NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
501333 | 2l2q | 17150 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 H GLY 1 8.522 -22.050 -0.217 2 HA2 GLY 1 1HA GLY 1 9.668 -22.654 -2.198 3 HA3 GLY 1 2HA GLY 1 8.165 -22.481 -3.092 4 HA PRO 2 HA PRO 2 10.854 -18.765 -3.890 5 HB2 PRO 2 1HB PRO 2 10.654 -18.889 -6.594 6 HB3 PRO 2 2HB PRO 2 11.889 -19.764 -5.682 7 HG2 PRO 2 1HG PRO 2 9.293 -20.759 -6.793 8 HG3 PRO 2 2HG PRO 2 10.888 -21.534 -6.811 9 HD2 PRO 2 1HD PRO 2 8.958 -22.213 -5.037 10 HD3 PRO 2 2HD PRO 2 10.687 -22.284 -4.640 11 H GLY 3 H GLY 3 9.023 -17.646 -2.924 12 HA2 GLY 3 1HA GLY 3 7.374 -16.371 -4.988 13 HA3 GLY 3 2HA GLY 3 6.561 -17.103 -3.612 14 H SER 4 H SER 4 6.294 -14.406 -4.233 15 HA SER 4 HA SER 4 7.057 -13.224 -1.744 16 HB2 SER 4 1HB SER 4 8.355 -11.338 -2.758 17 HB3 SER 4 2HB SER 4 9.178 -12.894 -2.855 18 HG SER 4 HG SER 4 7.986 -11.373 -4.885 19 H MET 5 H MET 5 6.526 -10.726 -1.888 20 HA MET 5 HA MET 5 4.216 -10.294 -3.640 21 HB2 MET 5 1HB MET 5 3.730 -11.100 -1.155 22 HB3 MET 5 2HB MET 5 3.988 -9.396 -0.807 23 HG2 MET 5 1HG MET 5 2.251 -9.664 -3.064 24 HG3 MET 5 2HG MET 5 1.650 -10.640 -1.725 25 HE1 MET 5 3HE MET 5 0.859 -9.640 0.619 26 HE2 MET 5 1HE MET 5 2.550 -9.174 0.808 27 HE3 MET 5 2HE MET 5 1.272 -8.001 1.125 28 H ASN 6 H ASN 6 3.608 -8.048 -3.863 29 HA ASN 6 HA ASN 6 5.714 -6.156 -3.064 30 HB2 ASN 6 1HB ASN 6 4.347 -6.056 -5.753 31 HB3 ASN 6 2HB ASN 6 5.770 -5.162 -5.225 32 HD21 ASN 6 2HD2 ASN 6 7.718 -5.996 -5.594 33 HD22 ASN 6 1HD2 ASN 6 8.020 -7.584 -6.206 34 H ILE 7 H ILE 7 4.956 -4.415 -2.058 35 HA ILE 7 HA ILE 7 2.098 -3.763 -2.365 36 HB ILE 7 HB ILE 7 3.842 -3.155 0.023 37 HG12 ILE 7 1HG1 ILE 7 1.965 -4.941 0.889 38 HG13 ILE 7 2HG1 ILE 7 2.295 -5.546 -0.731 39 HG21 ILE 7 1HG2 ILE 7 1.681 -2.678 1.121 40 HG22 ILE 7 2HG2 ILE 7 2.020 -1.593 -0.226 41 HG23 ILE 7 3HG2 ILE 7 0.871 -2.916 -0.427 42 HD11 ILE 7 3HD1 ILE 7 4.142 -6.508 -0.007 43 HD12 ILE 7 1HD1 ILE 7 4.769 -4.951 0.532 44 HD13 ILE 7 2HD1 ILE 7 3.791 -5.934 1.623 45 H LEU 8 H LEU 8 1.562 -1.792 -3.069 46 HA LEU 8 HA LEU 8 3.723 0.168 -3.423 47 HB2 LEU 8 1HB LEU 8 2.752 -0.427 -5.504 48 HB3 LEU 8 2HB LEU 8 1.119 -0.256 -4.865 49 HG LEU 8 HG LEU 8 1.525 2.198 -4.674 50 HD11 LEU 8 1HD1 LEU 8 4.192 1.391 -5.277 51 HD12 LEU 8 2HD1 LEU 8 3.583 2.992 -4.861 52 HD13 LEU 8 3HD1 LEU 8 3.617 2.473 -6.546 53 HD21 LEU 8 3HD2 LEU 8 1.479 0.693 -7.235 54 HD22 LEU 8 1HD2 LEU 8 1.703 2.441 -7.302 55 HD23 LEU 8 2HD2 LEU 8 0.270 1.765 -6.528 56 H LEU 9 H LEU 9 3.581 2.191 -2.590 57 HA LEU 9 HA LEU 9 1.160 2.829 -1.034 58 HB2 LEU 9 1HB LEU 9 3.494 2.300 0.104 59 HB3 LEU 9 2HB LEU 9 3.793 3.992 -0.289 60 HG LEU 9 HG LEU 9 1.239 3.662 1.025 61 HD11 LEU 9 1HD1 LEU 9 2.171 1.750 2.111 62 HD12 LEU 9 2HD1 LEU 9 2.201 3.092 3.253 63 HD13 LEU 9 3HD1 LEU 9 3.682 2.601 2.432 64 HD21 LEU 9 3HD2 LEU 9 3.725 5.109 1.921 65 HD22 LEU 9 1HD2 LEU 9 2.057 5.440 2.388 66 HD23 LEU 9 2HD2 LEU 9 2.587 5.749 0.734 67 H VAL 10 H VAL 10 0.202 4.728 -1.431 68 HA VAL 10 HA VAL 10 1.545 6.567 -3.295 69 HB VAL 10 HB VAL 10 -1.408 6.431 -2.685 70 HG11 VAL 10 1HG1 VAL 10 -1.713 8.067 -4.214 71 HG12 VAL 10 2HG1 VAL 10 -0.053 8.478 -3.778 72 HG13 VAL 10 3HG1 VAL 10 -0.375 7.522 -5.225 73 HG21 VAL 10 3HG2 VAL 10 -1.670 5.221 -4.774 74 HG22 VAL 10 1HG2 VAL 10 0.076 5.234 -5.023 75 HG23 VAL 10 2HG2 VAL 10 -0.616 4.324 -3.680 76 H CYS 11 H CYS 11 2.534 8.142 -2.195 77 HA CYS 11 HA CYS 11 1.039 10.045 -0.729 78 HB2 CYS 11 1HB CYS 11 1.247 8.203 0.975 79 HB3 CYS 11 2HB CYS 11 2.990 8.444 0.934 80 HG CYS 11 HG CYS 11 1.336 11.279 1.489 81 H GLY 12 H GLY 12 4.359 8.723 -0.728 82 HA2 GLY 12 1HA GLY 12 5.395 11.444 -1.034 83 HA3 GLY 12 2HA GLY 12 6.336 10.017 -0.627 84 H ALA 13 H ALA 13 7.406 11.610 -2.464 85 HA ALA 13 HA ALA 13 6.716 10.477 -5.085 86 HB1 ALA 13 3HB ALA 13 8.370 12.898 -4.382 87 HB2 ALA 13 1HB ALA 13 8.060 12.320 -6.020 88 HB3 ALA 13 2HB ALA 13 6.726 12.894 -5.019 89 H GLY 14 H GLY 14 8.038 8.776 -3.324 90 HA2 GLY 14 1HA GLY 14 9.795 7.295 -3.339 91 HA3 GLY 14 2HA GLY 14 10.246 7.966 -4.899 92 H MET 15 H MET 15 10.185 9.150 -1.532 93 HA MET 15 HA MET 15 12.845 10.305 -1.985 94 HB2 MET 15 1HB MET 15 12.399 11.714 -0.053 95 HB3 MET 15 2HB MET 15 11.084 11.845 -1.214 96 HG2 MET 15 1HG MET 15 9.657 10.502 0.117 97 HG3 MET 15 2HG MET 15 10.984 10.031 1.177 98 HE1 MET 15 3HE MET 15 9.185 11.354 3.630 99 HE2 MET 15 1HE MET 15 8.038 12.271 2.653 100 HE3 MET 15 2HE MET 15 8.502 10.640 2.168 101 H SER 16 H SER 16 14.460 10.121 -0.310 102 HA SER 16 HA SER 16 14.571 7.452 0.767 103 HB2 SER 16 1HB SER 16 16.701 9.189 1.684 104 HB3 SER 16 2HB SER 16 16.791 7.763 0.650 105 HG SER 16 HG SER 16 16.902 10.386 -0.021 106 H THR 17 H THR 17 14.883 6.909 2.969 107 HA THR 17 HA THR 17 14.442 6.988 5.201 108 HB THR 17 HB THR 17 14.501 9.982 5.191 109 HG1 THR 17 HG1 THR 17 16.697 8.231 4.740 110 HG21 THR 17 3HG2 THR 17 14.154 8.928 7.318 111 HG22 THR 17 1HG2 THR 17 15.802 9.552 7.285 112 HG23 THR 17 2HG2 THR 17 15.507 7.829 7.051 113 H SER 18 H SER 18 12.372 6.288 5.350 114 HA SER 18 HA SER 18 10.291 8.361 5.482 115 HB2 SER 18 1HB SER 18 10.405 6.016 3.716 116 HB3 SER 18 2HB SER 18 8.895 6.160 4.616 117 HG SER 18 HG SER 18 8.384 7.580 3.162 118 H MET 19 H MET 19 8.696 8.051 7.020 119 HA MET 19 HA MET 19 9.419 6.560 9.309 120 HB2 MET 19 1HB MET 19 6.815 7.899 8.561 121 HB3 MET 19 2HB MET 19 7.151 7.213 10.145 122 HG2 MET 19 1HG MET 19 8.504 8.912 10.751 123 HG3 MET 19 2HG MET 19 9.120 9.151 9.117 124 HE1 MET 19 3HE MET 19 6.731 11.996 11.218 125 HE2 MET 19 1HE MET 19 7.853 10.740 11.742 126 HE3 MET 19 2HE MET 19 8.408 12.028 10.671 127 H LEU 20 H LEU 20 6.491 6.203 7.297 128 HA LEU 20 HA LEU 20 5.656 3.768 8.310 129 HB2 LEU 20 1HB LEU 20 5.249 5.206 5.741 130 HB3 LEU 20 2HB LEU 20 4.743 3.521 5.836 131 HG LEU 20 HG LEU 20 3.780 5.696 7.690 132 HD11 LEU 20 1HD1 LEU 20 1.614 5.067 6.277 133 HD12 LEU 20 2HD1 LEU 20 2.837 4.777 5.040 134 HD13 LEU 20 3HD1 LEU 20 2.715 6.362 5.804 135 HD21 LEU 20 3HD2 LEU 20 3.447 3.741 8.856 136 HD22 LEU 20 1HD2 LEU 20 3.226 2.780 7.394 137 HD23 LEU 20 2HD2 LEU 20 1.941 3.856 7.943 138 H VAL 21 H VAL 21 7.763 4.383 5.514 139 HA VAL 21 HA VAL 21 8.149 1.727 4.735 140 HB VAL 21 HB VAL 21 10.125 4.002 4.509 141 HG11 VAL 21 1HG1 VAL 21 11.488 2.547 3.537 142 HG12 VAL 21 2HG1 VAL 21 10.323 1.251 3.813 143 HG13 VAL 21 3HG1 VAL 21 10.252 2.200 2.328 144 HG21 VAL 21 3HG2 VAL 21 9.167 4.315 2.259 145 HG22 VAL 21 1HG2 VAL 21 7.945 3.098 2.629 146 HG23 VAL 21 2HG2 VAL 21 7.988 4.610 3.536 147 H GLN 22 H GLN 22 9.967 3.732 7.027 148 HA GLN 22 HA GLN 22 12.016 1.919 7.594 149 HB2 GLN 22 1HB GLN 22 10.817 4.255 8.992 150 HB3 GLN 22 2HB GLN 22 11.847 3.186 9.935 151 HG2 GLN 22 1HG GLN 22 12.797 4.233 7.308 152 HG3 GLN 22 2HG GLN 22 12.862 5.252 8.744 153 HE21 GLN 22 2HE2 GLN 22 15.170 5.207 8.385 154 HE22 GLN 22 1HE2 GLN 22 16.097 3.876 8.979 155 H ARG 23 H ARG 23 9.046 2.528 9.478 156 HA ARG 23 HA ARG 23 9.356 0.508 11.347 157 HB2 ARG 23 1HB ARG 23 6.744 1.461 10.158 158 HB3 ARG 23 2HB ARG 23 6.951 0.655 11.707 159 HG2 ARG 23 1HG ARG 23 8.628 2.982 11.565 160 HG3 ARG 23 2HG ARG 23 6.953 3.400 11.198 161 HD2 ARG 23 1HD ARG 23 7.303 3.607 13.566 162 HD3 ARG 23 2HD ARG 23 6.259 2.219 13.264 163 HE ARG 23 HE ARG 23 9.011 1.481 13.436 164 HH11 ARG 23 1HH1 ARG 23 6.188 2.265 15.318 165 HH12 ARG 23 2HH1 ARG 23 6.700 1.359 16.703 166 HH21 ARG 23 1HH2 ARG 23 9.695 0.285 15.254 167 HH22 ARG 23 2HH2 ARG 23 8.695 0.234 16.666 168 H ILE 24 H ILE 24 7.385 0.344 8.375 169 HA ILE 24 HA ILE 24 6.685 -2.326 8.510 170 HB ILE 24 HB ILE 24 7.270 -0.736 6.010 171 HG12 ILE 24 1HG1 ILE 24 4.572 -1.236 7.251 172 HG13 ILE 24 2HG1 ILE 24 5.552 0.152 7.709 173 HG21 ILE 24 1HG2 ILE 24 5.252 -2.552 5.477 174 HG22 ILE 24 2HG2 ILE 24 6.931 -2.666 4.953 175 HG23 ILE 24 3HG2 ILE 24 6.414 -3.471 6.434 176 HD11 ILE 24 3HD1 ILE 24 4.225 -0.449 5.107 177 HD12 ILE 24 1HD1 ILE 24 4.167 1.017 6.086 178 HD13 ILE 24 2HD1 ILE 24 5.622 0.626 5.169 179 H GLU 25 H GLU 25 9.498 -0.904 6.850 180 HA GLU 25 HA GLU 25 10.606 -3.256 5.870 181 HB2 GLU 25 1HB GLU 25 11.771 -0.606 6.652 182 HB3 GLU 25 2HB GLU 25 12.830 -1.919 6.158 183 HG2 GLU 25 1HG GLU 25 10.584 -0.776 4.512 184 HG3 GLU 25 2HG GLU 25 12.296 -0.407 4.312 185 H LYS 26 H LYS 26 10.885 -1.771 9.049 186 HA LYS 26 HA LYS 26 12.927 -3.444 10.050 187 HB2 LYS 26 1HB LYS 26 10.937 -1.570 11.201 188 HB3 LYS 26 2HB LYS 26 11.610 -2.769 12.297 189 HG2 LYS 26 1HG LYS 26 13.823 -1.781 10.973 190 HG3 LYS 26 2HG LYS 26 12.803 -0.361 11.217 191 HD2 LYS 26 1HD LYS 26 12.618 -0.970 13.616 192 HD3 LYS 26 2HD LYS 26 13.752 -2.293 13.332 193 HE2 LYS 26 1HE LYS 26 14.793 0.180 12.287 194 HE3 LYS 26 2HE LYS 26 14.352 0.365 13.984 195 HZ1 LYS 26 3HZ LYS 26 15.622 -1.957 14.080 196 HZ2 LYS 26 1HZ LYS 26 16.409 -0.472 14.274 197 HZ3 LYS 26 2HZ LYS 26 16.442 -1.257 12.776 198 H TYR 27 H TYR 27 9.405 -3.549 10.611 199 HA TYR 27 HA TYR 27 9.298 -5.889 12.075 200 HB2 TYR 27 1HB TYR 27 7.349 -4.481 11.826 201 HB3 TYR 27 2HB TYR 27 7.297 -4.788 10.093 202 HD1 TYR 27 HD1 TYR 27 6.547 -6.966 9.239 203 HD2 TYR 27 HD2 TYR 27 6.490 -6.084 13.401 204 HE1 TYR 27 HE1 TYR 27 5.054 -8.883 9.618 205 HE2 TYR 27 HE2 TYR 27 4.997 -7.999 13.791 206 HH TYR 27 HH TYR 27 3.313 -9.535 11.400 207 H ALA 28 H ALA 28 9.081 -5.510 8.547 208 HA ALA 28 HA ALA 28 8.810 -8.255 7.961 209 HB1 ALA 28 3HB ALA 28 8.561 -6.029 6.497 210 HB2 ALA 28 1HB ALA 28 10.167 -6.537 5.976 211 HB3 ALA 28 2HB ALA 28 8.793 -7.626 5.787 212 H LYS 29 H LYS 29 11.663 -6.126 7.914 213 HA LYS 29 HA LYS 29 13.537 -8.047 7.137 214 HB2 LYS 29 1HB LYS 29 14.053 -5.673 7.119 215 HB3 LYS 29 2HB LYS 29 13.892 -5.594 8.868 216 HG2 LYS 29 1HG LYS 29 15.820 -7.594 8.051 217 HG3 LYS 29 2HG LYS 29 16.223 -5.988 7.438 218 HD2 LYS 29 1HD LYS 29 16.405 -5.083 9.568 219 HD3 LYS 29 2HD LYS 29 15.425 -6.355 10.300 220 HE2 LYS 29 1HE LYS 29 17.282 -7.957 9.751 221 HE3 LYS 29 2HE LYS 29 18.256 -6.561 9.290 222 HZ1 LYS 29 3HZ LYS 29 16.999 -6.451 11.912 223 HZ2 LYS 29 1HZ LYS 29 18.535 -5.937 11.424 224 HZ3 LYS 29 2HZ LYS 29 18.251 -7.575 11.733 225 H SER 30 H SER 30 12.037 -7.437 10.209 226 HA SER 30 HA SER 30 13.943 -9.035 11.690 227 HB2 SER 30 1HB SER 30 12.613 -7.001 12.576 228 HB3 SER 30 2HB SER 30 11.267 -8.130 12.731 229 HG SER 30 HG SER 30 12.808 -9.456 13.974 230 H LYS 31 H LYS 31 10.606 -9.327 10.549 231 HA LYS 31 HA LYS 31 10.193 -11.916 11.679 232 HB2 LYS 31 1HB LYS 31 8.715 -10.344 9.569 233 HB3 LYS 31 2HB LYS 31 8.200 -11.937 10.107 234 HG2 LYS 31 1HG LYS 31 8.465 -9.490 11.843 235 HG3 LYS 31 2HG LYS 31 6.957 -10.174 11.230 236 HD2 LYS 31 1HD LYS 31 6.869 -11.433 13.063 237 HD3 LYS 31 2HD LYS 31 8.290 -12.298 12.471 238 HE2 LYS 31 1HE LYS 31 9.744 -10.712 13.618 239 HE3 LYS 31 2HE LYS 31 8.336 -9.810 14.180 240 HZ1 LYS 31 3HZ LYS 31 9.211 -11.297 15.885 241 HZ2 LYS 31 1HZ LYS 31 8.952 -12.631 14.877 242 HZ3 LYS 31 2HZ LYS 31 7.637 -11.733 15.444 243 H ASN 32 H ASN 32 11.838 -10.784 8.928 244 HA ASN 32 HA ASN 32 12.936 -11.836 7.237 245 HB2 ASN 32 1HB ASN 32 13.468 -13.402 9.240 246 HB3 ASN 32 2HB ASN 32 12.311 -14.496 8.488 247 HD21 ASN 32 2HD2 ASN 32 15.314 -14.487 8.899 248 HD22 ASN 32 1HD2 ASN 32 15.947 -14.877 7.339 249 H ILE 33 H ILE 33 10.700 -11.078 6.309 250 HA ILE 33 HA ILE 33 9.356 -13.413 5.116 251 HB ILE 33 HB ILE 33 8.275 -10.617 5.487 252 HG12 ILE 33 1HG1 ILE 33 7.240 -13.135 6.771 253 HG13 ILE 33 2HG1 ILE 33 8.521 -12.189 7.520 254 HG21 ILE 33 1HG2 ILE 33 6.162 -11.541 4.671 255 HG22 ILE 33 2HG2 ILE 33 7.433 -11.660 3.455 256 HG23 ILE 33 3HG2 ILE 33 6.955 -13.088 4.372 257 HD11 ILE 33 3HD1 ILE 33 6.882 -10.212 7.262 258 HD12 ILE 33 1HD1 ILE 33 5.661 -11.469 7.064 259 HD13 ILE 33 2HD1 ILE 33 6.617 -11.392 8.545 260 H ASN 34 H ASN 34 9.035 -13.497 2.912 261 HA ASN 34 HA ASN 34 10.852 -11.894 1.332 262 HB2 ASN 34 1HB ASN 34 9.115 -14.284 0.770 263 HB3 ASN 34 2HB ASN 34 9.863 -13.385 -0.547 264 HD21 ASN 34 2HD2 ASN 34 10.351 -16.098 0.135 265 HD22 ASN 34 1HD2 ASN 34 12.016 -16.232 0.574 266 H ALA 35 H ALA 35 9.796 -9.844 1.581 267 HA ALA 35 HA ALA 35 7.774 -9.415 -0.459 268 HB1 ALA 35 3HB ALA 35 6.526 -7.932 1.302 269 HB2 ALA 35 1HB ALA 35 6.200 -9.662 1.195 270 HB3 ALA 35 2HB ALA 35 7.267 -9.042 2.455 271 H THR 36 H THR 36 7.446 -7.113 -0.925 272 HA THR 36 HA THR 36 9.574 -5.354 0.060 273 HB THR 36 HB THR 36 10.405 -6.344 -2.041 274 HG1 THR 36 HG1 THR 36 11.159 -4.433 -2.696 275 HG21 THR 36 3HG2 THR 36 9.292 -6.260 -4.055 276 HG22 THR 36 1HG2 THR 36 8.315 -4.871 -3.581 277 HG23 THR 36 2HG2 THR 36 7.939 -6.472 -2.943 278 H ILE 37 H ILE 37 9.177 -3.089 -0.328 279 HA ILE 37 HA ILE 37 6.459 -2.383 -1.145 280 HB ILE 37 HB ILE 37 6.372 -2.677 1.301 281 HG12 ILE 37 1HG1 ILE 37 6.230 0.267 0.669 282 HG13 ILE 37 2HG1 ILE 37 5.075 -0.883 0.004 283 HG21 ILE 37 1HG2 ILE 37 7.851 -1.799 2.750 284 HG22 ILE 37 2HG2 ILE 37 8.898 -1.705 1.335 285 HG23 ILE 37 3HG2 ILE 37 7.988 -0.286 1.853 286 HD11 ILE 37 3HD1 ILE 37 4.973 -1.514 2.632 287 HD12 ILE 37 1HD1 ILE 37 5.304 0.217 2.708 288 HD13 ILE 37 2HD1 ILE 37 3.892 -0.374 1.831 289 H GLU 38 H GLU 38 6.222 -0.276 -1.898 290 HA GLU 38 HA GLU 38 8.566 1.465 -1.892 291 HB2 GLU 38 1HB GLU 38 8.339 -0.125 -4.000 292 HB3 GLU 38 2HB GLU 38 7.176 1.093 -4.505 293 HG2 GLU 38 1HG GLU 38 8.763 2.584 -4.990 294 HG3 GLU 38 2HG GLU 38 9.702 2.200 -3.548 295 H ALA 39 H ALA 39 8.099 3.662 -2.384 296 HA ALA 39 HA ALA 39 5.231 4.334 -2.252 297 HB1 ALA 39 3HB ALA 39 5.552 5.606 -0.455 298 HB2 ALA 39 1HB ALA 39 7.146 4.864 -0.319 299 HB3 ALA 39 2HB ALA 39 6.955 6.395 -1.175 300 H ILE 40 H ILE 40 4.485 5.640 -3.798 301 HA ILE 40 HA ILE 40 6.238 7.532 -5.128 302 HB ILE 40 HB ILE 40 5.521 6.726 -7.399 303 HG12 ILE 40 1HG1 ILE 40 5.163 3.972 -6.658 304 HG13 ILE 40 2HG1 ILE 40 3.956 4.959 -5.842 305 HG21 ILE 40 1HG2 ILE 40 7.725 6.191 -6.067 306 HG22 ILE 40 2HG2 ILE 40 7.099 4.544 -6.134 307 HG23 ILE 40 3HG2 ILE 40 7.398 5.434 -7.626 308 HD11 ILE 40 3HD1 ILE 40 4.270 4.316 -8.693 309 HD12 ILE 40 1HD1 ILE 40 2.814 4.618 -7.744 310 HD13 ILE 40 2HD1 ILE 40 3.786 5.971 -8.323 311 H ALA 41 H ALA 41 4.810 8.513 -7.079 312 HA ALA 41 HA ALA 41 2.461 9.580 -5.755 313 HB1 ALA 41 3HB ALA 41 2.404 10.969 -7.950 314 HB2 ALA 41 1HB ALA 41 3.658 11.284 -6.751 315 HB3 ALA 41 2HB ALA 41 4.029 10.327 -8.186 316 H GLU 42 H GLU 42 0.637 10.129 -7.547 317 HA GLU 42 HA GLU 42 -0.464 7.551 -8.216 318 HB2 GLU 42 1HB GLU 42 -2.467 8.795 -8.848 319 HB3 GLU 42 2HB GLU 42 -1.885 9.314 -7.272 320 HG2 GLU 42 1HG GLU 42 -2.023 11.390 -8.025 321 HG3 GLU 42 2HG GLU 42 -0.629 11.027 -9.041 322 H THR 43 H THR 43 1.155 10.126 -9.867 323 HA THR 43 HA THR 43 0.273 9.647 -12.493 324 HB THR 43 HB THR 43 1.476 11.682 -11.947 325 HG1 THR 43 HG1 THR 43 3.170 10.230 -13.697 326 HG21 THR 43 3HG2 THR 43 4.020 10.101 -11.712 327 HG22 THR 43 1HG2 THR 43 3.026 10.460 -10.301 328 HG23 THR 43 2HG2 THR 43 3.714 11.776 -11.253 329 H ARG 44 H ARG 44 2.854 8.208 -10.574 330 HA ARG 44 HA ARG 44 3.513 6.428 -12.815 331 HB2 ARG 44 1HB ARG 44 5.016 7.303 -10.369 332 HB3 ARG 44 2HB ARG 44 5.462 5.818 -11.199 333 HG2 ARG 44 1HG ARG 44 5.940 7.015 -13.217 334 HG3 ARG 44 2HG ARG 44 5.309 8.512 -12.529 335 HD2 ARG 44 1HD ARG 44 7.086 8.480 -10.844 336 HD3 ARG 44 2HD ARG 44 7.716 6.987 -11.540 337 HE ARG 44 HE ARG 44 8.735 8.231 -13.160 338 HH11 ARG 44 1HH1 ARG 44 6.227 10.146 -11.689 339 HH12 ARG 44 2HH1 ARG 44 6.651 11.593 -12.541 340 HH21 ARG 44 1HH2 ARG 44 9.304 10.130 -14.288 341 HH22 ARG 44 2HH2 ARG 44 8.401 11.583 -14.020 342 H LEU 45 H LEU 45 1.226 6.324 -10.764 343 HA LEU 45 HA LEU 45 1.752 3.893 -9.302 344 HB2 LEU 45 1HB LEU 45 0.339 5.387 -8.189 345 HB3 LEU 45 2HB LEU 45 -0.630 5.682 -9.631 346 HG LEU 45 HG LEU 45 -0.658 2.933 -8.516 347 HD11 LEU 45 1HD1 LEU 45 -1.617 5.339 -7.071 348 HD12 LEU 45 2HD1 LEU 45 -1.011 3.806 -6.446 349 HD13 LEU 45 3HD1 LEU 45 -2.654 3.912 -7.077 350 HD21 LEU 45 3HD2 LEU 45 -2.022 3.124 -10.361 351 HD22 LEU 45 1HD2 LEU 45 -2.494 4.779 -9.976 352 HD23 LEU 45 2HD2 LEU 45 -3.164 3.434 -9.052 353 H SER 46 H SER 46 0.131 4.835 -12.258 354 HA SER 46 HA SER 46 -1.138 2.292 -12.666 355 HB2 SER 46 1HB SER 46 -1.100 3.483 -15.138 356 HB3 SER 46 2HB SER 46 -2.348 3.734 -13.917 357 HG SER 46 HG SER 46 -1.700 5.746 -14.322 358 H GLU 47 H GLU 47 1.960 3.647 -13.322 359 HA GLU 47 HA GLU 47 2.631 1.701 -15.362 360 HB2 GLU 47 1HB GLU 47 4.057 3.999 -14.073 361 HB3 GLU 47 2HB GLU 47 4.979 2.788 -14.954 362 HG2 GLU 47 1HG GLU 47 4.143 3.414 -16.976 363 HG3 GLU 47 2HG GLU 47 2.618 3.979 -16.296 364 H VAL 48 H VAL 48 2.930 2.085 -11.938 365 HA VAL 48 HA VAL 48 4.899 -0.058 -11.721 366 HB VAL 48 HB VAL 48 4.910 0.412 -9.330 367 HG11 VAL 48 1HG1 VAL 48 6.469 1.748 -10.379 368 HG12 VAL 48 2HG1 VAL 48 5.246 2.667 -11.258 369 HG13 VAL 48 3HG1 VAL 48 5.490 2.946 -9.534 370 HG21 VAL 48 3HG2 VAL 48 2.634 2.249 -10.019 371 HG22 VAL 48 1HG2 VAL 48 2.677 0.951 -8.826 372 HG23 VAL 48 2HG2 VAL 48 3.583 2.438 -8.545 373 H VAL 49 H VAL 49 1.501 0.567 -11.168 374 HA VAL 49 HA VAL 49 0.876 -1.676 -9.603 375 HB VAL 49 HB VAL 49 -0.652 0.254 -10.011 376 HG11 VAL 49 1HG1 VAL 49 -0.343 0.474 -12.413 377 HG12 VAL 49 2HG1 VAL 49 -1.096 -1.102 -12.669 378 HG13 VAL 49 3HG1 VAL 49 -2.048 0.238 -12.028 379 HG21 VAL 49 3HG2 VAL 49 -2.726 -1.147 -10.179 380 HG22 VAL 49 1HG2 VAL 49 -1.684 -2.530 -10.515 381 HG23 VAL 49 2HG2 VAL 49 -1.562 -1.689 -8.970 382 H ASP 50 H ASP 50 1.550 -1.351 -12.982 383 HA ASP 50 HA ASP 50 0.255 -3.612 -13.996 384 HB2 ASP 50 1HB ASP 50 1.715 -1.657 -15.116 385 HB3 ASP 50 2HB ASP 50 2.928 -2.934 -15.100 386 H ARG 51 H ARG 51 3.115 -3.299 -12.068 387 HA ARG 51 HA ARG 51 3.688 -6.165 -12.424 388 HB2 ARG 51 1HB ARG 51 5.467 -3.920 -11.462 389 HB3 ARG 51 2HB ARG 51 5.925 -5.617 -11.450 390 HG2 ARG 51 1HG ARG 51 5.090 -5.190 -14.046 391 HG3 ARG 51 2HG ARG 51 5.941 -3.703 -13.624 392 HD2 ARG 51 1HD ARG 51 7.599 -5.110 -14.496 393 HD3 ARG 51 2HD ARG 51 7.798 -5.213 -12.747 394 HE ARG 51 HE ARG 51 6.090 -7.261 -13.773 395 HH11 ARG 51 1HH1 ARG 51 9.413 -6.330 -13.316 396 HH12 ARG 51 2HH1 ARG 51 10.002 -7.959 -13.295 397 HH21 ARG 51 1HH2 ARG 51 6.853 -9.410 -13.747 398 HH22 ARG 51 2HH2 ARG 51 8.546 -9.710 -13.541 399 H PHE 52 H PHE 52 3.222 -3.606 -10.041 400 HA PHE 52 HA PHE 52 3.693 -5.063 -7.716 401 HB2 PHE 52 1HB PHE 52 2.176 -2.609 -8.405 402 HB3 PHE 52 2HB PHE 52 1.767 -3.378 -6.874 403 HD1 PHE 52 HD1 PHE 52 3.779 -3.961 -5.329 404 HD2 PHE 52 HD2 PHE 52 3.927 -1.115 -8.490 405 HE1 PHE 52 HE1 PHE 52 5.724 -2.890 -4.269 406 HE2 PHE 52 HE2 PHE 52 5.873 -0.040 -7.436 407 HZ PHE 52 HZ PHE 52 6.775 -0.928 -5.323 408 H ASP 53 H ASP 53 1.722 -5.342 -6.074 409 HA ASP 