.811 -0.488 864 HD2 PRO 108 HD2 PRO 108 5.683 8.513 -1.125 865 HD3 PRO 108 HD1 PRO 108 5.063 7.814 0.383 866 H ALA 109 HN ALA 109 9.637 9.804 0.193 867 HA ALA 109 HA ALA 109 10.067 9.968 -2.558 868 HB1 ALA 109 HB1 ALA 109 10.480 11.842 -1.046 869 HB2 ALA 109 HB2 ALA 109 11.915 11.490 -2.007 870 HB3 ALA 109 HB3 ALA 109 11.836 10.975 -0.323 871 H ASP 110 HN ASP 110 12.016 8.508 -0.007 872 HA ASP 110 HA ASP 110 14.082 7.640 -1.775 873 HB2 ASP 110 HB2 ASP 110 14.958 6.468 0.231 874 HB3 ASP 110 HB1 ASP 110 14.609 8.167 0.532 875 H ALA 111 HN ALA 111 11.073 6.609 -1.726 876 HA ALA 111 HA ALA 111 11.776 3.762 -1.982 877 HB1 ALA 111 HB1 ALA 111 10.147 4.221 -0.218 878 HB2 ALA 111 HB2 ALA 111 9.444 3.253 -1.514 879 HB3 ALA 111 HB3 ALA 111 9.078 4.977 -1.404 880 H TYR 112 HN TYR 112 10.543 6.546 -3.655 881 HA TYR 112 HA TYR 112 9.990 4.777 -5.921 882 HB2 TYR 112 HB2 TYR 112 8.329 6.463 -6.741 883 HB3 TYR 112 HB1 TYR 112 7.883 5.482 -5.365 884 HD1 TYR 112 HD2 TYR 112 9.879 8.656 -5.415 885 HD2 TYR 112 HD1 TYR 112 6.287 6.676 -4.310 886 HE1 TYR 112 HE2 TYR 112 9.152 10.660 -4.180 887 HE2 TYR 112 HE1 TYR 112 5.541 8.648 -3.094 888 HH TYR 112 HH TYR 112 6.555 10.632 -2.003 889 H VAL 113 HN VAL 113 12.271 6.560 -5.022 890 HA VAL 113 HA VAL 113 12.666 8.286 -7.264 891 HB VAL 113 HB VAL 113 15.153 8.100 -6.609 892 HG11 VAL 113 HG11 VAL 113 14.844 9.595 -4.684 893 HG12 VAL 113 HG12 VAL 113 13.139 9.149 -4.626 894 HG13 VAL 113 HG13 VAL 113 13.778 10.008 -6.027 895 HG21 VAL 113 HG21 VAL 113 13.976 6.827 -4.138 896 HG22 VAL 113 HG22 VAL 113 15.666 7.238 -4.422 897 HG23 VAL 113 HG23 VAL 113 14.900 5.961 -5.365 898 H ASN 114 HN ASN 114 12.251 7.240 -9.067 899 HA ASN 114 HA ASN 114 13.835 5.718 -10.610 900 HB2 ASN 114 HB2 ASN 114 13.550 3.431 -10.191 901 HB3 ASN 114 HB1 ASN 114 13.628 4.063 -8.552 902 HD21 ASN 114 HD21 ASN 114 11.669 4.200 -7.328 903 HD22 ASN 114 HD22 ASN 114 10.302 3.236 -7.753 904 H GLY 115 HN GLY 115 10.743 6.303 -9.244 905 HA2 GLY 115 HA2 GLY 115 9.468 7.061 -11.596 906 HA3 GLY 115 HA1 GLY 115 9.060 5.374 -11.303 907 H THR 116 HN THR 116 7.879 4.815 -9.443 908 HA THR 116 HA THR 116 6.938 6.759 -7.583 909 HB THR 116 HB THR 116 4.477 5.817 -8.581 910 HG1 THR 116 HG1 THR 116 5.808 7.191 -10.676 911 HG21 THR 116 HG21 THR 116 5.752 8.544 -8.814 912 HG22 THR 116 HG22 THR 116 4.890 7.929 -7.405 913 HG23 THR 116 HG23 THR 116 4.025 8.193 -8.918 914 H VAL 117 HN VAL 117 4.983 5.610 -6.277 915 HA VAL 117 HA VAL 117 6.056 2.936 -5.709 916 HB VAL 117 HB VAL 117 4.842 3.144 -3.510 917 HG11 VAL 117 HG11 VAL 117 7.204 3.501 -3.575 918 HG12 VAL 117 HG12 VAL 117 6.466 4.684 -2.488 919 HG13 VAL 117 HG13 VAL 117 6.977 5.168 -4.108 920 HG21 VAL 117 HG21 VAL 117 4.462 6.001 -4.402 921 HG22 VAL 117 HG22 VAL 117 4.264 5.432 -2.743 922 HG23 VAL 117 HG23 VAL 117 3.205 4.824 -4.014 923 H GLU 118 HN GLU 118 4.943 1.443 -6.774 924 HA GLU 118 HA GLU 118 2.027 1.461 -6.401 925 HB2 GLU 118 HB2 GLU 118 2.818 1.343 -8.773 926 HB3 GLU 118 HB1 GLU 118 3.613 -0.179 -8.389 927 HG2 GLU 118 HG2 GLU 118 1.451 -1.155 -7.808 928 HG3 GLU 118 HG1 GLU 118 0.665 0.375 -8.191 929 H LEU 119 HN LEU 119 1.461 0.279 -4.722 930 HA LEU 119 HA LEU 119 2.866 -2.231 -4.240 931 HB2 LEU 119 HB2 LEU 119 3.118 -1.765 -1.876 932 HB3 LEU 119 HB1 LEU 119 3.941 -0.550 -2.828 933 HG LEU 119 HG LEU 119 1.599 0.727 -2.419 934 HD11 LEU 119 HD11 LEU 119 0.647 -1.078 -1.122 935 HD12 LEU 119 HD12 LEU 119 0.890 0.355 -0.121 936 HD13 LEU 119 HD13 LEU 119 2.003 -1.008 0.000 937 HD21 LEU 119 HD21 LEU 119 3.804 1.636 -1.940 938 HD22 LEU 119 HD22 LEU 119 3.931 0.616 -0.506 939 HD23 LEU 119 HD23 LEU 119 2.721 1.896 -0.571 940 H THR 120 HN THR 120 1.686 -3.709 -2.898 941 HA THR 120 HA THR 120 -1.168 -3.449 -3.417 942 HB THR 120 HB THR 120 0.456 -5.856 -2.587 943 HG1 THR 120 HG1 THR 120 0.858 -5.052 -4.739 944 HG21 THR 120 HG21 THR 120 -1.549 -7.143 -3.138 945 HG22 THR 120 HG22 THR 120 -2.418 -5.653 -3.494 946 HG23 THR 120 HG23 THR 120 -1.880 -5.988 -1.847 947 H LEU 121 HN LEU 121 -2.564 -3.020 -1.896 948 HA LEU 121 HA LEU 121 -1.874 -3.612 0.903 949 HB2 LEU 121 HB2 LEU 121 -3.240 -1.170 -0.226 950 HB3 LEU 121 HB1 LEU 121 -3.281 -1.589 1.477 951 HG LEU 121 HG LEU 121 -0.785 -1.011 -0.118 952 HD11 LEU 121 HD11 LEU 121 -2.126 0.986 0.250 953 HD12 LEU 121 HD12 LEU 121 -0.647 1.018 1.205 954 HD13 LEU 121 HD13 LEU 121 -2.187 0.636 1.977 955 HD21 LEU 121 HD21 LEU 121 -0.450 -2.645 1.675 956 HD22 LEU 121 HD22 LEU 121 -1.165 -1.517 2.830 957 HD23 LEU 121 HD23 LEU 121 0.350 -1.110 2.024 958 HA PRO 122 HA PRO 122 -5.768 -5.760 0.664 959 HB2 PRO 122 HB2 PRO 122 -5.562 -6.130 3.544 960 HB3 PRO 122 HB1 PRO 122 -5.448 -7.337 2.260 961 HG2 PRO 122 HG2 PRO 122 -3.327 -6.588 3.788 962 HG3 PRO 122 HG1 PRO 122 -3.167 -7.153 2.115 963 HD2 PRO 122 HD2 PRO 122 -3.129 -4.354 3.181 964 HD3 PRO 122 HD1 PRO 122 -2.126 -5.094 1.913 965 H ILE 123 HN ILE 123 -7.594 -4.608 0.518 966 HA ILE 123 HA ILE 123 -8.247 -2.720 2.649 967 HB ILE 123 HB ILE 123 -10.306 -2.281 1.123 968 HG12 ILE 123 HG12 ILE 123 -8.438 -3.150 -1.097 969 HG13 ILE 123 HG11 ILE 123 -9.639 -4.269 -0.424 970 HG21 ILE 123 HG21 ILE 123 -9.007 -0.634 -0.162 971 HG22 ILE 123 HG22 ILE 123 -7.524 -1.408 0.401 972 HG23 ILE 123 HG23 ILE 123 -8.618 -0.649 1.559 973 HD11 ILE 123 HD11 ILE 123 -11.405 -2.681 -1.015 974 HD12 ILE 123 HD12 ILE 123 -10.460 -3.176 -2.420 975 HD13 ILE 123 HD13 ILE 123 -10.189 -1.594 -1.687 976 H ASP 124 HN ASP 124 -8.958 -3.861 4.345 977 HA ASP 124 HA ASP 124 -10.679 -6.173 3.890 978 HB2 ASP 124 HB2 ASP 124 -9.608 -5.128 6.521 979 HB3 ASP 124 HB1 ASP 124 -10.304 -6.713 6.217 980 H PHE 125 HN PHE 125 -12.801 -5.829 3.814 981 HA PHE 125 HA PHE 125 -13.966 -4.249 6.005 982 HB2 PHE 125 HB2 PHE 125 -15.067 -4.900 3.267 983 HB3 PHE 125 HB1 PHE 125 -16.089 -4.328 4.582 984 HD1 PHE 125 HD1 PHE 125 -15.824 -2.042 5.439 985 HD2 PHE 125 HD2 PHE 125 -13.605 -3.442 2.088 986 HE1 PHE 125 HE1 PHE 125 -15.285 0.278 4.834 987 HE2 PHE 125 HE2 PHE 125 -13.063 -1.119 1.475 988 HZ PHE 125 HZ PHE 125 -13.904 0.743 2.851 989 H SER 126 HN SER 126 -15.091 -5.409 7.507 990 HA SER 126 HA SER 126 -14.761 -8.212 7.537 991 HB2 SER 126 HB2 SER 126 -16.634 -6.522 9.206 992 HB3 SER 126 HB1 SER 126 -16.070 -8.147 9.597 993 HG SER 126 HG SER 126 -14.010 -7.369 9.888 994 H LEU 127 HN LEU 127 -15.723 -9.396 5.980 995 HA LEU 127 HA LEU 127 -18.240 -8.869 4.849 996 HB2 LEU 127 HB2 LEU 127 -16.230 -10.979 4.669 997 HB3 LEU 127 HB1 LEU 127 -17.867 -11.566 4.446 998 HG LEU 127 HG LEU 127 -16.644 -9.299 2.873 999 HD11 LEU 127 HD11 LEU 127 -17.097 -12.167 2.061 1000 HD12 LEU 127 HD12 LEU 127 -15.530 -11.403 2.341 1001 HD13 LEU 127 HD13 LEU 127 -16.549 -10.862 1.003 1002 HD21 LEU 127 HD21 LEU 127 -19.210 -10.831 2.500 1003 HD22 LEU 127 HD22 LEU 127 -18.587 -9.575 1.431 1004 HD23 LEU 127 HD23 LEU 127 -19.068 -9.170 3.078 1005 H ARG 128 HN ARG 128 -19.966 -8.727 6.100 1006 HA ARG 128 HA ARG 128 -20.560 -10.855 8.007 1007 HB2 ARG 128 HB2 ARG 128 -21.656 -8.081 7.593 1008 HB3 ARG 128 HB1 ARG 128 -22.382 -9.234 8.692 1009 HG2 ARG 128 HG2 ARG 128 -20.294 -9.338 9.965 1010 HG3 ARG 128 HG1 ARG 128 -19.580 -8.160 8.861 1011 HD2 ARG 128 HD2 ARG 128 -20.424 -7.182 10.988 1012 HD3 ARG 128 HD1 ARG 128 -21.142 -6.479 9.539 1013 HE ARG 128 HE ARG 128 -22.818 -8.541 10.338 1014 HH11 ARG 128 HH11 ARG 128 -21.643 -5.551 11.741 1015 HH12 ARG 128 HH12 ARG 128 -23.119 -5.222 12.598 1016 HH21 ARG 128 HH21 ARG 128 -24.742 -8.125 11.462 1017 HH22 ARG 128 HH22 ARG 128 -24.883 -6.692 12.437 1018 H GLY 129 HN GLY 129 -21.318 -9.805 4.892 1019 HA2 GLY 129 HA2 GLY 129 -23.148 -11.822 4.309 1020 HA3 GLY 129 HA1 GLY 129 -24.068 -10.379 4.718 1021 H ALA 130 HN ALA 130 -24.864 -10.193 2.598 1022 HA ALA 130 HA ALA 130 -24.944 -9.286 0.518 1023 HB1 ALA 130 HB1 ALA 130 -22.141 -8.341 1.121 1024 HB2 ALA 130 HB2 ALA 130 -23.635 -7.431 1.352 1025 HB3 ALA 130 HB3 ALA 130 -23.099 -7.848 -0.277 1026 H GLY 131 HN GLY 131 -21.572 -10.446 0.810 1027 HA2 GLY 131 HA2 GLY 131 -21.892 -11.923 -1.692 1028 HA3 GLY 131 HA1 GLY 131 -20.392 -11.707 -0.793 1029 H PHE 132 HN PHE 132 -23.613 -13.067 -0.129 1030 HA PHE 132 HA PHE 132 -22.326 -15.237 1.335 1031 HB2 PHE 132 HB2 PHE 132 -24.611 -15.724 2.201 1032 HB3 PHE 132 HB1 PHE 132 -24.039 -14.111 2.598 1033 HD1 PHE 132 HD1 PHE 132 -24.917 -12.159 1.234 1034 HD2 PHE 132 HD2 PHE 132 -26.636 -16.049 1.080 1035 HE1 PHE 132 HE1 PHE 132 -26.987 -11.202 0.316 1036 HE2 PHE 132 HE2 PHE 132 -28.708 -15.097 0.156 1037 HZ PHE 132 HZ PHE 132 -28.885 -12.673 -0.227 Start of MODEL 16 1 H1 LYS 2 HT1 LYS 2 18.747 30.374 29.336 2 H2 LYS 2 HT2 LYS 2 17.642 31.020 28.228 3 H3 LYS 2 HT3 LYS 2 18.711 32.047 29.049 4 HA LYS 2 HA LYS 2 19.455 31.723 26.801 5 HB2 LYS 2 HB2 LYS 2 21.136 30.246 28.841 6 HB3 LYS 2 HB1 LYS 2 21.723 30.831 27.291 7 HG2 LYS 2 HG2 LYS 2 21.345 33.112 27.947 8 HG3 LYS 2 HG1 LYS 2 20.577 32.589 29.445 9 HD2 LYS 2 HD2 LYS 2 22.860 33.312 29.866 10 HD3 LYS 2 HD1 LYS 2 22.693 31.585 30.174 11 HE2 LYS 2 HE2 LYS 2 23.699 31.076 28.026 12 HE3 LYS 2 HE1 LYS 2 23.795 32.793 27.638 13 HZ1 LYS 2 HZ1 LYS 2 25.346 33.119 29.418 14 HZ2 LYS 2 HZ2 LYS 2 25.910 31.858 28.439 15 HZ3 LYS 2 HZ3 LYS 2 25.184 31.511 29.932 16 H VAL 3 HN VAL 3 19.328 30.484 25.040 17 HA VAL 3 HA VAL 3 18.763 27.616 25.430 18 HB VAL 3 HB VAL 3 17.559 27.682 23.282 19 HG11 VAL 3 HG11 VAL 3 16.315 27.974 25.348 20 HG12 VAL 3 HG12 VAL 3 15.607 28.953 24.062 21 HG13 VAL 3 HG13 VAL 3 16.609 29.711 25.300 22 HG21 VAL 3 HG21 VAL 3 18.053 30.657 23.396 23 HG22 VAL 3 HG22 VAL 3 17.004 29.832 22.243 24 HG23 VAL 3 HG23 VAL 3 18.743 29.534 22.223 25 H GLN 4 HN GLN 4 20.934 29.860 24.054 26 HA GLN 4 HA GLN 4 21.935 28.075 22.006 27 HB2 GLN 4 HB2 GLN 4 22.848 30.774 22.999 28 HB3 GLN 4 HB1 GLN 4 23.678 29.883 21.731 29 HG2 GLN 4 HG2 GLN 4 20.808 30.777 21.629 30 HG3 GLN 4 HG1 GLN 4 22.161 31.594 20.847 31 HE21 GLN 4 HE21 GLN 4 23.169 30.617 19.081 32 HE22 GLN 4 HE22 GLN 4 22.395 29.366 18.167 33 H GLU 5 HN GLU 5 22.003 26.967 24.581 34 HA GLU 5 HA GLU 5 24.775 27.104 25.463 35 HB2 GLU 5 HB2 GLU 5 22.513 25.435 26.578 36 HB3 GLU 5 HB1 GLU 5 24.051 25.785 27.354 37 HG2 GLU 5 HG2 GLU 5 21.922 27.813 26.707 38 HG3 GLU 5 HG1 GLU 5 22.206 27.091 28.290 39 H GLN 6 HN GLN 6 26.254 25.714 24.754 40 HA GLN 6 HA GLN 6 25.548 23.513 23.056 41 HB2 GLN 6 HB2 GLN 6 27.632 24.842 22.778 42 HB3 GLN 6 HB1 GLN 6 28.220 24.192 24.302 43 HG2 GLN 6 HG2 GLN 6 29.211 23.029 22.423 44 HG3 GLN 6 HG1 GLN 6 28.191 21.943 23.366 45 HE21 GLN 6 HE21 GLN 6 28.544 23.669 20.374 46 HE22 GLN 6 HE22 GLN 6 27.308 22.829 19.509 47 H SER 7 HN SER 7 24.226 22.251 24.368 48 HA SER 7 HA SER 7 25.134 21.278 26.913 49 HB2 SER 7 HB2 SER 7 22.765 20.369 25.262 50 HB3 SER 7 HB1 SER 7 23.008 20.121 26.992 51 HG SER 7 HG SER 7 23.142 22.746 26.133 52 H VAL 8 HN VAL 8 25.426 19.037 27.431 53 HA VAL 8 HA VAL 8 26.510 17.491 25.167 54 HB VAL 8 HB VAL 8 27.191 17.215 28.102 55 HG11 VAL 8 HG11 VAL 8 27.429 15.128 26.867 56 HG12 VAL 8 HG12 VAL 8 29.008 15.770 27.316 57 HG13 VAL 8 HG13 VAL 8 28.425 15.943 25.660 58 HG21 VAL 8 HG21 VAL 8 29.358 18.203 27.493 59 HG22 VAL 8 HG22 VAL 8 28.022 19.321 27.224 60 HG23 VAL 8 HG23 VAL 8 28.759 18.483 25.859 61 H GLY 9 HN GLY 9 24.790 16.289 24.515 62 HA2 GLY 9 HA2 GLY 9 23.323 14.764 26.565 63 HA3 GLY 9 HA1 GLY 9 22.759 15.079 24.929 64 H ALA 10 HN ALA 10 23.041 12.550 26.390 65 HA ALA 10 HA ALA 10 24.993 11.193 24.647 66 HB1 ALA 10 HB1 ALA 10 23.841 10.275 27.286 67 HB2 ALA 10 HB2 ALA 10 25.468 10.903 27.023 68 HB3 ALA 10 HB3 ALA 10 24.987 9.372 26.294 69 HA PRO 11 HA PRO 11 21.060 9.751 22.928 70 HB2 PRO 11 HB2 PRO 11 21.941 9.408 20.411 71 HB3 PRO 11 HB1 PRO 11 21.557 11.007 21.057 72 HG2 PRO 11 HG2 PRO 11 24.207 9.715 20.636 73 HG3 PRO 11 HG1 PRO 11 23.737 11.411 20.430 74 HD2 PRO 11 HD2 PRO 11 25.067 10.367 22.638 75 HD3 PRO 11 HD1 PRO 11 24.178 11.902 22.609 76 HA PRO 12 HA PRO 12 22.031 5.425 23.727 77 HB2 PRO 12 HB2 PRO 12 19.294 5.260 22.552 78 HB3 PRO 12 HB1 PRO 12 19.947 4.486 24.000 79 HG2 PRO 12 HG2 PRO 12 18.358 6.608 24.200 80 HG3 PRO 12 HG1 PRO 12 19.755 6.416 25.276 81 HD2 PRO 12 HD2 PRO 12 19.402 8.216 22.926 82 HD3 PRO 12 HD1 PRO 12 20.303 8.488 24.430 83 HA PRO 13 HA PRO 13 21.544 4.100 19.160 84 HB2 PRO 13 HB2 PRO 13 20.541 6.236 17.515 85 HB3 PRO 13 HB1 PRO 13 19.797 4.672 17.850 86 HG2 PRO 13 HG2 PRO 13 18.794 7.076 18.718 87 HG3 PRO 13 HG1 PRO 13 18.477 5.521 19.504 88 HD2 PRO 13 HD2 PRO 13 20.429 7.660 20.249 89 HD3 PRO 13 HD1 PRO 13 19.395 6.662 21.294 90 H GLY 14 HN GLY 14 23.010 6.778 20.342 91 HA2 GLY 14 HA2 GLY 14 24.966 7.861 19.821 92 HA3 GLY 14 HA1 GLY 14 25.212 6.666 18.554 93 H ARG 15 HN ARG 15 25.883 8.066 16.968 94 HA ARG 15 HA ARG 15 23.829 9.958 16.025 95 HB2 ARG 15 HB2 ARG 15 26.811 10.033 15.524 96 HB3 ARG 15 HB1 ARG 15 25.639 11.184 14.897 97 HG2 ARG 15 HG2 ARG 15 26.449 10.764 17.763 98 HG3 ARG 15 HG1 ARG 15 26.708 12.193 16.760 99 HD2 ARG 15 HD2 ARG 15 24.059 11.130 17.736 100 HD3 ARG 15 HD1 ARG 15 24.887 12.577 18.309 101 HE ARG 15 HE ARG 15 24.611 13.329 15.858 102 HH11 ARG 15 HH11 ARG 15 22.353 11.283 17.580 103 HH12 ARG 15 HH12 ARG 15 20.955 11.880 16.736 104 HH21 ARG 15 HH21 ARG 15 22.772 14.116 14.725 105 HH22 ARG 15 HH22 ARG 15 21.197 13.485 15.110 106 H ALA 16 HN ALA 16 23.560 7.299 15.472 107 HA ALA 16 HA ALA 16 24.175 7.202 12.597 108 HB1 ALA 16 HB1 ALA 16 24.256 4.767 12.763 109 HB2 ALA 16 HB2 ALA 16 23.958 4.869 14.498 110 HB3 ALA 16 HB3 ALA 16 25.453 5.514 13.820 111 H ASP 17 HN ASP 17 22.411 7.408 11.410 112 HA ASP 17 HA ASP 17 19.810 6.671 12.561 113 HB2 ASP 17 HB2 ASP 17 20.049 8.952 11.621 114 HB3 ASP 17 HB1 ASP 17 20.453 8.253 10.054 115 H LYS 18 HN LYS 18 21.698 6.323 9.578 116 HA LYS 18 HA LYS 18 20.653 3.616 9.257 117 HB2 LYS 18 HB2 LYS 18 20.576 5.708 7.067 118 HB3 LYS 18 HB1 LYS 18 20.260 3.995 6.828 119 HG2 LYS 18 HG2 LYS 18 18.335 4.143 8.336 120 HG3 LYS 18 HG1 LYS 18 18.652 5.864 8.561 121 HD2 LYS 18 HD2 LYS 18 18.290 6.224 6.157 122 HD3 LYS 18 HD1 LYS 18 17.935 4.505 5.962 123 HE2 LYS 18 HE2 LYS 18 15.851 5.675 6.112 124 HE3 LYS 18 HE1 LYS 18 16.080 4.770 7.607 125 HZ1 LYS 18 HZ1 LYS 18 17.080 6.989 8.456 126 HZ2 LYS 18 HZ2 LYS 18 15.398 6.821 8.361 127 HZ3 LYS 18 HZ3 LYS 18 16.222 7.680 7.162 128 H THR 19 HN THR 19 22.390 2.346 9.139 129 HA THR 19 HA THR 19 24.918 3.540 8.253 130 HB THR 19 HB THR 19 25.902 1.429 9.315 131 HG1 THR 19 HG1 THR 19 23.931 0.239 9.430 132 HG21 THR 19 HG21 THR 19 26.012 3.629 10.382 133 HG22 THR 19 HG22 THR 19 25.757 2.360 11.579 134 HG23 THR 19 HG23 THR 19 24.409 3.379 11.076 135 H ALA 20 HN ALA 20 24.089 3.310 5.998 136 HA ALA 20 HA ALA 20 24.010 0.611 4.943 137 HB1 ALA 20 HB1 ALA 20 22.426 2.248 4.086 138 HB2 ALA 20 HB2 ALA 20 23.500 1.694 2.800 139 HB3 ALA 20 HB3 ALA 20 23.757 3.272 3.545 140 H ALA 21 HN ALA 21 26.279 0.281 5.718 141 HA ALA 21 HA ALA 21 28.444 1.542 4.405 142 HB1 ALA 21 HB1 ALA 21 29.823 -0.266 5.261 143 HB2 ALA 21 HB2 ALA 21 28.379 -1.192 5.674 144 HB3 ALA 21 HB3 ALA 21 28.723 0.323 6.508 145 HA PRO 22 HA PRO 22 27.978 -1.680 0.996 146 HB2 PRO 22 HB2 PRO 22 26.228 -3.803 1.433 147 HB3 PRO 22 HB1 PRO 22 27.975 -3.856 1.669 148 HG2 PRO 22 HG2 PRO 22 25.961 -4.059 3.660 149 HG3 PRO 22 HG1 PRO 22 27.712 -3.967 3.907 150 HD2 PRO 22 HD2 PRO 22 25.658 -1.832 4.096 151 HD3 PRO 22 HD1 PRO 22 27.212 -1.990 4.945 152 H GLN 23 HN GLN 23 25.886 -2.796 -0.379 153 HA GLN 23 HA GLN 23 24.065 -0.536 -0.573 154 HB2 GLN 23 HB2 GLN 23 24.298 -3.012 -2.293 155 HB3 GLN 23 HB1 GLN 23 23.221 -1.660 -2.610 156 HG2 GLN 23 HG2 GLN 23 25.288 -0.204 -2.662 157 HG3 GLN 23 HG1 GLN 23 26.217 -1.702 -2.692 158 HE21 GLN 23 HE21 GLN 23 23.109 -1.271 -4.245 159 HE22 GLN 23 HE22 GLN 23 23.693 -1.383 -5.872 160 H THR 24 HN THR 24 23.722 -1.831 1.782 161 HA THR 24 HA THR 24 21.650 -3.804 1.670 162 HB THR 24 HB THR 24 21.521 -3.146 4.198 163 HG1 THR 24 HG1 THR 24 23.515 -2.155 4.882 164 HG21 THR 24 HG21 THR 24 22.506 -5.223 3.384 165 HG22 THR 24 HG22 THR 24 23.499 -4.533 4.670 166 HG23 THR 24 HG23 THR 24 24.000 -4.373 2.987 167 H ARG 25 HN ARG 25 21.691 -0.490 1.236 168 HA ARG 25 HA ARG 25 19.193 0.202 2.400 169 HB2 ARG 25 HB2 ARG 25 19.343 2.243 1.109 170 HB3 ARG 25 HB1 ARG 25 20.919 1.875 1.794 171 HG2 ARG 25 HG2 ARG 25 21.550 0.887 -0.418 172 HG3 ARG 25 HG1 ARG 25 20.028 1.512 -1.055 173 HD2 ARG 25 HD2 ARG 25 22.299 3.109 0.118 174 HD3 ARG 25 HD1 ARG 25 21.804 3.054 -1.572 175 HE ARG 25 HE ARG 25 20.069 4.152 0.553 176 HH11 ARG 25 HH11 ARG 25 21.531 4.330 -2.618 177 HH12 ARG 25 HH12 ARG 25 20.772 5.833 -3.034 178 HH21 ARG 25 HH21 ARG 25 19.030 6.122 0.004 179 HH22 ARG 25 HH22 ARG 25 19.355 6.862 -1.542 180 H LEU 26 HN LEU 26 20.073 -1.608 -0.342 181 HA LEU 26 HA LEU 26 17.365 -1.360 -1.474 182 HB2 LEU 26 HB2 LEU 26 19.337 -0.956 -2.983 183 HB3 LEU 26 HB1 LEU 26 19.805 -2.627 -2.734 184 HG LEU 26 HG LEU 26 17.627 -3.330 -3.731 185 HD11 LEU 26 HD11 LEU 26 16.343 -1.315 -3.283 186 HD12 LEU 26 HD12 LEU 26 16.345 -1.680 -5.008 187 HD13 LEU 26 HD13 LEU 26 17.376 -0.395 -4.377 188 HD21 LEU 26 HD21 LEU 26 18.270 -2.837 -6.038 189 HD22 LEU 26 HD22 LEU 26 19.668 -3.284 -5.060 190 HD23 LEU 26 HD23 LEU 26 19.380 -1.591 -5.464 191 H THR 27 HN THR 27 17.831 -2.752 0.928 192 HA THR 27 HA THR 27 17.384 -5.530 0.087 193 HB THR 27 HB THR 27 18.421 -4.540 2.748 194 HG1 THR 27 HG1 THR 27 19.666 -4.958 0.462 195 HG21 THR 27 HG21 THR 27 17.066 -6.565 2.988 196 HG22 THR 27 HG22 THR 27 18.774 -6.906 3.268 197 HG23 THR 27 HG23 THR 27 18.023 -7.359 1.737 198 HA PRO 28 HA PRO 28 13.997 -4.682 3.452 199 HB2 PRO 28 HB2 PRO 28 13.597 -2.111 4.227 200 HB3 PRO 28 HB1 PRO 28 14.700 -3.206 5.069 201 HG2 PRO 28 HG2 PRO 28 15.315 -1.101 3.027 202 HG3 PRO 28 HG1 PRO 28 16.149 -1.454 4.553 203 HD2 PRO 28 HD2 PRO 28 17.094 -2.309 2.185 204 HD3 PRO 28 HD1 PRO 28 17.270 -3.268 3.667 205 H TYR 29 HN TYR 29 11.804 -3.715 3.304 206 HA TYR 29 HA TYR 29 11.127 -3.231 0.543 207 HB2 TYR 29 HB2 TYR 29 9.438 -3.515 3.036 208 HB3 TYR 29 HB1 TYR 29 8.764 -3.242 1.434 209 HD1 TYR 29 HD1 TYR 29 10.764 -5.622 3.456 210 HD2 TYR 29 HD2 TYR 29 8.446 -5.036 -0.066 211 HE1 TYR 29 HE1 TYR 29 10.775 -8.048 3.051 212 HE2 TYR 29 HE2 TYR 29 8.448 -7.459 -0.476 213 HH TYR 29 HH TYR 29 9.610 -9.727 1.886 214 H ALA 30 HN ALA 30 12.516 -1.160 0.884 215 HA ALA 30 HA ALA 30 12.650 1.096 0.823 216 HB1 ALA 30 HB1 ALA 30 9.660 0.938 0.481 217 HB2 ALA 30 HB2 ALA 30 10.863 0.910 -0.808 218 HB3 ALA 30 HB3 ALA 30 10.654 2.362 0.171 219 H GLN 31 HN GLN 31 9.471 1.336 2.265 220 HA GLN 31 HA GLN 31 10.520 1.617 4.940 221 HB2 GLN 31 HB2 GLN 31 9.444 3.883 5.229 222 HB3 GLN 31 HB1 GLN 31 10.918 3.855 4.271 223 HG2 GLN 31 HG2 GLN 31 9.632 3.993 2.231 224 HG3 GLN 31 HG1 GLN 31 8.126 3.921 3.147 225 HE21 GLN 31 HE21 GLN 31 10.945 5.845 2.409 226 HE22 GLN 31 HE22 GLN 31 10.276 7.360 2.916 227 H ALA 32 HN ALA 32 8.649 -0.079 3.461 228 HA ALA 32 HA ALA 32 6.036 0.552 4.556 229 HB1 ALA 32 HB1 ALA 32 7.017 -1.925 3.131 230 HB2 ALA 32 HB2 ALA 32 6.204 -0.552 2.377 231 HB3 ALA 32 HB3 ALA 32 5.340 -1.563 3.537 232 H GLY 33 HN GLY 33 7.077 0.682 6.741 233 HA2 GLY 33 HA2 GLY 33 7.604 -1.953 7.921 234 HA3 GLY 33 HA1 GLY 33 8.121 -0.415 8.589 235 H GLU 34 HN GLU 34 7.258 -0.652 10.574 236 HA GLU 34 HA GLU 34 4.506 -1.556 10.859 237 HB2 GLU 34 HB2 GLU 34 5.049 -1.654 13.273 238 HB3 GLU 34 HB1 GLU 34 6.137 -2.616 12.281 239 HG2 GLU 34 HG2 GLU 34 7.843 -0.911 12.436 240 HG3 GLU 34 HG1 GLU 34 6.744 0.140 13.328 241 H ASP 35 HN ASP 35 5.444 1.274 10.006 242 HA ASP 35 HA ASP 35 4.286 2.927 12.061 243 HB2 ASP 35 HB2 ASP 35 5.301 3.448 9.286 244 HB3 ASP 35 HB1 ASP 35 4.311 4.658 10.096 245 H ASN 36 HN ASN 36 2.352 4.195 11.774 246 HA ASN 36 HA ASN 36 0.259 2.580 10.562 247 HB2 ASN 36 HB2 ASN 36 0.279 4.879 12.498 248 HB3 ASN 36 HB1 ASN 36 -1.214 4.384 11.707 249 HD21 ASN 36 HD21 ASN 36 -0.279 4.281 14.536 250 HD22 ASN 36 HD22 ASN 36 -0.524 2.635 15.018 251 H TRP 37 HN TRP 37 1.608 3.442 8.518 252 HA TRP 37 HA TRP 37 0.918 6.063 7.647 253 HB2 TRP 37 HB2 TRP 37 1.790 5.231 5.387 254 HB3 TRP 37 HB1 TRP 37 2.927 5.282 6.721 255 HD1 TRP 37 HD1 TRP 37 3.454 2.816 7.899 256 HE1 TRP 37 HE1 TRP 37 3.664 0.507 6.777 257 HE3 TRP 37 HE3 TRP 37 1.011 3.832 3.531 258 HZ2 TRP 37 HZ2 TRP 37 2.903 -0.712 4.342 259 HZ3 TRP 37 HZ3 TRP 37 0.806 2.048 1.848 260 HH2 TRP 37 HH2 TRP 37 1.732 -0.177 2.246 261 H ARG 38 HN ARG 38 -0.477 2.877 7.106 262 HA ARG 38 HA ARG 38 -2.251 3.733 5.050 263 HB2 ARG 38 HB2 ARG 38 -3.199 1.633 5.079 264 HB3 ARG 38 HB1 ARG 38 -1.576 1.298 5.665 265 HG2 ARG 38 HG2 ARG 38 -4.083 1.520 7.331 266 HG3 ARG 38 HG1 ARG 38 -3.230 0.037 6.910 267 HD2 ARG 38 HD2 ARG 38 -1.234 0.999 8.127 268 HD3 ARG 38 HD1 ARG 38 -2.302 2.268 8.700 269 HE ARG 38 HE ARG 38 -3.671 0.322 9.624 270 HH11 ARG 38 HH11 ARG 38 -0.186 0.224 9.246 271 HH12 ARG 38 HH12 ARG 38 0.057 -0.812 10.626 272 HH21 ARG 38 HH21 ARG 38 -3.349 -1.031 11.433 273 HH22 ARG 38 HH22 ARG 38 -1.742 -1.521 11.868 274 H SER 39 HN SER 39 -2.270 3.890 8.480 275 HA SER 39 HA SER 39 -5.051 4.346 8.816 276 HB2 SER 39 HB2 SER 39 -2.990 5.420 10.706 277 HB3 SER 39 HB1 SER 39 -4.521 4.618 11.050 278 HG SER 39 HG SER 39 -3.416 2.861 11.260 279 H ARG 40 HN ARG 40 -2.209 6.328 8.225 280 HA ARG 40 HA ARG 40 -3.550 8.827 8.402 281 HB2 ARG 40 HB2 ARG 40 -0.973 8.063 7.012 282 HB3 ARG 40 HB1 ARG 40 -1.494 9.669 7.426 283 HG2 ARG 40 HG2 ARG 40 -0.879 7.509 9.405 284 HG3 ARG 40 HG1 ARG 40 0.187 8.853 8.985 285 HD2 ARG 40 HD2 ARG 40 -1.374 10.442 9.870 286 HD3 ARG 40 HD1 ARG 40 -2.587 9.188 10.114 287 HE ARG 40 HE ARG 40 -0.294 8.503 11.578 288 HH11 ARG 40 HH11 ARG 40 -2.795 10.956 11.563 289 HH12 ARG 40 HH12 ARG 40 -2.766 11.179 13.290 290 HH21 ARG 40 HH21 ARG 40 -0.256 8.771 13.829 291 HH22 ARG 40 HH22 ARG 40 -1.339 9.909 14.591 292 H ILE 41 HN ILE 41 -2.711 6.532 5.867 293 HA ILE 41 HA ILE 41 -3.655 7.884 3.620 294 HB ILE 41 HB ILE 41 -3.701 4.931 4.276 295 HG12 ILE 41 HG12 ILE 41 -1.909 6.584 2.485 296 HG13 ILE 41 HG11 ILE 41 -1.476 5.940 4.065 297 HG21 ILE 41 HG21 ILE 41 -5.441 5.318 2.651 298 HG22 ILE 41 HG22 ILE 41 -4.068 4.538 1.864 299 HG23 ILE 41 HG23 ILE 41 -4.342 6.267 1.651 300 HD11 ILE 41 HD11 ILE 41 -2.140 4.314 1.622 301 HD12 ILE 41 HD12 ILE 41 -1.701 3.671 3.205 302 HD13 ILE 41 HD13 ILE 41 -0.527 4.604 2.276 303 H SER 42 HN SER 42 -5.347 5.772 5.896 304 HA SER 42 HA SER 42 -7.888 5.851 4.794 305 HB2 SER 42 HB2 SER 42 -7.095 5.667 7.704 306 HB3 SER 42 HB1 SER 42 -8.691 5.274 7.066 307 HG SER 42 HG SER 42 -6.223 3.992 6.459 308 H GLY 43 HN GLY 43 -6.319 8.248 6.889 309 HA2 GLY 43 HA2 GLY 43 -8.623 9.769 7.472 310 HA3 GLY 43 HA1 GLY 43 -6.975 10.380 7.477 311 H ARG 44 HN ARG 44 -6.156 10.344 4.954 312 HA ARG 44 HA ARG 44 -7.738 12.297 3.664 313 HB2 ARG 44 HB2 ARG 44 -6.099 11.977 1.749 314 HB3 ARG 44 HB1 ARG 44 -5.481 12.557 3.272 315 HG2 ARG 44 HG2 ARG 44 -4.765 10.215 3.766 316 HG3 ARG 44 HG1 ARG 44 -5.185 9.850 2.089 317 HD2 ARG 44 HD2 ARG 44 -2.757 10.428 2.524 318 HD3 ARG 44 HD1 ARG 44 -3.565 11.338 1.248 319 HE ARG 44 HE ARG 44 -3.615 12.603 3.848 320 HH11 ARG 44 HH11 ARG 44 -1.820 12.254 0.845 321 HH12 ARG 44 HH12 ARG 44 -1.024 13.788 1.012 322 HH21 ARG 44 HH21 ARG 44 -2.573 14.589 4.054 323 HH22 ARG 44 HH22 ARG 44 -1.461 15.116 2.826 324 H LEU 45 HN LEU 45 -7.562 8.814 3.333 325 HA LEU 45 HA LEU 45 -9.002 8.463 0.980 326 HB2 LEU 45 HB2 LEU 45 -8.078 6.782 2.826 327 HB3 LEU 45 HB1 LEU 45 -9.725 6.865 3.402 328 HG LEU 45 HG LEU 45 -8.972 6.046 0.599 329 HD11 LEU 45 HD11 LEU 45 -9.485 3.754 1.347 330 HD12 LEU 45 HD12 LEU 45 -9.612 4.348 3.003 331 HD13 LEU 45 HD13 LEU 45 -8.069 4.437 2.152 332 HD21 LEU 45 HD21 LEU 45 -11.555 5.670 2.098 333 HD22 LEU 45 HD22 LEU 45 -11.228 5.258 0.412 334 HD23 LEU 45 HD23 LEU 45 -11.261 6.948 0.920 335 H ASN 46 HN ASN 46 -10.048 9.429 4.160 336 HA ASN 46 HA ASN 46 -12.860 9.322 3.714 337 HB2 ASN 46 HB2 ASN 46 -11.686 9.222 5.971 338 HB3 ASN 46 HB1 ASN 46 -11.404 10.950 5.810 339 HD21 ASN 46 HD21 ASN 46 -12.880 9.544 7.838 340 HD22 ASN 46 HD22 ASN 46 -14.506 10.154 7.788 341 H ARG 47 HN ARG 47 -10.325 11.705 3.435 342 HA ARG 47 HA ARG 47 -11.721 14.012 2.920 343 HB2 ARG 47 HB2 ARG 47 -9.609 14.662 2.669 344 HB3 ARG 47 HB1 ARG 47 -9.081 13.001 2.568 345 HG2 ARG 47 HG2 ARG 47 -9.691 13.116 0.098 346 HG3 ARG 47 HG1 ARG 47 -9.788 14.864 0.328 347 HD2 ARG 47 HD2 ARG 47 -7.459 14.868 1.132 348 HD3 ARG 47 HD1 ARG 47 -7.363 13.119 0.847 349 HE ARG 47 HE ARG 47 -8.198 14.555 -1.486 350 HH11 ARG 47 HH11 ARG 47 -5.348 13.782 0.403 351 HH12 ARG 47 HH12 ARG 47 -4.279 13.869 -0.957 352 HH21 ARG 47 HH21 ARG 47 -6.804 14.677 -3.250 353 HH22 ARG 47 HH22 ARG 47 -5.099 14.383 -3.050 354 H PHE 48 HN PHE 48 -11.380 11.147 0.961 355 HA PHE 48 HA PHE 48 -12.856 12.446 -1.178 356 HB2 PHE 48 HB2 PHE 48 -11.068 10.114 -1.060 357 HB3 PHE 48 HB1 PHE 48 -12.446 9.958 -2.142 358 HD1 PHE 48 HD1 PHE 48 -12.758 11.667 -3.952 359 HD2 PHE 48 HD2 PHE 48 -9.184 11.367 -1.662 360 HE1 PHE 48 HE1 PHE 48 -11.541 12.894 -5.700 361 HE2 PHE 48 HE2 PHE 48 -7.961 12.601 -3.405 362 HZ PHE 48 HZ PHE 48 -9.140 13.364 -5.430 363 H LYS 49 HN LYS 49 -12.937 9.391 0.627 364 HA LYS 49 HA LYS 49 -15.724 9.486 1.143 365 HB2 LYS 49 HB2 LYS 49 -14.909 8.400 -1.419 366 HB3 LYS 49 HB1 LYS 49 -15.662 7.157 -0.439 367 HG2 LYS 49 HG2 LYS 49 -17.693 8.351 -0.304 368 HG3 LYS 49 HG1 LYS 49 -16.950 9.826 -0.927 369 HD2 LYS 49 HD2 LYS 49 -18.257 8.810 -2.678 370 HD3 LYS 49 HD1 LYS 49 -16.548 8.664 -3.082 371 HE2 LYS 49 HE2 LYS 49 -17.404 6.562 -3.599 372 HE3 LYS 49 HE1 LYS 49 -16.705 6.338 -1.997 373 HZ1 LYS 49 HZ1 LYS 49 -18.866 6.464 -1.016 374 HZ2 LYS 49 HZ2 LYS 49 -18.941 5.335 -2.281 375 HZ3 LYS 49 HZ3 LYS 49 -19.581 6.892 -2.493 376 H ARG 50 HN ARG 50 -15.271 8.736 3.211 377 HA ARG 50 HA ARG 50 -14.676 5.886 3.292 378 HB2 ARG 50 HB2 ARG 50 -12.529 7.172 3.721 379 HB3 ARG 50 HB1 ARG 50 -13.276 7.744 5.208 380 HG2 ARG 50 HG2 ARG 50 -13.494 5.457 5.999 381 HG3 ARG 50 HG1 ARG 50 -12.787 4.860 4.494 382 HD2 ARG 50 HD2 ARG 50 -10.722 6.055 4.982 383 HD3 ARG 50 HD1 ARG 50 -11.422 6.686 6.468 384 HE ARG 50 HE ARG 50 -10.560 3.937 5.963 385 HH11 ARG 50 HH11 ARG 50 -12.045 6.231 8.162 386 HH12 ARG 50 HH12 ARG 50 -11.654 5.302 9.584 387 HH21 ARG 50 HH21 ARG 50 -10.064 2.726 7.819 388 HH22 ARG 50 HH22 ARG 50 -10.548 3.304 9.385 389 H TYR 51 HN TYR 51 -16.522 5.181 4.047 390 HA TYR 51 HA TYR 51 -17.974 6.669 6.095 391 HB2 TYR 51 HB2 TYR 51 -18.835 5.558 3.812 392 HB3 TYR 51 HB1 TYR 51 -19.024 4.164 4.873 393 HD1 TYR 51 HD1 TYR 51 -19.994 7.701 4.407 394 HD2 TYR 51 HD2 TYR 51 -20.865 4.022 6.347 395 HE1 TYR 51 HE1 TYR 51 -22.125 8.629 5.188 396 HE2 TYR 51 HE2 TYR 51 -23.002 4.939 7.140 397 HH TYR 51 HH TYR 51 -24.054 7.068 7.563 398 HA PRO 52 HA PRO 52 -16.818 3.953 9.466 399 HB2 PRO 52 HB2 PRO 52 -19.713 4.167 10.147 400 HB3 PRO 52 HB1 PRO 52 -18.293 4.421 11.169 401 HG2 PRO 52 HG2 PRO 52 -19.671 6.499 10.253 402 HG3 PRO 52 HG1 PRO 52 -17.899 6.548 10.325 403 HD2 PRO 52 HD2 PRO 52 -19.695 6.172 7.968 404 HD3 PRO 52 HD1 PRO 52 -18.152 7.042 8.086 405 H LYS 53 HN LYS 53 -16.731 1.804 9.704 406 HA LYS 53 HA LYS 53 -17.736 0.187 7.632 407 HB2 LYS 53 HB2 LYS 53 -16.468 -0.599 10.252 408 HB3 LYS 53 HB1 LYS 53 -16.774 -1.705 8.923 409 HG2 LYS 53 HG2 LYS 53 -14.923 0.675 8.895 410 HG3 LYS 53 HG1 LYS 53 -14.457 -1.024 8.926 411 HD2 LYS 53 HD2 LYS 53 -14.243 -0.666 6.693 412 HD3 LYS 53 HD1 LYS 53 -15.965 -1.049 6.719 413 HE2 LYS 53 HE2 LYS 53 -15.625 0.932 5.380 414 HE3 LYS 53 HE1 LYS 53 -16.456 1.375 6.864 415 HZ1 LYS 53 HZ1 LYS 53 -14.376 2.157 7.787 416 HZ2 LYS 53 HZ2 LYS 53 -14.696 2.934 6.319 417 HZ3 LYS 53 HZ3 LYS 53 -13.540 1.697 6.383 418 H ASP 54 HN ASP 54 -19.094 1.000 10.679 419 HA ASP 54 HA ASP 54 -20.712 -1.166 11.289 420 HB2 ASP 54 HB2 ASP 54 -20.476 0.820 12.719 421 HB3 ASP 54 HB1 ASP 54 -21.357 1.783 11.541 422 H ALA 55 HN ALA 55 -21.221 1.404 8.929 423 HA ALA 55 HA ALA 55 -23.804 0.458 8.121 424 HB1 ALA 55 HB1 ALA 55 -23.138 2.811 7.884 425 HB2 ALA 55 HB2 ALA 55 -23.639 2.099 6.350 426 HB3 ALA 55 HB3 ALA 55 -21.927 2.334 6.695 427 H LEU 56 HN LEU 56 -20.500 -0.003 7.015 428 HA LEU 56 HA LEU 56 -21.179 -1.044 4.457 429 HB2 LEU 56 HB2 LEU 56 -18.632 -1.115 6.063 430 HB3 LEU 56 HB1 LEU 56 -18.764 -1.864 4.488 431 HG LEU 56 HG LEU 56 -17.703 0.248 4.205 432 HD11 LEU 56 HD11 LEU 56 -19.312 -0.356 2.479 433 HD12 LEU 56 HD12 LEU 56 -19.200 1.392 2.686 434 HD13 LEU 56 HD13 LEU 56 -20.576 0.513 3.351 435 HD21 LEU 56 HD21 LEU 56 -18.650 2.344 4.910 436 HD22 LEU 56 HD22 LEU 56 -18.457 1.276 6.299 437 HD23 LEU 56 HD23 LEU 56 -20.053 1.519 5.588 438 H ARG 57 HN ARG 57 -20.344 -2.604 7.547 439 HA ARG 57 HA ARG 57 -20.266 -5.233 6.472 440 HB2 ARG 57 HB2 ARG 57 -20.474 -5.983 8.826 441 HB3 ARG 57 HB1 ARG 57 -19.213 -4.777 8.593 442 HG2 ARG 57 HG2 ARG 57 -20.538 -3.075 9.563 443 HG3 ARG 57 HG1 ARG 57 -21.978 -4.095 9.553 444 HD2 ARG 57 HD2 ARG 57 -21.102 -3.991 11.783 445 HD3 ARG 57 HD1 ARG 57 -20.863 -5.614 11.147 446 HE ARG 57 HE ARG 57 -18.512 -5.019 10.826 447 HH11 ARG 57 HH11 ARG 57 -20.461 -3.002 12.902 448 HH12 ARG 57 HH12 ARG 57 -19.111 -2.439 13.854 449 HH21 ARG 57 HH21 ARG 57 -16.718 -4.321 12.100 450 HH22 ARG 57 HH22 ARG 57 -16.997 -3.205 13.402 451 H LEU 58 HN LEU 58 -22.790 -3.131 6.880 452 HA LEU 58 HA LEU 58 -24.779 -5.297 6.919 453 HB2 LEU 58 HB2 LEU 58 -24.831 -3.825 8.897 454 HB3 LEU 58 HB1 LEU 58 -25.044 -2.436 7.854 455 HG LEU 58 HG LEU 58 -27.236 -3.276 7.157 456 HD11 LEU 58 HD11 LEU 58 -26.811 -5.667 7.363 457 HD12 LEU 58 HD12 LEU 58 -28.242 -5.199 8.280 458 HD13 LEU 58 HD13 LEU 58 -26.721 -5.509 9.117 459 HD21 LEU 58 HD21 LEU 58 -26.868 -3.168 10.149 460 HD22 LEU 58 HD22 LEU 58 -28.390 -2.939 9.287 461 HD23 LEU 58 HD23 LEU 58 -27.074 -1.784 9.074 462 H LYS 59 HN LYS 59 -23.208 -3.700 4.744 463 HA LYS 59 HA LYS 59 -25.447 -3.363 2.950 464 HB2 LYS 59 HB2 LYS 59 -25.457 -1.189 4.020 465 HB3 LYS 59 HB1 LYS 59 -23.734 -0.999 3.732 466 HG2 LYS 59 HG2 LYS 59 -24.124 -0.919 1.338 467 HG3 LYS 59 HG1 LYS 59 -25.847 -1.165 1.604 468 HD2 LYS 59 HD2 LYS 59 -24.259 1.166 2.663 469 HD3 LYS 59 HD1 LYS 59 -25.241 1.207 1.200 470 HE2 LYS 59 HE2 LYS 59 -26.293 0.570 3.951 471 HE3 LYS 59 HE1 LYS 59 -26.368 2.162 3.201 472 HZ1 LYS 59 HZ1 LYS 59 -27.673 1.174 1.395 473 HZ2 LYS 59 HZ2 LYS 59 -28.441 1.025 2.901 474 HZ3 LYS 59 HZ3 LYS 59 -27.669 -0.319 2.207 475 H ARG 60 HN ARG 60 -22.065 -2.203 3.097 476 HA ARG 60 HA ARG 60 -21.577 -3.646 0.572 477 HB2 ARG 60 HB2 ARG 60 -20.233 -1.081 1.444 478 HB3 ARG 60 HB1 ARG 60 -20.036 -1.903 -0.094 479 HG2 ARG 60 HG2 ARG 60 -22.593 -0.641 0.865 480 HG3 ARG 60 HG1 ARG 60 -21.433 0.118 -0.223 481 HD2 ARG 60 HD2 ARG 60 -21.771 -1.849 -1.766 482 HD3 ARG 60 HD1 ARG 60 -23.118 -2.325 -0.729 483 HE ARG 60 HE ARG 60 -23.332 0.399 -1.548 484 HH11 ARG 60 HH11 ARG 60 -23.949 -2.901 -2.563 485 HH12 ARG 60 HH12 ARG 60 -25.073 -2.436 -3.803 486 HH21 ARG 60 HH21 ARG 60 -24.817 1.009 -3.178 487 HH22 ARG 60 HH22 ARG 60 -25.590 -0.223 -4.138 488 H GLN 61 HN GLN 61 -20.834 -5.438 1.868 489 HA GLN 61 HA GLN 61 -18.414 -5.059 3.417 490 HB2 GLN 61 HB2 GLN 61 -19.630 -7.691 2.571 491 HB3 GLN 61 HB1 GLN 61 -18.522 -7.404 3.898 492 HG2 GLN 61 HG2 GLN 61 -20.548 -7.708 4.959 493 HG3 GLN 61 HG1 GLN 61 -20.405 -5.955 4.883 494 HE21 GLN 61 HE21 GLN 61 -21.204 -7.927 2.113 495 HE22 GLN 61 HE22 GLN 61 -22.842 -7.394 1.970 496 H GLY 62 HN GLY 62 -16.586 -6.807 2.815 497 HA2 GLY 62 HA2 GLY 62 -16.183 -7.967 0.447 498 HA3 GLY 62 HA1 GLY 62 -15.958 -6.282 0.026 499 H VAL 63 HN VAL 63 -14.378 -9.000 0.762 500 HA VAL 63 HA VAL 63 -12.064 -7.536 1.833 501 HB VAL 63 HB VAL 63 -12.537 -10.528 1.803 502 HG11 VAL 63 