53 HA ASP 53 -0.283 -7.011 -7.446 410 HB2 ASP 53 1HB ASP 53 1.222 -7.482 -4.882 411 HB3 ASP 53 2HB ASP 53 -0.305 -8.296 -5.213 412 H VAL 54 H VAL 54 0.287 -5.379 -4.323 413 HA VAL 54 HA VAL 54 -2.561 -4.621 -4.313 414 HB VAL 54 HB VAL 54 -2.289 -4.373 -1.833 415 HG11 VAL 54 1HG1 VAL 54 -2.587 -6.691 -1.368 416 HG12 VAL 54 2HG1 VAL 54 -3.260 -6.387 -2.971 417 HG13 VAL 54 3HG1 VAL 54 -1.682 -7.157 -2.808 418 HG21 VAL 54 3HG2 VAL 54 -0.397 -5.355 -0.726 419 HG22 VAL 54 1HG2 VAL 54 0.283 -5.885 -2.264 420 HG23 VAL 54 2HG2 VAL 54 0.192 -4.165 -1.887 421 H VAL 55 H VAL 55 -3.133 -2.523 -3.674 422 HA VAL 55 HA VAL 55 -0.919 -0.576 -3.647 423 HB VAL 55 HB VAL 55 -3.633 -0.204 -4.923 424 HG11 VAL 55 1HG1 VAL 55 -1.280 1.637 -4.578 425 HG12 VAL 55 2HG1 VAL 55 -2.526 1.903 -5.799 426 HG13 VAL 55 3HG1 VAL 55 -2.954 1.896 -4.088 427 HG21 VAL 55 3HG2 VAL 55 -2.320 -1.648 -6.298 428 HG22 VAL 55 1HG2 VAL 55 -2.284 -0.042 -7.027 429 HG23 VAL 55 2HG2 VAL 55 -0.895 -0.625 -6.110 430 H LEU 56 H LEU 56 -1.104 1.183 -2.280 431 HA LEU 56 HA LEU 56 -3.446 1.246 -0.504 432 HB2 LEU 56 1HB LEU 56 -0.556 1.067 0.219 433 HB3 LEU 56 2HB LEU 56 -1.660 1.941 1.278 434 HG LEU 56 HG LEU 56 -2.772 -0.624 0.667 435 HD11 LEU 56 1HD1 LEU 56 -0.787 -1.684 2.153 436 HD12 LEU 56 2HD1 LEU 56 0.131 -0.569 1.141 437 HD13 LEU 56 3HD1 LEU 56 -0.879 -1.808 0.396 438 HD21 LEU 56 3HD2 LEU 56 -1.613 0.283 3.284 439 HD22 LEU 56 1HD2 LEU 56 -2.995 -0.773 2.996 440 HD23 LEU 56 2HD2 LEU 56 -3.115 0.951 2.644 441 H LEU 57 H LEU 57 -4.249 3.226 -0.123 442 HA LEU 57 HA LEU 57 -2.727 5.523 -1.156 443 HB2 LEU 57 1HB LEU 57 -4.710 5.352 -2.385 444 HB3 LEU 57 2HB LEU 57 -5.663 4.954 -0.957 445 HG LEU 57 HG LEU 57 -5.377 7.288 -0.172 446 HD11 LEU 57 1HD1 LEU 57 -4.712 8.582 -2.573 447 HD12 LEU 57 2HD1 LEU 57 -3.479 7.348 -2.315 448 HD13 LEU 57 3HD1 LEU 57 -3.794 8.554 -1.067 449 HD21 LEU 57 3HD2 LEU 57 -6.632 6.828 -2.870 450 HD22 LEU 57 1HD2 LEU 57 -6.853 8.303 -1.930 451 HD23 LEU 57 2HD2 LEU 57 -7.409 6.757 -1.288 452 H ALA 58 H ALA 58 -2.271 7.219 0.136 453 HA ALA 58 HA ALA 58 -2.672 6.904 2.972 454 HB1 ALA 58 3HB ALA 58 -0.883 8.220 3.169 455 HB2 ALA 58 1HB ALA 58 -0.734 8.093 1.416 456 HB3 ALA 58 2HB ALA 58 -1.582 9.464 2.132 457 HA PRO 59 HA PRO 59 -6.152 9.500 3.606 458 HB2 PRO 59 1HB PRO 59 -5.484 10.829 5.877 459 HB3 PRO 59 2HB PRO 59 -5.910 9.114 5.858 460 HG2 PRO 59 1HG PRO 59 -3.204 10.392 5.920 461 HG3 PRO 59 2HG PRO 59 -3.804 8.996 6.836 462 HD2 PRO 59 1HD PRO 59 -2.257 8.735 4.628 463 HD3 PRO 59 2HD PRO 59 -3.502 7.548 5.068 464 H GLN 60 H GLN 60 -6.726 11.880 4.235 465 HA GLN 60 HA GLN 60 -6.739 14.068 3.614 466 HB2 GLN 60 1HB GLN 60 -3.880 13.483 4.132 467 HB3 GLN 60 2HB GLN 60 -4.226 14.953 3.230 468 HG2 GLN 60 1HG GLN 60 -5.955 14.710 5.524 469 HG3 GLN 60 2HG GLN 60 -4.256 14.624 5.987 470 HE21 GLN 60 2HE2 GLN 60 -6.817 16.634 5.100 471 HE22 GLN 60 1HE2 GLN 60 -5.936 18.114 4.967 472 H SER 61 H SER 61 -7.745 13.645 1.619 473 HA SER 61 HA SER 61 -6.136 14.378 -0.668 474 HB2 SER 61 1HB SER 61 -7.682 11.781 -0.761 475 HB3 SER 61 2HB SER 61 -6.648 12.454 -2.021 476 HG SER 61 HG SER 61 -5.638 10.792 -0.746 477 H ARG 62 H ARG 62 -7.272 15.652 -1.988 478 HA ARG 62 HA ARG 62 -10.117 15.991 -1.467 479 HB2 ARG 62 1HB ARG 62 -8.477 17.925 -1.637 480 HB3 ARG 62 2HB ARG 62 -8.405 17.594 -3.363 481 HG2 ARG 62 1HG ARG 62 -10.783 18.029 -3.570 482 HG3 ARG 62 2HG ARG 62 -10.898 18.301 -1.830 483 HD2 ARG 62 1HD ARG 62 -8.866 19.993 -2.599 484 HD3 ARG 62 2HD ARG 62 -9.995 20.084 -3.950 485 HE ARG 62 HE ARG 62 -11.612 20.391 -1.824 486 HH11 ARG 62 1HH1 ARG 62 -8.624 21.922 -2.744 487 HH12 ARG 62 2HH1 ARG 62 -9.006 23.426 -1.973 488 HH21 ARG 62 1HH2 ARG 62 -12.126 22.365 -0.804 489 HH22 ARG 62 2HH2 ARG 62 -10.998 23.676 -0.869 490 H PHE 63 H PHE 63 -8.068 15.728 -4.379 491 HA PHE 63 HA PHE 63 -10.352 14.473 -5.750 492 HB2 PHE 63 1HB PHE 63 -8.131 16.234 -6.754 493 HB3 PHE 63 2HB PHE 63 -9.016 15.180 -7.852 494 HD1 PHE 63 HD1 PHE 63 -11.725 15.339 -7.231 495 HD2 PHE 63 HD2 PHE 63 -8.801 18.413 -6.891 496 HE1 PHE 63 HE1 PHE 63 -13.492 17.038 -7.439 497 HE2 PHE 63 HE2 PHE 63 -10.563 20.117 -7.097 498 HZ PHE 63 HZ PHE 63 -12.913 19.431 -7.371 499 H ASN 64 H ASN 64 -7.027 14.150 -4.837 500 HA ASN 64 HA ASN 64 -6.096 12.209 -6.564 501 HB2 ASN 64 1HB ASN 64 -5.509 12.950 -3.744 502 HB3 ASN 64 2HB ASN 64 -4.906 11.393 -4.306 503 HD21 ASN 64 2HD2 ASN 64 -3.650 14.060 -3.612 504 HD22 ASN 64 1HD2 ASN 64 -2.611 14.392 -4.952 505 H LYS 65 H LYS 65 -7.736 11.665 -3.445 506 HA LYS 65 HA LYS 65 -7.890 8.866 -3.688 507 HB2 LYS 65 1HB LYS 65 -9.569 8.993 -1.897 508 HB3 LYS 65 2HB LYS 65 -8.167 9.996 -1.545 509 HG2 LYS 65 1HG LYS 65 -9.379 11.984 -2.181 510 HG3 LYS 65 2HG LYS 65 -10.771 11.012 -2.666 511 HD2 LYS 65 1HD LYS 65 -10.537 10.135 -0.168 512 HD3 LYS 65 2HD LYS 65 -9.790 11.720 0.048 513 HE2 LYS 65 1HE LYS 65 -12.076 12.195 -1.476 514 HE3 LYS 65 2HE LYS 65 -12.576 11.018 -0.262 515 HZ1 LYS 65 3HZ LYS 65 -10.985 13.299 0.637 516 HZ2 LYS 65 1HZ LYS 65 -12.232 12.472 1.427 517 HZ3 LYS 65 2HZ LYS 65 -12.596 13.592 0.214 518 H LYS 66 H LYS 66 -9.976 11.450 -4.806 519 HA LYS 66 HA LYS 66 -12.258 9.946 -5.422 520 HB2 LYS 66 1HB LYS 66 -11.317 12.607 -5.859 521 HB3 LYS 66 2HB LYS 66 -11.950 11.987 -7.378 522 HG2 LYS 66 1HG LYS 66 -13.580 11.587 -4.932 523 HG3 LYS 66 2HG LYS 66 -13.485 13.212 -5.613 524 HD2 LYS 66 1HD LYS 66 -14.082 12.126 -7.845 525 HD3 LYS 66 2HD LYS 66 -14.515 10.698 -6.902 526 HE2 LYS 66 1HE LYS 66 -16.515 11.925 -7.219 527 HE3 LYS 66 2HE LYS 66 -16.024 12.197 -5.547 528 HZ1 LYS 66 3HZ LYS 66 -15.076 14.110 -7.534 529 HZ2 LYS 66 1HZ LYS 66 -15.568 14.363 -5.935 530 HZ3 LYS 66 2HZ LYS 66 -16.723 14.160 -7.153 531 H ARG 67 H ARG 67 -9.645 10.999 -7.614 532 HA ARG 67 HA ARG 67 -10.512 9.501 -9.826 533 HB2 ARG 67 1HB ARG 67 -8.225 11.130 -9.122 534 HB3 ARG 67 2HB ARG 67 -7.728 9.716 -10.042 535 HG2 ARG 67 1HG ARG 67 -8.156 11.065 -11.790 536 HG3 ARG 67 2HG ARG 67 -9.810 10.505 -11.534 537 HD2 ARG 67 1HD ARG 67 -9.860 12.548 -9.858 538 HD3 ARG 67 2HD ARG 67 -8.566 13.133 -10.904 539 HE ARG 67 HE ARG 67 -11.359 12.957 -11.539 540 HH11 ARG 67 1HH1 ARG 67 -8.134 12.995 -12.849 541 HH12 ARG 67 2HH1 ARG 67 -8.633 13.575 -14.404 542 HH21 ARG 67 1HH2 ARG 67 -12.028 13.721 -13.581 543 HH22 ARG 67 2HH2 ARG 67 -10.847 13.988 -14.819 544 H LEU 68 H LEU 68 -8.081 8.775 -7.339 545 HA LEU 68 HA LEU 68 -7.125 6.372 -8.287 546 HB2 LEU 68 1HB LEU 68 -7.366 7.649 -5.653 547 HB3 LEU 68 2HB LEU 68 -7.203 5.895 -5.614 548 HG LEU 68 HG LEU 68 -5.268 7.640 -7.113 549 HD11 LEU 68 1HD1 LEU 68 -4.416 6.630 -4.504 550 HD12 LEU 68 2HD1 LEU 68 -5.651 7.885 -4.426 551 HD13 LEU 68 3HD1 LEU 68 -4.132 8.194 -5.267 552 HD21 LEU 68 3HD2 LEU 68 -4.578 5.620 -7.761 553 HD22 LEU 68 1HD2 LEU 68 -5.579 4.802 -6.561 554 HD23 LEU 68 2HD2 LEU 68 -3.988 5.416 -6.111 555 H GLU 69 H GLU 69 -9.707 6.678 -5.839 556 HA GLU 69 HA GLU 69 -10.498 3.997 -5.917 557 HB2 GLU 69 1HB GLU 69 -11.697 6.531 -4.933 558 HB3 GLU 69 2HB GLU 69 -12.783 5.166 -5.147 559 HG2 GLU 69 1HG GLU 69 -10.394 4.344 -3.779 560 HG3 GLU 69 2HG GLU 69 -11.144 5.712 -2.958 561 H GLU 70 H GLU 70 -11.531 6.772 -7.822 562 HA GLU 70 HA GLU 70 -13.743 5.558 -9.077 563 HB2 GLU 70 1HB GLU 70 -12.006 7.914 -9.684 564 HB3 GLU 70 2HB GLU 70 -13.118 7.336 -10.917 565 HG2 GLU 70 1HG GLU 70 -14.245 7.722 -8.220 566 HG3 GLU 70 2HG GLU 70 -13.760 9.178 -9.087 567 H ILE 71 H ILE 71 -10.332 5.320 -9.610 568 HA ILE 71 HA ILE 71 -10.682 4.068 -12.221 569 HB ILE 71 HB ILE 71 -8.163 4.655 -10.661 570 HG12 ILE 71 1HG1 ILE 71 -8.863 5.998 -13.228 571 HG13 ILE 71 2HG1 ILE 71 -9.716 6.511 -11.777 572 HG21 ILE 71 1HG2 ILE 71 -8.649 3.369 -13.318 573 HG22 ILE 71 2HG2 ILE 71 -7.165 4.273 -13.021 574 HG23 ILE 71 3HG2 ILE 71 -7.562 2.877 -12.019 575 HD11 ILE 71 3HD1 ILE 71 -6.825 6.747 -12.457 576 HD12 ILE 71 1HD1 ILE 71 -7.942 7.967 -11.846 577 HD13 ILE 71 2HD1 ILE 71 -7.334 6.709 -10.769 578 H THR 72 H THR 72 -9.784 3.261 -8.923 579 HA THR 72 HA THR 72 -8.904 0.617 -9.438 580 HB THR 72 HB THR 72 -9.072 0.243 -7.052 581 HG1 THR 72 HG1 THR 72 -10.232 1.561 -5.734 582 HG21 THR 72 3HG2 THR 72 -7.621 2.339 -8.243 583 HG22 THR 72 1HG2 THR 72 -7.244 1.481 -6.750 584 HG23 THR 72 2HG2 THR 72 -8.207 2.957 -6.700 585 H LYS 73 H LYS 73 -12.045 2.023 -8.708 586 HA LYS 73 HA LYS 73 -13.518 -0.224 -8.085 587 HB2 LYS 73 1HB LYS 73 -14.060 2.460 -8.944 588 HB3 LYS 73 2HB LYS 73 -15.144 1.355 -9.778 589 HG2 LYS 73 1HG LYS 73 -16.420 1.565 -7.960 590 HG3 LYS 73 2HG LYS 73 -15.287 0.428 -7.226 591 HD2 LYS 73 1HD LYS 73 -14.585 3.313 -7.161 592 HD3 LYS 73 2HD LYS 73 -15.883 2.761 -6.100 593 HE2 LYS 73 1HE LYS 73 -13.244 1.340 -6.210 594 HE3 LYS 73 2HE LYS 73 -13.474 2.763 -5.194 595 HZ1 LYS 73 3HZ LYS 73 -15.156 0.320 -5.053 596 HZ2 LYS 73 1HZ LYS 73 -15.210 1.650 -4.009 597 HZ3 LYS 73 2HZ LYS 73 -13.853 0.641 -4.023 598 HA PRO 74 HA PRO 74 -14.421 -1.001 -12.759 599 HB2 PRO 74 1HB PRO 74 -13.025 0.462 -14.571 600 HB3 PRO 74 2HB PRO 74 -14.573 0.988 -13.899 601 HG2 PRO 74 1HG PRO 74 -11.797 1.797 -13.121 602 HG3 PRO 74 2HG PRO 74 -13.242 2.806 -13.322 603 HD2 PRO 74 1HD PRO 74 -12.350 2.004 -10.894 604 HD3 PRO 74 2HD PRO 74 -14.073 2.248 -11.246 605 H LYS 75 H LYS 75 -11.090 -0.025 -12.049 606 HA LYS 75 HA LYS 75 -9.821 -1.863 -13.771 607 HB2 LYS 75 1HB LYS 75 -8.947 -0.314 -11.355 608 HB3 LYS 75 2HB LYS 75 -7.878 -1.514 -12.070 609 HG2 LYS 75 1HG LYS 75 -9.089 0.751 -13.631 610 HG3 LYS 75 2HG LYS 75 -7.521 0.850 -12.826 611 HD2 LYS 75 1HD LYS 75 -6.681 -0.984 -14.163 612 HD3 LYS 75 2HD LYS 75 -8.267 -1.207 -14.906 613 HE2 LYS 75 1HE LYS 75 -7.672 1.477 -15.314 614 HE3 LYS 75 2HE LYS 75 -6.143 0.642 -15.585 615 HZ1 LYS 75 3HZ LYS 75 -8.727 0.070 -16.930 616 HZ2 LYS 75 1HZ LYS 75 -7.315 -0.840 -17.136 617 HZ3 LYS 75 2HZ LYS 75 -7.359 0.776 -17.632 618 H GLY 76 H GLY 76 -11.279 -2.204 -10.652 619 HA2 GLY 76 1HA GLY 76 -11.570 -4.019 -9.277 620 HA3 GLY 76 2HA GLY 76 -11.308 -4.995 -10.715 621 H ILE 77 H ILE 77 -9.392 -3.010 -8.454 622 HA ILE 77 HA ILE 77 -7.461 -5.228 -8.314 623 HB ILE 77 HB ILE 77 -5.659 -3.496 -8.052 624 HG12 ILE 77 1HG1 ILE 77 -6.961 -1.422 -9.543 625 HG13 ILE 77 2HG1 ILE 77 -7.894 -1.751 -8.087 626 HG21 ILE 77 1HG2 ILE 77 -6.607 -4.705 -10.270 627 HG22 ILE 77 2HG2 ILE 77 -6.729 -3.013 -10.750 628 HG23 ILE 77 3HG2 ILE 77 -5.175 -3.676 -10.245 629 HD11 ILE 77 3HD1 ILE 77 -6.279 0.010 -7.705 630 HD12 ILE 77 1HD1 ILE 77 -5.889 -1.409 -6.734 631 HD13 ILE 77 2HD1 ILE 77 -4.968 -1.061 -8.197 632 HA PRO 78 HA PRO 78 -7.747 -4.909 -3.944 633 HB2 PRO 78 1HB PRO 78 -5.236 -5.626 -3.200 634 HB3 PRO 78 2HB PRO 78 -6.413 -6.778 -3.841 635 HG2 PRO 78 1HG PRO 78 -4.153 -5.402 -5.242 636 HG3 PRO 78 2HG PRO 78 -4.673 -7.094 -5.351 637 HD2 PRO 78 1HD PRO 78 -5.315 -5.248 -7.226 638 HD3 PRO 78 2HD PRO 78 -6.385 -6.604 -6.815 639 H ILE 79 H ILE 79 -8.056 -2.725 -3.529 640 HA ILE 79 HA ILE 79 -5.608 -1.163 -3.017 641 HB ILE 79 HB ILE 79 -6.860 -0.153 -4.824 642 HG12 ILE 79 1HG1 ILE 79 -7.241 2.079 -3.860 643 HG13 ILE 79 2HG1 ILE 79 -7.247 1.382 -2.244 644 HG21 ILE 79 1HG2 ILE 79 -9.075 -0.211 -4.943 645 HG22 ILE 79 2HG2 ILE 79 -9.100 -1.063 -3.400 646 HG23 ILE 79 3HG2 ILE 79 -9.221 0.695 -3.438 647 HD11 ILE 79 3HD1 ILE 79 -4.849 0.605 -3.559 648 HD12 ILE 79 1HD1 ILE 79 -5.058 2.348 -3.730 649 HD13 ILE 79 2HD1 ILE 79 -5.055 1.613 -2.127 650 H GLU 80 H GLU 80 -5.281 -0.459 -1.003 651 HA GLU 80 HA GLU 80 -7.521 -0.649 0.904 652 HB2 GLU 80 1HB GLU 80 -4.786 -1.666 1.013 653 HB3 GLU 80 2HB GLU 80 -5.215 -0.714 2.428 654 HG2 GLU 80 1HG GLU 80 -5.635 -3.144 2.670 655 HG3 GLU 80 2HG GLU 80 -7.061 -2.138 2.919 656 H ILE 81 H ILE 81 -7.655 0.927 2.551 657 HA ILE 81 HA ILE 81 -6.208 3.419 1.927 658 HB ILE 81 HB ILE 81 -8.911 3.205 3.253 659 HG12 ILE 81 1HG1 ILE 81 -8.983 2.396 0.916 660 HG13 ILE 81 2HG1 ILE 81 -9.874 3.899 1.126 661 HG21 ILE 81 1HG2 ILE 81 -8.593 5.702 2.076 662 HG22 ILE 81 2HG2 ILE 81 -8.502 5.323 3.796 663 HG23 ILE 81 3HG2 ILE 81 -7.032 5.357 2.822 664 HD11 ILE 81 3HD1 ILE 81 -8.678 4.853 -0.465 665 HD12 ILE 81 1HD1 ILE 81 -7.186 4.509 0.409 666 HD13 ILE 81 2HD1 ILE 81 -7.839 3.324 -0.723 667 H ILE 82 H ILE 82 -5.099 4.418 3.508 668 HA ILE 82 HA ILE 82 -4.878 3.058 6.068 669 HB ILE 82 HB ILE 82 -3.330 5.447 5.061 670 HG12 ILE 82 1HG1 ILE 82 -2.552 2.523 5.043 671 HG13 ILE 82 2HG1 ILE 82 -3.062 3.435 3.627 672 HG21 ILE 82 1HG2 ILE 82 -2.798 3.537 7.333 673 HG22 ILE 82 2HG2 ILE 82 -1.717 4.823 6.800 674 HG23 ILE 82 3HG2 ILE 82 -3.294 5.222 7.481 675 HD11 ILE 82 3HD1 ILE 82 -0.653 3.226 3.703 676 HD12 ILE 82 1HD1 ILE 82 -1.134 4.912 3.893 677 HD13 ILE 82 2HD1 ILE 82 -0.620 3.977 5.298 678 H ASN 83 H ASN 83 -5.804 3.725 7.891 679 HA ASN 83 HA ASN 83 -7.585 5.936 7.917 680 HB2 ASN 83 1HB ASN 83 -6.754 3.820 9.794 681 HB3 ASN 83 2HB ASN 83 -7.274 5.321 10.555 682 HD21 ASN 83 2HD2 ASN 83 -8.243 2.449 9.072 683 HD22 ASN 83 1HD2 ASN 83 -9.939 2.770 8.997 684 H THR 84 H THR 84 -7.471 7.863 9.114 685 HA THR 84 HA THR 84 -5.117 9.300 8.971 686 HB THR 84 HB THR 84 -6.800 10.181 11.192 687 HG1 THR 84 HG1 THR 84 -8.591 9.458 10.271 688 HG21 THR 84 3HG2 THR 84 -6.747 11.676 8.659 689 HG22 THR 84 1HG2 THR 84 -5.164 11.351 9.364 690 HG23 THR 84 2HG2 THR 84 -6.386 12.212 10.300 691 H ILE 85 H ILE 85 -6.422 7.460 11.693 692 HA ILE 85 HA ILE 85 -4.482 8.261 13.587 693 HB ILE 85 HB ILE 85 -6.061 5.687 13.532 694 HG12 ILE 85 1HG1 ILE 85 -7.158 7.466 15.398 695 HG13 ILE 85 2HG1 ILE 85 -6.861 8.438 13.961 696 HG21 ILE 85 1HG2 ILE 85 -4.231 6.933 15.479 697 HG22 ILE 85 2HG2 ILE 85 -5.726 6.268 16.135 698 HG23 ILE 85 3HG2 ILE 85 -4.630 5.235 15.218 699 HD11 ILE 85 3HD1 ILE 85 -8.028 6.026 13.095 700 HD12 ILE 85 1HD1 ILE 85 -8.963 6.595 14.478 701 HD13 ILE 85 2HD1 ILE 85 -8.724 7.646 13.082 702 H ASP 86 H ASP 86 -4.789 5.197 11.782 703 HA ASP 86 HA ASP 86 -2.392 4.050 12.573 704 HB2 ASP 86 1HB ASP 86 -3.992 3.771 10.033 705 HB3 ASP 86 2HB ASP 86 -2.540 2.820 10.335 706 H TYR 87 H TYR 87 -3.036 6.346 9.978 707 HA TYR 87 HA TYR 87 -0.463 6.234 8.800 708 HB2 TYR 87 1HB TYR 87 -2.379 7.127 7.585 709 HB3 TYR 87 2HB TYR 87 -2.539 8.435 8.753 710 HD1 TYR 87 HD2 TYR 87 0.166 6.980 6.610 711 HD2 TYR 87 HD1 TYR 87 -1.775 10.484 8.045 712 HE1 TYR 87 HE2 TYR 87 1.680 8.367 5.255 713 HE2 TYR 87 HE1 TYR 87 -0.267 11.880 6.694 714 HH TYR 87 HH TYR 87 2.553 10.786 5.365 715 H GLY 88 H GLY 88 -1.923 8.785 10.833 716 HA2 GLY 88 1HA GLY 88 0.391 10.280 11.230 717 HA3 GLY 88 2HA GLY 88 -0.979 10.245 12.331 718 H THR 89 H THR 89 -0.592 7.297 12.713 719 HA THR 89 HA THR 89 1.336 7.529 14.869 720 HB THR 89 HB THR 89 0.586 5.220 15.461 721 HG1 THR 89 HG1 THR 89 -0.071 4.742 13.211 722 HG21 THR 89 3HG2 THR 89 -0.935 6.247 16.722 723 HG22 THR 89 1HG2 THR 89 -2.019 6.398 15.340 724 HG23 THR 89 2HG2 THR 89 -0.828 7.656 15.668 725 H MET 90 H MET 90 1.118 6.143 11.703 726 HA MET 90 HA MET 90 2.626 5.063 10.389 727 HB2 MET 90 1HB MET 90 4.680 5.752 12.491 728 HB3 MET 90 2HB MET 90 4.970 5.396 10.794 729 HG2 MET 90 1HG MET 90 4.797 7.539 10.303 730 HG3 MET 90 2HG MET 90 3.150 7.561 10.929 731 HE1 MET 90 3HE MET 90 6.573 6.950 12.141 732 HE2 MET 90 1HE MET 90 7.078 8.620 12.402 733 HE3 MET 90 2HE MET 90 6.591 7.621 13.772 734 H ASN 91 H ASN 91 1.190 3.287 11.538 735 HA ASN 91 HA ASN 91 2.770 1.482 13.181 736 HB2 ASN 91 1HB ASN 91 -0.074 1.836 12.548 737 HB3 ASN 91 2HB ASN 91 0.432 0.150 12.615 738 HD21 ASN 91 2HD2 ASN 91 2.112 -0.106 14.565 739 HD22 ASN 91 1HD2 ASN 91 1.481 0.448 16.075 740 H GLY 92 H GLY 92 4.379 0.777 11.763 741 HA2 GLY 92 1HA GLY 92 4.095 -0.096 9.156 742 HA3 GLY 92 2HA GLY 92 5.303 -0.710 10.276 743 H GLU 93 H GLU 93 3.818 -2.055 12.116 744 HA GLU 93 HA GLU 93 3.402 -4.527 10.960 745 HB2 GLU 93 1HB GLU 93 3.683 -4.095 13.396 746 HB3 GLU 93 2HB GLU 93 2.035 -3.486 13.446 747 HG2 GLU 93 1HG GLU 93 1.337 -5.756 12.540 748 HG3 GLU 93 2HG GLU 93 2.971 -6.287 12.935 749 H LYS 94 H LYS 94 0.943 -2.112 11.847 750 HA LYS 94 HA LYS 94 -1.281 -3.556 10.926 751 HB2 LYS 94 1HB LYS 94 -0.882 -0.568 11.158 752 HB3 LYS 94 2HB LYS 94 -2.433 -1.355 10.899 753 HG2 LYS 94 1HG LYS 94 -0.819 -2.213 13.236 754 HG3 LYS 94 2HG LYS 94 -1.609 -0.635 13.302 755 HD2 LYS 94 1HD LYS 94 -3.557 -2.344 12.300 756 HD3 LYS 94 2HD LYS 94 -2.746 -3.289 13.551 757 HE2 LYS 94 1HE LYS 94 -3.000 -0.956 14.848 758 HE3 LYS 94 2HE LYS 94 -4.394 -0.841 13.775 759 HZ1 LYS 94 3HZ LYS 94 -4.072 -3.386 15.123 760 HZ2 LYS 94 1HZ LYS 94 -5.468 -2.468 14.859 761 HZ3 LYS 94 2HZ LYS 94 -4.430 -2.080 16.136 762 H VAL 95 H VAL 95 0.908 -1.328 9.295 763 HA VAL 95 HA VAL 95 -0.531 -1.019 6.906 764 HB VAL 95 HB VAL 95 2.469 -0.989 7.263 765 HG11 VAL 95 1HG1 VAL 95 2.127 -1.072 4.966 766 HG12 VAL 95 2HG1 VAL 95 0.649 -0.111 5.052 767 HG13 VAL 95 3HG1 VAL 95 2.217 0.659 5.292 768 HG21 VAL 95 3HG2 VAL 95 0.531 0.700 8.384 769 HG22 VAL 95 1HG2 VAL 95 2.275 0.957 8.319 770 HG23 VAL 95 2HG2 VAL 95 1.240 1.599 7.043 771 H LEU 96 H LEU 96 2.394 -3.015 7.341 772 HA LEU 96 HA LEU 96 2.178 -4.458 4.988 773 HB2 LEU 96 1HB LEU 96 3.543 -6.198 6.176 774 HB3 LEU 96 2HB LEU 96 4.202 -4.564 6.193 775 HG LEU 96 HG LEU 96 2.826 -4.623 8.546 776 HD11 LEU 96 1HD1 LEU 96 3.251 -6.694 9.660 777 HD12 LEU 96 2HD1 LEU 96 4.090 -7.341 8.251 778 HD13 LEU 96 3HD1 LEU 96 2.354 -7.042 8.182 779 HD21 LEU 96 3HD2 LEU 96 5.685 -5.493 8.142 780 HD22 LEU 96 1HD2 LEU 96 4.990 -4.779 9.598 781 HD23 LEU 96 2HD2 LEU 96 5.125 -3.820 8.123 782 H GLN 97 H GLN 97 0.711 -5.072 8.133 783 HA GLN 97 HA GLN 97 -0.272 -7.647 7.637 784 HB2 GLN 97 1HB GLN 97 -1.034 -5.434 9.496 785 HB3 GLN 97 2HB GLN 97 -2.105 -6.820 9.341 786 HG2 GLN 97 1HG GLN 97 0.817 -7.043 10.011 787 HG3 GLN 97 2HG GLN 97 -0.462 -6.938 11.220 788 HE21 GLN 97 2HE2 GLN 97 1.079 -8.913 8.840 789 HE22 GLN 97 1HE2 GLN 97 0.275 -10.389 9.238 790 H LEU 98 H LEU 98 -1.852 -4.485 7.223 791 HA LEU 98 HA LEU 98 -4.287 -5.455 6.231 792 HB2 LEU 98 1HB LEU 98 -3.655 -3.097 7.017 793 HB3 LEU 98 2HB LEU 98 -3.063 -2.852 5.376 794 HG LEU 98 HG LEU 98 -5.451 -3.555 4.663 795 HD11 LEU 98 1HD1 LEU 98 -7.046 -2.636 6.523 796 HD12 LEU 98 2HD1 LEU 98 -5.740 -3.132 7.599 797 HD13 LEU 98 3HD1 LEU 98 -6.514 -4.317 6.548 798 HD21 LEU 98 3HD2 LEU 98 -4.577 -1.333 4.320 799 HD22 LEU 98 1HD2 LEU 98 -4.865 -0.921 6.010 800 HD23 LEU 98 2HD2 LEU 98 -6.228 -1.222 4.932 801 H ALA 99 H ALA 99 -1.394 -4.319 4.502 802 HA ALA 99 HA ALA 99 -2.290 -4.601 1.900 803 HB1 ALA 99 3HB ALA 99 0.012 -3.789 2.950 804 HB2 ALA 99 1HB ALA 99 0.506 -5.411 2.464 805 HB3 ALA 99 2HB ALA 99 -0.130 -4.285 1.264 806 H ILE 100 H ILE 100 -0.481 -7.020 3.801 807 HA ILE 100 HA ILE 100 -0.602 -9.083 1.924 808 HB ILE 100 HB ILE 100 -0.520 -9.329 4.934 809 HG12 ILE 100 1HG1 ILE 100 1.811 -9.500 3.034 810 HG13 ILE 100 2HG1 ILE 100 1.294 -7.964 3.721 811 HG21 ILE 100 1HG2 ILE 100 0.517 -11.530 4.476 812 HG22 ILE 100 2HG2 ILE 100 -1.158 -11.425 3.937 813 HG23 ILE 100 3HG2 ILE 100 0.154 -11.309 2.764 814 HD11 ILE 100 3HD1 ILE 100 2.676 -10.241 4.983 815 HD12 ILE 100 1HD1 ILE 100 2.837 -8.508 5.269 816 HD13 ILE 100 2HD1 ILE 100 1.480 -9.396 5.965 817 H ASN 101 H ASN 101 -2.845 -8.199 4.511 818 HA ASN 101 HA ASN 101 -4.546 -10.396 4.404 819 HB2 ASN 101 1HB ASN 101 -4.541 -7.837 5.633 820 HB3 ASN 101 2HB ASN 101 -6.099 -8.028 4.834 821 HD21 ASN 101 2HD2 ASN 101 -7.485 -8.515 6.386 822 HD22 ASN 101 1HD2 ASN 101 -7.289 -9.776 7.551 823 H ALA 102 H ALA 102 -4.854 -7.293 2.676 824 HA ALA 102 HA ALA 102 -7.124 -7.996 1.180 825 HB1 ALA 102 3HB ALA 102 -5.696 -6.184 -0.381 826 HB2 ALA 102 1HB ALA 102 -6.952 -5.813 0.801 827 HB3 ALA 102 2HB ALA 102 -5.256 -5.802 1.284 828 H PHE 103 H PHE 103 -3.670 -8.312 0.485 829 HA PHE 103 HA PHE 103 -3.802 -9.085 -2.176 830 HB2 PHE 103 1HB PHE 103 -1.679 -8.602 -1.126 831 HB3 PHE 103 2HB PHE 103 -1.875 -9.953 -0.015 832 HD1 PHE 103 HD2 PHE 103 -1.793 -9.281 -3.683 833 HD2 PHE 103 HD1 PHE 103 -0.774 -11.907 -0.492 834 HE1 PHE 103 HE2 PHE 103 -0.620 -10.750 -5.271 835 HE2 PHE 103 HE1 PHE 103 0.402 -13.379 -2.075 836 HZ PHE 103 HZ PHE 103 0.479 -12.802 -4.468 837 H ASN 104 H ASN 104 -3.617 -11.244 0.660 838 HA ASN 104 HA ASN 104 -4.057 -13.622 -0.765 839 HB2 ASN 104 1HB ASN 104 -4.367 -12.856 2.126 840 HB3 ASN 104 2HB ASN 104 -4.825 -14.462 1.566 841 HD21 ASN 104 2HD2 ASN 104 -2.900 -14.230 3.437 842 HD22 ASN 104 1HD2 ASN 104 -1.354 -14.614 2.766 843 H ASN 105 H ASN 105 -6.294 -11.425 0.872 844 HA ASN 105 HA ASN 105 -8.623 -12.932 0.672 845 HB2 ASN 105 1HB ASN 105 -8.340 -10.778 1.939 846 HB3 ASN 105 2HB ASN 105 -8.455 -9.926 0.402 847 HD21 ASN 105 2HD2 ASN 105 -10.188 -9.596 2.610 848 HD22 ASN 105 1HD2 ASN 105 -11.770 -10.086 2.116 849 H LYS 106 H LYS 106 -7.087 -10.798 -1.680 850 HA LYS 106 HA LYS 106 -7.489 -10.396 -3.886 851 HB2 LYS 106 1HB LYS 106 -8.028 -13.291 -3.492 852 HB3 LYS 106 2HB LYS 106 -8.546 -12.586 -5.018 853 HG2 LYS 106 1HG LYS 106 -5.875 -11.740 -4.402 854 HG3 LYS 106 2HG LYS 106 -5.994 -13.500 -4.331 855 HD2 LYS 106 1HD LYS 106 -5.595 -13.274 -6.559 856 HD3 LYS 106 2HD LYS 106 -7.351 -13.098 -6.588 857 HE2 LYS 106 1HE LYS 106 -5.598 -10.698 -6.242 858 HE3 LYS 106 2HE LYS 106 -5.861 -11.378 -7.847 859 HZ1 LYS 106 3HZ LYS 106 -7.485 -9.599 -6.563 860 HZ2 LYS 106 1HZ LYS 106 -8.300 -11.071 -6.393 861 HZ3 LYS 106 2HZ LYS 106 -7.888 -10.506 -7.933 862 H SER 107 H SER 107 -9.192 -8.888 -3.066 863 HA SER 107 HA SER 107 -11.897 -9.789 -3.794 864 HB2 SER 107 1HB SER 107 -12.363 -7.432 -2.582 865 HB3 SER 107 2HB SER 107 -12.243 -8.953 -1.697 866 HG SER 107 HG SER 107 -9.985 -7.327 -2.192 867 H SER 108 H SER 108 -13.269 -8.280 -4.952 868 HA SER 108 HA SER 108 -12.059 -6.042 -6.305 869 HB2 SER 108 1HB SER 108 -12.131 -8.656 -7.566 870 HB3 SER 108 2HB SER 108 -13.053 -7.472 -8.493 871 HG SER 108 HG SER 108 -10.399 -7.749 -8.302 872 H VAL 109 H VAL 109 -13.567 -4.684 -7.286 873 HA VAL 109 HA VAL 109 -15.585 -3.667 -7.558 874 HB VAL 109 HB VAL 109 -16.706 -6.468 -7.712 875 HG11 VAL 109 1HG1 VAL 109 -17.739 -3.759 -8.457 876 HG12 VAL 109 2HG1 VAL 109 -18.310 -5.202 -9.299 877 HG13 VAL 109 3HG1 VAL 109 -18.535 -5.048 -7.556 878 HG21 VAL 109 3HG2 VAL 109 -15.201 -4.809 -9.678 879 HG22 VAL 109 1HG2 VAL 109 -15.133 -6.546 -9.382 880 HG23 VAL 109 2HG2 VAL 109 -16.498 -5.853 -10.258 Start of MODEL 2 1 H1 GLY 1 H GLY 1 15.100 -17.904 -8.133 2 HA2 GLY 1 1HA GLY 1 14.779 -17.830 -5.856 3 HA3 GLY 1 2HA GLY 1 13.919 -16.339 -6.211 4 HA PRO 2 HA PRO 2 11.077 -19.691 -4.431 5 HB2 PRO 2 1HB PRO 2 10.643 -18.541 -2.011 6 HB3 PRO 2 2HB PRO 2 11.954 -19.688 -2.308 7 HG2 PRO 2 1HG PRO 2 12.039 -16.697 -2.206 8 HG3 PRO 2 2HG PRO 2 13.174 -17.873 -1.516 9 HD2 PRO 2 1HD PRO 2 13.661 -16.565 -3.838 10 HD3 PRO 2 2HD PRO 2 14.238 -18.217 -3.532 11 H GLY 3 H GLY 3 11.059 -16.157 -4.150 12 HA2 GLY 3 1HA GLY 3 9.150 -15.208 -5.557 13 HA3 GLY 3 2HA GLY 3 8.132 -16.199 -4.522 14 H SER 4 H SER 4 7.703 -13.494 -4.718 15 HA SER 4 HA SER 4 7.822 -12.704 -1.993 16 HB2 SER 4 1HB SER 4 9.191 -10.639 -2.337 17 HB3 SER 4 2HB SER 4 10.120 -12.131 -2.485 18 HG SER 4 HG SER 4 10.412 -11.762 -4.557 19 H MET 5 H MET 5 6.670 -10.728 -1.583 20 HA MET 5 HA MET 5 4.787 -10.102 -3.740 21 HB2 MET 5 1HB MET 5 3.936 -10.884 -1.510 22 HB3 MET 5 2HB MET 5 4.567 -9.398 -0.811 23 HG2 MET 5 1HG MET 5 2.949 -8.102 -1.743 24 HG3 MET 5 2HG MET 5 2.745 -9.162 -3.136 25 HE1 MET 5 3HE MET 5 2.888 -9.476 0.554 26 HE2 MET 5 1HE MET 5 1.283 -8.803 0.837 27 HE3 MET 5 2HE MET 5 1.552 -10.539 0.998 28 H ASN 6 H ASN 6 4.105 -7.874 -4.043 29 HA ASN 6 HA ASN 6 6.125 -5.895 -3.237 30 HB2 ASN 6 1HB ASN 6 4.885 -6.014 -5.992 31 HB3 ASN 6 2HB ASN 6 6.172 -4.942 -5.447 32 HD21 ASN 6 2HD2 ASN 6 6.068 -6.905 -7.639 33 HD22 ASN 6 1HD2 ASN 6 7.403 -7.967 -7.370 34 H ILE 7 H ILE 7 5.255 -4.190 -2.272 35 HA ILE 7 HA ILE 7 2.400 -3.626 -2.734 36 HB ILE 7 HB ILE 7 4.073 -2.970 -0.306 37 HG12 ILE 7 1HG1 ILE 7 1.967 -4.598 0.461 38 HG13 ILE 7 2HG1 ILE 7 2.481 -5.296 -1.071 39 HG21 ILE 7 1HG2 ILE 7 1.374 -2.161 -1.189 40 HG22 ILE 7 2HG2 ILE 7 1.540 -2.633 0.502 41 HG23 ILE 7 3HG2 ILE 7 2.528 -1.326 -0.150 42 HD11 ILE 7 3HD1 ILE 7 4.458 -5.999 -0.242 43 HD12 ILE 7 1HD1 ILE 7 4.605 -4.638 0.870 44 HD13 ILE 7 2HD1 ILE 7 3.540 -5.988 1.264 45 H LEU 8 H LEU 8 1.726 -1.538 -3.121 46 HA LEU 8 HA LEU 8 3.866 0.423 -3.628 47 HB2 LEU 8 1HB LEU 8 2.845 -0.370 -5.689 48 HB3 LEU 8 2HB LEU 8 1.248 0.056 -5.078 49 HG LEU 8 HG LEU 8 1.885 2.431 -5.112 50 HD11 LEU 8 1HD1 LEU 8 4.505 1.332 -5.437 51 HD12 LEU 8 2HD1 LEU 8 4.025 3.005 -5.150 52 HD13 LEU 8 3HD1 LEU 8 4.136 2.390 -6.799 53 HD21 LEU 8 3HD2 LEU 8 2.069 2.626 -7.619 54 HD22 LEU 8 1HD2 LEU 8 0.726 1.648 -7.024 55 HD23 LEU 8 2HD2 LEU 8 2.170 0.865 -7.668 56 H LEU 9 H LEU 9 3.587 2.507 -2.934 57 HA LEU 9 HA LEU 9 1.155 3.049 -1.361 58 HB2 LEU 9 1HB LEU 9 3.442 2.685 -0.168 59 HB3 LEU 9 2HB LEU 9 3.787 4.320 -0.731 60 HG LEU 9 HG LEU 9 1.226 4.202 0.601 61 HD11 LEU 9 1HD1 LEU 9 3.615 3.098 2.045 62 HD12 LEU 9 2HD1 LEU 9 1.988 2.428 1.933 63 HD13 LEU 9 3HD1 LEU 9 2.278 3.878 2.892 64 HD21 LEU 9 3HD2 LEU 9 3.760 5.647 1.355 65 HD22 LEU 9 1HD2 LEU 9 2.106 6.076 1.791 66 HD23 LEU 9 2HD2 LEU 9 2.638 6.206 0.114 67 H VAL 10 H VAL 10 0.043 4.812 -1.904 68 HA VAL 10 HA VAL 10 1.197 6.618 -3.900 69 HB VAL 10 HB VAL 10 -1.675 6.479 -2.981 70 HG11 VAL 10 1HG1 VAL 10 -0.978 7.417 -5.679 71 HG12 VAL 10 2HG1 VAL 10 -2.154 8.046 -4.524 72 HG13 VAL 10 3HG1 VAL 10 -0.447 8.458 -4.359 73 HG21 VAL 10 3HG2 VAL 10 -2.120 5.147 -4.967 74 HG22 VAL 10 1HG2 VAL 10 -0.405 5.158 -5.378 75 HG23 VAL 10 2HG2 VAL 10 -0.958 4.327 -3.925 76 H CYS 11 H CYS 11 2.226 8.310 -3.051 77 HA CYS 11 HA CYS 11 0.890 10.300 -1.598 78 HB2 CYS 11 1HB CYS 11 1.011 8.829 0.308 79 HB3 CYS 11 2HB CYS 11 2.723 8.535 0.031 80 HG CYS 11 HG CYS 11 3.180 11.442 0.432 81 H GLY 12 H GLY 12 4.218 9.067 -1.260 82 HA2 GLY 12 1HA GLY 12 5.851 10.070 -2.917 83 HA3 GLY 12 2HA GLY 12 5.149 11.610 -2.440 84 H ALA 13 H ALA 13 7.536 9.300 -1.790 85 HA ALA 13 HA ALA 13 8.007 10.193 0.939 86 HB1 ALA 13 3HB ALA 13 10.122 8.550 -0.019 87 HB2 ALA 13 1HB ALA 13 8.883 8.172 1.180 88 HB3 ALA 13 2HB ALA 13 8.589 7.844 -0.528 89 H GLY 14 H GLY 14 9.277 10.661 -2.281 90 HA2 GLY 14 1HA GLY 14 10.755 12.224 -3.094 91 HA3 GLY 14 2HA GLY 14 10.670 13.017 -1.528 92 H MET 15 H MET 15 12.028 10.050 -2.970 93 HA MET 15 HA MET 15 14.059 9.053 -2.747 94 HB2 MET 15 1HB MET 15 14.570 11.835 -2.829 95 HB3 MET 15 2HB MET 15 15.614 11.163 -1.584 96 HG2 MET 15 1HG MET 15 16.801 11.159 -3.649 97 HG3 MET 15 2HG MET 15 16.414 9.493 -3.227 98 HE1 MET 15 3HE MET 15 16.803 9.032 -6.442 99 HE2 MET 15 1HE MET 15 16.481 8.228 -4.905 100 HE3 MET 15 2HE MET 15 15.317 8.106 -6.225 101 H SER 16 H SER 16 15.869 8.609 -1.082 102 HA SER 16 HA SER 16 16.390 7.714 0.945 103 HB2 SER 16 1HB SER 16 14.792 10.019 2.079 104 HB3 SER 16 2HB SER 16 16.087 9.126 2.876 105 HG SER 16 HG SER 16 17.438 10.442 1.977 106 H THR 17 H THR 17 15.131 7.445 3.330 107 HA THR 17 HA THR 17 12.801 5.815 2.605 108 HB THR 17 HB THR 17 14.656 4.644 3.739 109 HG1 THR 17 HG1 THR 17 12.507 3.910 4.068 110 HG21 THR 17 3HG2 THR 17 13.973 6.243 6.196 111 HG22 THR 17 1HG2 THR 17 15.301 6.679 5.123 112 HG23 THR 17 2HG2 THR 17 15.317 5.126 5.958 113 H SER 18 H SER 18 11.019 5.699 4.183 114 HA SER 18 HA SER 18 10.593 8.290 5.524 115 HB2 SER 18 1HB SER 18 8.819 6.686 3.742 116 HB3 SER 18 2HB SER 18 8.069 7.572 5.070 117 HG SER 18 HG SER 18 9.802 8.707 3.126 118 H MET 19 H MET 19 8.707 8.088 7.166 119 HA MET 19 HA MET 19 9.522 6.413 9.240 120 HB2 MET 19 1HB MET 19 6.797 7.662 8.841 121 HB3 MET 19 2HB MET 19 7.441 7.058 10.363 122 HG2 MET 19 1HG MET 19 8.292 9.051 10.772 123 HG3 MET 19 2HG MET 19 9.326 8.887 9.355 124 HE1 MET 19 3HE MET 19 7.271 10.735 11.219 125 HE2 MET 19 1HE MET 19 7.488 12.186 10.241 126 HE3 MET 19 2HE MET 19 5.910 11.405 10.319 127 H LEU 20 H LEU 20 6.583 6.121 7.235 128 HA LEU 20 HA LEU 20 5.653 3.715 8.215 129 HB2 LEU 20 1HB LEU 20 5.444 5.083 5.574 130 HB3 LEU 20 2HB LEU 20 4.836 3.437 5.734 131 HG LEU 20 HG LEU 20 3.076 5.147 5.976 132 HD11 LEU 20 1HD1 LEU 20 3.186 2.869 7.218 133 HD12 LEU 20 2HD1 LEU 20 1.960 4.052 7.672 134 HD13 LEU 20 3HD1 LEU 20 3.412 3.867 8.655 135 HD21 LEU 20 3HD2 LEU 20 4.264 5.898 8.618 136 HD22 LEU 20 1HD2 LEU 20 3.044 6.737 7.660 137 HD23 LEU 20 2HD2 LEU 20 4.732 6.753 7.148 138 H VAL 21 H VAL 21 7.705 4.154 5.328 139 HA VAL 21 HA VAL 21 8.139 1.501 4.708 140 HB VAL 21 HB VAL 21 10.183 3.714 4.468 141 HG11 VAL 21 1HG1 VAL 21 10.381 1.991 2.300 142 HG12 VAL 21 2HG1 VAL 21 11.489 2.097 3.669 143 HG13 VAL 21 3HG1 VAL 21 10.168 0.928 3.689 144 HG21 VAL 21 3HG2 VAL 21 9.155 3.614 2.032 145 HG22 VAL 21 1HG2 VAL 21 7.734 3.059 2.918 146 HG23 VAL 21 2HG2 VAL 21 8.450 4.626 3.293 147 H GLN 22 H GLN 22 9.841 3.523 7.056 148 HA GLN 22 HA GLN 22 11.886 1.720 7.709 149 HB2 GLN 22 1HB GLN 22 10.711 4.142 8.903 150 HB3 GLN 22 2HB GLN 22 11.490 3.059 10.049 151 HG2 GLN 22 1HG GLN 22 12.910 3.854 7.547 152 HG3 GLN 22 2HG GLN 22 12.851 4.956 8.923 153 HE21 GLN 22 2HE2 GLN 22 14.169 2.049 7.640 154 HE22 GLN 22 1HE2 GLN 22 15.265 1.717 8.934 155 H ARG 23 H ARG 23 8.779 2.312 9.353 156 HA ARG 23 HA ARG 23 9.014 0.369 11.325 157 HB2 ARG 23 1HB ARG 23 6.486 1.265 9.928 158 HB3 ARG 23 2HB ARG 23 6.572 0.458 11.489 159 HG2 ARG 23 1HG ARG 23 8.191 2.880 11.341 160 HG3 ARG 23 2HG ARG 23 6.465 3.157 11.096 161 HD2 ARG 23 1HD ARG 23 6.869 3.356 13.426 162 HD3 ARG 23 2HD ARG 23 6.060 1.810 13.178 163 HE ARG 23 HE ARG 23 8.765 1.275 13.117 164 HH11 ARG 23 1HH1 ARG 23 6.485 2.605 15.388 165 HH12 ARG 23 2HH1 ARG 23 7.350 2.050 16.781 166 HH21 ARG 23 1HH2 ARG 23 9.913 0.538 14.945 167 HH22 ARG 23 2HH2 ARG 23 9.301 0.875 16.529 168 H ILE 24 H ILE 24 7.259 0.073 8.231 169 HA ILE 24 HA ILE 24 6.628 -2.622 8.419 170 HB ILE 24 HB ILE 24 7.256 -1.068 5.907 171 HG12 ILE 24 1HG1 ILE 24 4.458 -1.621 6.585 172 HG13 ILE 24 2HG1 ILE 24 5.268 -0.580 7.751 173 HG21 ILE 24 1HG2 ILE 24 5.728 -2.758 4.852 174 HG22 ILE 24 2HG2 ILE 24 7.288 -3.385 5.382 175 HG23 ILE 24 3HG2 ILE 24 5.842 -3.688 6.345 176 HD11 ILE 24 3HD1 ILE 24 4.654 -0.098 4.880 177 HD12 ILE 24 1HD1 ILE 24 4.417 0.951 6.278 178 HD13 ILE 24 2HD1 ILE 24 6.036 0.712 5.618 179 H GLU 25 H GLU 25 9.464 -1.124 6.874 180 HA GLU 25 HA GLU 25 10.703 -3.428 5.957 181 HB2 GLU 25 1HB GLU 25 11.740 -0.756 6.838 182 HB3 GLU 25 2HB GLU 25 12.867 -2.032 6.400 183 HG2 GLU 25 1HG GLU 25 10.653 -1.146 4.579 184 HG3 GLU 25 2HG GLU 25 12.241 -0.382 4.589 185 H LYS 26 H LYS 26 10.797 -1.948 9.157 186 HA LYS 26 HA LYS 26 12.791 -3.635 10.245 187 HB2 LYS 26 1HB LYS 26 11.075 -1.521 11.162 188 HB3 LYS 26 2HB LYS 26 11.043 -2.843 12.321 189 HG2 LYS 26 1HG LYS 26 13.737 -2.276 11.446 190 HG3 LYS 26 2HG LYS 26 12.953 -0.843 12.116 191 HD2 LYS 26 1HD LYS 26 12.880 -3.499 13.522 192 HD3 LYS 26 2HD LYS 26 14.216 -2.365 13.738 193 HE2 LYS 26 1HE LYS 26 11.728 -0.975 14.003 194 HE3 LYS 26 2HE LYS 26 11.723 -2.390 15.054 195 HZ1 LYS 26 3HZ LYS 26 13.985 -0.482 14.992 196 HZ2 LYS 26 1HZ LYS 26 13.627 -1.644 16.169 197 HZ3 LYS 26 2HZ LYS 26 12.655 -0.268 16.017 198 H TYR 27 H TYR 27 9.277 -3.647 10.876 199 HA TYR 27 HA TYR 27 9.140 -6.038 12.246 200 HB2 TYR 27 1HB TYR 27 7.251 -4.497 12.076 201 HB3 TYR 27 2HB TYR 27 7.083 -4.865 10.364 202 HD1 TYR 27 HD1 TYR 27 6.211 -7.044 9.640 203 HD2 TYR 27 HD2 TYR 27 6.435 -6.008 13.760 204 HE1 TYR 27 HE1 TYR 27 4.679 -8.891 10.182 205 HE2 TYR 27 HE2 TYR 27 4.904 -7.853 14.313 206 HH TYR 27 HH TYR 27 3.161 -9.199 13.184 207 H ALA 28 H ALA 28 9.014 -5.489 8.753 208 HA ALA 28 HA ALA 28 8.514 -8.185 8.037 209 HB1 ALA 28 3HB ALA 28 9.986 -6.369 6.194 210 HB2 ALA 28 1HB ALA 28 8.667 -7.493 5.860 211 HB3 ALA 28 2HB ALA 28 8.336 -5.954 6.657 212 H LYS 29 H LYS 29 11.502 -6.263 8.186 213 HA LYS 29 HA LYS 29 13.252 -8.264 7.299 214 HB2 LYS 29 1HB LYS 29 13.935 -5.938 7.415 215 HB3 LYS 29 2HB LYS 29 13.746 -5.937 9.163 216 HG2 LYS 29 1HG LYS 29 15.617 -7.337 9.468 217 HG3 LYS 29 2HG LYS 29 15.685 -7.744 7.752 218 HD2 LYS 29 1HD LYS 29 16.386 -5.528 7.184 219 HD3 LYS 29 2HD LYS 29 16.102 -4.960 8.832 220 HE2 LYS 29 1HE LYS 29 17.880 -7.208 8.871 221 HE3 LYS 29 2HE LYS 29 18.482 -5.994 7.742 222 HZ1 LYS 29 3HZ LYS 29 18.139 -4.344 9.583 223 HZ2 LYS 29 1HZ LYS 29 19.376 -5.468 9.841 224 HZ3 LYS 29 2HZ LYS 29 17.890 -5.653 10.625 225 H SER 30 H SER 30 11.763 -7.709 10.389 226 HA SER 30 HA SER 30 13.532 -9.488 11.819 227 HB2 SER 30 1HB SER 30 10.901 -8.250 12.666 228 HB3 SER 30 2HB SER 30 12.029 -9.095 13.726 229 HG SER 30 HG SER 30 13.216 -7.363 13.816 230 H LYS 31 H LYS 31 10.193 -9.568 10.628 231 HA LYS 31 HA LYS 31 9.684 -12.218 11.563 232 HB2 LYS 31 1HB LYS 31 8.271 -10.371 9.651 233 HB3 LYS 31 2HB LYS 31 7.720 -12.022 9.907 234 HG2 LYS 31 1HG LYS 31 7.994 -9.920 12.046 235 HG3 LYS 31 2HG LYS 31 6.486 -10.414 11.273 236 HD2 LYS 31 1HD LYS 31 7.533 -12.807 12.102 237 HD3 LYS 31 2HD LYS 31 8.025 -11.711 13.396 238 HE2 LYS 31 1HE LYS 31 5.210 -11.696 12.379 239 HE3 LYS 31 2HE LYS 31 5.731 -12.914 13.543 240 HZ1 LYS 31 3HZ LYS 31 6.399 -10.148 14.164 241 HZ2 LYS 31 1HZ LYS 31 5.902 -11.399 15.189 242 HZ3 LYS 31 2HZ LYS 31 4.762 -10.563 14.260 243 H ASN 32 H ASN 32 11.360 -10.940 8.891 244 HA ASN 32 HA ASN 32 12.418 -11.901 7.123 245 HB2 ASN 32 1HB ASN 32 12.827 -13.655 9.045 246 HB3 ASN 32 2HB ASN 32 11.728 -14.647 8.092 247 HD21 ASN 32 2HD2 ASN 32 12.703 -15.957 6.745 248 HD22 ASN 32 1HD2 ASN 32 14.216 -15.679 5.960 249 H ILE 33 H ILE 33 10.195 -11.006 6.275 250 HA ILE 33 HA ILE 33 8.743 -13.201 4.952 251 HB ILE 33 HB ILE 33 7.838 -10.362 5.439 252 HG12 ILE 33 1HG1 ILE 33 6.634 -12.859 6.610 253 HG13 ILE 33 2HG1 ILE 33 7.975 -12.038 7.401 254 HG21 ILE 33 1HG2 ILE 33 5.647 -11.193 4.622 255 HG22 ILE 33 2HG2 ILE 33 6.902 -11.180 3.384 256 HG23 ILE 33 3HG2 ILE 33 6.437 -12.698 4.152 257 HD11 ILE 33 3HD1 ILE 33 5.174 -11.100 6.975 258 HD12 ILE 33 1HD1 ILE 33 6.122 -11.164 8.461 259 HD13 ILE 33 2HD1 ILE 33 6.479 -9.944 7.238 260 H ASN 34 H ASN 34 8.428 -13.174 2.746 261 HA ASN 34 HA ASN 34 10.334 -11.591 1.241 262 HB2 ASN 34 1HB ASN 34 8.524 -13.899 0.572 263 HB3 ASN 34 2HB ASN 34 9.334 -12.985 -0.697 264 HD21 ASN 34 2HD2 ASN 34 9.570 -15.784 0.507 265 HD22 ASN 34 1HD2 ASN 34 11.270 -15.979 0.740 266 H ALA 35 H ALA 35 9.340 -9.519 1.550 267 HA ALA 35 HA ALA 35 7.295 -8.990 -0.459 268 HB1 ALA 35 3HB ALA 35 5.853 -9.221 1.368 269 HB2 ALA 35 1HB ALA 35 6.968 -8.407 2.466 270 HB3 ALA 35 2HB ALA 35 6.111 -7.481 1.233 271 H THR 36 H THR 36 7.003 -6.607 -0.796 272 HA THR 36 HA THR 36 9.318 -5.007 0.006 273 HB THR 36 HB THR 36 8.984 -4.271 -2.644 274 HG1 THR 36 HG1 THR 36 8.107 -6.000 -3.522 275 HG21 THR 36 3HG2 THR 36 11.042 -4.858 -1.029 276 HG22 THR 36 1HG2 THR 36 11.214 -4.693 -2.776 277 HG23 THR 36 2HG2 THR 36 11.064 -6.295 -2.052 278 H ILE 37 H ILE 37 9.045 -2.697 -0.507 279 HA ILE 37 HA ILE 37 6.321 -1.827 -1.058 280 HB ILE 37 HB ILE 37 6.437 -2.166 1.408 281 HG12 ILE 37 1HG1 ILE 37 6.246 0.778 1.092 282 HG13 ILE 37 2HG1 ILE 37 5.236 -0.190 0.025 283 HG21 ILE 37 1HG2 ILE 37 8.948 -0.996 1.136 284 HG22 ILE 37 2HG2 ILE 37 7.977 0.205 1.985 285 HG23 ILE 37 3HG2 ILE 37 8.133 -1.424 2.640 286 HD11 ILE 37 3HD1 ILE 37 5.053 -1.161 2.718 287 HD12 ILE 37 1HD1 ILE 37 4.704 0.567 2.655 288 HD13 ILE 37 2HD1 ILE 37 3.785 -0.556 1.652 289 H GLU 38 H GLU 38 6.154 0.364 -1.663 290 HA GLU 38 HA GLU 38 8.503 2.036 -1.724 291 HB2 GLU 38 1HB GLU 38 8.125 0.314 -3.874 292 HB3 GLU 38 2HB GLU 38 7.471 1.846 -4.437 293 HG2 GLU 38 1HG GLU 38 9.694 1.919 -5.089 294 HG3 GLU 38 2HG GLU 38 9.664 2.870 -3.604 295 H ALA 39 H ALA 39 8.028 4.163 -2.769 296 HA ALA 39 HA ALA 39 5.159 4.808 -2.739 297 HB1 ALA 39 3HB ALA 39 5.367 6.015 -0.891 298 HB2 ALA 39 1HB ALA 39 7.085 5.623 -0.805 299 HB3 ALA 39 2HB ALA 39 6.548 7.042 -1.705 300 H ILE 40 H ILE 40 4.511 6.036 -4.397 301 HA ILE 40 HA ILE 40 6.346 7.843 -5.728 302 HB ILE 40 HB ILE 40 5.754 6.867 -7.989 303 HG12 ILE 40 1HG1 ILE 40 5.482 4.167 -6.965 304 HG13 ILE 40 2HG1 ILE 40 4.151 5.188 -6.431 305 HG21 ILE 40 1HG2 ILE 40 7.377 4.872 -6.492 306 HG22 ILE 40 2HG2 ILE 40 7.699 5.659 -8.036 307 HG23 ILE 40 3HG2 ILE 40 7.917 6.551 -6.530 308 HD11 ILE 40 3HD1 ILE 40 4.705 5.593 -9.226 309 HD12 ILE 40 1HD1 ILE 40 4.404 3.892 -8.872 310 HD13 ILE 40 2HD1 ILE 40 3.207 5.110 -8.431 311 H ALA 41 H ALA 41 5.064 8.688 -7.831 312 HA ALA 41 HA ALA 41 2.653 9.861 -6.759 313 HB1 ALA 41 3HB ALA 41 4.128 11.318 -7.946 314 HB2 ALA 41 1HB ALA 41 4.115 10.266 -9.361 315 HB3 ALA 41 2HB ALA 41 2.656 11.145 -8.902 316 H GLU 42 H GLU 42 0.908 10.204 -8.685 317 HA GLU 42 HA GLU 42 -0.203 7.576 -9.072 318 HB2 GLU 42 1HB GLU 42 -2.111 8.831 -10.091 319 HB3 GLU 42 2HB GLU 42 -1.719 9.323 -8.449 320 HG2 GLU 42 1HG GLU 42 -0.280 10.894 -10.400 321 HG3 GLU 42 2HG GLU 42 -2.022 10.967 -10.657 322 H THR 43 H THR 43 1.394 9.993 -11.018 323 HA THR 43 HA THR 43 0.664 9.117 -13.572 324 HB THR 43 HB THR 43 2.521 10.340 -14.423 325 HG1 THR 43 HG1 THR 43 3.674 10.634 -11.866 326 HG21 THR 43 3HG2 THR 43 2.273 12.474 -13.369 327 HG22 THR 43 1HG2 THR 43 1.766 11.729 -11.853 328 HG23 THR 43 2HG2 THR 43 0.718 11.650 -13.269 329 H ARG 44 H ARG 44 3.180 8.004 -11.373 330 HA ARG 44 HA ARG 44 4.120 6.060 -13.339 331 HB2 ARG 44 1HB ARG 44 5.179 7.206 -10.819 332 HB3 ARG 44 2HB ARG 44 5.611 5.536 -11.158 333 HG2 ARG 44 1HG ARG 44 6.789 6.094 -13.077 334 HG3 ARG 44 2HG ARG 44 