HG11 VAL 63 -10.314 -8.912 3.045 503 HG12 VAL 63 HG12 VAL 63 -10.177 -9.964 1.636 504 HG13 VAL 63 HG13 VAL 63 -10.543 -10.653 3.217 505 HG21 VAL 63 HG21 VAL 63 -14.011 -9.421 3.386 506 HG22 VAL 63 HG22 VAL 63 -12.642 -8.562 4.091 507 HG23 VAL 63 HG23 VAL 63 -12.756 -10.316 4.242 508 H GLY 64 HN GLY 64 -10.486 -7.111 0.429 509 HA2 GLY 64 HA2 GLY 64 -9.869 -8.987 -1.699 510 HA3 GLY 64 HA1 GLY 64 -10.481 -7.425 -2.226 511 H GLN 65 HN GLN 65 -8.046 -8.264 -3.031 512 HA GLN 65 HA GLN 65 -6.108 -6.770 -1.401 513 HB2 GLN 65 HB2 GLN 65 -5.820 -8.840 -3.573 514 HB3 GLN 65 HB1 GLN 65 -4.484 -7.783 -3.155 515 HG2 GLN 65 HG2 GLN 65 -4.292 -9.949 -2.076 516 HG3 GLN 65 HG1 GLN 65 -4.467 -8.655 -0.897 517 HE21 GLN 65 HE21 GLN 65 -6.195 -8.648 0.454 518 HE22 GLN 65 HE22 GLN 65 -7.368 -9.913 0.514 519 H VAL 66 HN VAL 66 -5.504 -4.822 -2.043 520 HA VAL 66 HA VAL 66 -6.310 -3.942 -4.735 521 HB VAL 66 HB VAL 66 -6.458 -2.494 -2.092 522 HG11 VAL 66 HG11 VAL 66 -7.351 -0.581 -3.256 523 HG12 VAL 66 HG12 VAL 66 -7.099 -1.382 -4.814 524 HG13 VAL 66 HG13 VAL 66 -5.712 -0.927 -3.821 525 HG21 VAL 66 HG21 VAL 66 -8.847 -2.387 -2.580 526 HG22 VAL 66 HG22 VAL 66 -8.266 -4.054 -2.529 527 HG23 VAL 66 HG23 VAL 66 -8.574 -3.275 -4.080 528 H ARG 67 HN ARG 67 -4.623 -3.482 -5.943 529 HA ARG 67 HA ARG 67 -2.107 -2.649 -4.648 530 HB2 ARG 67 HB2 ARG 67 -2.039 -4.909 -5.625 531 HB3 ARG 67 HB1 ARG 67 -2.542 -4.259 -7.174 532 HG2 ARG 67 HG2 ARG 67 -0.470 -3.110 -7.441 533 HG3 ARG 67 HG1 ARG 67 0.018 -3.510 -5.789 534 HD2 ARG 67 HD2 ARG 67 0.209 -5.815 -6.303 535 HD3 ARG 67 HD1 ARG 67 -0.616 -5.611 -7.845 536 HE ARG 67 HE ARG 67 1.436 -4.192 -8.430 537 HH11 ARG 67 HH11 ARG 67 1.548 -6.961 -6.258 538 HH12 ARG 67 HH12 ARG 67 3.153 -7.419 -6.743 539 HH21 ARG 67 HH21 ARG 67 3.534 -4.787 -9.029 540 HH22 ARG 67 HH22 ARG 67 4.298 -6.151 -8.275 541 H PHE 68 HN PHE 68 -1.340 -0.710 -5.224 542 HA PHE 68 HA PHE 68 -2.128 0.475 -7.755 543 HB2 PHE 68 HB2 PHE 68 -2.832 2.589 -6.442 544 HB3 PHE 68 HB1 PHE 68 -3.972 1.259 -6.577 545 HD1 PHE 68 HD2 PHE 68 -1.130 2.066 -4.251 546 HD2 PHE 68 HD1 PHE 68 -5.235 1.013 -4.714 547 HE1 PHE 68 HE2 PHE 68 -1.401 2.012 -1.804 548 HE2 PHE 68 HE1 PHE 68 -5.504 0.969 -2.270 549 HZ PHE 68 HZ PHE 68 -3.591 1.468 -0.818 550 H THR 69 HN THR 69 -1.110 2.538 -8.158 551 HA THR 69 HA THR 69 1.526 2.801 -6.847 552 HB THR 69 HB THR 69 0.595 3.940 -9.494 553 HG1 THR 69 HG1 THR 69 1.391 1.447 -8.817 554 HG21 THR 69 HG21 THR 69 3.346 3.715 -8.270 555 HG22 THR 69 HG22 THR 69 2.411 5.200 -8.439 556 HG23 THR 69 HG23 THR 69 2.978 4.349 -9.875 557 H LEU 70 HN LEU 70 1.997 4.634 -5.755 558 HA LEU 70 HA LEU 70 -0.163 6.629 -5.610 559 HB2 LEU 70 HB2 LEU 70 1.645 5.628 -3.419 560 HB3 LEU 70 HB1 LEU 70 0.443 6.896 -3.238 561 HG LEU 70 HG LEU 70 -0.172 4.041 -3.997 562 HD11 LEU 70 HD11 LEU 70 -1.146 3.946 -1.706 563 HD12 LEU 70 HD12 LEU 70 -0.344 5.481 -1.361 564 HD13 LEU 70 HD13 LEU 70 0.613 4.051 -1.756 565 HD21 LEU 70 HD21 LEU 70 -1.778 5.634 -4.886 566 HD22 LEU 70 HD22 LEU 70 -1.958 6.366 -3.289 567 HD23 LEU 70 HD23 LEU 70 -2.493 4.708 -3.564 568 H ASP 71 HN ASP 71 0.318 8.740 -5.597 569 HA ASP 71 HA ASP 71 3.068 9.551 -6.092 570 HB2 ASP 71 HB2 ASP 71 1.125 10.502 -7.402 571 HB3 ASP 71 HB1 ASP 71 0.585 11.281 -5.914 572 H ARG 72 HN ARG 72 3.966 11.391 -4.843 573 HA ARG 72 HA ARG 72 4.056 10.791 -2.126 574 HB2 ARG 72 HB2 ARG 72 5.628 12.471 -1.925 575 HB3 ARG 72 HB1 ARG 72 5.703 12.154 -3.651 576 HG2 ARG 72 HG2 ARG 72 3.726 14.104 -3.342 577 HG3 ARG 72 HG1 ARG 72 5.033 14.574 -2.259 578 HD2 ARG 72 HD2 ARG 72 5.565 15.608 -4.276 579 HD3 ARG 72 HD1 ARG 72 6.579 14.167 -4.257 580 HE ARG 72 HE ARG 72 4.174 13.545 -5.573 581 HH11 ARG 72 HH11 ARG 72 7.002 15.565 -6.014 582 HH12 ARG 72 HH12 ARG 72 6.916 15.512 -7.751 583 HH21 ARG 72 HH21 ARG 72 4.073 13.453 -7.849 584 HH22 ARG 72 HH22 ARG 72 5.248 14.329 -8.792 585 H GLN 73 HN GLN 73 2.018 13.022 -3.894 586 HA GLN 73 HA GLN 73 1.078 14.241 -1.409 587 HB2 GLN 73 HB2 GLN 73 -0.207 15.750 -2.925 588 HB3 GLN 73 HB1 GLN 73 1.534 15.810 -3.153 589 HG2 GLN 73 HG2 GLN 73 1.318 14.351 -5.106 590 HG3 GLN 73 HG1 GLN 73 -0.432 14.327 -4.884 591 HE21 GLN 73 HE21 GLN 73 1.238 15.304 -7.113 592 HE22 GLN 73 HE22 GLN 73 0.769 16.950 -7.349 593 H GLY 74 HN GLY 74 0.468 11.458 -2.589 594 HA2 GLY 74 HA2 GLY 74 -1.263 10.030 -2.125 595 HA3 GLY 74 HA1 GLY 74 -2.184 11.385 -1.513 596 H HIS 75 HN HIS 75 -0.801 11.223 -4.706 597 HA HIS 75 HA HIS 75 -3.495 11.308 -5.834 598 HB2 HIS 75 HB2 HIS 75 -1.950 13.058 -6.565 599 HB3 HIS 75 HB1 HIS 75 -0.789 11.843 -7.082 600 HD1 HIS 75 HD1 HIS 75 -4.044 13.439 -8.086 601 HD2 HIS 75 HD2 HIS 75 -1.288 10.691 -9.561 602 HE1 HIS 75 HE1 HIS 75 -4.653 13.082 -10.498 603 HE2 HIS 75 HE2 HIS 75 -2.898 11.527 -11.404 604 H VAL 76 HN VAL 76 -4.208 9.221 -5.862 605 HA VAL 76 HA VAL 76 -2.915 6.910 -6.505 606 HB VAL 76 HB VAL 76 -5.246 6.930 -5.838 607 HG11 VAL 76 HG11 VAL 76 -7.038 7.532 -7.400 608 HG12 VAL 76 HG12 VAL 76 -5.829 8.096 -8.553 609 HG13 VAL 76 HG13 VAL 76 -6.011 8.909 -6.999 610 HG21 VAL 76 HG21 VAL 76 -4.457 4.954 -6.996 611 HG22 VAL 76 HG22 VAL 76 -4.869 5.673 -8.552 612 HG23 VAL 76 HG23 VAL 76 -6.145 5.264 -7.405 613 H LEU 77 HN LEU 77 -1.815 6.189 -8.163 614 HA LEU 77 HA LEU 77 -1.988 7.651 -10.702 615 HB2 LEU 77 HB2 LEU 77 0.277 6.068 -9.498 616 HB3 LEU 77 HB1 LEU 77 0.319 6.811 -11.085 617 HG LEU 77 HG LEU 77 -0.246 8.510 -8.688 618 HD11 LEU 77 HD11 LEU 77 2.132 8.920 -8.401 619 HD12 LEU 77 HD12 LEU 77 2.502 7.711 -9.634 620 HD13 LEU 77 HD13 LEU 77 1.756 7.220 -8.112 621 HD21 LEU 77 HD21 LEU 77 -0.517 9.449 -10.928 622 HD22 LEU 77 HD22 LEU 77 1.142 8.998 -11.322 623 HD23 LEU 77 HD23 LEU 77 0.829 10.209 -10.079 624 H ALA 78 HN ALA 78 -1.764 4.421 -9.311 625 HA ALA 78 HA ALA 78 -2.792 3.327 -11.844 626 HB1 ALA 78 HB1 ALA 78 -1.398 1.349 -11.567 627 HB2 ALA 78 HB2 ALA 78 -0.704 2.023 -10.092 628 HB3 ALA 78 HB3 ALA 78 -0.392 2.797 -11.648 629 H VAL 79 HN VAL 79 -3.924 1.239 -11.523 630 HA VAL 79 HA VAL 79 -4.924 0.738 -8.856 631 HB VAL 79 HB VAL 79 -7.327 0.845 -9.733 632 HG11 VAL 79 HG11 VAL 79 -6.483 2.408 -8.079 633 HG12 VAL 79 HG12 VAL 79 -7.544 3.238 -9.218 634 HG13 VAL 79 HG13 VAL 79 -5.794 3.411 -9.355 635 HG21 VAL 79 HG21 VAL 79 -6.018 2.621 -11.789 636 HG22 VAL 79 HG22 VAL 79 -7.754 2.481 -11.515 637 HG23 VAL 79 HG23 VAL 79 -6.839 1.091 -12.103 638 H THR 80 HN THR 80 -4.833 -1.382 -8.673 639 HA THR 80 HA THR 80 -5.822 -3.035 -10.877 640 HB THR 80 HB THR 80 -3.182 -3.467 -9.461 641 HG1 THR 80 HG1 THR 80 -3.846 -2.837 -12.164 642 HG21 THR 80 HG21 THR 80 -4.308 -5.599 -9.871 643 HG22 THR 80 HG22 THR 80 -2.918 -5.410 -10.939 644 HG23 THR 80 HG23 THR 80 -4.547 -5.155 -11.562 645 H LEU 81 HN LEU 81 -7.392 -4.275 -10.082 646 HA LEU 81 HA LEU 81 -7.394 -5.058 -7.297 647 HB2 LEU 81 HB2 LEU 81 -9.509 -4.633 -8.584 648 HB3 LEU 81 HB1 LEU 81 -9.165 -6.080 -9.518 649 HG LEU 81 HG LEU 81 -9.177 -7.371 -7.356 650 HD11 LEU 81 HD11 LEU 81 -8.791 -5.476 -5.860 651 HD12 LEU 81 HD12 LEU 81 -10.252 -6.365 -5.428 652 HD13 LEU 81 HD13 LEU 81 -10.376 -4.825 -6.278 653 HD21 LEU 81 HD21 LEU 81 -11.726 -5.944 -8.124 654 HD22 LEU 81 HD22 LEU 81 -11.621 -7.446 -7.204 655 HD23 LEU 81 HD23 LEU 81 -11.084 -7.400 -8.883 656 H VAL 82 HN VAL 82 -6.001 -6.519 -6.678 657 HA VAL 82 HA VAL 82 -4.693 -8.212 -8.624 658 HB VAL 82 HB VAL 82 -3.938 -8.756 -5.885 659 HG11 VAL 82 HG11 VAL 82 -2.460 -7.448 -8.165 660 HG12 VAL 82 HG12 VAL 82 -2.541 -9.182 -7.849 661 HG13 VAL 82 HG13 VAL 82 -1.733 -8.112 -6.702 662 HG21 VAL 82 HG21 VAL 82 -4.814 -6.543 -5.413 663 HG22 VAL 82 HG22 VAL 82 -3.882 -5.865 -6.750 664 HG23 VAL 82 HG23 VAL 82 -3.051 -6.526 -5.340 665 H SER 83 HN SER 83 -6.650 -8.613 -5.739 666 HA SER 83 HA SER 83 -7.566 -11.210 -6.598 667 HB2 SER 83 HB2 SER 83 -5.928 -10.862 -4.070 668 HB3 SER 83 HB1 SER 83 -6.862 -12.310 -4.463 669 HG SER 83 HG SER 83 -5.245 -11.581 -6.514 670 H SER 84 HN SER 84 -9.406 -11.922 -5.321 671 HA SER 84 HA SER 84 -10.372 -10.279 -3.188 672 HB2 SER 84 HB2 SER 84 -12.433 -9.520 -4.390 673 HB3 SER 84 HB1 SER 84 -10.949 -8.767 -4.968 674 HG SER 84 HG SER 84 -10.974 -10.120 -6.754 675 H ALA 85 HN ALA 85 -12.182 -11.152 -2.142 676 HA ALA 85 HA ALA 85 -12.283 -14.008 -2.371 677 HB1 ALA 85 HB1 ALA 85 -12.204 -12.864 -0.209 678 HB2 ALA 85 HB2 ALA 85 -13.609 -13.923 -0.347 679 HB3 ALA 85 HB3 ALA 85 -13.798 -12.178 -0.523 680 H GLY 86 HN GLY 86 -14.079 -11.579 -3.837 681 HA2 GLY 86 HA2 GLY 86 -15.703 -12.464 -5.505 682 HA3 GLY 86 HA1 GLY 86 -16.358 -13.424 -4.185 683 H LEU 87 HN LEU 87 -15.796 -10.068 -5.195 684 HA LEU 87 HA LEU 87 -18.127 -9.305 -3.551 685 HB2 LEU 87 HB2 LEU 87 -15.950 -7.429 -4.459 686 HB3 LEU 87 HB1 LEU 87 -17.208 -7.109 -3.296 687 HG LEU 87 HG LEU 87 -15.345 -7.334 -1.952 688 HD11 LEU 87 HD11 LEU 87 -16.479 -10.115 -2.122 689 HD12 LEU 87 HD12 LEU 87 -17.085 -8.785 -1.134 690 HD13 LEU 87 HD13 LEU 87 -15.501 -9.483 -0.799 691 HD21 LEU 87 HD21 LEU 87 -13.815 -8.041 -3.739 692 HD22 LEU 87 HD22 LEU 87 -14.416 -9.692 -3.581 693 HD23 LEU 87 HD23 LEU 87 -13.565 -8.932 -2.239 694 HA PRO 88 HA PRO 88 -19.486 -8.544 -7.825 695 HB2 PRO 88 HB2 PRO 88 -22.181 -9.023 -6.937 696 HB3 PRO 88 HB1 PRO 88 -21.173 -10.045 -7.964 697 HG2 PRO 88 HG2 PRO 88 -21.972 -10.700 -5.409 698 HG3 PRO 88 HG1 PRO 88 -20.554 -11.378 -6.225 699 HD2 PRO 88 HD2 PRO 88 -20.705 -9.205 -4.178 700 HD3 PRO 88 HD1 PRO 88 -19.491 -10.486 -4.378 701 H SER 89 HN SER 89 -22.236 -7.796 -5.800 702 HA SER 89 HA SER 89 -22.579 -5.184 -6.807 703 HB2 SER 89 HB2 SER 89 -23.707 -6.170 -4.188 704 HB3 SER 89 HB1 SER 89 -24.438 -5.060 -5.349 705 HG SER 89 HG SER 89 -24.998 -7.521 -5.199 706 H LEU 90 HN LEU 90 -20.582 -6.474 -4.424 707 HA LEU 90 HA LEU 90 -20.434 -4.224 -2.667 708 HB2 LEU 90 HB2 LEU 90 -18.447 -6.489 -2.931 709 HB3 LEU 90 HB1 LEU 90 -18.734 -5.463 -1.539 710 HG LEU 90 HG LEU 90 -20.791 -7.384 -2.618 711 HD11 LEU 90 HD11 LEU 90 -20.121 -8.926 -0.929 712 HD12 LEU 90 HD12 LEU 90 -18.952 -7.780 -0.274 713 HD13 LEU 90 HD13 LEU 90 -18.685 -8.494 -1.868 714 HD21 LEU 90 HD21 LEU 90 -21.742 -5.595 -1.321 715 HD22 LEU 90 HD22 LEU 90 -20.543 -5.835 -0.052 716 HD23 LEU 90 HD23 LEU 90 -21.757 -7.076 -0.361 717 H ASP 91 HN ASP 91 -18.628 -5.410 -5.423 718 HA ASP 91 HA ASP 91 -16.175 -4.214 -4.976 719 HB2 ASP 91 HB2 ASP 91 -16.334 -5.921 -6.600 720 HB3 ASP 91 HB1 ASP 91 -17.557 -5.049 -7.514 721 H ARG 92 HN ARG 92 -18.887 -2.856 -6.907 722 HA ARG 92 HA ARG 92 -17.332 -0.764 -7.946 723 HB2 ARG 92 HB2 ARG 92 -19.401 0.299 -8.650 724 HB3 ARG 92 HB1 ARG 92 -19.427 -1.419 -9.007 725 HG2 ARG 92 HG2 ARG 92 -20.659 -0.451 -6.474 726 HG3 ARG 92 HG1 ARG 92 -21.520 -0.216 -7.999 727 HD2 ARG 92 HD2 ARG 92 -20.540 -2.833 -6.872 728 HD3 ARG 92 HD1 ARG 92 -22.215 -2.283 -6.935 729 HE ARG 92 HE ARG 92 -20.644 -2.720 -9.396 730 HH11 ARG 92 HH11 ARG 92 -23.536 -3.192 -7.487 731 HH12 ARG 92 HH12 ARG 92 -24.309 -4.197 -8.677 732 HH21 ARG 92 HH21 ARG 92 -21.670 -3.967 -10.981 733 HH22 ARG 92 HH22 ARG 92 -23.269 -4.601 -10.694 734 H GLU 93 HN GLU 93 -19.234 -0.948 -4.985 735 HA GLU 93 HA GLU 93 -18.993 1.858 -4.440 736 HB2 GLU 93 HB2 GLU 93 -20.887 0.587 -3.568 737 HB3 GLU 93 HB1 GLU 93 -19.800 -0.430 -2.635 738 HG2 GLU 93 HG2 GLU 93 -20.745 1.128 -1.143 739 HG3 GLU 93 HG1 GLU 93 -19.076 1.619 -1.404 740 H ILE 94 HN ILE 94 -17.487 -1.080 -3.066 741 HA ILE 94 HA ILE 94 -15.932 0.339 -1.193 742 HB ILE 94 HB ILE 94 -14.664 -1.734 -0.865 743 HG12 ILE 94 HG12 ILE 94 -16.333 -2.842 -3.136 744 HG13 ILE 94 HG11 ILE 94 -14.614 -2.478 -3.232 745 HG21 ILE 94 HG21 ILE 94 -16.781 -1.427 0.280 746 HG22 ILE 94 HG22 ILE 94 -16.547 -3.127 -0.133 747 HG23 ILE 94 HG23 ILE 94 -17.645 -2.129 -1.088 748 HD11 ILE 94 HD11 ILE 94 -15.907 -4.547 -1.470 749 HD12 ILE 94 HD12 ILE 94 -14.187 -4.156 -1.490 750 HD13 ILE 94 HD13 ILE 94 -14.952 -4.841 -2.923 751 H GLN 95 HN GLN 95 -15.230 -0.678 -4.525 752 HA GLN 95 HA GLN 95 -12.498 0.174 -4.296 753 HB2 GLN 95 HB2 GLN 95 -14.019 -0.383 -6.815 754 HB3 GLN 95 HB1 GLN 95 -12.306 -0.337 -6.601 755 HG2 GLN 95 HG2 GLN 95 -14.115 -2.358 -5.331 756 HG3 GLN 95 HG1 GLN 95 -13.166 -2.626 -6.792 757 HE21 GLN 95 HE21 GLN 95 -13.124 -4.035 -4.278 758 HE22 GLN 95 HE22 GLN 95 -11.508 -3.915 -3.674 759 H ALA 96 HN ALA 96 -15.518 1.556 -5.462 760 HA ALA 96 HA ALA 96 -14.474 3.919 -6.526 761 HB1 ALA 96 HB1 ALA 96 -16.576 5.003 -5.876 762 HB2 ALA 96 HB2 ALA 96 -16.970 3.626 -4.845 763 HB3 ALA 96 HB3 ALA 96 -16.874 3.418 -6.593 764 H LEU 97 HN LEU 97 -15.267 3.028 -3.217 765 HA LEU 97 HA LEU 97 -14.600 5.361 -1.919 766 HB2 LEU 97 HB2 LEU 97 -15.960 3.457 -1.105 767 HB3 LEU 97 HB1 LEU 97 -14.496 2.495 -0.982 768 HG LEU 97 HG LEU 97 -14.096 4.901 0.363 769 HD11 LEU 97 HD11 LEU 97 -16.483 5.144 0.578 770 HD12 LEU 97 HD12 LEU 97 -15.817 4.680 2.145 771 HD13 LEU 97 HD13 LEU 97 -16.632 3.478 1.143 772 HD21 LEU 97 HD21 LEU 97 -13.890 3.337 2.338 773 HD22 LEU 97 HD22 LEU 97 -12.856 2.998 0.948 774 HD23 LEU 97 HD23 LEU 97 -14.319 2.045 1.214 775 H VAL 98 HN VAL 98 -12.719 2.336 -2.096 776 HA VAL 98 HA VAL 98 -10.352 3.697 -1.118 777 HB VAL 98 HB VAL 98 -10.779 0.800 -1.851 778 HG11 VAL 98 HG11 VAL 98 -8.436 1.441 -2.100 779 HG12 VAL 98 HG12 VAL 98 -8.662 0.377 -0.710 780 HG13 VAL 98 HG13 VAL 98 -8.439 2.112 -0.469 781 HG21 VAL 98 HG21 VAL 98 -12.080 1.498 0.082 782 HG22 VAL 98 HG22 VAL 98 -10.633 2.174 0.829 783 HG23 VAL 98 HG23 VAL 98 -10.759 0.433 0.572 784 H LYS 99 HN LYS 99 -11.247 1.930 -4.088 785 HA LYS 99 HA LYS 99 -8.595 2.039 -5.112 786 HB2 LYS 99 HB2 LYS 99 -10.061 0.189 -5.694 787 HB3 LYS 99 HB1 LYS 99 -11.195 1.275 -6.490 788 HG2 LYS 99 HG2 LYS 99 -10.037 1.192 -8.393 789 HG3 LYS 99 HG1 LYS 99 -8.519 1.555 -7.570 790 HD2 LYS 99 HD2 LYS 99 -8.295 -0.582 -8.632 791 HD3 LYS 99 HD1 LYS 99 -8.395 -0.845 -6.891 792 HE2 LYS 99 HE2 LYS 99 -9.755 -2.489 -7.948 793 HE3 LYS 99 HE1 LYS 99 -10.832 -1.317 -7.185 794 HZ1 LYS 99 HZ1 LYS 99 -10.104 -1.362 -10.068 795 HZ2 LYS 99 HZ2 LYS 99 -11.180 -0.276 -9.331 796 HZ3 LYS 99 HZ3 LYS 99 -11.568 -1.924 -9.414 797 H ARG 100 HN ARG 100 -11.364 4.179 -5.397 798 HA ARG 100 HA ARG 100 -9.995 5.681 -7.494 799 HB2 ARG 100 HB2 ARG 100 -12.394 5.518 -7.718 800 HB3 ARG 100 HB1 ARG 100 -12.634 6.139 -6.091 801 HG2 ARG 100 HG2 ARG 100 -13.093 7.781 -7.904 802 HG3 ARG 100 HG1 ARG 100 -11.893 8.315 -6.728 803 HD2 ARG 100 HD2 ARG 100 -11.213 8.869 -9.008 804 HD3 ARG 100 HD1 ARG 100 -10.101 7.717 -8.268 805 HE ARG 100 HE ARG 100 -12.227 6.805 -10.093 806 HH11 ARG 100 HH11 ARG 100 -8.857 7.058 -9.207 807 HH12 ARG 100 HH12 ARG 100 -8.297 6.004 -10.470 808 HH21 ARG 100 HH21 ARG 100 -11.511 5.386 -11.761 809 HH22 ARG 100 HH22 ARG 100 -9.809 5.062 -11.928 810 H ALA 101 HN ALA 101 -10.363 5.645 -4.068 811 HA ALA 101 HA ALA 101 -9.051 8.275 -3.896 812 HB1 ALA 101 HB1 ALA 101 -10.022 8.572 -1.733 813 HB2 ALA 101 HB2 ALA 101 -10.648 6.920 -1.730 814 HB3 ALA 101 HB3 ALA 101 -11.307 8.114 -2.853 815 H SER 102 HN SER 102 -7.056 6.919 -4.344 816 HA SER 102 HA SER 102 -6.102 5.729 -1.839 817 HB2 SER 102 HB2 SER 102 -4.920 5.431 -4.604 818 HB3 SER 102 HB1 SER 102 -4.433 4.554 -3.153 819 HG SER 102 HG SER 102 -7.087 4.292 -3.558 820 HA PRO 103 HA PRO 103 -3.443 9.354 -1.835 821 HB2 PRO 103 HB2 PRO 103 -4.529 10.433 0.417 822 HB3 PRO 103 HB1 PRO 103 -5.294 10.556 -1.175 823 HG2 PRO 103 HG2 PRO 103 -6.204 9.080 1.147 824 HG3 PRO 103 HG1 PRO 103 -7.030 9.316 -0.403 825 HD2 PRO 103 HD2 PRO 103 -5.325 7.055 0.508 826 HD3 PRO 103 HD1 PRO 103 -6.651 7.068 -0.683 827 H LEU 104 HN LEU 104 -1.431 8.509 -1.262 828 HA LEU 104 HA LEU 104 -0.878 7.654 1.446 829 HB2 LEU 104 HB2 LEU 104 0.275 7.090 -0.960 830 HB3 LEU 104 HB1 LEU 104 1.342 8.355 -0.390 831 HG LEU 104 HG LEU 104 0.737 5.812 1.125 832 HD11 LEU 104 HD11 LEU 104 3.141 6.579 -0.527 833 HD12 LEU 104 HD12 LEU 104 1.955 5.331 -0.914 834 HD13 LEU 104 HD13 LEU 104 3.008 5.142 0.489 835 HD21 LEU 104 HD21 LEU 104 2.627 6.451 2.520 836 HD22 LEU 104 HD22 LEU 104 1.364 7.682 2.571 837 HD23 LEU 104 HD23 LEU 104 2.814 7.945 1.604 838 HA PRO 105 HA PRO 105 -0.260 11.927 2.577 839 HB2 PRO 105 HB2 PRO 105 0.329 11.181 5.260 840 HB3 PRO 105 HB1 PRO 105 -1.206 11.763 4.616 841 HG2 PRO 105 HG2 PRO 105 -0.696 9.189 5.576 842 HG3 PRO 105 HG1 PRO 105 -2.082 9.691 4.603 843 HD2 PRO 105 HD2 PRO 105 0.367 8.247 3.784 844 HD3 PRO 105 HD1 PRO 105 -1.279 8.166 3.119 845 H THR 106 HN THR 106 1.858 9.654 4.295 846 HA THR 106 HA THR 106 4.033 11.413 4.568 847 HB THR 106 HB THR 106 4.147 8.388 4.494 848 HG1 THR 106 HG1 THR 106 4.006 8.864 6.922 849 HG21 THR 106 HG21 THR 106 6.332 9.532 4.442 850 HG22 THR 106 HG22 THR 106 6.084 8.657 5.952 851 HG23 THR 106 HG23 THR 106 5.896 10.410 5.909 852 HA PRO 107 HA PRO 107 5.260 11.400 0.243 853 HB2 PRO 107 HB2 PRO 107 7.613 12.829 1.329 854 HB3 PRO 107 HB1 PRO 107 6.461 13.338 0.089 855 HG2 PRO 107 HG2 PRO 107 6.436 14.434 2.521 856 HG3 PRO 107 HG1 PRO 107 4.929 14.112 1.644 857 HD2 PRO 107 HD2 PRO 107 6.190 12.562 3.873 858 HD3 PRO 107 HD1 PRO 107 4.481 12.970 3.610 859 HA PRO 108 HA PRO 108 8.254 8.090 0.949 860 HB2 PRO 108 HB2 PRO 108 7.242 6.334 -0.748 861 HB3 PRO 108 HB1 PRO 108 6.386 6.718 0.750 862 HG2 PRO 108 HG2 PRO 108 5.795 7.567 -2.040 863 HG3 PRO 108 HG1 PRO 108 4.677 7.242 -0.706 864 HD2 PRO 108 HD2 PRO 108 5.634 9.775 -1.555 865 HD3 PRO 108 HD1 PRO 108 4.686 9.427 -0.096 866 H ALA 109 HN ALA 109 9.007 10.321 -0.682 867 HA ALA 109 HA ALA 109 9.693 9.661 -3.308 868 HB1 ALA 109 HB1 ALA 109 11.187 11.413 -1.357 869 HB2 ALA 109 HB2 ALA 109 9.923 11.925 -2.479 870 HB3 ALA 109 HB3 ALA 109 11.475 11.354 -3.095 871 H ASP 110 HN ASP 110 11.313 9.033 -0.264 872 HA ASP 110 HA ASP 110 13.698 7.954 -1.385 873 HB2 ASP 110 HB2 ASP 110 13.473 8.927 0.925 874 HB3 ASP 110 HB1 ASP 110 12.553 7.500 1.383 875 H ALA 111 HN ALA 111 10.556 6.757 -0.960 876 HA ALA 111 HA ALA 111 11.306 3.965 -0.748 877 HB1 ALA 111 HB1 ALA 111 9.347 4.835 0.468 878 HB2 ALA 111 HB2 ALA 111 8.926 3.526 -0.638 879 HB3 ALA 111 HB3 ALA 111 8.570 5.202 -1.077 880 H TYR 112 HN TYR 112 10.380 6.230 -3.238 881 HA TYR 112 HA TYR 112 10.089 3.959 -5.060 882 HB2 TYR 112 HB2 TYR 112 8.400 5.154 -6.334 883 HB3 TYR 112 HB1 TYR 112 7.928 4.807 -4.688 884 HD1 TYR 112 HD2 TYR 112 9.833 7.690 -6.147 885 HD2 TYR 112 HD1 TYR 112 6.391 6.330 -4.058 886 HE1 TYR 112 HE2 TYR 112 9.078 10.016 -5.885 887 HE2 TYR 112 HE1 TYR 112 5.617 8.628 -3.800 888 HH TYR 112 HH TYR 112 6.735 10.968 -3.764 889 H VAL 113 HN VAL 113 12.311 5.887 -4.476 890 HA VAL 113 HA VAL 113 12.779 7.263 -6.927 891 HB VAL 113 HB VAL 113 15.265 7.103 -6.194 892 HG11 VAL 113 HG11 VAL 113 13.884 9.109 -5.989 893 HG12 VAL 113 HG12 VAL 113 14.974 8.932 -4.613 894 HG13 VAL 113 HG13 VAL 113 13.266 8.526 -4.443 895 HG21 VAL 113 HG21 VAL 113 14.881 5.215 -4.615 896 HG22 VAL 113 HG22 VAL 113 13.966 6.321 -3.586 897 HG23 VAL 113 HG23 VAL 113 15.679 6.606 -3.885 898 H ASN 114 HN ASN 114 12.418 5.998 -8.576 899 HA ASN 114 HA ASN 114 14.016 4.290 -9.884 900 HB2 ASN 114 HB2 ASN 114 13.578 2.046 -9.254 901 HB3 ASN 114 HB1 ASN 114 13.849 2.861 -7.720 902 HD21 ASN 114 HD21 ASN 114 12.096 3.178 -6.320 903 HD22 ASN 114 HD22 ASN 114 10.615 2.314 -6.509 904 H GLY 115 HN GLY 115 10.989 5.326 -8.789 905 HA2 GLY 115 HA2 GLY 115 9.848 5.852 -11.215 906 HA3 GLY 115 HA1 GLY 115 9.331 4.215 -10.831 907 H THR 116 HN THR 116 8.078 3.858 -8.968 908 HA THR 116 HA THR 116 7.093 5.966 -7.339 909 HB THR 116 HB THR 116 4.671 4.990 -8.437 910 HG1 THR 116 HG1 THR 116 5.665 4.540 -10.396 911 HG21 THR 116 HG21 THR 116 4.921 7.134 -7.353 912 HG22 THR 116 HG22 THR 116 4.330 7.382 -8.996 913 HG23 THR 116 HG23 THR 116 6.027 7.680 -8.613 914 H VAL 117 HN VAL 117 5.001 4.890 -6.068 915 HA VAL 117 HA VAL 117 6.102 2.284 -5.293 916 HB VAL 117 HB VAL 117 4.793 2.565 -3.162 917 HG11 VAL 117 HG11 VAL 117 6.363 4.134 -2.141 918 HG12 VAL 117 HG12 VAL 117 6.875 4.655 -3.746 919 HG13 VAL 117 HG13 VAL 117 7.169 2.997 -3.223 920 HG21 VAL 117 HG21 VAL 117 4.397 5.377 -4.182 921 HG22 VAL 117 HG22 VAL 117 4.102 4.851 -2.525 922 HG23 VAL 117 HG23 VAL 117 3.139 4.186 -3.843 923 H GLU 118 HN GLU 118 5.118 0.699 -6.264 924 HA GLU 118 HA GLU 118 2.175 0.685 -6.322 925 HB2 GLU 118 HB2 GLU 118 3.560 0.309 -8.460 926 HB3 GLU 118 HB1 GLU 118 4.011 -1.234 -7.752 927 HG2 GLU 118 HG2 GLU 118 1.543 -1.725 -7.563 928 HG3 GLU 118 HG1 GLU 118 1.282 -0.300 -8.571 929 H LEU 119 HN LEU 119 1.369 -0.313 -4.587 930 HA LEU 119 HA LEU 119 2.667 -2.744 -3.628 931 HB2 LEU 119 HB2 LEU 119 2.839 -1.998 -1.381 932 HB3 LEU 119 HB1 LEU 119 3.577 -0.764 -2.377 933 HG LEU 119 HG LEU 119 1.061 0.246 -2.135 934 HD11 LEU 119 HD11 LEU 119 0.392 -0.004 0.197 935 HD12 LEU 119 HD12 LEU 119 1.661 -1.207 0.428 936 HD13 LEU 119 HD13 LEU 119 0.325 -1.535 -0.675 937 HD21 LEU 119 HD21 LEU 119 2.001 1.737 -0.449 938 HD22 LEU 119 HD22 LEU 119 3.166 1.438 -1.740 939 HD23 LEU 119 HD23 LEU 119 3.336 0.615 -0.189 940 H THR 120 HN THR 120 1.276 -4.033 -2.253 941 HA THR 120 HA THR 120 -1.528 -3.640 -2.991 942 HB THR 120 HB THR 120 -0.048 -6.093 -2.030 943 HG1 THR 120 HG1 THR 120 -0.008 -6.604 -4.099 944 HG21 THR 120 HG21 THR 120 -2.340 -6.039 -1.115 945 HG22 THR 120 HG22 THR 120 -2.133 -7.321 -2.313 946 HG23 THR 120 HG23 THR 120 -2.974 -5.833 -2.749 947 H LEU 121 HN LEU 121 -2.892 -2.895 -1.565 948 HA LEU 121 HA LEU 121 -2.407 -3.466 1.279 949 HB2 LEU 121 HB2 LEU 121 -3.587 -1.038 -0.047 950 HB3 LEU 121 HB1 LEU 121 -3.877 -1.398 1.647 951 HG LEU 121 HG LEU 121 -1.173 -0.960 0.384 952 HD11 LEU 121 HD11 LEU 121 -2.234 1.135 0.508 953 HD12 LEU 121 HD12 LEU 121 -1.174 1.045 1.911 954 HD13 LEU 121 HD13 LEU 121 -2.912 0.791 2.098 955 HD21 LEU 121 HD21 LEU 121 -1.943 -1.435 3.260 956 HD22 LEU 121 HD22 LEU 121 -0.321 -1.082 2.662 957 HD23 LEU 121 HD23 LEU 121 -1.123 -2.587 2.201 958 HA PRO 122 HA PRO 122 -6.153 -5.769 0.792 959 HB2 PRO 122 HB2 PRO 122 -6.053 -6.222 3.662 960 HB3 PRO 122 HB1 PRO 122 -5.794 -7.375 2.353 961 HG2 PRO 122 HG2 PRO 122 -3.811 -6.526 4.016 962 HG3 PRO 122 HG1 PRO 122 -3.526 -7.053 2.348 963 HD2 PRO 122 HD2 PRO 122 -3.707 -4.282 3.458 964 HD3 PRO 122 HD1 PRO 122 -2.615 -4.930 2.215 965 H ILE 123 HN ILE 123 -8.022 -4.717 0.599 966 HA ILE 123 HA ILE 123 -8.813 -2.869 2.725 967 HB ILE 123 HB ILE 123 -10.448 -1.935 1.205 968 HG12 ILE 123 HG12 ILE 123 -9.544 -3.874 -0.923 969 HG13 ILE 123 HG11 ILE 123 -10.991 -4.135 0.051 970 HG21 ILE 123 HG21 ILE 123 -8.922 -1.244 -0.717 971 HG22 ILE 123 HG22 ILE 123 -7.718 -2.316 0.004 972 HG23 ILE 123 HG23 ILE 123 -8.331 -0.942 0.922 973 HD11 ILE 123 HD11 ILE 123 -11.948 -2.070 -0.792 974 HD12 ILE 123 HD12 ILE 123 -11.514 -3.148 -2.118 975 HD13 ILE 123 HD13 ILE 123 -10.488 -1.764 -1.734 976 H ASP 124 HN ASP 124 -9.769 -4.009 4.341 977 HA ASP 124 HA ASP 124 -11.529 -6.193 3.502 978 HB2 ASP 124 HB2 ASP 124 -11.257 -7.143 5.720 979 HB3 ASP 124 HB1 ASP 124 -9.686 -6.844 4.991 980 H PHE 125 HN PHE 125 -13.537 -5.818 3.460 981 HA PHE 125 HA PHE 125 -14.806 -4.406 5.706 982 HB2 PHE 125 HB2 PHE 125 -15.881 -5.047 2.943 983 HB3 PHE 125 HB1 PHE 125 -16.795 -4.257 4.220 984 HD1 PHE 125 HD2 PHE 125 -13.983 -3.899 1.874 985 HD2 PHE 125 HD1 PHE 125 -16.519 -1.943 4.673 986 HE1 PHE 125 HE2 PHE 125 -13.144 -1.722 1.104 987 HE2 PHE 125 HE1 PHE 125 -15.685 0.237 3.906 988 HZ PHE 125 HZ PHE 125 -13.992 0.345 2.122 989 H SER 126 HN SER 126 -16.077 -5.654 7.032 990 HA SER 126 HA SER 126 -15.400 -8.346 7.178 991 HB2 SER 126 HB2 SER 126 -17.825 -7.094 8.464 992 HB3 SER 126 HB1 SER 126 -16.848 -8.435 9.068 993 HG SER 126 HG SER 126 -15.063 -6.754 8.959 994 H LEU 127 HN LEU 127 -15.893 -9.710 5.581 995 HA LEU 127 HA LEU 127 -18.457 -9.710 4.269 996 HB2 LEU 127 HB2 LEU 127 -15.905 -11.217 3.976 997 HB3 LEU 127 HB1 LEU 127 -17.366 -11.962 3.356 998 HG LEU 127 HG LEU 127 -16.344 -9.239 2.540 999 HD11 LEU 127 HD11 LEU 127 -16.251 -11.885 1.103 1000 HD12 LEU 127 HD12 LEU 127 -14.869 -10.981 1.725 1001 HD13 LEU 127 HD13 LEU 127 -15.834 -10.320 0.398 1002 HD21 LEU 127 HD21 LEU 127 -18.561 -10.933 1.410 1003 HD22 LEU 127 HD22 LEU 127 -18.037 -9.356 0.818 1004 HD23 LEU 127 HD23 LEU 127 -18.782 -9.499 2.412 1005 H ARG 128 HN ARG 128 -19.766 -10.058 6.104 1006 HA ARG 128 HA ARG 128 -19.872 -12.890 6.865 1007 HB2 ARG 128 HB2 ARG 128 -21.184 -11.887 8.914 1008 HB3 ARG 128 HB1 ARG 128 -19.430 -11.943 8.903 1009 HG2 ARG 128 HG2 ARG 128 -20.056 -9.825 9.743 1010 HG3 ARG 128 HG1 ARG 128 -19.446 -9.567 8.111 1011 HD2 ARG 128 HD2 ARG 128 -21.452 -8.239 8.539 1012 HD3 ARG 128 HD1 ARG 128 -21.729 -9.427 7.265 1013 HE ARG 128 HE ARG 128 -22.489 -10.497 9.770 1014 HH11 ARG 128 HH11 ARG 128 -23.506 -8.017 7.507 1015 HH12 ARG 128 HH12 ARG 128 -25.197 -8.258 7.812 1016 HH21 ARG 128 HH21 ARG 128 -24.711 -10.830 10.159 1017 HH22 ARG 128 HH22 ARG 128 -25.890 -9.875 9.307 1018 H GLY 129 HN GLY 129 -21.035 -11.680 4.554 1019 HA2 GLY 129 HA2 GLY 129 -23.742 -12.624 4.900 1020 HA3 GLY 129 HA1 GLY 129 -23.625 -10.905 4.552 1021 H ALA 130 HN ALA 130 -23.381 -10.262 2.489 1022 HA ALA 130 HA ALA 130 -23.570 -12.127 0.354 1023 HB1 ALA 130 HB1 ALA 130 -24.518 -9.875 0.201 1024 HB2 ALA 130 HB2 ALA 130 -23.375 -10.174 -1.108 1025 HB3 ALA 130 HB3 ALA 130 -22.897 -9.183 0.269 1026 H GLY 131 HN GLY 131 -21.854 -13.505 0.291 1027 HA2 GLY 131 HA2 GLY 131 -19.701 -13.759 -0.902 1028 HA3 GLY 131 HA1 GLY 131 -19.171 -12.308 -0.053 1029 H PHE 132 HN PHE 132 -20.649 -15.436 0.739 1030 HA PHE 132 HA PHE 132 -19.260 -15.420 3.287 1031 HB2 PHE 132 HB2 PHE 132 -20.727 -17.433 3.761 1032 HB3 PHE 132 HB1 PHE 132 -21.568 -15.910 3.521 1033 HD1 PHE 132 HD2 PHE 132 -22.623 -15.484 1.232 1034 HD2 PHE 132 HD1 PHE 132 -21.277 -19.315 2.510 1035 HE1 PHE 132 HE2 PHE 132 -24.048 -16.549 -0.466 1036 HE2 PHE 132 HE1 PHE 132 -22.701 -20.385 0.815 1037 HZ PHE 132 HZ PHE 132 -24.091 -19.002 -0.677 Start of MODEL 17 1 H1 LYS 2 HT1 LYS 2 36.234 4.256 35.111 2 H2 LYS 2 HT2 LYS 2 34.680 4.213 35.785 3 H3 LYS 2 HT3 LYS 2 35.128 5.501 34.779 4 HA LYS 2 HA LYS 2 33.678 3.939 33.659 5 HB2 LYS 2 HB2 LYS 2 35.220 3.523 31.683 6 HB3 LYS 2 HB1 LYS 2 35.062 5.185 32.222 7 HG2 LYS 2 HG2 LYS 2 37.203 4.971 33.424 8 HG3 LYS 2 HG1 LYS 2 37.364 3.328 32.795 9 HD2 LYS 2 HD2 LYS 2 38.653 4.874 31.439 10 HD3 LYS 2 HD1 LYS 2 37.308 4.223 30.502 11 HE2 LYS 2 HE2 LYS 2 37.444 6.560 30.049 12 HE3 LYS 2 HE1 LYS 2 36.026 6.294 31.061 13 HZ1 LYS 2 HZ1 LYS 2 38.663 7.352 31.922 14 HZ2 LYS 2 HZ2 LYS 2 37.416 6.945 32.996 15 HZ3 LYS 2 HZ3 LYS 2 37.188 8.191 31.869 16 H VAL 3 HN VAL 3 33.386 2.215 35.243 17 HA VAL 3 HA VAL 3 34.613 -0.258 34.244 18 HB VAL 3 HB VAL 3 34.734 -1.167 36.548 19 HG11 VAL 3 HG11 VAL 3 36.368 1.323 36.086 20 HG12 VAL 3 HG12 VAL 3 36.756 -0.307 35.532 21 HG13 VAL 3 HG13 VAL 3 36.744 0.059 37.258 22 HG21 VAL 3 HG21 VAL 3 34.145 1.671 37.376 23 HG22 VAL 3 HG22 VAL 3 34.669 0.382 38.458 24 HG23 VAL 3 HG23 VAL 3 33.111 0.265 37.636 25 H GLN 4 HN GLN 4 31.905 1.426 34.513 26 HA GLN 4 HA GLN 4 30.240 -0.912 35.203 27 HB2 GLN 4 HB2 GLN 4 29.641 2.026 35.561 28 HB3 GLN 4 HB1 GLN 4 28.466 0.742 35.803 29 HG2 GLN 4 HG2 GLN 4 29.869 -0.187 37.590 30 HG3 GLN 4 HG1 GLN 4 31.016 1.132 37.359 31 HE21 GLN 4 HE21 GLN 4 27.866 0.237 38.510 32 HE22 GLN 4 HE22 GLN 4 27.549 1.704 39.383 33 H GLU 5 HN GLU 5 31.082 1.403 32.842 34 HA GLU 5 HA GLU 5 28.720 0.749 31.234 35 HB2 GLU 5 HB2 GLU 5 29.460 2.612 29.766 36 HB3 GLU 5 HB1 GLU 5 29.106 3.115 31.411 37 HG2 GLU 5 HG2 GLU 5 31.906 2.493 30.563 38 HG3 GLU 5 HG1 GLU 5 31.181 4.064 30.232 39 H GLN 6 HN GLN 6 28.858 -0.373 29.388 40 HA GLN 6 HA GLN 6 31.530 -1.274 28.564 41 HB2 GLN 6 HB2 GLN 6 30.393 -3.228 27.567 42 HB3 GLN 6 HB1 GLN 6 30.146 -3.118 29.305 43 HG2 GLN 6 HG2 GLN 6 27.928 -2.128 28.895 44 HG3 GLN 6 HG1 GLN 6 28.180 -2.343 27.162 45 HE21 GLN 6 HE21 GLN 6 29.300 -4.632 29.539 46 HE22 GLN 6 HE22 GLN 6 28.177 -5.891 29.149 47 H SER 7 HN SER 7 32.220 -0.843 26.577 48 HA SER 7 HA SER 7 30.269 0.206 24.632 49 HB2 SER 7 HB2 SER 7 33.203 0.925 24.853 50 HB3 SER 7 HB1 SER 7 32.030 1.624 23.734 51 HG SER 7 HG SER 7 31.073 1.833 26.208 52 H VAL 8 HN VAL 8 33.117 -1.764 25.218 53 HA VAL 8 HA VAL 8 34.202 -3.350 23.998 54 HB VAL 8 HB VAL 8 31.486 -3.871 22.774 55 HG11 VAL 8 HG11 VAL 8 33.287 -5.051 21.660 56 HG12 VAL 8 HG12 VAL 8 32.311 -6.185 22.595 57 HG13 VAL 8 HG13 VAL 8 33.879 -5.658 23.206 58 HG21 VAL 8 HG21 VAL 8 31.323 -3.784 25.214 59 HG22 VAL 8 HG22 VAL 8 32.643 -4.945 25.347 60 HG23 VAL 8 HG23 VAL 8 31.113 -5.429 24.617 61 H GLY 9 HN GLY 9 35.436 -1.844 22.837 62 HA2 GLY 9 HA2 GLY 9 36.222 -1.661 20.509 63 HA3 GLY 9 HA1 GLY 9 34.541 -1.396 20.056 64 H ALA 10 HN ALA 10 36.019 -0.047 22.915 65 HA ALA 10 HA ALA 10 35.244 2.593 22.304 66 HB1 ALA 10 HB1 ALA 10 36.482 3.257 24.277 67 HB2 ALA 10 HB2 ALA 10 37.300 1.697 24.322 68 HB3 ALA 10 HB3 ALA 10 35.561 1.787 24.606 69 HA PRO 11 HA PRO 11 39.802 3.279 20.838 70 HB2 PRO 11 HB2 PRO 11 41.222 1.028 20.240 71 HB3 PRO 11 HB1 PRO 11 41.344 1.859 21.794 72 HG2 PRO 11 HG2 PRO 11 39.788 -0.589 21.069 73 HG3 PRO 11 HG1 PRO 11 40.720 -0.244 22.538 74 HD2 PRO 11 HD2 PRO 11 38.018 -0.051 22.424 75 HD3 PRO 11 HD1 PRO 11 39.015 0.965 23.485 76 HA PRO 12 HA PRO 12 37.522 2.654 17.047 77 HB2 PRO 12 HB2 PRO 12 39.158 4.266 15.506 78 HB3 PRO 12 HB1 PRO 12 37.810 4.838 16.488 79 HG2 PRO 12 HG2 PRO 12 40.730 4.833 17.101 80 HG3 PRO 12 HG1 PRO 12 39.506 6.062 17.466 81 HD2 PRO 12 HD2 PRO 12 40.418 4.367 19.345 82 HD3 PRO 12 HD1 PRO 12 38.729 4.917 19.323 83 HA PRO 13 HA PRO 13 40.128 -0.530 15.228 84 HB2 PRO 13 HB2 PRO 13 37.862 -0.955 13.423 85 HB3 PRO 13 HB1 PRO 13 38.555 -2.054 14.618 86 HG2 PRO 13 HG2 PRO 13 36.123 -0.916 14.929 87 HG3 PRO 13 HG1 PRO 13 37.181 -1.302 16.301 88 HD2 PRO 13 HD2 PRO 13 36.701 1.335 14.957 89 HD3 PRO 13 HD1 PRO 13 36.852 0.965 16.689 90 H GLY 14 HN GLY 14 41.269 1.495 14.443 91 HA2 GLY 14 HA2 GLY 14 42.207 1.497 12.012 92 HA3 GLY 14 HA1 GLY 14 40.626 2.188 11.670 93 H ARG 15 HN ARG 15 41.158 4.222 11.103 94 HA ARG 15 HA ARG 15 42.859 5.776 12.958 95 HB2 ARG 15 HB2 ARG 15 42.387 6.290 10.018 96 HB3 ARG 15 HB1 ARG 15 43.569 7.074 11.055 97 HG2 ARG 15 HG2 ARG 15 44.971 5.240 11.067 98 HG3 ARG 15 HG1 ARG 15 43.674 4.122 10.638 99 HD2 ARG 15 HD2 ARG 15 44.950 6.182 8.845 100 HD3 ARG 15 HD1 ARG 15 45.130 4.430 8.739 101 HE ARG 15 HE ARG 15 42.400 5.363 8.555 102 HH11 ARG 15 HH11 ARG 15 45.309 4.531 6.794 103 HH12 ARG 15 HH12 ARG 15 44.471 4.304 5.281 104 HH21 ARG 15 HH21 ARG 15 41.304 5.075 6.591 105 HH22 ARG 15 HH22 ARG 15 42.197 4.606 5.172 106 H ALA 16 HN ALA 16 40.194 5.522 13.537 107 HA ALA 16 HA ALA 16 38.281 6.650 13.999 108 HB1 ALA 16 HB1 ALA 16 39.690 8.609 14.485 109 HB2 ALA 16 HB2 ALA 16 38.142 9.060 13.770 110 HB3 ALA 16 HB3 ALA 16 39.605 9.073 12.785 111 H ASP 17 HN ASP 17 39.397 8.075 10.968 112 HA ASP 17 HA ASP 17 38.640 8.011 8.846 113 HB2 ASP 17 HB2 ASP 17 37.722 5.299 9.793 114 HB3 ASP 17 HB1 ASP 17 37.587 5.820 8.116 115 H LYS 18 HN LYS 18 37.218 9.772 9.641 116 HA LYS 18 HA LYS 18 34.387 9.173 9.745 117 HB2 LYS 18 HB2 LYS 18 35.926 11.772 9.669 118 HB3 LYS 18 HB1 LYS 18 34.171 11.687 9.739 119 HG2 LYS 18 HG2 LYS 18 34.296 10.531 11.874 120 HG3 LYS 18 HG1 LYS 18 36.059 10.560 11.797 121 HD2 LYS 18 HD2 LYS 18 36.082 12.957 11.915 122 HD3 LYS 18 HD1 LYS 18 34.324 13.024 11.784 123 HE2 LYS 18 HE2 LYS 18 35.824 11.713 14.048 124 HE3 LYS 18 HE1 LYS 18 35.178 13.354 14.100 125 HZ1 LYS 18 HZ1 LYS 18 33.564 10.882 13.700 126 HZ2 LYS 18 HZ2 LYS 18 32.961 12.466 13.796 127 HZ3 LYS 18 HZ3 LYS 18 33.690 11.754 15.151 128 H THR 19 HN THR 19 35.146 8.048 7.512 129 HA THR 19 HA THR 19 35.070 9.766 5.224 130 HB THR 19 HB THR 19 34.635 6.774 5.322 131 HG1 THR 19 HG1 THR 19 37.017 6.929 4.721 132 HG21 