5.979 7.654 -13.236 335 HD2 ARG 44 1HD ARG 44 7.116 8.151 -10.938 336 HD3 ARG 44 2HD ARG 44 8.200 6.843 -11.412 337 HE ARG 44 HE ARG 44 8.089 9.493 -12.522 338 HH11 ARG 44 1HH1 ARG 44 9.014 6.184 -13.085 339 HH12 ARG 44 2HH1 ARG 44 10.194 6.582 -14.289 340 HH21 ARG 44 1HH2 ARG 44 9.641 10.029 -14.105 341 HH22 ARG 44 2HH2 ARG 44 10.551 8.769 -14.868 342 H LEU 45 H LEU 45 2.012 6.282 -10.661 343 HA LEU 45 HA LEU 45 2.124 3.788 -9.490 344 HB2 LEU 45 1HB LEU 45 0.694 5.361 -8.514 345 HB3 LEU 45 2HB LEU 45 -0.155 5.659 -10.029 346 HG LEU 45 HG LEU 45 -0.376 2.940 -8.864 347 HD11 LEU 45 1HD1 LEU 45 -2.429 4.036 -7.597 348 HD12 LEU 45 2HD1 LEU 45 -1.331 5.414 -7.537 349 HD13 LEU 45 3HD1 LEU 45 -0.844 3.867 -6.843 350 HD21 LEU 45 3HD2 LEU 45 -1.624 3.097 -10.773 351 HD22 LEU 45 1HD2 LEU 45 -1.980 4.806 -10.533 352 HD23 LEU 45 2HD2 LEU 45 -2.828 3.588 -9.581 353 H SER 46 H SER 46 0.104 4.744 -12.269 354 HA SER 46 HA SER 46 -0.840 2.116 -12.771 355 HB2 SER 46 1HB SER 46 -0.837 3.820 -15.124 356 HB3 SER 46 2HB SER 46 -2.200 3.167 -14.217 357 HG SER 46 HG SER 46 -2.341 4.970 -13.101 358 H GLU 47 H GLU 47 2.146 3.570 -13.310 359 HA GLU 47 HA GLU 47 2.804 1.928 -15.629 360 HB2 GLU 47 1HB GLU 47 4.458 3.951 -14.106 361 HB3 GLU 47 2HB GLU 47 4.976 3.113 -15.562 362 HG2 GLU 47 1HG GLU 47 2.857 4.129 -16.625 363 HG3 GLU 47 2HG GLU 47 2.890 5.228 -15.248 364 H VAL 48 H VAL 48 3.105 1.903 -12.213 365 HA VAL 48 HA VAL 48 5.221 -0.124 -12.284 366 HB VAL 48 HB VAL 48 5.252 0.113 -9.818 367 HG11 VAL 48 1HG1 VAL 48 5.998 2.105 -11.769 368 HG12 VAL 48 2HG1 VAL 48 5.698 2.837 -10.191 369 HG13 VAL 48 3HG1 VAL 48 6.878 1.535 -10.351 370 HG21 VAL 48 3HG2 VAL 48 3.308 2.376 -10.258 371 HG22 VAL 48 1HG2 VAL 48 2.881 0.802 -9.586 372 HG23 VAL 48 2HG2 VAL 48 4.001 1.856 -8.721 373 H VAL 49 H VAL 49 1.830 0.302 -11.629 374 HA VAL 49 HA VAL 49 1.218 -1.917 -10.109 375 HB VAL 49 HB VAL 49 -1.004 -1.910 -11.251 376 HG11 VAL 49 1HG1 VAL 49 -0.919 0.883 -10.803 377 HG12 VAL 49 2HG1 VAL 49 -1.471 -0.385 -9.708 378 HG13 VAL 49 3HG1 VAL 49 0.217 0.130 -9.685 379 HG21 VAL 49 3HG2 VAL 49 -0.478 -1.330 -13.479 380 HG22 VAL 49 1HG2 VAL 49 -1.377 0.041 -12.828 381 HG23 VAL 49 2HG2 VAL 49 0.379 0.128 -12.980 382 H ASP 50 H ASP 50 2.090 -1.739 -13.479 383 HA ASP 50 HA ASP 50 1.145 -4.173 -14.420 384 HB2 ASP 50 1HB ASP 50 2.409 -2.241 -15.639 385 HB3 ASP 50 2HB ASP 50 3.852 -3.166 -15.233 386 H ARG 51 H ARG 51 3.773 -3.490 -12.264 387 HA ARG 51 HA ARG 51 4.598 -6.315 -12.349 388 HB2 ARG 51 1HB ARG 51 6.122 -3.982 -11.180 389 HB3 ARG 51 2HB ARG 51 6.711 -5.624 -11.403 390 HG2 ARG 51 1HG ARG 51 6.055 -5.051 -13.934 391 HG3 ARG 51 2HG ARG 51 6.428 -3.428 -13.350 392 HD2 ARG 51 1HD ARG 51 8.547 -4.637 -12.358 393 HD3 ARG 51 2HD ARG 51 8.199 -5.807 -13.630 394 HE ARG 51 HE ARG 51 8.163 -3.259 -14.768 395 HH11 ARG 51 1HH1 ARG 51 10.422 -5.449 -13.277 396 HH12 ARG 51 2HH1 ARG 51 11.784 -4.858 -14.170 397 HH21 ARG 51 1HH2 ARG 51 9.949 -2.472 -15.950 398 HH22 ARG 51 2HH2 ARG 51 11.515 -3.165 -15.689 399 H PHE 52 H PHE 52 3.749 -3.649 -10.189 400 HA PHE 52 HA PHE 52 4.059 -4.952 -7.746 401 HB2 PHE 52 1HB PHE 52 2.447 -2.639 -8.709 402 HB3 PHE 52 2HB PHE 52 2.031 -3.325 -7.142 403 HD1 PHE 52 HD1 PHE 52 4.238 -3.833 -5.657 404 HD2 PHE 52 HD2 PHE 52 3.869 -0.853 -8.673 405 HE1 PHE 52 HE1 PHE 52 6.062 -2.555 -4.611 406 HE2 PHE 52 HE2 PHE 52 5.693 0.430 -7.633 407 HZ PHE 52 HZ PHE 52 6.792 -0.420 -5.600 408 H ASP 53 H ASP 53 1.938 -5.223 -6.288 409 HA ASP 53 HA ASP 53 -0.005 -6.868 -7.750 410 HB2 ASP 53 1HB ASP 53 1.530 -7.678 -5.277 411 HB3 ASP 53 2HB ASP 53 0.080 -8.510 -5.833 412 H VAL 54 H VAL 54 0.817 -5.178 -4.755 413 HA VAL 54 HA VAL 54 -2.065 -4.741 -4.304 414 HB VAL 54 HB VAL 54 0.054 -4.810 -2.155 415 HG11 VAL 54 1HG1 VAL 54 -2.959 -4.721 -2.062 416 HG12 VAL 54 2HG1 VAL 54 -1.920 -4.977 -0.658 417 HG13 VAL 54 3HG1 VAL 54 -1.839 -3.457 -1.550 418 HG21 VAL 54 3HG2 VAL 54 -0.842 -6.996 -1.531 419 HG22 VAL 54 1HG2 VAL 54 -1.932 -6.950 -2.917 420 HG23 VAL 54 2HG2 VAL 54 -0.188 -7.023 -3.168 421 H VAL 55 H VAL 55 -2.738 -2.694 -3.709 422 HA VAL 55 HA VAL 55 -0.690 -0.577 -3.827 423 HB VAL 55 HB VAL 55 -3.515 -0.303 -4.852 424 HG11 VAL 55 1HG1 VAL 55 -1.068 1.444 -5.072 425 HG12 VAL 55 2HG1 VAL 55 -2.573 1.717 -5.952 426 HG13 VAL 55 3HG1 VAL 55 -2.553 1.797 -4.189 427 HG21 VAL 55 3HG2 VAL 55 -2.559 -1.834 -6.343 428 HG22 VAL 55 1HG2 VAL 55 -2.318 -0.268 -7.116 429 HG23 VAL 55 2HG2 VAL 55 -0.980 -1.052 -6.276 430 H LEU 56 H LEU 56 -1.058 1.285 -2.564 431 HA LEU 56 HA LEU 56 -3.248 1.152 -0.623 432 HB2 LEU 56 1HB LEU 56 -0.357 0.970 -0.070 433 HB3 LEU 56 2HB LEU 56 -1.269 2.068 0.964 434 HG LEU 56 HG LEU 56 -2.509 -0.563 0.686 435 HD11 LEU 56 1HD1 LEU 56 0.142 -0.816 0.679 436 HD12 LEU 56 2HD1 LEU 56 -0.917 -1.923 1.552 437 HD13 LEU 56 3HD1 LEU 56 -0.106 -0.615 2.414 438 HD21 LEU 56 3HD2 LEU 56 -3.149 -0.166 2.823 439 HD22 LEU 56 1HD2 LEU 56 -2.777 1.495 2.366 440 HD23 LEU 56 2HD2 LEU 56 -1.600 0.547 3.274 441 H LEU 57 H LEU 57 -3.959 3.130 0.139 442 HA LEU 57 HA LEU 57 -2.837 5.472 -1.247 443 HB2 LEU 57 1HB LEU 57 -5.081 5.095 -1.931 444 HB3 LEU 57 2HB LEU 57 -5.617 4.868 -0.268 445 HG LEU 57 HG LEU 57 -5.143 7.277 0.149 446 HD11 LEU 57 1HD1 LEU 57 -3.930 8.426 -1.303 447 HD12 LEU 57 2HD1 LEU 57 -5.220 8.252 -2.493 448 HD13 LEU 57 3HD1 LEU 57 -3.920 7.063 -2.422 449 HD21 LEU 57 3HD2 LEU 57 -7.183 8.000 -0.697 450 HD22 LEU 57 1HD2 LEU 57 -7.380 6.248 -0.628 451 HD23 LEU 57 2HD2 LEU 57 -7.029 7.036 -2.167 452 H ALA 58 H ALA 58 -2.670 7.458 -0.114 453 HA ALA 58 HA ALA 58 -2.259 7.093 2.765 454 HB1 ALA 58 3HB ALA 58 -0.300 7.991 2.074 455 HB2 ALA 58 1HB ALA 58 -1.034 8.806 0.692 456 HB3 ALA 58 2HB ALA 58 -1.183 9.500 2.307 457 HA PRO 59 HA PRO 59 -5.580 9.693 3.976 458 HB2 PRO 59 1HB PRO 59 -4.504 11.092 6.040 459 HB3 PRO 59 2HB PRO 59 -4.911 9.375 6.151 460 HG2 PRO 59 1HG PRO 59 -2.254 10.665 5.660 461 HG3 PRO 59 2HG PRO 59 -2.655 9.296 6.712 462 HD2 PRO 59 1HD PRO 59 -1.555 8.975 4.259 463 HD3 PRO 59 2HD PRO 59 -2.682 7.797 4.962 464 H GLN 60 H GLN 60 -6.102 12.063 4.564 465 HA GLN 60 HA GLN 60 -6.270 14.224 3.872 466 HB2 GLN 60 1HB GLN 60 -3.992 14.283 4.940 467 HB3 GLN 60 2HB GLN 60 -3.304 14.047 3.338 468 HG2 GLN 60 1HG GLN 60 -3.469 16.204 2.879 469 HG3 GLN 60 2HG GLN 60 -5.178 16.220 3.304 470 HE21 GLN 60 2HE2 GLN 60 -5.405 17.965 4.535 471 HE22 GLN 60 1HE2 GLN 60 -4.482 18.318 5.952 472 H SER 61 H SER 61 -7.489 13.352 2.041 473 HA SER 61 HA SER 61 -6.359 14.276 -0.456 474 HB2 SER 61 1HB SER 61 -7.377 11.904 -1.359 475 HB3 SER 61 2HB SER 61 -5.667 12.208 -1.060 476 HG SER 61 HG SER 61 -7.537 10.835 0.527 477 H ARG 62 H ARG 62 -7.888 15.533 -1.269 478 HA ARG 62 HA ARG 62 -10.679 15.066 -0.590 479 HB2 ARG 62 1HB ARG 62 -9.061 17.353 -1.421 480 HB3 ARG 62 2HB ARG 62 -10.609 17.272 -2.251 481 HG2 ARG 62 1HG ARG 62 -10.660 16.876 0.674 482 HG3 ARG 62 2HG ARG 62 -10.267 18.496 0.095 483 HD2 ARG 62 1HD ARG 62 -12.510 18.737 0.084 484 HD3 ARG 62 2HD ARG 62 -12.374 17.934 -1.480 485 HE ARG 62 HE ARG 62 -12.625 15.906 0.347 486 HH11 ARG 62 1HH1 ARG 62 -14.496 18.702 -0.550 487 HH12 ARG 62 2HH1 ARG 62 -16.016 17.977 -0.142 488 HH21 ARG 62 1HH2 ARG 62 -14.620 14.942 0.888 489 HH22 ARG 62 2HH2 ARG 62 -16.086 15.839 0.677 490 H PHE 63 H PHE 63 -8.764 15.599 -3.549 491 HA PHE 63 HA PHE 63 -10.941 14.453 -5.131 492 HB2 PHE 63 1HB PHE 63 -8.644 16.244 -5.698 493 HB3 PHE 63 2HB PHE 63 -9.132 15.155 -6.991 494 HD1 PHE 63 HD1 PHE 63 -10.387 17.782 -4.702 495 HD2 PHE 63 HD2 PHE 63 -10.985 15.635 -8.328 496 HE1 PHE 63 HE1 PHE 63 -12.196 19.332 -5.317 497 HE2 PHE 63 HE2 PHE 63 -12.795 17.181 -8.949 498 HZ PHE 63 HZ PHE 63 -13.402 19.033 -7.444 499 H ASN 64 H ASN 64 -7.551 13.933 -4.323 500 HA ASN 64 HA ASN 64 -6.913 11.888 -6.070 501 HB2 ASN 64 1HB ASN 64 -6.042 12.309 -3.205 502 HB3 ASN 64 2HB ASN 64 -5.305 11.134 -4.291 503 HD21 ASN 64 2HD2 ASN 64 -3.324 12.246 -4.004 504 HD22 ASN 64 1HD2 ASN 64 -3.000 13.708 -4.867 505 H LYS 65 H LYS 65 -8.598 11.717 -2.967 506 HA LYS 65 HA LYS 65 -8.720 8.940 -2.703 507 HB2 LYS 65 1HB LYS 65 -9.336 10.322 -0.850 508 HB3 LYS 65 2HB LYS 65 -10.603 11.112 -1.781 509 HG2 LYS 65 1HG LYS 65 -12.034 9.313 -1.615 510 HG3 LYS 65 2HG LYS 65 -10.727 8.167 -1.314 511 HD2 LYS 65 1HD LYS 65 -11.651 8.352 0.786 512 HD3 LYS 65 2HD LYS 65 -10.389 9.583 0.861 513 HE2 LYS 65 1HE LYS 65 -11.878 11.235 1.084 514 HE3 LYS 65 2HE LYS 65 -12.893 10.603 -0.212 515 HZ1 LYS 65 3HZ LYS 65 -12.865 9.514 2.548 516 HZ2 LYS 65 1HZ LYS 65 -13.939 9.112 1.305 517 HZ3 LYS 65 2HZ LYS 65 -13.984 10.655 1.995 518 H LYS 66 H LYS 66 -11.226 11.121 -4.009 519 HA LYS 66 HA LYS 66 -12.992 9.158 -4.878 520 HB2 LYS 66 1HB LYS 66 -13.608 11.513 -4.766 521 HB3 LYS 66 2HB LYS 66 -12.468 11.895 -6.050 522 HG2 LYS 66 1HG LYS 66 -13.797 10.389 -7.549 523 HG3 LYS 66 2HG LYS 66 -15.002 10.291 -6.263 524 HD2 LYS 66 1HD LYS 66 -14.373 13.029 -6.655 525 HD3 LYS 66 2HD LYS 66 -14.665 12.311 -8.241 526 HE2 LYS 66 1HE LYS 66 -16.821 11.523 -7.554 527 HE3 LYS 66 2HE LYS 66 -16.516 11.997 -5.883 528 HZ1 LYS 66 3HZ LYS 66 -17.464 13.924 -6.377 529 HZ2 LYS 66 1HZ LYS 66 -17.538 13.551 -8.026 530 HZ3 LYS 66 2HZ LYS 66 -16.152 14.277 -7.385 531 H ARG 67 H ARG 67 -10.160 10.522 -6.458 532 HA ARG 67 HA ARG 67 -10.593 9.359 -9.000 533 HB2 ARG 67 1HB ARG 67 -8.208 10.510 -7.593 534 HB3 ARG 67 2HB ARG 67 -8.004 9.676 -9.128 535 HG2 ARG 67 1HG ARG 67 -10.092 11.394 -9.628 536 HG3 ARG 67 2HG ARG 67 -9.035 12.332 -8.571 537 HD2 ARG 67 1HD ARG 67 -7.371 12.435 -10.104 538 HD3 ARG 67 2HD ARG 67 -7.715 10.827 -10.741 539 HE ARG 67 HE ARG 67 -9.064 11.784 -12.321 540 HH11 ARG 67 1HH1 ARG 67 -8.467 14.095 -9.788 541 HH12 ARG 67 2HH1 ARG 67 -9.220 15.408 -10.629 542 HH21 ARG 67 1HH2 ARG 67 -10.058 13.504 -13.440 543 HH22 ARG 67 2HH2 ARG 67 -10.126 15.071 -12.707 544 H LEU 68 H LEU 68 -8.327 8.416 -6.407 545 HA LEU 68 HA LEU 68 -7.403 6.062 -7.506 546 HB2 LEU 68 1HB LEU 68 -7.644 7.162 -4.785 547 HB3 LEU 68 2HB LEU 68 -7.460 5.413 -4.881 548 HG LEU 68 HG LEU 68 -5.311 6.472 -4.537 549 HD11 LEU 68 1HD1 LEU 68 -5.334 5.592 -7.401 550 HD12 LEU 68 2HD1 LEU 68 -5.642 4.457 -6.087 551 HD13 LEU 68 3HD1 LEU 68 -4.106 5.320 -6.165 552 HD21 LEU 68 3HD2 LEU 68 -5.376 8.614 -5.353 553 HD22 LEU 68 1HD2 LEU 68 -6.186 8.139 -6.846 554 HD23 LEU 68 2HD2 LEU 68 -4.467 7.808 -6.633 555 H GLU 69 H GLU 69 -10.342 6.613 -5.623 556 HA GLU 69 HA GLU 69 -11.087 3.861 -5.511 557 HB2 GLU 69 1HB GLU 69 -12.832 6.308 -5.181 558 HB3 GLU 69 2HB GLU 69 -13.226 4.672 -4.671 559 HG2 GLU 69 1HG GLU 69 -10.731 5.411 -3.518 560 HG3 GLU 69 2HG GLU 69 -11.900 6.696 -3.220 561 H GLU 70 H GLU 70 -12.003 6.590 -7.575 562 HA GLU 70 HA GLU 70 -13.949 5.185 -9.077 563 HB2 GLU 70 1HB GLU 70 -12.392 7.715 -9.524 564 HB3 GLU 70 2HB GLU 70 -13.433 7.069 -10.786 565 HG2 GLU 70 1HG GLU 70 -14.492 7.508 -8.027 566 HG3 GLU 70 2HG GLU 70 -14.359 8.848 -9.165 567 H ILE 71 H ILE 71 -10.530 5.156 -9.111 568 HA ILE 71 HA ILE 71 -10.403 4.073 -11.823 569 HB ILE 71 HB ILE 71 -8.179 4.726 -9.886 570 HG12 ILE 71 1HG1 ILE 71 -8.716 6.169 -12.458 571 HG13 ILE 71 2HG1 ILE 71 -9.645 6.582 -11.020 572 HG21 ILE 71 1HG2 ILE 71 -8.164 3.669 -12.696 573 HG22 ILE 71 2HG2 ILE 71 -6.784 4.524 -12.009 574 HG23 ILE 71 3HG2 ILE 71 -7.348 3.025 -11.270 575 HD11 ILE 71 3HD1 ILE 71 -6.747 6.957 -11.580 576 HD12 ILE 71 1HD1 ILE 71 -7.924 8.090 -10.918 577 HD13 ILE 71 2HD1 ILE 71 -7.296 6.783 -9.914 578 H THR 72 H THR 72 -9.736 3.160 -8.474 579 HA THR 72 HA THR 72 -8.725 0.577 -9.051 580 HB THR 72 HB THR 72 -9.286 0.098 -6.631 581 HG1 THR 72 HG1 THR 72 -10.893 1.433 -6.063 582 HG21 THR 72 3HG2 THR 72 -7.815 2.481 -6.184 583 HG22 THR 72 1HG2 THR 72 -7.344 1.851 -7.762 584 HG23 THR 72 2HG2 THR 72 -7.206 0.833 -6.327 585 H LYS 73 H LYS 73 -11.953 1.831 -8.433 586 HA LYS 73 HA LYS 73 -13.364 -0.496 -7.981 587 HB2 LYS 73 1HB LYS 73 -13.969 2.203 -8.779 588 HB3 LYS 73 2HB LYS 73 -14.981 1.077 -9.677 589 HG2 LYS 73 1HG LYS 73 -14.696 0.954 -6.690 590 HG3 LYS 73 2HG LYS 73 -15.907 1.958 -7.493 591 HD2 LYS 73 1HD LYS 73 -15.696 -0.915 -8.254 592 HD3 LYS 73 2HD LYS 73 -16.461 -0.501 -6.719 593 HE2 LYS 73 1HE LYS 73 -18.236 0.524 -7.725 594 HE3 LYS 73 2HE LYS 73 -17.294 1.015 -9.132 595 HZ1 LYS 73 3HZ LYS 73 -19.069 -0.903 -9.258 596 HZ2 LYS 73 1HZ LYS 73 -17.762 -1.844 -8.738 597 HZ3 LYS 73 2HZ LYS 73 -17.647 -0.956 -10.173 598 HA PRO 74 HA PRO 74 -13.998 -1.097 -12.726 599 HB2 PRO 74 1HB PRO 74 -12.569 0.495 -14.398 600 HB3 PRO 74 2HB PRO 74 -14.168 0.934 -13.786 601 HG2 PRO 74 1HG PRO 74 -11.470 1.808 -12.830 602 HG3 PRO 74 2HG PRO 74 -12.940 2.771 -13.064 603 HD2 PRO 74 1HD PRO 74 -12.143 1.897 -10.628 604 HD3 PRO 74 2HD PRO 74 -13.854 2.093 -11.059 605 H LYS 75 H LYS 75 -10.748 -0.030 -11.803 606 HA LYS 75 HA LYS 75 -9.323 -1.744 -13.532 607 HB2 LYS 75 1HB LYS 75 -8.631 -0.272 -11.011 608 HB3 LYS 75 2HB LYS 75 -7.481 -1.397 -11.722 609 HG2 LYS 75 1HG LYS 75 -8.708 0.847 -13.293 610 HG3 LYS 75 2HG LYS 75 -7.235 1.045 -12.343 611 HD2 LYS 75 1HD LYS 75 -6.051 -0.505 -13.664 612 HD3 LYS 75 2HD LYS 75 -7.529 -1.126 -14.401 613 HE2 LYS 75 1HE LYS 75 -6.832 1.751 -14.754 614 HE3 LYS 75 2HE LYS 75 -5.963 0.541 -15.697 615 HZ1 LYS 75 3HZ LYS 75 -8.004 -0.225 -16.632 616 HZ2 LYS 75 1HZ LYS 75 -7.954 1.455 -16.817 617 HZ3 LYS 75 2HZ LYS 75 -8.921 0.767 -15.614 618 H GLY 76 H GLY 76 -10.918 -2.272 -10.506 619 HA2 GLY 76 1HA GLY 76 -11.192 -4.147 -9.212 620 HA3 GLY 76 2HA GLY 76 -10.854 -5.052 -10.681 621 H ILE 77 H ILE 77 -8.993 -3.042 -8.393 622 HA ILE 77 HA ILE 77 -7.059 -5.254 -8.193 623 HB ILE 77 HB ILE 77 -5.273 -3.507 -7.917 624 HG12 ILE 77 1HG1 ILE 77 -6.567 -1.453 -9.441 625 HG13 ILE 77 2HG1 ILE 77 -7.520 -1.778 -7.997 626 HG21 ILE 77 1HG2 ILE 77 -6.688 -3.565 -10.579 627 HG22 ILE 77 2HG2 ILE 77 -4.999 -3.139 -10.310 628 HG23 ILE 77 3HG2 ILE 77 -5.556 -4.780 -9.987 629 HD11 ILE 77 3HD1 ILE 77 -5.908 0.001 -7.627 630 HD12 ILE 77 1HD1 ILE 77 -5.561 -1.396 -6.609 631 HD13 ILE 77 2HD1 ILE 77 -4.592 -1.092 -8.051 632 HA PRO 78 HA PRO 78 -7.412 -4.908 -3.830 633 HB2 PRO 78 1HB PRO 78 -4.907 -5.600 -3.045 634 HB3 PRO 78 2HB PRO 78 -6.067 -6.765 -3.694 635 HG2 PRO 78 1HG PRO 78 -3.796 -5.383 -5.071 636 HG3 PRO 78 2HG PRO 78 -4.302 -7.079 -5.176 637 HD2 PRO 78 1HD PRO 78 -4.929 -5.251 -7.073 638 HD3 PRO 78 2HD PRO 78 -5.996 -6.612 -6.669 639 H ILE 79 H ILE 79 -7.732 -2.784 -3.287 640 HA ILE 79 HA ILE 79 -5.311 -1.155 -2.859 641 HB ILE 79 HB ILE 79 -6.781 -0.231 -4.617 642 HG12 ILE 79 1HG1 ILE 79 -7.118 2.048 -3.469 643 HG13 ILE 79 2HG1 ILE 79 -6.455 1.280 -2.031 644 HG21 ILE 79 1HG2 ILE 79 -8.812 0.106 -2.416 645 HG22 ILE 79 2HG2 ILE 79 -8.980 0.605 -4.100 646 HG23 ILE 79 3HG2 ILE 79 -8.902 -1.109 -3.691 647 HD11 ILE 79 3HD1 ILE 79 -4.933 2.611 -3.696 648 HD12 ILE 79 1HD1 ILE 79 -4.355 1.145 -2.907 649 HD13 ILE 79 2HD1 ILE 79 -4.932 1.082 -4.573 650 H GLU 80 H GLU 80 -4.949 -0.384 -0.865 651 HA GLU 80 HA GLU 80 -7.106 -0.646 1.125 652 HB2 GLU 80 1HB GLU 80 -4.210 -1.410 1.306 653 HB3 GLU 80 2HB GLU 80 -5.108 -0.985 2.756 654 HG2 GLU 80 1HG GLU 80 -5.769 -3.204 0.834 655 HG3 GLU 80 2HG GLU 80 -5.080 -3.380 2.448 656 H ILE 81 H ILE 81 -7.634 1.187 2.104 657 HA ILE 81 HA ILE 81 -5.835 3.487 1.847 658 HB ILE 81 HB ILE 81 -8.753 3.394 2.623 659 HG12 ILE 81 1HG1 ILE 81 -8.784 4.736 0.342 660 HG13 ILE 81 2HG1 ILE 81 -7.297 3.840 0.051 661 HG21 ILE 81 1HG2 ILE 81 -8.281 5.957 1.931 662 HG22 ILE 81 2HG2 ILE 81 -8.222 5.359 3.588 663 HG23 ILE 81 3HG2 ILE 81 -6.732 5.534 2.660 664 HD11 ILE 81 3HD1 ILE 81 -10.064 2.953 -0.020 665 HD12 ILE 81 1HD1 ILE 81 -8.627 2.259 -0.770 666 HD13 ILE 81 2HD1 ILE 81 -9.010 1.887 0.911 667 H ILE 82 H ILE 82 -4.785 4.304 3.540 668 HA ILE 82 HA ILE 82 -5.120 3.073 6.140 669 HB ILE 82 HB ILE 82 -3.231 5.305 5.398 670 HG12 ILE 82 1HG1 ILE 82 -2.749 2.319 5.310 671 HG13 ILE 82 2HG1 ILE 82 -2.928 3.361 3.902 672 HG21 ILE 82 1HG2 ILE 82 -1.913 4.377 7.292 673 HG22 ILE 82 2HG2 ILE 82 -3.473 5.044 7.770 674 HG23 ILE 82 3HG2 ILE 82 -3.262 3.298 7.644 675 HD11 ILE 82 3HD1 ILE 82 -0.939 4.651 5.083 676 HD12 ILE 82 1HD1 ILE 82 -0.648 3.049 5.760 677 HD13 ILE 82 2HD1 ILE 82 -0.670 3.277 4.010 678 H ASN 83 H ASN 83 -5.572 4.189 8.070 679 HA ASN 83 HA ASN 83 -7.418 6.395 7.726 680 HB2 ASN 83 1HB ASN 83 -7.410 4.260 9.413 681 HB3 ASN 83 2HB ASN 83 -6.753 5.512 10.462 682 HD21 ASN 83 2HD2 ASN 83 -8.067 7.075 11.235 683 HD22 ASN 83 1HD2 ASN 83 -9.765 7.154 10.922 684 H THR 84 H THR 84 -7.316 8.250 9.277 685 HA THR 84 HA THR 84 -4.905 9.658 8.960 686 HB THR 84 HB THR 84 -6.725 10.497 11.151 687 HG1 THR 84 HG1 THR 84 -8.431 10.813 9.864 688 HG21 THR 84 3HG2 THR 84 -5.090 12.078 10.584 689 HG22 THR 84 1HG2 THR 84 -6.539 12.649 9.758 690 HG23 THR 84 2HG2 THR 84 -5.288 11.795 8.854 691 H ILE 85 H ILE 85 -6.281 7.968 11.751 692 HA ILE 85 HA ILE 85 -4.201 8.700 13.550 693 HB ILE 85 HB ILE 85 -6.137 6.387 13.712 694 HG12 ILE 85 1HG1 ILE 85 -6.530 8.697 15.470 695 HG13 ILE 85 2HG1 ILE 85 -6.702 9.085 13.762 696 HG21 ILE 85 1HG2 ILE 85 -4.315 7.621 15.768 697 HG22 ILE 85 2HG2 ILE 85 -5.640 6.526 16.159 698 HG23 ILE 85 3HG2 ILE 85 -4.294 5.963 15.168 699 HD11 ILE 85 3HD1 ILE 85 -8.237 6.987 13.726 700 HD12 ILE 85 1HD1 ILE 85 -8.329 7.263 15.464 701 HD13 ILE 85 2HD1 ILE 85 -8.847 8.523 14.344 702 H ASP 86 H ASP 86 -4.937 5.643 11.869 703 HA ASP 86 HA ASP 86 -2.763 4.159 12.705 704 HB2 ASP 86 1HB ASP 86 -4.116 4.115 9.998 705 HB3 ASP 86 2HB ASP 86 -3.047 2.857 10.612 706 H TYR 87 H TYR 87 -2.977 6.367 9.936 707 HA TYR 87 HA TYR 87 -0.328 5.920 9.028 708 HB2 TYR 87 1HB TYR 87 -2.096 6.854 7.587 709 HB3 TYR 87 2HB TYR 87 -2.127 8.311 8.574 710 HD1 TYR 87 HD1 TYR 87 0.080 6.281 6.376 711 HD2 TYR 87 HD2 TYR 87 -0.679 10.092 8.109 712 HE1 TYR 87 HE1 TYR 87 1.838 7.266 4.965 713 HE2 TYR 87 HE2 TYR 87 1.076 11.087 6.701 714 HH TYR 87 HH TYR 87 2.813 10.636 5.329 715 H GLY 88 H GLY 88 -1.770 8.647 10.825 716 HA2 GLY 88 1HA GLY 88 0.530 10.134 11.235 717 HA3 GLY 88 2HA GLY 88 -0.843 10.110 12.333 718 H THR 89 H THR 89 -0.492 7.206 12.830 719 HA THR 89 HA THR 89 1.470 7.476 14.947 720 HB THR 89 HB THR 89 0.691 5.221 15.647 721 HG1 THR 89 HG1 THR 89 -0.954 4.232 14.512 722 HG21 THR 89 3HG2 THR 89 -0.612 6.616 16.837 723 HG22 THR 89 1HG2 THR 89 -1.885 6.129 15.719 724 HG23 THR 89 2HG2 THR 89 -0.984 7.618 15.434 725 H MET 90 H MET 90 1.222 6.030 11.819 726 HA MET 90 HA MET 90 2.707 4.895 10.526 727 HB2 MET 90 1HB MET 90 4.781 5.542 12.619 728 HB3 MET 90 2HB MET 90 5.050 5.185 10.919 729 HG2 MET 90 1HG MET 90 4.958 7.341 10.461 730 HG3 MET 90 2HG MET 90 3.293 7.388 11.037 731 HE1 MET 90 3HE MET 90 6.708 7.533 13.984 732 HE2 MET 90 1HE MET 90 6.633 6.650 12.459 733 HE3 MET 90 2HE MET 90 7.186 8.325 12.481 734 H ASN 91 H ASN 91 1.242 3.148 11.628 735 HA ASN 91 HA ASN 91 2.751 1.337 13.334 736 HB2 ASN 91 1HB ASN 91 -0.097 1.546 12.453 737 HB3 ASN 91 2HB ASN 91 0.507 -0.022 12.982 738 HD21 ASN 91 2HD2 ASN 91 -0.156 -0.372 14.969 739 HD22 ASN 91 1HD2 ASN 91 -0.119 0.763 16.270 740 H GLY 92 H GLY 92 4.357 0.503 12.023 741 HA2 GLY 92 1HA GLY 92 4.162 -0.347 9.400 742 HA3 GLY 92 2HA GLY 92 5.270 -1.033 10.579 743 H GLU 93 H GLU 93 3.585 -2.277 12.334 744 HA GLU 93 HA GLU 93 3.091 -4.722 11.136 745 HB2 GLU 93 1HB GLU 93 3.278 -4.302 13.591 746 HB3 GLU 93 2HB GLU 93 1.657 -3.622 13.557 747 HG2 GLU 93 1HG GLU 93 0.970 -5.891 12.544 748 HG3 GLU 93 2HG GLU 93 2.518 -6.457 13.168 749 H LYS 94 H LYS 94 0.748 -2.161 11.917 750 HA LYS 94 HA LYS 94 -1.514 -3.462 10.883 751 HB2 LYS 94 1HB LYS 94 -0.896 -0.531 11.252 752 HB3 LYS 94 2HB LYS 94 -2.470 -1.126 10.742 753 HG2 LYS 94 1HG LYS 94 -1.206 -2.143 13.254 754 HG3 LYS 94 2HG LYS 94 -2.063 -0.599 13.234 755 HD2 LYS 94 1HD LYS 94 -4.102 -1.612 12.668 756 HD3 LYS 94 2HD LYS 94 -3.317 -3.112 12.167 757 HE2 LYS 94 1HE LYS 94 -3.019 -2.207 14.990 758 HE3 LYS 94 2HE LYS 94 -4.552 -2.918 14.487 759 HZ1 LYS 94 3HZ LYS 94 -2.498 -4.349 15.363 760 HZ2 LYS 94 1HZ LYS 94 -2.157 -4.365 13.705 761 HZ3 LYS 94 2HZ LYS 94 -3.641 -4.950 14.270 762 H VAL 95 H VAL 95 0.903 -1.400 9.370 763 HA VAL 95 HA VAL 95 -0.407 -0.992 6.914 764 HB VAL 95 HB VAL 95 2.562 -1.100 7.468 765 HG11 VAL 95 1HG1 VAL 95 0.994 -0.565 5.044 766 HG12 VAL 95 2HG1 VAL 95 2.241 0.629 5.403 767 HG13 VAL 95 3HG1 VAL 95 2.674 -1.071 5.223 768 HG21 VAL 95 3HG2 VAL 95 0.632 0.704 8.387 769 HG22 VAL 95 1HG2 VAL 95 2.384 0.901 8.420 770 HG23 VAL 95 2HG2 VAL 95 1.453 1.524 7.059 771 H LEU 96 H LEU 96 2.397 -3.127 7.468 772 HA LEU 96 HA LEU 96 2.239 -4.555 5.114 773 HB2 LEU 96 1HB LEU 96 3.400 -6.390 6.392 774 HB3 LEU 96 2HB LEU 96 4.170 -4.805 6.429 775 HG LEU 96 HG LEU 96 2.587 -4.815 8.698 776 HD11 LEU 96 1HD1 LEU 96 2.797 -6.842 9.806 777 HD12 LEU 96 2HD1 LEU 96 4.042 -7.431 8.704 778 HD13 LEU 96 3HD1 LEU 96 2.366 -7.328 8.166 779 HD21 LEU 96 3HD2 LEU 96 5.503 -5.534 8.410 780 HD22 LEU 96 1HD2 LEU 96 4.717 -4.968 9.884 781 HD23 LEU 96 2HD2 LEU 96 4.840 -3.901 8.484 782 H GLN 97 H GLN 97 0.606 -5.184 8.188 783 HA GLN 97 HA GLN 97 -0.536 -7.655 7.518 784 HB2 GLN 97 1HB GLN 97 -1.269 -5.497 9.471 785 HB3 GLN 97 2HB GLN 97 -2.316 -6.893 9.252 786 HG2 GLN 97 1HG GLN 97 0.597 -7.230 9.841 787 HG3 GLN 97 2HG GLN 97 -0.569 -6.939 11.130 788 HE21 GLN 97 2HE2 GLN 97 0.478 -9.148 8.650 789 HE22 GLN 97 1HE2 GLN 97 -0.373 -10.530 9.242 790 H LEU 98 H LEU 98 -1.722 -4.349 7.078 791 HA LEU 98 HA LEU 98 -4.272 -5.026 6.095 792 HB2 LEU 98 1HB LEU 98 -3.393 -2.761 6.891 793 HB3 LEU 98 2HB LEU 98 -2.725 -2.587 5.269 794 HG LEU 98 HG LEU 98 -5.037 -2.814 4.365 795 HD11 LEU 98 1HD1 LEU 98 -5.681 -2.893 7.290 796 HD12 LEU 98 2HD1 LEU 98 -6.239 -3.958 6.001 797 HD13 LEU 98 3HD1 LEU 98 -6.848 -2.306 6.105 798 HD21 LEU 98 3HD2 LEU 98 -5.622 -0.566 4.760 799 HD22 LEU 98 1HD2 LEU 98 -3.864 -0.627 4.884 800 HD23 LEU 98 2HD2 LEU 98 -4.848 -0.560 6.346 801 H ALA 99 H ALA 99 -1.242 -4.257 4.400 802 HA ALA 99 HA ALA 99 -2.184 -4.478 1.786 803 HB1 ALA 99 3HB ALA 99 -0.037 -4.196 1.174 804 HB2 ALA 99 1HB ALA 99 0.200 -3.860 2.888 805 HB3 ALA 99 2HB ALA 99 0.548 -5.467 2.248 806 H ILE 100 H ILE 100 -0.479 -6.965 3.697 807 HA ILE 100 HA ILE 100 -0.718 -9.050 1.877 808 HB ILE 100 HB ILE 100 -0.711 -9.247 4.891 809 HG12 ILE 100 1HG1 ILE 100 1.644 -9.591 3.045 810 HG13 ILE 100 2HG1 ILE 100 1.206 -8.015 3.694 811 HG21 ILE 100 1HG2 ILE 100 -1.464 -11.311 3.847 812 HG22 ILE 100 2HG2 ILE 100 -0.050 -11.309 2.793 813 HG23 ILE 100 3HG2 ILE 100 0.147 -11.514 4.534 814 HD11 ILE 100 3HD1 ILE 100 2.921 -9.746 4.863 815 HD12 ILE 100 1HD1 ILE 100 2.029 -8.488 5.717 816 HD13 ILE 100 2HD1 ILE 100 1.416 -10.141 5.694 817 H ASN 101 H ASN 101 -2.870 -8.216 4.587 818 HA ASN 101 HA ASN 101 -4.718 -10.260 4.307 819 HB2 ASN 101 1HB ASN 101 -4.933 -7.438 5.316 820 HB3 ASN 101 2HB ASN 101 -6.363 -8.464 5.233 821 HD21 ASN 101 2HD2 ASN 101 -6.453 -8.230 7.533 822 HD22 ASN 101 1HD2 ASN 101 -5.459 -9.218 8.543 823 H ALA 102 H ALA 102 -4.714 -7.059 2.760 824 HA ALA 102 HA ALA 102 -7.108 -7.337 1.336 825 HB1 ALA 102 3HB ALA 102 -5.385 -5.770 -0.235 826 HB2 ALA 102 1HB ALA 102 -6.600 -5.220 0.918 827 HB3 ALA 102 2HB ALA 102 -4.936 -5.475 1.444 828 H PHE 103 H PHE 103 -3.776 -8.140 0.426 829 HA PHE 103 HA PHE 103 -4.241 -8.880 -2.221 830 HB2 PHE 103 1HB PHE 103 -1.995 -8.590 -1.169 831 HB3 PHE 103 2HB PHE 103 -2.228 -10.125 -0.340 832 HD1 PHE 103 HD2 PHE 103 -2.347 -8.713 -3.789 833 HD2 PHE 103 HD1 PHE 103 -1.344 -12.013 -1.295 834 HE1 PHE 103 HE2 PHE 103 -1.424 -9.899 -5.737 835 HE2 PHE 103 HE1 PHE 103 -0.419 -13.205 -3.239 836 HZ PHE 103 HZ PHE 103 -0.459 -12.149 -5.464 837 H ASN 104 H ASN 104 -4.071 -10.990 0.649 838 HA ASN 104 HA ASN 104 -4.797 -13.359 -0.650 839 HB2 ASN 104 1HB ASN 104 -4.853 -12.424 2.192 840 HB3 ASN 104 2HB ASN 104 -5.649 -13.940 1.778 841 HD21 ASN 104 2HD2 ASN 104 -2.748 -12.452 2.563 842 HD22 ASN 104 1HD2 ASN 104 -1.682 -13.764 2.207 843 H ASN 105 H ASN 105 -6.828 -11.134 1.258 844 HA ASN 105 HA ASN 105 -9.260 -12.412 0.928 845 HB2 ASN 105 1HB ASN 105 -8.676 -10.351 2.357 846 HB3 ASN 105 2HB ASN 105 -9.012 -9.410 0.907 847 HD21 ASN 105 2HD2 ASN 105 -10.646 -8.475 2.359 848 HD22 ASN 105 1HD2 ASN 105 -12.190 -9.245 2.455 849 H LYS 106 H LYS 106 -7.529 -10.302 -1.272 850 HA LYS 106 HA LYS 106 -9.442 -11.013 -3.376 851 HB2 LYS 106 1HB LYS 106 -8.566 -8.242 -2.607 852 HB3 LYS 106 2HB LYS 106 -9.090 -8.605 -4.246 853 HG2 LYS 106 1HG LYS 106 -11.117 -9.677 -2.792 854 HG3 LYS 106 2HG LYS 106 -10.653 -8.299 -1.790 855 HD2 LYS 106 1HD LYS 106 -11.060 -6.765 -3.536 856 HD3 LYS 106 2HD LYS 106 -11.127 -8.045 -4.750 857 HE2 LYS 106 1HE LYS 106 -13.115 -8.866 -3.171 858 HE3 LYS 106 2HE LYS 106 -13.183 -7.141 -2.815 859 HZ1 LYS 106 3HZ LYS 106 -13.648 -8.523 -5.372 860 HZ2 LYS 106 1HZ LYS 106 -13.136 -6.910 -5.370 861 HZ3 LYS 106 2HZ LYS 106 -14.585 -7.337 -4.611 862 H SER 107 H SER 107 -8.031 -12.394 -4.376 863 HA SER 107 HA SER 107 -5.479 -11.247 -5.297 864 HB2 SER 107 1HB SER 107 -4.889 -13.722 -5.689 865 HB3 SER 107 2HB SER 107 -4.954 -13.158 -4.019 866 HG SER 107 HG SER 107 -6.414 -14.619 -3.702 867 H SER 108 H SER 108 -8.004 -10.750 -6.576 868 HA SER 108 HA SER 108 -8.967 -10.725 -8.637 869 HB2 SER 108 1HB SER 108 -6.673 -9.976 -9.255 870 HB3 SER 108 2HB SER 108 -6.244 -11.656 -9.580 871 HG SER 108 HG SER 108 -7.158 -10.075 -11.324 872 H VAL 109 H VAL 109 -9.526 -12.991 -7.197 873 HA VAL 109 HA VAL 109 -9.025 -15.405 -8.600 874 HB VAL 109 HB VAL 109 -9.677 -15.371 -6.228 875 HG11 VAL 109 1HG1 VAL 109 -11.528 -14.396 -5.440 876 HG12 VAL 109 2HG1 VAL 109 -11.622 -13.604 -7.015 877 HG13 VAL 109 3HG1 VAL 109 -12.537 -15.081 -6.714 878 HG21 VAL 109 3HG2 VAL 109 -10.273 -17.248 -8.033 879 HG22 VAL 109 1HG2 VAL 109 -10.684 -17.403 -6.326 880 HG23 VAL 109 2HG2 VAL 109 -11.904 -16.868 -7.482 Start of MODEL 3 1 H1 GLY 1 H GLY 1 12.510 -16.119 -9.433 2 HA2 GLY 1 1HA GLY 1 14.099 -17.459 -7.339 3 HA3 GLY 1 2HA GLY 1 13.278 -15.940 -7.013 4 HA PRO 2 HA PRO 2 10.510 -19.550 -5.905 5 HB2 PRO 2 1HB PRO 2 10.111 -18.807 -3.325 6 HB3 PRO 2 2HB PRO 2 11.456 -19.836 -3.830 7 HG2 PRO 2 1HG PRO 2 11.426 -16.896 -3.268 8 HG3 PRO 2 2HG PRO 2 12.628 -18.113 -2.799 9 HD2 PRO 2 1HD PRO 2 12.988 -16.443 -4.900 10 HD3 PRO 2 2HD PRO 2 13.639 -18.095 -4.870 11 H GLY 3 H GLY 3 10.358 -16.109 -5.056 12 HA2 GLY 3 1HA GLY 3 8.403 -14.990 -6.220 13 HA3 GLY 3 2HA GLY 3 7.430 -16.222 -5.428 14 H SER 4 H SER 4 7.133 -13.384 -5.167 15 HA SER 4 HA SER 4 7.028 -13.215 -2.315 16 HB2 SER 4 1HB SER 4 8.668 -11.673 -1.840 17 HB3 SER 4 2HB SER 4 9.459 -12.535 -3.161 18 HG SER 4 HG SER 4 9.244 -10.069 -3.159 19 H MET 5 H MET 5 5.980 -11.224 -1.579 20 HA MET 5 HA MET 5 4.044 -10.315 -3.550 21 HB2 MET 5 1HB MET 5 3.814 -10.973 -0.904 22 HB3 MET 5 2HB MET 5 3.873 -9.217 -0.828 23 HG2 MET 5 1HG MET 5 2.001 -9.071 -2.371 24 HG3 MET 5 2HG MET 5 1.956 -10.829 -2.496 25 HE1 MET 5 3HE MET 5 1.934 -8.578 1.237 26 HE2 MET 5 1HE MET 5 1.948 -7.849 -0.370 27 HE3 MET 5 2HE MET 5 0.434 -7.981 0.525 28 H ASN 6 H ASN 6 3.734 -8.194 -4.165 29 HA ASN 6 HA ASN 6 5.848 -6.304 -3.361 30 HB2 ASN 6 1HB ASN 6 4.542 -6.678 -6.062 31 HB3 ASN 6 2HB ASN 6 5.561 -5.300 -5.654 32 HD21 ASN 6 2HD2 ASN 6 7.618 -5.477 -6.150 33 HD22 ASN 6 1HD2 ASN 6 8.486 -6.952 -6.388 34 H ILE 7 H ILE 7 4.934 -4.894 -2.009 35 HA ILE 7 HA ILE 7 2.194 -3.986 -2.508 36 HB ILE 7 HB ILE 7 3.929 -3.424 -0.103 37 HG12 ILE 7 1HG1 ILE 7 1.811 -5.184 0.542 38 HG13 ILE 7 2HG1 ILE 7 2.584 -5.837 -0.899 39 HG21 ILE 7 1HG2 ILE 7 1.079 -2.872 -0.809 40 HG22 ILE 7 2HG2 ILE 7 1.542 -3.101 0.877 41 HG23 ILE 7 3HG2 ILE 7 2.278 -1.809 -0.073 42 HD11 ILE 7 3HD1 ILE 7 3.674 -6.830 0.920 43 HD12 ILE 7 1HD1 ILE 7 4.776 -5.582 0.338 44 HD13 ILE 7 2HD1 ILE 7 3.805 -5.299 1.784 45 H LEU 8 H LEU 8 1.656 -1.817 -2.723 46 HA LEU 8 HA LEU 8 3.918 -0.012 -3.283 47 HB2 LEU 8 1HB LEU 8 2.760 -0.570 -5.318 48 HB3 LEU 8 2HB LEU 8 1.208 -0.163 -4.590 49 HG LEU 8 HG LEU 8 1.889 2.197 -4.491 50 HD11 LEU 8 1HD1 LEU 8 4.050 2.214 -6.305 51 HD12 LEU 8 2HD1 LEU 8 4.465 1.092 -5.010 52 HD13 LEU 8 3HD1 LEU 8 4.027 2.757 -4.627 53 HD21 LEU 8 3HD2 LEU 8 1.969 2.553 -7.002 54 HD22 LEU 8 1HD2 LEU 8 0.612 1.613 -6.382 55 HD23 LEU 8 2HD2 LEU 8 1.973 0.794 -7.150 56 H LEU 9 H LEU 9 3.709 2.174 -2.694 57 HA LEU 9 HA LEU 9 1.494 2.776 -0.850 58 HB2 LEU 9 1HB LEU 9 3.481 2.281 0.448 59 HB3 LEU 9 2HB LEU 9 4.412 3.444 -0.493 60 HG LEU 9 HG LEU 9 2.943 5.246 0.422 61 HD11 LEU 9 1HD1 LEU 9 0.997 4.489 1.250 62 HD12 LEU 9 2HD1 LEU 9 1.931 4.265 2.729 63 HD13 LEU 9 3HD1 LEU 9 1.659 2.902 1.643 64 HD21 LEU 9 3HD2 LEU 9 4.398 5.563 2.103 65 HD22 LEU 9 1HD2 LEU 9 5.166 4.102 1.480 66 HD23 LEU 9 2HD2 LEU 9 4.046 3.998 2.839 67 H VAL 10 H VAL 10 0.382 4.505 -1.453 68 HA VAL 10 HA VAL 10 1.733 6.544 -3.101 69 HB VAL 10 HB VAL 10 -1.194 5.792 -3.138 70 HG11 VAL 10 1HG1 VAL 10 -0.769 8.171 -3.597 71 HG12 VAL 10 2HG1 VAL 10 0.340 7.711 -4.890 72 HG13 VAL 10 3HG1 VAL 10 -1.375 7.318 -5.016 73 HG21 VAL 10 3HG2 VAL 10 0.421 4.130 -4.141 74 HG22 VAL 10 1HG2 VAL 10 -0.810 4.759 -5.237 75 HG23 VAL 10 2HG2 VAL 10 0.841 5.375 -5.317 76 H CYS 11 H CYS 11 1.958 8.454 -2.160 77 HA CYS 11 HA CYS 11 -0.084 9.356 -0.254 78 HB2 CYS 11 1HB CYS 11 2.876 9.744 0.202 79 HB3 CYS 11 2HB CYS 11 1.564 10.135 1.306 80 HG CYS 11 HG CYS 11 0.947 7.142 1.092 81 H GLY 12 H GLY 12 0.563 9.969 -3.092 82 HA2 GLY 12 1HA GLY 12 0.687 11.803 -4.466 83 HA3 GLY 12 2HA GLY 12 0.060 12.705 -3.093 84 H ALA 13 H ALA 13 2.898 11.800 -4.884 85 HA ALA 13 HA ALA 13 4.983 12.707 -5.005 86 HB1 ALA 13 3HB ALA 13 4.522 15.025 -3.302 87 HB2 ALA 13 1HB ALA 13 5.017 14.939 -4.993 88 HB3 ALA 13 2HB ALA 13 3.307 14.837 -4.566 89 H GLY 14 H GLY 14 6.852 13.541 -3.570 90 HA2 GLY 14 1HA GLY 14 6.748 13.072 -0.769 91 HA3 GLY 14 2HA GLY 14 7.398 11.667 -1.601 92 H MET 15 H MET 15 9.395 11.983 -0.514 93 HA MET 15 HA MET 15 11.265 13.513 -1.998 94 HB2 MET 15 1HB MET 15 10.099 15.233 -0.472 95 HB3 MET 15 2HB MET 15 10.970 14.457 0.844 96 HG2 MET 15 1HG MET 15 13.082 14.893 -0.471 97 HG3 MET 15 2HG MET 15 12.103 15.915 -1.521 98 HE1 MET 15 3HE MET 15 10.147 17.498 0.163 99 HE2 MET 15 1HE MET 15 11.107 18.886 0.676 100 HE3 MET 15 2HE MET 15 11.277 18.253 -0.962 101 H SER 16 H SER 16 11.084 10.836 -1.345 102 HA SER 16 HA SER 16 12.336 9.090 -0.594 103 HB2 SER 16 1HB SER 16 14.147 10.897 -1.392 104 HB3 SER 16 2HB SER 16 14.561 10.841 0.321 105 HG SER 16 HG SER 16 15.670 9.291 -1.074 106 H THR 17 H THR 17 13.561 8.256 1.403 107 HA THR 17 HA THR 17 13.427 7.723 3.614 108 HB THR 17 HB THR 17 13.110 10.643 4.243 109 HG1 THR 17 HG1 THR 17 15.288 10.938 3.817 110 HG21 THR 17 3HG2 THR 17 13.489 8.426 5.813 111 HG22 THR 17 1HG2 THR 17 13.879 10.081 6.278 112 HG23 THR 17 2HG2 THR 17 15.133 9.033 5.614 113 H SER 18 H SER 18 11.432 6.680 3.602 114 HA SER 18 HA SER 18 9.133 8.307 4.466 115 HB2 SER 18 1HB SER 18 9.322 5.821 2.792 116 HB3 SER 18 2HB SER 18 7.836 6.190 3.667 117 HG SER 18 HG SER 18 7.440 7.789 2.337 118 H MET 19 H MET 19 8.684 8.129 6.550 119 HA MET 19 HA MET 19 9.825 6.371 8.346 120 HB2 MET 19 1HB MET 19 7.093 7.643 8.591 121 HB3 MET 19 2HB MET 19 8.081 7.037 9.914 122 HG2 MET 19 1HG MET 19 9.316 8.891 10.000 123 HG3 MET 19 2HG MET 19 9.441 9.005 8.246 124 HE1 MET 19 3HE MET 19 8.758 11.955 7.981 125 HE2 MET 19 1HE MET 19 8.240 12.436 9.596 126 HE3 MET 19 2HE MET 19 9.624 11.361 9.398 127 H LEU 20 H LEU 20 6.610 6.128 6.833 128 HA LEU 20 HA LEU 20 5.743 3.784 8.003 129 HB2 LEU 20 1HB LEU 20 5.210 5.160 5.435 130 HB3 LEU 20 2HB LEU 20 4.686 3.482 5.568 131 HG LEU 20 HG LEU 20 2.870 5.019 6.080 132 HD11 LEU 20 1HD1 LEU 20 3.656 2.836 7.574 133 HD12 LEU 20 2HD1 LEU 20 2.070 3.605 7.602 134 HD13 LEU 20 3HD1 LEU 20 3.292 4.063 8.787 135 HD21 LEU 20 3HD2 LEU 20 2.939 6.494 7.985 136 HD22 LEU 20 1HD2 LEU 20 4.279 6.876 6.904 137 HD23 LEU 20 2HD2 LEU 20 4.573 5.962 8.383 138 H VAL 21 H VAL 21 7.437 4.070 4.875 139 HA VAL 21 HA VAL 21 7.714 1.384 4.300 140 HB VAL 21 HB VAL 21 9.742 3.549 3.723 141 HG11 VAL 21 1HG1 VAL 21 9.589 1.606 1.670 142 HG12 VAL 21 2HG1 VAL 21 10.949 1.970 2.734 143 HG13 VAL 21 3HG1 VAL 21 9.764 0.750 3.202 144 HG21 VAL 21 3HG2 VAL 21 7.613 4.243 2.888 145 HG22 VAL 21 1HG2 VAL 21 8.563 3.663 1.520 146 HG23 VAL 21 2HG2 VAL 21 7.298 2.646 2.208 147 H GLN 22 H GLN 22 9.861 3.447 6.231 148 HA GLN 22 HA GLN 22 11.889 1.607 6.718 149 HB2 GLN 22 1HB GLN 22 10.911 4.075 8.011 150 HB3 GLN 22 2HB GLN 22 11.855 3.007 9.041 151 HG2 GLN 22 1HG GLN 22 13.689 3.064 7.442 152 HG3 GLN 22 2HG GLN 22 12.743 4.113 6.387 153 HE21 GLN 22 2HE2 GLN 22 13.446 4.043 9.866 154 HE22 GLN 22 1HE2 GLN 22 13.988 5.680 9.963 155 H ARG 23 H ARG 23 9.040 2.315 8.741 156 HA ARG 23 HA ARG 23 9.491 0.423 10.721 157 HB2 ARG 23 1HB ARG 23 6.833 1.359 9.621 158 HB3 ARG 23 2HB ARG 23 7.069 0.543 11.161 159 HG2 ARG 23 1HG ARG 23 8.745 2.901 10.871 160 HG3 ARG 23 2HG ARG 23 7.021 3.258 10.753 161 HD2 ARG 23 1HD ARG 23 7.815 3.416 13.061 162 HD3 ARG 23 2HD ARG 23 6.629 2.125 12.873 163 HE ARG 23 HE ARG 23 9.126 0.968 12.559 164 HH11 ARG 23 1HH1 ARG 23 7.357 2.650 15.043 165 HH12 ARG 23 2HH1 ARG 23 8.152 1.830 16.345 166 HH21 ARG 23 1HH2 ARG 23 10.179 -0.118 14.267 167 HH22 ARG 23 2HH2 ARG 23 9.758 0.257 15.902 168 H ILE 24 H ILE 24 7.422 0.074 7.835 169 HA ILE 24 HA ILE 24 6.710 -2.582 8.180 170 HB ILE 24 HB ILE 24 7.201 -1.157 5.563 171 HG12 ILE 24 1HG1 ILE 24 4.444 -1.558 6.472 172 HG13 ILE 24 2HG1 ILE 24 5.384 -0.515 7.533 173 HG21 ILE 24 1HG2 ILE 24 5.309 -2.881 4.930 174 HG22 ILE 24 2HG2 ILE 24 7.013 -3.329 4.877 175 HG23 ILE 24 3HG2 ILE 24 6.022 -3.797 6.258 176 HD11 ILE 24 3HD1 ILE 24 4.629 1.065 6.118 177 HD12 ILE 24 1HD1 ILE 24 6.037 0.566 5.181 178 HD13 ILE 24 2HD1 ILE 24 4.440 -0.066 4.778 179 H GLU 25 H GLU 25 9.548 -1.231 6.537 180 HA GLU 25 HA GLU 25 10.602 -3.644 5.575 181 HB2 GLU 25 1HB GLU 25 11.722 -0.941 6.161 182 HB3 GLU 25 2HB GLU 25 12.843 -2.263 5.867 183 HG2 GLU 25 1HG GLU 25 11.283 -2.641 3.768 184 HG3 GLU 25 2HG GLU 25 10.952 -0.927 4.016 185 H LYS 26 H LYS 26 10.983 -2.004 8.674 186 HA LYS 26 HA LYS 26 13.004 -3.682 9.710 187 HB2 LYS 26 1HB LYS 26 11.456 -1.467 10.611 188 HB3 LYS 26 2HB LYS 26 11.342 -2.734 11.826 189 HG2 LYS 26 1HG LYS 26 13.185 -1.188 12.267 190 HG3 LYS 26 2HG LYS 26 13.755 -2.836 11.993 191 HD2 LYS 26 1HD LYS 26 14.525 -2.310 9.820 192 HD3 LYS 26 2HD LYS 26 13.658 -0.773 9.804 193 HE2 LYS 26 1HE LYS 26 15.663 -1.186 11.949 194 HE3 LYS 26 2HE LYS 26 16.270 -0.951 10.310 195 HZ1 LYS 26 3HZ LYS 26 15.880 1.085 11.825 196 HZ2 LYS 26 1HZ LYS 26 14.254 0.893 11.403 197 HZ3 LYS 26 2HZ LYS 26 15.412 1.167 10.201 198 H TYR 27 H TYR 27 9.510 -3.630 10.438 199 HA TYR 27 HA TYR 27 9.398 -5.910 11.995 200 HB2 TYR 27 1HB TYR 27 7.490 -4.447 11.816 201 HB3 TYR 27 2HB TYR 27 7.334 -4.782 10.095 202 HD1 TYR 27 HD1 TYR 27 6.480 -6.962 9.327 203 HD2 TYR 27 HD2 TYR 27 6.627 -5.966 13.461 204 HE1 TYR 27 HE1 TYR 27 4.935 -8.810 9.821 205 HE2 TYR 27 HE2 TYR 27 5.083 -7.812 13.967 206 HH TYR 27 HH TYR 27 4.412 -10.278 11.862 207 H ALA 28 H ALA 28 9.080 -5.635 8.470 208 HA ALA 28 HA ALA 28 8.619 -8.378 7.984 209 HB1 ALA 28 3HB ALA 28 10.005 -6.804 5.902 210 HB2 ALA 28 1HB ALA 28 8.566 -7.819 5.793 211 HB3 ALA 28 2HB ALA 28 8.448 -6.189 6.457 212 H LYS 29 H LYS 29 11.587 -6.423 7.765 213 HA LYS 29 HA LYS 29 13.321 -8.470 6.994 214 HB2 LYS 29 1HB LYS 29 13.701 -5.863 8.427 215 HB3 LYS 29 2HB LYS 29 15.058 -6.966 8.238 216 HG2 LYS 29 1HG LYS 29 14.924 -6.844 5.863 217 HG3 LYS 29 2HG LYS 29 13.401 -5.956 5.940 218 HD2 LYS 29 1HD LYS 29 14.480 -4.016 6.104 219 HD3 LYS 29 2HD LYS 29 15.420 -4.604 7.476 220 HE2 LYS 29 1HE LYS 29 16.717 -5.886 5.548 221 HE3 LYS 29 2HE LYS 29 16.097 -4.548 4.584 222 HZ1 LYS 29 3HZ LYS 29 18.108 -3.748 5.330 223 HZ2 LYS 29 1HZ LYS 29 17.973 -4.479 6.851 224 HZ3 LYS 29 2HZ LYS 29 17.046 -3.113 6.484 225 H SER 30 H SER 30 11.960 -7.691 10.093 226 HA SER 30 HA SER 30 13.818 -9.366 11.554 227 HB2 SER 30 1HB SER 30 11.980 -7.287 12.214 228 HB3 SER 30 2HB SER 30 11.527 -8.725 13.129 229 HG SER 30 HG SER 30 13.357 -8.634 14.214 230 H LYS 31 H LYS 31 10.435 -9.467 10.527 231 HA LYS 31 HA LYS 31 9.881 -11.981 11.759 232 HB2 LYS 31 1HB LYS 31 8.454 -10.029 10.123 233 HB3 LYS 31 2HB LYS 31 8.031 -11.689 9.718 234 HG2 LYS 31 1HG LYS 31 7.959 -10.564 12.509 235 HG3 LYS 31 2HG LYS 31 6.565 -10.639 11.427 236 HD2 LYS 31 1HD LYS 31 7.943 -13.188 11.622 237 HD3 LYS 31 2HD LYS 31 7.390 -12.608 13.195 238 HE2 LYS 31 1HE LYS 31 5.224 -12.908 12.679 239 HE3 LYS 31 2HE LYS 31 5.432 -12.309 11.034 240 HZ1 LYS 31 3HZ LYS 31 5.192 -14.959 11.889 241 HZ2 LYS 31 1HZ LYS 31 6.748 -14.770 11.251 242 HZ3 LYS 31 2HZ LYS 31 5.395 -14.385 10.311 243 H ASN 32 H ASN 32 11.521 -11.061 8.929 244 HA ASN 32 HA ASN 32 12.496 -12.243 7.248 245 HB2 ASN 32 1HB ASN 32 12.886 -13.800 9.340 246 HB3 ASN 32 2HB ASN 32 11.737 -14.846 8.510 247 HD21 ASN 32 2HD2 ASN 32 14.072 -15.933 8.856 248 HD22 ASN 32 1HD2 ASN 32 15.026 -15.934 7.415 249 H ILE 33 H ILE 33 10.296 -11.359 6.347 250 HA ILE 33 HA ILE 33 8.768 -13.635 5.263 251 HB ILE 33 HB ILE 33 7.871 -10.769 5.593 252 HG12 ILE 33 1HG1 ILE 33 6.729 -13.189 6.972 253 HG13 ILE 33 2HG1 ILE 33 8.081 -12.298 7.659 254 HG21 ILE 33 1HG2 ILE 33 5.682 -11.581 4.861 255 HG22 ILE 33 2HG2 ILE 33 6.906 -11.808 3.613 256 HG23 ILE 33 3HG2 ILE 33 6.369 -13.180 4.582 257 HD11 ILE 33 3HD1 ILE 33 5.266 -11.390 7.215 258 HD12 ILE 33 1HD1 