THR 19 HG21 THR 19 35.615 8.599 3.117 133 HG22 THR 19 HG22 THR 19 34.042 7.807 3.182 134 HG23 THR 19 HG23 THR 19 35.508 6.839 3.020 135 H ALA 20 HN ALA 20 32.718 8.537 7.317 136 HA ALA 20 HA ALA 20 30.556 8.406 5.423 137 HB1 ALA 20 HB1 ALA 20 30.564 7.031 7.466 138 HB2 ALA 20 HB2 ALA 20 29.130 8.051 7.360 139 HB3 ALA 20 HB3 ALA 20 30.451 8.497 8.440 140 H ALA 21 HN ALA 21 31.784 10.747 5.038 141 HA ALA 21 HA ALA 21 30.948 12.943 6.555 142 HB1 ALA 21 HB1 ALA 21 31.727 12.900 3.644 143 HB2 ALA 21 HB2 ALA 21 32.842 13.023 5.006 144 HB3 ALA 21 HB3 ALA 21 31.683 14.316 4.694 145 HA PRO 22 HA PRO 22 27.259 13.487 3.528 146 HB2 PRO 22 HB2 PRO 22 26.967 11.078 1.933 147 HB3 PRO 22 HB1 PRO 22 27.198 12.740 1.391 148 HG2 PRO 22 HG2 PRO 22 29.085 10.812 1.083 149 HG3 PRO 22 HG1 PRO 22 29.478 12.530 1.284 150 HD2 PRO 22 HD2 PRO 22 29.515 10.327 3.323 151 HD3 PRO 22 HD1 PRO 22 30.704 11.620 3.040 152 H GLN 23 HN GLN 23 27.654 11.809 5.938 153 HA GLN 23 HA GLN 23 26.432 10.672 7.465 154 HB2 GLN 23 HB2 GLN 23 24.782 12.463 6.774 155 HB3 GLN 23 HB1 GLN 23 24.024 11.262 5.746 156 HG2 GLN 23 HG2 GLN 23 23.600 9.869 7.725 157 HG3 GLN 23 HG1 GLN 23 24.308 11.124 8.738 158 HE21 GLN 23 HE21 GLN 23 22.340 11.805 5.934 159 HE22 GLN 23 HE22 GLN 23 20.976 12.430 6.805 160 H THR 24 HN THR 24 27.602 9.210 5.291 161 HA THR 24 HA THR 24 25.737 7.160 4.503 162 HB THR 24 HB THR 24 27.898 6.066 3.633 163 HG1 THR 24 HG1 THR 24 29.721 7.263 3.690 164 HG21 THR 24 HG21 THR 24 27.111 8.796 2.606 165 HG22 THR 24 HG22 THR 24 26.303 7.279 2.211 166 HG23 THR 24 HG23 THR 24 27.968 7.553 1.696 167 H ARG 25 HN ARG 25 26.038 7.503 7.328 168 HA ARG 25 HA ARG 25 27.546 5.353 8.430 169 HB2 ARG 25 HB2 ARG 25 26.232 5.752 10.467 170 HB3 ARG 25 HB1 ARG 25 26.815 7.268 9.795 171 HG2 ARG 25 HG2 ARG 25 24.524 7.460 8.689 172 HG3 ARG 25 HG1 ARG 25 24.028 6.156 9.767 173 HD2 ARG 25 HD2 ARG 25 25.145 8.832 10.600 174 HD3 ARG 25 HD1 ARG 25 23.457 8.342 10.691 175 HE ARG 25 HE ARG 25 25.292 6.644 12.155 176 HH11 ARG 25 HH11 ARG 25 23.149 9.420 12.251 177 HH12 ARG 25 HH12 ARG 25 23.025 9.420 13.983 178 HH21 ARG 25 HH21 ARG 25 25.100 6.635 14.438 179 HH22 ARG 25 HH22 ARG 25 24.101 7.827 15.219 180 H LEU 26 HN LEU 26 24.303 5.782 7.241 181 HA LEU 26 HA LEU 26 23.983 3.094 6.465 182 HB2 LEU 26 HB2 LEU 26 23.589 2.801 8.900 183 HB3 LEU 26 HB1 LEU 26 22.301 3.989 8.820 184 HG LEU 26 HG LEU 26 21.049 2.495 7.291 185 HD11 LEU 26 HD11 LEU 26 22.937 1.304 6.319 186 HD12 LEU 26 HD12 LEU 26 21.772 0.179 7.016 187 HD13 LEU 26 HD13 LEU 26 23.270 0.541 7.875 188 HD21 LEU 26 HD21 LEU 26 20.591 2.446 9.674 189 HD22 LEU 26 HD22 LEU 26 21.874 1.259 9.916 190 HD23 LEU 26 HD23 LEU 26 20.437 0.829 8.987 191 H THR 27 HN THR 27 23.317 3.855 4.522 192 HA THR 27 HA THR 27 21.895 6.153 4.004 193 HB THR 27 HB THR 27 21.677 3.686 2.288 194 HG1 THR 27 HG1 THR 27 23.854 3.818 2.688 195 HG21 THR 27 HG21 THR 27 20.427 5.739 1.684 196 HG22 THR 27 HG22 THR 27 21.624 5.270 0.480 197 HG23 THR 27 HG23 THR 27 21.959 6.605 1.585 198 HA PRO 28 HA PRO 28 17.851 5.142 5.551 199 HB2 PRO 28 HB2 PRO 28 16.577 7.321 4.516 200 HB3 PRO 28 HB1 PRO 28 17.578 7.376 5.971 201 HG2 PRO 28 HG2 PRO 28 18.275 8.132 3.160 202 HG3 PRO 28 HG1 PRO 28 18.659 8.974 4.672 203 HD2 PRO 28 HD2 PRO 28 20.463 7.432 3.390 204 HD3 PRO 28 HD1 PRO 28 20.416 7.553 5.163 205 H TYR 29 HN TYR 29 15.985 4.264 4.806 206 HA TYR 29 HA TYR 29 15.265 4.463 2.001 207 HB2 TYR 29 HB2 TYR 29 16.733 2.483 2.079 208 HB3 TYR 29 HB1 TYR 29 15.743 1.798 3.361 209 HD1 TYR 29 HD1 TYR 29 15.890 2.585 -0.228 210 HD2 TYR 29 HD2 TYR 29 13.632 0.757 2.877 211 HE1 TYR 29 HE1 TYR 29 14.470 1.486 -1.912 212 HE2 TYR 29 HE2 TYR 29 12.206 -0.341 1.209 213 HH TYR 29 HH TYR 29 12.994 -0.486 -2.097 214 H ALA 30 HN ALA 30 13.095 4.494 1.748 215 HA ALA 30 HA ALA 30 11.455 4.484 4.116 216 HB1 ALA 30 HB1 ALA 30 9.640 5.149 2.624 217 HB2 ALA 30 HB2 ALA 30 10.661 4.831 1.222 218 HB3 ALA 30 HB3 ALA 30 11.076 6.132 2.337 219 H GLN 31 HN GLN 31 11.888 2.251 4.652 220 HA GLN 31 HA GLN 31 10.889 0.188 2.889 221 HB2 GLN 31 HB2 GLN 31 12.980 -0.092 4.188 222 HB3 GLN 31 HB1 GLN 31 12.047 -0.005 5.675 223 HG2 GLN 31 HG2 GLN 31 10.911 -2.043 5.151 224 HG3 GLN 31 HG1 GLN 31 11.653 -2.096 3.553 225 HE21 GLN 31 HE21 GLN 31 14.235 -1.189 4.570 226 HE22 GLN 31 HE22 GLN 31 14.937 -2.545 5.380 227 H ALA 32 HN ALA 32 9.053 -0.956 3.132 228 HA ALA 32 HA ALA 32 7.054 0.142 4.924 229 HB1 ALA 32 HB1 ALA 32 5.489 -1.280 3.717 230 HB2 ALA 32 HB2 ALA 32 6.829 -2.054 2.869 231 HB3 ALA 32 HB3 ALA 32 6.483 -0.346 2.598 232 H GLY 33 HN GLY 33 7.240 -0.513 6.971 233 HA2 GLY 33 HA2 GLY 33 7.703 -3.364 7.532 234 HA3 GLY 33 HA1 GLY 33 7.924 -2.049 8.667 235 H GLU 34 HN GLU 34 6.568 -2.295 10.240 236 HA GLU 34 HA GLU 34 3.981 -3.489 9.926 237 HB2 GLU 34 HB2 GLU 34 3.687 -2.910 12.331 238 HB3 GLU 34 HB1 GLU 34 5.134 -3.852 12.003 239 HG2 GLU 34 HG2 GLU 34 6.502 -1.869 12.174 240 HG3 GLU 34 HG1 GLU 34 5.067 -0.871 12.400 241 H ASP 35 HN ASP 35 2.200 -2.083 11.340 242 HA ASP 35 HA ASP 35 1.582 -0.051 9.409 243 HB2 ASP 35 HB2 ASP 35 -0.263 -1.410 10.027 244 HB3 ASP 35 HB1 ASP 35 0.021 -1.133 11.746 245 H ASN 36 HN ASN 36 2.282 1.879 9.550 246 HA ASN 36 HA ASN 36 1.583 3.428 11.912 247 HB2 ASN 36 HB2 ASN 36 4.086 2.868 11.972 248 HB3 ASN 36 HB1 ASN 36 4.239 3.830 10.505 249 HD21 ASN 36 HD21 ASN 36 3.692 3.880 13.924 250 HD22 ASN 36 HD22 ASN 36 3.866 5.593 14.127 251 H TRP 37 HN TRP 37 0.518 2.839 9.238 252 HA TRP 37 HA TRP 37 0.706 5.483 8.021 253 HB2 TRP 37 HB2 TRP 37 1.093 4.503 5.776 254 HB3 TRP 37 HB1 TRP 37 2.437 4.294 6.884 255 HD1 TRP 37 HD1 TRP 37 0.794 1.624 8.236 256 HE1 TRP 37 HE1 TRP 37 1.096 -0.592 6.966 257 HE3 TRP 37 HE3 TRP 37 2.327 3.479 3.728 258 HZ2 TRP 37 HZ2 TRP 37 1.876 -1.443 4.391 259 HZ3 TRP 37 HZ3 TRP 37 2.835 1.897 1.916 260 HH2 TRP 37 HH2 TRP 37 2.613 -0.515 2.243 261 H ARG 38 HN ARG 38 -1.211 2.580 8.516 262 HA ARG 38 HA ARG 38 -3.071 3.157 6.421 263 HB2 ARG 38 HB2 ARG 38 -4.555 1.545 7.377 264 HB3 ARG 38 HB1 ARG 38 -2.922 0.899 7.481 265 HG2 ARG 38 HG2 ARG 38 -2.847 1.123 9.777 266 HG3 ARG 38 HG1 ARG 38 -4.109 2.354 9.804 267 HD2 ARG 38 HD2 ARG 38 -4.889 0.201 10.694 268 HD3 ARG 38 HD1 ARG 38 -5.784 0.696 9.260 269 HE ARG 38 HE ARG 38 -3.953 -0.896 8.178 270 HH11 ARG 38 HH11 ARG 38 -5.946 -1.339 11.022 271 HH12 ARG 38 HH12 ARG 38 -6.012 -3.068 10.857 272 HH21 ARG 38 HH21 ARG 38 -4.063 -3.168 7.953 273 HH22 ARG 38 HH22 ARG 38 -4.949 -4.102 9.127 274 H SER 39 HN SER 39 -2.753 4.126 9.750 275 HA SER 39 HA SER 39 -5.271 5.378 10.024 276 HB2 SER 39 HB2 SER 39 -3.928 6.717 11.811 277 HB3 SER 39 HB1 SER 39 -4.145 4.980 12.038 278 HG SER 39 HG SER 39 -2.022 5.220 12.311 279 H ARG 40 HN ARG 40 -2.147 6.415 8.788 280 HA ARG 40 HA ARG 40 -2.811 9.135 8.456 281 HB2 ARG 40 HB2 ARG 40 -0.848 7.844 6.621 282 HB3 ARG 40 HB1 ARG 40 -0.765 9.347 7.498 283 HG2 ARG 40 HG2 ARG 40 -0.370 6.647 8.728 284 HG3 ARG 40 HG1 ARG 40 0.911 7.751 8.244 285 HD2 ARG 40 HD2 ARG 40 -0.113 9.433 9.822 286 HD3 ARG 40 HD1 ARG 40 -1.125 8.119 10.425 287 HE ARG 40 HE ARG 40 1.409 7.120 10.562 288 HH11 ARG 40 HH11 ARG 40 -0.209 9.938 11.839 289 HH12 ARG 40 HH12 ARG 40 0.864 10.103 13.195 290 HH21 ARG 40 HH21 ARG 40 2.834 7.323 12.348 291 HH22 ARG 40 HH22 ARG 40 2.571 8.597 13.502 292 H ILE 41 HN ILE 41 -2.848 6.301 6.350 293 HA ILE 41 HA ILE 41 -3.657 7.591 3.974 294 HB ILE 41 HB ILE 41 -4.069 4.725 4.905 295 HG12 ILE 41 HG12 ILE 41 -2.027 5.908 3.012 296 HG13 ILE 41 HG11 ILE 41 -1.714 5.444 4.681 297 HG21 ILE 41 HG21 ILE 41 -4.454 4.169 2.545 298 HG22 ILE 41 HG22 ILE 41 -4.423 5.887 2.148 299 HG23 ILE 41 HG23 ILE 41 -5.697 5.246 3.187 300 HD11 ILE 41 HD11 ILE 41 -0.914 3.759 3.126 301 HD12 ILE 41 HD12 ILE 41 -2.537 3.584 2.460 302 HD13 ILE 41 HD13 ILE 41 -2.214 3.122 4.131 303 H SER 42 HN SER 42 -5.513 5.962 6.558 304 HA SER 42 HA SER 42 -8.056 6.219 5.456 305 HB2 SER 42 HB2 SER 42 -7.265 6.327 8.376 306 HB3 SER 42 HB1 SER 42 -8.895 6.030 7.768 307 HG SER 42 HG SER 42 -6.618 4.387 7.677 308 H GLY 43 HN GLY 43 -6.089 8.578 7.175 309 HA2 GLY 43 HA2 GLY 43 -8.124 10.552 7.432 310 HA3 GLY 43 HA1 GLY 43 -6.391 10.834 7.527 311 H ARG 44 HN ARG 44 -5.812 9.736 4.921 312 HA ARG 44 HA ARG 44 -6.209 12.023 3.303 313 HB2 ARG 44 HB2 ARG 44 -4.626 9.688 3.363 314 HB3 ARG 44 HB1 ARG 44 -5.481 9.682 1.855 315 HG2 ARG 44 HG2 ARG 44 -3.542 10.792 1.306 316 HG3 ARG 44 HG1 ARG 44 -4.630 12.135 1.677 317 HD2 ARG 44 HD2 ARG 44 -3.743 12.295 3.907 318 HD3 ARG 44 HD1 ARG 44 -2.755 10.851 3.648 319 HE ARG 44 HE ARG 44 -1.724 12.346 1.783 320 HH11 ARG 44 HH11 ARG 44 -2.789 13.418 4.944 321 HH12 ARG 44 HH12 ARG 44 -1.656 14.743 5.009 322 HH21 ARG 44 HH21 ARG 44 -0.182 14.025 1.903 323 HH22 ARG 44 HH22 ARG 44 -0.149 15.060 3.306 324 H LEU 45 HN LEU 45 -7.545 8.773 3.468 325 HA LEU 45 HA LEU 45 -9.130 8.923 1.126 326 HB2 LEU 45 HB2 LEU 45 -8.349 6.986 2.910 327 HB3 LEU 45 HB1 LEU 45 -10.051 7.163 3.273 328 HG LEU 45 HG LEU 45 -9.056 6.704 0.479 329 HD11 LEU 45 HD11 LEU 45 -9.869 4.631 2.515 330 HD12 LEU 45 HD12 LEU 45 -8.241 4.880 1.877 331 HD13 LEU 45 HD13 LEU 45 -9.533 4.324 0.810 332 HD21 LEU 45 HD21 LEU 45 -11.725 6.272 1.812 333 HD22 LEU 45 HD22 LEU 45 -11.335 5.837 0.146 334 HD23 LEU 45 HD23 LEU 45 -11.324 7.531 0.642 335 H ASN 46 HN ASN 46 -9.488 9.939 4.360 336 HA ASN 46 HA ASN 46 -12.302 10.331 4.460 337 HB2 ASN 46 HB2 ASN 46 -10.906 10.204 6.502 338 HB3 ASN 46 HB1 ASN 46 -10.084 11.686 6.028 339 HD21 ASN 46 HD21 ASN 46 -12.817 10.316 7.536 340 HD22 ASN 46 HD22 ASN 46 -13.637 11.792 7.921 341 H ARG 47 HN ARG 47 -9.524 12.196 3.513 342 HA ARG 47 HA ARG 47 -10.711 14.649 2.961 343 HB2 ARG 47 HB2 ARG 47 -8.536 15.020 2.654 344 HB3 ARG 47 HB1 ARG 47 -8.210 13.305 2.552 345 HG2 ARG 47 HG2 ARG 47 -8.749 13.366 0.141 346 HG3 ARG 47 HG1 ARG 47 -8.969 15.116 0.270 347 HD2 ARG 47 HD2 ARG 47 -6.635 15.332 1.037 348 HD3 ARG 47 HD1 ARG 47 -6.425 13.587 0.835 349 HE ARG 47 HE ARG 47 -7.257 14.333 -1.604 350 HH11 ARG 47 HH11 ARG 47 -4.791 15.672 0.478 351 HH12 ARG 47 HH12 ARG 47 -3.797 16.222 -0.837 352 HH21 ARG 47 HH21 ARG 47 -5.966 15.079 -3.340 353 HH22 ARG 47 HH22 ARG 47 -4.474 15.901 -2.996 354 H PHE 48 HN PHE 48 -11.007 11.608 1.358 355 HA PHE 48 HA PHE 48 -12.100 12.948 -0.998 356 HB2 PHE 48 HB2 PHE 48 -11.222 10.091 -0.644 357 HB3 PHE 48 HB1 PHE 48 -11.939 10.734 -2.111 358 HD1 PHE 48 HD2 PHE 48 -10.699 12.560 -3.347 359 HD2 PHE 48 HD1 PHE 48 -8.932 10.242 -0.250 360 HE1 PHE 48 HE2 PHE 48 -8.462 13.162 -4.175 361 HE2 PHE 48 HE1 PHE 48 -6.693 10.839 -1.072 362 HZ PHE 48 HZ PHE 48 -6.456 12.303 -3.040 363 H LYS 49 HN LYS 49 -12.735 10.037 0.933 364 HA LYS 49 HA LYS 49 -15.515 10.613 1.315 365 HB2 LYS 49 HB2 LYS 49 -14.715 8.452 -0.651 366 HB3 LYS 49 HB1 LYS 49 -16.252 8.432 0.191 367 HG2 LYS 49 HG2 LYS 49 -16.809 10.598 -0.866 368 HG3 LYS 49 HG1 LYS 49 -15.299 10.500 -1.777 369 HD2 LYS 49 HD2 LYS 49 -16.050 8.371 -2.757 370 HD3 LYS 49 HD1 LYS 49 -17.570 8.513 -1.873 371 HE2 LYS 49 HE2 LYS 49 -17.914 9.246 -4.135 372 HE3 LYS 49 HE1 LYS 49 -18.009 10.639 -3.060 373 HZ1 LYS 49 HZ1 LYS 49 -15.547 9.901 -4.538 374 HZ2 LYS 49 HZ2 LYS 49 -15.873 11.356 -3.718 375 HZ3 LYS 49 HZ3 LYS 49 -16.708 10.979 -5.146 376 H ARG 50 HN ARG 50 -15.302 10.096 3.497 377 HA ARG 50 HA ARG 50 -14.271 7.387 4.024 378 HB2 ARG 50 HB2 ARG 50 -13.021 9.302 5.064 379 HB3 ARG 50 HB1 ARG 50 -14.465 9.653 6.004 380 HG2 ARG 50 HG2 ARG 50 -12.994 8.399 7.378 381 HG3 ARG 50 HG1 ARG 50 -14.335 7.342 6.930 382 HD2 ARG 50 HD2 ARG 50 -12.909 6.398 5.125 383 HD3 ARG 50 HD1 ARG 50 -11.572 7.378 5.718 384 HE ARG 50 HE ARG 50 -12.598 5.847 7.845 385 HH11 ARG 50 HH11 ARG 50 -10.830 5.439 4.851 386 HH12 ARG 50 HH12 ARG 50 -9.955 4.041 5.399 387 HH21 ARG 50 HH21 ARG 50 -11.444 3.999 8.588 388 HH22 ARG 50 HH22 ARG 50 -10.317 3.220 7.516 389 H TYR 51 HN TYR 51 -16.028 6.127 3.989 390 HA TYR 51 HA TYR 51 -18.325 6.899 5.635 391 HB2 TYR 51 HB2 TYR 51 -18.267 5.914 3.081 392 HB3 TYR 51 HB1 TYR 51 -18.503 4.439 4.019 393 HD1 TYR 51 HD2 TYR 51 -19.906 7.764 3.270 394 HD2 TYR 51 HD1 TYR 51 -20.597 3.975 5.066 395 HE1 TYR 51 HE2 TYR 51 -22.290 8.311 3.480 396 HE2 TYR 51 HE1 TYR 51 -22.985 4.509 5.284 397 HH TYR 51 HH TYR 51 -24.458 7.084 3.667 398 HA PRO 52 HA PRO 52 -16.857 4.187 8.823 399 HB2 PRO 52 HB2 PRO 52 -19.740 3.929 9.482 400 HB3 PRO 52 HB1 PRO 52 -18.394 4.449 10.502 401 HG2 PRO 52 HG2 PRO 52 -20.162 6.216 9.581 402 HG3 PRO 52 HG1 PRO 52 -18.438 6.617 9.678 403 HD2 PRO 52 HD2 PRO 52 -20.071 5.851 7.293 404 HD3 PRO 52 HD1 PRO 52 -18.799 7.081 7.442 405 H LYS 53 HN LYS 53 -16.467 2.065 8.876 406 HA LYS 53 HA LYS 53 -17.311 0.444 6.738 407 HB2 LYS 53 HB2 LYS 53 -15.939 -0.321 9.315 408 HB3 LYS 53 HB1 LYS 53 -16.163 -1.409 7.957 409 HG2 LYS 53 HG2 LYS 53 -14.563 1.143 7.935 410 HG3 LYS 53 HG1 LYS 53 -13.913 -0.494 8.014 411 HD2 LYS 53 HD2 LYS 53 -13.718 -0.167 5.773 412 HD3 LYS 53 HD1 LYS 53 -15.387 -0.741 5.800 413 HE2 LYS 53 HE2 LYS 53 -15.140 1.275 4.414 414 HE3 LYS 53 HE1 LYS 53 -16.196 1.553 5.802 415 HZ1 LYS 53 HZ1 LYS 53 -14.622 3.370 5.449 416 HZ2 LYS 53 HZ2 LYS 53 -13.323 2.303 5.673 417 HZ3 LYS 53 HZ3 LYS 53 -14.388 2.629 6.953 418 H ASP 54 HN ASP 54 -18.678 0.929 9.870 419 HA ASP 54 HA ASP 54 -20.090 -1.462 10.215 420 HB2 ASP 54 HB2 ASP 54 -20.845 1.349 11.034 421 HB3 ASP 54 HB1 ASP 54 -21.645 -0.111 11.610 422 H ALA 55 HN ALA 55 -20.911 1.456 8.402 423 HA ALA 55 HA ALA 55 -23.502 0.604 7.624 424 HB1 ALA 55 HB1 ALA 55 -22.839 2.946 7.539 425 HB2 ALA 55 HB2 ALA 55 -23.366 2.385 5.952 426 HB3 ALA 55 HB3 ALA 55 -21.646 2.571 6.294 427 H LEU 56 HN LEU 56 -20.293 0.140 6.325 428 HA LEU 56 HA LEU 56 -21.139 -0.979 3.835 429 HB2 LEU 56 HB2 LEU 56 -18.510 -1.035 5.321 430 HB3 LEU 56 HB1 LEU 56 -18.740 -1.854 3.790 431 HG LEU 56 HG LEU 56 -17.649 0.208 3.349 432 HD11 LEU 56 HD11 LEU 56 -19.157 1.291 1.829 433 HD12 LEU 56 HD12 LEU 56 -20.550 0.583 2.652 434 HD13 LEU 56 HD13 LEU 56 -19.420 -0.453 1.778 435 HD21 LEU 56 HD21 LEU 56 -18.581 2.385 3.984 436 HD22 LEU 56 HD22 LEU 56 -18.168 1.404 5.388 437 HD23 LEU 56 HD23 LEU 56 -19.853 1.567 4.894 438 H ARG 57 HN ARG 57 -20.112 -2.338 6.956 439 HA ARG 57 HA ARG 57 -20.228 -5.048 6.276 440 HB2 ARG 57 HB2 ARG 57 -20.894 -3.720 8.911 441 HB3 ARG 57 HB1 ARG 57 -20.701 -5.454 8.697 442 HG2 ARG 57 HG2 ARG 57 -18.371 -5.005 7.904 443 HG3 ARG 57 HG1 ARG 57 -18.603 -3.323 8.388 444 HD2 ARG 57 HD2 ARG 57 -18.861 -5.716 10.212 445 HD3 ARG 57 HD1 ARG 57 -17.452 -4.662 10.115 446 HE ARG 57 HE ARG 57 -19.011 -2.842 10.857 447 HH11 ARG 57 HH11 ARG 57 -19.675 -6.192 11.612 448 HH12 ARG 57 HH12 ARG 57 -20.521 -5.830 13.089 449 HH21 ARG 57 HH21 ARG 57 -20.110 -2.349 12.817 450 HH22 ARG 57 HH22 ARG 57 -20.785 -3.650 13.757 451 H LEU 58 HN LEU 58 -22.732 -2.748 6.941 452 HA LEU 58 HA LEU 58 -24.798 -4.799 7.082 453 HB2 LEU 58 HB2 LEU 58 -24.713 -2.865 8.661 454 HB3 LEU 58 HB1 LEU 58 -25.016 -1.797 7.306 455 HG LEU 58 HG LEU 58 -27.207 -2.893 6.960 456 HD11 LEU 58 HD11 LEU 58 -26.674 -5.078 7.906 457 HD12 LEU 58 HD12 LEU 58 -28.090 -4.377 8.689 458 HD13 LEU 58 HD13 LEU 58 -26.529 -4.356 9.509 459 HD21 LEU 58 HD21 LEU 58 -26.730 -1.822 9.738 460 HD22 LEU 58 HD22 LEU 58 -28.290 -1.909 8.917 461 HD23 LEU 58 HD23 LEU 58 -27.019 -0.858 8.290 462 H LYS 59 HN LYS 59 -23.196 -3.323 4.641 463 HA LYS 59 HA LYS 59 -25.508 -3.444 2.861 464 HB2 LYS 59 HB2 LYS 59 -25.444 -1.123 3.485 465 HB3 LYS 59 HB1 LYS 59 -23.722 -1.029 3.161 466 HG2 LYS 59 HG2 LYS 59 -24.116 -1.319 0.796 467 HG3 LYS 59 HG1 LYS 59 -25.838 -1.546 1.091 468 HD2 LYS 59 HD2 LYS 59 -24.271 0.955 1.704 469 HD3 LYS 59 HD1 LYS 59 -25.335 0.730 0.316 470 HE2 LYS 59 HE2 LYS 59 -26.165 0.641 3.216 471 HE3 LYS 59 HE1 LYS 59 -26.443 1.981 2.105 472 HZ1 LYS 59 HZ1 LYS 59 -28.416 0.627 2.309 473 HZ2 LYS 59 HZ2 LYS 59 -27.563 -0.763 1.849 474 HZ3 LYS 59 HZ3 LYS 59 -27.794 0.494 0.735 475 H ARG 60 HN ARG 60 -22.181 -2.218 2.461 476 HA ARG 60 HA ARG 60 -21.790 -4.282 0.399 477 HB2 ARG 60 HB2 ARG 60 -20.819 -1.420 0.417 478 HB3 ARG 60 HB1 ARG 60 -20.302 -2.630 -0.747 479 HG2 ARG 60 HG2 ARG 60 -23.144 -1.722 -0.360 480 HG3 ARG 60 HG1 ARG 60 -22.046 -1.120 -1.604 481 HD2 ARG 60 HD2 ARG 60 -21.829 -3.421 -2.472 482 HD3 ARG 60 HD1 ARG 60 -23.004 -3.960 -1.270 483 HE ARG 60 HE ARG 60 -23.724 -1.885 -3.238 484 HH11 ARG 60 HH11 ARG 60 -24.246 -5.032 -1.783 485 HH12 ARG 60 HH12 ARG 60 -25.724 -5.341 -2.646 486 HH21 ARG 60 HH21 ARG 60 -25.675 -2.273 -4.371 487 HH22 ARG 60 HH22 ARG 60 -26.521 -3.774 -4.140 488 H GLN 61 HN GLN 61 -20.768 -5.666 1.826 489 HA GLN 61 HA GLN 61 -18.328 -4.761 3.133 490 HB2 GLN 61 HB2 GLN 61 -18.297 -7.017 4.125 491 HB3 GLN 61 HB1 GLN 61 -19.833 -6.208 4.405 492 HG2 GLN 61 HG2 GLN 61 -20.735 -7.469 2.430 493 HG3 GLN 61 HG1 GLN 61 -19.238 -8.397 2.440 494 HE21 GLN 61 HE21 GLN 61 -20.786 -7.251 5.344 495 HE22 GLN 61 HE22 GLN 61 -21.291 -8.796 5.927 496 H GLY 62 HN GLY 62 -16.499 -6.641 2.937 497 HA2 GLY 62 HA2 GLY 62 -16.058 -8.256 0.873 498 HA3 GLY 62 HA1 GLY 62 -15.913 -6.697 0.086 499 H VAL 63 HN VAL 63 -14.167 -9.098 1.303 500 HA VAL 63 HA VAL 63 -11.995 -7.306 2.129 501 HB VAL 63 HB VAL 63 -12.534 -8.917 3.863 502 HG11 VAL 63 HG11 VAL 63 -12.216 -11.332 3.507 503 HG12 VAL 63 HG12 VAL 63 -12.000 -11.027 1.782 504 HG13 VAL 63 HG13 VAL 63 -13.545 -10.669 2.556 505 HG21 VAL 63 HG21 VAL 63 -10.324 -9.935 4.165 506 HG22 VAL 63 HG22 VAL 63 -10.206 -8.262 3.617 507 HG23 VAL 63 HG23 VAL 63 -9.939 -9.582 2.480 508 H GLY 64 HN GLY 64 -10.328 -7.087 0.808 509 HA2 GLY 64 HA2 GLY 64 -9.494 -9.194 -0.976 510 HA3 GLY 64 HA1 GLY 64 -10.245 -7.828 -1.793 511 H GLN 65 HN GLN 65 -7.669 -8.455 -2.386 512 HA GLN 65 HA GLN 65 -6.078 -6.503 -0.870 513 HB2 GLN 65 HB2 GLN 65 -5.249 -8.736 -2.720 514 HB3 GLN 65 HB1 GLN 65 -4.130 -7.507 -2.150 515 HG2 GLN 65 HG2 GLN 65 -4.693 -8.197 0.185 516 HG3 GLN 65 HG1 GLN 65 -5.618 -9.534 -0.498 517 HE21 GLN 65 HE21 GLN 65 -2.443 -8.210 0.015 518 HE22 GLN 65 HE22 GLN 65 -1.560 -9.640 -0.387 519 H VAL 66 HN VAL 66 -5.622 -4.637 -1.714 520 HA VAL 66 HA VAL 66 -6.133 -4.189 -4.578 521 HB VAL 66 HB VAL 66 -6.904 -2.559 -2.161 522 HG11 VAL 66 HG11 VAL 66 -7.475 -0.686 -3.500 523 HG12 VAL 66 HG12 VAL 66 -7.020 -1.531 -4.986 524 HG13 VAL 66 HG13 VAL 66 -5.779 -1.069 -3.818 525 HG21 VAL 66 HG21 VAL 66 -8.461 -3.463 -4.577 526 HG22 VAL 66 HG22 VAL 66 -9.105 -2.589 -3.185 527 HG23 VAL 66 HG23 VAL 66 -8.486 -4.230 -2.988 528 H ARG 67 HN ARG 67 -4.266 -3.734 -5.570 529 HA ARG 67 HA ARG 67 -2.194 -2.346 -4.018 530 HB2 ARG 67 HB2 ARG 67 -0.533 -3.246 -5.490 531 HB3 ARG 67 HB1 ARG 67 -1.556 -4.582 -4.978 532 HG2 ARG 67 HG2 ARG 67 -2.477 -4.854 -7.058 533 HG3 ARG 67 HG1 ARG 67 -2.143 -3.187 -7.545 534 HD2 ARG 67 HD2 ARG 67 -0.657 -4.700 -8.716 535 HD3 ARG 67 HD1 ARG 67 0.258 -3.696 -7.592 536 HE ARG 67 HE ARG 67 -0.400 -6.089 -6.296 537 HH11 ARG 67 HH11 ARG 67 1.648 -4.883 -8.855 538 HH12 ARG 67 HH12 ARG 67 2.774 -6.209 -8.762 539 HH21 ARG 67 HH21 ARG 67 1.095 -7.834 -6.130 540 HH22 ARG 67 HH22 ARG 67 2.440 -7.899 -7.229 541 H PHE 68 HN PHE 68 -1.174 -0.536 -4.907 542 HA PHE 68 HA PHE 68 -2.242 0.600 -7.329 543 HB2 PHE 68 HB2 PHE 68 -2.796 2.741 -5.845 544 HB3 PHE 68 HB1 PHE 68 -3.991 1.497 -6.178 545 HD1 PHE 68 HD2 PHE 68 -1.252 1.997 -3.665 546 HD2 PHE 68 HD1 PHE 68 -5.314 0.995 -4.421 547 HE1 PHE 68 HE2 PHE 68 -1.625 1.689 -1.253 548 HE2 PHE 68 HE1 PHE 68 -5.696 0.686 -2.015 549 HZ PHE 68 HZ PHE 68 -3.854 1.033 -0.427 550 H THR 69 HN THR 69 -1.121 2.352 -8.096 551 HA THR 69 HA THR 69 1.462 2.960 -6.826 552 HB THR 69 HB THR 69 0.426 3.900 -9.513 553 HG1 THR 69 HG1 THR 69 1.319 1.446 -8.713 554 HG21 THR 69 HG21 THR 69 3.219 3.698 -8.378 555 HG22 THR 69 HG22 THR 69 2.288 5.186 -8.561 556 HG23 THR 69 HG23 THR 69 2.790 4.279 -9.989 557 H LEU 70 HN LEU 70 1.768 4.846 -5.803 558 HA LEU 70 HA LEU 70 -0.548 6.657 -5.762 559 HB2 LEU 70 HB2 LEU 70 1.303 5.942 -3.498 560 HB3 LEU 70 HB1 LEU 70 -0.113 6.976 -3.397 561 HG LEU 70 HG LEU 70 -0.179 4.048 -4.122 562 HD11 LEU 70 HD11 LEU 70 -0.899 5.403 -1.528 563 HD12 LEU 70 HD12 LEU 70 0.524 4.397 -1.806 564 HD13 LEU 70 HD13 LEU 70 -1.089 3.688 -1.899 565 HD21 LEU 70 HD21 LEU 70 -2.395 5.998 -3.492 566 HD22 LEU 70 HD22 LEU 70 -2.589 4.277 -3.829 567 HD23 LEU 70 HD23 LEU 70 -2.001 5.361 -5.090 568 H ASP 71 HN ASP 71 -0.253 8.743 -5.963 569 HA ASP 71 HA ASP 71 2.319 9.818 -6.653 570 HB2 ASP 71 HB2 ASP 71 0.212 10.576 -7.720 571 HB3 ASP 71 HB1 ASP 71 -0.337 11.193 -6.164 572 H ARG 72 HN ARG 72 3.347 11.531 -5.557 573 HA ARG 72 HA ARG 72 3.756 11.048 -2.833 574 HB2 ARG 72 HB2 ARG 72 5.497 11.914 -4.253 575 HB3 ARG 72 HB1 ARG 72 4.568 13.363 -4.588 576 HG2 ARG 72 HG2 ARG 72 4.935 14.226 -2.436 577 HG3 ARG 72 HG1 ARG 72 5.490 12.667 -1.819 578 HD2 ARG 72 HD2 ARG 72 7.307 14.352 -2.261 579 HD3 ARG 72 HD1 ARG 72 7.512 12.797 -3.064 580 HE ARG 72 HE ARG 72 6.741 15.329 -4.353 581 HH11 ARG 72 HH11 ARG 72 7.740 11.976 -4.608 582 HH12 ARG 72 HH12 ARG 72 8.131 12.091 -6.303 583 HH21 ARG 72 HH21 ARG 72 7.235 15.481 -6.563 584 HH22 ARG 72 HH22 ARG 72 7.823 14.084 -7.423 585 H GLN 73 HN GLN 73 1.575 13.275 -4.445 586 HA GLN 73 HA GLN 73 0.989 14.648 -1.950 587 HB2 GLN 73 HB2 GLN 73 -0.344 14.870 -4.648 588 HB3 GLN 73 HB1 GLN 73 -0.598 15.942 -3.276 589 HG2 GLN 73 HG2 GLN 73 1.958 15.582 -4.819 590 HG3 GLN 73 HG1 GLN 73 0.869 16.958 -4.898 591 HE21 GLN 73 HE21 GLN 73 3.382 15.409 -3.156 592 HE22 GLN 73 HE22 GLN 73 3.635 16.648 -1.974 593 H GLY 74 HN GLY 74 0.201 11.724 -3.183 594 HA2 GLY 74 HA2 GLY 74 -1.252 10.200 -2.166 595 HA3 GLY 74 HA1 GLY 74 -2.136 11.539 -1.467 596 H HIS 75 HN HIS 75 -1.317 11.158 -4.843 597 HA HIS 75 HA HIS 75 -4.182 11.057 -5.476 598 HB2 HIS 75 HB2 HIS 75 -3.119 12.939 -6.504 599 HB3 HIS 75 HB1 HIS 75 -1.770 11.960 -7.058 600 HD1 HIS 75 HD1 HIS 75 -5.308 12.867 -7.888 601 HD2 HIS 75 HD2 HIS 75 -2.203 10.583 -9.445 602 HE1 HIS 75 HE1 HIS 75 -5.983 12.309 -10.252 603 HE2 HIS 75 HE2 HIS 75 -3.976 11.140 -11.229 604 H VAL 76 HN VAL 76 -4.963 9.119 -5.980 605 HA VAL 76 HA VAL 76 -3.567 6.808 -6.514 606 HB VAL 76 HB VAL 76 -5.914 6.714 -5.984 607 HG11 VAL 76 HG11 VAL 76 -7.653 7.424 -7.570 608 HG12 VAL 76 HG12 VAL 76 -6.403 8.087 -8.625 609 HG13 VAL 76 HG13 VAL 76 -6.659 8.775 -7.022 610 HG21 VAL 76 HG21 VAL 76 -6.722 5.154 -7.673 611 HG22 VAL 76 HG22 VAL 76 -5.022 4.860 -7.306 612 HG23 VAL 76 HG23 VAL 76 -5.474 5.698 -8.792 613 H LEU 77 HN LEU 77 -2.212 6.319 -8.074 614 HA LEU 77 HA LEU 77 -2.458 7.653 -10.674 615 HB2 LEU 77 HB2 LEU 77 -0.175 6.059 -9.510 616 HB3 LEU 77 HB1 LEU 77 -0.148 6.902 -11.047 617 HG LEU 77 HG LEU 77 -0.562 8.323 -8.422 618 HD11 LEU 77 HD11 LEU 77 1.784 8.902 -8.465 619 HD12 LEU 77 HD12 LEU 77 2.021 7.939 -9.924 620 HD13 LEU 77 HD13 LEU 77 1.596 7.148 -8.406 621 HD21 LEU 77 HD21 LEU 77 -1.308 9.496 -10.432 622 HD22 LEU 77 HD22 LEU 77 0.287 9.281 -11.151 623 HD23 LEU 77 HD23 LEU 77 0.098 10.280 -9.711 624 H ALA 78 HN ALA 78 -2.308 4.520 -9.135 625 HA ALA 78 HA ALA 78 -3.410 3.254 -11.517 626 HB1 ALA 78 HB1 ALA 78 -1.763 1.478 -11.524 627 HB2 ALA 78 HB2 ALA 78 -0.930 2.207 -10.149 628 HB3 ALA 78 HB3 ALA 78 -0.945 3.032 -11.711 629 H VAL 79 HN VAL 79 -4.458 1.257 -11.028 630 HA VAL 79 HA VAL 79 -4.495 0.351 -8.273 631 HB VAL 79 HB VAL 79 -7.072 0.182 -8.439 632 HG11 VAL 79 HG11 VAL 79 -5.691 2.811 -7.956 633 HG12 VAL 79 HG12 VAL 79 -6.005 1.538 -6.776 634 HG13 VAL 79 HG13 VAL 79 -7.347 2.445 -7.475 635 HG21 VAL 79 HG21 VAL 79 -6.601 2.457 -10.360 636 HG22 VAL 79 HG22 VAL 79 -8.161 1.978 -9.689 637 HG23 VAL 79 HG23 VAL 79 -7.288 0.886 -10.766 638 H THR 80 HN THR 80 -4.622 -1.802 -8.179 639 HA THR 80 HA THR 80 -5.782 -3.289 -10.414 640 HB THR 80 HB THR 80 -2.987 -3.812 -9.376 641 HG1 THR 80 HG1 THR 80 -3.980 -2.305 -11.470 642 HG21 THR 80 HG21 THR 80 -4.131 -5.864 -10.029 643 HG22 THR 80 HG22 THR 80 -2.874 -5.462 -11.200 644 HG23 THR 80 HG23 THR 80 -4.568 -5.147 -11.575 645 H LEU 81 HN LEU 81 -6.917 -5.003 -9.720 646 HA LEU 81 HA LEU 81 -7.054 -5.591 -6.909 647 HB2 LEU 81 HB2 LEU 81 -9.021 -5.734 -8.427 648 HB3 LEU 81 HB1 LEU 81 -8.265 -7.098 -9.232 649 HG LEU 81 HG LEU 81 -8.289 -8.304 -7.025 650 HD11 LEU 81 HD11 LEU 81 -10.065 -6.007 -6.232 651 HD12 LEU 81 HD12 LEU 81 -8.473 -6.373 -5.570 652 HD13 LEU 81 HD13 LEU 81 -9.815 -7.486 -5.305 653 HD21 LEU 81 HD21 LEU 81 -10.946 -7.448 -8.172 654 HD22 LEU 81 HD22 LEU 81 -10.674 -8.863 -7.153 655 HD23 LEU 81 HD23 LEU 81 -9.937 -8.773 -8.752 656 H VAL 82 HN VAL 82 -5.821 -6.953 -5.850 657 HA VAL 82 HA VAL 82 -3.899 -8.542 -7.390 658 HB VAL 82 HB VAL 82 -3.610 -8.386 -4.457 659 HG11 VAL 82 HG11 VAL 82 -1.796 -9.303 -5.626 660 HG12 VAL 82 HG12 VAL 82 -1.283 -7.663 -5.201 661 HG13 VAL 82 HG13 VAL 82 -1.824 -8.024 -6.840 662 HG21 VAL 82 HG21 VAL 82 -4.560 -6.182 -4.913 663 HG22 VAL 82 HG22 VAL 82 -3.319 -5.897 -6.134 664 HG23 VAL 82 HG23 VAL 82 -2.864 -6.070 -4.437 665 H SER 83 HN SER 83 -6.074 -8.803 -4.611 666 HA SER 83 HA SER 83 -6.573 -11.596 -5.313 667 HB2 SER 83 HB2 SER 83 -5.852 -10.699 -2.506 668 HB3 SER 83 HB1 SER 83 -6.389 -12.316 -2.959 669 HG SER 83 HG SER 83 -3.946 -11.550 -2.855 670 H SER 84 HN SER 84 -8.658 -12.304 -4.733 671 HA SER 84 HA SER 84 -10.394 -10.271 -3.520 672 HB2 SER 84 HB2 SER 84 -10.580 -9.923 -5.909 673 HB3 SER 84 HB1 SER 84 -10.872 -11.642 -6.174 674 HG SER 84 HG SER 84 -12.873 -10.811 -6.151 675 H ALA 85 HN ALA 85 -12.212 -11.057 -2.486 676 HA ALA 85 HA ALA 85 -12.328 -13.975 -2.140 677 HB1 ALA 85 HB1 ALA 85 -13.465 -11.792 -0.394 678 HB2 ALA 85 HB2 ALA 85 -11.964 -12.671 -0.093 679 HB3 ALA 85 HB3 ALA 85 -13.508 -13.523 -0.056 680 H GLY 86 HN GLY 86 -13.535 -12.035 -4.228 681 HA2 GLY 86 HA2 GLY 86 -15.374 -12.478 -5.618 682 HA3 GLY 86 HA1 GLY 86 -16.117 -13.385 -4.306 683 H LEU 87 HN LEU 87 -15.284 -10.084 -5.326 684 HA LEU 87 HA LEU 87 -17.644 -9.154 -3.810 685 HB2 LEU 87 HB2 LEU 87 -15.387 -7.370 -4.680 686 HB3 LEU 87 HB1 LEU 87 -16.653 -7.009 -3.543 687 HG LEU 87 HG LEU 87 -14.801 -7.234 -2.189 688 HD11 LEU 87 HD11 LEU 87 -16.597 -8.612 -1.352 689 HD12 LEU 87 HD12 LEU 87 -15.028 -9.309 -0.948 690 HD13 LEU 87 HD13 LEU 87 -15.984 -9.993 -2.262 691 HD21 LEU 87 HD21 LEU 87 -13.933 -9.654 -3.755 692 HD22 LEU 87 HD22 LEU 87 -13.081 -8.924 -2.396 693 HD23 LEU 87 HD23 LEU 87 -13.261 -8.032 -3.906 694 HA PRO 88 HA PRO 88 -18.280 -8.502 -8.385 695 HB2 PRO 88 HB2 PRO 88 -20.769 -9.577 -8.568 696 HB3 PRO 88 HB1 PRO 88 -19.294 -10.540 -8.694 697 HG2 PRO 88 HG2 PRO 88 -21.163 -10.219 -6.392 698 HG3 PRO 88 HG1 PRO 88 -20.276 -11.654 -6.927 699 HD2 PRO 88 HD2 PRO 88 -19.526 -10.055 -4.819 700 HD3 PRO 88 HD1 PRO 88 -18.420 -11.092 -5.737 701 H SER 89 HN SER 89 -21.309 -8.449 -6.525 702 HA SER 89 HA SER 89 -22.067 -5.912 -7.561 703 HB2 SER 89 HB2 SER 89 -23.195 -7.284 -5.113 704 HB3 SER 89 HB1 SER 89 -24.004 -6.120 -6.165 705 HG SER 89 HG SER 89 -24.687 -8.206 -6.677 706 H LEU 90 HN LEU 90 -20.058 -6.924 -5.019 707 HA LEU 90 HA LEU 90 -20.495 -4.697 -3.272 708 HB2 LEU 90 HB2 LEU 90 -18.206 -6.671 -3.319 709 HB3 LEU 90 HB1 LEU 90 -18.639 -5.611 -1.993 710 HG LEU 90 HG LEU 90 -20.492 -7.751 -3.025 711 HD11 LEU 90 HD11 LEU 90 -18.654 -7.971 -0.660 712 HD12 LEU 90 HD12 LEU 90 -18.270 -8.631 -2.250 713 HD13 LEU 90 HD13 LEU 90 -19.680 -9.226 -1.361 714 HD21 LEU 90 HD21 LEU 90 -21.516 -7.482 -0.810 715 HD22 LEU 90 HD22 LEU 90 -21.555 -5.986 -1.744 716 HD23 LEU 90 HD23 LEU 90 -20.373 -6.187 -0.450 717 H ASP 91 HN ASP 91 -18.309 -5.415 -5.904 718 HA ASP 91 HA ASP 91 -16.122 -3.830 -5.301 719 HB2 ASP 91 HB2 ASP 91 -15.963 -5.337 -7.139 720 HB3 ASP 91 HB1 ASP 91 -17.329 -4.593 -7.961 721 H ARG 92 HN ARG 92 -19.169 -2.894 -6.766 722 HA ARG 92 HA ARG 92 -18.495 -0.432 -7.822 723 HB2 ARG 92 HB2 ARG 92 -20.910 0.153 -7.467 724 HB3 ARG 92 HB1 ARG 92 -20.638 -1.391 -8.265 725 HG2 ARG 92 HG2 ARG 92 -20.950 -2.515 -6.078 726 HG3 ARG 92 HG1 ARG 92 -21.371 -0.951 -5.381 727 HD2 ARG 92 HD2 ARG 92 -22.813 -2.261 -7.672 728 HD3 ARG 92 HD1 ARG 92 -23.325 -2.345 -5.992 729 HE ARG 92 HE ARG 92 -23.312 0.242 -6.234 730 HH11 ARG 92 HH11 ARG 92 -24.235 -2.047 -8.731 731 HH12 ARG 92 HH12 ARG 92 -25.481 -1.018 -9.381 732 HH21 ARG 92 HH21 ARG 92 -24.946 1.593 -7.092 733 HH22 ARG 92 HH22 ARG 92 -25.887 1.045 -8.453 734 H GLU 93 HN GLU 93 -19.754 -1.009 -4.506 735 HA GLU 93 HA GLU 93 -19.495 1.762 -3.845 736 HB2 GLU 93 HB2 GLU 93 -20.534 -0.686 -2.577 737 HB3 GLU 93 HB1 GLU 93 -19.947 0.552 -1.490 738 HG2 GLU 93 HG2 GLU 93 -22.270 0.907 -1.758 739 HG3 GLU 93 HG1 GLU 93 -21.455 2.175 -2.670 740 H ILE 94 HN ILE 94 -17.934 -1.223 -2.686 741 HA ILE 94 HA ILE 94 -16.362 0.036 -0.741 742 HB ILE 94 HB ILE 94 -15.027 -2.007 -0.637 743 HG12 ILE 94 HG12 ILE 94 -16.616 -2.920 -3.045 744 HG13 ILE 94 HG11 ILE 94 -14.913 -2.477 -3.070 745 HG21 ILE 94 HG21 ILE 94 -16.853 -3.568 -0.119 746 HG22 ILE 94 HG22 ILE 94 -17.982 -2.502 -0.955 747 HG23 ILE 94 HG23 ILE 94 -17.161 -1.946 0.504 748 HD11 ILE 94 HD11 ILE 94 -16.119 -4.764 -1.532 749 HD12 ILE 94 HD12 ILE 94 -14.411 -4.320 -1.556 750 HD13 ILE 94 HD13 ILE 94 -15.197 -4.885 -3.031 751 H GLN 95 HN GLN 95 -15.657 -0.704 -4.120 752 HA GLN 95 HA GLN 95 -12.976 0.285 -3.854 753 HB2 GLN 95 HB2 GLN 95 -14.519 -0.439 -6.320 754 HB3 GLN 95 HB1 GLN 95 -12.817 -0.164 -6.207 755 HG2 GLN 95 HG2 GLN 95 -14.238 -2.359 -4.746 756 HG3 GLN 95 HG1 GLN 95 -13.459 -2.561 -6.313 757 HE21 GLN 95 HE21 GLN 95 -12.900 -3.932 -3.884 758 HE22 GLN 95 HE22 GLN 95 -11.260 -3.587 -3.468 759 H ALA 96 HN ALA 96 -16.075 1.574 -4.690 760 HA ALA 96 HA ALA 96 -15.346 3.718 -6.284 761 HB1 ALA 96 HB1 ALA 96 -17.684 3.182 -5.731 762 HB2 ALA 96 HB2 ALA 96 -17.313 4.887 -5.474 763 HB3 ALA 96 HB3 ALA 96 -17.423 3.792 -4.096 764 H LEU 97 HN LEU 97 -15.556 3.694 -2.704 765 HA LEU 97 HA LEU 97 -14.183 6.201 -2.643 766 HB2 LEU 97 HB2 LEU 97 -14.333 6.200 -0.276 767 HB3 LEU 97 HB1 LEU 97 -15.866 5.755 -0.965 768 HG LEU 97 HG LEU 97 -15.632 4.521 0.972 769 HD11 LEU 97 HD11 LEU 97 -15.649 2.218 0.395 770 HD12 LEU 97 HD12 LEU 97 -14.886 2.578 -1.148 771 HD13 LEU 97 HD13 LEU 97 -16.506 3.178 -0.806 772 HD21 LEU 97 HD21 LEU 97 -13.345 4.846 1.481 773 HD22 LEU 97 HD22 LEU 97 -12.862 3.759 0.180 774 HD23 LEU 97 HD23 LEU 97 -13.728 3.127 1.579 775 H VAL 98 HN VAL 98 -13.187 2.897 -1.740 776 HA VAL 98 HA VAL 98 -10.549 3.689 -1.053 777 HB VAL 98 HB VAL 98 -11.663 0.983 -1.769 778 HG11 VAL 98 HG11 VAL 98 -8.893 1.638 -0.756 779 HG12 VAL 98 HG12 VAL 98 -9.290 1.020 -2.360 780 HG13 VAL 98 HG13 VAL 98 -9.572 0.017 -0.937 781 HG21 VAL 98 HG21 VAL 98 -12.509 1.739 0.302 782 HG22 VAL 98 HG22 VAL 98 -10.943 2.377 0.799 783 HG23 VAL 98 HG23 VAL 98 -11.195 0.631 0.699 784 H LYS 99 HN LYS 99 -11.800 2.250 -4.086 785 HA LYS 99 HA LYS 99 -9.150 1.985 -5.162 786 HB2 LYS 99 HB2 LYS 99 -10.897 0.353 -5.737 787 HB3 LYS 99 HB1 LYS 99 -11.846 1.611 -6.510 788 HG2 LYS 99 HG2 LYS 99 -9.892 1.937 -8.090 789 HG3 LYS 99 HG1 LYS 99 -9.212 0.460 -7.405 790 HD2 LYS 99 HD2 LYS 99 -11.912 0.694 -8.737 791 HD3 LYS 99 HD1 LYS 99 -10.458 0.040 -9.486 792 HE2 LYS 99 HE2 LYS 99 -10.403 -1.782 -7.910 793 HE3 LYS 99 HE1 LYS 99 -11.738 -1.083 -6.997 794 HZ1 LYS 99 HZ1 LYS 99 -13.088 -1.331 -9.088 795 HZ2 LYS 99 HZ2 LYS 99 -12.666 -2.776 -8.320 796 HZ3 LYS 99 HZ3 LYS 99 -11.824 -2.279 -9.710 797 H ARG 100 HN ARG 100 -11.765 4.359 -5.476 798 HA ARG 100 HA ARG 100 -10.316 5.644 -7.652 799 HB2 ARG 100 HB2 ARG 100 -12.779 5.541 -7.732 800 HB3 ARG 100 HB1 ARG 100 -12.859 6.515 -6.271 801 HG2 ARG 100 HG2 ARG 100 -13.255 7.771 -8.386 802 HG3 ARG 100 HG1 ARG 100 -11.948 8.408 -7.385 803 HD2 ARG 100 HD2 ARG 100 -11.308 8.379 -9.741 804 HD3 ARG 100 HD1 ARG 100 -10.305 7.279 -8.796 805 HE ARG 100 HE ARG 100 -12.605 6.284 -10.362 806 HH11 ARG 100 HH11 