ILE 33 6.206 -11.413 8.708 259 HD13 ILE 33 2HD1 ILE 33 6.582 -10.239 7.446 260 H ASN 34 H ASN 34 8.432 -13.785 3.077 261 HA ASN 34 HA ASN 34 10.282 -12.338 1.404 262 HB2 ASN 34 1HB ASN 34 8.201 -14.398 0.639 263 HB3 ASN 34 2HB ASN 34 9.522 -13.828 -0.377 264 HD21 ASN 34 2HD2 ASN 34 8.602 -16.395 1.234 265 HD22 ASN 34 1HD2 ASN 34 10.114 -17.004 1.807 266 H ALA 35 H ALA 35 9.394 -10.209 1.635 267 HA ALA 35 HA ALA 35 7.362 -9.663 -0.363 268 HB1 ALA 35 3HB ALA 35 6.987 -8.901 2.528 269 HB2 ALA 35 1HB ALA 35 6.055 -8.221 1.194 270 HB3 ALA 35 2HB ALA 35 5.956 -9.946 1.553 271 H THR 36 H THR 36 7.112 -7.276 -0.710 272 HA THR 36 HA THR 36 9.335 -5.643 0.212 273 HB THR 36 HB THR 36 10.252 -6.750 -1.782 274 HG1 THR 36 HG1 THR 36 10.660 -4.721 -2.964 275 HG21 THR 36 3HG2 THR 36 7.899 -5.488 -3.190 276 HG22 THR 36 1HG2 THR 36 8.222 -7.211 -3.010 277 HG23 THR 36 2HG2 THR 36 9.284 -6.215 -4.005 278 H ILE 37 H ILE 37 8.881 -3.486 0.237 279 HA ILE 37 HA ILE 37 6.375 -2.607 -1.025 280 HB ILE 37 HB ILE 37 6.024 -3.011 1.408 281 HG12 ILE 37 1HG1 ILE 37 5.874 -0.055 0.888 282 HG13 ILE 37 2HG1 ILE 37 4.891 -1.180 -0.045 283 HG21 ILE 37 1HG2 ILE 37 8.488 -2.074 1.799 284 HG22 ILE 37 2HG2 ILE 37 7.584 -0.589 2.090 285 HG23 ILE 37 3HG2 ILE 37 7.246 -2.029 3.050 286 HD11 ILE 37 3HD1 ILE 37 3.384 -0.982 1.567 287 HD12 ILE 37 1HD1 ILE 37 4.465 -1.950 2.569 288 HD13 ILE 37 2HD1 ILE 37 4.530 -0.189 2.648 289 H GLU 38 H GLU 38 6.276 -0.407 -1.606 290 HA GLU 38 HA GLU 38 8.602 1.272 -1.206 291 HB2 GLU 38 1HB GLU 38 8.994 -0.237 -3.258 292 HB3 GLU 38 2HB GLU 38 7.756 0.736 -4.042 293 HG2 GLU 38 1HG GLU 38 9.201 2.355 -4.469 294 HG3 GLU 38 2HG GLU 38 9.712 2.423 -2.784 295 H ALA 39 H ALA 39 8.209 3.461 -1.594 296 HA ALA 39 HA ALA 39 5.390 4.132 -2.137 297 HB1 ALA 39 3HB ALA 39 5.305 5.447 -0.329 298 HB2 ALA 39 1HB ALA 39 6.740 4.571 0.202 299 HB3 ALA 39 2HB ALA 39 6.907 6.120 -0.627 300 H ILE 40 H ILE 40 4.951 5.671 -3.626 301 HA ILE 40 HA ILE 40 7.111 7.354 -4.638 302 HB ILE 40 HB ILE 40 6.444 6.844 -6.997 303 HG12 ILE 40 1HG1 ILE 40 5.468 4.193 -6.552 304 HG13 ILE 40 2HG1 ILE 40 4.442 5.321 -5.673 305 HG21 ILE 40 1HG2 ILE 40 7.440 4.329 -5.730 306 HG22 ILE 40 2HG2 ILE 40 7.978 5.129 -7.205 307 HG23 ILE 40 3HG2 ILE 40 8.396 5.807 -5.632 308 HD11 ILE 40 3HD1 ILE 40 3.364 5.404 -7.642 309 HD12 ILE 40 1HD1 ILE 40 4.604 6.598 -8.021 310 HD13 ILE 40 2HD1 ILE 40 4.787 4.931 -8.568 311 H ALA 41 H ALA 41 6.035 8.711 -6.590 312 HA ALA 41 HA ALA 41 3.912 10.193 -5.322 313 HB1 ALA 41 3HB ALA 41 5.368 10.611 -7.927 314 HB2 ALA 41 1HB ALA 41 4.156 11.712 -7.273 315 HB3 ALA 41 2HB ALA 41 5.661 11.435 -6.396 316 H GLU 42 H GLU 42 2.280 11.113 -7.185 317 HA GLU 42 HA GLU 42 0.743 8.756 -7.935 318 HB2 GLU 42 1HB GLU 42 -1.106 10.276 -8.277 319 HB3 GLU 42 2HB GLU 42 -0.349 10.624 -6.728 320 HG2 GLU 42 1HG GLU 42 -0.233 12.743 -7.344 321 HG3 GLU 42 2HG GLU 42 0.959 12.270 -8.554 322 H THR 43 H THR 43 3.118 10.439 -9.355 323 HA THR 43 HA THR 43 1.971 10.765 -11.989 324 HB THR 43 HB THR 43 4.139 11.544 -12.687 325 HG1 THR 43 HG1 THR 43 5.907 11.454 -11.161 326 HG21 THR 43 3HG2 THR 43 2.618 12.863 -10.956 327 HG22 THR 43 1HG2 THR 43 4.171 13.498 -11.498 328 HG23 THR 43 2HG2 THR 43 4.048 12.680 -9.940 329 H ARG 44 H ARG 44 4.403 8.655 -10.477 330 HA ARG 44 HA ARG 44 4.373 6.948 -12.856 331 HB2 ARG 44 1HB ARG 44 6.180 6.938 -10.432 332 HB3 ARG 44 2HB ARG 44 6.318 5.829 -11.789 333 HG2 ARG 44 1HG ARG 44 7.242 7.383 -13.146 334 HG3 ARG 44 2HG ARG 44 6.331 8.713 -12.426 335 HD2 ARG 44 1HD ARG 44 7.884 8.046 -10.341 336 HD3 ARG 44 2HD ARG 44 8.944 7.559 -11.664 337 HE ARG 44 HE ARG 44 8.265 10.236 -10.886 338 HH11 ARG 44 1HH1 ARG 44 9.278 8.209 -13.529 339 HH12 ARG 44 2HH1 ARG 44 10.016 9.504 -14.411 340 HH21 ARG 44 1HH2 ARG 44 9.234 11.950 -12.037 341 HH22 ARG 44 2HH2 ARG 44 9.992 11.632 -13.561 342 H LEU 45 H LEU 45 2.299 7.172 -10.598 343 HA LEU 45 HA LEU 45 2.340 4.694 -9.208 344 HB2 LEU 45 1HB LEU 45 1.084 6.398 -8.213 345 HB3 LEU 45 2HB LEU 45 0.243 6.776 -9.715 346 HG LEU 45 HG LEU 45 -0.984 4.636 -9.520 347 HD11 LEU 45 1HD1 LEU 45 -0.873 3.798 -6.998 348 HD12 LEU 45 2HD1 LEU 45 0.789 4.363 -7.163 349 HD13 LEU 45 3HD1 LEU 45 0.163 3.136 -8.263 350 HD21 LEU 45 3HD2 LEU 45 -1.735 5.683 -6.965 351 HD22 LEU 45 1HD2 LEU 45 -2.561 5.831 -8.516 352 HD23 LEU 45 2HD2 LEU 45 -1.335 7.012 -8.055 353 H SER 46 H SER 46 0.914 5.783 -12.232 354 HA SER 46 HA SER 46 -0.587 3.373 -12.656 355 HB2 SER 46 1HB SER 46 0.155 5.301 -14.841 356 HB3 SER 46 2HB SER 46 -1.316 4.343 -14.660 357 HG SER 46 HG SER 46 -1.340 6.720 -14.130 358 H GLU 47 H GLU 47 2.639 4.416 -13.254 359 HA GLU 47 HA GLU 47 3.155 2.402 -15.276 360 HB2 GLU 47 1HB GLU 47 4.587 4.713 -14.149 361 HB3 GLU 47 2HB GLU 47 5.614 3.344 -14.553 362 HG2 GLU 47 1HG GLU 47 4.224 3.437 -16.802 363 HG3 GLU 47 2HG GLU 47 4.036 5.122 -16.320 364 H VAL 48 H VAL 48 3.436 2.782 -11.850 365 HA VAL 48 HA VAL 48 5.189 0.465 -11.585 366 HB VAL 48 HB VAL 48 5.195 0.947 -9.194 367 HG11 VAL 48 1HG1 VAL 48 5.802 3.122 -11.142 368 HG12 VAL 48 2HG1 VAL 48 6.003 3.428 -9.416 369 HG13 VAL 48 3HG1 VAL 48 6.900 2.122 -10.192 370 HG21 VAL 48 3HG2 VAL 48 2.996 1.703 -8.767 371 HG22 VAL 48 1HG2 VAL 48 4.053 3.075 -8.430 372 HG23 VAL 48 2HG2 VAL 48 3.140 3.014 -9.938 373 H VAL 49 H VAL 49 1.854 1.409 -11.093 374 HA VAL 49 HA VAL 49 1.004 -0.772 -9.539 375 HB VAL 49 HB VAL 49 -0.326 1.303 -9.943 376 HG11 VAL 49 1HG1 VAL 49 0.130 1.159 -12.478 377 HG12 VAL 49 2HG1 VAL 49 -1.252 0.064 -12.509 378 HG13 VAL 49 3HG1 VAL 49 -1.450 1.720 -11.935 379 HG21 VAL 49 3HG2 VAL 49 -1.654 -1.347 -10.502 380 HG22 VAL 49 1HG2 VAL 49 -1.399 -0.589 -8.929 381 HG23 VAL 49 2HG2 VAL 49 -2.519 0.132 -10.085 382 H ASP 50 H ASP 50 1.726 -0.484 -12.913 383 HA ASP 50 HA ASP 50 0.234 -2.680 -13.877 384 HB2 ASP 50 1HB ASP 50 1.748 -0.741 -15.043 385 HB3 ASP 50 2HB ASP 50 2.812 -2.135 -15.204 386 H ARG 51 H ARG 51 3.227 -2.446 -12.150 387 HA ARG 51 HA ARG 51 3.781 -5.291 -12.628 388 HB2 ARG 51 1HB ARG 51 5.548 -3.138 -11.451 389 HB3 ARG 51 2HB ARG 51 6.016 -4.815 -11.689 390 HG2 ARG 51 1HG ARG 51 5.014 -3.688 -14.138 391 HG3 ARG 51 2HG ARG 51 6.319 -2.700 -13.476 392 HD2 ARG 51 1HD ARG 51 6.650 -5.660 -13.558 393 HD3 ARG 51 2HD ARG 51 6.819 -4.746 -15.056 394 HE ARG 51 HE ARG 51 8.693 -4.880 -12.925 395 HH11 ARG 51 1HH1 ARG 51 7.400 -2.745 -15.351 396 HH12 ARG 51 2HH1 ARG 51 8.832 -1.775 -15.449 397 HH21 ARG 51 1HH2 ARG 51 10.586 -3.612 -13.045 398 HH22 ARG 51 2HH2 ARG 51 10.644 -2.270 -14.138 399 H PHE 52 H PHE 52 3.476 -2.891 -10.035 400 HA PHE 52 HA PHE 52 3.883 -4.533 -7.843 401 HB2 PHE 52 1HB PHE 52 2.358 -2.015 -8.309 402 HB3 PHE 52 2HB PHE 52 2.077 -2.877 -6.799 403 HD1 PHE 52 HD2 PHE 52 4.376 -3.689 -5.649 404 HD2 PHE 52 HD1 PHE 52 3.927 -0.356 -8.259 405 HE1 PHE 52 HE2 PHE 52 6.400 -2.669 -4.691 406 HE2 PHE 52 HE1 PHE 52 5.951 0.668 -7.306 407 HZ PHE 52 HZ PHE 52 7.190 -0.488 -5.518 408 H ASP 53 H ASP 53 2.112 -5.135 -6.226 409 HA ASP 53 HA ASP 53 -0.011 -6.563 -7.684 410 HB2 ASP 53 1HB ASP 53 1.428 -7.223 -5.113 411 HB3 ASP 53 2HB ASP 53 -0.038 -8.053 -5.627 412 H VAL 54 H VAL 54 0.622 -5.099 -4.492 413 HA VAL 54 HA VAL 54 -2.241 -4.428 -4.328 414 HB VAL 54 HB VAL 54 -0.269 -4.517 -2.045 415 HG11 VAL 54 1HG1 VAL 54 -2.512 -4.765 -0.786 416 HG12 VAL 54 2HG1 VAL 54 -2.037 -3.168 -1.368 417 HG13 VAL 54 3HG1 VAL 54 -3.229 -4.115 -2.260 418 HG21 VAL 54 3HG2 VAL 54 -1.427 -6.653 -1.445 419 HG22 VAL 54 1HG2 VAL 54 -2.179 -6.623 -3.041 420 HG23 VAL 54 2HG2 VAL 54 -0.425 -6.743 -2.894 421 H VAL 55 H VAL 55 -2.890 -2.352 -3.812 422 HA VAL 55 HA VAL 55 -0.778 -0.296 -3.877 423 HB VAL 55 HB VAL 55 -3.552 -0.112 -5.060 424 HG11 VAL 55 1HG1 VAL 55 -2.782 2.073 -5.922 425 HG12 VAL 55 2HG1 VAL 55 -2.870 2.024 -4.160 426 HG13 VAL 55 3HG1 VAL 55 -1.308 1.902 -4.971 427 HG21 VAL 55 3HG2 VAL 55 -0.835 -0.270 -6.361 428 HG22 VAL 55 1HG2 VAL 55 -2.106 -1.491 -6.420 429 HG23 VAL 55 2HG2 VAL 55 -2.343 0.068 -7.210 430 H LEU 56 H LEU 56 -0.986 1.465 -2.522 431 HA LEU 56 HA LEU 56 -3.252 1.437 -0.647 432 HB2 LEU 56 1HB LEU 56 -0.326 1.449 -0.070 433 HB3 LEU 56 2HB LEU 56 -1.420 2.302 1.019 434 HG LEU 56 HG LEU 56 -2.445 -0.321 0.574 435 HD11 LEU 56 1HD1 LEU 56 0.485 -0.146 0.823 436 HD12 LEU 56 2HD1 LEU 56 -0.529 -1.434 0.172 437 HD13 LEU 56 3HD1 LEU 56 -0.316 -1.276 1.915 438 HD21 LEU 56 3HD2 LEU 56 -3.075 0.499 2.582 439 HD22 LEU 56 1HD2 LEU 56 -1.583 1.412 2.801 440 HD23 LEU 56 2HD2 LEU 56 -1.613 -0.321 3.128 441 H LEU 57 H LEU 57 -3.984 3.423 0.047 442 HA LEU 57 HA LEU 57 -2.708 5.776 -1.185 443 HB2 LEU 57 1HB LEU 57 -4.723 5.395 -2.368 444 HB3 LEU 57 2HB LEU 57 -5.620 5.097 -0.880 445 HG LEU 57 HG LEU 57 -5.240 7.526 -0.306 446 HD11 LEU 57 1HD1 LEU 57 -4.905 8.316 -3.071 447 HD12 LEU 57 2HD1 LEU 57 -3.508 7.427 -2.464 448 HD13 LEU 57 3HD1 LEU 57 -4.064 8.875 -1.624 449 HD21 LEU 57 3HD2 LEU 57 -6.911 6.566 -2.591 450 HD22 LEU 57 1HD2 LEU 57 -6.916 8.273 -2.147 451 HD23 LEU 57 2HD2 LEU 57 -7.402 7.055 -0.969 452 H ALA 58 H ALA 58 -2.019 7.239 0.221 453 HA ALA 58 HA ALA 58 -2.697 7.020 3.015 454 HB1 ALA 58 3HB ALA 58 -0.672 8.418 1.413 455 HB2 ALA 58 1HB ALA 58 -1.201 9.273 2.862 456 HB3 ALA 58 2HB ALA 58 -0.539 7.643 2.992 457 HA PRO 59 HA PRO 59 -5.800 10.105 3.338 458 HB2 PRO 59 1HB PRO 59 -5.143 11.352 5.658 459 HB3 PRO 59 2HB PRO 59 -5.814 9.718 5.603 460 HG2 PRO 59 1HG PRO 59 -2.965 10.588 5.902 461 HG3 PRO 59 2HG PRO 59 -3.840 9.308 6.762 462 HD2 PRO 59 1HD PRO 59 -2.163 8.792 4.700 463 HD3 PRO 59 2HD PRO 59 -3.602 7.806 5.030 464 H GLN 60 H GLN 60 -4.845 11.215 1.410 465 HA GLN 60 HA GLN 60 -4.559 13.979 1.912 466 HB2 GLN 60 1HB GLN 60 -2.101 12.401 1.737 467 HB3 GLN 60 2HB GLN 60 -2.152 13.737 0.595 468 HG2 GLN 60 1HG GLN 60 -3.031 14.570 3.212 469 HG3 GLN 60 2HG GLN 60 -1.428 13.837 3.275 470 HE21 GLN 60 2HE2 GLN 60 -3.299 16.150 1.343 471 HE22 GLN 60 1HE2 GLN 60 -1.997 17.257 1.093 472 H SER 61 H SER 61 -6.301 13.828 0.402 473 HA SER 61 HA SER 61 -5.606 14.434 -2.236 474 HB2 SER 61 1HB SER 61 -6.879 12.256 -3.138 475 HB3 SER 61 2HB SER 61 -5.130 12.301 -2.919 476 HG SER 61 HG SER 61 -5.291 11.040 -1.200 477 H ARG 62 H ARG 62 -7.196 15.693 -2.930 478 HA ARG 62 HA ARG 62 -9.767 15.630 -1.597 479 HB2 ARG 62 1HB ARG 62 -8.460 17.493 -3.561 480 HB3 ARG 62 2HB ARG 62 -10.177 17.619 -3.202 481 HG2 ARG 62 1HG ARG 62 -8.223 17.581 -0.954 482 HG3 ARG 62 2HG ARG 62 -8.436 19.057 -1.898 483 HD2 ARG 62 1HD ARG 62 -10.429 19.486 -0.978 484 HD3 ARG 62 2HD ARG 62 -10.955 17.809 -1.126 485 HE ARG 62 HE ARG 62 -9.160 17.789 0.932 486 HH11 ARG 62 1HH1 ARG 62 -12.093 19.529 0.233 487 HH12 ARG 62 2HH1 ARG 62 -12.541 19.704 1.897 488 HH21 ARG 62 1HH2 ARG 62 -9.739 18.012 3.127 489 HH22 ARG 62 2HH2 ARG 62 -11.201 18.842 3.543 490 H PHE 63 H PHE 63 -8.506 15.212 -4.884 491 HA PHE 63 HA PHE 63 -11.099 14.034 -5.642 492 HB2 PHE 63 1HB PHE 63 -9.124 15.665 -7.214 493 HB3 PHE 63 2HB PHE 63 -10.246 14.581 -8.032 494 HD1 PHE 63 HD1 PHE 63 -12.767 14.847 -7.155 495 HD2 PHE 63 HD2 PHE 63 -9.756 17.852 -7.012 496 HE1 PHE 63 HE1 PHE 63 -14.508 16.583 -7.068 497 HE2 PHE 63 HE2 PHE 63 -11.492 19.593 -6.923 498 HZ PHE 63 HZ PHE 63 -13.872 18.959 -6.951 499 H ASN 64 H ASN 64 -7.670 13.610 -5.473 500 HA ASN 64 HA ASN 64 -7.203 11.562 -7.262 501 HB2 ASN 64 1HB ASN 64 -5.858 12.710 -5.028 502 HB3 ASN 64 2HB ASN 64 -5.782 10.958 -4.862 503 HD21 ASN 64 2HD2 ASN 64 -4.865 13.702 -6.772 504 HD22 ASN 64 1HD2 ASN 64 -3.704 12.886 -7.758 505 H LYS 65 H LYS 65 -8.453 11.344 -3.952 506 HA LYS 65 HA LYS 65 -8.568 8.547 -3.785 507 HB2 LYS 65 1HB LYS 65 -10.255 8.941 -1.993 508 HB3 LYS 65 2HB LYS 65 -8.784 9.885 -1.798 509 HG2 LYS 65 1HG LYS 65 -9.961 11.822 -2.812 510 HG3 LYS 65 2HG LYS 65 -11.442 10.861 -2.820 511 HD2 LYS 65 1HD LYS 65 -11.103 10.559 -0.331 512 HD3 LYS 65 2HD LYS 65 -9.847 11.795 -0.442 513 HE2 LYS 65 1HE LYS 65 -11.451 13.403 -1.266 514 HE3 LYS 65 2HE LYS 65 -12.712 12.171 -1.309 515 HZ1 LYS 65 3HZ LYS 65 -12.897 12.155 0.967 516 HZ2 LYS 65 1HZ LYS 65 -12.564 13.789 0.686 517 HZ3 LYS 65 2HZ LYS 65 -11.338 12.757 1.225 518 H LYS 66 H LYS 66 -10.963 10.913 -4.892 519 HA LYS 66 HA LYS 66 -13.090 9.144 -5.312 520 HB2 LYS 66 1HB LYS 66 -12.773 11.826 -5.542 521 HB3 LYS 66 2HB LYS 66 -12.808 11.366 -7.240 522 HG2 LYS 66 1HG LYS 66 -14.911 10.139 -5.615 523 HG3 LYS 66 2HG LYS 66 -14.994 11.898 -5.721 524 HD2 LYS 66 1HD LYS 66 -14.985 11.783 -8.141 525 HD3 LYS 66 2HD LYS 66 -14.786 10.030 -8.083 526 HE2 LYS 66 1HE LYS 66 -16.979 9.725 -7.862 527 HE3 LYS 66 2HE LYS 66 -17.053 10.851 -6.508 528 HZ1 LYS 66 3HZ LYS 66 -16.830 11.959 -9.208 529 HZ2 LYS 66 1HZ LYS 66 -17.633 12.575 -7.852 530 HZ3 LYS 66 2HZ LYS 66 -18.322 11.312 -8.742 531 H ARG 67 H ARG 67 -10.562 10.252 -7.550 532 HA ARG 67 HA ARG 67 -11.472 8.744 -9.764 533 HB2 ARG 67 1HB ARG 67 -9.018 10.260 -9.066 534 HB3 ARG 67 2HB ARG 67 -8.863 9.049 -10.333 535 HG2 ARG 67 1HG ARG 67 -10.938 10.190 -11.358 536 HG3 ARG 67 2HG ARG 67 -10.522 11.533 -10.293 537 HD2 ARG 67 1HD ARG 67 -8.251 11.553 -11.275 538 HD3 ARG 67 2HD ARG 67 -8.755 10.285 -12.393 539 HE ARG 67 HE ARG 67 -10.580 12.266 -12.776 540 HH11 ARG 67 1HH1 ARG 67 -7.103 12.105 -12.856 541 HH12 ARG 67 2HH1 ARG 67 -6.943 13.360 -14.039 542 HH21 ARG 67 1HH2 ARG 67 -10.381 13.920 -14.334 543 HH22 ARG 67 2HH2 ARG 67 -8.808 14.392 -14.878 544 H LEU 68 H LEU 68 -8.857 8.157 -7.418 545 HA LEU 68 HA LEU 68 -7.908 5.757 -8.387 546 HB2 LEU 68 1HB LEU 68 -8.057 6.992 -5.688 547 HB3 LEU 68 2HB LEU 68 -7.595 5.294 -5.798 548 HG LEU 68 HG LEU 68 -6.147 7.322 -7.449 549 HD11 LEU 68 1HD1 LEU 68 -6.315 8.095 -5.028 550 HD12 LEU 68 2HD1 LEU 68 -4.698 7.925 -5.711 551 HD13 LEU 68 3HD1 LEU 68 -5.332 6.684 -4.631 552 HD21 LEU 68 3HD2 LEU 68 -4.852 5.578 -7.900 553 HD22 LEU 68 1HD2 LEU 68 -5.950 4.557 -6.972 554 HD23 LEU 68 2HD2 LEU 68 -4.561 5.303 -6.182 555 H GLU 69 H GLU 69 -10.636 6.309 -6.188 556 HA GLU 69 HA GLU 69 -11.242 3.555 -5.833 557 HB2 GLU 69 1HB GLU 69 -12.993 5.990 -5.456 558 HB3 GLU 69 2HB GLU 69 -13.373 4.371 -4.888 559 HG2 GLU 69 1HG GLU 69 -10.767 5.289 -3.992 560 HG3 GLU 69 2HG GLU 69 -12.083 6.337 -3.466 561 H GLU 70 H GLU 70 -12.499 6.076 -7.977 562 HA GLU 70 HA GLU 70 -14.534 4.503 -9.151 563 HB2 GLU 70 1HB GLU 70 -13.083 6.981 -10.065 564 HB3 GLU 70 2HB GLU 70 -14.348 6.230 -11.025 565 HG2 GLU 70 1HG GLU 70 -14.784 7.075 -8.181 566 HG3 GLU 70 2HG GLU 70 -15.021 8.168 -9.543 567 H ILE 71 H ILE 71 -11.133 4.574 -9.568 568 HA ILE 71 HA ILE 71 -11.257 3.253 -12.169 569 HB ILE 71 HB ILE 71 -8.867 4.111 -10.534 570 HG12 ILE 71 1HG1 ILE 71 -9.648 5.322 -13.154 571 HG13 ILE 71 2HG1 ILE 71 -10.520 5.810 -11.705 572 HG21 ILE 71 1HG2 ILE 71 -7.909 2.492 -11.804 573 HG22 ILE 71 2HG2 ILE 71 -9.147 2.585 -13.055 574 HG23 ILE 71 3HG2 ILE 71 -7.872 3.801 -12.985 575 HD11 ILE 71 3HD1 ILE 71 -7.689 6.284 -12.469 576 HD12 ILE 71 1HD1 ILE 71 -8.875 7.389 -11.778 577 HD13 ILE 71 2HD1 ILE 71 -8.105 6.172 -10.760 578 H THR 72 H THR 72 -10.242 2.635 -8.842 579 HA THR 72 HA THR 72 -9.209 0.039 -9.300 580 HB THR 72 HB THR 72 -9.483 -0.262 -6.826 581 HG1 THR 72 HG1 THR 72 -11.279 1.045 -6.447 582 HG21 THR 72 3HG2 THR 72 -7.461 0.668 -6.749 583 HG22 THR 72 1HG2 THR 72 -8.195 2.269 -6.689 584 HG23 THR 72 2HG2 THR 72 -7.801 1.538 -8.244 585 H LYS 73 H LYS 73 -12.411 1.261 -8.528 586 HA LYS 73 HA LYS 73 -13.708 -1.045 -7.747 587 HB2 LYS 73 1HB LYS 73 -14.472 1.534 -8.855 588 HB3 LYS 73 2HB LYS 73 -15.555 0.251 -9.379 589 HG2 LYS 73 1HG LYS 73 -14.863 0.385 -6.497 590 HG3 LYS 73 2HG LYS 73 -15.957 1.608 -7.148 591 HD2 LYS 73 1HD LYS 73 -17.396 -0.182 -8.034 592 HD3 LYS 73 2HD LYS 73 -16.314 -1.384 -7.328 593 HE2 LYS 73 1HE LYS 73 -18.274 -0.998 -5.917 594 HE3 LYS 73 2HE LYS 73 -16.786 -0.523 -5.102 595 HZ1 LYS 73 3HZ LYS 73 -17.343 1.658 -5.150 596 HZ2 LYS 73 1HZ LYS 73 -18.911 1.020 -5.154 597 HZ3 LYS 73 2HZ LYS 73 -18.205 1.540 -6.601 598 HA PRO 74 HA PRO 74 -14.692 -2.119 -12.346 599 HB2 PRO 74 1HB PRO 74 -13.455 -0.659 -14.272 600 HB3 PRO 74 2HB PRO 74 -15.014 -0.204 -13.576 601 HG2 PRO 74 1HG PRO 74 -12.279 0.829 -12.930 602 HG3 PRO 74 2HG PRO 74 -13.796 1.726 -13.134 603 HD2 PRO 74 1HD PRO 74 -12.780 1.112 -10.700 604 HD3 PRO 74 2HD PRO 74 -14.526 1.220 -11.006 605 H LYS 75 H LYS 75 -11.417 -0.884 -11.794 606 HA LYS 75 HA LYS 75 -10.075 -2.718 -13.466 607 HB2 LYS 75 1HB LYS 75 -9.262 -0.951 -11.192 608 HB3 LYS 75 2HB LYS 75 -8.128 -2.154 -11.791 609 HG2 LYS 75 1HG LYS 75 -8.534 -1.150 -14.096 610 HG3 LYS 75 2HG LYS 75 -9.299 0.193 -13.244 611 HD2 LYS 75 1HD LYS 75 -7.222 1.051 -13.195 612 HD3 LYS 75 2HD LYS 75 -6.978 -0.069 -11.852 613 HE2 LYS 75 1HE LYS 75 -5.243 -0.804 -13.073 614 HE3 LYS 75 2HE LYS 75 -6.475 -1.676 -13.984 615 HZ1 LYS 75 3HZ LYS 75 -5.089 -0.506 -15.509 616 HZ2 LYS 75 1HZ LYS 75 -5.275 0.950 -14.668 617 HZ3 LYS 75 2HZ LYS 75 -6.592 0.272 -15.487 618 H GLY 76 H GLY 76 -11.412 -2.996 -10.286 619 HA2 GLY 76 1HA GLY 76 -11.534 -4.753 -8.814 620 HA3 GLY 76 2HA GLY 76 -11.253 -5.782 -10.212 621 H ILE 77 H ILE 77 -9.296 -3.465 -8.333 622 HA ILE 77 HA ILE 77 -7.258 -5.578 -8.069 623 HB ILE 77 HB ILE 77 -5.562 -3.726 -8.009 624 HG12 ILE 77 1HG1 ILE 77 -7.058 -1.828 -9.548 625 HG13 ILE 77 2HG1 ILE 77 -7.909 -2.128 -8.036 626 HG21 ILE 77 1HG2 ILE 77 -6.343 -5.167 -10.052 627 HG22 ILE 77 2HG2 ILE 77 -6.938 -3.621 -10.650 628 HG23 ILE 77 3HG2 ILE 77 -5.226 -3.822 -10.280 629 HD11 ILE 77 3HD1 ILE 77 -6.084 -1.409 -6.749 630 HD12 ILE 77 1HD1 ILE 77 -4.985 -1.468 -8.126 631 HD13 ILE 77 2HD1 ILE 77 -6.242 -0.232 -8.053 632 HA PRO 78 HA PRO 78 -7.366 -4.993 -3.719 633 HB2 PRO 78 1HB PRO 78 -4.784 -5.500 -3.057 634 HB3 PRO 78 2HB PRO 78 -5.910 -6.764 -3.567 635 HG2 PRO 78 1HG PRO 78 -3.810 -5.344 -5.159 636 HG3 PRO 78 2HG PRO 78 -4.223 -7.068 -5.137 637 HD2 PRO 78 1HD PRO 78 -5.068 -5.393 -7.089 638 HD3 PRO 78 2HD PRO 78 -6.028 -6.783 -6.543 639 H ILE 79 H ILE 79 -7.778 -2.857 -3.287 640 HA ILE 79 HA ILE 79 -5.421 -1.110 -3.014 641 HB ILE 79 HB ILE 79 -6.762 -0.286 -4.852 642 HG12 ILE 79 1HG1 ILE 79 -7.268 1.980 -4.009 643 HG13 ILE 79 2HG1 ILE 79 -7.165 1.381 -2.357 644 HG21 ILE 79 1HG2 ILE 79 -8.925 -1.190 -3.276 645 HG22 ILE 79 2HG2 ILE 79 -9.140 0.543 -3.520 646 HG23 ILE 79 3HG2 ILE 79 -8.966 -0.528 -4.910 647 HD11 ILE 79 3HD1 ILE 79 -4.773 0.660 -3.681 648 HD12 ILE 79 1HD1 ILE 79 -5.096 2.359 -4.025 649 HD13 ILE 79 2HD1 ILE 79 -5.000 1.801 -2.355 650 H GLU 80 H GLU 80 -5.058 -0.389 -1.023 651 HA GLU 80 HA GLU 80 -7.276 -0.473 0.916 652 HB2 GLU 80 1HB GLU 80 -4.322 -0.889 1.411 653 HB3 GLU 80 2HB GLU 80 -5.562 -0.852 2.658 654 HG2 GLU 80 1HG GLU 80 -5.389 -2.854 0.417 655 HG3 GLU 80 2HG GLU 80 -4.901 -3.130 2.087 656 H ILE 