ARG 100 -9.196 6.246 -9.553 807 HH12 ARG 100 HH12 ARG 100 -8.839 4.870 -10.541 808 HH21 ARG 100 HH21 ARG 100 -12.139 4.464 -11.680 809 HH22 ARG 100 HH22 ARG 100 -10.509 3.852 -11.754 810 H ALA 101 HN ALA 101 -10.494 5.842 -4.245 811 HA ALA 101 HA ALA 101 -8.985 8.370 -4.344 812 HB1 ALA 101 HB1 ALA 101 -9.854 8.999 -2.219 813 HB2 ALA 101 HB2 ALA 101 -10.617 7.420 -1.995 814 HB3 ALA 101 HB3 ALA 101 -11.225 8.530 -3.229 815 H SER 102 HN SER 102 -7.441 6.303 -4.772 816 HA SER 102 HA SER 102 -6.434 5.158 -2.333 817 HB2 SER 102 HB2 SER 102 -5.227 5.103 -5.107 818 HB3 SER 102 HB1 SER 102 -4.796 4.055 -3.754 819 HG SER 102 HG SER 102 -7.387 3.827 -4.027 820 HA PRO 103 HA PRO 103 -3.938 8.818 -1.840 821 HB2 PRO 103 HB2 PRO 103 -4.267 8.910 0.842 822 HB3 PRO 103 HB1 PRO 103 -5.546 9.343 -0.297 823 HG2 PRO 103 HG2 PRO 103 -5.378 7.045 1.484 824 HG3 PRO 103 HG1 PRO 103 -6.767 7.641 0.562 825 HD2 PRO 103 HD2 PRO 103 -4.880 5.491 -0.096 826 HD3 PRO 103 HD1 PRO 103 -6.478 5.840 -0.791 827 H LEU 104 HN LEU 104 -2.059 9.475 -0.634 828 HA LEU 104 HA LEU 104 -0.422 7.381 0.586 829 HB2 LEU 104 HB2 LEU 104 0.169 7.461 -1.819 830 HB3 LEU 104 HB1 LEU 104 0.499 9.174 -1.672 831 HG LEU 104 HG LEU 104 2.312 8.559 -0.007 832 HD11 LEU 104 HD11 LEU 104 3.206 6.272 -0.181 833 HD12 LEU 104 HD12 LEU 104 1.797 5.811 -1.137 834 HD13 LEU 104 HD13 LEU 104 1.596 6.312 0.544 835 HD21 LEU 104 HD21 LEU 104 3.904 7.990 -1.765 836 HD22 LEU 104 HD22 LEU 104 2.779 9.240 -2.297 837 HD23 LEU 104 HD23 LEU 104 2.572 7.576 -2.843 838 HA PRO 105 HA PRO 105 -0.337 11.276 2.942 839 HB2 PRO 105 HB2 PRO 105 -0.107 10.149 5.393 840 HB3 PRO 105 HB1 PRO 105 -1.645 10.327 4.545 841 HG2 PRO 105 HG2 PRO 105 0.039 7.917 4.931 842 HG3 PRO 105 HG1 PRO 105 -1.718 8.057 4.796 843 HD2 PRO 105 HD2 PRO 105 -0.012 7.229 2.762 844 HD3 PRO 105 HD1 PRO 105 -1.682 7.795 2.554 845 H THR 106 HN THR 106 1.798 8.560 3.862 846 HA THR 106 HA THR 106 3.873 10.439 4.631 847 HB THR 106 HB THR 106 3.989 7.418 4.633 848 HG1 THR 106 HG1 THR 106 2.776 9.238 6.381 849 HG21 THR 106 HG21 THR 106 5.743 7.755 6.324 850 HG22 THR 106 HG22 THR 106 5.586 9.500 6.129 851 HG23 THR 106 HG23 THR 106 6.169 8.515 4.788 852 HA PRO 107 HA PRO 107 5.262 10.248 0.367 853 HB2 PRO 107 HB2 PRO 107 7.390 12.039 1.330 854 HB3 PRO 107 HB1 PRO 107 6.164 12.316 0.087 855 HG2 PRO 107 HG2 PRO 107 6.064 13.551 2.471 856 HG3 PRO 107 HG1 PRO 107 4.596 13.047 1.614 857 HD2 PRO 107 HD2 PRO 107 5.990 11.730 3.916 858 HD3 PRO 107 HD1 PRO 107 4.251 11.969 3.639 859 HA PRO 108 HA PRO 108 8.622 7.386 1.340 860 HB2 PRO 108 HB2 PRO 108 7.977 5.508 -0.413 861 HB3 PRO 108 HB1 PRO 108 6.961 5.770 1.013 862 HG2 PRO 108 HG2 PRO 108 6.526 6.647 -1.812 863 HG3 PRO 108 HG1 PRO 108 5.350 6.014 -0.649 864 HD2 PRO 108 HD2 PRO 108 5.785 8.713 -1.217 865 HD3 PRO 108 HD1 PRO 108 4.960 8.082 0.223 866 H ALA 109 HN ALA 109 9.484 9.574 0.153 867 HA ALA 109 HA ALA 109 10.213 9.511 -2.526 868 HB1 ALA 109 HB1 ALA 109 10.504 11.484 -1.121 869 HB2 ALA 109 HB2 ALA 109 12.014 11.052 -1.925 870 HB3 ALA 109 HB3 ALA 109 11.779 10.663 -0.221 871 H ASP 110 HN ASP 110 11.897 8.240 0.302 872 HA ASP 110 HA ASP 110 14.104 7.224 -1.199 873 HB2 ASP 110 HB2 ASP 110 13.278 6.600 1.640 874 HB3 ASP 110 HB1 ASP 110 14.843 6.243 0.921 875 H ALA 111 HN ALA 111 11.105 6.226 -1.410 876 HA ALA 111 HA ALA 111 11.759 3.355 -1.326 877 HB1 ALA 111 HB1 ALA 111 9.366 2.943 -1.184 878 HB2 ALA 111 HB2 ALA 111 9.051 4.678 -1.281 879 HB3 ALA 111 HB3 ALA 111 9.896 4.009 0.118 880 H TYR 112 HN TYR 112 10.714 5.988 -3.358 881 HA TYR 112 HA TYR 112 10.258 4.051 -5.511 882 HB2 TYR 112 HB2 TYR 112 8.528 5.533 -6.443 883 HB3 TYR 112 HB1 TYR 112 8.140 4.819 -4.895 884 HD1 TYR 112 HD2 TYR 112 10.288 7.812 -5.255 885 HD2 TYR 112 HD1 TYR 112 6.428 6.298 -4.337 886 HE1 TYR 112 HE2 TYR 112 9.640 10.006 -4.377 887 HE2 TYR 112 HE1 TYR 112 5.763 8.476 -3.463 888 HH TYR 112 HH TYR 112 6.809 10.495 -2.549 889 H VAL 113 HN VAL 113 12.541 5.888 -4.745 890 HA VAL 113 HA VAL 113 12.857 7.546 -7.055 891 HB VAL 113 HB VAL 113 15.370 7.397 -6.459 892 HG11 VAL 113 HG11 VAL 113 15.103 8.996 -4.618 893 HG12 VAL 113 HG12 VAL 113 13.409 8.527 -4.462 894 HG13 VAL 113 HG13 VAL 113 13.973 9.319 -5.933 895 HG21 VAL 113 HG21 VAL 113 15.927 6.658 -4.232 896 HG22 VAL 113 HG22 VAL 113 15.177 5.322 -5.106 897 HG23 VAL 113 HG23 VAL 113 14.249 6.229 -3.909 898 H ASN 114 HN ASN 114 12.396 6.439 -8.783 899 HA ASN 114 HA ASN 114 13.835 4.886 -10.377 900 HB2 ASN 114 HB2 ASN 114 13.126 2.523 -9.932 901 HB3 ASN 114 HB1 ASN 114 14.234 3.161 -8.732 902 HD21 ASN 114 HD21 ASN 114 10.735 3.809 -8.828 903 HD22 ASN 114 HD22 ASN 114 10.382 2.956 -7.369 904 H GLY 115 HN GLY 115 10.908 5.830 -8.994 905 HA2 GLY 115 HA2 GLY 115 9.507 6.305 -11.286 906 HA3 GLY 115 HA1 GLY 115 9.115 4.637 -10.889 907 H THR 116 HN THR 116 7.978 4.184 -8.977 908 HA THR 116 HA THR 116 6.896 6.256 -7.330 909 HB THR 116 HB THR 116 4.485 5.310 -8.173 910 HG1 THR 116 HG1 THR 116 5.502 4.283 -9.995 911 HG21 THR 116 HG21 THR 116 4.983 7.638 -7.724 912 HG22 THR 116 HG22 THR 116 4.192 7.482 -9.295 913 HG23 THR 116 HG23 THR 116 5.935 7.747 -9.204 914 H VAL 117 HN VAL 117 4.916 5.139 -6.030 915 HA VAL 117 HA VAL 117 6.014 2.531 -5.257 916 HB VAL 117 HB VAL 117 4.689 2.811 -3.138 917 HG11 VAL 117 HG11 VAL 117 6.240 4.435 -2.125 918 HG12 VAL 117 HG12 VAL 117 6.796 4.871 -3.742 919 HG13 VAL 117 HG13 VAL 117 7.050 3.234 -3.135 920 HG21 VAL 117 HG21 VAL 117 3.036 4.429 -3.854 921 HG22 VAL 117 HG22 VAL 117 4.298 5.629 -4.156 922 HG23 VAL 117 HG23 VAL 117 3.969 5.086 -2.509 923 H GLU 118 HN GLU 118 5.033 0.949 -6.256 924 HA GLU 118 HA GLU 118 2.086 0.902 -6.199 925 HB2 GLU 118 HB2 GLU 118 3.253 0.565 -8.432 926 HB3 GLU 118 HB1 GLU 118 3.921 -0.921 -7.770 927 HG2 GLU 118 HG2 GLU 118 1.535 -1.633 -7.325 928 HG3 GLU 118 HG1 GLU 118 1.049 -0.263 -8.325 929 H LEU 119 HN LEU 119 1.393 -0.118 -4.437 930 HA LEU 119 HA LEU 119 2.892 -2.459 -3.508 931 HB2 LEU 119 HB2 LEU 119 2.791 -1.675 -1.204 932 HB3 LEU 119 HB1 LEU 119 3.685 -0.557 -2.214 933 HG LEU 119 HG LEU 119 1.070 0.419 -2.242 934 HD11 LEU 119 HD11 LEU 119 0.494 -1.059 -0.434 935 HD12 LEU 119 HD12 LEU 119 0.518 0.618 0.114 936 HD13 LEU 119 HD13 LEU 119 1.856 -0.460 0.516 937 HD21 LEU 119 HD21 LEU 119 2.017 2.253 -0.940 938 HD22 LEU 119 HD22 LEU 119 3.126 1.745 -2.214 939 HD23 LEU 119 HD23 LEU 119 3.418 1.259 -0.543 940 H THR 120 HN THR 120 1.695 -3.878 -2.149 941 HA THR 120 HA THR 120 -1.104 -3.923 -2.990 942 HB THR 120 HB THR 120 0.648 -6.114 -1.860 943 HG1 THR 120 HG1 THR 120 1.148 -5.364 -4.035 944 HG21 THR 120 HG21 THR 120 -1.726 -6.435 -1.332 945 HG22 THR 120 HG22 THR 120 -1.165 -7.621 -2.512 946 HG23 THR 120 HG23 THR 120 -2.134 -6.244 -3.039 947 H LEU 121 HN LEU 121 -2.516 -3.118 -1.567 948 HA LEU 121 HA LEU 121 -2.107 -3.794 1.270 949 HB2 LEU 121 HB2 LEU 121 -3.362 -1.336 0.055 950 HB3 LEU 121 HB1 LEU 121 -3.500 -1.752 1.754 951 HG LEU 121 HG LEU 121 -0.954 -1.127 0.265 952 HD11 LEU 121 HD11 LEU 121 -2.438 0.359 2.425 953 HD12 LEU 121 HD12 LEU 121 -2.261 0.844 0.738 954 HD13 LEU 121 HD13 LEU 121 -0.849 0.790 1.789 955 HD21 LEU 121 HD21 LEU 121 -0.616 -2.886 1.931 956 HD22 LEU 121 HD22 LEU 121 -1.362 -1.863 3.161 957 HD23 LEU 121 HD23 LEU 121 0.160 -1.375 2.413 958 HA PRO 122 HA PRO 122 -5.993 -5.925 0.695 959 HB2 PRO 122 HB2 PRO 122 -5.802 -6.452 3.569 960 HB3 PRO 122 HB1 PRO 122 -5.799 -7.596 2.226 961 HG2 PRO 122 HG2 PRO 122 -3.602 -7.106 3.725 962 HG3 PRO 122 HG1 PRO 122 -3.512 -7.535 2.006 963 HD2 PRO 122 HD2 PRO 122 -3.275 -4.848 3.303 964 HD3 PRO 122 HD1 PRO 122 -2.348 -5.531 1.950 965 H ILE 123 HN ILE 123 -7.749 -4.689 0.595 966 HA ILE 123 HA ILE 123 -8.263 -2.744 2.715 967 HB ILE 123 HB ILE 123 -9.954 -1.778 1.279 968 HG12 ILE 123 HG12 ILE 123 -9.374 -3.969 -0.718 969 HG13 ILE 123 HG11 ILE 123 -10.784 -3.946 0.334 970 HG21 ILE 123 HG21 ILE 123 -7.781 -0.976 0.761 971 HG22 ILE 123 HG22 ILE 123 -8.586 -1.269 -0.788 972 HG23 ILE 123 HG23 ILE 123 -7.396 -2.420 -0.175 973 HD11 ILE 123 HD11 ILE 123 -11.379 -3.148 -1.854 974 HD12 ILE 123 HD12 ILE 123 -10.110 -1.927 -1.784 975 HD13 ILE 123 HD13 ILE 123 -11.489 -1.827 -0.690 976 H ASP 124 HN ASP 124 -9.591 -3.319 4.366 977 HA ASP 124 HA ASP 124 -11.118 -5.775 3.891 978 HB2 ASP 124 HB2 ASP 124 -10.952 -6.233 6.266 979 HB3 ASP 124 HB1 ASP 124 -9.352 -5.941 5.597 980 H PHE 125 HN PHE 125 -13.133 -5.480 3.542 981 HA PHE 125 HA PHE 125 -14.650 -3.992 5.581 982 HB2 PHE 125 HB2 PHE 125 -15.600 -4.974 2.867 983 HB3 PHE 125 HB1 PHE 125 -16.554 -4.062 4.029 984 HD1 PHE 125 HD1 PHE 125 -13.544 -3.847 1.863 985 HD2 PHE 125 HD2 PHE 125 -16.586 -1.736 3.956 986 HE1 PHE 125 HE1 PHE 125 -12.820 -1.755 0.793 987 HE2 PHE 125 HE2 PHE 125 -15.866 0.362 2.888 988 HZ PHE 125 HZ PHE 125 -13.980 0.353 1.305 989 H SER 126 HN SER 126 -15.735 -5.332 7.019 990 HA SER 126 HA SER 126 -14.949 -7.998 7.187 991 HB2 SER 126 HB2 SER 126 -17.420 -6.795 8.448 992 HB3 SER 126 HB1 SER 126 -16.509 -8.192 9.021 993 HG SER 126 HG SER 126 -14.691 -6.430 8.918 994 H LEU 127 HN LEU 127 -15.368 -9.482 5.713 995 HA LEU 127 HA LEU 127 -17.903 -9.403 4.235 996 HB2 LEU 127 HB2 LEU 127 -15.428 -9.441 3.269 997 HB3 LEU 127 HB1 LEU 127 -15.613 -11.166 3.491 998 HG LEU 127 HG LEU 127 -17.148 -9.355 1.644 999 HD11 LEU 127 HD11 LEU 127 -15.561 -11.869 1.181 1000 HD12 LEU 127 HD12 LEU 127 -14.996 -10.224 0.887 1001 HD13 LEU 127 HD13 LEU 127 -16.339 -10.877 -0.053 1002 HD21 LEU 127 HD21 LEU 127 -18.526 -11.252 1.004 1003 HD22 LEU 127 HD22 LEU 127 -18.780 -10.837 2.701 1004 HD23 LEU 127 HD23 LEU 127 -17.788 -12.230 2.271 1005 H ARG 128 HN ARG 128 -19.374 -10.631 5.312 1006 HA ARG 128 HA ARG 128 -18.646 -13.239 6.316 1007 HB2 ARG 128 HB2 ARG 128 -21.306 -11.817 6.156 1008 HB3 ARG 128 HB1 ARG 128 -21.037 -13.367 6.925 1009 HG2 ARG 128 HG2 ARG 128 -19.373 -12.208 8.427 1010 HG3 ARG 128 HG1 ARG 128 -19.989 -10.686 7.773 1011 HD2 ARG 128 HD2 ARG 128 -21.123 -11.184 9.844 1012 HD3 ARG 128 HD1 ARG 128 -22.260 -11.342 8.504 1013 HE ARG 128 HE ARG 128 -20.962 -13.631 9.847 1014 HH11 ARG 128 HH11 ARG 128 -23.711 -12.155 8.245 1015 HH12 ARG 128 HH12 ARG 128 -24.708 -13.574 8.361 1016 HH21 ARG 128 HH21 ARG 128 -22.292 -15.481 10.071 1017 HH22 ARG 128 HH22 ARG 128 -23.913 -15.465 9.433 1018 H GLY 129 HN GLY 129 -20.725 -11.850 3.782 1019 HA2 GLY 129 HA2 GLY 129 -20.036 -13.542 1.748 1020 HA3 GLY 129 HA1 GLY 129 -21.285 -14.419 2.619 1021 H ALA 130 HN ALA 130 -20.824 -11.017 1.627 1022 HA ALA 130 HA ALA 130 -23.633 -10.777 1.021 1023 HB1 ALA 130 HB1 ALA 130 -21.440 -8.775 0.516 1024 HB2 ALA 130 HB2 ALA 130 -22.323 -8.935 2.036 1025 HB3 ALA 130 HB3 ALA 130 -23.176 -8.468 0.565 1026 H GLY 131 HN GLY 131 -21.051 -11.994 -0.674 1027 HA2 GLY 131 HA2 GLY 131 -21.941 -11.015 -3.274 1028 HA3 GLY 131 HA1 GLY 131 -20.546 -12.042 -2.973 1029 H PHE 132 HN PHE 132 -23.893 -12.488 -1.936 1030 HA PHE 132 HA PHE 132 -23.783 -15.181 -3.026 1031 HB2 PHE 132 HB2 PHE 132 -25.781 -15.621 -1.652 1032 HB3 PHE 132 HB1 PHE 132 -24.453 -14.990 -0.692 1033 HD1 PHE 132 HD1 PHE 132 -24.522 -12.477 -0.117 1034 HD2 PHE 132 HD2 PHE 132 -27.887 -14.662 -1.526 1035 HE1 PHE 132 HE1 PHE 132 -26.018 -10.769 0.821 1036 HE2 PHE 132 HE2 PHE 132 -29.392 -12.955 -0.591 1037 HZ PHE 132 HZ PHE 132 -28.453 -11.005 0.585 Start of MODEL 18 1 H1 LYS 2 HT1 LYS 2 47.309 11.289 29.070 2 H2 LYS 2 HT2 LYS 2 47.419 9.637 28.697 3 H3 LYS 2 HT3 LYS 2 48.708 10.425 29.464 4 HA LYS 2 HA LYS 2 46.017 10.020 30.628 5 HB2 LYS 2 HB2 LYS 2 47.360 7.933 30.386 6 HB3 LYS 2 HB1 LYS 2 48.651 8.689 31.311 7 HG2 LYS 2 HG2 LYS 2 47.103 8.896 33.233 8 HG3 LYS 2 HG1 LYS 2 45.881 8.032 32.298 9 HD2 LYS 2 HD2 LYS 2 46.968 6.470 33.755 10 HD3 LYS 2 HD1 LYS 2 47.470 6.125 32.099 11 HE2 LYS 2 HE2 LYS 2 49.409 6.001 33.480 12 HE3 LYS 2 HE1 LYS 2 49.528 7.480 32.529 13 HZ1 LYS 2 HZ1 LYS 2 50.151 7.881 34.815 14 HZ2 LYS 2 HZ2 LYS 2 48.662 7.291 35.365 15 HZ3 LYS 2 HZ3 LYS 2 48.722 8.722 34.460 16 H VAL 3 HN VAL 3 45.648 11.845 31.716 17 HA VAL 3 HA VAL 3 47.801 12.792 33.487 18 HB VAL 3 HB VAL 3 46.839 15.105 33.286 19 HG11 VAL 3 HG11 VAL 3 47.957 13.847 30.782 20 HG12 VAL 3 HG12 VAL 3 48.880 14.517 32.128 21 HG13 VAL 3 HG13 VAL 3 47.906 15.579 31.110 22 HG21 VAL 3 HG21 VAL 3 45.385 13.915 30.922 23 HG22 VAL 3 HG22 VAL 3 45.483 15.632 31.312 24 HG23 VAL 3 HG23 VAL 3 44.640 14.529 32.399 25 H GLN 4 HN GLN 4 44.326 12.580 32.943 26 HA GLN 4 HA GLN 4 43.588 11.617 35.408 27 HB2 GLN 4 HB2 GLN 4 44.496 14.039 36.007 28 HB3 GLN 4 HB1 GLN 4 42.911 14.538 35.440 29 HG2 GLN 4 HG2 GLN 4 43.384 12.517 37.617 30 HG3 GLN 4 HG1 GLN 4 43.061 14.226 37.893 31 HE21 GLN 4 HE21 GLN 4 41.728 11.161 36.975 32 HE22 GLN 4 HE22 GLN 4 40.061 11.637 37.019 33 H GLU 5 HN GLU 5 42.381 10.575 33.737 34 HA GLU 5 HA GLU 5 40.319 12.192 32.435 35 HB2 GLU 5 HB2 GLU 5 41.250 9.369 31.891 36 HB3 GLU 5 HB1 GLU 5 39.947 10.168 31.027 37 HG2 GLU 5 HG2 GLU 5 41.758 10.400 29.610 38 HG3 GLU 5 HG1 GLU 5 41.694 11.950 30.443 39 H GLN 6 HN GLN 6 38.179 11.857 32.733 40 HA GLN 6 HA GLN 6 37.406 9.944 34.822 41 HB2 GLN 6 HB2 GLN 6 36.806 12.285 35.266 42 HB3 GLN 6 HB1 GLN 6 35.924 12.356 33.748 43 HG2 GLN 6 HG2 GLN 6 34.432 12.099 35.660 44 HG3 GLN 6 HG1 GLN 6 34.329 10.723 34.564 45 HE21 GLN 6 HE21 GLN 6 34.983 8.708 35.270 46 HE22 GLN 6 HE22 GLN 6 35.404 8.379 36.913 47 H SER 7 HN SER 7 36.837 8.065 33.951 48 HA SER 7 HA SER 7 35.580 7.961 31.342 49 HB2 SER 7 HB2 SER 7 36.325 5.754 33.279 50 HB3 SER 7 HB1 SER 7 35.736 5.510 31.630 51 HG SER 7 HG SER 7 37.651 7.120 31.241 52 H VAL 8 HN VAL 8 33.498 7.823 30.963 53 HA VAL 8 HA VAL 8 31.663 6.767 32.964 54 HB VAL 8 HB VAL 8 31.858 9.234 33.390 55 HG11 VAL 8 HG11 VAL 8 30.834 10.806 31.838 56 HG12 VAL 8 HG12 VAL 8 30.570 9.502 30.681 57 HG13 VAL 8 HG13 VAL 8 32.212 9.986 31.105 58 HG21 VAL 8 HG21 VAL 8 29.159 8.243 32.483 59 HG22 VAL 8 HG22 VAL 8 29.438 9.654 33.504 60 HG23 VAL 8 HG23 VAL 8 29.872 8.046 34.085 61 H GLY 9 HN GLY 9 32.672 5.859 30.456 62 HA2 GLY 9 HA2 GLY 9 30.501 6.298 28.538 63 HA3 GLY 9 HA1 GLY 9 32.045 5.531 28.195 64 H ALA 10 HN ALA 10 29.149 5.052 30.197 65 HA ALA 10 HA ALA 10 29.459 2.278 30.542 66 HB1 ALA 10 HB1 ALA 10 27.150 2.283 31.279 67 HB2 ALA 10 HB2 ALA 10 26.899 3.873 30.559 68 HB3 ALA 10 HB3 ALA 10 27.992 3.690 31.931 69 HA PRO 11 HA PRO 11 28.285 1.171 26.348 70 HB2 PRO 11 HB2 PRO 11 29.208 -1.490 26.932 71 HB3 PRO 11 HB1 PRO 11 29.994 -0.255 25.947 72 HG2 PRO 11 HG2 PRO 11 30.972 -1.165 28.345 73 HG3 PRO 11 HG1 PRO 11 31.340 0.424 27.654 74 HD2 PRO 11 HD2 PRO 11 29.357 -0.300 29.781 75 HD3 PRO 11 HD1 PRO 11 30.449 1.101 29.684 76 HA PRO 12 HA PRO 12 24.397 -0.741 27.545 77 HB2 PRO 12 HB2 PRO 12 23.225 -0.547 25.109 78 HB3 PRO 12 HB1 PRO 12 23.378 0.831 26.205 79 HG2 PRO 12 HG2 PRO 12 25.051 0.099 23.838 80 HG3 PRO 12 HG1 PRO 12 24.447 1.693 24.331 81 HD2 PRO 12 HD2 PRO 12 26.990 0.852 24.805 82 HD3 PRO 12 HD1 PRO 12 26.136 1.990 25.863 83 HA PRO 13 HA PRO 13 25.123 -4.874 26.060 84 HB2 PRO 13 HB2 PRO 13 22.899 -6.056 26.987 85 HB3 PRO 13 HB1 PRO 13 24.161 -5.475 28.081 86 HG2 PRO 13 HG2 PRO 13 21.548 -4.207 27.351 87 HG3 PRO 13 HG1 PRO 13 22.332 -4.325 28.937 88 HD2 PRO 13 HD2 PRO 13 22.416 -2.093 27.339 89 HD3 PRO 13 HD1 PRO 13 23.643 -2.491 28.556 90 H GLY 14 HN GLY 14 24.497 -3.376 23.925 91 HA2 GLY 14 HA2 GLY 14 22.886 -5.149 22.339 92 HA3 GLY 14 HA1 GLY 14 22.117 -3.590 22.605 93 H ARG 15 HN ARG 15 22.340 -3.678 20.164 94 HA ARG 15 HA ARG 15 24.976 -2.616 19.385 95 HB2 ARG 15 HB2 ARG 15 22.931 -4.055 17.681 96 HB3 ARG 15 HB1 ARG 15 24.388 -3.299 17.055 97 HG2 ARG 15 HG2 ARG 15 24.951 -5.545 17.212 98 HG3 ARG 15 HG1 ARG 15 25.650 -4.845 18.673 99 HD2 ARG 15 HD2 ARG 15 23.384 -5.514 19.757 100 HD3 ARG 15 HD1 ARG 15 23.236 -6.588 18.367 101 HE ARG 15 HE ARG 15 25.698 -7.173 19.304 102 HH11 ARG 15 HH11 ARG 15 22.499 -7.087 20.741 103 HH12 ARG 15 HH12 ARG 15 22.918 -8.170 22.038 104 HH21 ARG 15 HH21 ARG 15 26.249 -8.585 21.004 105 HH22 ARG 15 HH22 ARG 15 25.050 -9.028 22.186 106 H ALA 16 HN ALA 16 24.826 -0.477 19.476 107 HA ALA 16 HA ALA 16 22.348 0.839 18.638 108 HB1 ALA 16 HB1 ALA 16 23.339 1.473 20.796 109 HB2 ALA 16 HB2 ALA 16 23.268 2.835 19.679 110 HB3 ALA 16 HB3 ALA 16 24.798 2.004 19.959 111 H ASP 17 HN ASP 17 25.504 0.150 17.554 112 HA ASP 17 HA ASP 17 25.787 2.373 15.761 113 HB2 ASP 17 HB2 ASP 17 27.318 -0.195 16.145 114 HB3 ASP 17 HB1 ASP 17 27.691 0.923 14.837 115 H LYS 18 HN LYS 18 23.401 1.563 15.110 116 HA LYS 18 HA LYS 18 23.513 -0.359 12.929 117 HB2 LYS 18 HB2 LYS 18 21.034 0.155 12.777 118 HB3 LYS 18 HB1 LYS 18 21.580 -0.582 14.276 119 HG2 LYS 18 HG2 LYS 18 21.579 1.644 15.335 120 HG3 LYS 18 HG1 LYS 18 20.945 2.330 13.838 121 HD2 LYS 18 HD2 LYS 18 18.959 0.929 14.024 122 HD3 LYS 18 HD1 LYS 18 19.602 0.189 15.491 123 HE2 LYS 18 HE2 LYS 18 18.872 3.096 15.126 124 HE3 LYS 18 HE1 LYS 18 17.957 1.897 16.038 125 HZ1 LYS 18 HZ1 LYS 18 19.916 1.637 17.496 126 HZ2 LYS 18 HZ2 LYS 18 19.254 3.197 17.547 127 HZ3 LYS 18 HZ3 LYS 18 20.673 2.910 16.671 128 H THR 19 HN THR 19 25.144 1.396 12.127 129 HA THR 19 HA THR 19 25.744 3.010 10.668 130 HB THR 19 HB THR 19 24.422 3.044 8.508 131 HG1 THR 19 HG1 THR 19 22.532 2.016 9.936 132 HG21 THR 19 HG21 THR 19 25.129 0.789 7.855 133 HG22 THR 19 HG22 THR 19 25.338 0.363 9.554 134 HG23 THR 19 HG23 THR 19 26.363 1.599 8.821 135 H ALA 20 HN ALA 20 25.133 4.565 12.402 136 HA ALA 20 HA ALA 20 22.912 6.282 11.512 137 HB1 ALA 20 HB1 ALA 20 22.698 7.059 13.810 138 HB2 ALA 20 HB2 ALA 20 24.039 6.021 14.297 139 HB3 ALA 20 HB3 ALA 20 22.532 5.306 13.721 140 H ALA 21 HN ALA 21 25.430 6.408 10.369 141 HA ALA 21 HA ALA 21 26.691 8.792 11.471 142 HB1 ALA 21 HB1 ALA 21 28.438 8.462 9.830 143 HB2 ALA 21 HB2 ALA 21 27.515 7.169 9.068 144 HB3 ALA 21 HB3 ALA 21 28.136 6.962 10.705 145 HA PRO 22 HA PRO 22 25.047 10.574 7.340 146 HB2 PRO 22 HB2 PRO 22 23.455 8.600 5.955 147 HB3 PRO 22 HB1 PRO 22 24.932 9.393 5.409 148 HG2 PRO 22 HG2 PRO 22 24.777 6.732 6.002 149 HG3 PRO 22 HG1 PRO 22 26.268 7.684 6.127 150 HD2 PRO 22 HD2 PRO 22 24.357 6.865 8.288 151 HD3 PRO 22 HD1 PRO 22 26.135 6.879 8.300 152 H GLN 23 HN GLN 23 22.516 10.475 6.147 153 HA GLN 23 HA GLN 23 20.847 10.971 8.474 154 HB2 GLN 23 HB2 GLN 23 20.367 11.460 5.530 155 HB3 GLN 23 HB1 GLN 23 19.189 11.818 6.790 156 HG2 GLN 23 HG2 GLN 23 21.900 13.054 6.401 157 HG3 GLN 23 HG1 GLN 23 20.322 13.840 6.289 158 HE21 GLN 23 HE21 GLN 23 19.212 14.369 8.177 159 HE22 GLN 23 HE22 GLN 23 19.976 14.334 9.737 160 H THR 24 HN THR 24 21.650 8.258 7.601 161 HA THR 24 HA THR 24 19.372 6.872 6.645 162 HB THR 24 HB THR 24 20.655 4.883 7.742 163 HG1 THR 24 HG1 THR 24 22.375 5.452 8.829 164 HG21 THR 24 HG21 THR 24 20.635 5.344 5.335 165 HG22 THR 24 HG22 THR 24 22.238 4.832 5.865 166 HG23 THR 24 HG23 THR 24 21.916 6.537 5.548 167 H ARG 25 HN ARG 25 19.895 8.445 9.490 168 HA ARG 25 HA ARG 25 18.673 6.681 11.359 169 HB2 ARG 25 HB2 ARG 25 18.629 8.647 12.836 170 HB3 ARG 25 HB1 ARG 25 20.205 8.434 12.087 171 HG2 ARG 25 HG2 ARG 25 18.601 10.137 10.442 172 HG3 ARG 25 HG1 ARG 25 18.581 10.732 12.103 173 HD2 ARG 25 HD2 ARG 25 21.086 10.040 10.572 174 HD3 ARG 25 HD1 ARG 25 20.417 11.667 10.699 175 HE ARG 25 HE ARG 25 20.658 10.894 13.285 176 HH11 ARG 25 HH11 ARG 25 22.912 10.970 10.591 177 HH12 ARG 25 HH12 ARG 25 24.294 11.247 11.606 178 HH21 ARG 25 HH21 ARG 25 22.459 11.263 14.593 179 HH22 ARG 25 HH22 ARG 25 24.037 11.415 13.881 180 H LEU 26 HN LEU 26 17.411 8.573 8.839 181 HA LEU 26 HA LEU 26 14.705 8.185 9.827 182 HB2 LEU 26 HB2 LEU 26 15.545 10.406 10.696 183 HB3 LEU 26 HB1 LEU 26 15.622 10.942 9.030 184 HG LEU 26 HG LEU 26 13.189 10.580 8.810 185 HD11 LEU 26 HD11 LEU 26 11.854 10.201 10.836 186 HD12 LEU 26 HD12 LEU 26 13.337 9.952 11.757 187 HD13 LEU 26 HD13 LEU 26 12.902 8.830 10.467 188 HD21 LEU 26 HD21 LEU 26 13.975 12.349 11.124 189 HD22 LEU 26 HD22 LEU 26 12.498 12.480 10.171 190 HD23 LEU 26 HD23 LEU 26 14.063 12.783 9.416 191 H THR 27 HN THR 27 16.174 7.060 7.659 192 HA THR 27 HA THR 27 15.232 8.298 5.229 193 HB THR 27 HB THR 27 16.231 5.472 5.400 194 HG1 THR 27 HG1 THR 27 18.261 6.134 5.716 195 HG21 THR 27 HG21 THR 27 16.617 7.680 3.380 196 HG22 THR 27 HG22 THR 27 15.513 6.314 3.226 197 HG23 THR 27 HG23 THR 27 17.255 6.042 3.246 198 HA PRO 28 HA PRO 28 11.278 6.179 5.278 199 HB2 PRO 28 HB2 PRO 28 11.049 6.798 2.440 200 HB3 PRO 28 HB1 PRO 28 10.126 7.444 3.797 201 HG2 PRO 28 HG2 PRO 28 11.904 8.929 2.376 202 HG3 PRO 28 HG1 PRO 28 11.544 9.222 4.087 203 HD2 PRO 28 HD2 PRO 28 13.880 7.815 2.852 204 HD3 PRO 28 HD1 PRO 28 13.836 8.934 4.233 205 H TYR 29 HN TYR 29 12.579 4.139 5.469 206 HA TYR 29 HA TYR 29 13.197 2.666 3.083 207 HB2 TYR 29 HB2 TYR 29 12.915 1.661 5.925 208 HB3 TYR 29 HB1 TYR 29 13.668 0.797 4.592 209 HD1 TYR 29 HD1 TYR 29 15.729 1.970 3.500 210 HD2 TYR 29 HD2 TYR 29 14.211 2.922 7.356 211 HE1 TYR 29 HE1 TYR 29 17.906 2.937 4.113 212 HE2 TYR 29 HE2 TYR 29 16.382 3.894 7.980 213 HH TYR 29 HH TYR 29 18.703 3.792 7.339 214 H ALA 30 HN ALA 30 11.828 1.527 1.874 215 HA ALA 30 HA ALA 30 9.227 0.775 3.033 216 HB1 ALA 30 HB1 ALA 30 10.058 0.952 0.139 217 HB2 ALA 30 HB2 ALA 30 9.108 2.151 1.018 218 HB3 ALA 30 HB3 ALA 30 8.448 0.540 0.731 219 H GLN 31 HN GLN 31 12.107 -0.458 1.464 220 HA GLN 31 HA GLN 31 11.054 -3.170 1.420 221 HB2 GLN 31 HB2 GLN 31 13.271 -3.740 0.418 222 HB3 GLN 31 HB1 GLN 31 12.350 -2.554 -0.494 223 HG2 GLN 31 HG2 GLN 31 13.721 -0.769 0.545 224 HG3 GLN 31 HG1 GLN 31 14.701 -2.021 1.309 225 HE21 GLN 31 HE21 GLN 31 16.067 -3.282 0.030 226 HE22 GLN 31 HE22 GLN 31 16.501 -2.819 -1.584 227 H ALA 32 HN ALA 32 11.146 -2.136 3.954 228 HA ALA 32 HA ALA 32 13.141 -3.901 5.193 229 HB1 ALA 32 HB1 ALA 32 13.510 -2.273 6.979 230 HB2 ALA 32 HB2 ALA 32 12.438 -1.131 6.167 231 HB3 ALA 32 HB3 ALA 32 13.959 -1.604 5.409 232 H GLY 33 HN GLY 33 10.217 -3.999 4.525 233 HA2 GLY 33 HA2 GLY 33 8.980 -5.589 6.084 234 HA3 GLY 33 HA1 GLY 33 9.110 -4.275 7.242 235 H GLU 34 HN GLU 34 6.671 -5.437 6.350 236 HA GLU 34 HA GLU 34 5.558 -3.389 4.584 237 HB2 GLU 34 HB2 GLU 34 3.579 -4.838 4.408 238 HB3 GLU 34 HB1 GLU 34 5.044 -5.682 3.947 239 HG2 GLU 34 HG2 GLU 34 3.608 -5.971 6.580 240 HG3 GLU 34 HG1 GLU 34 3.516 -7.095 5.228 241 H ASP 35 HN ASP 35 5.886 -1.842 6.335 242 HA ASP 35 HA ASP 35 4.511 -2.005 8.794 243 HB2 ASP 35 HB2 ASP 35 6.437 -0.484 8.331 244 HB3 ASP 35 HB1 ASP 35 5.374 0.501 7.331 245 H ASN 36 HN ASN 36 2.561 -1.189 9.452 246 HA ASN 36 HA ASN 36 0.590 -1.016 7.329 247 HB2 ASN 36 HB2 ASN 36 0.365 -1.302 10.325 248 HB3 ASN 36 HB1 ASN 36 -1.038 -1.070 9.284 249 HD21 ASN 36 HD21 ASN 36 -0.127 -3.327 10.995 250 HD22 ASN 36 HD22 ASN 36 -0.129 -4.709 9.948 251 H TRP 37 HN TRP 37 0.519 0.959 6.444 252 HA TRP 37 HA TRP 37 0.361 3.313 8.191 253 HB2 TRP 37 HB2 TRP 37 0.235 3.484 5.204 254 HB3 TRP 37 HB1 TRP 37 0.919 4.626 6.351 255 HD1 TRP 37 HD1 TRP 37 3.266 3.504 7.639 256 HE1 TRP 37 HE1 TRP 37 5.235 2.375 6.423 257 HE3 TRP 37 HE3 TRP 37 0.928 2.311 3.257 258 HZ2 TRP 37 HZ2 TRP 37 5.728 1.143 3.921 259 HZ3 TRP 37 HZ3 TRP 37 2.214 1.169 1.502 260 HH2 TRP 37 HH2 TRP 37 4.561 0.599 1.824 261 H ARG 38 HN ARG 38 -1.796 1.244 7.746 262 HA ARG 38 HA ARG 38 -3.611 2.288 5.835 263 HB2 ARG 38 HB2 ARG 38 -5.188 0.574 6.693 264 HB3 ARG 38 HB1 ARG 38 -3.633 -0.059 6.188 265 HG2 ARG 38 HG2 ARG 38 -4.011 -1.233 8.121 266 HG3 ARG 38 HG1 ARG 38 -3.044 0.115 8.719 267 HD2 ARG 38 HD2 ARG 38 -4.948 1.216 9.592 268 HD3 ARG 38 HD1 ARG 38 -6.051 0.153 8.720 269 HE ARG 38 HE ARG 38 -4.513 -1.436 10.427 270 HH11 ARG 38 HH11 ARG 38 -6.842 1.160 10.703 271 HH12 ARG 38 HH12 ARG 38 -7.575 0.531 12.147 272 HH21 ARG 38 HH21 ARG 38 -5.468 -2.268 12.331 273 HH22 ARG 38 HH22 ARG 38 -6.779 -1.413 13.077 274 H SER 39 HN SER 39 -3.300 2.690 9.309 275 HA SER 39 HA SER 39 -5.825 3.946 9.658 276 HB2 SER 39 HB2 SER 39 -3.292 4.287 11.285 277 HB3 SER 39 HB1 SER 39 -4.926 4.716 11.800 278 HG SER 39 HG SER 39 -4.175 2.636 12.566 279 H ARG 40 HN ARG 40 -2.660 5.047 8.640 280 HA ARG 40 HA ARG 40 -3.287 7.826 8.739 281 HB2 ARG 40 HB2 ARG 40 -1.136 6.379 7.170 282 HB3 ARG 40 HB1 ARG 40 -1.192 8.068 7.589 283 HG2 ARG 40 HG2 ARG 40 -1.012 5.879 9.615 284 HG3 ARG 40 HG1 ARG 40 0.373 6.770 8.979 285 HD2 ARG 40 HD2 ARG 40 -0.604 8.858 9.818 286 HD3 ARG 40 HD1 ARG 40 -1.970 7.955 10.467 287 HE ARG 40 HE ARG 40 -0.173 6.741 11.813 288 HH11 ARG 40 HH11 ARG 40 0.104 10.097 10.828 289 HH12 ARG 40 HH12 ARG 40 1.089 10.543 12.187 290 HH21 ARG 40 HH21 ARG 40 1.081 7.339 13.618 291 HH22 ARG 40 HH22 ARG 40 1.607 8.990 13.784 292 H ILE 41 HN ILE 41 -3.091 5.327 6.249 293 HA ILE 41 HA ILE 41 -3.794 6.851 4.012 294 HB ILE 41 HB ILE 41 -4.339 3.932 4.635 295 HG12 ILE 41 HG12 ILE 41 -2.218 5.236 2.919 296 HG13 ILE 41 HG11 ILE 41 -1.959 4.633 4.552 297 HG21 ILE 41 HG21 ILE 41 -5.897 4.687 2.925 298 HG22 ILE 41 HG22 ILE 41 -4.675 3.624 2.224 299 HG23 ILE 41 HG23 ILE 41 -4.562 5.369 1.990 300 HD11 ILE 41 HD11 ILE 41 -2.481 2.375 3.796 301 HD12 ILE 41 HD12 ILE 41 -1.138 3.070 2.889 302 HD13 ILE 41 HD13 ILE 41 -2.744 2.981 2.162 303 H SER 42 HN SER 42 -5.785 5.090 6.364 304 HA SER 42 HA SER 42 -8.298 5.485 5.244 305 HB2 SER 42 HB2 SER 42 -7.866 3.957 7.118 306 HB3 SER 42 HB1 SER 42 -7.535 5.331 8.171 307 HG SER 42 HG SER 42 -9.596 4.985 8.596 308 H GLY 43 HN GLY 43 -6.399 7.597 7.371 309 HA2 GLY 43 HA2 GLY 43 -8.389 9.572 7.735 310 HA3 GLY 43 HA1 GLY 43 -6.658 9.822 7.899 311 H ARG 44 HN ARG 44 -5.853 9.191 5.300 312 HA ARG 44 HA ARG 44 -6.392 11.620 3.950 313 HB2 ARG 44 HB2 ARG 44 -4.763 9.193 3.502 314 HB3 ARG 44 HB1 ARG 44 -5.208 10.107 2.085 315 HG2 ARG 44 HG2 ARG 44 -3.163 11.005 2.627 316 HG3 ARG 44 HG1 ARG 44 -4.278 12.139 3.383 317 HD2 ARG 44 HD2 ARG 44 -3.079 9.814 4.863 318 HD3 ARG 44 HD1 ARG 44 -2.279 11.382 4.760 319 HE ARG 44 HE ARG 44 -4.992 11.154 5.879 320 HH11 ARG 44 HH11 ARG 44 -1.641 12.134 6.145 321 HH12 ARG 44 HH12 ARG 44 -1.843 12.843 7.725 322 HH21 ARG 44 HH21 ARG 44 -5.255 12.106 7.971 323 HH22 ARG 44 HH22 ARG 44 -3.877 12.829 8.743 324 H LEU 45 HN LEU 45 -7.574 8.327 3.682 325 HA LEU 45 HA LEU 45 -8.913 8.524 1.216 326 HB2 LEU 45 HB2 LEU 45 -8.424 6.527 2.899 327 HB3 LEU 45 HB1 LEU 45 -10.035 6.908 3.465 328 HG LEU 45 HG LEU 45 -9.546 6.365 0.557 329 HD11 LEU 45 HD11 LEU 45 -10.040 4.006 0.965 330 HD12 LEU 45 HD12 LEU 45 -10.049 4.306 2.703 331 HD13 LEU 45 HD13 LEU 45 -8.553 4.497 1.784 332 HD21 LEU 45 HD21 LEU 45 -11.917 6.040 2.392 333 HD22 LEU 45 HD22 LEU 45 -11.883 5.541 0.699 334 HD23 LEU 45 HD23 LEU 45 -11.718 7.249 1.123 335 H ASN 46 HN ASN 46 -9.713 9.556 4.413 336 HA ASN 46 HA ASN 46 -12.491 10.060 4.011 337 HB2 ASN 46 HB2 ASN 46 -11.580 9.669 6.263 338 HB3 ASN 46 HB1 ASN 46 -10.595 11.121 6.127 339 HD21 ASN 46 HD21 ASN 46 -11.544 13.125 6.382 340 HD22 ASN 46 HD22 ASN 46 -13.167 13.323 6.950 341 H ARG 47 HN ARG 47 -9.522 11.886 3.805 342 HA ARG 47 HA ARG 47 -10.466 14.431 3.315 343 HB2 ARG 47 HB2 ARG 47 -8.250 14.671 3.216 344 HB3 ARG 47 HB1 ARG 47 -8.038 12.947 3.013 345 HG2 ARG 47 HG2 ARG 47 -8.265 13.160 0.599 346 HG3 ARG 47 HG1 ARG 47 -8.526 14.908 0.781 347 HD2 ARG 47 HD2 ARG 47 -6.300 15.122 1.807 348 HD3 ARG 47 HD1 ARG 47 -6.039 13.394 1.575 349 HE ARG 47 HE ARG 47 -6.655 14.468 -0.915 350 HH11 ARG 47 HH11 ARG 47 -4.160 14.824 1.521 351 HH12 ARG 47 HH12 ARG 47 -2.918 15.240 0.372 352 HH21 ARG 47 HH21 ARG 47 -5.003 14.960 -2.437 353 HH22 ARG 47 HH22 ARG 47 -3.396 15.282 -1.871 354 H PHE 48 HN PHE 48 -10.497 11.591 1.259 355 HA PHE 48 HA PHE 48 -11.373 13.208 -0.980 356 HB2 PHE 48 HB2 PHE 48 -10.800 10.258 -0.798 357 HB3 PHE 48 HB1 PHE 48 -11.346 11.065 -2.260 358 HD1 PHE 48 HD1 PHE 48 -9.871 12.746 -3.351 359 HD2 PHE 48 HD2 PHE 48 -8.534 10.289 -0.146 360 HE1 PHE 48 HE1 PHE 48 -7.537 13.216 -3.970 361 HE2 PHE 48 HE2 PHE 48 -6.198 10.757 -0.755 362 HZ PHE 48 HZ PHE 48 -5.696 12.222 -2.670 363 H LYS 49 HN LYS 49 -12.464 10.290 0.689 364 HA LYS 49 HA LYS 49 -15.161 11.055 1.000 365 HB2 LYS 49 HB2 LYS 49 -14.451 9.637 -1.518 366 HB3 LYS 49 HB1 LYS 49 -15.845 9.022 -0.646 367 HG2 LYS 49 HG2 LYS 49 -15.496 11.874 -1.549 368 HG3 LYS 49 HG1 LYS 49 -16.441 10.647 -2.395 369 HD2 LYS 49 HD2 LYS 49 -17.929 10.433 -0.504 370 HD3 LYS 49 HD1 LYS 49 -16.934 11.538 0.443 371 HE2 LYS 49 HE2 LYS 49 -17.434 13.335 -1.155 372 HE3 LYS 49 HE1 LYS 49 -18.453 12.225 -2.069 373 HZ1 LYS 49 HZ1 LYS 49 -20.009 12.124 -0.353 374 HZ2 LYS 49 HZ2 LYS 49 -19.579 13.766 -0.404 375 HZ3 LYS 49 HZ3 LYS 49 -18.937 12.757 0.795 376 H ARG 50 HN ARG 50 -15.161 10.093 3.002 377 HA ARG 50 HA ARG 50 -14.764 7.180 2.960 378 HB2 ARG 50 HB2 ARG 50 -12.903 8.501 4.118 379 HB3 ARG 50 HB1 ARG 50 -14.093 8.866 5.362 380 HG2 ARG 50 HG2 ARG 50 -14.402 6.470 5.757 381 HG3 ARG 50 HG1 ARG 50 -13.187 6.119 4.527 382 HD2 ARG 50 HD2 ARG 50 -12.089 5.983 6.615 383 HD3 ARG 50 HD1 ARG 50 -11.584 7.503 5.880 384 HE ARG 50 HE ARG 50 -13.682 8.244 7.415 385 HH11 ARG 50 HH11 ARG 50 -10.761 6.429 8.051 386 HH12 ARG 50 HH12 ARG 50 -10.733 6.820 9.742 387 HH21 ARG 50 HH21 ARG 50 -13.622 8.793 9.655 388 HH22 ARG 50 HH22 ARG 50 -12.337 8.160 10.644 389 H TYR 51 HN TYR 51 -16.779 6.486 3.008 390 HA TYR 51 HA TYR 51 -18.811 7.696 4.649 391 HB2 TYR 51 HB2 TYR 51 -18.954 6.346 2.345 392 HB3 TYR 51 HB1 TYR 51 -19.138 4.981 3.448 393 HD1 TYR 51 HD2 TYR 51 -20.545 8.323 2.629 394 HD2 TYR 51 HD1 TYR 51 -21.239 4.518 4.389 395 HE1 TYR 51 HE2 TYR 51 -22.922 8.882 2.878 396 HE2 TYR 51 HE1 TYR 51 -23.622 5.066 4.644 397 HH TYR 51 HH TYR 51 -25.053 7.780 3.124 398 HA PRO 52 HA PRO 52 -17.949 5.575 8.466 399 HB2 PRO 52 HB2 PRO 52 -20.653 5.101 9.107 400 HB3 PRO 52 HB1 PRO 52 -19.681 6.487 9.604 401 HG2 PRO 52 HG2 PRO 52 -21.627 6.241 7.365 402 HG3 PRO 52 HG1 PRO 52 -21.251 7.643 8.384 403 HD2 PRO 52 HD2 PRO 52 -20.372 7.483 5.865 404 HD3 PRO 52 HD1 PRO 52 -19.364 8.191 7.148 405 H LYS 53 HN LYS 53 -17.532 3.500 8.948 406 HA LYS 53 HA LYS 53 -17.892 1.595 6.891 407 HB2 LYS 53 HB2 LYS 53 -16.848 1.306 9.706 408 HB3 LYS 53 HB1 LYS 53 -16.837 -0.002 8.534 409 HG2 LYS 53 HG2 LYS 53 -15.418 2.639 8.223 410 HG3 LYS 53 HG1 LYS 53 -14.668 1.119 8.705 411 HD2 LYS 53 HD2 LYS 53 -14.191 1.136 6.457 412 HD3 LYS 53 HD1 LYS 53 -15.720 0.257 6.450 413 HE2 LYS 53 HE2 LYS 53 -15.792 1.913 4.706 414 HE3 LYS 53 HE1 LYS 53 -16.884 2.411 6.000 415 HZ1 LYS 53 HZ1 LYS 53 -15.597 4.269 5.241 416 HZ2 LYS 53 HZ2 LYS 53 -14.142 3.449 5.532 417 HZ3 LYS 53 HZ3 LYS 53 -15.143 3.891 6.827 418 H ASP 54 HN ASP 54 -19.800 2.284 9.704 419 HA ASP 54 HA ASP 54 -20.964 -0.225 10.126 420 HB2 ASP 54 HB2 ASP 54 -21.268 1.697 11.651 421 HB3 ASP 54 HB1 ASP 54 -22.305 2.467 10.453 422 H ALA 55 HN ALA 55 -21.782 2.317 7.823 423 HA ALA 55 HA ALA 55 -24.169 1.125 6.869 424 HB1 ALA 55 HB1 ALA 55 -23.663 3.483 6.508 425 HB2 ALA 55 HB2 ALA 55 -23.963 2.654 4.980 426 HB3 ALA 55 HB3 ALA 55 -22.311 3.039 5.466 427 H LEU 56 HN LEU 56 -20.803 0.696 6.129 428 HA LEU 56 HA LEU 56 -21.239 -0.843 3.733 429 HB2 LEU 56 HB2 LEU 56 -18.801 -0.469 5.497 430 HB3 LEU 56 HB1 LEU 56 -18.793 -1.427 4.035 431 HG LEU 56 HG LEU 56 -17.780 0.703 3.594 432 HD11 LEU 56 HD11 LEU 56 -20.527 0.657 2.388 433 HD12 LEU 56 HD12 LEU 56 -19.138 -0.271 1.821 434 HD13 LEU 56 HD13 LEU 56 -19.108 1.492 1.751 435 HD21 LEU 56 HD21 LEU 56 -18.992 2.813 3.807 436 HD22 LEU 56 HD22 LEU 56 -18.776 2.020 5.366 437 HD23 LEU 56 HD23 LEU 56 -20.339 1.957 4.556 438 H ARG 57 HN ARG 57 -20.515 -1.536 7.146 439 HA ARG 57 HA ARG 57 -20.272 -4.337 6.902 440 HB2 ARG 57 HB2 ARG 57 -21.273 -2.747 9.273 441 HB3 ARG 57 HB1 ARG 57 -20.736 -4.417 9.320 442 HG2 ARG 57 HG2 ARG 57 -18.488 -3.694 8.654 443 HG3 ARG 57 HG1 ARG 57 -19.043 -2.019 8.660 444 HD2 ARG 57 HD2 ARG 57 -18.955 -3.900 11.019 445 HD3 