81 H ILE 81 -7.198 1.119 2.639 657 HA ILE 81 HA ILE 81 -5.646 3.528 1.988 658 HB ILE 81 HB ILE 81 -8.589 3.508 2.672 659 HG12 ILE 81 1HG1 ILE 81 -7.150 4.274 0.122 660 HG13 ILE 81 2HG1 ILE 81 -8.137 2.835 0.354 661 HG21 ILE 81 1HG2 ILE 81 -8.468 5.935 2.345 662 HG22 ILE 81 2HG2 ILE 81 -7.441 5.400 3.675 663 HG23 ILE 81 3HG2 ILE 81 -6.723 5.811 2.117 664 HD11 ILE 81 3HD1 ILE 81 -9.897 3.980 -0.324 665 HD12 ILE 81 1HD1 ILE 81 -9.730 5.038 1.076 666 HD13 ILE 81 2HD1 ILE 81 -8.930 5.449 -0.442 667 H ILE 82 H ILE 82 -4.537 4.213 3.688 668 HA ILE 82 HA ILE 82 -5.006 3.113 6.302 669 HB ILE 82 HB ILE 82 -3.086 5.323 5.576 670 HG12 ILE 82 1HG1 ILE 82 -2.618 2.333 5.553 671 HG13 ILE 82 2HG1 ILE 82 -2.747 3.352 4.124 672 HG21 ILE 82 1HG2 ILE 82 -3.049 3.306 7.817 673 HG22 ILE 82 2HG2 ILE 82 -1.857 4.574 7.533 674 HG23 ILE 82 3HG2 ILE 82 -3.511 5.000 7.971 675 HD11 ILE 82 3HD1 ILE 82 -0.559 3.207 6.147 676 HD12 ILE 82 1HD1 ILE 82 -0.469 3.100 4.389 677 HD13 ILE 82 2HD1 ILE 82 -0.779 4.654 5.165 678 H ASN 83 H ASN 83 -5.685 4.171 8.145 679 HA ASN 83 HA ASN 83 -7.409 6.447 7.703 680 HB2 ASN 83 1HB ASN 83 -6.970 4.479 9.887 681 HB3 ASN 83 2HB ASN 83 -7.595 6.059 10.353 682 HD21 ASN 83 2HD2 ASN 83 -9.583 5.246 10.952 683 HD22 ASN 83 1HD2 ASN 83 -10.744 4.685 9.803 684 H THR 84 H THR 84 -7.342 8.364 9.060 685 HA THR 84 HA THR 84 -4.941 9.719 8.986 686 HB THR 84 HB THR 84 -6.793 10.481 11.178 687 HG1 THR 84 HG1 THR 84 -7.608 10.920 8.508 688 HG21 THR 84 3HG2 THR 84 -5.680 12.023 8.833 689 HG22 THR 84 1HG2 THR 84 -4.904 11.901 10.412 690 HG23 THR 84 2HG2 THR 84 -6.472 12.692 10.258 691 H ILE 85 H ILE 85 -6.259 7.705 11.540 692 HA ILE 85 HA ILE 85 -4.354 8.445 13.525 693 HB ILE 85 HB ILE 85 -5.961 5.893 13.372 694 HG12 ILE 85 1HG1 ILE 85 -7.408 7.878 13.227 695 HG13 ILE 85 2HG1 ILE 85 -7.616 7.043 14.763 696 HG21 ILE 85 1HG2 ILE 85 -5.736 6.227 15.944 697 HG22 ILE 85 2HG2 ILE 85 -4.403 5.523 15.031 698 HG23 ILE 85 3HG2 ILE 85 -4.347 7.220 15.505 699 HD11 ILE 85 3HD1 ILE 85 -5.621 8.938 15.214 700 HD12 ILE 85 1HD1 ILE 85 -6.846 9.757 14.246 701 HD13 ILE 85 2HD1 ILE 85 -7.295 8.985 15.767 702 H ASP 86 H ASP 86 -4.739 5.346 11.794 703 HA ASP 86 HA ASP 86 -2.328 4.210 12.513 704 HB2 ASP 86 1HB ASP 86 -3.824 3.892 9.902 705 HB3 ASP 86 2HB ASP 86 -2.558 2.813 10.480 706 H TYR 87 H TYR 87 -2.985 6.642 10.105 707 HA TYR 87 HA TYR 87 -0.431 6.430 8.811 708 HB2 TYR 87 1HB TYR 87 -2.543 7.300 7.728 709 HB3 TYR 87 2HB TYR 87 -2.353 8.758 8.696 710 HD1 TYR 87 HD2 TYR 87 -0.362 6.626 6.357 711 HD2 TYR 87 HD1 TYR 87 -1.261 10.549 7.734 712 HE1 TYR 87 HE2 TYR 87 1.127 7.563 4.638 713 HE2 TYR 87 HE1 TYR 87 0.224 11.498 6.019 714 HH TYR 87 HH TYR 87 1.141 10.825 3.802 715 H GLY 88 H GLY 88 -1.900 8.627 11.178 716 HA2 GLY 88 1HA GLY 88 0.327 10.366 11.391 717 HA3 GLY 88 2HA GLY 88 -0.973 10.209 12.563 718 H THR 89 H THR 89 -0.637 7.496 13.225 719 HA THR 89 HA THR 89 1.535 7.729 15.085 720 HB THR 89 HB THR 89 -0.477 6.628 15.830 721 HG1 THR 89 HG1 THR 89 1.390 4.520 15.535 722 HG21 THR 89 3HG2 THR 89 -1.665 5.405 14.392 723 HG22 THR 89 1HG2 THR 89 -0.455 4.133 14.549 724 HG23 THR 89 2HG2 THR 89 -0.311 5.332 13.264 725 H MET 90 H MET 90 1.061 6.264 11.985 726 HA MET 90 HA MET 90 2.441 5.118 10.589 727 HB2 MET 90 1HB MET 90 4.629 6.055 12.453 728 HB3 MET 90 2HB MET 90 4.845 5.463 10.811 729 HG2 MET 90 1HG MET 90 4.318 7.431 9.903 730 HG3 MET 90 2HG MET 90 2.976 7.692 11.015 731 HE1 MET 90 3HE MET 90 6.590 6.946 11.247 732 HE2 MET 90 1HE MET 90 7.378 8.433 11.776 733 HE3 MET 90 2HE MET 90 6.673 7.337 12.965 734 H ASN 91 H ASN 91 1.404 3.166 11.380 735 HA ASN 91 HA ASN 91 3.098 1.550 13.158 736 HB2 ASN 91 1HB ASN 91 0.216 1.802 12.798 737 HB3 ASN 91 2HB ASN 91 0.751 0.126 12.740 738 HD21 ASN 91 2HD2 ASN 91 1.232 -0.885 14.584 739 HD22 ASN 91 1HD2 ASN 91 1.278 -0.137 16.140 740 H GLY 92 H GLY 92 4.614 0.704 11.788 741 HA2 GLY 92 1HA GLY 92 4.292 -0.135 9.173 742 HA3 GLY 92 2HA GLY 92 5.475 -0.807 10.287 743 H GLU 93 H GLU 93 3.927 -2.100 12.119 744 HA GLU 93 HA GLU 93 3.404 -4.542 10.928 745 HB2 GLU 93 1HB GLU 93 3.719 -4.062 13.391 746 HB3 GLU 93 2HB GLU 93 2.038 -3.548 13.428 747 HG2 GLU 93 1HG GLU 93 1.360 -5.783 12.660 748 HG3 GLU 93 2HG GLU 93 3.048 -6.289 12.707 749 H LYS 94 H LYS 94 1.094 -1.996 11.828 750 HA LYS 94 HA LYS 94 -1.222 -3.333 10.957 751 HB2 LYS 94 1HB LYS 94 -0.588 -0.404 11.306 752 HB3 LYS 94 2HB LYS 94 -2.182 -0.978 10.831 753 HG2 LYS 94 1HG LYS 94 -1.460 -2.481 13.085 754 HG3 LYS 94 2HG LYS 94 -1.015 -0.810 13.439 755 HD2 LYS 94 1HD LYS 94 -3.205 -0.048 13.190 756 HD3 LYS 94 2HD LYS 94 -3.696 -1.472 12.272 757 HE2 LYS 94 1HE LYS 94 -2.732 -2.097 14.954 758 HE3 LYS 94 2HE LYS 94 -4.146 -1.044 14.950 759 HZ1 LYS 94 3HZ LYS 94 -4.423 -3.191 13.095 760 HZ2 LYS 94 1HZ LYS 94 -5.445 -2.729 14.362 761 HZ3 LYS 94 2HZ LYS 94 -4.143 -3.766 14.662 762 H VAL 95 H VAL 95 1.050 -1.218 9.286 763 HA VAL 95 HA VAL 95 -0.409 -0.861 6.912 764 HB VAL 95 HB VAL 95 2.589 -0.917 7.281 765 HG11 VAL 95 1HG1 VAL 95 2.355 -1.056 4.994 766 HG12 VAL 95 2HG1 VAL 95 0.831 -0.165 4.988 767 HG13 VAL 95 3HG1 VAL 95 2.354 0.690 5.236 768 HG21 VAL 95 3HG2 VAL 95 0.753 0.830 8.378 769 HG22 VAL 95 1HG2 VAL 95 2.474 1.136 8.149 770 HG23 VAL 95 2HG2 VAL 95 1.314 1.672 6.934 771 H LEU 96 H LEU 96 2.423 -2.985 7.362 772 HA LEU 96 HA LEU 96 2.156 -4.422 5.010 773 HB2 LEU 96 1HB LEU 96 3.427 -6.224 6.216 774 HB3 LEU 96 2HB LEU 96 4.166 -4.624 6.223 775 HG LEU 96 HG LEU 96 2.755 -4.622 8.571 776 HD11 LEU 96 1HD1 LEU 96 2.349 -7.104 8.078 777 HD12 LEU 96 2HD1 LEU 96 2.958 -6.664 9.674 778 HD13 LEU 96 3HD1 LEU 96 4.058 -7.319 8.460 779 HD21 LEU 96 3HD2 LEU 96 5.029 -3.820 8.244 780 HD22 LEU 96 1HD2 LEU 96 5.609 -5.481 8.105 781 HD23 LEU 96 2HD2 LEU 96 4.943 -4.904 9.634 782 H GLN 97 H GLN 97 0.683 -5.000 8.166 783 HA GLN 97 HA GLN 97 -0.439 -7.511 7.636 784 HB2 GLN 97 1HB GLN 97 -1.086 -5.293 9.539 785 HB3 GLN 97 2HB GLN 97 -2.198 -6.648 9.384 786 HG2 GLN 97 1HG GLN 97 0.715 -7.091 9.903 787 HG3 GLN 97 2HG GLN 97 -0.404 -6.726 11.214 788 HE21 GLN 97 2HE2 GLN 97 0.451 -9.019 8.728 789 HE22 GLN 97 1HE2 GLN 97 -0.424 -10.356 9.384 790 H LEU 98 H LEU 98 -1.763 -4.250 7.176 791 HA LEU 98 HA LEU 98 -4.300 -5.051 6.258 792 HB2 LEU 98 1HB LEU 98 -2.894 -2.631 6.653 793 HB3 LEU 98 2HB LEU 98 -3.498 -2.617 4.998 794 HG LEU 98 HG LEU 98 -5.487 -3.411 7.002 795 HD11 LEU 98 1HD1 LEU 98 -4.722 -0.516 6.944 796 HD12 LEU 98 2HD1 LEU 98 -4.018 -1.624 8.122 797 HD13 LEU 98 3HD1 LEU 98 -5.762 -1.371 8.084 798 HD21 LEU 98 3HD2 LEU 98 -5.442 -2.479 4.397 799 HD22 LEU 98 1HD2 LEU 98 -6.031 -1.104 5.331 800 HD23 LEU 98 2HD2 LEU 98 -6.866 -2.655 5.425 801 H ALA 99 H ALA 99 -1.389 -4.075 4.453 802 HA ALA 99 HA ALA 99 -2.354 -4.362 1.878 803 HB1 ALA 99 3HB ALA 99 0.165 -3.986 3.093 804 HB2 ALA 99 1HB ALA 99 0.335 -5.313 1.945 805 HB3 ALA 99 2HB ALA 99 -0.277 -3.751 1.402 806 H ILE 100 H ILE 100 -0.591 -6.826 3.766 807 HA ILE 100 HA ILE 100 -0.816 -8.910 1.938 808 HB ILE 100 HB ILE 100 -0.759 -9.114 4.950 809 HG12 ILE 100 1HG1 ILE 100 1.573 -9.414 3.067 810 HG13 ILE 100 2HG1 ILE 100 1.118 -7.846 3.728 811 HG21 ILE 100 1HG2 ILE 100 -1.466 -11.204 4.046 812 HG22 ILE 100 2HG2 ILE 100 -0.227 -11.146 2.794 813 HG23 ILE 100 3HG2 ILE 100 0.235 -11.362 4.483 814 HD11 ILE 100 3HD1 ILE 100 1.230 -9.252 5.994 815 HD12 ILE 100 1HD1 ILE 100 2.395 -10.161 5.032 816 HD13 ILE 100 2HD1 ILE 100 2.626 -8.432 5.294 817 H ASN 101 H ASN 101 -2.953 -8.081 4.657 818 HA ASN 101 HA ASN 101 -4.766 -10.158 4.450 819 HB2 ASN 101 1HB ASN 101 -4.968 -7.329 5.404 820 HB3 ASN 101 2HB ASN 101 -6.438 -8.290 5.269 821 HD21 ASN 101 2HD2 ASN 101 -5.435 -7.268 7.671 822 HD22 ASN 101 1HD2 ASN 101 -4.982 -8.597 8.679 823 H ALA 102 H ALA 102 -4.704 -7.087 2.690 824 HA ALA 102 HA ALA 102 -7.138 -7.478 1.300 825 HB1 ALA 102 3HB ALA 102 -5.463 -5.865 -0.286 826 HB2 ALA 102 1HB ALA 102 -6.731 -5.350 0.828 827 HB3 ALA 102 2HB ALA 102 -5.068 -5.506 1.396 828 H PHE 103 H PHE 103 -3.756 -8.123 0.441 829 HA PHE 103 HA PHE 103 -4.126 -8.938 -2.189 830 HB2 PHE 103 1HB PHE 103 -1.919 -8.564 -1.113 831 HB3 PHE 103 2HB PHE 103 -2.129 -10.063 -0.215 832 HD1 PHE 103 HD1 PHE 103 -1.793 -8.659 -3.621 833 HD2 PHE 103 HD2 PHE 103 -1.579 -12.132 -1.170 834 HE1 PHE 103 HE1 PHE 103 -0.788 -9.909 -5.487 835 HE2 PHE 103 HE2 PHE 103 -0.573 -13.388 -3.032 836 HZ PHE 103 HZ PHE 103 -0.175 -12.276 -5.193 837 H ASN 104 H ASN 104 -4.169 -10.903 0.774 838 HA ASN 104 HA ASN 104 -4.749 -13.344 -0.543 839 HB2 ASN 104 1HB ASN 104 -4.878 -12.403 2.302 840 HB3 ASN 104 2HB ASN 104 -5.563 -13.965 1.864 841 HD21 ASN 104 2HD2 ASN 104 -2.973 -12.667 3.192 842 HD22 ASN 104 1HD2 ASN 104 -1.743 -13.760 2.666 843 H ASN 105 H ASN 105 -6.807 -11.082 1.281 844 HA ASN 105 HA ASN 105 -9.225 -12.397 1.029 845 HB2 ASN 105 1HB ASN 105 -8.703 -10.280 2.353 846 HB3 ASN 105 2HB ASN 105 -8.956 -9.398 0.849 847 HD21 ASN 105 2HD2 ASN 105 -10.417 -9.477 3.454 848 HD22 ASN 105 1HD2 ASN 105 -12.063 -9.781 3.024 849 H LYS 106 H LYS 106 -7.730 -10.086 -1.208 850 HA LYS 106 HA LYS 106 -9.878 -10.399 -3.125 851 HB2 LYS 106 1HB LYS 106 -7.254 -8.915 -3.369 852 HB3 LYS 106 2HB LYS 106 -8.603 -8.810 -4.491 853 HG2 LYS 106 1HG LYS 106 -9.284 -8.216 -1.703 854 HG3 LYS 106 2HG LYS 106 -8.148 -7.090 -2.447 855 HD2 LYS 106 1HD LYS 106 -9.696 -6.269 -3.877 856 HD3 LYS 106 2HD LYS 106 -10.477 -7.838 -4.095 857 HE2 LYS 106 1HE LYS 106 -10.719 -6.367 -1.499 858 HE3 LYS 106 2HE LYS 106 -11.747 -5.938 -2.867 859 HZ1 LYS 106 3HZ LYS 106 -12.343 -7.831 -1.076 860 HZ2 LYS 106 1HZ LYS 106 -11.605 -8.768 -2.275 861 HZ3 LYS 106 2HZ LYS 106 -12.944 -7.807 -2.657 862 H SER 107 H SER 107 -8.920 -10.574 -5.533 863 HA SER 107 HA SER 107 -8.149 -12.003 -7.126 864 HB2 SER 107 1HB SER 107 -5.961 -11.223 -5.929 865 HB3 SER 107 2HB SER 107 -5.936 -12.865 -5.288 866 HG SER 107 HG SER 107 -5.873 -12.051 -8.000 867 H SER 108 H SER 108 -10.058 -12.965 -5.180 868 HA SER 108 HA SER 108 -9.636 -15.828 -5.576 869 HB2 SER 108 1HB SER 108 -8.912 -15.051 -3.212 870 HB3 SER 108 2HB SER 108 -10.638 -14.860 -2.909 871 HG SER 108 HG SER 108 -10.281 -16.910 -2.336 872 H VAL 109 H VAL 109 -11.280 -14.277 -7.089 873 HA VAL 109 HA VAL 109 -13.403 -14.149 -7.898 874 HB VAL 109 HB VAL 109 -14.017 -16.373 -5.950 875 HG11 VAL 109 1HG1 VAL 109 -15.679 -16.907 -7.866 876 HG12 VAL 109 2HG1 VAL 109 -16.075 -15.633 -6.712 877 HG13 VAL 109 3HG1 VAL 109 -15.448 -15.215 -8.307 878 HG21 VAL 109 3HG2 VAL 109 -13.707 -17.734 -8.153 879 HG22 VAL 109 1HG2 VAL 109 -12.711 -16.361 -8.636 880 HG23 VAL 109 2HG2 VAL 109 -12.298 -17.286 -7.191 Start of MODEL 4 1 H1 GLY 1 H GLY 1 13.606 -17.010 -3.649 2 HA2 GLY 1 1HA GLY 1 14.034 -15.099 -5.082 3 HA3 GLY 1 2HA GLY 1 14.088 -16.205 -6.446 4 HA PRO 2 HA PRO 2 9.833 -15.612 -7.294 5 HB2 PRO 2 1HB PRO 2 8.886 -18.115 -7.750 6 HB3 PRO 2 2HB PRO 2 9.967 -17.279 -8.870 7 HG2 PRO 2 1HG PRO 2 10.611 -19.355 -6.812 8 HG3 PRO 2 2HG PRO 2 11.206 -19.207 -8.475 9 HD2 PRO 2 1HD PRO 2 12.661 -18.418 -6.332 10 HD3 PRO 2 2HD PRO 2 12.768 -17.608 -7.908 11 H GLY 3 H GLY 3 7.755 -15.616 -6.421 12 HA2 GLY 3 1HA GLY 3 6.067 -16.450 -4.946 13 HA3 GLY 3 2HA GLY 3 7.329 -17.201 -3.982 14 H SER 4 H SER 4 7.231 -13.875 -5.175 15 HA SER 4 HA SER 4 7.073 -12.967 -2.375 16 HB2 SER 4 1HB SER 4 8.480 -11.010 -3.125 17 HB3 SER 4 2HB SER 4 9.314 -12.564 -3.132 18 HG SER 4 HG SER 4 9.152 -10.915 -5.115 19 H MET 5 H MET 5 6.142 -10.838 -2.056 20 HA MET 5 HA MET 5 4.165 -10.179 -4.138 21 HB2 MET 5 1HB MET 5 3.095 -11.034 -2.137 22 HB3 MET 5 2HB MET 5 3.975 -9.886 -1.137 23 HG2 MET 5 1HG MET 5 2.741 -8.066 -1.938 24 HG3 MET 5 2HG MET 5 2.119 -8.985 -3.307 25 HE1 MET 5 3HE MET 5 0.653 -7.609 0.150 26 HE2 MET 5 1HE MET 5 0.888 -9.109 1.048 27 HE3 MET 5 2HE MET 5 2.266 -8.313 0.286 28 H ASN 6 H ASN 6 4.159 -8.178 -4.961 29 HA ASN 6 HA ASN 6 6.034 -6.232 -3.815 30 HB2 ASN 6 1HB ASN 6 4.834 -6.512 -6.573 31 HB3 ASN 6 2HB ASN 6 5.744 -5.091 -6.067 32 HD21 ASN 6 2HD2 ASN 6 7.872 -5.120 -6.291 33 HD22 ASN 6 1HD2 ASN 6 8.826 -6.517 -6.640 34 H ILE 7 H ILE 7 5.041 -4.951 -2.386 35 HA ILE 7 HA ILE 7 2.290 -4.105 -2.829 36 HB ILE 7 HB ILE 7 4.096 -3.407 -0.514 37 HG12 ILE 7 1HG1 ILE 7 2.084 -5.656 -0.753 38 HG13 ILE 7 2HG1 ILE 7 3.833 -5.850 -0.731 39 HG21 ILE 7 1HG2 ILE 7 1.944 -3.004 0.648 40 HG22 ILE 7 2HG2 ILE 7 2.218 -1.916 -0.713 41 HG23 ILE 7 3HG2 ILE 7 1.107 -3.276 -0.880 42 HD11 ILE 7 3HD1 ILE 7 2.094 -4.846 1.504 43 HD12 ILE 7 1HD1 ILE 7 2.962 -6.378 1.429 44 HD13 ILE 7 2HD1 ILE 7 3.856 -4.861 1.540 45 H LEU 8 H LEU 8 1.636 -1.942 -2.961 46 HA LEU 8 HA LEU 8 3.776 -0.039 -3.661 47 HB2 LEU 8 1HB LEU 8 2.481 -0.783 -5.616 48 HB3 LEU 8 2HB LEU 8 1.006 -0.210 -4.839 49 HG LEU 8 HG LEU 8 1.741 2.076 -5.014 50 HD11 LEU 8 1HD1 LEU 8 4.331 0.829 -5.427 51 HD12 LEU 8 2HD1 LEU 8 3.930 2.460 -4.891 52 HD13 LEU 8 3HD1 LEU 8 3.984 2.088 -6.613 53 HD21 LEU 8 3HD2 LEU 8 2.040 0.490 -7.556 54 HD22 LEU 8 1HD2 LEU 8 1.963 2.251 -7.509 55 HD23 LEU 8 2HD2 LEU 8 0.594 1.293 -6.944 56 H LEU 9 H LEU 9 3.710 1.951 -2.756 57 HA LEU 9 HA LEU 9 1.390 2.585 -1.054 58 HB2 LEU 9 1HB LEU 9 3.690 1.922 0.012 59 HB3 LEU 9 2HB LEU 9 4.127 3.579 -0.401 60 HG LEU 9 HG LEU 9 1.641 3.673 0.952 61 HD11 LEU 9 1HD1 LEU 9 3.696 1.942 2.312 62 HD12 LEU 9 2HD1 LEU 9 2.048 1.498 1.872 63 HD13 LEU 9 3HD1 LEU 9 2.331 2.702 3.130 64 HD21 LEU 9 3HD2 LEU 9 4.445 4.572 1.417 65 HD22 LEU 9 1HD2 LEU 9 3.268 4.719 2.721 66 HD23 LEU 9 2HD2 LEU 9 2.979 5.525 1.180 67 H VAL 10 H VAL 10 0.439 4.479 -1.434 68 HA VAL 10 HA VAL 10 1.808 6.383 -3.210 69 HB VAL 10 HB VAL 10 -1.150 6.214 -2.627 70 HG11 VAL 10 1HG1 VAL 10 0.432 7.739 -4.691 71 HG12 VAL 10 2HG1 VAL 10 -1.329 7.618 -4.661 72 HG13 VAL 10 3HG1 VAL 10 -0.475 8.414 -3.338 73 HG21 VAL 10 3HG2 VAL 10 0.347 5.201 -5.043 74 HG22 VAL 10 1HG2 VAL 10 -0.312 4.187 -3.759 75 HG23 VAL 10 2HG2 VAL 10 -1.395 5.133 -4.779 76 H CYS 11 H CYS 11 2.839 7.846 -1.981 77 HA CYS 11 HA CYS 11 1.358 9.746 -0.496 78 HB2 CYS 11 1HB CYS 11 1.313 8.020 1.216 79 HB3 CYS 11 2HB CYS 11 3.057 7.818 1.100 80 HG CYS 11 HG CYS 11 3.614 10.401 2.083 81 H GLY 12 H GLY 12 2.413 11.330 -1.593 82 HA2 GLY 12 1HA GLY 12 5.191 11.347 -2.129 83 HA3 GLY 12 2HA GLY 12 4.114 12.732 -2.239 84 H ALA 13 H ALA 13 6.377 11.002 -0.254 85 HA ALA 13 HA ALA 13 6.041 12.783 2.008 86 HB1 ALA 13 3HB ALA 13 8.340 11.348 2.478 87 HB2 ALA 13 1HB ALA 13 6.716 10.903 3.001 88 HB3 ALA 13 2HB ALA 13 7.371 10.245 1.501 89 H GLY 14 H GLY 14 8.106 12.453 -0.773 90 HA2 GLY 14 1HA GLY 14 9.780 13.784 -1.605 91 HA3 GLY 14 2HA GLY 14 9.105 15.064 -0.607 92 H MET 15 H MET 15 10.259 12.105 0.819 93 HA MET 15 HA MET 15 12.651 13.533 1.777 94 HB2 MET 15 1HB MET 15 10.504 12.819 3.344 95 HB3 MET 15 2HB MET 15 11.611 11.474 3.583 96 HG2 MET 15 1HG MET 15 13.379 13.104 4.180 97 HG3 MET 15 2HG MET 15 12.177 14.387 4.068 98 HE1 MET 15 3HE MET 15 13.800 14.375 6.180 99 HE2 MET 15 1HE MET 15 12.582 14.827 7.373 100 HE3 MET 15 2HE MET 15 13.555 13.375 7.613 101 H SER 16 H SER 16 14.417 12.110 2.475 102 HA SER 16 HA SER 16 14.981 10.140 0.527 103 HB2 SER 16 1HB SER 16 16.880 9.637 2.345 104 HB3 SER 16 2HB SER 16 16.943 11.047 1.289 105 HG SER 16 HG SER 16 17.084 12.056 3.142 106 H THR 17 H THR 17 13.712 9.999 3.779 107 HA THR 17 HA THR 17 13.250 7.122 3.420 108 HB THR 17 HB THR 17 13.982 8.192 6.129 109 HG1 THR 17 HG1 THR 17 15.746 7.270 4.091 110 HG21 THR 17 3HG2 THR 17 14.002 6.026 6.773 111 HG22 THR 17 1HG2 THR 17 14.710 5.473 5.257 112 HG23 THR 17 2HG2 THR 17 12.980 5.799 5.354 113 H SER 18 H SER 18 11.219 6.524 3.844 114 HA SER 18 HA SER 18 9.410 8.515 4.993 115 HB2 SER 18 1HB SER 18 9.028 6.097 3.255 116 HB3 SER 18 2HB SER 18 7.669 6.747 4.172 117 HG SER 18 HG SER 18 9.162 7.954 2.111 118 H MET 19 H MET 19 8.347 8.241 6.877 119 HA MET 19 HA MET 19 9.298 6.517 8.832 120 HB2 MET 19 1HB MET 19 6.592 7.853 8.657 121 HB3 MET 19 2HB MET 19 7.263 7.125 10.110 122 HG2 MET 19 1HG MET 19 8.100 9.116 10.592 123 HG3 MET 19 2HG MET 19 9.237 8.866 9.269 124 HE1 MET 19 3HE MET 19 8.620 12.359 8.092 125 HE2 MET 19 1HE MET 19 9.451 11.470 9.369 126 HE3 MET 19 2HE MET 19 9.575 10.930 7.694 127 H LEU 20 H LEU 20 6.223 6.265 7.040 128 HA LEU 20 HA LEU 20 5.331 3.866 8.074 129 HB2 LEU 20 1HB LEU 20 4.950 5.280 5.486 130 HB3 LEU 20 2HB LEU 20 4.384 3.617 5.617 131 HG LEU 20 HG LEU 20 3.514 5.888 7.403 132 HD11 LEU 20 1HD1 LEU 20 2.697 6.240 5.160 133 HD12 LEU 20 2HD1 LEU 20 1.373 5.700 6.193 134 HD13 LEU 20 3HD1 LEU 20 2.132 4.571 5.070 135 HD21 LEU 20 3HD2 LEU 20 2.554 4.362 8.697 136 HD22 LEU 20 1HD2 LEU 20 3.402 3.115 7.784 137 HD23 LEU 20 2HD2 LEU 20 1.776 3.605 7.307 138 H VAL 21 H VAL 21 7.164 4.278 5.038 139 HA VAL 21 HA VAL 21 7.548 1.589 4.468 140 HB VAL 21 HB VAL 21 9.512 3.807 3.880 141 HG11 VAL 21 1HG1 VAL 21 9.261 1.850 1.817 142 HG12 VAL 21 2HG1 VAL 21 10.683 2.282 2.769 143 HG13 VAL 21 3HG1 VAL 21 9.579 1.035 3.348 144 HG21 VAL 21 3HG2 VAL 21 8.266 3.894 1.678 145 HG22 VAL 21 1HG2 VAL 21 6.995 2.959 2.467 146 HG23 VAL 21 2HG2 VAL 21 7.418 4.560 3.074 147 H GLN 22 H GLN 22 9.346 3.721 6.608 148 HA GLN 22 HA GLN 22 11.578 2.082 7.051 149 HB2 GLN 22 1HB GLN 22 10.401 4.457 8.255 150 HB3 GLN 22 2HB GLN 22 11.163 3.416 9.449 151 HG2 GLN 22 1HG GLN 22 12.679 4.012 6.975 152 HG3 GLN 22 2HG GLN 22 12.492 5.303 8.161 153 HE21 GLN 22 2HE2 GLN 22 13.582 5.199 10.069 154 HE22 GLN 22 1HE2 GLN 22 14.754 3.984 10.437 155 H ARG 23 H ARG 23 8.772 2.548 9.210 156 HA ARG 23 HA ARG 23 9.340 0.506 10.990 157 HB2 ARG 23 1HB ARG 23 6.612 1.465 10.106 158 HB3 ARG 23 2HB ARG 23 6.950 0.549 11.569 159 HG2 ARG 23 1HG ARG 23 8.643 2.810 11.584 160 HG3 ARG 23 2HG ARG 23 7.020 3.361 11.164 161 HD2 ARG 23 1HD ARG 23 7.067 3.447 13.498 162 HD3 ARG 23 2HD ARG 23 6.229 1.938 13.138 163 HE ARG 23 HE ARG 23 7.966 0.782 14.086 164 HH11 ARG 23 1HH1 ARG 23 8.943 4.076 13.525 165 HH12 ARG 23 2HH1 ARG 23 10.430 3.922 14.401 166 HH21 ARG 23 1HH2 ARG 23 9.921 0.567 15.242 167 HH22 ARG 23 2HH2 ARG 23 10.986 1.925 15.376 168 H ILE 24 H ILE 24 7.234 0.362 8.120 169 HA ILE 24 HA ILE 24 6.494 -2.304 8.285 170 HB ILE 24 HB ILE 24 7.009 -0.714 5.769 171 HG12 ILE 24 1HG1 ILE 24 4.351 -1.187 7.104 172 HG13 ILE 24 2HG1 ILE 24 5.362 0.190 7.528 173 HG21 ILE 24 1HG2 ILE 24 5.375 -2.289 4.758 174 HG22 ILE 24 2HG2 ILE 24 6.888 -3.051 5.246 175 HG23 ILE 24 3HG2 ILE 24 5.443 -3.244 6.238 176 HD11 ILE 24 3HD1 ILE 24 5.344 0.723 5.027 177 HD12 ILE 24 1HD1 ILE 24 3.995 -0.408 4.935 178 HD13 ILE 24 2HD1 ILE 24 3.875 1.028 5.953 179 H GLU 25 H GLU 25 9.314 -0.886 6.652 180 HA GLU 25 HA GLU 25 10.352 -3.256 5.587 181 HB2 GLU 25 1HB GLU 25 11.570 -0.622 6.345 182 HB3 GLU 25 2HB GLU 25 12.592 -1.945 5.802 183 