ARG 57 HD1 ARG 57 -17.897 -2.520 10.737 446 HE ARG 57 HE ARG 57 -20.743 -1.950 10.905 447 HH11 ARG 57 HH11 ARG 57 -17.655 -2.047 12.557 448 HH12 ARG 57 HH12 ARG 57 -18.159 -0.960 13.812 449 HH21 ARG 57 HH21 ARG 57 -21.405 -0.517 12.556 450 HH22 ARG 57 HH22 ARG 57 -20.273 -0.082 13.814 451 H LEU 58 HN LEU 58 -22.979 -2.246 6.845 452 HA LEU 58 HA LEU 58 -24.858 -4.457 7.246 453 HB2 LEU 58 HB2 LEU 58 -25.099 -2.335 8.546 454 HB3 LEU 58 HB1 LEU 58 -25.399 -1.495 7.038 455 HG LEU 58 HG LEU 58 -27.417 -2.916 6.704 456 HD11 LEU 58 HD11 LEU 58 -28.294 -4.174 8.608 457 HD12 LEU 58 HD12 LEU 58 -26.820 -3.829 9.514 458 HD13 LEU 58 HD13 LEU 58 -26.749 -4.828 8.061 459 HD21 LEU 58 HD21 LEU 58 -27.349 -1.360 9.282 460 HD22 LEU 58 HD22 LEU 58 -28.785 -1.743 8.330 461 HD23 LEU 58 HD23 LEU 58 -27.548 -0.669 7.674 462 H LYS 59 HN LYS 59 -23.182 -3.298 4.747 463 HA LYS 59 HA LYS 59 -25.263 -3.955 2.839 464 HB2 LYS 59 HB2 LYS 59 -25.654 -1.599 3.076 465 HB3 LYS 59 HB1 LYS 59 -23.942 -1.242 2.895 466 HG2 LYS 59 HG2 LYS 59 -23.994 -1.931 0.592 467 HG3 LYS 59 HG1 LYS 59 -25.661 -2.458 0.758 468 HD2 LYS 59 HD2 LYS 59 -25.631 -0.316 -0.336 469 HD3 LYS 59 HD1 LYS 59 -26.297 -0.114 1.287 470 HE2 LYS 59 HE2 LYS 59 -24.164 0.711 2.086 471 HE3 LYS 59 HE1 LYS 59 -23.432 0.424 0.509 472 HZ1 LYS 59 HZ1 LYS 59 -25.077 2.030 -0.408 473 HZ2 LYS 59 HZ2 LYS 59 -23.949 2.712 0.655 474 HZ3 LYS 59 HZ3 LYS 59 -25.532 2.408 1.186 475 H ARG 60 HN ARG 60 -22.130 -2.253 2.542 476 HA ARG 60 HA ARG 60 -21.426 -4.227 0.500 477 HB2 ARG 60 HB2 ARG 60 -20.313 -1.468 1.039 478 HB3 ARG 60 HB1 ARG 60 -19.692 -2.565 -0.191 479 HG2 ARG 60 HG2 ARG 60 -22.454 -1.378 -0.064 480 HG3 ARG 60 HG1 ARG 60 -21.173 -0.972 -1.209 481 HD2 ARG 60 HD2 ARG 60 -21.287 -3.121 -2.224 482 HD3 ARG 60 HD1 ARG 60 -22.322 -3.742 -0.940 483 HE ARG 60 HE ARG 60 -23.414 -1.519 -2.461 484 HH11 ARG 60 HH11 ARG 60 -23.188 -5.001 -2.099 485 HH12 ARG 60 HH12 ARG 60 -24.660 -5.321 -2.961 486 HH21 ARG 60 HH21 ARG 60 -25.347 -1.932 -3.594 487 HH22 ARG 60 HH22 ARG 60 -25.881 -3.571 -3.827 488 H GLN 61 HN GLN 61 -20.863 -5.813 1.948 489 HA GLN 61 HA GLN 61 -18.403 -5.376 3.473 490 HB2 GLN 61 HB2 GLN 61 -19.061 -7.693 4.411 491 HB3 GLN 61 HB1 GLN 61 -19.981 -6.287 4.928 492 HG2 GLN 61 HG2 GLN 61 -21.753 -6.834 3.375 493 HG3 GLN 61 HG1 GLN 61 -20.817 -8.193 2.752 494 HE21 GLN 61 HE21 GLN 61 -23.463 -8.063 4.053 495 HE22 GLN 61 HE22 GLN 61 -23.367 -9.145 5.396 496 H GLY 62 HN GLY 62 -16.548 -6.317 2.836 497 HA2 GLY 62 HA2 GLY 62 -16.308 -8.606 1.250 498 HA3 GLY 62 HA1 GLY 62 -16.361 -7.212 0.188 499 H VAL 63 HN VAL 63 -14.292 -9.275 1.389 500 HA VAL 63 HA VAL 63 -12.174 -7.314 1.922 501 HB VAL 63 HB VAL 63 -12.187 -10.302 2.392 502 HG11 VAL 63 HG11 VAL 63 -9.955 -9.466 1.841 503 HG12 VAL 63 HG12 VAL 63 -10.057 -9.953 3.532 504 HG13 VAL 63 HG13 VAL 63 -10.099 -8.242 3.104 505 HG21 VAL 63 HG21 VAL 63 -12.204 -9.722 4.764 506 HG22 VAL 63 HG22 VAL 63 -13.631 -9.088 3.942 507 HG23 VAL 63 HG23 VAL 63 -12.295 -8.010 4.348 508 H GLY 64 HN GLY 64 -10.705 -6.925 0.425 509 HA2 GLY 64 HA2 GLY 64 -9.994 -8.968 -1.519 510 HA3 GLY 64 HA1 GLY 64 -10.725 -7.504 -2.167 511 H GLN 65 HN GLN 65 -8.200 -8.196 -2.935 512 HA GLN 65 HA GLN 65 -6.452 -6.456 -1.350 513 HB2 GLN 65 HB2 GLN 65 -5.859 -8.511 -3.482 514 HB3 GLN 65 HB1 GLN 65 -4.642 -7.402 -2.862 515 HG2 GLN 65 HG2 GLN 65 -4.916 -8.314 -0.630 516 HG3 GLN 65 HG1 GLN 65 -6.180 -9.395 -1.213 517 HE21 GLN 65 HE21 GLN 65 -2.765 -8.745 -1.141 518 HE22 GLN 65 HE22 GLN 65 -2.266 -10.274 -1.774 519 H VAL 66 HN VAL 66 -5.625 -4.624 -2.165 520 HA VAL 66 HA VAL 66 -6.470 -3.825 -4.867 521 HB VAL 66 HB VAL 66 -6.794 -2.362 -2.246 522 HG11 VAL 66 HG11 VAL 66 -7.184 -1.124 -4.960 523 HG12 VAL 66 HG12 VAL 66 -5.797 -0.821 -3.911 524 HG13 VAL 66 HG13 VAL 66 -7.420 -0.369 -3.378 525 HG21 VAL 66 HG21 VAL 66 -8.747 -2.930 -4.468 526 HG22 VAL 66 HG22 VAL 66 -9.104 -2.182 -2.909 527 HG23 VAL 66 HG23 VAL 66 -8.594 -3.869 -2.983 528 H ARG 67 HN ARG 67 -4.661 -3.419 -6.024 529 HA ARG 67 HA ARG 67 -2.368 -2.310 -4.552 530 HB2 ARG 67 HB2 ARG 67 -0.835 -3.466 -5.953 531 HB3 ARG 67 HB1 ARG 67 -2.015 -4.650 -5.409 532 HG2 ARG 67 HG2 ARG 67 -3.081 -4.661 -7.548 533 HG3 ARG 67 HG1 ARG 67 -2.071 -3.323 -8.111 534 HD2 ARG 67 HD2 ARG 67 -0.100 -4.662 -8.000 535 HD3 ARG 67 HD1 ARG 67 -0.952 -5.955 -7.163 536 HE ARG 67 HE ARG 67 -2.233 -6.225 -9.301 537 HH11 ARG 67 HH11 ARG 67 0.984 -4.845 -9.285 538 HH12 ARG 67 HH12 ARG 67 1.363 -5.387 -10.886 539 HH21 ARG 67 HH21 ARG 67 -1.715 -6.980 -11.392 540 HH22 ARG 67 HH22 ARG 67 -0.167 -6.604 -12.084 541 H PHE 68 HN PHE 68 -1.245 -0.617 -5.451 542 HA PHE 68 HA PHE 68 -2.214 0.585 -7.883 543 HB2 PHE 68 HB2 PHE 68 -2.759 2.732 -6.489 544 HB3 PHE 68 HB1 PHE 68 -3.966 1.469 -6.666 545 HD1 PHE 68 HD2 PHE 68 -1.060 2.042 -4.351 546 HD2 PHE 68 HD1 PHE 68 -5.213 1.201 -4.801 547 HE1 PHE 68 HE2 PHE 68 -1.303 1.891 -1.904 548 HE2 PHE 68 HE1 PHE 68 -5.457 1.058 -2.361 549 HZ PHE 68 HZ PHE 68 -3.505 1.405 -0.912 550 H THR 69 HN THR 69 -1.126 2.595 -8.388 551 HA THR 69 HA THR 69 1.504 2.864 -7.075 552 HB THR 69 HB THR 69 0.775 4.144 -9.702 553 HG1 THR 69 HG1 THR 69 1.464 1.441 -9.189 554 HG21 THR 69 HG21 THR 69 2.843 4.832 -8.596 555 HG22 THR 69 HG22 THR 69 3.201 3.929 -10.069 556 HG23 THR 69 HG23 THR 69 3.363 3.153 -8.492 557 H LEU 70 HN LEU 70 1.759 4.527 -5.801 558 HA LEU 70 HA LEU 70 -0.309 6.607 -5.822 559 HB2 LEU 70 HB2 LEU 70 1.519 5.676 -3.614 560 HB3 LEU 70 HB1 LEU 70 0.297 6.929 -3.462 561 HG LEU 70 HG LEU 70 -0.311 4.067 -4.200 562 HD11 LEU 70 HD11 LEU 70 -1.156 3.854 -1.901 563 HD12 LEU 70 HD12 LEU 70 -0.505 5.451 -1.528 564 HD13 LEU 70 HD13 LEU 70 0.585 4.129 -1.954 565 HD21 LEU 70 HD21 LEU 70 -1.945 5.700 -4.995 566 HD22 LEU 70 HD22 LEU 70 -2.094 6.350 -3.361 567 HD23 LEU 70 HD23 LEU 70 -2.612 4.700 -3.703 568 H ASP 71 HN ASP 71 0.162 8.688 -5.962 569 HA ASP 71 HA ASP 71 2.777 9.542 -6.752 570 HB2 ASP 71 HB2 ASP 71 0.627 10.573 -7.571 571 HB3 ASP 71 HB1 ASP 71 0.387 11.228 -5.953 572 H ARG 72 HN ARG 72 4.076 11.082 -5.611 573 HA ARG 72 HA ARG 72 4.494 10.464 -2.905 574 HB2 ARG 72 HB2 ARG 72 6.354 11.196 -4.134 575 HB3 ARG 72 HB1 ARG 72 5.524 12.634 -4.712 576 HG2 ARG 72 HG2 ARG 72 5.836 13.764 -2.714 577 HG3 ARG 72 HG1 ARG 72 6.112 12.279 -1.802 578 HD2 ARG 72 HD2 ARG 72 8.151 13.726 -2.296 579 HD3 ARG 72 HD1 ARG 72 8.274 12.009 -2.672 580 HE ARG 72 HE ARG 72 7.760 12.694 -5.032 581 HH11 ARG 72 HH11 ARG 72 9.274 14.903 -2.776 582 HH12 ARG 72 HH12 ARG 72 10.051 15.836 -4.024 583 HH21 ARG 72 HH21 ARG 72 8.833 13.847 -6.661 584 HH22 ARG 72 HH22 ARG 72 9.830 15.216 -6.241 585 H GLN 73 HN GLN 73 2.469 12.845 -4.419 586 HA GLN 73 HA GLN 73 2.058 14.373 -1.999 587 HB2 GLN 73 HB2 GLN 73 0.429 14.334 -4.547 588 HB3 GLN 73 HB1 GLN 73 0.342 15.546 -3.274 589 HG2 GLN 73 HG2 GLN 73 2.490 16.376 -3.788 590 HG3 GLN 73 HG1 GLN 73 2.851 14.998 -4.827 591 HE21 GLN 73 HE21 GLN 73 1.840 14.836 -6.839 592 HE22 GLN 73 HE22 GLN 73 1.199 16.240 -7.630 593 H GLY 74 HN GLY 74 1.081 11.390 -3.060 594 HA2 GLY 74 HA2 GLY 74 -0.302 9.899 -1.915 595 HA3 GLY 74 HA1 GLY 74 -1.016 11.254 -1.061 596 H HIS 75 HN HIS 75 -0.666 10.985 -4.532 597 HA HIS 75 HA HIS 75 -3.595 11.082 -4.737 598 HB2 HIS 75 HB2 HIS 75 -2.350 13.051 -5.614 599 HB3 HIS 75 HB1 HIS 75 -1.532 11.994 -6.756 600 HD1 HIS 75 HD1 HIS 75 -4.961 13.376 -5.974 601 HD2 HIS 75 HD2 HIS 75 -2.925 11.489 -9.074 602 HE1 HIS 75 HE1 HIS 75 -6.518 13.440 -7.952 603 HE2 HIS 75 HE2 HIS 75 -5.228 12.392 -9.846 604 H VAL 76 HN VAL 76 -4.555 9.339 -5.461 605 HA VAL 76 HA VAL 76 -3.458 7.014 -6.399 606 HB VAL 76 HB VAL 76 -5.769 7.146 -5.699 607 HG11 VAL 76 HG11 VAL 76 -6.267 8.738 -8.206 608 HG12 VAL 76 HG12 VAL 76 -6.325 9.349 -6.552 609 HG13 VAL 76 HG13 VAL 76 -7.502 8.151 -7.093 610 HG21 VAL 76 HG21 VAL 76 -5.200 5.297 -7.143 611 HG22 VAL 76 HG22 VAL 76 -5.516 6.279 -8.573 612 HG23 VAL 76 HG23 VAL 76 -6.840 5.842 -7.492 613 H LEU 77 HN LEU 77 -2.457 6.410 -8.196 614 HA LEU 77 HA LEU 77 -2.767 8.087 -10.591 615 HB2 LEU 77 HB2 LEU 77 -0.416 6.360 -9.827 616 HB3 LEU 77 HB1 LEU 77 -0.513 7.415 -11.223 617 HG LEU 77 HG LEU 77 -0.641 8.412 -8.385 618 HD11 LEU 77 HD11 LEU 77 1.739 8.333 -10.227 619 HD12 LEU 77 HD12 LEU 77 1.486 7.262 -8.848 620 HD13 LEU 77 HD13 LEU 77 1.680 8.998 -8.592 621 HD21 LEU 77 HD21 LEU 77 -0.138 10.563 -9.401 622 HD22 LEU 77 HD22 LEU 77 -1.617 9.882 -10.081 623 HD23 LEU 77 HD23 LEU 77 -0.113 9.818 -10.999 624 H ALA 78 HN ALA 78 -2.080 4.795 -9.520 625 HA ALA 78 HA ALA 78 -3.546 3.755 -11.851 626 HB1 ALA 78 HB1 ALA 78 -1.936 1.938 -12.041 627 HB2 ALA 78 HB2 ALA 78 -1.009 2.592 -10.690 628 HB3 ALA 78 HB3 ALA 78 -1.116 3.492 -12.207 629 H VAL 79 HN VAL 79 -4.604 1.723 -11.453 630 HA VAL 79 HA VAL 79 -4.609 0.717 -8.732 631 HB VAL 79 HB VAL 79 -7.172 0.661 -8.790 632 HG11 VAL 79 HG11 VAL 79 -5.759 3.302 -8.448 633 HG12 VAL 79 HG12 VAL 79 -5.929 2.041 -7.227 634 HG13 VAL 79 HG13 VAL 79 -7.353 2.904 -7.806 635 HG21 VAL 79 HG21 VAL 79 -7.483 1.309 -11.115 636 HG22 VAL 79 HG22 VAL 79 -6.716 2.866 -10.798 637 HG23 VAL 79 HG23 VAL 79 -8.257 2.471 -10.038 638 H THR 80 HN THR 80 -4.678 -1.413 -8.745 639 HA THR 80 HA THR 80 -5.956 -2.799 -10.997 640 HB THR 80 HB THR 80 -3.269 -3.548 -9.809 641 HG1 THR 80 HG1 THR 80 -3.977 -1.860 -11.820 642 HG21 THR 80 HG21 THR 80 -3.190 -5.219 -11.597 643 HG22 THR 80 HG22 THR 80 -4.802 -4.740 -12.130 644 HG23 THR 80 HG23 THR 80 -4.582 -5.488 -10.548 645 H LEU 81 HN LEU 81 -7.395 -4.242 -10.289 646 HA LEU 81 HA LEU 81 -7.632 -4.694 -7.462 647 HB2 LEU 81 HB2 LEU 81 -9.609 -4.437 -8.934 648 HB3 LEU 81 HB1 LEU 81 -9.198 -5.960 -9.707 649 HG LEU 81 HG LEU 81 -9.381 -7.028 -7.407 650 HD11 LEU 81 HD11 LEU 81 -10.733 -5.830 -5.753 651 HD12 LEU 81 HD12 LEU 81 -10.713 -4.397 -6.780 652 HD13 LEU 81 HD13 LEU 81 -9.211 -4.999 -6.080 653 HD21 LEU 81 HD21 LEU 81 -11.818 -7.189 -7.526 654 HD22 LEU 81 HD22 LEU 81 -11.096 -7.288 -9.133 655 HD23 LEU 81 HD23 LEU 81 -11.863 -5.792 -8.602 656 H VAL 82 HN VAL 82 -6.313 -6.014 -6.517 657 HA VAL 82 HA VAL 82 -5.178 -8.318 -7.846 658 HB VAL 82 HB VAL 82 -4.662 -8.225 -5.000 659 HG11 VAL 82 HG11 VAL 82 -3.070 -8.019 -7.522 660 HG12 VAL 82 HG12 VAL 82 -3.034 -9.271 -6.276 661 HG13 VAL 82 HG13 VAL 82 -2.312 -7.685 -5.965 662 HG21 VAL 82 HG21 VAL 82 -3.493 -6.056 -4.939 663 HG22 VAL 82 HG22 VAL 82 -5.236 -5.879 -5.136 664 HG23 VAL 82 HG23 VAL 82 -4.165 -5.668 -6.524 665 H SER 83 HN SER 83 -7.308 -7.616 -5.124 666 HA SER 83 HA SER 83 -9.169 -8.632 -4.357 667 HB2 SER 83 HB2 SER 83 -9.701 -8.835 -6.749 668 HB3 SER 83 HB1 SER 83 -8.929 -10.419 -6.779 669 HG SER 83 HG SER 83 -10.794 -11.158 -6.179 670 H SER 84 HN SER 84 -10.108 -10.967 -3.866 671 HA SER 84 HA SER 84 -8.131 -12.911 -3.120 672 HB2 SER 84 HB2 SER 84 -9.474 -11.254 -0.968 673 HB3 SER 84 HB1 SER 84 -8.541 -12.723 -0.673 674 HG SER 84 HG SER 84 -7.049 -11.128 -2.173 675 H ALA 85 HN ALA 85 -11.312 -11.841 -1.850 676 HA ALA 85 HA ALA 85 -12.177 -14.618 -1.876 677 HB1 ALA 85 HB1 ALA 85 -12.548 -13.279 0.134 678 HB2 ALA 85 HB2 ALA 85 -14.064 -13.866 -0.550 679 HB3 ALA 85 HB3 ALA 85 -13.582 -12.186 -0.788 680 H GLY 86 HN GLY 86 -14.050 -11.677 -2.638 681 HA2 GLY 86 HA2 GLY 86 -14.588 -12.103 -5.297 682 HA3 GLY 86 HA1 GLY 86 -15.692 -13.168 -4.434 683 H LEU 87 HN LEU 87 -15.021 -9.953 -5.398 684 HA LEU 87 HA LEU 87 -17.398 -9.026 -3.907 685 HB2 LEU 87 HB2 LEU 87 -15.182 -7.210 -4.808 686 HB3 LEU 87 HB1 LEU 87 -16.469 -6.846 -3.697 687 HG LEU 87 HG LEU 87 -14.589 -6.970 -2.348 688 HD11 LEU 87 HD11 LEU 87 -14.823 -8.985 -0.983 689 HD12 LEU 87 HD12 LEU 87 -15.836 -9.697 -2.238 690 HD13 LEU 87 HD13 LEU 87 -16.374 -8.249 -1.386 691 HD21 LEU 87 HD21 LEU 87 -12.868 -8.664 -2.446 692 HD22 LEU 87 HD22 LEU 87 -13.055 -7.895 -4.023 693 HD23 LEU 87 HD23 LEU 87 -13.727 -9.499 -3.736 694 HA PRO 88 HA PRO 88 -18.257 -8.522 -8.418 695 HB2 PRO 88 HB2 PRO 88 -20.940 -9.465 -7.831 696 HB3 PRO 88 HB1 PRO 88 -19.713 -10.200 -8.867 697 HG2 PRO 88 HG2 PRO 88 -20.525 -11.299 -6.509 698 HG3 PRO 88 HG1 PRO 88 -18.901 -11.527 -7.185 699 HD2 PRO 88 HD2 PRO 88 -19.808 -9.650 -5.029 700 HD3 PRO 88 HD1 PRO 88 -18.343 -10.655 -5.104 701 H SER 89 HN SER 89 -21.238 -8.255 -6.538 702 HA SER 89 HA SER 89 -21.863 -5.669 -7.531 703 HB2 SER 89 HB2 SER 89 -23.034 -7.010 -5.085 704 HB3 SER 89 HB1 SER 89 -23.799 -5.802 -6.117 705 HG SER 89 HG SER 89 -24.605 -7.528 -7.030 706 H LEU 90 HN LEU 90 -19.903 -6.799 -5.014 707 HA LEU 90 HA LEU 90 -20.231 -4.612 -3.196 708 HB2 LEU 90 HB2 LEU 90 -17.946 -6.587 -3.300 709 HB3 LEU 90 HB1 LEU 90 -18.484 -5.640 -1.925 710 HG LEU 90 HG LEU 90 -20.241 -7.719 -3.206 711 HD11 LEU 90 HD11 LEU 90 -18.068 -8.691 -2.491 712 HD12 LEU 90 HD12 LEU 90 -19.468 -9.314 -1.608 713 HD13 LEU 90 HD13 LEU 90 -18.410 -8.120 -0.854 714 HD21 LEU 90 HD21 LEU 90 -21.311 -6.041 -1.759 715 HD22 LEU 90 HD22 LEU 90 -20.221 -6.496 -0.449 716 HD23 LEU 90 HD23 LEU 90 -21.385 -7.665 -1.073 717 H ASP 91 HN ASP 91 -18.110 -5.419 -5.838 718 HA ASP 91 HA ASP 91 -15.902 -3.827 -5.332 719 HB2 ASP 91 HB2 ASP 91 -15.629 -5.329 -7.078 720 HB3 ASP 91 HB1 ASP 91 -17.156 -4.896 -7.833 721 H ARG 92 HN ARG 92 -18.922 -2.936 -6.940 722 HA ARG 92 HA ARG 92 -18.083 -0.584 -8.119 723 HB2 ARG 92 HB2 ARG 92 -20.462 0.107 -8.091 724 HB3 ARG 92 HB1 ARG 92 -20.226 -1.541 -8.655 725 HG2 ARG 92 HG2 ARG 92 -20.977 -2.425 -6.553 726 HG3 ARG 92 HG1 ARG 92 -21.061 -0.809 -5.855 727 HD2 ARG 92 HD2 ARG 92 -23.270 -1.539 -6.445 728 HD3 ARG 92 HD1 ARG 92 -22.790 -0.228 -7.520 729 HE ARG 92 HE ARG 92 -22.596 -3.051 -8.350 730 HH11 ARG 92 HH11 ARG 92 -23.620 0.247 -8.909 731 HH12 ARG 92 HH12 ARG 92 -24.333 -0.107 -10.459 732 HH21 ARG 92 HH21 ARG 92 -23.551 -3.525 -10.365 733 HH22 ARG 92 HH22 ARG 92 -24.360 -2.265 -11.255 734 H GLU 93 HN GLU 93 -19.553 -0.916 -4.875 735 HA GLU 93 HA GLU 93 -19.342 1.887 -4.409 736 HB2 GLU 93 HB2 GLU 93 -20.432 -0.470 -3.016 737 HB3 GLU 93 HB1 GLU 93 -20.024 0.923 -2.041 738 HG2 GLU 93 HG2 GLU 93 -21.420 2.322 -3.551 739 HG3 GLU 93 HG1 GLU 93 -21.899 0.847 -4.389 740 H ILE 94 HN ILE 94 -17.823 -0.950 -2.859 741 HA ILE 94 HA ILE 94 -16.290 0.558 -1.063 742 HB ILE 94 HB ILE 94 -14.978 -1.455 -0.636 743 HG12 ILE 94 HG12 ILE 94 -16.527 -2.702 -2.919 744 HG13 ILE 94 HG11 ILE 94 -14.820 -2.274 -2.970 745 HG21 ILE 94 HG21 ILE 94 -17.121 -1.210 0.450 746 HG22 ILE 94 HG22 ILE 94 -16.831 -2.908 0.072 747 HG23 ILE 94 HG23 ILE 94 -17.934 -1.957 -0.924 748 HD11 ILE 94 HD11 ILE 94 -14.372 -3.877 -1.183 749 HD12 ILE 94 HD12 ILE 94 -15.115 -4.645 -2.586 750 HD13 ILE 94 HD13 ILE 94 -16.082 -4.309 -1.150 751 H GLN 95 HN GLN 95 -15.517 -0.582 -4.334 752 HA GLN 95 HA GLN 95 -12.804 0.333 -4.101 753 HB2 GLN 95 HB2 GLN 95 -14.317 -0.503 -6.556 754 HB3 GLN 95 HB1 GLN 95 -12.608 -0.290 -6.412 755 HG2 GLN 95 HG2 GLN 95 -14.144 -2.308 -4.821 756 HG3 GLN 95 HG1 GLN 95 -13.353 -2.663 -6.357 757 HE21 GLN 95 HE21 GLN 95 -12.882 -3.789 -3.738 758 HE22 GLN 95 HE22 GLN 95 -11.226 -3.478 -3.364 759 H ALA 96 HN ALA 96 -15.837 1.591 -5.371 760 HA ALA 96 HA ALA 96 -14.832 3.880 -6.614 761 HB1 ALA 96 HB1 ALA 96 -16.931 4.993 -6.001 762 HB2 ALA 96 HB2 ALA 96 -17.292 3.692 -4.865 763 HB3 ALA 96 HB3 ALA 96 -17.230 3.359 -6.596 764 H LEU 97 HN LEU 97 -15.443 3.165 -3.230 765 HA LEU 97 HA LEU 97 -14.736 5.645 -2.180 766 HB2 LEU 97 HB2 LEU 97 -16.174 4.026 -1.077 767 HB3 LEU 97 HB1 LEU 97 -14.858 2.866 -1.018 768 HG LEU 97 HG LEU 97 -13.802 5.033 0.194 769 HD11 LEU 97 HD11 LEU 97 -15.909 6.205 0.267 770 HD12 LEU 97 HD12 LEU 97 -15.462 5.706 1.902 771 HD13 LEU 97 HD13 LEU 97 -16.690 4.804 1.007 772 HD21 LEU 97 HD21 LEU 97 -15.260 2.937 1.751 773 HD22 LEU 97 HD22 LEU 97 -13.682 3.685 2.073 774 HD23 LEU 97 HD23 LEU 97 -13.862 2.525 0.754 775 H VAL 98 HN VAL 98 -12.971 2.521 -2.253 776 HA VAL 98 HA VAL 98 -10.584 3.832 -1.237 777 HB VAL 98 HB VAL 98 -11.155 0.931 -1.839 778 HG11 VAL 98 HG11 VAL 98 -8.707 2.170 -0.575 779 HG12 VAL 98 HG12 VAL 98 -8.777 1.389 -2.155 780 HG13 VAL 98 HG13 VAL 98 -9.043 0.441 -0.691 781 HG21 VAL 98 HG21 VAL 98 -11.350 0.641 0.498 782 HG22 VAL 98 HG22 VAL 98 -12.302 2.081 0.116 783 HG23 VAL 98 HG23 VAL 98 -10.696 2.243 0.828 784 H LYS 99 HN LYS 99 -11.493 2.010 -4.146 785 HA LYS 99 HA LYS 99 -8.894 2.161 -5.289 786 HB2 LYS 99 HB2 LYS 99 -10.218 0.293 -5.912 787 HB3 LYS 99 HB1 LYS 99 -11.587 1.293 -6.381 788 HG2 LYS 99 HG2 LYS 99 -10.766 1.649 -8.449 789 HG3 LYS 99 HG1 LYS 99 -9.097 1.762 -7.892 790 HD2 LYS 99 HD2 LYS 99 -9.461 -0.185 -9.354 791 HD3 LYS 99 HD1 LYS 99 -8.956 -0.656 -7.733 792 HE2 LYS 99 HE2 LYS 99 -10.706 -2.132 -8.444 793 HE3 LYS 99 HE1 LYS 99 -11.332 -1.089 -7.171 794 HZ1 LYS 99 HZ1 LYS 99 -12.919 -1.326 -8.967 795 HZ2 LYS 99 HZ2 LYS 99 -11.800 -0.730 -10.089 796 HZ3 LYS 99 HZ3 LYS 99 -12.398 0.285 -8.868 797 H ARG 100 HN ARG 100 -11.541 4.425 -5.203 798 HA ARG 100 HA ARG 100 -10.188 5.976 -7.291 799 HB2 ARG 100 HB2 ARG 100 -12.606 5.945 -7.446 800 HB3 ARG 100 HB1 ARG 100 -12.751 6.528 -5.795 801 HG2 ARG 100 HG2 ARG 100 -13.168 8.290 -7.433 802 HG3 ARG 100 HG1 ARG 100 -11.768 8.650 -6.423 803 HD2 ARG 100 HD2 ARG 100 -11.300 9.205 -8.739 804 HD3 ARG 100 HD1 ARG 100 -10.288 7.861 -8.215 805 HE ARG 100 HE ARG 100 -12.731 7.080 -9.536 806 HH11 ARG 100 HH11 ARG 100 -9.364 7.947 -9.966 807 HH12 ARG 100 HH12 ARG 100 -9.210 7.090 -11.467 808 HH21 ARG 100 HH21 ARG 100 -12.527 5.962 -11.515 809 HH22 ARG 100 HH22 ARG 100 -10.996 5.974 -12.353 810 H ALA 101 HN ALA 101 -10.800 6.006 -3.808 811 HA ALA 101 HA ALA 101 -9.126 8.406 -3.588 812 HB1 ALA 101 HB1 ALA 101 -9.899 8.650 -1.329 813 HB2 ALA 101 HB2 ALA 101 -10.704 7.070 -1.381 814 HB3 ALA 101 HB3 ALA 101 -11.297 8.404 -2.379 815 H SER 102 HN SER 102 -7.436 6.720 -4.348 816 HA SER 102 HA SER 102 -6.316 5.239 -2.103 817 HB2 SER 102 HB2 SER 102 -5.268 5.423 -4.933 818 HB3 SER 102 HB1 SER 102 -4.807 4.249 -3.704 819 HG SER 102 HG SER 102 -7.440 4.130 -3.960 820 HA PRO 103 HA PRO 103 -3.663 8.845 -1.632 821 HB2 PRO 103 HB2 PRO 103 -3.972 9.041 1.029 822 HB3 PRO 103 HB1 PRO 103 -5.230 9.548 -0.103 823 HG2 PRO 103 HG2 PRO 103 -5.195 7.256 1.721 824 HG3 PRO 103 HG1 PRO 103 -6.563 7.985 0.868 825 HD2 PRO 103 HD2 PRO 103 -4.967 5.645 0.142 826 HD3 PRO 103 HD1 PRO 103 -6.516 6.198 -0.529 827 H LEU 104 HN LEU 104 -1.814 9.327 -0.135 828 HA LEU 104 HA LEU 104 -0.379 6.981 0.870 829 HB2 LEU 104 HB2 LEU 104 0.325 7.270 -1.473 830 HB3 LEU 104 HB1 LEU 104 0.723 8.945 -1.152 831 HG LEU 104 HG LEU 104 2.421 8.005 0.554 832 HD11 LEU 104 HD11 LEU 104 3.310 5.759 -0.184 833 HD12 LEU 104 HD12 LEU 104 1.792 5.542 -1.060 834 HD13 LEU 104 HD13 LEU 104 1.776 5.729 0.696 835 HD21 LEU 104 HD21 LEU 104 3.011 9.122 -1.532 836 HD22 LEU 104 HD22 LEU 104 2.830 7.601 -2.404 837 HD23 LEU 104 HD23 LEU 104 4.100 7.777 -1.194 838 HA PRO 105 HA PRO 105 0.047 10.523 3.733 839 HB2 PRO 105 HB2 PRO 105 0.512 8.760 5.895 840 HB3 PRO 105 HB1 PRO 105 -0.962 9.654 5.539 841 HG2 PRO 105 HG2 PRO 105 -0.554 6.855 5.376 842 HG3 PRO 105 HG1 PRO 105 -1.989 7.774 4.919 843 HD2 PRO 105 HD2 PRO 105 0.025 6.557 3.202 844 HD3 PRO 105 HD1 PRO 105 -1.583 7.196 2.789 845 H THR 106 HN THR 106 1.900 7.596 4.533 846 HA THR 106 HA THR 106 4.290 9.089 5.047 847 HB THR 106 HB THR 106 5.211 6.607 5.038 848 HG1 THR 106 HG1 THR 106 3.690 5.163 4.763 849 HG21 THR 106 HG21 THR 106 4.529 6.388 7.376 850 HG22 THR 106 HG22 THR 106 3.294 7.626 7.146 851 HG23 THR 106 HG23 THR 106 5.002 8.050 7.021 852 HA PRO 107 HA PRO 107 5.355 9.020 0.681 853 HB2 PRO 107 HB2 PRO 107 7.497 10.845 1.385 854 HB3 PRO 107 HB1 PRO 107 6.027 11.167 0.462 855 HG2 PRO 107 HG2 PRO 107 6.481 12.205 2.935 856 HG3 PRO 107 HG1 PRO 107 4.858 11.853 2.312 857 HD2 PRO 107 HD2 PRO 107 6.562 10.232 4.177 858 HD3 PRO 107 HD1 PRO 107 4.824 10.596 4.268 859 HA PRO 108 HA PRO 108 8.887 6.223 1.439 860 HB2 PRO 108 HB2 PRO 108 8.203 4.344 -0.297 861 HB3 PRO 108 HB1 PRO 108 7.249 4.551 1.185 862 HG2 PRO 108 HG2 PRO 108 6.678 5.590 -1.574 863 HG3 PRO 108 HG1 PRO 108 5.593 4.705 -0.484 864 HD2 PRO 108 HD2 PRO 108 5.613 7.429 -0.703 865 HD3 PRO 108 HD1 PRO 108 5.154 6.575 0.782 866 H ALA 109 HN ALA 109 9.765 8.326 0.463 867 HA ALA 109 HA ALA 109 10.095 8.727 -2.249 868 HB1 ALA 109 HB1 ALA 109 10.651 10.399 -0.576 869 HB2 ALA 109 HB2 ALA 109 12.005 10.124 -1.671 870 HB3 ALA 109 HB3 ALA 109 12.024 9.430 -0.050 871 H ASP 110 HN ASP 110 12.043 6.793 -0.031 872 HA ASP 110 HA ASP 110 13.970 6.172 -2.039 873 HB2 ASP 110 HB2 ASP 110 13.536 5.145 0.755 874 HB3 ASP 110 HB1 ASP 110 14.813 4.529 -0.294 875 H ALA 111 HN ALA 111 10.936 5.306 -1.957 876 HA ALA 111 HA ALA 111 11.464 2.581 -2.932 877 HB1 ALA 111 HB1 ALA 111 9.925 2.647 -1.040 878 HB2 ALA 111 HB2 ALA 111 9.102 2.109 -2.505 879 HB3 ALA 111 HB3 ALA 111 8.877 3.760 -1.921 880 H TYR 112 HN TYR 112 10.567 5.756 -3.856 881 HA TYR 112 HA TYR 112 9.810 4.704 -6.468 882 HB2 TYR 112 HB2 TYR 112 8.093 6.455 -6.741 883 HB3 TYR 112 HB1 TYR 112 7.737 5.200 -5.580 884 HD1 TYR 112 HD2 TYR 112 9.730 8.324 -5.039 885 HD2 TYR 112 HD1 TYR 112 6.195 6.122 -4.224 886 HE1 TYR 112 HE2 TYR 112 9.084 9.988 -3.347 887 HE2 TYR 112 HE1 TYR 112 5.529 7.757 -2.550 888 HH TYR 112 HH TYR 112 6.501 9.436 -1.135 889 H VAL 113 HN VAL 113 12.135 6.241 -5.184 890 HA VAL 113 HA VAL 113 12.384 8.459 -6.977 891 HB VAL 113 HB VAL 113 14.919 8.137 -6.541 892 HG11 VAL 113 HG11 VAL 113 13.581 9.880 -5.491 893 HG12 VAL 113 HG12 VAL 113 14.752 9.217 -4.351 894 HG13 VAL 113 HG13 VAL 113 13.056 8.745 -4.248 895 HG21 VAL 113 HG21 VAL 113 15.540 6.842 -4.616 896 HG22 VAL 113 HG22 VAL 113 14.700 5.786 -5.751 897 HG23 VAL 113 HG23 VAL 113 13.862 6.389 -4.321 898 H ASN 114 HN ASN 114 11.836 7.818 -8.935 899 HA ASN 114 HA ASN 114 13.211 6.691 -10.913 900 HB2 ASN 114 HB2 ASN 114 12.904 4.335 -10.994 901 HB3 ASN 114 HB1 ASN 114 13.460 4.654 -9.358 902 HD21 ASN 114 HD21 ASN 114 12.004 4.417 -7.631 903 HD22 ASN 114 HD22 ASN 114 10.524 3.540 -7.811 904 H GLY 115 HN GLY 115 10.266 6.932 -9.153 905 HA2 GLY 115 HA2 GLY 115 8.712 7.918 -11.219 906 HA3 GLY 115 HA1 GLY 115 8.443 6.180 -11.191 907 H THR 116 HN THR 116 7.396 5.239 -9.420 908 HA THR 116 HA THR 116 6.385 6.828 -7.254 909 HB THR 116 HB THR 116 3.947 6.048 -8.107 910 HG1 THR 116 HG1 THR 116 5.281 5.531 -10.201 911 HG21 THR 116 HG21 THR 116 3.599 8.378 -8.830 912 HG22 THR 116 HG22 THR 116 5.346 8.620 -8.854 913 HG23 THR 116 HG23 THR 116 4.521 8.284 -7.332 914 H VAL 117 HN VAL 117 4.519 5.328 -6.105 915 HA VAL 117 HA VAL 117 5.972 2.787 -5.812 916 HB VAL 117 HB VAL 117 4.736 2.664 -3.573 917 HG11 VAL 117 HG11 VAL 117 6.849 4.739 -4.073 918 HG12 VAL 117 HG12 VAL 117 7.078 3.051 -3.606 919 HG13 VAL 117 HG13 VAL 117 6.356 4.196 -2.469 920 HG21 VAL 117 HG21 VAL 117 3.063 4.365 -3.936 921 HG22 VAL 117 HG22 VAL 117 4.311 5.588 -4.173 922 HG23 VAL 117 HG23 VAL 117 4.101 4.838 -2.590 923 H GLU 118 HN GLU 118 5.027 1.234 -6.923 924 HA GLU 118 HA GLU 118 2.121 0.938 -6.777 925 HB2 GLU 118 HB2 GLU 118 3.456 0.651 -8.950 926 HB3 GLU 118 HB1 GLU 118 4.067 -0.841 -8.249 927 HG2 GLU 118 HG2 GLU 118 1.696 -1.590 -7.997 928 HG3 GLU 118 HG1 GLU 118 1.221 -0.162 -8.919 929 H LEU 119 HN LEU 119 1.410 -0.131 -5.034 930 HA LEU 119 HA LEU 119 2.861 -2.503 -4.160 931 HB2 LEU 119 HB2 LEU 119 3.027 -1.835 -1.885 932 HB3 LEU 119 HB1 LEU 119 3.729 -0.562 -2.856 933 HG LEU 119 HG LEU 119 1.157 0.340 -2.541 934 HD11 LEU 119 HD11 LEU 119 1.965 -1.045 -0.001 935 HD12 LEU 119 HD12 LEU 119 0.607 -1.473 -1.041 936 HD13 LEU 119 HD13 LEU 119 0.611 0.071 -0.187 937 HD21 LEU 119 HD21 LEU 119 3.521 0.850 -0.737 938 HD22 LEU 119 HD22 LEU 119 2.111 1.894 -0.918 939 HD23 LEU 119 HD23 LEU 119 3.205 1.646 -2.279 940 H THR 120 HN THR 120 1.604 -3.877 -2.756 941 HA THR 120 HA THR 120 -1.228 -3.674 -3.483 942 HB THR 120 HB THR 120 0.362 -6.080 -2.572 943 HG1 THR 120 HG1 THR 120 0.874 -5.310 -4.705 944 HG21 THR 120 HG21 THR 120 -1.606 -7.371 -3.211 945 HG22 THR 120 HG22 THR 120 -2.459 -5.889 -3.637 946 HG23 THR 120 HG23 THR 120 -2.016 -6.201 -1.957 947 H LEU 121 HN LEU 121 -2.707 -3.269 -2.014 948 HA LEU 121 HA LEU 121 -2.157 -3.939 0.798 949 HB2 LEU 121 HB2 LEU 121 -3.406 -1.426 -0.308 950 HB3 LEU 121 HB1 LEU 121 -3.524 -1.896 1.379 951 HG LEU 121 HG LEU 121 -0.967 -1.283 -0.111 952 HD11 LEU 121 HD11 LEU 121 -2.210 0.715 0.320 953 HD12 LEU 121 HD12 LEU 121 -0.863 0.626 1.449 954 HD13 LEU 121 HD13 LEU 121 -2.496 0.235 1.990 955 HD21 LEU 121 HD21 LEU 121 0.106 -1.520 2.070 956 HD22 LEU 121 HD22 LEU 121 -0.666 -3.028 1.571 957 HD23 LEU 121 HD23 LEU 121 -1.435 -1.999 2.782 958 HA PRO 122 HA PRO 122 -6.132 -5.914 0.202 959 HB2 PRO 122 HB2 PRO 122 -5.937 -6.869 2.914 960 HB3 PRO 122 HB1 PRO 122 -5.786 -7.787 1.414 961 HG2 PRO 122 HG2 PRO 122 -3.715 -7.314 3.160 962 HG3 PRO 122 HG1 PRO 122 -3.512 -7.682 1.439 963 HD2 PRO 122 HD2 PRO 122 -3.380 -5.051 2.847 964 HD3 PRO 122 HD1 PRO 122 -2.429 -5.647 1.468 965 H ILE 123 HN ILE 123 -7.920 -4.754 0.378 966 HA ILE 123 HA ILE 123 -8.248 -2.993 2.687 967 HB ILE 123 HB ILE 123 -9.907 -1.781 1.444 968 HG12 ILE 123 HG12 ILE 123 -9.659 -3.823 -0.767 969 HG13 ILE 123 HG11 ILE 123 -10.995 -3.766 0.376 970 HG21 ILE 123 HG21 ILE 123 -8.637 -1.209 -0.687 971 HG22 ILE 123 HG22 ILE 123 -7.500 -2.478 -0.222 972 HG23 ILE 123 HG23 ILE 123 -7.735 -1.083 0.829 973 HD11 ILE 123 HD11 ILE 123 -11.604 -2.733 -1.731 974 HD12 ILE 123 HD12 ILE 123 -10.259 -1.601 -1.578 975 HD13 ILE 123 HD13 ILE 123 -11.596 -1.545 -0.428 976 H ASP 124 HN ASP 124 -9.325 -3.862 4.349 977 HA ASP 124 HA ASP 124 -11.089 -6.121 3.794 978 HB2 ASP 124 HB2 ASP 124 -9.804 -5.076 6.299 979 HB3 ASP 124 HB1 ASP 124 -11.143 -6.210 6.379 980 H PHE 125 HN PHE 125 -13.138 -5.656 3.428 981 HA PHE 125 HA PHE 125 -14.509 -4.151 5.558 982 HB2 PHE 125 HB2 PHE 125 -15.437 -4.879 2.764 983 HB3 PHE 125 HB1 PHE 125 -16.490 -4.188 3.996 984 HD1 PHE 125 HD2 PHE 125 -13.729 -3.569 1.683 985 HD2 PHE 125 HD1 PHE 125 -16.305 -1.865 4.608 986 HE1 PHE 125 HE2 PHE 125 -13.043 -1.317 0.965 987 HE2 PHE 125 HE1 PHE 125 -15.629 0.389 3.897 988 HZ PHE 125 HZ PHE 125 -13.994 0.666 2.074 989 H SER 126 HN SER 126 -15.801 -5.375 6.925 990 HA SER 126 HA SER 126 -15.058 -8.044 7.209 991 HB2 SER 126 HB2 SER 126 -17.483 -6.666 8.375 992 HB3 SER 126 HB1 SER 126 -16.738 -8.145 8.983 993 HG SER 126 HG SER 126 -14.832 -6.932 9.377 994 H LEU 127 HN LEU 127 -15.466 -9.530 5.705 995 HA LEU 127 HA LEU 127 -18.006 -9.617 4.299 996 HB2 LEU 127 HB2 LEU 127 -15.343 -10.351 3.718 997 HB3 LEU 127 HB1 LEU 127 -16.259 -11.844 3.748 998 HG LEU 127 HG LEU 127 -16.939 -9.446 2.047 999 HD11 LEU 127 HD11 LEU 127 -16.120 -10.717 0.168 1000 HD12 LEU 127 HD12 LEU 127 -15.690 -12.063 1.229 1001 HD13 LEU 127 HD13 LEU 127 -14.836 -10.525 1.365 1002 HD21 LEU 127 HD21 LEU 127 -18.433 -11.015 0.895 1003 HD22 LEU 127 HD22 LEU 127 -18.893 -10.749 2.578 1004 HD23 LEU 127 HD23 LEU 127 -18.063 -12.235 2.115 1005 H ARG 128 HN ARG 128 -19.569 -10.365 5.702 1006 HA ARG 128 HA ARG 128 -19.182 -13.135 6.606 1007 HB2 ARG 128 HB2 ARG 128 -20.408 -12.552 8.726 1008 HB3 ARG 128 HB1 ARG 128 -18.798 -11.864 8.579 1009 HG2 ARG 128 HG2 ARG 128 -20.037 -10.108 9.427 1010 HG3 ARG 128 HG1 ARG 128 -20.020 -9.765 7.696 1011 HD2 ARG 128 HD2 ARG 128 -22.237 -10.973 7.572 1012 HD3 ARG 128 HD1 ARG 128 -22.251 -10.948 9.335 1013 HE ARG 128 HE ARG 128 -21.808 -8.339 8.430 1014 HH11 ARG 128 HH11 ARG 128 -24.328 -10.766 8.542 1015 HH12 ARG 128 HH12 ARG 128 -25.621 -9.612 8.351 1016 HH21 ARG 128 HH21 ARG 128 -23.490 -6.816 8.194 1017 HH22 ARG 128 HH22 ARG 128 -25.138 -7.365 8.184 1018 H GLY 129 HN GLY 129 -20.885 -11.288 4.606 1019 HA2 GLY 129 HA2 GLY 129 -23.016 -13.195 4.426 1020 HA3 GLY 129 HA1 GLY 129 -23.568 -11.655 5.064 1021 H ALA 130 HN ALA 130 -21.088 -12.212 2.607 1022 HA ALA 130 HA ALA 130 -22.874 -11.500 0.454 1023 HB1 ALA 130 HB1 ALA 130 -20.553 -9.685 1.103 1024 HB2 ALA 130 HB2 ALA 130 -22.251 -9.294 1.365 1025 HB3 ALA 130 HB3 ALA 130 -21.646 -9.537 -0.274 1026 H GLY 131 HN GLY 131 -21.483 -13.821 0.978 1027 HA2 GLY 131 HA2 GLY 131 -19.820 -14.147 -1.323 1028 HA3 GLY 131 HA1 GLY 131 -18.855 -14.059 0.143 1029 H PHE 132 HN PHE 132 -20.719 -15.345 1.868 1030 HA PHE 132 HA PHE 132 -20.915 -18.031 0.723 1031 HB2 PHE 132 HB2 PHE 132 -20.072 -18.968 2.889 1032 HB3 PHE 132 HB1 PHE 132 -18.856 -18.102 1.962 1033 HD1 PHE 132 HD2 PHE 132 -17.968 -15.981 2.741 1034 HD2 PHE 132 HD1 PHE 132 -20.877 -18.115 5.003 1035 HE1 PHE 132 HE2 PHE 132 -17.455 -14.592 4.706 1036 HE2 PHE 132 HE1 PHE 132 -20.370 -16.727 6.968 1037 HZ PHE 132 HZ PHE 132 -18.659 -14.965 6.823 Start of MODEL 19 1 H1 LYS 2 HT1 LYS 2 -4.783 16.652 -36.878 2 H2 LYS 2 HT2 LYS 2 -4.196 15.224 -37.579 3 H3 LYS 2 HT3 LYS 2 -3.216 16.109 -36.514 4 HA LYS 2 HA LYS 2 -4.775 15.670 -34.712 5 HB2 LYS 2 HB2 LYS 2 -6.103 13.978 -36.835 6 HB3 LYS 2 HB1 LYS 2 -6.432 13.818 -35.116 7 HG2 LYS 2 HG2 LYS 2 -6.856 16.326 -36.722 8 HG3 LYS 2 HG1 LYS 2 -8.115 15.161 -36.310 9 HD2 LYS 2 HD2 LYS 2 -7.642 15.559 -33.913 10 HD3 LYS 2 HD1 LYS 2 -6.473 16.797 -34.379 11 HE2 LYS 2 HE2 LYS 2 -8.213 18.112 -35.414 12 HE3 LYS 2 HE1 LYS 2 -9.397 16.837 -35.119 13 HZ1 LYS 2 HZ1 LYS 2 -9.179 17.182 -32.762 14 HZ2 LYS 2 HZ2 LYS 2 -9.527 18.670 -33.501 15 HZ3 LYS 2 HZ3 LYS 2 -7.948 18.323 -32.989 16 H VAL 3 HN VAL 3 -4.739 13.565 -33.517 17 HA VAL 3 HA VAL 3 -3.549 11.847 -32.652 18 HB VAL 3 HB VAL 3 -2.830 11.169 -35.506 19 HG11 VAL 3 HG11 VAL 3 -2.537 8.894 -34.641 20 HG12 VAL 3 HG12 VAL 3 -2.871 9.477 -33.011 21 HG13 VAL 3 HG13 VAL 3 -1.433 10.032 -33.867 22 HG21 VAL 3 HG21 VAL 3 -4.749 9.644 -35.435 23 HG22 VAL 3 HG22 VAL 3 -5.249 11.323 -35.228 24 HG23 VAL 3 HG23 VAL 3 -5.164 10.249 -33.832 25 H GLN 4 HN GLN 4 -2.098 13.181 -31.623 26 HA GLN 4 HA GLN 4 0.479 13.583 -32.980 27 HB2 GLN 4 HB2 GLN 4 -0.828 15.081 -30.709 28 HB3 GLN 4 HB1 GLN 4 0.850 15.324 -31.185 29 HG2 GLN 4 HG2 GLN 4 0.242 16.196 -33.273 30 HG3 GLN 4 HG1 GLN 4 -1.410 15.602 -33.135 31 HE21 GLN 4 HE21 GLN 4 0.227 17.154 -30.474 32 HE22 GLN 4 HE22 GLN 4 -0.712 18.611 -30.503 33 H GLU 5 HN GLU 5 1.016 11.370 -32.512 34 HA GLU 5 HA GLU 5 1.406 10.670 -29.719 35 HB2 GLU 5 HB2 GLU 5 1.952 8.465 -30.474 36 HB3 GLU 5 HB1 GLU 5 0.547 8.999 -31.382 37 HG2 GLU 5 HG2 GLU 5 3.382 9.028 -32.400 38 HG3 GLU 5 HG1 GLU 5 2.187 7.782 -32.750 39 H GLN 6 HN GLN 6 3.066 12.296 -32.074 40 HA GLN 6 HA GLN 6 5.694 11.460 -31.951 41 HB2 GLN 6 HB2 GLN 6 4.763 14.333 -32.092 42 HB3 GLN 6 HB1 GLN 6 6.299 13.698 -32.664 43 HG2 GLN 6 HG2 GLN 6 5.172 12.414 -34.372 44 HG3 GLN 6 HG1 GLN 6 3.603 12.935 -33.762 45 HE21 GLN 6 HE21 GLN 6 4.741 13.270 -36.405 46 HE22 GLN 6 HE22 GLN 6 4.776 14.973 -36.708 47 H SER 7 HN SER 7 3.850 13.233 -29.600 48 HA SER 7 HA SER 7 6.013 14.329 -28.143 49 HB2 SER 7 HB2 SER 7 3.214 13.740 -27.162 50 HB3 SER 7 HB1 SER 7 4.353 14.908 -26.486 51 HG SER 7 HG SER 7 4.299 15.822 -28.744 52 H VAL 8 HN VAL 8 4.705 11.128 -28.233 53 HA VAL 8 HA VAL 8 5.475 10.445 -25.541 54 HB VAL 8 HB VAL 8 3.675 9.276 -26.989 55 HG11 VAL 8 HG11 VAL 8 6.122 7.806 -27.955 56 HG12 VAL 8 HG12 VAL 8 5.039 8.798 -28.934 57 HG13 VAL 8 HG13 VAL 8 4.453 7.298 -28.213 58 HG21 VAL 8 HG21 VAL 8 4.006 7.155 -25.805 59 HG22 VAL 8 HG22 VAL 8 4.282 8.545 -24.753 60 HG23 VAL 8 HG23 VAL 8 5.652 7.642 -25.401 61 H GLY 9 HN GLY 9 7.143 10.995 -28.374 62 HA2 GLY 9 HA2 GLY 9 9.448 9.437 -27.393 63 HA3 GLY 9 HA1 GLY 9 9.165 9.777 -29.095 64 H ALA 10 HN ALA 10 8.394 12.291 -26.911 65 HA ALA 10 HA ALA 10 10.612 13.866 -27.936 66 HB1 ALA 10 HB1 ALA 10 8.294 14.753 -26.223 67 HB2 ALA 10 HB2 ALA 10 8.351 14.823 -27.984 68 HB3 ALA 10 HB3 ALA 10 9.466 15.797 -27.026 69 HA PRO 11 HA PRO 11 11.838 13.793 -23.379 70 HB2 PRO 11 HB2 PRO 11 9.967 12.804 -21.550 71 HB3 PRO 11 HB1 PRO 11 10.254 14.507 -21.913 72 HG2 PRO 11 HG2 PRO 11 7.910 13.031 -22.462 73 HG3 PRO 11 HG1 PRO 11 8.294 14.664 -23.031 74 HD2 PRO 11 HD2 PRO 11 8.563 12.050 -24.438 75 HD3 PRO 11 HD1 PRO 11 8.187 13.658 -25.096 76 HA PRO 12 HA PRO 12 12.898 9.439 -23.987 77 HB2 PRO 12 HB2 PRO 12 15.218 10.188 -22.320 78 HB3 PRO 12 HB1 PRO 12 15.178 9.488 -23.942 79 HG2 PRO 12 HG2 PRO 12 15.874 12.042 -23.539 80 HG3 PRO 12 HG1 PRO 12 14.945 11.548 -24.966 81 HD2 PRO 12 HD2 PRO 12 14.003 12.884 -22.460 82 HD3 PRO 12 HD1 PRO 12 13.518 13.175 -24.145 83 HA PRO 13 HA PRO 13 11.331 8.321 -19.893 84 HB2 PRO 13 HB2 PRO 13 10.415 5.879 -20.598 85 HB3 PRO 13 HB1 PRO 13 9.535 7.366 -20.975 86 HG2 PRO 13 HG2 PRO 13 11.291 5.703 -22.734 87 HG3 PRO 13 HG1 PRO 13 9.748 6.489 -23.114 88 HD2 PRO 13 HD2 PRO 13 12.183 7.515 -23.815 89 HD3 PRO 13 HD1 PRO 13 10.744 8.512 -23.527 90 H GLY 14 HN GLY 14 13.668 6.765 -21.899 91 HA2 GLY 14 HA2 GLY 14 15.737 6.040 -20.880 92 HA3 GLY 14 HA1 GLY 14 14.798 5.470 -19.508 93 H ARG 15 HN ARG 15 15.791 3.418 -19.721 94 HA ARG 15 HA ARG 15 15.278 1.909 -22.159 95 HB2 ARG 15 HB2 ARG 15 16.732 1.124 -19.628 96 HB3 ARG 15 HB1 ARG 15 16.627 0.148 -21.085 97 HG2 ARG 15 HG2 ARG 15 17.961 2.838 -20.863 98 HG3 ARG 15 HG1 ARG 15 18.777 1.275 -20.897 99 HD2 ARG 15 HD2 ARG 15 17.398 1.019 -23.144 100 HD3 ARG 15 HD1 ARG 15 17.447 2.782 -23.088 101 HE ARG 15 HE ARG 15 19.944 1.273 -22.806 102 HH11 ARG 15 HH11 ARG 15 17.945 3.468 -24.670 103 HH12 ARG 15 HH12 ARG 15 19.209 3.861 -25.797 104 HH21 ARG 15 HH21 ARG 15 21.589 1.761 -24.291 105 HH22 ARG 15 HH22 ARG 15 21.282 2.888 -25.580 106 H ALA 16 HN ALA 16 14.105 -0.038 -22.200 107 HA ALA 16 HA ALA 16 12.363 -0.498 -19.866 108 HB1 ALA 16 HB1 ALA 16 11.623 -0.793 -22.777 109 HB2 ALA 16 HB2 ALA 16 11.105 0.512 -21.710 110 HB3 ALA 16 HB3 ALA 16 10.575 -1.142 -21.403 111 H ASP 17 HN ASP 17 14.955 -1.669 -21.034 112 HA ASP 17 HA ASP 17 14.183 -4.464 -20.688 113 HB2 ASP 17 HB2 ASP 17 15.459 -5.198 -22.609 114 HB3 ASP 17 HB1 ASP 17 14.274 -4.011 -23.144 115 H LYS 18 HN LYS 18 15.849 -5.783 -19.900 116 HA LYS 18 HA LYS 18 17.536 -6.231 -18.446 117 HB2 LYS 18 HB2 LYS 18 18.955 -4.205 -20.189 118 HB3 LYS 18 HB1 LYS 18 19.760 -5.227 -19.005 119 HG2 LYS 18 HG2 LYS 18 18.201 -6.224 -21.382 120 HG3 LYS 18 HG1 LYS 18 19.958 -6.083 -21.299 121 HD2 LYS 18 HD2 LYS 18 20.048 -7.696 -19.505 122 HD3 LYS 18 HD1 LYS 18 18.287 -7.756 -19.426 123 HE2 LYS 18 HE2 LYS 18 19.972 -8.608 -21.777 124 HE3 LYS 18 HE1 LYS 18 19.230 -9.693 -20.601 125 HZ1 LYS 18 HZ1 LYS 18 17.811 -9.636 -22.465 126 HZ2 LYS 18 HZ2 LYS 18 17.868 -7.944 -22.576 127 HZ3 LYS 18 HZ3 LYS 18 17.049 -8.683 -21.287 128 H THR 19 HN THR 19 15.983 -5.055 -16.968 129 HA THR 19 HA THR 19 16.710 -2.374 -16.183 130 HB THR 19 HB THR 19 14.729 -4.202 -14.812 131 HG1 THR 19 HG1 THR 19 14.383 -2.477 -17.076 132 HG21 THR 19 HG21 THR 19 14.917 -1.189 -15.026 133 HG22 THR 19 HG22 THR 19 15.311 -2.149 -13.599 134 HG23 THR 19 HG23 THR 19 13.650 -2.081 -14.191 135 H ALA 20 HN ALA 20 18.947 -3.235 -15.690 136 HA ALA 20 HA ALA 20 19.063 -4.110 -12.877 137 HB1 ALA 20 HB1 ALA 20 21.179 -4.450 -15.007 138 HB2 ALA 20 HB2 ALA 20 20.082 -5.714 -14.450 139 HB3 ALA 20 HB3 ALA 20 21.268 -5.023 -13.342 140 H ALA 21 HN ALA 21 18.522 -1.601 -13.072 141 HA ALA 21 HA ALA 21 20.809 0.113 -13.306 142 HB1 ALA 21 HB1 ALA 21 18.069 0.648 -12.144 143 HB2 ALA 21 HB2 ALA 21 18.544 0.908 -13.822 144 HB3 ALA 21 HB3 ALA 21 19.284 1.865 -12.540 145 HA PRO 22 HA PRO 22 22.752 0.184 -9.370 146 HB2 PRO 22 HB2 PRO 22 21.763 2.643 -8.306 147 HB3 PRO 22 HB1 PRO 22 23.320 2.342 -9.075 148 HG2 PRO 22 HG2 PRO 22 20.834 3.467 -10.223 149 HG3 PRO 22 HG1 PRO 22 22.521 3.748 -10.690 150 HD2 PRO 22 HD2 PRO 22 20.890 2.262 -12.202 151 HD3 PRO 22 HD1 PRO 22 22.603 1.831 -12.000 152 H GLN 23 HN GLN 23 19.323 1.126 -9.225 153 HA GLN 23 HA GLN 23 19.243 0.367 -6.413 154 HB2 GLN 23 HB2 GLN 23 17.087 1.616 -8.117 155 HB3 GLN 23 HB1 GLN 23 17.014 1.364 -6.377 156 HG2 GLN 23 HG2 GLN 23 18.943 2.875 -6.110 157 HG3 GLN 23 HG1 GLN 23 18.919 3.172 -7.848 158 HE21 GLN 23 HE21 GLN 23 17.201 4.336 -8.739 159 HE22 GLN 23 HE22 GLN 23 16.176 5.340 -7.766 160 H THR 24 HN THR 24 18.419 -1.052 -9.456 161 HA THR 24 HA THR 24 16.361 -2.699 -8.215 162 HB THR 24 HB THR 24 16.118 -3.726 -10.488 163 HG1 THR 24 HG1 THR 24 17.457 -3.209 -12.032 164 HG21 THR 24 HG21 THR 24 15.046 -1.763 -11.505 165 HG22 THR 24 HG22 THR 24 15.871 -0.720 -10.345 166 HG23 THR 24 HG23 THR 24 14.675 -1.889 -9.784 167 H ARG 25 HN ARG 25 18.769 -3.043 -7.010 168 HA ARG 25 HA ARG 25 20.027 -5.433 -8.078 169 HB2 ARG 25 HB2 ARG 25 20.462 -4.075 -5.412 170 HB3 ARG 25 HB1 ARG 25 21.481 -5.314 -6.130 171 HG2 ARG 25 HG2 ARG 25 21.041 -2.544 -7.208 172 HG3 ARG 25 HG1 ARG 25 22.470 -3.109 -6.343 173 HD2 ARG 25 HD2 ARG 25 22.818 -4.796 -8.130 174 HD3 ARG 25 HD1 ARG 25 21.475 -4.078 -9.016 175 HE ARG 25 HE ARG 25 23.640 -2.276 -8.281 176 HH11 ARG 25 HH11 ARG 25 22.173 -4.306 -10.728 177 HH12 ARG 25 HH12 ARG 25 23.040 -3.576 -12.047 178 HH21 ARG 25 HH21 ARG 25 24.792 -1.315 -10.015 179 HH22 ARG 25 HH22 ARG 25 24.519 -1.864 -11.639 180 H LEU 26 HN LEU 26 18.937 -4.801 -4.760 181 HA LEU 26 HA LEU 26 17.320 -7.257 -4.884 182 HB2 LEU 26 HB2 LEU 26 19.556 -7.682 -3.826 183 HB3 LEU 26 HB1 LEU 26 19.126 -6.536 -2.572 184 HG LEU 26 HG LEU 26 17.236 -7.988 -1.914 185 HD11 LEU 26 HD11 LEU 26 16.847 -9.048 -4.089 186 HD12 LEU 26 HD12 LEU 26 17.065 -10.244 -2.811 187 HD13 LEU 26 HD13 LEU 26 18.378 -9.911 -3.939 188 HD21 LEU 26 HD21 LEU 26 18.599 -9.788 -0.936 189 HD22 LEU 26 HD22 LEU 26 19.353 -8.202 -0.762 190 HD23 LEU 26 HD23 LEU 26 19.937 -9.325 -1.989 191 H THR 27 HN THR 27 16.969 -4.238 -4.814 192 HA THR 27 HA THR 27 14.963 -4.229 -2.673 193 HB THR 27 HB THR 27 15.418 -1.678 -2.645 194 HG1 THR 27 HG1 THR 27 17.138 -1.006 -3.694 195 HG21 THR 27 HG21 THR 27 17.298 -2.008 -1.022 196 HG22 THR 27 HG22 THR 27 17.336 -3.705 -1.493 197 HG23 THR 27 HG23 THR 27 15.897 -3.034 -0.726 198 HA PRO 28 HA PRO 28 12.903 -2.857 -6.587 199 HB2 PRO 28 HB2 PRO 28 11.829 -5.138 -7.501 200 HB3 PRO 28 HB1 PRO 28 13.515 -4.720 -7.818 201 HG2 PRO 28 HG2 PRO 28 12.406 -6.778 -6.036 202 HG3 PRO 28 HG1 PRO 28 14.027 -6.654 -6.733 203 HD2 PRO 28 HD2 PRO 28 13.126 -5.881 -4.088 204 HD3 PRO 28 HD1 PRO 28 14.779 -5.896 -4.736 205 H TYR 29 HN TYR 29 12.066 -3.203 -3.699 206 HA TYR 29 HA TYR 29 9.174 -3.481 -4.171 207 HB2 TYR 29 HB2 TYR 29 10.077 -5.487 -3.032 208 HB3 TYR 29 HB1 TYR 29 10.697 -4.463 -1.744 209 HD1 TYR 29 HD2 TYR 29 7.390 -4.434 -3.477 210 HD2 TYR 29 HD1 TYR 29 9.513 -5.025 0.162 211 HE1 TYR 29 HE2 TYR 29 5.256 -4.664 -2.275 212 HE2 TYR 29 HE1 TYR 29 7.387 -5.256 1.373 213 HH TYR 29 HH TYR 29 5.056 -4.590 1.133 214 H ALA 30 HN ALA 30 8.539 -1.418 -4.099 215 HA ALA 30 HA ALA 30 9.808 0.495 -2.354 216 HB1 ALA 30 HB1 ALA 30 8.390 2.128 -3.444 217 HB2 ALA 30 HB2 ALA 30 7.459 0.838 -4.205 218 HB3 ALA 30 HB3 ALA 30 9.151 1.078 -4.640 219 H GLN 31 HN GLN 31 8.867 -1.208 -0.600 220 HA GLN 31 HA GLN 31 7.021 0.381 0.896 221 HB2 GLN 31 HB2 GLN 31 5.512 -0.984 -0.606 222 HB3 GLN 31 HB1 GLN 31 6.121 -2.423 0.197 223 HG2 GLN 31 HG2 GLN 31 4.930 -0.219 1.816 224 HG3 GLN 31 HG1 GLN 31 3.880 -1.337 0.950 225 HE21 GLN 31 HE21 GLN 31 4.287 -0.890 3.833 226 HE22 GLN 31 HE22 GLN 31 4.701 -2.437 4.484 227 H ALA 32 HN ALA 32 8.173 0.438 2.712 228 HA ALA 32 HA ALA 32 8.794 -2.061 4.059 229 HB1 ALA 32 HB1 ALA 32 10.941 -0.019 3.474 230 HB2 ALA 32 HB2 ALA 32 10.803 -1.610 2.723 231 HB3 ALA 32 HB3 ALA 32 11.128 -1.475 4.452 232 H GLY 33 HN GLY 33 9.084 -1.819 6.313 233 HA2 GLY 33 HA2 GLY 33 9.583 -0.037 8.059 234 HA3 GLY 33 HA1 GLY 33 8.247 0.826 7.317 235 H GLU 34 HN GLU 34 6.899 0.882 9.002 236 HA GLU 34 HA GLU 34 6.093 -1.679 10.215 237 HB2 GLU 34 HB2 GLU 34 7.238 0.099 11.653 238 HB3 GLU 34 HB1 GLU 34 5.786 1.064 11.436 239 HG2 GLU 34 HG2 GLU 34 4.456 -0.657 12.516 240 HG3 GLU 34 HG1 GLU 34 5.888 -1.670 12.695 241 H ASP 35 HN ASP 35 3.829 -1.980 10.627 242 HA ASP 35 HA ASP 35 2.208 -0.769 8.564 243 HB2 ASP 35 HB2 ASP 35 2.067 -3.197 9.022 244 HB3 ASP 35 HB1 ASP 35 1.431 -2.844 10.626 245 H ASN 36 HN ASN 36 2.587 1.333 9.733 246 HA ASN 36 HA ASN 36 0.285 1.822 11.515 247 HB2 ASN 36 HB2 ASN 36 2.284 2.338 12.741 248 HB3 ASN 36 HB1 ASN 36 2.978 3.199 11.374 249 HD21 ASN 36 HD21 ASN 36 0.587 3.319 13.924 250 HD22 ASN 36 HD22 ASN 36 0.358 5.035 13.883 251 H TRP 37 HN TRP 37 1.622 2.258 8.492 252 HA TRP 37 HA TRP 37 0.800 4.939 7.994 253 HB2 TRP 37 HB2 TRP 37 1.467 4.498 5.666 254 HB3 TRP 37 HB1 TRP 37 2.713 4.047 6.816 255 HD1 TRP 37 HD1 TRP 37 1.784 1.116 7.549 256 HE1 TRP 37 HE1 TRP 37 1.929 -0.748 5.785 257 HE3 TRP 37 HE3 TRP 37 1.859 4.011 3.347 258 HZ2 TRP 37 HZ2 TRP 37 2.080 -0.953 2.973 259 HZ3 TRP 37 HZ3 TRP 37 2.015 2.907 1.158 260 HH2 TRP 37 HH2 TRP 37 2.123 0.478 0.978 261 H ARG 38 HN ARG 38 -0.888 1.928 7.869 262 HA ARG 38 HA ARG 38 -2.653 2.611 5.747 263 HB2 ARG 38 HB2 ARG 38 -4.093 0.792 6.503 264 HB3 ARG 38 HB1 ARG 38 -2.417 0.279 6.374 265 HG2 ARG 38 HG2 ARG 38 -2.193 -0.033 8.624 266 HG3 ARG 38 HG1 ARG 38 -3.403 1.187 9.024 267 HD2 ARG 38 HD2 ARG 38 -4.182 -1.093 9.529 268 HD3 ARG 38 HD1 ARG 38 -5.183 -0.296 8.319 269 HE ARG 38 HE ARG 38 -3.061 -2.089 7.392 270 HH11 ARG 38 HH11 ARG 38 -6.492 -1.528 7.928 271 HH12 ARG 38 HH12 ARG 38 -6.994 -2.814 6.865 272 HH21 ARG 38 HH21 ARG 38 -3.728 -3.777 6.024 273 HH22 ARG 38 HH22 ARG 38 -5.422 -4.082 5.787 274 H SER 39 HN SER 39 -2.784 3.093 9.241 275 HA SER 39 HA SER 39 -5.460 4.043 9.272 276 HB2 SER 39 HB2 SER 39 -4.705 5.041 11.513 277 HB3 SER 39 HB1 SER 39 -4.597 3.289 11.345 278 HG SER 39 HG SER 39 -2.681 4.062 12.224 279 H ARG 40 HN ARG 40 -2.332 5.489 8.718 280 HA ARG 40 HA ARG 40 -3.139 8.184 8.789 281 HB2 ARG 40 HB2 ARG 40 -0.925 7.235 7.005 282 HB3 ARG 40 HB1 ARG 40 -1.024 8.648 8.022 283 HG2 ARG 40 HG2 ARG 40 -0.553 5.845 8.964 284 HG3 ARG 40 HG1 ARG 40 0.634 7.142 8.879 285 HD2 ARG 40 HD2 ARG 40 -1.843 7.177 10.599 286 HD3 ARG 40 HD1 ARG 40 -0.227 6.752 11.163 287 HE ARG 40 HE ARG 40 -0.989 9.417 10.141 288 HH11 ARG 40 HH11 ARG 40 0.968 7.342 12.169 289 HH12 ARG 40 HH12 ARG 40 1.707 8.657 13.036 290 HH21 ARG 40 HH21 ARG 40 -0.009 11.159 11.258 291 HH22 ARG 40 HH22 ARG 40 1.159 10.832 12.506 292 H ILE 41 HN ILE 41 -2.909 5.725 6.283 293 HA ILE 41 HA ILE 41 -3.676 7.301 4.069 294 HB ILE 41 HB ILE 41 -4.009 4.335 4.607 295 HG12 ILE 41 HG12 ILE 41 -2.034 5.835 2.878 296 HG13 ILE 41 HG11 ILE 41 -1.687 5.192 4.481 297 HG21 ILE 41 HG21 ILE 41 -5.661 4.992 2.972 298 HG22 ILE 41 HG22 ILE 41 -4.364 4.095 2.180 299 HG23 ILE 41 HG23 ILE 41 -4.436 5.852 2.040 300 HD11 ILE 41 HD11 ILE 41 -2.075 2.935 3.657 301 HD12 ILE 41 HD12 ILE 41 -0.820 3.753 2.729 302 HD13 ILE 41 HD13 ILE 41 -2.441 3.577 2.056 303 H SER 42 HN SER 42 -5.573 5.128 6.192 304 HA SER 42 HA SER 42 -8.085 5.592 5.104 305 HB2 SER 42 HB2 SER 42 -7.358 4.996 7.982 306 HB3 SER 42 HB1 SER 42 -8.980 4.858 7.298 307 HG SER 42 HG SER 42 -7.183 2.999 7.343 308 H GLY 43 HN GLY 43 -6.289 7.539 7.423 309 HA2 GLY 43 HA2 GLY 43 -8.352 9.315 8.147 310 HA3 GLY 43 HA1 GLY 43 -6.634 9.694 8.155 311 H ARG 44 HN ARG 44 -5.961 9.520 5.523 312 HA ARG 44 HA ARG 44 -6.951 11.936 4.442 313 HB2 ARG 44 HB2 ARG 44 -5.271 9.734 3.263 314 HB3 ARG 44 HB1 ARG 44 -5.610 11.244 2.453 315 HG2 ARG 44 HG2 ARG 44 -4.500 12.454 4.285 316 HG3 ARG 44 HG1 ARG 44 -4.113 10.901 5.032 317 HD2 ARG 44 HD2 ARG 44 -2.232 11.813 3.718 318 HD3 ARG 44 HD1 ARG 44 -2.804 10.253 3.108 319 HE ARG 44 HE ARG 44 -4.153 11.811 1.511 320 HH11 ARG 44 HH11 ARG 44 -0.912 12.439 2.668 321 HH12 ARG 44 HH12 ARG 44 -0.395 13.204 1.192 322 HH21 ARG 44 HH21 ARG 44 -3.486 12.847 -0.426 323 HH22 ARG 44 HH22 ARG 44 -1.860 13.444 -0.560 324 H LEU 45 HN LEU 45 -7.632 8.539 3.872 325 HA LEU 45 HA LEU 45 -9.144 8.789 1.515 326 HB2 LEU 45 HB2 LEU 45 -8.258 6.737 3.006 327 HB3 LEU 45 HB1 LEU 45 -9.923 6.773 3.550 328 HG LEU 45 HG LEU 45 -9.141 6.572 0.653 329 HD11 LEU 45 HD11 LEU 45 -9.595 4.178 0.852 330 HD12 LEU 45 HD12 LEU 45 -9.820 4.365 2.592 331 HD13 LEU 45 HD13 LEU 45 -8.238 4.666 1.868 332 HD21 LEU 45 HD21 LEU 45 -11.723 5.981 2.095 333 HD22 LEU 45 HD22 LEU 45 -11.423 5.736 0.374 334 HD23 LEU 45 HD23 LEU 45 -11.409 7.365 1.049 335 H ASN 46 HN ASN 46 -9.840 9.329 4.831 336 HA ASN 46 HA ASN 46 -12.683 9.427 4.685 337 HB2 ASN 46 HB2 ASN 46 -11.567 8.980 6.815 338 HB3 ASN 46 HB1 ASN 46 -10.748 10.536 6.742 339 HD21 ASN 46 HD21 ASN 46 -11.843 12.380 7.310 340 HD22 ASN 46 HD22 ASN 46 -13.414 12.356 8.038 341 H ARG 47 HN ARG 47 -10.058 11.716 4.479 342 HA ARG 47 HA ARG 47 -11.452 14.096 4.234 343 HB2 ARG 47 HB2 ARG 47 -9.297 14.693 4.149 344 HB3 ARG 47 HB1 ARG 47 -8.802 13.080 3.675 345 HG2 ARG 47 HG2 ARG 47 -9.216 13.575 1.346 346 HG3 ARG 47 HG1 ARG 47 -9.837 15.178 1.780 347 HD2 ARG 47 HD2 ARG 47 -7.604 15.717 2.745 348 HD3 ARG 47 HD1 ARG 47 -7.017 14.170 2.130 349 HE ARG 47 HE ARG 47 -8.261 15.808 0.126 350 HH11 ARG 47 HH11 ARG 47 -5.254 15.197 1.825 351 HH12 ARG 47 HH12 ARG 47 -4.261 15.778 0.512 352 HH21 ARG 47 HH21 ARG 47 -6.967 16.569 -1.580 353 HH22 ARG 47 HH22 ARG 47 -5.235 16.562 -1.411 354 H PHE 48 HN PHE 48 -10.958 11.485 1.917 355 HA PHE 48 HA PHE 48 -12.003 13.144 -0.212 356 HB2 PHE 48 HB2 PHE 48 -10.950 10.329 -0.240 357 HB3 PHE 48 HB1 PHE 48 -11.547 11.166 -1.664 358 HD1 PHE 48 HD1 PHE 48 -10.385 13.453 -2.175 359 HD2 PHE 48 HD2 PHE 48 -8.712 10.378 0.235 360 HE1 PHE 48 HE1 PHE 48 -8.134 14.348 -2.605 361 HE2 PHE 48 HE2 PHE 48 -6.456 11.267 -0.180 362 HZ PHE 48 HZ PHE 48 -6.163 13.255 -1.605 363 H LYS 49 HN LYS 49 -12.707 9.923 1.103 364 HA LYS 49 HA LYS 49 -15.553 10.288 0.988 365 HB2 LYS 49 HB2 LYS 49 -14.190 8.484 -1.023 366 HB3 LYS 49 HB1 LYS 49 -15.859 8.253 -0.535 367 HG2 LYS 49 HG2 LYS 49 -14.743 10.702 -1.873 368 HG3 LYS 49 HG1 LYS 49 -15.689 9.435 -2.654 369 HD2 LYS 49 HD2 LYS 49 -17.554 9.956 -1.087 370 HD3 LYS 49 HD1 LYS 49 -16.601 11.310 -0.476 371 HE2 LYS 49 HE2 LYS 49 -17.616 10.922 -3.283 372 HE3 LYS 49 HE1 LYS 49 -18.173 12.115 -2.113 373 HZ1 LYS 49 HZ1 LYS 49 -16.688 13.100 -3.730 374 HZ2 LYS 49 HZ2 LYS 49 -15.461 12.004 -3.329 375 HZ3 LYS 49 HZ3 LYS 49 -15.977 13.150 -2.193 376 H ARG 50 HN ARG 50 -15.728 9.534 3.060 377 HA ARG 50 HA ARG 50 -14.931 6.723 3.413 378 HB2 ARG 50 HB2 ARG 50 -13.507 8.557 4.632 379 HB3 ARG 50 HB1 ARG 50 -14.870 8.593 5.742 380 HG2 ARG 50 HG2 ARG 50 -13.243 7.105 6.633 381 HG3 ARG 50 HG1 ARG 50 -14.593 6.133 6.046 382 HD2 ARG 50 HD2 ARG 50 -13.345 5.669 3.981 383 HD3 ARG 50 HD1 ARG 50 -11.995 6.623 4.592 384 HE ARG 50 HE ARG 50 -12.233 4.857 6.548 385 HH11 ARG 50 HH11 ARG 50 -12.255 4.374 3.074 386 HH12 ARG 50 HH12 ARG 50 -11.650 2.753 3.166 387 HH21 ARG 50 HH21 ARG 50 -11.455 2.716 6.671 388 HH22 ARG 50 HH22 ARG 50 -11.193 1.796 5.218 389 H TYR 51 HN TYR 51 -16.827 5.784 3.272 390 HA TYR 51 HA TYR 51 -19.170 6.803 4.632 391 HB2 TYR 51 HB2 TYR 51 -18.867 5.450 2.330 392 HB3 TYR 51 HB1 TYR 51 -19.082 4.083 3.417 393 HD1 TYR 51 HD2 TYR 51 -20.669 7.446 2.972 394 HD2 TYR 51 HD1 TYR 51 -21.227 3.256 3.437 395 HE1 TYR 51 HE2 TYR 51 -23.103 7.766 2.855 396 HE2 TYR 51 HE1 TYR 51 -23.661 3.565 3.321 397 HH TYR 51 HH TYR 51 -25.109 6.475 2.306 398 HA PRO 52 HA PRO 52 -18.218 4.766 8.487 399 HB2 PRO 52 HB2 PRO 52 -21.181 4.488 8.647 400 HB3 PRO 52 HB1 PRO 52 -20.048 5.163 9.824 401 HG2 PRO 52 HG2 PRO 52 -21.589 6.766 8.371 402 HG3 PRO 52 HG1 PRO 52 -19.904 7.197 8.719 403 HD2 PRO 52 HD2 PRO 52 -21.107 6.145 6.196 404 HD3 PRO 52 HD1 PRO 52 -19.815 7.343 6.421 405 H LYS 53 HN LYS 53 -17.777 2.707 8.977 406 HA LYS 53 HA LYS 53 -18.200 0.702 7.044 407 HB2 LYS 53 HB2 LYS 53 -17.346 0.350 9.923 408 HB3 LYS 53 HB1 LYS 53 -17.164 -0.839 8.647 409 HG2 LYS 53 HG2 LYS 53 -15.798 1.845 8.747 410 HG3 LYS 53 HG1 LYS 53 -15.067 0.298 9.166 411 HD2 LYS 53 HD2 LYS 53 -14.328 0.542 7.005 412 HD3 LYS 53 HD1 LYS 53 -15.827 -0.348 6.727 413 HE2 LYS 53 HE2 LYS 53 -15.575 1.555 5.181 414 HE3 LYS 53 HE1 LYS 53 -16.991 1.721 6.225 415 HZ1 LYS 53 HZ1 LYS 53 -14.370 3.057 6.675 416 HZ2 LYS 53 HZ2 LYS 53 -15.753 3.230 7.638 417 HZ3 LYS 53 HZ3 LYS 53 -15.761 3.793 6.045 418 H ASP 54 HN ASP 54 -20.042 1.651 9.796 419 HA ASP 54 HA ASP 54 -21.480 -0.653 10.391 420 HB2 ASP 54 HB2 ASP 54 -22.575 2.173 10.336 421 HB3 ASP 54 HB1 ASP 54 -23.223 0.820 11.254 422 H ALA 55 HN ALA 55 -22.018 1.788 7.912 423 HA ALA 55 HA ALA 55 -24.429 0.692 6.909 424 HB1 ALA 55 HB1 ALA 55 -23.810 3.026 6.547 425 HB2 ALA 55 HB2 ALA 55 -24.093 2.192 5.018 426 HB3 ALA 55 HB3 ALA 55 -22.445 2.509 5.557 427 H LEU 56 HN LEU 56 -21.042 0.341 6.043 428 HA LEU 56 HA LEU 56 -21.420 -1.144 3.688 429 HB2 LEU 56 HB2 LEU 56 -19.112 -0.996 5.614 430 HB3 LEU 56 HB1 LEU 56 -19.062 -1.986 4.169 431 HG LEU 56 HG LEU 56 -17.915 0.040 3.695 432 HD11 LEU 56 HD11 LEU 56 -19.153 0.938 1.838 433 HD12 LEU 56 HD12 LEU 56 -20.658 0.278 2.484 434 HD13 LEU 56 HD13 LEU 56 -19.387 -0.810 1.917 435 HD21 LEU 56 HD21 LEU 56 -18.993 2.248 3.889 436 HD22 LEU 56 HD22 LEU 56 -18.748 1.458 5.444 437 HD23 LEU 56 HD23 LEU 56 -20.353 1.482 4.712 438 H ARG 57 HN ARG 57 -21.040 -2.135 7.052 439 HA ARG 57 HA ARG 57 -20.920 -4.897 6.655 440 HB2 ARG 57 HB2 ARG 57 -22.029 -3.317 8.976 441 HB3 ARG 57 HB1 ARG 57 -21.760 -5.056 9.007 442 HG2 ARG 57 HG2 ARG 57 -19.367 -4.656 8.554 443 HG3 ARG 57 HG1 ARG 57 -19.668 -2.922 8.636 444 HD2 ARG 57 HD2 ARG 57 -20.298 -3.057 10.931 445 HD3 ARG 57 HD1 ARG 57 -20.313 -4.819 10.885 446 HE ARG 57 HE ARG 57 -17.740 -4.052 10.216 447 HH11 ARG 57 HH11 ARG 57 -19.878 -3.672 12.964 448 HH12 ARG 57 HH12 ARG 57 -18.581 -3.668 14.119 449 HH21 ARG 57 HH21 ARG 57 -16.031 -4.029 11.757 450 HH22 ARG 57 HH22 ARG 57 -16.426 -3.870 13.448 451 H LEU 58 HN LEU 58 -23.584 -2.806 6.160 452 HA LEU 58 HA LEU 58 -25.406 -5.127 6.104 453 HB2 LEU 58 HB2 LEU 58 -25.924 -2.210 6.595 454 HB3 LEU 58 HB1 LEU 58 -27.206 -3.270 6.051 455 HG LEU 58 HG LEU 58 -26.790 -4.682 8.090 456 HD11 LEU 58 HD11 LEU 58 -24.527 -3.965 8.605 457 HD12 LEU 58 HD12 LEU 58 -25.603 -3.642 9.964 458 HD13 LEU 58 HD13 LEU 58 -25.098 -2.324 8.906 459 HD21 LEU 58 HD21 LEU 58 -27.571 -1.810 8.574 460 HD22 LEU 58 HD22 LEU 58 -28.018 -3.200 9.565 461 HD23 LEU 58 HD23 LEU 58 -28.625 -3.062 7.915 462 H LYS 59 HN LYS 59 -23.929 -2.628 4.263 463 HA LYS 59 HA LYS 59 -25.736 -3.064 1.995 464 HB2 LYS 59 HB2 LYS 59 -25.506 -0.751 2.537 465 HB3 LYS 59 HB1 LYS 59 -23.757 -0.880 2.629 466 HG2 LYS 59 HG2 LYS 59 -23.786 -1.418 0.163 467 HG3 LYS 59 HG1 LYS 59 -25.488 -0.954 0.175 468 HD2 LYS 59 HD2 LYS 59 -23.380 0.876 1.265 469 HD3 LYS 59 HD1 LYS 59 -23.729 0.817 -0.463 470 HE2 LYS 59 HE2 LYS 59 -25.840 1.286 1.632 471 HE3 LYS 59 HE1 LYS 59 -24.951 2.594 0.852 472 HZ1 LYS 59 HZ1 LYS 59 -27.022 2.246 -0.280 473 HZ2 LYS 59 HZ2 LYS 59 -26.690 0.594 -0.498 474 HZ3 LYS 59 HZ3 LYS 59 -25.756 1.763 -1.299 475 H ARG 60 HN ARG 60 -22.260 -2.322 2.248 476 HA ARG 60 HA ARG 60 -21.772 -4.445 0.272 477 HB2 ARG 60 HB2 ARG 60 -20.530 -1.690 0.371 478 HB3 ARG 60 HB1 ARG 60 -19.998 -2.985 -0.694 479 HG2 ARG 60 HG2 ARG 60 -22.747 -1.757 -0.685 480 HG3 ARG 60 HG1 ARG 60 -21.460 -1.388 -1.837 481 HD2 ARG 60 HD2 ARG 60 -21.524 -3.557 -2.756 482 HD3 ARG 60 HD1 ARG 60 -22.480 -4.181 -1.414 483 HE ARG 60 HE ARG 60 -23.847 -2.120 -2.833 484 HH11 ARG 60 HH11 ARG 60 -23.035 -5.518 -2.916 485 HH12 ARG 60 HH12 ARG 60 -24.414 -5.968 -3.870 486 HH21 ARG 60 HH21 ARG 60 -25.682 -2.691 -4.063 487 HH22 ARG 60 HH22 ARG 60 -25.907 -4.347 -4.556 488 H GLN 61 HN GLN 61 -21.243 -5.799 1.962 489 HA GLN 61 HA GLN 61 -18.886 -5.121 3.549 490 HB2 GLN 61 HB2 GLN 61 -19.535 -7.304 4.732 491 HB3 GLN 61 HB1 GLN 61 -20.600 -5.922 4.941 492 HG2 GLN 61 HG2 GLN 61 -22.119 -6.816 3.272 493 HG3 GLN 61 HG1 GLN 61 -21.043 -8.187 3.011 494 HE21 GLN 61 HE21 GLN 61 -23.834 -8.081 3.902 495 HE22 GLN 61 HE22 GLN 61 -23.866 -8.921 5.418 496 H GLY 62 HN GLY 62 -16.976 -5.733 2.767 497 HA2 GLY 62 HA2 GLY 62 -16.571 -8.392 1.788 498 HA3 GLY 62 HA1 GLY 62 -16.525 -7.195 0.507 499 H VAL 63 HN VAL 63 -14.467 -9.013 1.792 500 HA VAL 63 HA VAL 63 -12.488 -6.953 2.492 501 HB VAL 63 HB VAL 63 -12.202 -9.965 2.660 502 HG11 VAL 63 HG11 VAL 63 -10.241 -9.473 4.047 503 HG12 VAL 63 HG12 VAL 63 -10.481 -7.748 3.763 504 HG13 VAL 63 HG13 VAL 63 -10.078 -8.817 2.418 505 HG21 VAL 63 HG21 VAL 63 -12.783 -8.000 4.872 506 HG22 VAL 63 HG22 VAL 63 -12.462 -9.722 5.075 507 HG23 VAL 63 HG23 VAL 63 -13.909 -9.190 4.219 508 H GLY 64 HN GLY 64 -11.134 -6.308 0.927 509 HA2 GLY 64 HA2 GLY 64 -10.401 -8.250 -1.149 510 HA3 GLY 64 HA1 GLY 64 -11.051 -6.691 -1.632 511 H GLN 65 HN GLN 65 -8.602 -7.533 -2.459 512 HA GLN 65 HA GLN 65 -6.743 -5.843 -0.952 513 HB2 GLN 65 HB2 GLN 65 -6.240 -7.956 -3.059 514 HB3 GLN 65 HB1 GLN 65 -4.994 -6.896 -2.421 515 HG2 GLN 65 HG2 GLN 65 -5.385 -7.819 -0.179 516 HG3 GLN 65 HG1 GLN 65 -6.584 -8.918 -0.864 517 HE21 GLN 65 HE21 GLN 65 -3.213 -8.149 -0.626 518 HE22 GLN 65 HE22 GLN 65 -2.613 -9.621 -1.302 519 H VAL 66 HN VAL 66 -5.735 -4.144 -1.990 520 HA VAL 66 HA VAL 66 -6.719 -3.514 -4.674 521 HB VAL 66 HB VAL 66 -8.142 -2.420 -2.974 522 HG11 VAL 66 HG11 VAL 66 -7.283 -0.577 -1.631 523 HG12 VAL 66 HG12 VAL 66 -5.643 -0.977 -2.150 524 HG13 VAL 66 HG13 VAL 66 -6.571 -2.129 -1.190 525 HG21 VAL 66 HG21 VAL 66 -7.833 -1.394 -5.157 526 HG22 VAL 66 HG22 VAL 66 -6.496 -0.438 -4.511 527 HG23 VAL 66 HG23 VAL 66 -8.131 -0.218 -3.877 528 H ARG 67 HN ARG 67 -5.009 -3.254 -5.952 529 HA ARG 67 HA ARG 67 -2.472 -2.420 -4.714 530 HB2 ARG 67 HB2 ARG 67 -2.543 -4.685 -5.770 531 HB3 ARG 67 HB1 ARG 67 -2.894 -3.916 -7.312 532 HG2 ARG 67 HG2 ARG 67 -0.774 -2.852 -7.357 533 HG3 ARG 67 HG1 ARG 67 -0.435 -3.329 -5.694 534 HD2 ARG 67 HD2 ARG 67 -0.381 -5.677 -6.367 535 HD3 ARG 67 HD1 ARG 67 -0.751 -5.216 -8.030 536 HE ARG 67 HE ARG 67 1.414 -3.847 -7.807 537 HH11 ARG 67 HH11 ARG 67 0.886 -7.018 -6.360 538 HH12 ARG 67 HH12 ARG 67 2.586 -7.384 -6.280 539 HH21 ARG 67 HH21 ARG 67 3.597 -4.343 -7.723 540 HH22 ARG 67 HH22 ARG 67 4.131 -5.865 -7.061 541 H PHE 68 HN PHE 68 -1.316 -0.700 -5.601 542 HA PHE 68 HA PHE 68 -2.277 0.667 -7.921 543 HB2 PHE 68 HB2 PHE 68 -2.784 2.785 -6.539 544 HB3 PHE 68 HB1 PHE 68 -4.008 1.525 -6.609 545 HD1 PHE 68 HD1 PHE 68 -1.031 2.377 -4.480 546 HD2 PHE 68 HD2 PHE 68 -5.092 1.096 -4.673 547 HE1 PHE 68 HE1 PHE 68 -1.137 2.309 -2.021 548 HE2 PHE 68 HE2 PHE 68 -5.198 1.035 -2.220 549 HZ PHE 68 HZ PHE 68 -3.223 1.640 -0.892 550 H THR 69 HN THR 69 -1.216 2.821 -8.158 551 HA THR 69 HA THR 69 1.442 2.904 -6.865 552 HB THR 69 HB THR 69 0.799 4.095 -9.565 553 HG1 THR 69 HG1 THR 69 2.176 1.644 -9.182 554 HG21 THR 69 HG21 THR 69 3.251 4.022 -9.805 555 HG22 THR 69 HG22 THR 69 3.379 3.368 -8.169 556 HG23 THR 69 HG23 THR 69 2.748 4.996 -8.423 557 H LEU 70 HN LEU 70 1.922 4.722 -5.815 558 HA LEU 70 HA LEU 70 -0.166 6.788 -5.797 559 HB2 LEU 70 HB2 LEU 70 1.689 5.858 -3.612 560 HB3 LEU 70 HB1 LEU 70 0.556 7.195 -3.462 561 HG LEU 70 HG LEU 70 -0.300 4.383 -4.137 562 HD11 LEU 70 HD11 LEU 70 -1.105 4.433 -1.699 563 HD12 LEU 70 HD12 LEU 70 0.090 5.715 -1.473 564 HD13 LEU 70 HD13 LEU 70 0.602 4.109 -2.007 565 HD21 LEU 70 HD21 LEU 70 -2.498 5.195 -3.481 566 HD22 LEU 70 HD22 LEU 70 -1.834 6.169 -4.795 567 HD23 LEU 70 HD23 LEU 70 -1.824 6.789 -3.141 568 H ASP 71 HN ASP 71 0.325 8.880 -5.959 569 HA ASP 71 HA ASP 71 2.969 9.620 -6.847 570 HB2 ASP 71 HB2 ASP 71 0.747 10.548 -7.749 571 HB3 ASP 71 HB1 ASP 71 0.671 11.500 -6.266 572 H ARG 72 HN ARG 72 4.126 11.461 -5.851 573 HA ARG 72 HA ARG 72 4.729 11.053 -3.175 574 HB2 ARG 72 HB2 ARG 72 5.044 13.646 -4.695 575 HB3 ARG 72 HB1 ARG 72 5.942 13.153 -3.268 576 HG2 ARG 72 HG2 ARG 72 6.994 11.360 -4.523 577 HG3 ARG 72 HG1 ARG 72 6.066 11.804 -5.958 578 HD2 ARG 72 HD2 ARG 72 8.076 13.533 -4.522 579 HD3 ARG 72 HD1 ARG 72 8.315 12.722 -6.070 580 HE ARG 72 HE ARG 72 6.401 14.161 -6.869 581 HH11 ARG 72 HH11 ARG 72 8.488 15.157 -4.242 582 HH12 ARG 72 HH12 ARG 72 8.272 16.858 -4.537 583 HH21 ARG 72 HH21 ARG 72 6.107 16.402 -7.266 584 HH22 ARG 72 HH22 ARG 72 6.931 17.559 -6.264 585 H GLN 73 HN GLN 73 2.400 13.198 -4.668 586 HA GLN 73 HA GLN 73 1.812 14.624 -2.231 587 HB2 GLN 73 HB2 GLN 73 0.108 15.767 -3.600 588 HB3 GLN 73 HB1 GLN 73 1.692 15.787 -4.365 589 HG2 GLN 73 HG2 GLN 73 0.954 13.807 -5.719 590 HG3 GLN 73 HG1 GLN 73 -0.666 14.062 -5.072 591 HE21 GLN 73 HE21 GLN 73 1.551 16.655 -5.841 592 HE22 GLN 73 HE22 GLN 73 0.663 17.269 -7.195 593 H GLY 74 HN GLY 74 1.098 11.600 -3.166 594 HA2 GLY 74 HA2 GLY 74 -0.383 10.085 -2.237 595 HA3 GLY 74 HA1 GLY 74 -1.168 11.415 -1.403 596 H HIS 75 HN HIS 75 -0.592 10.896 -4.844 597 HA HIS 75 HA HIS 75 -3.496 11.102 -5.274 598 HB2 HIS 75 HB2 HIS 75 -2.231 12.939 -6.293 599 HB3 HIS 75 HB1 HIS 75 -1.217 11.785 -7.150 600 HD1 HIS 75 HD1 HIS 75 -4.806 12.993 -7.048 601 HD2 HIS 75 HD2 HIS 75 -2.182 10.996 -9.587 602 HE1 HIS 75 HE1 HIS 75 -6.020 12.767 -9.244 603 HE2 HIS 75 HE2 HIS 75 -4.357 11.693 -10.803 604 H VAL 76 HN VAL 76 -4.480 9.305 -5.884 605 HA VAL 76 HA VAL 76 -3.264 6.897 -6.551 606 HB VAL 76 HB VAL 76 -5.584 6.991 -5.855 607 HG11 VAL 76 HG11 VAL 76 -6.141 8.352 -8.481 608 HG12 VAL 76 HG12 VAL 76 -6.267 9.072 -6.876 609 HG13 VAL 76 HG13 VAL 76 -7.364 7.774 -7.348 610 HG21 VAL 76 HG21 VAL 76 -5.306 5.888 -8.644 611 HG22 VAL 76 HG22 VAL 76 -6.575 5.461 -7.497 612 HG23 VAL 76 HG23 VAL 76 -4.895 5.056 -7.146 613 H LEU 77 HN LEU 77 -1.935 6.530 -8.192 614 HA LEU 77 HA LEU 77 -2.358 7.962 -10.709 615 HB2 LEU 77 HB2 LEU 77 0.028 6.441 -9.672 616 HB3 LEU 77 HB1 LEU 77 -0.053 7.195 -11.254 617 HG LEU 77 HG LEU 77 -0.340 8.724 -8.672 618 HD11 LEU 77 HD11 LEU 77 1.855 7.675 -8.784 619 HD12 LEU 77 HD12 LEU 77 1.963 9.422 -8.994 620 HD13 LEU 77 HD13 LEU 77 2.102 8.355 -10.394 621 HD21 LEU 77 HD21 LEU 77 -1.318 9.801 -10.636 622 HD22 LEU 77 HD22 LEU 77 0.207 9.614 -11.502 623 HD23 LEU 77 HD23 LEU 77 0.119 10.662 -10.086 624 H ALA 78 HN ALA 78 -1.961 4.740 -9.383 625 HA ALA 78 HA ALA 78 -2.951 3.610 -11.915 626 HB1 ALA 78 HB1 ALA 78 -0.512 3.225 -11.710 627 HB2 ALA 78 HB2 ALA 78 -1.444 1.727 -11.682 628 HB3 ALA 78 HB3 ALA 78 -0.801 2.390 -10.177 629 H VAL 79 HN VAL 79 -4.025 1.539 -11.655 630 HA VAL 79 HA VAL 79 -4.721 0.749 -8.954 631 HB VAL 79 HB VAL 79 -7.153 0.543 -9.634 632 HG11 VAL 79 HG11 VAL 79 -7.679 2.890 -9.112 633 HG12 VAL 79 HG12 VAL 79 -5.985 3.308 -9.365 634 HG13 VAL 79 HG13 VAL 79 -6.439 2.225 -8.048 635 HG21 VAL 79 HG21 VAL 79 -6.869 0.842 -12.044 636 HG22 VAL 79 HG22 VAL 79 -6.323 2.497 -11.776 637 HG23 VAL 79 HG23 VAL 79 -7.978 2.040 -11.377 638 H THR 80 HN THR 80 -4.448 -1.331 -8.837 639 HA THR 80 HA THR 80 -5.069 -3.016 -11.169 640 HB THR 80 HB THR 80 -2.849 -3.502 -9.166 641 HG1 THR 80 HG1 THR 80 -1.936 -2.007 -10.416 642 HG21 THR 80 HG21 THR 80 -3.573 -4.911 -11.738 643 HG22 THR 80 HG22 THR 80 -3.794 -5.548 -10.106 644 HG23 THR 80 HG23 THR 80 -2.169 -5.265 -10.732 645 H LEU 81 HN LEU 81 -6.763 -4.253 -10.687 646 HA LEU 81 HA LEU 81 -7.611 -4.514 -7.954 647 HB2 LEU 81 HB2 LEU 81 -9.216 -4.179 -9.810 648 HB3 LEU 81 HB1 LEU 81 -8.791 -5.768 -10.428 649 HG LEU 81 HG LEU 81 -9.549 -6.727 -8.233 650 HD11 LEU 81 HD11 LEU 81 -10.605 -3.930 -7.843 651 HD12 LEU 81 HD12 LEU 81 -9.370 -4.736 -6.874 652 HD13 LEU 81 HD13 LEU 81 -11.030 -5.330 -6.858 653 HD21 LEU 81 HD21 LEU 81 -10.942 -6.818 -10.227 654 HD22 LEU 81 HD22 LEU 81 -11.588 -5.218 -9.865 655 HD23 LEU 81 HD23 LEU 81 -11.929 -6.571 -8.787 656 H VAL 82 HN VAL 82 -6.959 -5.997 -6.645 657 HA VAL 82 HA VAL 82 -5.901 -8.516 -7.723 658 HB VAL 82 HB VAL 82 -5.111 -8.417 -5.072 659 HG11 VAL 82 HG11 VAL 82 -3.740 -9.113 -6.973 660 HG12 VAL 82 HG12 VAL 82 -2.887 -7.917 -5.994 661 HG13 VAL 82 HG13 VAL 82 -3.633 -7.439 -7.517 662 HG21 VAL 82 HG21 VAL 82 -4.926 -5.650 -6.267 663 HG22 VAL 82 HG22 VAL 82 -4.098 -6.183 -4.800 664 HG23 VAL 82 HG23 VAL 82 -5.861 -6.114 -4.845 665 H SER 83 HN SER 83 -7.571 -7.324 -4.784 666 HA SER 83 HA SER 83 -9.302 -8.152 -3.573 667 HB2 SER 83 HB2 SER 83 -10.425 -8.047 -5.805 668 HB3 SER 83 HB1 SER 83 -9.985 -9.734 -6.062 669 HG SER 83 HG SER 83 -12.093 -9.572 -5.239 670 H SER 84 HN SER 84 -10.456 -10.456 -3.046 671 HA SER 84 HA SER 84 -8.542 -12.623 -3.005 672 HB2 SER 84 HB2 SER 84 -9.355 -11.312 -0.400 673 HB3 SER 84 HB1 SER 84 -8.362 -12.760 -0.572 674 HG SER 84 HG SER 84 -7.141 -11.046 -2.037 675 H ALA 85 HN ALA 85 -11.256 -11.670 -0.879 676 HA ALA 85 HA ALA 85 -12.094 -14.326 -0.555 677 HB1 ALA 85 HB1 ALA 85 -13.998 -13.416 0.638 678 HB2 ALA 85 HB2 ALA 85 -13.658 -11.813 -0.013 679 HB3 ALA 85 HB3 ALA 85 -12.516 -12.575 1.092 680 H GLY 86 HN GLY 86 -14.026 -11.733 -2.070 681 HA2 GLY 86 HA2 GLY 86 -14.760 -12.879 -4.419 682 HA3 GLY 86 HA1 GLY 86 -15.766 -13.707 -3.232 683 H LEU 87 HN LEU 87 -15.028 -10.600 -4.692 684 HA LEU 87 HA LEU 87 -17.572 -9.602 -3.578 685 HB2 LEU 87 HB2 LEU 87 -15.307 -7.796 -4.351 686 HB3 LEU 87 HB1 LEU 87 -16.711 -7.404 -3.408 687 HG LEU 87 HG LEU 87 -14.947 -7.357 -1.893 688 HD11 LEU 87 HD11 LEU 87 -16.829 -8.583 -1.015 689 HD12 LEU 87 HD12 LEU 87 -15.311 -9.201 -0.361 690 HD13 LEU 87 HD13 LEU 87 -16.154 -10.092 -1.629 691 HD21 LEU 87 HD21 LEU 87 -13.274 -8.437 -3.334 692 HD22 LEU 87 HD22 LEU 87 -13.962 -10.009 -2.923 693 HD23 LEU 87 HD23 LEU 87 -13.219 -9.016 -1.670 694 HA PRO 88 HA PRO 88 -18.062 -9.431 -8.126 695 HB2 PRO 88 HB2 PRO 88 -20.884 -9.849 -7.619 696 HB3 PRO 88 HB1 PRO 88 -19.748 -10.899 -8.466 697 HG2 PRO 88 HG2 PRO 88 -20.859 -11.517 -6.051 698 HG3 PRO 88 HG1 PRO 88 -19.286 -12.127 -6.596 699 HD2 PRO 88 HD2 PRO 88 -19.901 -9.883 -4.712 700 HD3 PRO 88 HD1 PRO 88 -18.620 -11.112 -4.624 701 H SER 89 HN SER 89 -21.086 -8.514 -6.604 702 HA SER 89 HA SER 89 -21.073 -5.942 -7.845 703 HB2 SER 89 HB2 SER 89 -22.953 -7.016 -5.733 704 HB3 SER 89 HB1 SER 89 -23.254 -5.669 -6.833 705 HG SER 89 HG SER 89 -22.753 -7.431 -8.507 706 H LEU 90 HN LEU 90 -19.879 -7.207 -4.923 707 HA LEU 90 HA LEU 90 -20.078 -4.855 -3.320 708 HB2 LEU 90 HB2 LEU 90 -18.042 -7.077 -3.041 709 HB3 LEU 90 HB1 LEU 90 -18.557 -5.948 -1.807 710 HG LEU 90 HG LEU 90 -20.458 -7.929 -3.024 711 HD11 LEU 90 HD11 LEU 90 -19.914 -9.479 -1.314 712 HD12 LEU 90 HD12 LEU 90 -18.867 -8.316 -0.502 713 HD13 LEU 90 HD13 LEU 90 -18.384 -8.995 -2.062 714 HD21 LEU 90 HD21 LEU 90 -21.684 -7.566 -0.960 715 HD22 LEU 90 HD22 LEU 90 -21.410 -6.030 -1.783 716 HD23 LEU 90 HD23 LEU 90 -20.428 -6.471 -0.383 717 H ASP 91 HN ASP 91 -17.698 -6.140 -5.563 718 HA ASP 91 HA ASP 91 -15.417 -4.783 -4.761 719 HB2 ASP 91 HB2 ASP 91 -15.487 -6.600 -6.457 720 HB3 ASP 91 HB1 ASP 91 -16.190 -5.466 -7.604 721 H ARG 92 HN ARG 92 -17.781 -3.825 -7.210 722 HA ARG 92 HA ARG 92 -16.578 -1.508 -8.105 723 HB2 ARG 92 HB2 ARG 92 -18.915 -0.784 -8.714 724 HB3 ARG 92 HB1 ARG 92 -18.465 -2.389 -9.279 725 HG2 ARG 92 HG2 ARG 92 -19.738 -3.435 -7.562 726 HG3 ARG 92 HG1 ARG 92 -20.012 -1.896 -6.752 727 HD2 ARG 92 HD2 ARG 92 -22.001 -2.544 -7.913 728 HD3 ARG 92 HD1 ARG 92 -21.302 -1.134 -8.709 729 HE ARG 92 HE ARG 92 -20.899 -3.865 -9.755 730 HH11 ARG 92 HH11 ARG 92 -21.829 -0.523 -10.183 731 HH12 ARG 92 HH12 ARG 92 -22.096 -0.672 -11.890 732 HH21 ARG 92 HH21 ARG 92 -21.246 -4.075 -12.005 733 HH22 ARG 92 HH22 ARG 92 -21.785 -2.701 -12.927 734 H GLU 93 HN GLU 93 -18.648 -1.981 -5.279 735 HA GLU 93 HA GLU 93 -18.950 0.802 -4.737 736 HB2 GLU 93 HB2 GLU 93 -19.601 -1.751 -3.295 737 HB3 GLU 93 HB1 GLU 93 -19.942 -0.182 -2.622 738 HG2 GLU 93 HG2 GLU 93 -20.969 -1.076 -5.290 739 HG3 GLU 93 HG1 GLU 93 -21.847 -1.337 -3.788 740 H ILE 94 HN ILE 94 -17.401 -1.855 -2.955 741 HA ILE 94 HA ILE 94 -16.284 -0.167 -0.993 742 HB ILE 94 HB ILE 94 -14.985 -2.099 -0.235 743 HG12 ILE 94 HG12 ILE 94 -16.099 -3.509 -2.675 744 HG13 ILE 94 HG11 ILE 94 -14.412 -3.069 -2.424 745 HG21 ILE 94 HG21 ILE 94 -17.299 -1.861 0.463 746 HG22 ILE 94 HG22 ILE 94 -16.866 -3.563 0.302 747 HG23 ILE 94 HG23 ILE 94 -17.835 -2.776 -0.945 748 HD11 ILE 94 HD11 ILE 94 -16.002 -5.041 -0.802 749 HD12 ILE 94 HD12 ILE 94 -14.331 -4.571 -0.488 750 HD13 ILE 94 HD13 ILE 94 -14.745 -5.412 -1.983 751 H GLN 95 HN GLN 95 -14.852 -1.620 -3.923 752 HA GLN 95 HA GLN 95 -12.286 -0.654 -3.292 753 HB2 GLN 95 HB2 GLN 95 -13.296 -1.237 -6.057 754 HB3 GLN 95 HB1 GLN 95 -11.650 -1.174 -5.513 755 HG2 GLN 95 HG2 GLN 95 -13.496 -3.164 -4.306 756 HG3 GLN 95 HG1 GLN 95 -12.739 -3.479 -5.866 757 HE21 GLN 95 HE21 GLN 95 -12.412 -4.857 -3.321 758 HE22 GLN 95 HE22 GLN 95 -10.729 -4.770 -2.945 759 H ALA 96 HN ALA 96 -14.905 0.623 -5.424 760 HA ALA 96 HA ALA 96 -13.355 2.675 -6.534 761 HB1 ALA 96 HB1 ALA 96 -15.432 3.780 -7.119 762 HB2 ALA 96 HB2 ALA 96 -16.314 2.765 -5.978 763 HB3 ALA 96 HB3 ALA 96 -15.555 2.043 -7.397 764 H LEU 97 HN LEU 97 -15.050 2.544 -3.482 765 HA LEU 97 HA LEU 97 -14.939 5.109 -2.578 766 HB2 LEU 97 HB2 LEU 97 -16.016 3.206 -1.479 767 HB3 LEU 97 HB1 LEU 97 -14.444 2.494 -1.154 768 HG LEU 97 HG LEU 97 -14.415 5.084 -0.159 769 HD11 LEU 97 HD11 LEU 97 -16.857 3.536 0.679 770 HD12 LEU 97 HD12 LEU 97 -16.826 5.104 -0.134 771 HD13 LEU 97 HD13 LEU 97 -16.237 4.956 1.522 772 HD21 LEU 97 HD21 LEU 97 -14.234 3.837 2.044 773 HD22 LEU 97 HD22 LEU 97 -13.052 3.434 0.798 774 HD23 LEU 97 HD23 LEU 97 -14.429 2.363 1.091 775 H VAL 98 HN VAL 98 -12.521 2.548 -2.153 776 HA VAL 98 HA VAL 98 -10.496 4.425 -1.237 777 HB VAL 98 HB VAL 98 -10.329 1.456 -1.770 778 HG11 VAL 98 HG11 VAL 98 -8.141 2.545 -1.864 779 HG12 VAL 98 HG12 VAL 98 -8.290 1.488 -0.462 780 HG13 VAL 98 HG13 VAL 98 -8.418 3.238 -0.265 781 HG21 VAL 98 HG21 VAL 98 -11.926 1.963 -0.022 782 HG22 VAL 98 HG22 VAL 98 -10.740 2.972 0.804 783 HG23 VAL 98 HG23 VAL 98 -10.479 1.232 0.674 784 H LYS 99 HN LYS 99 -11.283 2.728 -4.147 785 HA LYS 99 HA LYS 99 -8.721 2.529 -5.308 786 HB2 LYS 99 HB2 LYS 99 -10.792 1.094 -5.829 787 HB3 LYS 99 HB1 LYS 99 -11.383 2.466 -6.756 788 HG2 LYS 99 HG2 LYS 99 -9.394 2.346 -8.200 789 HG3 LYS 99 HG1 LYS 99 -8.853 0.930 -7.296 790 HD2 LYS 99 HD2 LYS 99 -11.487 1.101 -8.757 791 HD3 LYS 99 HD1 LYS 99 -10.019 0.394 -9.436 792 HE2 LYS 99 HE2 LYS 99 -9.974 -1.292 -7.733 793 HE3 LYS 99 HE1 LYS 99 -11.305 -0.526 -6.869 794 HZ1 LYS 99 HZ1 LYS 99 -12.728 -0.983 -8.812 795 HZ2 LYS 99 HZ2 LYS 99 -12.124 -2.400 -8.105 796 HZ3 LYS 99 HZ3 LYS 99 -11.446 -1.822 -9.547 797 H ARG 100 HN ARG 100 -11.123 5.040 -5.268 798 HA ARG 100 HA ARG 100 -9.603 6.507 -7.305 799 HB2 ARG 100 HB2 ARG 100 -11.994 6.316 -7.744 800 HB3 ARG 100 HB1 ARG 100 -12.359 7.051 -6.191 801 HG2 ARG 100 HG2 ARG 100 -12.573 8.566 -8.171 802 HG3 ARG 100 HG1 ARG 100 -11.516 9.158 -6.890 803 HD2 ARG 100 HD2 ARG 100 -10.470 9.572 -9.016 804 HD3 ARG 100 HD1 ARG 100 -9.568 8.317 -8.173 805 HE ARG 100 HE ARG 100 -11.519 7.697 -10.305 806 HH11 ARG 100 HH11 ARG 100 -8.371 7.280 -8.814 807 HH12 ARG 100 HH12 ARG 100 -7.813 6.164 -10.014 808 HH21 ARG 100 HH21 ARG 100 -10.759 6.242 -11.894 809 HH22 ARG 100 HH22 ARG 100 -9.150 5.587 -11.767 810 H ALA 101 HN ALA 101 -10.202 6.374 -3.936 811 HA ALA 101 HA ALA 101 -8.966 9.026 -3.613 812 HB1 ALA 101 HB1 ALA 101 -9.971 9.206 -1.442 813 HB2 ALA 101 HB2 ALA 101 -10.576 7.544 -1.533 814 HB3 ALA 101 HB3 ALA 101 -11.230 8.783 -2.607 815 H SER 102 HN SER 102 -7.296 6.951 -4.250 816 HA SER 102 HA SER 102 -6.201 5.823 -1.838 817 HB2 SER 102 HB2 SER 102 -4.892 5.797 -4.553 818 HB3 SER 102 HB1 SER 102 -4.667 4.665 -3.224 819 HG SER 102 HG SER 102 -7.206 4.554 -3.705 820 HA PRO 103 HA PRO 103 -3.581 9.432 -1.444 821 HB2 PRO 103 HB2 PRO 103 -3.756 9.570 1.234 822 HB3 PRO 103 HB1 PRO 103 -5.083 10.068 0.181 823 HG2 PRO 103 HG2 PRO 103 -4.892 7.741 1.948 824 HG3 PRO 103 HG1 PRO 103 -6.325 8.465 1.199 825 HD2 PRO 103 HD2 PRO 103 -4.757 6.162 0.329 826 HD3 PRO 103 HD1 PRO 103 -6.333 6.730 -0.262 827 H LEU 104 HN LEU 104 -1.685 9.925 -0.014 828 HA LEU 104 HA LEU 104 -0.176 7.600 0.915 829 HB2 LEU 104 HB2 LEU 104 0.435 8.001 -1.469 830 HB3 LEU 104 HB1 LEU 104 0.898 9.637 -1.051 831 HG LEU 104 HG LEU 104 2.571 8.532 0.573 832 HD11 LEU 104 HD11 LEU 104 2.179 6.225 -1.318 833 HD12 LEU 104 HD12 LEU 104 1.550 6.261 0.326 834 HD13 LEU 104 HD13 LEU 104 3.293 6.322 0.046 835 HD21 LEU 104 HD21 LEU 104 2.940 8.299 -2.407 836 HD22 LEU 104 HD22 LEU 104 4.225 8.356 -1.200 837 HD23 LEU 104 HD23 LEU 104 3.182 9.757 -1.445 838 HA PRO 105 HA PRO 105 -0.039 11.164 3.787 839 HB2 PRO 105 HB2 PRO 105 0.429 9.529 5.998 840 HB3 PRO 105 HB1 PRO 105 -1.128 10.172 5.485 841 HG2 PRO 105 HG2 PRO 105 -0.108 7.455 5.306 842 HG3 PRO 105 HG1 PRO 105 -1.758 8.050 5.110 843 HD2 PRO 105 HD2 PRO 105 -0.009 7.180 3.067 844 HD3 PRO 105 HD1 PRO 105 -1.601 7.944 2.879 845 H THR 106 HN THR 106 2.020 8.381 4.657 846 HA THR 106 HA THR 106 4.288 10.108 5.001 847 HB THR 106 HB THR 106 4.160 8.210 6.473 848 HG1 THR 106 HG1 THR 106 6.255 8.049 6.339 849 HG21 THR 106 HG21 THR 106 4.300 5.893 5.665 850 HG22 THR 106 HG22 THR 106 4.203 6.474 4.003 851 HG23 THR 106 HG23 THR 106 2.837 6.698 5.095 852 HA PRO 107 HA PRO 107 5.257 9.795 0.656 853 HB2 PRO 107 HB2 PRO 107 7.308 11.772 1.108 854 HB3 PRO 107 HB1 PRO 107 5.748 11.980 0.310 855 HG2 PRO 107 HG2 PRO 107 6.408 13.127 2.711 856 HG3 PRO 107 HG1 PRO 107 4.747 12.772 2.204 857 HD2 PRO 107 HD2 PRO 107 6.544 11.223 4.037 858 HD3 PRO 107 HD1 PRO 107 4.802 11.557 4.180 859 HA PRO 108 HA PRO 108 8.832 7.171 1.657 860 HB2 PRO 108 HB2 PRO 108 8.296 5.191 -0.024 861 HB3 PRO 108 HB1 PRO 108 7.273 5.440 1.403 862 HG2 PRO 108 HG2 PRO 108 6.799 6.334 -1.429 863 HG3 PRO 108 HG1 PRO 108 5.684 5.475 -0.347 864 HD2 PRO 108 HD2 PRO 108 5.638 8.177 -0.693 865 HD3 PRO 108 HD1 PRO 108 5.160 7.391 0.826 866 H ALA 109 HN ALA 109 9.770 9.237 0.549 867 HA ALA 109 HA ALA 109 10.355 9.272 -2.191 868 HB1 ALA 109 HB1 ALA 109 12.145 10.826 -1.634 869 HB2 ALA 109 HB2 ALA 109 12.037 10.368 0.065 870 HB3 ALA 109 HB3 ALA 109 10.691 11.205 -0.708 871 H ASP 110 HN ASP 110 12.029 7.864 0.549 872 HA ASP 110 HA ASP 110 14.273 6.869 -0.855 873 HB2 ASP 110 HB2 ASP 110 14.587 5.464 1.189 874 HB3 ASP 110 HB1 ASP 110 14.372 7.177 1.534 875 H ALA 111 HN ALA 111 11.156 6.019 -1.290 876 HA ALA 111 HA ALA 111 11.797 3.197 -1.819 877 HB1 ALA 111 HB1 ALA 111 9.976 3.520 -0.226 878 HB2 ALA 111 HB2 ALA 111 9.399 2.767 -1.715 879 HB3 ALA 111 HB3 ALA 111 9.098 4.481 -1.418 880 H TYR 112 HN TYR 112 10.531 6.177 -3.220 881 HA TYR 112 HA TYR 112 10.193 4.701 -5.730 882 HB2 TYR 112 HB2 TYR 112 8.378 6.245 -6.354 883 HB3 TYR 112 HB1 TYR 112 8.040 5.191 -5.002 884 HD1 TYR 112 HD2 TYR 112 9.954 8.365 -4.701 885 HD2 TYR 112 HD1 TYR 112 6.246 6.370 -4.145 886 HE1 TYR 112 HE2 TYR 112 9.128 10.268 -3.388 887 HE2 TYR 112 HE1 TYR 112 5.404 8.251 -2.843 888 HH TYR 112 HH TYR 112 6.276 10.110 -1.521 889 H VAL 113 HN VAL 113 12.353 6.545 -4.593 890 HA VAL 113 HA VAL 113 12.573 8.549 -6.620 891 HB VAL 113 HB VAL 113 15.085 8.461 -6.053 892 HG11 VAL 113 HG11 VAL 113 13.094 9.130 -3.889 893 HG12 VAL 113 HG12 VAL 113 13.579 10.179 -5.221 894 HG13 VAL 113 HG13 VAL 113 14.752 9.726 -3.986 895 HG21 VAL 113 HG21 VAL 113 15.714 7.403 -3.971 896 HG22 VAL 113 HG22 VAL 113 15.050 6.189 -5.064 897 HG23 VAL 113 HG23 VAL 113 14.071 6.808 -3.735 898 H ASN 114 HN ASN 114 12.177 7.683 -8.521 899 HA ASN 114 HA ASN 114 13.808 6.493 -10.278 900 HB2 ASN 114 HB2 ASN 114 13.541 4.120 -10.218 901 HB3 ASN 114 HB1 ASN 114 13.964 4.574 -8.574 902 HD21 ASN 114 HD21 ASN 114 12.381 4.425 -6.948 903 HD22 ASN 114 HD22 ASN 114 10.950 3.485 -7.168 904 H GLY 115 HN GLY 115 10.706 6.689 -8.800 905 HA2 GLY 115 HA2 GLY 115 9.356 7.587 -11.061 906 HA3 GLY 115 HA1 GLY 115 9.078 5.853 -10.948 907 H THR 116 HN THR 116 8.000 5.018 -9.083 908 HA THR 116 HA THR 116 6.668 6.772 -7.243 909 HB THR 116 HB THR 116 4.372 5.795 -8.176 910 HG1 THR 116 HG1 THR 116 6.019 6.047 -10.491 911 HG21 THR 116 HG21 THR 116 5.754 8.245 -9.272 912 HG22 THR 116 HG22 THR 116 4.796 8.151 -7.794 913 HG23 THR 116 HG23 THR 116 4.022 7.931 -9.364 914 H VAL 117 HN VAL 117 4.792 5.330 -6.115 915 HA VAL 117 HA VAL 117 6.199 2.830 -5.476 916 HB VAL 117 HB VAL 117 4.687 2.884 -3.393 917 HG11 VAL 117 HG11 VAL 117 7.058 3.260 -3.241 918 HG12 VAL 117 HG12 VAL 117 6.213 4.412 -2.203 919 HG13 VAL 117 HG13 VAL 117 6.859 4.935 -3.759 920 HG21 VAL 117 HG21 VAL 117 4.422 5.762 -4.260 921 HG22 VAL 117 HG22 VAL 117 3.995 5.139 -2.667 922 HG23 VAL 117 HG23 VAL 117 3.117 4.587 -4.094 923 H GLU 118 HN GLU 118 5.408 1.198 -6.536 924 HA GLU 118 HA GLU 118 2.505 0.918 -6.886 925 HB2 GLU 118 HB2 GLU 118 4.316 0.757 -8.783 926 HB3 GLU 118 HB1 GLU 118 4.611 -0.841 -8.123 927 HG2 GLU 118 HG2 GLU 118 1.900 0.067 -9.028 928 HG3 GLU 118 HG1 GLU 118 3.070 -0.692 -10.105 929 H LEU 119 HN LEU 119 1.555 -0.269 -5.296 930 HA LEU 119 HA LEU 119 2.931 -2.578 -4.226 931 HB2 LEU 119 HB2 LEU 119 3.151 -1.840 -2.000 932 HB3 LEU 119 HB1 LEU 119 3.851 -0.595 -3.007 933 HG LEU 119 HG LEU 119 1.364 0.442 -2.687 934 HD11 LEU 119 HD11 LEU 119 1.938 -1.132 -0.190 935 HD12 LEU 119 HD12 LEU 119 0.595 -1.381 -1.306 936 HD13 LEU 119 HD13 LEU 119 0.694 0.108 -0.366 937 HD21 LEU 119 HD21 LEU 119 2.324 1.863 -0.972 938 HD22 LEU 119 HD22 LEU 119 3.515 1.558 -2.236 939 HD23 LEU 119 HD23 LEU 119 3.621 0.699 -0.699 940 H THR 120 HN THR 120 1.659 -3.849 -2.771 941 HA THR 120 HA THR 120 -1.187 -3.661 -3.415 942 HB THR 120 HB THR 120 0.354 -5.928 -2.134 943 HG1 THR 120 HG1 THR 120 1.009 -6.152 -4.140 944 HG21 THR 120 HG21 THR 120 -2.046 -5.899 -1.580 945 HG22 THR 120 HG22 THR 120 -1.621 -7.274 -2.603 946 HG23 THR 120 HG23 THR 120 -2.434 -5.872 -3.301 947 H LEU 121 HN LEU 121 -2.604 -2.943 -1.952 948 HA LEU 121 HA LEU 121 -2.023 -3.433 0.886 949 HB2 LEU 121 HB2 LEU 121 -3.105 -0.939 -0.400 950 HB3 LEU 121 HB1 LEU 121 -3.409 -1.304 1.290 951 HG LEU 121 HG LEU 121 -0.705 -0.919 0.006 952 HD11 LEU 121 HD11 LEU 121 -0.614 1.003 1.615 953 HD12 LEU 121 HD12 LEU 121 -2.347 0.780 1.862 954 HD13 LEU 121 HD13 LEU 121 -1.724 1.183 0.261 955 HD21 LEU 121 HD21 LEU 121 -0.631 -2.632 1.737 956 HD22 LEU 121 HD22 LEU 121 -1.426 -1.537 2.872 957 HD23 LEU 121 HD23 LEU 121 0.189 -1.162 2.269 958 HA PRO 122 HA PRO 122 -6.069 -5.225 0.621 959 HB2 PRO 122 HB2 PRO 122 -6.077 -5.855 3.379 960 HB3 PRO 122 HB1 PRO 122 -5.581 -6.904 2.051 961 HG2 PRO 122 HG2 PRO 122 -3.905 -5.887 4.034 962 HG3 PRO 122 HG1 PRO 122 -3.387 -6.587 2.492 963 HD2 PRO 122 HD2 PRO 122 -3.673 -3.721 3.269 964 HD3 PRO 122 HD1 PRO 122 -2.472 -4.492 2.209 965 H ILE 123 HN ILE 123 -7.815 -3.956 0.494 966 HA ILE 123 HA ILE 123 -8.442 -2.211 2.751 967 HB ILE 123 HB ILE 123 -10.367 -1.423 1.288 968 HG12 ILE 123 HG12 ILE 123 -8.740 -2.531 -1.022 969 HG13 ILE 123 HG11 ILE 123 -10.133 -3.394 -0.350 970 HG21 ILE 123 HG21 ILE 123 -8.918 0.103 0.036 971 HG22 ILE 123 HG22 ILE 123 -7.533 -0.925 0.414 972 HG23 ILE 123 HG23 ILE 123 -8.400 -0.100 1.711 973 HD11 ILE 123 HD11 ILE 123 -10.701 -2.066 -2.318 974 HD12 ILE 123 HD12 ILE 123 -10.181 -0.604 -1.475 975 HD13 ILE 123 HD13 ILE 123 -11.570 -1.521 -0.884 976 H ASP 124 HN ASP 124 -9.247 -3.417 4.307 977 HA ASP 124 HA ASP 124 -11.094 -5.564 3.620 978 HB2 ASP 124 HB2 ASP 124 -10.706 -6.356 5.927 979 HB3 ASP 124 HB1 ASP 124 -9.214 -6.200 5.012 980 H PHE 125 HN PHE 125 -13.159 -5.344 3.805 981 HA PHE 125 HA PHE 125 -14.281 -3.631 5.920 982 HB2 PHE 125 HB2 PHE 125 -15.585 -4.607 3.359 983 HB3 PHE 125 HB1 PHE 125 -16.367 -3.614 4.585 984 HD1 PHE 125 HD2 PHE 125 -13.848 -3.680 1.920 985 HD2 PHE 125 HD1 PHE 125 -15.927 -1.270 4.742 986 HE1 PHE 125 HE2 PHE 125 -13.039 -1.654 0.780 987 HE2 PHE 125 HE1 PHE 125 -15.125 0.761 3.608 988 HZ PHE 125 HZ PHE 125 -13.676 0.570 1.625 989 H SER 126 HN SER 126 -16.030 -4.605 7.160 990 HA SER 126 HA SER 126 -15.459 -7.268 7.880 991 HB2 SER 126 HB2 SER 126 -18.002 -5.777 8.528 992 HB3 SER 126 HB1 SER 126 -17.201 -7.026 9.486 993 HG SER 126 HG SER 126 -15.384 -5.487 9.588 994 H LEU 127 HN LEU 127 -15.781 -8.835 6.388 995 HA LEU 127 HA LEU 127 -18.246 -8.917 4.832 996 HB2 LEU 127 HB2 LEU 127 -15.638 -9.622 4.278 997 HB3 LEU 127 HB1 LEU 127 -16.384 -11.173 4.595 998 HG LEU 127 HG LEU 127 -17.335 -9.181 2.534 999 HD11 LEU 127 HD11 LEU 127 -15.151 -10.199 2.010 1000 HD12 LEU 127 HD12 LEU 127 -16.424 -10.667 0.883 1001 HD13 LEU 127 HD13 LEU 127 -15.895 -11.795 2.136 1002 HD21 LEU 127 HD21 LEU 127 -18.201 -12.017 3.061 1003 HD22 LEU 127 HD22 LEU 127 -18.735 -11.001 1.719 1004 HD23 LEU 127 HD23 LEU 127 -19.149 -10.563 3.380 1005 H ARG 128 HN ARG 128 -19.841 -9.492 6.314 1006 HA ARG 128 HA ARG 128 -19.518 -11.814 7.986 1007 HB2 ARG 128 HB2 ARG 128 -21.912 -10.082 7.359 1008 HB3 ARG 128 HB1 ARG 128 -21.938 -11.424 8.482 1009 HG2 ARG 128 HG2 ARG 128 -20.210 -10.283 9.831 1010 HG3 ARG 128 HG1 ARG 128 -20.319 -8.905 8.730 1011 HD2 ARG 128 HD2 ARG 128 -22.622 -10.031 10.326 1012 HD3 ARG 128 HD1 ARG 128 -21.664 -8.629 10.798 1013 HE ARG 128 HE ARG 128 -22.514 -7.896 8.375 1014 HH11 ARG 128 HH11 ARG 128 -24.258 -9.376 11.030 1015 HH12 ARG 128 HH12 ARG 128 -25.743 -8.525 10.703 1016 HH21 ARG 128 HH21 ARG 128 -24.465 -6.778 7.932 1017 HH22 ARG 128 HH22 ARG 128 -25.858 -7.045 8.946 1018 H GLY 129 HN GLY 129 -21.556 -10.947 5.200 1019 HA2 GLY 129 HA2 GLY 129 -21.338 -13.585 4.105 1020 HA3 GLY 129 HA1 GLY 129 -22.911 -13.294 4.832 1021 H ALA 130 HN ALA 130 -20.642 -12.104 2.416 1022 HA ALA 130 HA ALA 130 -22.897 -11.455 0.693 1023 HB1 ALA 130 HB1 ALA 130 -21.940 -9.275 0.080 1024 HB2 ALA 130 HB2 ALA 130 -20.704 -9.479 1.323 1025 HB3 ALA 130 HB3 ALA 130 -22.401 -9.335 1.782 1026 H GLY 131 HN GLY 131 -22.044 -10.917 -1.558 1027 HA2 GLY 131 HA2 GLY 131 -20.483 -11.295 -3.279 1028 HA3 GLY 131 HA1 GLY 131 -19.475 -12.183 -2.142 1029 H PHE 132 HN PHE 132 -21.058 -14.067 -1.140 1030 HA PHE 132 HA PHE 132 -21.793 -15.664 -3.463 1031 HB2 PHE 132 HB2 PHE 132 -21.890 -17.556 -1.756 1032 HB3 PHE 132 HB1 PHE 132 -20.304 -16.876 -2.087 1033 HD1 PHE 132 HD2 PHE 132 -19.368 -15.183 -0.417 1034 HD2 PHE 132 HD1 PHE 132 -22.709 -17.685 0.429 1035 HE1 PHE 132 HE2 PHE 132 -19.017 -14.836 1.996 1036 HE2 PHE 132 HE1 PHE 132 -22.358 -17.347 2.840 1037 HZ PHE 132 HZ PHE 132 -20.512 -15.921 3.625 Start of MODEL 20 1 H1 LYS 2 HT1 LYS 2 14.480 -28.003 11.400 2 H2 LYS 2 HT2 LYS 2 15.904 -27.349 10.742 3 H3 LYS 2 HT3 LYS 2 14.708 -27.984 9.727 4 HA LYS 2 HA LYS 2 14.790 -25.519 9.838 5 HB2 LYS 2 HB2 LYS 2 12.263 -26.951 10.671 6 HB3 LYS 2 HB1 LYS 2 12.306 -25.279 10.130 7 HG2 LYS 2 HG2 LYS 2 13.257 -26.070 7.971 8 HG3 LYS 2 HG1 LYS 2 13.018 -27.727 8.529 9 HD2 LYS 2 HD2 LYS 2 10.828 -25.670 8.293 10 HD3 LYS 2 HD1 LYS 2 11.195 -26.881 7.064 11 HE2 LYS 2 HE2 LYS 2 10.393 -27.471 9.913 12 HE3 LYS 2 HE1 LYS 2 9.316 -27.540 8.520 13 HZ1 LYS 2 HZ1 LYS 2 9.975 -29.723 8.810 14 HZ2 LYS 2 HZ2 LYS 2 11.572 -29.315 9.199 15 HZ3 LYS 2 HZ3 LYS 2 11.034 -29.182 7.596 16 H VAL 3 HN VAL 3 15.000 -23.792 11.057 17 HA VAL 3 HA VAL 3 14.303 -23.972 13.928 18 HB VAL 3 HB VAL 3 16.436 -22.271 12.602 19 HG11 VAL 3 HG11 VAL 3 15.402 -21.049 14.417 20 HG12 VAL 3 HG12 VAL 3 17.016 -21.574 14.896 21 HG13 VAL 3 HG13 VAL 3 15.594 -22.432 15.493 22 HG21 VAL 3 HG21 VAL 3 17.995 -23.585 13.998 23 HG22 VAL 3 HG22 VAL 3 17.144 -24.568 12.807 24 HG23 VAL 3 HG23 VAL 3 16.646 -24.606 14.497 25 H GLN 4 HN GLN 4 14.736 -21.780 11.230 26 HA GLN 4 HA GLN 4 12.149 -20.811 11.104 27 HB2 GLN 4 HB2 GLN 4 12.638 -19.684 13.258 28 HB3 GLN 4 HB1 GLN 4 14.028 -18.898 12.521 29 HG2 GLN 4 HG2 GLN 4 12.095 -17.407 12.675 30 HG3 GLN 4 HG1 GLN 4 12.595 -17.683 11.008 31 HE21 GLN 4 HE21 GLN 4 10.794 -20.008 12.905 32 HE22 GLN 4 HE22 GLN 4 9.315 -19.880 12.016 33 H GLU 5 HN GLU 5 12.708 -21.284 9.002 34 HA GLU 5 HA GLU 5 15.102 -20.212 7.830 35 HB2 GLU 5 HB2 GLU 5 12.884 -21.557 6.312 36 HB3 GLU 5 HB1 GLU 5 14.609 -21.571 5.980 37 HG2 GLU 5 HG2 GLU 5 13.191 -23.007 8.211 38 HG3 GLU 5 HG1 GLU 5 13.922 -23.728 6.781 39 H GLN 6 HN GLN 6 14.065 -18.013 8.531 40 HA GLN 6 HA GLN 6 12.160 -16.981 6.580 41 HB2 GLN 6 HB2 GLN 6 11.787 -16.542 8.970 42 HB3 GLN 6 HB1 GLN 6 13.337 -15.720 9.065 43 HG2 GLN 6 HG2 GLN 6 12.548 -13.988 7.571 44 HG3 GLN 6 HG1 GLN 6 11.011 -14.830 7.375 45 HE21 GLN 6 HE21 GLN 6 9.527 -14.817 9.057 46 HE22 GLN 6 HE22 GLN 6 9.639 -13.708 10.378 47 H SER 7 HN SER 7 15.263 -15.868 7.976 48 HA SER 7 HA SER 7 15.749 -14.462 5.428 49 HB2 SER 7 HB2 SER 7 15.512 -12.994 7.426 50 HB3 SER 7 HB1 SER 7 16.877 -13.825 8.168 51 HG SER 7 HG SER 7 18.157 -13.111 6.399 52 H VAL 8 HN VAL 8 16.300 -17.157 5.586 53 HA VAL 8 HA VAL 8 19.238 -17.231 5.817 54 HB VAL 8 HB VAL 8 19.112 -19.604 6.264 55 HG11 VAL 8 HG11 VAL 8 17.988 -19.562 8.457 56 HG12 VAL 8 HG12 VAL 8 17.244 -18.023 8.025 57 HG13 VAL 8 HG13 VAL 8 18.996 -18.142 8.184 58 HG21 VAL 8 HG21 VAL 8 17.166 -20.173 4.927 59 HG22 VAL 8 HG22 VAL 8 16.119 -19.294 6.040 60 HG23 VAL 8 HG23 VAL 8 16.958 -20.747 6.582 61 H GLY 9 HN GLY 9 16.912 -16.950 3.570 62 HA2 GLY 9 HA2 GLY 9 18.020 -18.918 1.697 63 HA3 GLY 9 HA1 GLY 9 16.527 -18.018 1.476 64 H ALA 10 HN ALA 10 18.806 -15.966 2.626 65 HA ALA 10 HA ALA 10 20.095 -15.316 0.113 66 HB1 ALA 10 HB1 ALA 10 19.219 -13.043 0.016 67 HB2 ALA 10 HB2 ALA 10 18.204 -13.356 1.423 68 HB3 ALA 10 HB3 ALA 10 17.902 -14.210 -0.090 69 HA PRO 11 HA PRO 11 23.171 -13.927 3.072 70 HB2 PRO 11 HB2 PRO 11 24.599 -12.345 1.334 71 HB3 PRO 11 HB1 PRO 11 24.797 -14.095 1.463 72 HG2 PRO 11 HG2 PRO 11 23.246 -12.504 -0.534 73 HG3 PRO 11 HG1 PRO 11 24.238 -13.953 -0.780 74 HD2 PRO 11 HD2 PRO 11 21.544 -14.047 -0.678 75 HD3 PRO 11 HD1 PRO 11 22.561 -15.371 -0.074 76 HA PRO 12 HA PRO 12 20.772 -10.256 4.058 77 HB2 PRO 12 HB2 PRO 12 22.616 -10.194 6.373 78 HB3 PRO 12 HB1 PRO 12 20.850 -10.217 6.342 79 HG2 PRO 12 HG2 PRO 12 22.241 -12.376 7.064 80 HG3 PRO 12 HG1 PRO 12 20.753 -12.520 6.110 81 HD2 PRO 12 HD2 PRO 12 23.605 -12.713 5.217 82 HD3 PRO 12 HD1 PRO 12 22.199 -13.676 4.715 83 HA PRO 13 HA PRO 13 23.817 -7.313 2.553 84 HB2 PRO 13 HB2 PRO 13 21.626 -5.429 2.347 85 HB3 PRO 13 HB1 PRO 13 22.524 -6.220 1.052 86 HG2 PRO 13 HG2 PRO 13 19.907 -6.745 1.612 87 HG3 PRO 13 HG1 PRO 13 21.005 -7.918 0.864 88 HD2 PRO 13 HD2 PRO 13 20.109 -7.707 3.713 89 HD3 PRO 13 HD1 PRO 13 20.342 -9.154 2.709 90 H GLY 14 HN GLY 14 22.404 -7.501 5.436 91 HA2 GLY 14 HA2 GLY 14 22.984 -6.482 7.423 92 HA3 GLY 14 HA1 GLY 14 23.865 -5.264 6.512 93 H ARG 15 HN ARG 15 22.977 -3.664 7.892 94 HA ARG 15 HA ARG 15 20.243 -2.928 7.067 95 HB2 ARG 15 HB2 ARG 15 21.495 -2.507 9.787 96 HB3 ARG 15 HB1 ARG 15 19.965 -1.810 9.274 97 HG2 ARG 15 HG2 ARG 15 20.593 -4.738 9.594 98 HG3 ARG 15 HG1 ARG 15 19.567 -3.753 10.637 99 HD2 ARG 15 HD2 ARG 15 18.060 -3.358 8.716 100 HD3 ARG 15 HD1 ARG 15 19.061 -4.437 7.743 101 HE ARG 15 HE ARG 15 17.490 -5.256 10.105 102 HH11 ARG 15 HH11 ARG 15 19.044 -5.979 7.044 103 HH12 ARG 15 HH12 ARG 15 18.401 -7.595 6.955 104 HH21 ARG 15 HH21 ARG 15 16.655 -7.391 9.982 105 HH22 ARG 15 HH22 ARG 15 17.053 -8.389 8.621 106 H ALA 16 HN ALA 16 22.666 -1.208 8.997 107 HA ALA 16 HA ALA 16 22.549 1.041 7.171 108 HB1 ALA 16 HB1 ALA 16 23.995 2.158 8.804 109 HB2 ALA 16 HB2 ALA 16 24.136 0.652 9.710 110 HB3 ALA 16 HB3 ALA 16 22.572 1.458 9.577 111 H ASP 17 HN ASP 17 23.841 -1.723 6.742 112 HA ASP 17 HA ASP 17 26.641 -1.147 6.368 113 HB2 ASP 17 HB2 ASP 17 25.019 -3.585 5.585 114 HB3 ASP 17 HB1 ASP 17 26.776 -3.470 5.562 115 H LYS 18 HN LYS 18 24.007 -0.276 4.687 116 HA LYS 18 HA LYS 18 25.336 -0.507 2.085 117 HB2 LYS 18 HB2 LYS 18 22.515 0.271 2.827 118 HB3 LYS 18 HB1 LYS 18 23.152 0.387 1.195 119 HG2 LYS 18 HG2 LYS 18 23.134 -2.196 2.735 120 HG3 LYS 18 HG1 LYS 18 21.774 -1.668 1.744 121 HD2 LYS 18 HD2 LYS 18 23.028 -3.091 0.359 122 HD3 LYS 18 HD1 LYS 18 23.439 -1.460 -0.168 123 HE2 LYS 18 HE2 LYS 18 25.462 -2.724 -0.081 124 HE3 LYS 18 HE1 LYS 18 25.479 -1.600 1.278 125 HZ1 LYS 18 HZ1 LYS 18 24.877 -4.506 1.359 126 HZ2 LYS 18 HZ2 LYS 18 24.671 -3.464 2.679 127 HZ3 LYS 18 HZ3 LYS 18 26.213 -3.718 2.041 128 H THR 19 HN THR 19 23.816 1.868 4.213 129 HA THR 19 HA THR 19 24.417 3.961 4.821 130 HB THR 19 HB THR 19 27.075 3.718 3.472 131 HG1 THR 19 HG1 THR 19 26.096 2.115 5.606 132 HG21 THR 19 HG21 THR 19 27.845 4.749 5.563 133 HG22 THR 19 HG22 THR 19 26.201 4.685 6.198 134 HG23 THR 19 HG23 THR 19 26.570 5.707 4.809 135 H ALA 20 HN ALA 20 23.450 3.322 1.971 136 HA ALA 20 HA ALA 20 23.142 4.305 -0.055 137 HB1 ALA 20 HB1 ALA 20 22.579 6.686 0.024 138 HB2 ALA 20 HB2 ALA 20 23.296 6.805 1.631 139 HB3 ALA 20 HB3 ALA 20 21.860 5.812 1.378 140 H ALA 21 HN ALA 21 25.742 3.558 0.215 141 HA ALA 21 HA ALA 21 27.257 5.841 -0.846 142 HB1 ALA 21 HB1 ALA 21 29.284 4.864 0.018 143 HB2 ALA 21 HB2 ALA 21 28.399 3.444 0.576 144 HB3 ALA 21 HB3 ALA 21 28.096 5.018 1.313 145 HA PRO 22 HA PRO 22 28.817 2.266 -3.610 146 HB2 PRO 22 HB2 PRO 22 27.660 -0.193 -3.444 147 HB3 PRO 22 HB1 PRO 22 29.080 0.284 -2.507 148 HG2 PRO 22 HG2 PRO 22 26.213 0.159 -1.676 149 HG3 PRO 22 HG1 PRO 22 27.666 -0.315 -0.776 150 HD2 PRO 22 HD2 PRO 22 26.359 2.031 -0.351 151 HD3 PRO 22 HD1 PRO 22 28.107 1.839 -0.110 152 H GLN 23 HN GLN 23 25.676 0.670 -3.323 153 HA GLN 23 HA GLN 23 24.659 2.191 -5.591 154 HB2 GLN 23 HB2 GLN 23 25.878 0.185 -6.478 155 HB3 GLN 23 HB1 GLN 23 24.741 -0.831 -5.606 156 HG2 GLN 23 HG2 GLN 23 22.902 0.151 -6.914 157 HG3 GLN 23 HG1 GLN 23 24.082 1.099 -7.818 158 HE21 GLN 23 HE21 GLN 23 23.623 0.188 -9.771 159 HE22 GLN 23 HE22 GLN 23 23.996 -1.458 -10.173 160 H THR 24 HN THR 24 23.123 3.041 -4.191 161 HA THR 24 HA THR 24 21.049 1.128 -3.357 162 HB THR 24 HB THR 24 20.438 2.921 -1.638 163 HG1 THR 24 HG1 THR 24 21.636 4.656 -1.658 164 HG21 THR 24 HG21 THR 24 21.540 0.791 -1.055 165 HG22 THR 24 HG22 THR 24 22.079 2.115 -0.023 166 HG23 THR 24 HG23 THR 24 23.112 1.542 -1.332 167 H ARG 25 HN ARG 25 21.360 2.513 -5.906 168 HA ARG 25 HA ARG 25 19.298 4.583 -5.843 169 HB2 ARG 25 HB2 ARG 25 19.986 4.924 -8.255 170 HB3 ARG 25 HB1 ARG 25 21.210 5.280 -7.046 171 HG2 ARG 25 HG2 ARG 25 22.248 3.093 -7.470 172 HG3 ARG 25 HG1 ARG 25 21.039 2.778 -8.716 173 HD2 ARG 25 HD2 ARG 25 22.790 5.214 -8.790 174 HD3 ARG 25 HD1 ARG 25 23.333 3.669 -9.443 175 HE ARG 25 HE ARG 25 21.359 3.792 -10.943 176 HH11 ARG 25 HH11 ARG 25 22.538 6.742 -9.463 177 HH12 ARG 25 HH12 ARG 25 22.048 7.751 -10.794 178 HH21 ARG 25 HH21 ARG 25 20.727 5.106 -12.692 179 HH22 ARG 25 HH22 ARG 25 21.015 6.821 -12.634 180 H LEU 26 HN LEU 26 19.265 1.369 -6.044 181 HA LEU 26 HA LEU 26 16.650 1.254 -7.152 182 HB2 LEU 26 HB2 LEU 26 18.119 1.414 -9.207 183 HB3 LEU 26 HB1 LEU 26 18.817 -0.124 -8.747 184 HG LEU 26 HG LEU 26 16.608 -1.194 -8.990 185 HD11 LEU 26 HD11 LEU 26 14.779 0.030 -10.044 186 HD12 LEU 26 HD12 LEU 26 15.730 1.515 -9.985 187 HD13 LEU 26 HD13 LEU 26 15.208 0.740 -8.488 188 HD21 LEU 26 HD21 LEU 26 17.474 0.378 -11.415 189 HD22 LEU 26 HD22 LEU 26 16.519 -1.106 -11.417 190 HD23 LEU 26 HD23 LEU 26 18.191 -1.135 -10.860 191 H THR 27 HN THR 27 17.845 0.560 -4.732 192 HA THR 27 HA THR 27 17.922 -2.374 -4.797 193 HB THR 27 HB THR 27 19.586 -1.027 -2.760 194 HG1 THR 27 HG1 THR 27 21.274 -0.813 -4.455 195 HG21 THR 27 HG21 THR 27 19.990 -3.332 -4.661 196 HG22 THR 27 HG22 THR 27 19.526 -3.451 -2.964 197 HG23 THR 27 HG23 THR 27 21.129 -2.854 -3.403 198 HA PRO 28 HA PRO 28 16.690 -1.040 -0.243 199 HB2 PRO 28 HB2 PRO 28 15.647 1.693 -0.734 200 HB3 PRO 28 HB1 PRO 28 16.598 1.073 0.620 201 HG2 PRO 28 HG2 PRO 28 17.716 2.639 -1.216 202 HG3 PRO 28 HG1 PRO 28 18.603 1.262 -0.533 203 HD2 PRO 28 HD2 PRO 28 17.219 1.504 -3.177 204 HD3 PRO 28 HD1 PRO 28 18.780 0.752 -2.787 205 H TYR 29 HN TYR 29 15.000 -2.393 -0.283 206 HA TYR 29 HA TYR 29 12.529 -1.746 -1.622 207 HB2 TYR 29 HB2 TYR 29 13.103 -3.958 0.368 208 HB3 TYR 29 HB1 TYR 29 11.704 -3.846 -0.692 209 HD1 TYR 29 HD2 TYR 29 12.069 -4.040 -3.193 210 HD2 TYR 29 HD1 TYR 29 15.100 -4.969 -0.357 211 HE1 TYR 29 HE2 TYR 29 13.270 -5.332 -4.907 212 HE2 TYR 29 HE1 TYR 29 16.309 -6.263 -2.062 213 HH TYR 29 HH TYR 29 15.524 -6.130 -5.388 214 H ALA 30 HN ALA 30 10.861 -0.668 -0.742 215 HA ALA 30 HA ALA 30 11.220 0.537 1.840 216 HB1 ALA 30 HB1 ALA 30 9.208 1.797 1.313 217 HB2 ALA 30 HB2 ALA 30 8.917 0.768 -0.090 218 HB3 ALA 30 HB3 ALA 30 10.335 1.816 -0.045 219 H GLN 31 HN GLN 31 11.151 -1.746 2.823 220 HA GLN 31 HA GLN 31 8.433 -2.687 3.296 221 HB2 GLN 31 HB2 GLN 31 9.544 -4.489 4.615 222 HB3 GLN 31 HB1 GLN 31 10.049 -4.419 2.934 223 HG2 GLN 31 HG2 GLN 31 12.129 -3.395 3.539 224 HG3 GLN 31 HG1 GLN 31 11.612 -3.238 5.218 225 HE21 GLN 31 HE21 GLN 31 13.921 -4.630 4.076 226 HE22 GLN 31 HE22 GLN 31 13.791 -6.268 4.606 227 H ALA 32 HN ALA 32 8.463 -0.264 4.219 228 HA ALA 32 HA ALA 32 9.367 0.028 6.912 229 HB1 ALA 32 HB1 ALA 32 8.123 2.127 6.889 230 HB2 ALA 32 HB2 ALA 32 7.359 1.668 5.366 231 HB3 ALA 32 HB3 ALA 32 9.098 1.957 5.429 232 H GLY 33 HN GLY 33 8.398 -0.541 8.739 233 HA2 GLY 33 HA2 GLY 33 5.501 -0.992 8.732 234 HA3 GLY 33 HA1 GLY 33 6.535 -2.316 9.245 235 H GLU 34 HN GLU 34 7.901 0.583 10.011 236 HA GLU 34 HA GLU 34 6.938 0.403 12.779 237 HB2 GLU 34 HB2 GLU 34 9.014 1.772 13.303 238 HB3 GLU 34 HB1 GLU 34 9.283 0.117 12.787 239 HG2 GLU 34 HG2 GLU 34 9.372 2.323 10.783 240 HG3 GLU 34 HG1 GLU 34 10.748 2.046 11.849 241 H ASP 35 HN ASP 35 5.335 1.639 10.892 242 HA ASP 35 HA ASP 35 5.136 4.303 12.014 243 HB2 ASP 35 HB2 ASP 35 6.637 4.461 9.960 244 HB3 ASP 35 HB1 ASP 35 5.239 3.974 9.007 245 H ASN 36 HN ASN 36 2.998 5.119 11.854 246 HA ASN 36 HA ASN 36 1.042 3.036 11.310 247 HB2 ASN 36 HB2 ASN 36 -0.580 4.589 12.402 248 HB3 ASN 36 HB1 ASN 36 0.784 4.155 13.426 249 HD21 ASN 36 HD21 ASN 36 2.337 5.708 13.912 250 HD22 ASN 36 HD22 ASN 36 2.049 7.396 13.681 251 H TRP 37 HN TRP 37 2.174 3.856 9.017 252 HA TRP 37 HA TRP 37 1.126 6.044 7.685 253 HB2 TRP 37 HB2 TRP 37 1.791 4.901 5.605 254 HB3 TRP 37 HB1 TRP 37 3.042 4.827 6.833 255 HD1 TRP 37 HD1 TRP 37 2.527 2.291 8.409 256 HE1 TRP 37 HE1 TRP 37 2.517 -0.042 7.323 257 HE3 TRP 37 HE3 TRP 37 1.623 3.654 3.561 258 HZ2 TRP 37 HZ2 TRP 37 2.185 -1.155 4.745 259 HZ3 TRP 37 HZ3 TRP 37 1.479 1.898 1.850 260 HH2 TRP 37 HH2 TRP 37 1.756 -0.458 2.429 261 H ARG 38 HN ARG 38 -0.242 2.811 8.032 262 HA ARG 38 HA ARG 38 -2.256 3.096 6.056 263 HB2 ARG 38 HB2 ARG 38 -3.392 1.214 7.265 264 HB3 ARG 38 HB1 ARG 38 -1.745 0.874 6.747 265 HG2 ARG 38 HG2 ARG 38 -0.916 0.905 8.903 266 HG3 ARG 38 HG1 ARG 38 -2.255 1.876 9.514 267 HD2 ARG 38 HD2 ARG 38 -3.748 0.025 9.407 268 HD3 ARG 38 HD1 ARG 38 -2.563 -0.955 8.537 269 HE ARG 38 HE ARG 38 -1.613 -0.076 11.097 270 HH11 ARG 38 HH11 ARG 38 -3.642 -2.472 9.523 271 HH12 ARG 38 HH12 ARG 38 -3.358 -3.683 10.735 272 HH21 ARG 38 HH21 ARG 38 -1.243 -1.673 12.689 273 HH22 ARG 38 HH22 ARG 38 -1.996 -3.234 12.527 274 H SER 39 HN SER 39 -2.143 3.759 9.502 275 HA SER 39 HA SER 39 -4.905 4.240 9.822 276 HB2 SER 39 HB2 SER 39 -2.732 5.484 11.505 277 HB3 SER 39 HB1 SER 39 -4.338 4.941 11.998 278 HG SER 39 HG SER 39 -3.337 3.172 12.550 279 H ARG 40 HN ARG 40 -2.149 6.210 8.900 280 HA ARG 40 HA ARG 40 -3.557 8.679 8.894 281 HB2 ARG 40 HB2 ARG 40 -0.992 7.846 7.533 282 HB3 ARG 40 HB1 ARG 40 -1.551 9.476 7.781 283 HG2 ARG 40 HG2 ARG 40 -0.893 7.564 9.991 284 HG3 ARG 40 HG1 ARG 40 0.189 8.817 9.382 285 HD2 ARG 40 HD2 ARG 40 -2.528 9.311 10.595 286 HD3 ARG 40 HD1 ARG 40 -0.992 9.488 11.443 287 HE ARG 40 HE ARG 40 -0.719 11.083 9.245 288 HH11 ARG 40 HH11 ARG 40 -2.996 10.881 11.898 289 HH12 ARG 40 HH12 ARG 40 -3.431 12.560 11.820 290 HH21 ARG 40 HH21 ARG 40 -1.258 13.304 9.159 291 HH22 ARG 40 HH22 ARG 40 -2.435 13.952 10.267 292 H ILE 41 HN ILE 41 -2.747 6.202 6.501 293 HA ILE 41 HA ILE 41 -3.714 7.428 4.175 294 HB ILE 41 HB ILE 41 -3.688 4.522 5.031 295 HG12 ILE 41 HG12 ILE 41 -2.050 6.051 3.003 296 HG13 ILE 41 HG11 ILE 41 -1.515 5.603 4.620 297 HG21 ILE 41 HG21 ILE 41 -5.553 4.869 3.449 298 HG22 ILE 41 HG22 ILE 41 -4.265 3.872 2.771 299 HG23 ILE 41 HG23 ILE 41 -4.411 5.562 2.293 300 HD11 ILE 41 HD11 ILE 41 -0.597 4.100 2.971 301 HD12 ILE 41 HD12 ILE 41 -2.215 3.710 2.392 302 HD13 ILE 41 HD13 ILE 41 -1.724 3.239 4.019 303 H SER 42 HN SER 42 -5.395 5.439 6.623 304 HA SER 42 HA SER 42 -7.934 5.409 5.490 305 HB2 SER 42 HB2 SER 42 -7.232 4.075 7.475 306 HB3 SER 42 HB1 SER 42 -7.300 5.541 8.450 307 HG SER 42 HG SER 42 -9.230 4.011 8.291 308 H GLY 43 HN GLY 43 -6.480 7.844 7.636 309 HA2 GLY 43 HA2 GLY 43 -8.745 9.533 7.795 310 HA3 GLY 43 HA1 GLY 43 -7.078 10.026 8.065 311 H ARG 44 HN ARG 44 -6.083 9.336 5.507 312 HA ARG 44 HA ARG 44 -6.703 11.659 4.019 313 HB2 ARG 44 HB2 ARG 44 -4.583 10.105 4.054 314 HB3 ARG 44 HB1 ARG 44 -5.454 9.228 2.836 315 HG2 ARG 44 HG2 ARG 44 -5.100 10.787 1.261 316 HG3 ARG 44 HG1 ARG 44 -5.242 12.127 2.407 317 HD2 ARG 44 HD2 ARG 44 -2.934 10.299 2.712 318 HD3 ARG 44 HD1 ARG 44 -2.909 11.409 1.327 319 HE ARG 44 HE ARG 44 -3.405 12.462 4.029 320 HH11 ARG 44 HH11 ARG 44 -1.294 12.257 1.226 321 HH12 ARG 44 HH12 ARG 44 -0.363 13.650 1.679 322 HH21 ARG 44 HH21 ARG 44 -2.178 14.298 4.610 323 HH22 ARG 44 HH22 ARG 44 -0.843 14.789 3.604 324 H LEU 45 HN LEU 45 -7.725 8.317 3.877 325 HA LEU 45 HA LEU 45 -9.039 8.374 1.378 326 HB2 LEU 45 HB2 LEU 45 -8.390 6.460 3.182 327 HB3 LEU 45 HB1 LEU 45 -10.096 6.634 3.529 328 HG LEU 45 HG LEU 45 -9.093 6.126 0.744 329 HD11 LEU 45 HD11 LEU 45 -8.242 4.340 2.185 330 HD12 LEU 45 HD12 LEU 45 -9.530 3.748 1.123 331 HD13 LEU 45 HD13 LEU 45 -9.871 4.081 2.820 332 HD21 LEU 45 HD21 LEU 45 -11.746 5.645 2.091 333 HD22 LEU 45 HD22 LEU 45 -11.357 5.221 0.423 334 HD23 LEU 45 HD23 LEU 45 -11.383 6.915 0.924 335 H ASN 46 HN ASN 46 -9.879 9.373 4.549 336 HA ASN 46 HA ASN 46 -12.706 9.537 4.228 337 HB2 ASN 46 HB2 ASN 46 -11.662 9.336 6.454 338 HB3 ASN 46 HB1 ASN 46 -10.877 10.892 6.230 339 HD21 ASN 46 HD21 ASN 46 -14.212 10.125 5.335 340 HD22 ASN 46 HD22 ASN 46 -14.940 11.190 6.481 341 H ARG 47 HN ARG 47 -9.992 11.730 3.921 342 HA ARG 47 HA ARG 47 -11.289 14.102 3.381 343 HB2 ARG 47 HB2 ARG 47 -9.162 14.731 3.235 344 HB3 ARG 47 HB1 ARG 47 -8.682 13.057 3.332 345 HG2 ARG 47 HG2 ARG 47 -8.792 12.890 0.865 346 HG3 ARG 47 HG1 ARG 47 -9.188 14.618 0.804 347 HD2 ARG 47 HD2 ARG 47 -7.083 15.155 1.918 348 HD3 ARG 47 HD1 ARG 47 -6.686 13.442 2.011 349 HE ARG 47 HE ARG 47 -7.154 14.214 -0.672 350 HH11 ARG 47 HH11 ARG 47 -4.796 14.470 1.905 351 HH12 ARG 47 HH12 ARG 47 -3.449 14.651 0.820 352 HH21 ARG 47 HH21 ARG 47 -5.359 14.419 -2.096 353 HH22 ARG 47 HH22 ARG 47 -3.767 14.618 -1.440 354 H PHE 48 HN PHE 48 -10.811 11.271 1.374 355 HA PHE 48 HA PHE 48 -11.821 12.696 -0.937 356 HB2 PHE 48 HB2 PHE 48 -10.700 9.929 -0.630 357 HB3 PHE 48 HB1 PHE 48 -11.423 10.504 -2.126 358 HD1 PHE 48 HD2 PHE 48 -10.414 12.778 -3.018 359 HD2 PHE 48 HD1 PHE 48 -8.435 10.096 -0.371 360 HE1 PHE 48 HE2 PHE 48 -8.244 13.692 -3.724 361 HE2 PHE 48 HE1 PHE 48 -6.260 11.007 -1.075 362 HZ PHE 48 HZ PHE 48 -6.165 12.806 -2.753 363 H LYS 49 HN LYS 49 -12.531 9.674 0.767 364 HA LYS 49 HA LYS 49 -15.319 10.095 0.919 365 HB2 LYS 49 HB2 LYS 49 -14.914 9.601 -1.578 366 HB3 LYS 49 HB1 LYS 49 -14.526 7.975 -1.071 367 HG2 LYS 49 HG2 LYS 49 -16.779 7.825 -0.035 368 HG3 LYS 49 HG1 LYS 49 -17.155 9.397 -0.747 369 HD2 LYS 49 HD2 LYS 49 -16.632 8.441 -2.983 370 HD3 LYS 49 HD1 LYS 49 -16.428 6.864 -2.217 371 HE2 LYS 49 HE2 LYS 49 -18.771 7.076 -1.365 372 HE3 LYS 49 HE1 LYS 49 -18.934 8.528 -2.351 373 HZ1 LYS 49 HZ1 LYS 49 -18.382 7.147 -4.308 374 HZ2 LYS 49 HZ2 LYS 49 -19.814 6.673 -3.541 375 HZ3 LYS 49 HZ3 LYS 49 -18.396 5.773 -3.314 376 H ARG 50 HN ARG 50 -15.221 9.240 2.997 377 HA ARG 50 HA ARG 50 -14.591 6.367 3.044 378 HB2 ARG 50 HB2 ARG 50 -12.825 7.880 4.181 379 HB3 ARG 50 HB1 ARG 50 -14.037 8.095 5.439 380 HG2 ARG 50 HG2 ARG 50 -14.127 5.636 5.708 381 HG3 ARG 50 HG1 ARG 50 -12.810 5.499 4.543 382 HD2 ARG 50 HD2 ARG 50 -11.825 5.386 6.684 383 HD3 ARG 50 HD1 ARG 50 -11.470 6.998 6.062 384 HE ARG 50 HE ARG 50 -13.761 7.345 7.495 385 HH11 ARG 50 HH11 ARG 50 -10.615 5.982 8.228 386 HH12 ARG 50 HH12 ARG 50 -10.704 6.363 9.923 387 HH21 ARG 50 HH21 ARG 50 -13.878 7.860 9.705 388 HH22 ARG 50 HH22 ARG 50 -12.559 7.453 10.763 389 H TYR 51 HN TYR 51 -16.533 5.540 3.138 390 HA TYR 51 HA TYR 51 -18.621 6.676 4.781 391 HB2 TYR 51 HB2 TYR 51 -18.607 5.256 2.445 392 HB3 TYR 51 HB1 TYR 51 -18.966 3.984 3.608 393 HD1 TYR 51 HD1 TYR 51 -20.044 7.487 2.861 394 HD2 TYR 51 HD2 TYR 51 -21.196 3.555 4.004 395 HE1 TYR 51 HE1 TYR 51 -22.403 8.181 2.851 396 HE2 TYR 51 HE2 TYR 51 -23.556 4.240 4.004 397 HH TYR 51 HH TYR 51 -24.857 6.333 4.259 398 HA PRO 52 HA PRO 52 -17.428 4.497 8.468 399 HB2 PRO 52 HB2 PRO 52 -20.354 4.459 9.001 400 HB3 PRO 52 HB1 PRO 52 -19.035 5.061 10.010 401 HG2 PRO 52 HG2 PRO 52 -20.645 6.755 8.734 402 HG3 PRO 52 HG1 PRO 52 -18.905 7.079 8.863 403 HD2 PRO 52 HD2 PRO 52 -20.477 6.054 6.535 404 HD3 PRO 52 HD1 PRO 52 -19.120 7.198 6.562 405 H LYS 53 HN LYS 53 -17.128 2.397 8.915 406 HA LYS 53 HA LYS 53 -17.904 0.496 6.999 407 HB2 LYS 53 HB2 LYS 53 -16.177 0.572 9.295 408 HB3 LYS 53 HB1 LYS 53 -17.096 -0.925 9.282 409 HG2 LYS 53 HG2 LYS 53 -15.134 -1.422 8.117 410 HG3 LYS 53 HG1 LYS 53 -16.350 -1.189 6.863 411 HD2 LYS 53 HD2 LYS 53 -14.461 0.981 7.753 412 HD3 LYS 53 HD1 LYS 53 -14.096 -0.130 6.436 413 HE2 LYS 53 HE2 LYS 53 -15.928 0.695 5.131 414 HE3 LYS 53 HE1 LYS 53 -16.558 1.608 6.505 415 HZ1 LYS 53 HZ1 LYS 53 -15.422 3.063 4.999 416 HZ2 LYS 53 HZ2 LYS 53 -14.009 2.125 5.061 417 HZ3 LYS 53 HZ3 LYS 53 -14.536 2.968 6.439 418 H ASP 54 HN ASP 54 -19.408 1.442 9.972 419 HA ASP 54 HA ASP 54 -21.027 -0.802 10.396 420 HB2 ASP 54 HB2 ASP 54 -21.292 2.100 11.080 421 HB3 ASP 54 HB1 ASP 54 -22.656 1.018 11.349 422 H ALA 55 HN ALA 55 -21.341 1.889 8.179 423 HA ALA 55 HA ALA 55 -23.951 1.159 7.277 424 HB1 ALA 55 HB1 ALA 55 -23.619 2.817 5.551 425 HB2 ALA 55 HB2 ALA 55 -21.902 2.908 5.943 426 HB3 ALA 55 HB3 ALA 55 -23.104 3.454 7.112 427 H LEU 56 HN LEU 56 -20.678 0.381 6.368 428 HA LEU 56 HA LEU 56 -21.337 -0.810 3.863 429 HB2 LEU 56 HB2 LEU 56 -18.894 -0.934 5.618 430 HB3 LEU 56 HB1 LEU 56 -19.024 -1.895 4.157 431 HG LEU 56 HG LEU 56 -17.744 0.044 3.641 432 HD11 LEU 56 HD11 LEU 56 -19.005 1.081 1.882 433 HD12 LEU 56 HD12 LEU 56 -20.524 0.546 2.610 434 HD13 LEU 56 HD13 LEU 56 -19.398 -0.640 1.946 435 HD21 LEU 56 HD21 LEU 56 -18.487 2.293 4.012 436 HD22 LEU 56 HD22 LEU 56 -18.474 1.414 5.537 437 HD23 LEU 56 HD23 LEU 56 -20.002 1.718 4.707 438 H ARG 57 HN ARG 57 -21.057 -1.993 7.166 439 HA ARG 57 HA ARG 57 -21.203 -4.750 6.514 440 HB2 ARG 57 HB2 ARG 57 -21.857 -3.289 9.072 441 HB3 ARG 57 HB1 ARG 57 -21.832 -5.041 8.920 442 HG2 ARG 57 HG2 ARG 57 -19.445 -4.804 8.129 443 HG3 ARG 57 HG1 ARG 57 -19.542 -3.126 8.656 444 HD2 ARG 57 HD2 ARG 57 -20.165 -5.446 10.465 445 HD3 ARG 57 HD1 ARG 57 -18.551 -4.761 10.312 446 HE ARG 57 HE ARG 57 -20.719 -2.935 11.030 447 HH11 ARG 57 HH11 ARG 57 -18.078 -4.955 12.094 448 HH12 ARG 57 HH12 ARG 57 -17.795 -4.057 13.555 449 HH21 ARG 57 HH21 ARG 57 -20.355 -1.726 12.972 450 HH22 ARG 57 HH22 ARG 57 -19.060 -2.202 14.028 451 H LEU 58 HN LEU 58 -23.519 -2.326 6.351 452 HA LEU 58 HA LEU 58 -25.641 -4.361 6.219 453 HB2 LEU 58 HB2 LEU 58 -25.763 -1.498 7.120 454 HB3 LEU 58 HB1 LEU 58 -27.191 -2.308 6.508 455 HG LEU 58 HG LEU 58 -26.755 -4.081 8.300 456 HD11 LEU 58 HD11 LEU 58 -25.523 -3.345 10.261 457 HD12 LEU 58 HD12 LEU 58 -25.040 -1.873 9.419 458 HD13 LEU 58 HD13 LEU 58 -24.471 -3.442 8.849 459 HD21 LEU 58 HD21 LEU 58 -27.913 -2.772 9.992 460 HD22 LEU 58 HD22 LEU 58 -28.580 -2.467 8.388 461 HD23 LEU 58 HD23 LEU 58 -27.506 -1.285 9.137 462 H LYS 59 HN LYS 59 -23.656 -3.215 4.200 463 HA LYS 59 HA LYS 59 -25.600 -2.731 2.099 464 HB2 LYS 59 HB2 LYS 59 -25.168 -0.497 3.080 465 HB3 LYS 59 HB1 LYS 59 -23.461 -0.687 2.732 466 HG2 LYS 59 HG2 LYS 59 -24.150 -0.931 0.296 467 HG3 LYS 59 HG1 LYS 59 -25.731 -0.337 0.813 468 HD2 LYS 59 HD2 LYS 59 -23.081 1.076 1.077 469 HD3 LYS 59 HD1 LYS 59 -24.424 1.527 0.027 470 HE2 LYS 59 HE2 LYS 59 -24.647 1.409 3.028 471 HE3 LYS 59 HE1 LYS 59 -24.171 2.866 2.160 472 HZ1 LYS 59 HZ1 LYS 59 -26.551 2.788 2.700 473 HZ2 LYS 59 HZ2 LYS 59 -26.727 1.411 1.723 474 HZ3 LYS 59 HZ3 LYS 59 -26.263 2.889 1.034 475 H ARG 60 HN ARG 60 -22.109 -2.049 2.380 476 HA ARG 60 HA ARG 60 -21.625 -4.051 0.281 477 HB2 ARG 60 HB2 ARG 60 -20.448 -1.269 0.422 478 HB3 ARG 60 HB1 ARG 60 -20.002 -2.503 -0.747 479 HG2 ARG 60 HG2 ARG 60 -22.803 -1.437 -0.505 480 HG3 ARG 60 HG1 ARG 60 -21.583 -0.703 -1.544 481 HD2 ARG 60 HD2 ARG 60 -22.769 -2.131 -2.962 482 HD3 ARG 60 HD1 ARG 60 -21.305 -3.026 -2.563 483 HE ARG 60 HE ARG 60 -23.156 -3.835 -0.704 484 HH11 ARG 60 HH11 ARG 60 -23.041 -3.761 -4.191 485 HH12 ARG 60 HH12 ARG 60 -24.015 -5.183 -4.394 486 HH21 ARG 60 HH21 ARG 60 -24.453 -5.696 -0.943 487 HH22 ARG 60 HH22 ARG 60 -24.815 -6.304 -2.533 488 H GLN 61 HN GLN 61 -20.764 -5.502 1.771 489 HA GLN 61 HA GLN 61 -18.290 -4.626 3.100 490 HB2 GLN 61 HB2 GLN 61 -18.799 -6.444 4.778 491 HB3 GLN 61 HB1 GLN 61 -19.893 -5.069 4.801 492 HG2 GLN 61 HG2 GLN 61 -21.501 -6.385 3.450 493 HG3 GLN 61 HG1 GLN 61 -20.414 -7.768 3.577 494 HE21 GLN 61 HE21 GLN 61 -23.161 -7.476 4.502 495 HE22 GLN 61 HE22 GLN 61 -23.120 -7.760 6.210 496 H GLY 62 HN GLY 62 -16.581 -5.442 2.105 497 HA2 GLY 62 HA2 GLY 62 -16.384 -8.289 1.689 498 HA3 GLY 62 HA1 GLY 62 -16.361 -7.342 0.210 499 H VAL 63 HN VAL 63 -14.276 -9.034 1.416 500 HA VAL 63 HA VAL 63 -12.185 -7.033 1.926 501 HB VAL 63 HB VAL 63 -12.032 -10.032 2.299 502 HG11 VAL 63 HG11 VAL 63 -9.857 -9.052 1.915 503 HG12 VAL 63 HG12 VAL 63 -10.009 -9.512 3.612 504 HG13 VAL 63 HG13 VAL 63 -10.163 -7.820 3.140 505 HG21 VAL 63 HG21 VAL 63 -12.171 -9.571 4.707 506 HG22 VAL 63 HG22 VAL 63 -13.640 -9.096 3.854 507 HG23 VAL 63 HG23 VAL 63 -12.474 -7.870 4.354 508 H GLY 64 HN GLY 64 -10.775 -6.571 0.365 509 HA2 GLY 64 HA2 GLY 64 -10.254 -8.590 -1.713 510 HA3 GLY 64 HA1 GLY 64 -10.745 -6.970 -2.192 511 H GLN 65 HN GLN 65 -8.311 -8.139 -2.980 512 HA GLN 65 HA GLN 65 -6.339 -6.703 -1.332 513 HB2 GLN 65 HB2 GLN 65 -6.087 -9.203 -1.930 514 HB3 GLN 65 HB1 GLN 65 -5.692 -8.637 -3.547 515 HG2 GLN 65 HG2 GLN 65 -3.827 -7.342 -2.634 516 HG3 GLN 65 HG1 GLN 65 -4.218 -7.933 -1.019 517 HE21 GLN 65 HE21 GLN 65 -2.234 -8.941 -0.740 518 HE22 GLN 65 HE22 GLN 65 -1.802 -10.376 -1.607 519 H VAL 66 HN VAL 66 -5.413 -4.893 -2.109 520 HA VAL 66 HA VAL 66 -6.014 -4.144 -4.895 521 HB VAL 66 HB VAL 66 -6.514 -2.552 -2.377 522 HG11 VAL 66 HG11 VAL 66 -6.822 -1.553 -5.199 523 HG12 VAL 66 HG12 VAL 66 -5.502 -1.112 -4.115 524 HG13 VAL 66 HG13 VAL 66 -7.163 -0.676 -3.703 525 HG21 VAL 66 HG21 VAL 66 -8.270 -4.113 -2.968 526 HG22 VAL 66 HG22 VAL 66 -8.342 -3.439 -4.598 527 HG23 VAL 66 HG23 VAL 66 -8.806 -2.448 -3.211 528 H ARG 67 HN ARG 67 -4.148 -3.714 -5.922 529 HA ARG 67 HA ARG 67 -1.963 -2.468 -4.389 530 HB2 ARG 67 HB2 ARG 67 -0.393 -3.358 -5.989 531 HB3 ARG 67 HB1 ARG 67 -1.412 -4.677 -5.429 532 HG2 ARG 67 HG2 ARG 67 -2.648 -4.684 -7.464 533 HG3 ARG 67 HG1 ARG 67 -1.852 -3.206 -8.015 534 HD2 ARG 67 HD2 ARG 67 0.189 -4.291 -8.349 535 HD3 ARG 67 HD1 ARG 67 -0.276 -5.667 -7.350 536 HE ARG 67 HE ARG 67 -1.933 -6.141 -9.201 537 HH11 ARG 67 HH11 ARG 67 1.078 -4.447 -9.817 538 HH12 ARG 67 HH12 ARG 67 1.238 -5.070 -11.427 539 HH21 ARG 67 HH21 ARG 67 -1.745 -6.940 -11.310 540 HH22 ARG 67 HH22 ARG 67 -0.393 -6.473 -12.299 541 H PHE 68 HN PHE 68 -0.881 -0.659 -5.325 542 HA PHE 68 HA PHE 68 -2.056 0.633 -7.595 543 HB2 PHE 68 HB2 PHE 68 -2.643 2.659 -6.001 544 HB3 PHE 68 HB1 PHE 68 -3.800 1.376 -6.318 545 HD1 PHE 68 HD1 PHE 68 -0.913 1.750 -3.961 546 HD2 PHE 68 HD2 PHE 68 -5.053 0.927 -4.487 547 HE1 PHE 68 HE1 PHE 68 -1.143 1.357 -1.544 548 HE2 PHE 68 HE2 PHE 68 -5.292 0.534 -2.074 549 HZ PHE 68 HZ PHE 68 -3.337 0.746 -0.601 550 H THR 69 HN THR 69 -0.979 2.426 -8.293 551 HA THR 69 HA THR 69 1.625 3.044 -7.076 552 HB THR 69 HB THR 69 0.430 4.134 -9.640 553 HG1 THR 69 HG1 THR 69 1.455 1.652 -9.080 554 HG21 THR 69 HG21 THR 69 2.751 4.615 -10.211 555 HG22 THR 69 HG22 THR 69 3.285 3.929 -8.676 556 HG23 THR 69 HG23 THR 69 2.312 5.401 -8.695 557 H LEU 70 HN LEU 70 1.906 4.859 -5.914 558 HA LEU 70 HA LEU 70 -0.394 6.688 -5.753 559 HB2 LEU 70 HB2 LEU 70 1.374 5.725 -3.517 560 HB3 LEU 70 HB1 LEU 70 0.040 6.852 -3.355 561 HG LEU 70 HG LEU 70 -0.269 4.011 -4.307 562 HD11 LEU 70 HD11 LEU 70 -1.193 3.609 -2.031 563 HD12 LEU 70 HD12 LEU 70 -0.589 5.201 -1.557 564 HD13 LEU 70 HD13 LEU 70 0.540 3.941 -2.061 565 HD21 LEU 70 HD21 LEU 70 -2.645 4.417 -3.813 566 HD22 LEU 70 HD22 LEU 70 -2.030 5.501 -5.061 567 HD23 LEU 70 HD23 LEU 70 -2.264 6.092 -3.415 568 H ASP 71 HN ASP 71 -0.038 8.789 -5.707 569 HA ASP 71 HA ASP 71 2.604 9.869 -6.095 570 HB2 ASP 71 HB2 ASP 71 0.478 10.784 -7.144 571 HB3 ASP 71 HB1 ASP 71 0.020 11.354 -5.537 572 H ARG 72 HN ARG 72 3.535 11.468 -4.681 573 HA ARG 72 HA ARG 72 3.657 10.645 -1.999 574 HB2 ARG 72 HB2 ARG 72 5.062 12.651 -1.662 575 HB3 ARG 72 HB1 ARG 72 5.545 11.710 -3.066 576 HG2 ARG 72 HG2 ARG 72 4.414 13.281 -4.534 577 HG3 ARG 72 HG1 ARG 72 3.877 14.214 -3.135 578 HD2 ARG 72 HD2 ARG 72 6.199 14.681 -2.552 579 HD3 ARG 72 HD1 ARG 72 6.743 13.732 -3.936 580 HE ARG 72 HE ARG 72 5.179 15.513 -5.143 581 HH11 ARG 72 HH11 ARG 72 7.650 15.936 -2.690 582 HH12 ARG 72 HH12 ARG 72 8.032 17.565 -3.174 583 HH21 ARG 72 HH21 ARG 72 5.691 17.638 -5.790 584 HH22 ARG 72 HH22 ARG 72 6.927 18.527 -4.955 585 H GLN 73 HN GLN 73 1.579 12.927 -3.584 586 HA GLN 73 HA GLN 73 0.770 14.179 -1.078 587 HB2 GLN 73 HB2 GLN 73 -0.716 15.530 -2.413 588 HB3 GLN 73 HB1 GLN 73 0.844 15.471 -3.222 589 HG2 GLN 73 HG2 GLN 73 0.009 13.808 -4.771 590 HG3 GLN 73 HG1 GLN 73 -1.542 13.784 -3.938 591 HE21 GLN 73 HE21 GLN 73 -1.526 16.681 -3.520 592 HE22 GLN 73 HE22 GLN 73 -1.893 17.379 -5.060 593 H GLY 74 HN GLY 74 0.201 11.299 -2.520 594 HA2 GLY 74 HA2 GLY 74 -1.316 9.659 -1.886 595 HA3 GLY 74 HA1 GLY 74 -2.266 10.885 -1.065 596 H HIS 75 HN HIS 75 -1.164 10.935 -4.390 597 HA HIS 75 HA HIS 75 -3.962 11.052 -5.245 598 HB2 HIS 75 HB2 HIS 75 -2.629 12.926 -6.018 599 HB3 HIS 75 HB1 HIS 75 -1.402 11.841 -6.662 600 HD1 HIS 75 HD1 HIS 75 -4.963 12.946 -7.306 601 HD2 HIS 75 HD2 HIS 75 -1.840 10.990 -9.241 602 HE1 HIS 75 HE1 HIS 75 -5.695 12.691 -9.703 603 HE2 HIS 75 HE2 HIS 75 -3.876 11.330 -10.802 604 H VAL 76 HN VAL 76 -4.768 9.132 -5.734 605 HA VAL 76 HA VAL 76 -3.560 6.821 -6.513 606 HB VAL 76 HB VAL 76 -5.908 6.839 -6.050 607 HG11 VAL 76 HG11 VAL 76 -6.234 8.582 -8.489 608 HG12 VAL 76 HG12 VAL 76 -6.467 9.071 -6.810 609 HG13 VAL 76 HG13 VAL 76 -7.553 7.891 -7.543 610 HG21 VAL 76 HG21 VAL 76 -5.477 6.161 -8.953 611 HG22 VAL 76 HG22 VAL 76 -6.806 5.588 -7.943 612 HG23 VAL 76 HG23 VAL 76 -5.148 5.107 -7.579 613 H LEU 77 HN LEU 77 -2.168 6.415 -8.074 614 HA LEU 77 HA LEU 77 -2.348 7.903 -10.603 615 HB2 LEU 77 HB2 LEU 77 -0.090 6.261 -9.452 616 HB3 LEU 77 HB1 LEU 77 -0.036 7.116 -10.981 617 HG LEU 77 HG LEU 77 -0.526 8.560 -8.389 618 HD11 LEU 77 HD11 LEU 77 1.826 9.015 -8.225 619 HD12 LEU 77 HD12 LEU 77 2.148 8.080 -9.690 620 HD13 LEU 77 HD13 LEU 77 1.574 7.267 -8.231 621 HD21 LEU 77 HD21 LEU 77 0.331 10.468 -9.641 622 HD22 LEU 77 HD22 LEU 77 -1.057 9.749 -10.458 623 HD23 LEU 77 HD23 LEU 77 0.574 9.443 -11.055 624 H ALA 78 HN ALA 78 -2.108 4.696 -9.212 625 HA ALA 78 HA ALA 78 -3.388 3.539 -11.563 626 HB1 ALA 78 HB1 ALA 78 -0.961 3.305 -11.977 627 HB2 ALA 78 HB2 ALA 78 -1.753 1.745 -11.736 628 HB3 ALA 78 HB3 ALA 78 -0.802 2.462 -10.432 629 H VAL 79 HN VAL 79 -4.592 1.692 -11.023 630 HA VAL 79 HA VAL 79 -4.227 0.517 -8.383 631 HB VAL 79 HB VAL 79 -6.960 1.377 -9.374 632 HG11 VAL 79 HG11 VAL 79 -6.140 -0.013 -6.826 633 HG12 VAL 79 HG12 VAL 79 -7.001 -0.744 -8.179 634 HG13 VAL 79 HG13 VAL 79 -7.770 0.525 -7.228 635 HG21 VAL 79 HG21 VAL 79 -7.022 2.872 -7.454 636 HG22 VAL 79 HG22 VAL 79 -5.672 3.274 -8.515 637 HG23 VAL 79 HG23 VAL 79 -5.382 2.395 -7.014 638 H THR 80 HN THR 80 -4.304 -1.635 -8.519 639 HA THR 80 HA THR 80 -5.748 -2.843 -10.770 640 HB THR 80 HB THR 80 -2.996 -3.763 -9.923 641 HG1 THR 80 HG1 THR 80 -3.793 -1.749 -11.681 642 HG21 THR 80 HG21 THR 80 -4.721 -4.365 -12.332 643 HG22 THR 80 HG22 THR 80 -4.335 -5.470 -11.013 644 HG23 THR 80 HG23 THR 80 -3.064 -4.930 -12.105 645 H LEU 81 HN LEU 81 -7.173 -4.234 -9.962 646 HA LEU 81 HA LEU 81 -7.192 -5.181 -7.328 647 HB2 LEU 81 HB2 LEU 81 -9.158 -5.144 -8.856 648 HB3 LEU 81 HB1 LEU 81 -8.457 -6.489 -9.735 649 HG LEU 81 HG LEU 81 -8.543 -7.825 -7.607 650 HD11 LEU 81 HD11 LEU 81 -8.637 -5.976 -6.031 651 HD12 LEU 81 HD12 LEU 81 -10.033 -7.037 -5.834 652 HD13 LEU 81 HD13 LEU 81 -10.210 -5.494 -6.669 653 HD21 LEU 81 HD21 LEU 81 -11.181 -6.777 -8.626 654 HD22 LEU 81 HD22 LEU 81 -10.914 -8.309 -7.793 655 HD23 LEU 81 HD23 LEU 81 -10.219 -8.041 -9.393 656 H VAL 82 HN VAL 82 -5.959 -6.627 -6.372 657 HA VAL 82 HA VAL 82 -4.124 -8.196 -8.006 658 HB VAL 82 HB VAL 82 -3.935 -8.431 -5.075 659 HG11 VAL 82 HG11 VAL 82 -1.549 -7.758 -5.645 660 HG12 VAL 82 HG12 VAL 82 -2.047 -7.849 -7.336 661 HG13 VAL 82 HG13 VAL 82 -2.132 -9.286 -6.314 662 HG21 VAL 82 HG21 VAL 82 -4.733 -6.145 -5.211 663 HG22 VAL 82 HG22 VAL 82 -3.497 -5.767 -6.413 664 HG23 VAL 82 HG23 VAL 82 -3.025 -6.177 -4.762 665 H SER 83 HN SER 83 -6.473 -8.658 -5.391 666 HA SER 83 HA SER 83 -7.126 -11.281 -6.453 667 HB2 SER 83 HB2 SER 83 -6.382 -10.926 -3.536 668 HB3 SER 83 HB1 SER 83 -6.875 -12.425 -4.325 669 HG SER 83 HG SER 83 -4.426 -11.204 -4.241 670 H SER 84 HN SER 84 -9.237 -11.886 -6.027 671 HA SER 84 HA SER 84 -10.806 -10.150 -4.249 672 HB2 SER 84 HB2 SER 84 -11.125 -9.390 -6.595 673 HB3 SER 84 HB1 SER 84 -11.681 -11.008 -7.022 674 HG SER 84 HG SER 84 -13.202 -9.108 -6.273 675 H ALA 85 HN ALA 85 -11.465 -11.467 -2.701 676 HA ALA 85 HA ALA 85 -11.505 -14.273 -2.897 677 HB1 ALA 85 HB1 ALA 85 -11.135 -13.101 -0.797 678 HB2 ALA 85 HB2 ALA 85 -12.486 -14.225 -0.659 679 HB3 ALA 85 HB3 ALA 85 -12.791 -12.496 -0.829 680 H GLY 86 HN GLY 86 -14.075 -11.873 -3.157 681 HA2 GLY 86 HA2 GLY 86 -15.787 -13.347 -4.724 682 HA3 GLY 86 HA1 GLY 86 -16.201 -13.779 -3.068 683 H LEU 87 HN LEU 87 -15.404 -10.769 -4.831 684 HA LEU 87 HA LEU 87 -17.751 -9.568 -3.507 685 HB2 LEU 87 HB2 LEU 87 -15.376 -7.928 -4.320 686 HB3 LEU 87 HB1 LEU 87 -16.661 -7.505 -3.223 687 HG LEU 87 HG LEU 87 -14.788 -7.742 -1.869 688 HD11 LEU 87 HD11 LEU 87 -15.174 -9.732 -0.498 689 HD12 LEU 87 HD12 LEU 87 -16.232 -10.374 -1.755 690 HD13 LEU 87 HD13 LEU 87 -16.665 -8.887 -0.911 691 HD21 LEU 87 HD21 LEU 87 -13.333 -8.787 -3.542 692 HD22 LEU 87 HD22 LEU 87 -14.113 -10.339 -3.231 693 HD23 LEU 87 HD23 LEU 87 -13.193 -9.542 -1.956 694 HA PRO 88 HA PRO 88 -18.166 -9.118 -8.103 695 HB2 PRO 88 HB2 PRO 88 -20.881 -10.105 -7.772 696 HB3 PRO 88 HB1 PRO 88 -19.564 -10.790 -8.728 697 HG2 PRO 88 HG2 PRO 88 -20.537 -11.986 -6.488 698 HG3 PRO 88 HG1 PRO 88 -18.852 -12.147 -7.017 699 HD2 PRO 88 HD2 PRO 88 -20.014 -10.351 -4.913 700 HD3 PRO 88 HD1 PRO 88 -18.527 -11.327 -4.860 701 H SER 89 HN SER 89 -21.148 -8.825 -6.159 702 HA SER 89 HA SER 89 -21.841 -6.351 -7.418 703 HB2 SER 89 HB2 SER 89 -23.509 -8.014 -6.569 704 HB3 SER 89 HB1 SER 89 -23.026 -7.607 -4.924 705 HG SER 89 HG SER 89 -24.781 -6.363 -6.518 706 H LEU 90 HN LEU 90 -20.007 -7.255 -4.663 707 HA LEU 90 HA LEU 90 -20.342 -4.863 -3.146 708 HB2 LEU 90 HB2 LEU 90 -18.132 -6.921 -3.023 709 HB3 LEU 90 HB1 LEU 90 -18.471 -5.698 -1.814 710 HG LEU 90 HG LEU 90 -20.477 -7.820 -2.543 711 HD11 LEU 90 HD11 LEU 90 -19.668 -9.164 -0.768 712 HD12 LEU 90 HD12 LEU 90 -18.528 -7.919 -0.258 713 HD13 LEU 90 HD13 LEU 90 -18.276 -8.769 -1.786 714 HD21 LEU 90 HD21 LEU 90 -21.369 -5.884 -1.398 715 HD22 LEU 90 HD22 LEU 90 -20.123 -6.013 -0.158 716 HD23 LEU 90 HD23 LEU 90 -21.349 -7.271 -0.309 717 H ASP 91 HN ASP 91 -18.219 -5.888 -5.688 718 HA ASP 91 HA ASP 91 -15.938 -4.399 -5.196 719 HB2 ASP 91 HB2 ASP 91 -16.070 -6.154 -6.893 720 HB3 ASP 91 HB1 ASP 91 -17.141 -5.155 -7.866 721 H ARG 92 HN ARG 92 -18.839 -3.448 -6.988 722 HA ARG 92 HA ARG 92 -17.850 -1.177 -8.213 723 HB2 ARG 92 HB2 ARG 92 -20.198 -0.433 -8.400 724 HB3 ARG 92 HB1 ARG 92 -19.976 -2.117 -8.845 725 HG2 ARG 92 HG2 ARG 92 -20.783 -2.762 -6.585 726 HG3 ARG 92 HG1 ARG 92 -21.132 -1.060 -6.278 727 HD2 ARG 92 HD2 ARG 92 -23.138 -2.222 -6.974 728 HD3 ARG 92 HD1 ARG 92 -22.662 -1.040 -8.194 729 HE ARG 92 HE ARG 92 -21.573 -3.107 -9.297 730 HH11 ARG 92 HH11 ARG 92 -24.584 -3.100 -7.499 731 HH12 ARG 92 HH12 ARG 92 -25.252 -4.439 -8.382 732 HH21 ARG 92 HH21 ARG 92 -22.435 -4.913 -10.412 733 HH22 ARG 92 HH22 ARG 92 -24.028 -5.486 -10.006 734 H GLU 93 HN GLU 93 -19.453 -1.343 -5.018 735 HA GLU 93 HA GLU 93 -19.247 1.502 -4.679 736 HB2 GLU 93 HB2 GLU 93 -21.094 0.073 -3.757 737 HB3 GLU 93 HB1 GLU 93 -19.941 -0.549 -2.587 738 HG2 GLU 93 HG2 GLU 93 -21.233 1.151 -1.537 739 HG3 GLU 93 HG1 GLU 93 -19.601 1.775 -1.774 740 H ILE 94 HN ILE 94 -17.708 -1.295 -3.055 741 HA ILE 94 HA ILE 94 -16.218 0.258 -1.259 742 HB ILE 94 HB ILE 94 -14.897 -1.745 -0.796 743 HG12 ILE 94 HG12 ILE 94 -16.431 -3.012 -3.081 744 HG13 ILE 94 HG11 ILE 94 -14.722 -2.592 -3.116 745 HG21 ILE 94 HG21 ILE 94 -16.745 -3.198 -0.077 746 HG22 ILE 94 HG22 ILE 94 -17.850 -2.271 -1.092 747 HG23 ILE 94 HG23 ILE 94 -17.052 -1.497 0.277 748 HD11 ILE 94 HD11 ILE 94 -16.014 -4.625 -1.309 749 HD12 ILE 94 HD12 ILE 94 -14.304 -4.193 -1.307 750 HD13 ILE 94 HD13 ILE 94 -15.019 -4.959 -2.725 751 H GLN 95 HN GLN 95 -15.449 -0.889 -4.523 752 HA GLN 95 HA GLN 95 -12.749 0.050 -4.295 753 HB2 GLN 95 HB2 GLN 95 -14.268 -0.767 -6.750 754 HB3 GLN 95 HB1 GLN 95 -12.561 -0.509 -6.629 755 HG2 GLN 95 HG2 GLN 95 -13.998 -2.591 -5.035 756 HG3 GLN 95 HG1 GLN 95 -13.277 -2.906 -6.612 757 HE21 GLN 95 HE21 GLN 95 -12.671 -4.109 -4.072 758 HE22 GLN 95 HE22 GLN 95 -11.006 -3.782 -3.751 759 H ALA 96 HN ALA 96 -15.798 1.297 -5.541 760 HA ALA 96 HA ALA 96 -14.795 3.577 -6.802 761 HB1 ALA 96 HB1 ALA 96 -17.194 3.021 -6.775 762 HB2 ALA 96 HB2 ALA 96 -16.903 4.678 -6.247 763 HB3 ALA 96 HB3 ALA 96 -17.261 3.424 -5.059 764 H LEU 97 HN LEU 97 -15.336 2.824 -3.427 765 HA LEU 97 HA LEU 97 -14.690 5.290 -2.321 766 HB2 LEU 97 HB2 LEU 97 -16.004 3.436 -1.320 767 HB3 LEU 97 HB1 LEU 97 -14.517 2.513 -1.169 768 HG LEU 97 HG LEU 97 -13.913 4.876 -0.024 769 HD11 LEU 97 HD11 LEU 97 -16.759 4.154 0.635 770 HD12 LEU 97 HD12 LEU 97 -16.144 5.696 0.010 771 HD13 LEU 97 HD13 LEU 97 -15.761 5.194 1.659 772 HD21 LEU 97 HD21 LEU 97 -14.284 3.501 2.144 773 HD22 LEU 97 HD22 LEU 97 -13.088 2.968 0.961 774 HD23 LEU 97 HD23 LEU 97 -14.683 2.193 1.021 775 H VAL 98 HN VAL 98 -12.818 2.250 -2.441 776 HA VAL 98 HA VAL 98 -10.426 3.622 -1.539 777 HB VAL 98 HB VAL 98 -10.931 0.710 -2.152 778 HG11 VAL 98 HG11 VAL 98 -8.581 1.300 -2.532 779 HG12 VAL 98 HG12 VAL 98 -8.773 0.260 -1.121 780 HG13 VAL 98 HG13 VAL 98 -8.498 1.990 -0.910 781 HG21 VAL 98 HG21 VAL 98 -12.131 1.505 -0.201 782 HG22 VAL 98 HG22 VAL 98 -10.649 2.198 0.454 783 HG23 VAL 98 HG23 VAL 98 -10.803 0.450 0.290 784 H LYS 99 HN LYS 99 -11.400 1.762 -4.404 785 HA LYS 99 HA LYS 99 -8.893 1.900 -5.694 786 HB2 LYS 99 HB2 LYS 99 -10.450 0.151 -6.279 787 HB3 LYS 99 HB1 LYS 99 -11.667 1.312 -6.782 788 HG2 LYS 99 HG2 LYS 99 -10.232 1.986 -8.652 789 HG3 LYS 99 HG1 LYS 99 -9.016 0.816 -8.139 790 HD2 LYS 99 HD2 LYS 99 -11.834 0.199 -9.035 791 HD3 LYS 99 HD1 LYS 99 -10.357 -0.094 -9.957 792 HE2 LYS 99 HE2 LYS 99 -9.606 -1.691 -8.292 793 HE3 LYS 99 HE1 LYS 99 -11.016 -1.347 -7.292 794 HZ1 LYS 99 HZ1 LYS 99 -10.907 -2.769 -9.882 795 HZ2 LYS 99 HZ2 LYS 99 -12.353 -2.097 -9.315 796 HZ3 LYS 99 HZ3 LYS 99 -11.564 -3.293 -8.413 797 H ARG 100 HN ARG 100 -11.555 4.196 -5.504 798 HA ARG 100 HA ARG 100 -10.238 5.789 -7.570 799 HB2 ARG 100 HB2 ARG 100 -12.711 5.704 -7.558 800 HB3 ARG 100 HB1 ARG 100 -12.710 6.462 -5.970 801 HG2 ARG 100 HG2 ARG 100 -13.176 8.074 -7.737 802 HG3 ARG 100 HG1 ARG 100 -11.665 8.451 -6.904 803 HD2 ARG 100 HD2 ARG 100 -11.357 8.723 -9.284 804 HD3 ARG 100 HD1 ARG 100 -10.420 7.336 -8.728 805 HE ARG 100 HE ARG 100 -13.021 7.127 -10.129 806 HH11 ARG 100 HH11 ARG 100 -9.827 5.870 -9.404 807 HH12 ARG 100 HH12 ARG 100 -9.965 4.545 -10.518 808 HH21 ARG 100 HH21 ARG 100 -13.189 5.399 -11.592 809 HH22 ARG 100 HH22 ARG 100 -11.871 4.279 -11.762 810 H ALA 101 HN ALA 101 -10.739 5.761 -4.077 811 HA ALA 101 HA ALA 101 -9.071 8.177 -3.891 812 HB1 ALA 101 HB1 ALA 101 -9.924 8.551 -1.699 813 HB2 ALA 101 HB2 ALA 101 -10.683 6.952 -1.659 814 HB3 ALA 101 HB3 ALA 101 -11.304 8.198 -2.746 815 H SER 102 HN SER 102 -7.254 6.708 -4.452 816 HA SER 102 HA SER 102 -6.339 5.058 -2.235 817 HB2 SER 102 HB2 SER 102 -4.995 5.549 -4.898 818 HB3 SER 102 HB1 SER 102 -4.635 4.264 -3.745 819 HG SER 102 HG SER 102 -7.194 4.057 -4.241 820 HA PRO 103 HA PRO 103 -4.064 8.791 -1.152 821 HB2 PRO 103 HB2 PRO 103 -4.658 8.745 1.467 822 HB3 PRO 103 HB1 PRO 103 -5.859 9.172 0.234 823 HG2 PRO 103 HG2 PRO 103 -5.668 6.741 1.877 824 HG3 PRO 103 HG1 PRO 103 -7.062 7.409 1.014 825 HD2 PRO 103 HD2 PRO 103 -5.232 5.307 0.178 826 HD3 PRO 103 HD1 PRO 103 -6.746 5.835 -0.587 827 H LEU 104 HN LEU 104 -2.132 9.240 -0.228 828 HA LEU 104 HA LEU 104 -0.870 7.362 1.607 829 HB2 LEU 104 HB2 LEU 104 -0.159 7.360 -1.054 830 HB3 LEU 104 HB1 LEU 104 0.973 8.516 -0.381 831 HG LEU 104 HG LEU 104 0.630 5.653 0.525 832 HD11 LEU 104 HD11 LEU 104 2.827 6.999 -1.038 833 HD12 LEU 104 HD12 LEU 104 1.699 5.780 -1.633 834 HD13 LEU 104 HD13 LEU 104 2.888 5.354 -0.404 835 HD21 LEU 104 HD21 LEU 104 1.265 7.075 2.384 836 HD22 LEU 104 HD22 LEU 104 2.579 7.764 1.431 837 HD23 LEU 104 HD23 LEU 104 2.622 6.063 1.890 838 HA PRO 105 HA PRO 105 -0.492 11.481 3.318 839 HB2 PRO 105 HB2 PRO 105 0.588 10.366 5.713 840 HB3 PRO 105 HB1 PRO 105 -1.038 10.982 5.435 841 HG2 PRO 105 HG2 PRO 105 -0.343 8.317 5.864 842 HG3 PRO 105 HG1 PRO 105 -1.874 8.911 5.229 843 HD2 PRO 105 HD2 PRO 105 0.372 7.646 3.811 844 HD3 PRO 105 HD1 PRO 105 -1.354 7.715 3.385 845 H THR 106 HN THR 106 2.024 9.215 4.357 846 HA THR 106 HA THR 106 4.031 11.244 4.380 847 HB THR 106 HB THR 106 4.298 9.416 5.905 848 HG1 THR 106 HG1 THR 106 6.250 9.087 3.855 849 HG21 THR 106 HG21 THR 106 4.721 7.107 5.151 850 HG22 THR 106 HG22 THR 106 4.392 7.602 3.489 851 HG23 THR 106 HG23 THR 106 3.109 7.667 4.699 852 HA PRO 107 HA PRO 107 4.981 10.999 0.010 853 HB2 PRO 107 HB2 PRO 107 7.239 12.742 0.665 854 HB3 PRO 107 HB1 PRO 107 5.835 13.070 -0.353 855 HG2 PRO 107 HG2 PRO 107 6.189 14.259 2.046 856 HG3 PRO 107 HG1 PRO 107 4.583 13.875 1.397 857 HD2 PRO 107 HD2 PRO 107 6.199 12.406 3.451 858 HD3 PRO 107 HD1 PRO 107 4.457 12.758 3.429 859 HA PRO 108 HA PRO 108 8.174 7.981 0.977 860 HB2 PRO 108 HB2 PRO 108 7.395 6.092 -0.716 861 HB3 PRO 108 HB1 PRO 108 6.427 6.477 0.712 862 HG2 PRO 108 HG2 PRO 108 5.983 7.232 -2.139 863 HG3 PRO 108 HG1 PRO 108 4.798 6.794 -0.896 864 HD2 PRO 108 HD2 PRO 108 5.483 9.400 -1.674 865 HD3 PRO 108 HD1 PRO 108 4.602 8.948 -0.203 866 H ALA 109 HN ALA 109 9.225 10.043 -0.381 867 HA ALA 109 HA ALA 109 10.030 9.562 -3.030 868 HB1 ALA 109 HB1 ALA 109 11.815 11.167 -2.612 869 HB2 ALA 109 HB2 ALA 109 11.529 11.051 -0.876 870 HB3 ALA 109 HB3 ALA 109 10.292 11.737 -1.930 871 H ASP 110 HN ASP 110 11.416 8.638 0.062 872 HA ASP 110 HA ASP 110 13.728 7.356 -1.043 873 HB2 ASP 110 HB2 ASP 110 14.130 6.598 1.252 874 HB3 ASP 110 HB1 ASP 110 13.733 8.312 1.222 875 H ALA 111 HN ALA 111 10.663 6.539 -1.387 876 HA ALA 111 HA ALA 111 11.125 3.653 -1.066 877 HB1 ALA 111 HB1 ALA 111 8.738 3.377 -0.901 878 HB2 ALA 111 HB2 ALA 111 8.481 5.092 -1.238 879 HB3 ALA 111 HB3 ALA 111 9.264 4.592 0.264 880 H TYR 112 HN TYR 112 10.440 6.199 -3.316 881 HA TYR 112 HA TYR 112 10.023 4.163 -5.373 882 HB2 TYR 112 HB2 TYR 112 8.519 5.680 -6.583 883 HB3 TYR 112 HB1 TYR 112 7.915 5.083 -5.056 884 HD1 TYR 112 HD2 TYR 112 10.124 8.039 -5.723 885 HD2 TYR 112 HD1 TYR 112 6.360 6.575 -4.404 886 HE1 TYR 112 HE2 TYR 112 9.466 10.319 -5.081 887 HE2 TYR 112 HE1 TYR 112 5.680 8.830 -3.777 888 HH TYR 112 HH TYR 112 7.461 11.609 -4.723 889 H VAL 113 HN VAL 113 12.342 5.840 -4.496 890 HA VAL 113 HA VAL 113 13.067 7.324 -6.823 891 HB VAL 113 HB VAL 113 15.480 6.866 -5.992 892 HG11 VAL 113 HG11 VAL 113 15.296 8.600 -4.288 893 HG12 VAL 113 HG12 VAL 113 13.551 8.357 -4.214 894 HG13 VAL 113 HG13 VAL 113 14.292 8.982 -5.686 895 HG21 VAL 113 HG21 VAL 113 14.836 4.911 -4.584 896 HG22 VAL 113 HG22 VAL 113 13.999 6.025 -3.499 897 HG23 VAL 113 HG23 VAL 113 15.743 6.148 -3.718 898 H ASN 114 HN ASN 114 12.643 6.204 -8.560 899 HA ASN 114 HA ASN 114 14.084 4.364 -9.891 900 HB2 ASN 114 HB2 ASN 114 13.350 2.175 -9.389 901 HB3 ASN 114 HB1 ASN 114 13.571 2.885 -7.796 902 HD21 ASN 114 HD21 ASN 114 11.757 3.293 -6.512 903 HD22 ASN 114 HD22 ASN 114 10.200 2.645 -6.885 904 H GLY 115 HN GLY 115 11.058 5.578 -8.842 905 HA2 GLY 115 HA2 GLY 115 10.034 6.376 -11.246 906 HA3 GLY 115 HA1 GLY 115 9.461 4.722 -11.057 907 H THR 116 HN THR 116 8.184 4.202 -9.197 908 HA THR 116 HA THR 116 7.117 6.261 -7.523 909 HB THR 116 HB THR 116 4.956 4.968 -9.116 910 HG1 THR 116 HG1 THR 116 6.780 6.869 -10.155 911 HG21 THR 116 HG21 THR 116 3.990 7.261 -8.861 912 HG22 THR 116 HG22 THR 116 5.440 7.715 -7.964 913 HG23 THR 116 HG23 THR 116 4.366 6.469 -7.335 914 H VAL 117 HN VAL 117 5.151 5.127 -6.225 915 HA VAL 117 HA VAL 117 6.160 2.452 -5.612 916 HB VAL 117 HB VAL 117 5.009 2.638 -3.435 917 HG11 VAL 117 HG11 VAL 117 6.900 4.894 -4.045 918 HG12 VAL 117 HG12 VAL 117 7.319 3.262 -3.522 919 HG13 VAL 117 HG13 VAL 117 6.462 4.348 -2.426 920 HG21 VAL 117 HG21 VAL 117 4.309 5.433 -4.329 921 HG22 VAL 117 HG22 VAL 117 4.189 4.850 -2.667 922 HG23 VAL 117 HG23 VAL 117 3.190 4.126 -3.926 923 H GLU 118 HN GLU 118 5.083 0.974 -6.738 924 HA GLU 118 HA GLU 118 2.165 0.976 -6.402 925 HB2 GLU 118 HB2 GLU 118 3.029 0.693 -8.753 926 HB3 GLU 118 HB1 GLU 118 3.801 -0.801 -8.234 927 HG2 GLU 118 HG2 GLU 118 1.554 -1.636 -7.557 928 HG3 GLU 118 HG1 GLU 118 0.859 -0.187 -8.283 929 H LEU 119 HN LEU 119 1.573 -0.114 -4.656 930 HA LEU 119 HA LEU 119 3.074 -2.526 -3.958 931 HB2 LEU 119 HB2 LEU 119 3.325 -1.905 -1.684 932 HB3 LEU 119 HB1 LEU 119 3.912 -0.561 -2.640 933 HG LEU 119 HG LEU 119 1.342 0.217 -2.211 934 HD11 LEU 119 HD11 LEU 119 2.210 -1.285 0.246 935 HD12 LEU 119 HD12 LEU 119 0.873 -1.719 -0.820 936 HD13 LEU 119 HD13 LEU 119 0.805 -0.226 0.118 937 HD21 LEU 119 HD21 LEU 119 3.726 0.686 -0.420 938 HD22 LEU 119 HD22 LEU 119 2.264 1.671 -0.450 939 HD23 LEU 119 HD23 LEU 119 3.309 1.599 -1.869 940 H THR 120 HN THR 120 1.895 -3.959 -2.546 941 HA THR 120 HA THR 120 -0.926 -3.897 -3.277 942 HB THR 120 HB THR 120 0.787 -6.145 -2.213 943 HG1 THR 120 HG1 THR 120 1.343 -6.286 -4.247 944 HG21 THR 120 HG21 THR 120 -1.577 -6.379 -1.598 945 HG22 THR 120 HG22 THR 120 -1.081 -7.597 -2.777 946 HG23 THR 120 HG23 THR 120 -2.029 -6.201 -3.295 947 H LEU 121 HN LEU 121 -2.350 -3.217 -1.839 948 HA LEU 121 HA LEU 121 -1.932 -3.935 0.988 949 HB2 LEU 121 HB2 LEU 121 -3.069 -1.402 -0.184 950 HB3 LEU 121 HB1 LEU 121 -3.362 -1.879 1.478 951 HG LEU 121 HG LEU 121 -0.677 -1.280 0.241 952 HD11 LEU 121 HD11 LEU 121 -1.807 0.755 0.625 953 HD12 LEU 121 HD12 LEU 121 -0.696 0.540 1.974 954 HD13 LEU 121 HD13 LEU 121 -2.417 0.210 2.187 955 HD21 LEU 121 HD21 LEU 121 -0.505 -3.084 1.855 956 HD22 LEU 121 HD22 LEU 121 -1.386 -2.123 3.045 957 HD23 LEU 121 HD23 LEU 121 0.209 -1.602 2.498 958 HA PRO 122 HA PRO 122 -5.863 -5.949 0.258 959 HB2 PRO 122 HB2 PRO 122 -5.739 -6.709 3.069 960 HB3 PRO 122 HB1 PRO 122 -5.666 -7.740 1.639 961 HG2 PRO 122 HG2 PRO 122 -3.538 -7.323 3.277 962 HG3 PRO 122 HG1 PRO 122 -3.379 -7.672 1.545 963 HD2 PRO 122 HD2 PRO 122 -3.191 -5.050 2.979 964 HD3 PRO 122 HD1 PRO 122 -2.224 -5.666 1.620 965 H ILE 123 HN ILE 123 -7.639 -4.711 0.255 966 HA ILE 123 HA ILE 123 -8.062 -2.823 2.437 967 HB ILE 123 HB ILE 123 -9.772 -1.776 1.075 968 HG12 ILE 123 HG12 ILE 123 -9.284 -3.899 -1.012 969 HG13 ILE 123 HG11 ILE 123 -10.667 -3.900 0.076 970 HG21 ILE 123 HG21 ILE 123 -8.425 -1.227 -0.996 971 HG22 ILE 123 HG22 ILE 123 -7.258 -2.434 -0.447 972 HG23 ILE 123 HG23 ILE 123 -7.586 -1.015 0.547 973 HD11 ILE 123 HD11 ILE 123 -10.008 -1.799 -1.971 974 HD12 ILE 123 HD12 ILE 123 -11.362 -1.730 -0.845 975 HD13 ILE 123 HD13 ILE 123 -11.296 -2.998 -2.070 976 H ASP 124 HN ASP 124 -8.963 -3.776 4.174 977 HA ASP 124 HA ASP 124 -10.882 -5.915 3.664 978 HB2 ASP 124 HB2 ASP 124 -10.572 -6.603 5.951 979 HB3 ASP 124 HB1 ASP 124 -8.994 -6.368 5.210 980 H PHE 125 HN PHE 125 -12.910 -5.506 3.660 981 HA PHE 125 HA PHE 125 -14.020 -3.742 5.742 982 HB2 PHE 125 HB2 PHE 125 -15.291 -4.794 3.203 983 HB3 PHE 125 HB1 PHE 125 -16.115 -3.804 4.397 984 HD1 PHE 125 HD1 PHE 125 -13.493 -3.843 1.810 985 HD2 PHE 125 HD2 PHE 125 -15.838 -1.449 4.432 986 HE1 PHE 125 HE1 PHE 125 -12.765 -1.821 0.611 987 HE2 PHE 125 HE2 PHE 125 -15.116 0.573 3.235 988 HZ PHE 125 HZ PHE 125 -13.577 0.389 1.323 989 H SER 126 HN SER 126 -15.282 -4.751 7.299 990 HA SER 126 HA SER 126 -14.907 -7.485 7.730 991 HB2 SER 126 HB2 SER 126 -17.118 -5.754 8.861 992 HB3 SER 126 HB1 SER 126 -16.483 -7.243 9.560 993 HG SER 126 HG SER 126 -14.371 -5.806 9.281 994 H LEU 127 HN LEU 127 -15.571 -8.953 6.294 995 HA LEU 127 HA LEU 127 -18.024 -8.578 4.783 996 HB2 LEU 127 HB2 LEU 127 -15.613 -9.559 4.093 997 HB3 LEU 127 HB1 LEU 127 -16.403 -11.058 4.536 998 HG LEU 127 HG LEU 127 -17.413 -9.124 2.443 999 HD11 LEU 127 HD11 LEU 127 -15.329 -10.225 1.790 1000 HD12 LEU 127 HD12 LEU 127 -16.700 -10.768 0.823 1001 HD13 LEU 127 HD13 LEU 127 -16.065 -11.797 2.110 1002 HD21 LEU 127 HD21 LEU 127 -18.340 -11.897 3.168 1003 HD22 LEU 127 HD22 LEU 127 -18.927 -10.924 1.819 1004 HD23 LEU 127 HD23 LEU 127 -19.212 -10.394 3.479 1005 H ARG 128 HN ARG 128 -19.484 -8.805 6.582 1006 HA ARG 128 HA ARG 128 -19.607 -11.165 8.141 1007 HB2 ARG 128 HB2 ARG 128 -21.549 -8.935 7.588 1008 HB3 ARG 128 HB1 ARG 128 -21.948 -10.280 8.639 1009 HG2 ARG 128 HG2 ARG 128 -20.159 -9.704 10.144 1010 HG3 ARG 128 HG1 ARG 128 -19.606 -8.438 9.044 1011 HD2 ARG 128 HD2 ARG 128 -20.946 -7.597 10.969 1012 HD3 ARG 128 HD1 ARG 128 -21.604 -7.170 9.391 1013 HE ARG 128 HE ARG 128 -22.840 -9.533 10.158 1014 HH11 ARG 128 HH11 ARG 128 -22.595 -6.259 11.376 1015 HH12 ARG 128 HH12 ARG 128 -24.194 -6.244 12.050 1016 HH21 ARG 128 HH21 ARG 128 -24.938 -9.546 11.065 1017 HH22 ARG 128 HH22 ARG 128 -25.529 -8.122 11.879 1018 H GLY 129 HN GLY 129 -21.652 -10.037 5.426 1019 HA2 GLY 129 HA2 GLY 129 -21.869 -12.662 4.345 1020 HA3 GLY 129 HA1 GLY 129 -23.309 -12.248 5.262 1021 H ALA 130 HN ALA 130 -21.211 -11.009 2.679 1022 HA ALA 130 HA ALA 130 -23.600 -10.381 1.131 1023 HB1 ALA 130 HB1 ALA 130 -22.753 -8.139 0.544 1024 HB2 ALA 130 HB2 ALA 130 -21.465 -8.340 1.732 1025 HB3 ALA 130 HB3 ALA 130 -23.149 -8.291 2.257 1026 H GLY 131 HN GLY 131 -21.083 -12.171 1.162 1027 HA2 GLY 131 HA2 GLY 131 -19.764 -11.272 -1.303 1028 HA3 GLY 131 HA1 GLY 131 -19.165 -12.502 -0.201 1029 H PHE 132 HN PHE 132 -22.472 -12.466 -1.248 1030 HA PHE 132 HA PHE 132 -21.953 -14.913 -2.770 1031 HB2 PHE 132 HB2 PHE 132 -24.357 -15.429 -2.441 1032 HB3 PHE 132 HB1 PHE 132 -23.487 -15.278 -0.922 1033 HD1 PHE 132 HD2 PHE 132 -23.813 -13.260 0.487 1034 HD2 PHE 132 HD1 PHE 132 -26.162 -14.000 -2.984 1035 HE1 PHE 132 HE2 PHE 132 -25.482 -11.637 1.274 1036 HE2 PHE 132 HE1 PHE 132 -27.841 -12.380 -2.198 1037 HZ PHE 132 HZ PHE 132 -27.500 -11.196 -0.065
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