HG2 GLU 25 1HG GLU 25 10.289 -1.446 4.077 184 HG3 GLU 25 2HG GLU 25 11.413 -0.094 4.190 185 H LYS 26 H LYS 26 10.821 -1.734 8.739 186 HA LYS 26 HA LYS 26 12.833 -3.487 9.666 187 HB2 LYS 26 1HB LYS 26 11.125 -1.390 10.786 188 HB3 LYS 26 2HB LYS 26 11.492 -2.670 11.935 189 HG2 LYS 26 1HG LYS 26 13.938 -2.177 10.819 190 HG3 LYS 26 2HG LYS 26 13.203 -0.572 10.853 191 HD2 LYS 26 1HD LYS 26 12.562 -1.234 13.297 192 HD3 LYS 26 2HD LYS 26 13.868 -2.408 13.117 193 HE2 LYS 26 1HE LYS 26 14.460 0.360 12.269 194 HE3 LYS 26 2HE LYS 26 14.239 0.103 13.999 195 HZ1 LYS 26 3HZ LYS 26 16.516 -0.381 12.531 196 HZ2 LYS 26 1HZ LYS 26 15.890 -1.914 12.877 197 HZ3 LYS 26 2HZ LYS 26 16.228 -0.836 14.135 198 H TYR 27 H TYR 27 9.336 -3.413 10.374 199 HA TYR 27 HA TYR 27 9.172 -5.693 11.919 200 HB2 TYR 27 1HB TYR 27 7.283 -4.194 11.645 201 HB3 TYR 27 2HB TYR 27 7.157 -4.610 9.941 202 HD1 TYR 27 HD1 TYR 27 6.359 -6.860 9.273 203 HD2 TYR 27 HD2 TYR 27 6.348 -5.599 13.337 204 HE1 TYR 27 HE1 TYR 27 4.804 -8.683 9.828 205 HE2 TYR 27 HE2 TYR 27 4.794 -7.419 13.903 206 HH TYR 27 HH TYR 27 4.107 -9.591 13.037 207 H ALA 28 H ALA 28 8.866 -5.437 8.385 208 HA ALA 28 HA ALA 28 8.486 -8.199 7.927 209 HB1 ALA 28 3HB ALA 28 8.624 -7.712 5.658 210 HB2 ALA 28 1HB ALA 28 8.042 -6.203 6.361 211 HB3 ALA 28 2HB ALA 28 9.740 -6.370 5.913 212 H LYS 29 H LYS 29 11.384 -6.157 7.553 213 HA LYS 29 HA LYS 29 13.170 -8.152 6.813 214 HB2 LYS 29 1HB LYS 29 13.528 -5.542 8.262 215 HB3 LYS 29 2HB LYS 29 14.899 -6.596 7.943 216 HG2 LYS 29 1HG LYS 29 14.548 -6.431 5.575 217 HG3 LYS 29 2HG LYS 29 13.052 -5.529 5.819 218 HD2 LYS 29 1HD LYS 29 14.279 -3.673 5.670 219 HD3 LYS 29 2HD LYS 29 14.956 -4.096 7.244 220 HE2 LYS 29 1HE LYS 29 16.904 -4.875 6.349 221 HE3 LYS 29 2HE LYS 29 16.138 -5.379 4.843 222 HZ1 LYS 29 3HZ LYS 29 17.072 -2.697 5.634 223 HZ2 LYS 29 1HZ LYS 29 15.869 -2.866 4.456 224 HZ3 LYS 29 2HZ LYS 29 17.392 -3.562 4.215 225 H SER 30 H SER 30 11.799 -7.427 9.907 226 HA SER 30 HA SER 30 13.750 -9.012 11.359 227 HB2 SER 30 1HB SER 30 13.103 -7.393 12.823 228 HB3 SER 30 2HB SER 30 11.525 -7.192 12.062 229 HG SER 30 HG SER 30 11.079 -8.132 13.972 230 H LYS 31 H LYS 31 10.352 -9.218 10.398 231 HA LYS 31 HA LYS 31 9.910 -11.745 11.658 232 HB2 LYS 31 1HB LYS 31 8.380 -9.925 9.884 233 HB3 LYS 31 2HB LYS 31 7.921 -11.623 9.847 234 HG2 LYS 31 1HG LYS 31 8.076 -9.937 12.338 235 HG3 LYS 31 2HG LYS 31 6.597 -10.291 11.441 236 HD2 LYS 31 1HD LYS 31 7.244 -12.762 11.776 237 HD3 LYS 31 2HD LYS 31 8.338 -12.156 13.021 238 HE2 LYS 31 1HE LYS 31 5.935 -10.871 13.536 239 HE3 LYS 31 2HE LYS 31 5.460 -12.508 13.086 240 HZ1 LYS 31 3HZ LYS 31 6.871 -13.398 14.778 241 HZ2 LYS 31 1HZ LYS 31 5.884 -12.220 15.487 242 HZ3 LYS 31 2HZ LYS 31 7.503 -11.871 15.143 243 H ASN 32 H ASN 32 11.526 -10.812 8.854 244 HA ASN 32 HA ASN 32 12.443 -11.950 7.112 245 HB2 ASN 32 1HB ASN 32 12.030 -14.071 9.170 246 HB3 ASN 32 2HB ASN 32 12.461 -14.575 7.538 247 HD21 ASN 32 2HD2 ASN 32 14.463 -15.338 8.147 248 HD22 ASN 32 1HD2 ASN 32 15.761 -14.291 8.599 249 H ILE 33 H ILE 33 10.229 -11.144 6.231 250 HA ILE 33 HA ILE 33 8.716 -13.465 5.227 251 HB ILE 33 HB ILE 33 7.775 -10.610 5.531 252 HG12 ILE 33 1HG1 ILE 33 6.687 -13.021 6.966 253 HG13 ILE 33 2HG1 ILE 33 8.057 -12.124 7.610 254 HG21 ILE 33 1HG2 ILE 33 5.558 -11.560 4.918 255 HG22 ILE 33 2HG2 ILE 33 6.739 -11.598 3.610 256 HG23 ILE 33 3HG2 ILE 33 6.369 -13.072 4.507 257 HD11 ILE 33 3HD1 ILE 33 5.207 -11.359 7.412 258 HD12 ILE 33 1HD1 ILE 33 6.376 -11.068 8.700 259 HD13 ILE 33 2HD1 ILE 33 6.413 -10.085 7.236 260 H ASN 34 H ASN 34 8.280 -13.628 3.048 261 HA ASN 34 HA ASN 34 10.087 -12.199 1.307 262 HB2 ASN 34 1HB ASN 34 8.108 -14.434 0.865 263 HB3 ASN 34 2HB ASN 34 8.990 -13.684 -0.462 264 HD21 ASN 34 2HD2 ASN 34 9.330 -15.481 2.531 265 HD22 ASN 34 1HD2 ASN 34 10.879 -16.156 2.168 266 H ALA 35 H ALA 35 9.190 -10.073 1.534 267 HA ALA 35 HA ALA 35 7.097 -9.569 -0.411 268 HB1 ALA 35 3HB ALA 35 5.921 -8.030 1.243 269 HB2 ALA 35 1HB ALA 35 5.678 -9.765 1.447 270 HB3 ALA 35 2HB ALA 35 6.798 -8.900 2.501 271 H THR 36 H THR 36 6.997 -7.360 -1.092 272 HA THR 36 HA THR 36 9.326 -5.745 -0.287 273 HB THR 36 HB THR 36 8.768 -5.022 -2.926 274 HG1 THR 36 HG1 THR 36 8.117 -6.776 -3.900 275 HG21 THR 36 3HG2 THR 36 10.927 -6.983 -2.258 276 HG22 THR 36 1HG2 THR 36 10.962 -5.366 -1.556 277 HG23 THR 36 2HG2 THR 36 10.986 -5.567 -3.307 278 H ILE 37 H ILE 37 9.099 -3.432 -0.708 279 HA ILE 37 HA ILE 37 6.385 -2.451 -1.105 280 HB ILE 37 HB ILE 37 6.527 -2.811 1.320 281 HG12 ILE 37 1HG1 ILE 37 5.946 -0.500 2.017 282 HG13 ILE 37 2HG1 ILE 37 6.577 0.097 0.486 283 HG21 ILE 37 1HG2 ILE 37 8.155 -1.905 2.694 284 HG22 ILE 37 2HG2 ILE 37 9.082 -2.386 1.273 285 HG23 ILE 37 3HG2 ILE 37 8.632 -0.696 1.502 286 HD11 ILE 37 3HD1 ILE 37 4.879 -1.198 -0.706 287 HD12 ILE 37 1HD1 ILE 37 4.238 -1.761 0.838 288 HD13 ILE 37 2HD1 ILE 37 4.165 -0.048 0.426 289 H GLU 38 H GLU 38 6.351 -0.578 -2.193 290 HA GLU 38 HA GLU 38 8.740 1.120 -2.187 291 HB2 GLU 38 1HB GLU 38 8.763 -0.446 -4.171 292 HB3 GLU 38 2HB GLU 38 7.305 0.360 -4.731 293 HG2 GLU 38 1HG GLU 38 9.160 1.294 -5.888 294 HG3 GLU 38 2HG GLU 38 8.562 2.500 -4.750 295 H ALA 39 H ALA 39 8.337 3.276 -2.304 296 HA ALA 39 HA ALA 39 5.504 4.071 -2.463 297 HB1 ALA 39 3HB ALA 39 5.771 5.329 -0.644 298 HB2 ALA 39 1HB ALA 39 7.305 4.490 -0.412 299 HB3 ALA 39 2HB ALA 39 7.264 6.037 -1.259 300 H ILE 40 H ILE 40 4.888 5.651 -3.850 301 HA ILE 40 HA ILE 40 6.856 7.325 -5.163 302 HB ILE 40 HB ILE 40 5.941 6.702 -7.445 303 HG12 ILE 40 1HG1 ILE 40 5.362 3.969 -6.577 304 HG13 ILE 40 2HG1 ILE 40 4.201 5.144 -5.968 305 HG21 ILE 40 1HG2 ILE 40 8.157 5.960 -6.277 306 HG22 ILE 40 2HG2 ILE 40 7.394 4.371 -6.283 307 HG23 ILE 40 3HG2 ILE 40 7.667 5.223 -7.803 308 HD11 ILE 40 3HD1 ILE 40 3.746 5.894 -8.227 309 HD12 ILE 40 1HD1 ILE 40 4.950 4.770 -8.858 310 HD13 ILE 40 2HD1 ILE 40 3.491 4.154 -8.083 311 H ALA 41 H ALA 41 5.549 8.574 -7.036 312 HA ALA 41 HA ALA 41 3.406 9.912 -5.628 313 HB1 ALA 41 3HB ALA 41 5.225 10.549 -7.807 314 HB2 ALA 41 1HB ALA 41 3.575 11.095 -8.109 315 HB3 ALA 41 2HB ALA 41 4.424 11.614 -6.651 316 H GLU 42 H GLU 42 1.606 10.735 -7.330 317 HA GLU 42 HA GLU 42 0.146 8.340 -8.004 318 HB2 GLU 42 1HB GLU 42 -1.697 9.870 -8.533 319 HB3 GLU 42 2HB GLU 42 -1.013 10.211 -6.950 320 HG2 GLU 42 1HG GLU 42 0.429 11.934 -8.327 321 HG3 GLU 42 2HG GLU 42 -0.933 11.820 -9.441 322 H THR 43 H THR 43 2.024 10.726 -9.659 323 HA THR 43 HA THR 43 0.987 10.540 -12.244 324 HB THR 43 HB THR 43 3.115 11.372 -13.041 325 HG1 THR 43 HG1 THR 43 4.210 11.044 -10.448 326 HG21 THR 43 3HG2 THR 43 3.345 13.358 -11.668 327 HG22 THR 43 1HG2 THR 43 2.520 12.561 -10.329 328 HG23 THR 43 2HG2 THR 43 1.640 12.932 -11.812 329 H ARG 44 H ARG 44 3.572 8.649 -10.698 330 HA ARG 44 HA ARG 44 3.546 6.806 -12.977 331 HB2 ARG 44 1HB ARG 44 5.473 6.924 -10.650 332 HB3 ARG 44 2HB ARG 44 5.639 5.936 -12.095 333 HG2 ARG 44 1HG ARG 44 5.996 7.847 -13.462 334 HG3 ARG 44 2HG ARG 44 5.557 8.940 -12.147 335 HD2 ARG 44 1HD ARG 44 7.512 8.251 -10.887 336 HD3 ARG 44 2HD ARG 44 7.932 7.083 -12.139 337 HE ARG 44 HE ARG 44 8.838 8.783 -13.371 338 HH11 ARG 44 1HH1 ARG 44 6.814 10.134 -10.882 339 HH12 ARG 44 2HH1 ARG 44 7.300 11.768 -11.191 340 HH21 ARG 44 1HH2 ARG 44 9.486 10.930 -13.788 341 HH22 ARG 44 2HH2 ARG 44 8.820 12.219 -12.845 342 H LEU 45 H LEU 45 1.590 7.043 -10.618 343 HA LEU 45 HA LEU 45 1.896 4.541 -9.224 344 HB2 LEU 45 1HB LEU 45 0.888 6.231 -7.957 345 HB3 LEU 45 2HB LEU 45 -0.197 6.687 -9.270 346 HG LEU 45 HG LEU 45 -1.409 4.540 -8.933 347 HD11 LEU 45 1HD1 LEU 45 0.739 4.192 -6.941 348 HD12 LEU 45 2HD1 LEU 45 -0.151 2.992 -7.878 349 HD13 LEU 45 3HD1 LEU 45 -0.881 3.707 -6.440 350 HD21 LEU 45 3HD2 LEU 45 -1.201 6.503 -6.662 351 HD22 LEU 45 1HD2 LEU 45 -2.420 5.230 -6.723 352 HD23 LEU 45 2HD2 LEU 45 -2.380 6.472 -7.974 353 H SER 46 H SER 46 -0.329 5.839 -11.672 354 HA SER 46 HA SER 46 -1.733 3.366 -11.982 355 HB2 SER 46 1HB SER 46 -2.969 5.317 -12.518 356 HB3 SER 46 2HB SER 46 -1.687 5.940 -13.557 357 HG SER 46 HG SER 46 -2.733 4.998 -15.107 358 H GLU 47 H GLU 47 1.217 4.593 -13.157 359 HA GLU 47 HA GLU 47 1.252 2.969 -15.558 360 HB2 GLU 47 1HB GLU 47 2.661 5.245 -14.630 361 HB3 GLU 47 2HB GLU 47 3.846 3.966 -14.855 362 HG2 GLU 47 1HG GLU 47 3.045 3.645 -17.151 363 HG3 GLU 47 2HG GLU 47 1.895 4.961 -16.921 364 H VAL 48 H VAL 48 2.248 2.740 -12.259 365 HA VAL 48 HA VAL 48 3.873 0.362 -12.835 366 HB VAL 48 HB VAL 48 4.710 0.534 -10.562 367 HG11 VAL 48 1HG1 VAL 48 6.213 1.838 -11.566 368 HG12 VAL 48 2HG1 VAL 48 4.978 2.639 -12.540 369 HG13 VAL 48 3HG1 VAL 48 5.322 3.210 -10.907 370 HG21 VAL 48 3HG2 VAL 48 2.665 2.721 -10.325 371 HG22 VAL 48 1HG2 VAL 48 2.894 1.305 -9.297 372 HG23 VAL 48 2HG2 VAL 48 4.059 2.629 -9.248 373 H VAL 49 H VAL 49 0.870 1.388 -11.488 374 HA VAL 49 HA VAL 49 0.233 -0.612 -9.701 375 HB VAL 49 HB VAL 49 -1.193 1.370 -10.236 376 HG11 VAL 49 1HG1 VAL 49 -2.493 1.524 -12.130 377 HG12 VAL 49 2HG1 VAL 49 -1.032 0.774 -12.777 378 HG13 VAL 49 3HG1 VAL 49 -2.453 -0.213 -12.430 379 HG21 VAL 49 3HG2 VAL 49 -1.943 -0.694 -8.955 380 HG22 VAL 49 1HG2 VAL 49 -3.216 0.325 -9.626 381 HG23 VAL 49 2HG2 VAL 49 -2.776 -1.180 -10.431 382 H ASP 50 H ASP 50 0.399 -0.754 -13.183 383 HA ASP 50 HA ASP 50 -1.055 -3.150 -13.555 384 HB2 ASP 50 1HB ASP 50 -0.127 -1.334 -15.262 385 HB3 ASP 50 2HB ASP 50 1.209 -2.476 -15.375 386 H ARG 51 H ARG 51 2.334 -2.476 -12.870 387 HA ARG 51 HA ARG 51 3.080 -5.263 -13.091 388 HB2 ARG 51 1HB ARG 51 4.758 -3.031 -11.956 389 HB3 ARG 51 2HB ARG 51 5.306 -4.551 -12.648 390 HG2 ARG 51 1HG ARG 51 3.944 -2.347 -14.182 391 HG3 ARG 51 2HG ARG 51 5.685 -2.630 -14.132 392 HD2 ARG 51 1HD ARG 51 5.142 -4.986 -14.960 393 HD3 ARG 51 2HD ARG 51 3.537 -4.356 -15.326 394 HE ARG 51 HE ARG 51 4.422 -3.213 -17.111 395 HH11 ARG 51 1HH1 ARG 51 6.998 -4.379 -15.081 396 HH12 ARG 51 2HH1 ARG 51 8.247 -3.974 -16.211 397 HH21 ARG 51 1HH2 ARG 51 6.057 -2.675 -18.607 398 HH22 ARG 51 2HH2 ARG 51 7.712 -3.003 -18.216 399 H PHE 52 H PHE 52 2.725 -2.852 -10.514 400 HA PHE 52 HA PHE 52 3.538 -4.441 -8.369 401 HB2 PHE 52 1HB PHE 52 1.796 -2.029 -8.647 402 HB3 PHE 52 2HB PHE 52 1.819 -2.878 -7.105 403 HD1 PHE 52 HD1 PHE 52 4.010 -3.165 -5.912 404 HD2 PHE 52 HD2 PHE 52 3.538 -0.589 -9.268 405 HE1 PHE 52 HE1 PHE 52 6.074 -1.980 -5.288 406 HE2 PHE 52 HE2 PHE 52 5.602 0.598 -8.651 407 HZ PHE 52 HZ PHE 52 6.875 -0.098 -6.660 408 H ASP 53 H ASP 53 1.875 -4.959 -6.519 409 HA ASP 53 HA ASP 53 -0.226 -6.631 -7.729 410 HB2 ASP 53 1HB ASP 53 1.318 -7.003 -5.155 411 HB3 ASP 53 2HB ASP 53 -0.032 -8.016 -5.657 412 H VAL 54 H VAL 54 0.454 -5.093 -4.579 413 HA VAL 54 HA VAL 54 -2.408 -4.425 -4.392 414 HB VAL 54 HB VAL 54 -0.419 -4.531 -2.123 415 HG11 VAL 54 1HG1 VAL 54 -3.434 -4.416 -2.167 416 HG12 VAL 54 2HG1 VAL 54 -2.435 -4.573 -0.720 417 HG13 VAL 54 3HG1 VAL 54 -2.345 -3.109 -1.701 418 HG21 VAL 54 3HG2 VAL 54 -1.564 -6.673 -1.532 419 HG22 VAL 54 1HG2 VAL 54 -2.344 -6.628 -3.113 420 HG23 VAL 54 2HG2 VAL 54 -0.589 -6.751 -2.999 421 H VAL 55 H VAL 55 -3.050 -2.357 -3.780 422 HA VAL 55 HA VAL 55 -0.948 -0.293 -3.947 423 HB VAL 55 HB VAL 55 -3.812 -0.099 -4.889 424 HG11 VAL 55 1HG1 VAL 55 -3.022 2.015 -3.975 425 HG12 VAL 55 2HG1 VAL 55 -1.584 1.932 -4.995 426 HG13 VAL 55 3HG1 VAL 55 -3.178 2.113 -5.728 427 HG21 VAL 55 3HG2 VAL 55 -2.955 -0.068 -7.107 428 HG22 VAL 55 1HG2 VAL 55 -1.291 0.019 -6.530 429 HG23 VAL 55 2HG2 VAL 55 -2.229 -1.456 -6.297 430 H LEU 56 H LEU 56 -1.037 1.434 -2.540 431 HA LEU 56 HA LEU 56 -3.166 1.418 -0.517 432 HB2 LEU 56 1HB LEU 56 -0.203 1.346 -0.079 433 HB3 LEU 56 2HB LEU 56 -1.277 2.058 1.124 434 HG LEU 56 HG LEU 56 -2.315 -0.494 0.499 435 HD11 LEU 56 1HD1 LEU 56 0.299 -0.587 -0.194 436 HD12 LEU 56 2HD1 LEU 56 -0.618 -1.962 0.418 437 HD13 LEU 56 3HD1 LEU 56 0.390 -1.017 1.514 438 HD21 LEU 56 3HD2 LEU 56 -1.555 -0.916 2.895 439 HD22 LEU 56 1HD2 LEU 56 -2.660 0.433 2.625 440 HD23 LEU 56 2HD2 LEU 56 -0.939 0.737 2.867 441 H LEU 57 H LEU 57 -3.690 3.416 0.360 442 HA LEU 57 HA LEU 57 -2.343 5.746 -0.836 443 HB2 LEU 57 1HB LEU 57 -4.384 5.548 -2.009 444 HB3 LEU 57 2HB LEU 57 -5.283 5.203 -0.533 445 HG LEU 57 HG LEU 57 -4.812 7.563 0.187 446 HD11 LEU 57 1HD1 LEU 57 -3.870 9.123 -1.219 447 HD12 LEU 57 2HD1 LEU 57 -4.190 8.169 -2.668 448 HD13 LEU 57 3HD1 LEU 57 -2.893 7.697 -1.570 449 HD21 LEU 57 3HD2 LEU 57 -6.449 6.909 -2.237 450 HD22 LEU 57 1HD2 LEU 57 -6.429 8.535 -1.554 451 HD23 LEU 57 2HD2 LEU 57 -6.980 7.175 -0.576 452 H ALA 58 H ALA 58 -2.318 7.654 0.418 453 HA ALA 58 HA ALA 58 -2.608 7.146 3.295 454 HB1 ALA 58 3HB ALA 58 -1.291 9.543 3.070 455 HB2 ALA 58 1HB ALA 58 -0.531 7.966 3.285 456 HB3 ALA 58 2HB ALA 58 -0.711 8.645 1.668 457 HA PRO 59 HA PRO 59 -5.902 9.993 3.836 458 HB2 PRO 59 1HB PRO 59 -5.238 11.219 6.165 459 HB3 PRO 59 2HB PRO 59 -5.795 9.543 6.086 460 HG2 PRO 59 1HG PRO 59 -3.004 10.604 6.299 461 HG3 PRO 59 2HG PRO 59 -3.751 9.242 7.154 462 HD2 PRO 59 1HD PRO 59 -2.130 8.905 5.011 463 HD3 PRO 59 2HD PRO 59 -3.481 7.810 5.367 464 H GLN 60 H GLN 60 -6.198 12.437 4.705 465 HA GLN 60 HA GLN 60 -6.008 14.635 4.151 466 HB2 GLN 60 1HB GLN 60 -3.686 14.012 5.292 467 HB3 GLN 60 2HB GLN 60 -3.078 14.380 3.684 468 HG2 GLN 60 1HG GLN 60 -4.884 16.297 5.094 469 HG3 GLN 60 2HG GLN 60 -3.162 16.241 5.469 470 HE21 GLN 60 2HE2 GLN 60 -5.452 17.673 3.583 471 HE22 GLN 60 1HE2 GLN 60 -4.442 18.272 2.314 472 H SER 61 H SER 61 -6.898 13.245 2.083 473 HA SER 61 HA SER 61 -6.156 14.781 -0.159 474 HB2 SER 61 1HB SER 61 -5.020 13.207 -1.543 475 HB3 SER 61 2HB SER 61 -4.180 13.191 0.007 476 HG SER 61 HG SER 61 -4.507 11.110 -0.182 477 H ARG 62 H ARG 62 -8.101 15.032 -1.020 478 HA ARG 62 HA ARG 62 -10.053 12.873 -0.890 479 HB2 ARG 62 1HB ARG 62 -10.358 15.707 -1.899 480 HB3 ARG 62 2HB ARG 62 -11.662 14.553 -1.653 481 HG2 ARG 62 1HG ARG 62 -11.650 14.806 0.604 482 HG3 ARG 62 2HG ARG 62 -9.922 15.162 0.666 483 HD2 ARG 62 1HD ARG 62 -10.744 17.316 -0.678 484 HD3 ARG 62 2HD ARG 62 -12.227 16.967 0.210 485 HE ARG 62 HE ARG 62 -10.203 16.879 2.073 486 HH11 ARG 62 1HH1 ARG 62 -11.487 19.227 -0.154 487 HH12 ARG 62 2HH1 ARG 62 -11.071 20.587 0.837 488 HH21 ARG 62 1HH2 ARG 62 -9.649 18.660 3.385 489 HH22 ARG 62 2HH2 ARG 62 -10.024 20.262 2.849 490 H PHE 63 H PHE 63 -8.405 14.867 -3.310 491 HA PHE 63 HA PHE 63 -9.667 13.777 -5.576 492 HB2 PHE 63 1HB PHE 63 -7.811 14.738 -6.850 493 HB3 PHE 63 2HB PHE 63 -8.384 15.875 -5.633 494 HD1 PHE 63 HD1 PHE 63 -7.024 16.415 -3.697 495 HD2 PHE 63 HD2 PHE 63 -5.629 13.738 -6.697 496 HE1 PHE 63 HE1 PHE 63 -4.735 16.628 -2.817 497 HE2 PHE 63 HE2 PHE 63 -3.339 13.946 -5.823 498 HZ PHE 63 HZ PHE 63 -2.889 15.392 -3.880 499 H ASN 64 H ASN 64 -6.822 12.792 -3.752 500 HA ASN 64 HA ASN 64 -5.809 10.886 -5.533 501 HB2 ASN 64 1HB ASN 64 -5.250 11.756 -2.899 502 HB3 ASN 64 2HB ASN 64 -5.444 10.008 -2.823 503 HD21 ASN 64 2HD2 ASN 64 -4.434 9.092 -5.098 504 HD22 ASN 64 1HD2 ASN 64 -2.767 9.518 -5.264 505 H LYS 65 H LYS 65 -7.740 10.246 -2.599 506 HA LYS 65 HA LYS 65 -8.244 7.570 -3.045 507 HB2 LYS 65 1HB LYS 65 -10.301 7.920 -1.644 508 HB3 LYS 65 2HB LYS 65 -8.814 8.539 -0.936 509 HG2 LYS 65 1HG LYS 65 -9.434 10.800 -1.759 510 HG3 LYS 65 2HG LYS 65 -10.978 10.132 -2.291 511 HD2 LYS 65 1HD LYS 65 -10.360 9.444 0.465 512 HD3 LYS 65 2HD LYS 65 -10.416 11.189 0.204 513 HE2 LYS 65 1HE LYS 65 -12.604 10.260 0.846 514 HE3 LYS 65 2HE LYS 65 -12.632 11.009 -0.749 515 HZ1 LYS 65 3HZ LYS 65 -12.067 8.151 -0.644 516 HZ2 LYS 65 1HZ LYS 65 -12.962 9.036 -1.773 517 HZ3 LYS 65 2HZ LYS 65 -13.650 8.626 -0.284 518 H LYS 66 H LYS 66 -10.088 10.373 -4.183 519 HA LYS 66 HA LYS 66 -12.238 9.057 -5.344 520 HB2 LYS 66 1HB LYS 66 -11.774 11.590 -5.069 521 HB3 LYS 66 2HB LYS 66 -10.971 11.462 -6.629 522 HG2 LYS 66 1HG LYS 66 -12.960 10.888 -7.731 523 HG3 LYS 66 2HG LYS 66 -13.792 10.530 -6.216 524 HD2 LYS 66 1HD LYS 66 -13.228 13.071 -5.731 525 HD3 LYS 66 2HD LYS 66 -13.200 13.150 -7.494 526 HE2 LYS 66 1HE LYS 66 -15.411 13.680 -6.830 527 HE3 LYS 66 2HE LYS 66 -15.460 12.037 -7.466 528 HZ1 LYS 66 3HZ LYS 66 -16.411 12.850 -5.044 529 HZ2 LYS 66 1HZ LYS 66 -14.946 12.099 -4.654 530 HZ3 LYS 66 2HZ LYS 66 -16.130 11.250 -5.513 531 H ARG 67 H ARG 67 -9.358 10.247 -7.089 532 HA ARG 67 HA ARG 67 -9.879 8.959 -9.499 533 HB2 ARG 67 1HB ARG 67 -7.539 10.212 -8.222 534 HB3 ARG 67 2HB ARG 67 -7.153 9.013 -9.448 535 HG2 ARG 67 1HG ARG 67 -8.612 10.232 -11.034 536 HG3 ARG 67 2HG ARG 67 -8.850 11.472 -9.801 537 HD2 ARG 67 1HD ARG 67 -7.043 12.474 -10.638 538 HD3 ARG 67 2HD ARG 67 -6.105 11.170 -9.910 539 HE ARG 67 HE ARG 67 -5.645 10.428 -12.011 540 HH11 ARG 67 1HH1 ARG 67 -8.559 12.329 -12.132 541 HH12 ARG 67 2HH1 ARG 67 -8.711 12.224 -13.855 542 HH21 ARG 67 1HH2 ARG 67 -5.835 10.282 -14.280 543 HH22 ARG 67 2HH2 ARG 67 -7.161 11.059 -15.076 544 H LEU 68 H LEU 68 -7.667 7.901 -6.906 545 HA LEU 68 HA LEU 68 -6.892 5.478 -7.963 546 HB2 LEU 68 1HB LEU 68 -7.162 6.570 -5.224 547 HB3 LEU 68 2HB LEU 68 -6.975 4.824 -5.371 548 HG LEU 68 HG LEU 68 -4.844 5.098 -6.467 549 HD11 LEU 68 1HD1 LEU 68 -4.017 7.640 -6.339 550 HD12 LEU 68 2HD1 LEU 68 -5.730 7.909 -6.659 551 HD13 LEU 68 3HD1 LEU 68 -4.767 6.940 -7.773 552 HD21 LEU 68 3HD2 LEU 68 -5.372 5.706 -3.822 553 HD22 LEU 68 1HD2 LEU 68 -4.310 7.011 -4.352 554 HD23 LEU 68 2HD2 LEU 68 -3.795 5.331 -4.516 555 H GLU 69 H GLU 69 -9.896 6.320 -6.371 556 HA GLU 69 HA GLU 69 -10.833 3.656 -6.021 557 HB2 GLU 69 1HB GLU 69 -11.953 6.382 -5.767 558 HB3 GLU 69 2HB GLU 69 -13.117 5.105 -6.095 559 HG2 GLU 69 1HG GLU 69 -11.112 4.803 -3.901 560 HG3 GLU 69 2HG GLU 69 -12.586 5.736 -3.652 561 H GLU 70 H GLU 70 -11.787 6.191 -8.345 562 HA GLU 70 HA GLU 70 -13.419 4.553 -9.925 563 HB2 GLU 70 1HB GLU 70 -13.100 6.301 -11.682 564 HB3 GLU 70 2HB GLU 70 -13.588 6.938 -10.118 565 HG2 GLU 70 1HG GLU 70 -11.248 7.533 -9.654 566 HG3 GLU 70 2HG GLU 70 -10.803 6.953 -11.258 567 H ILE 71 H ILE 71 -10.022 4.702 -9.652 568 HA ILE 71 HA ILE 71 -9.555 3.503 -12.269 569 HB ILE 71 HB ILE 71 -7.605 4.248 -10.086 570 HG12 ILE 71 1HG1 ILE 71 -7.799 5.592 -12.756 571 HG13 ILE 71 2HG1 ILE 71 -8.934 6.034 -11.485 572 HG21 ILE 71 1HG2 ILE 71 -7.284 2.895 -12.711 573 HG22 ILE 71 2HG2 ILE 71 -6.046 4.046 -12.212 574 HG23 ILE 71 3HG2 ILE 71 -6.412 2.651 -11.198 575 HD11 ILE 71 3HD1 ILE 71 -6.515 6.123 -10.198 576 HD12 ILE 71 1HD1 ILE 71 -6.133 6.723 -11.812 577 HD13 ILE 71 2HD1 ILE 71 -7.392 7.504 -10.855 578 H THR 72 H THR 72 -9.459 2.673 -8.852 579 HA THR 72 HA THR 72 -8.270 0.117 -9.161 580 HB THR 72 HB THR 72 -9.420 -0.307 -6.880 581 HG1 THR 72 HG1 THR 72 -10.830 1.197 -6.405 582 HG21 THR 72 3HG2 THR 72 -7.826 1.585 -5.885 583 HG22 THR 72 1HG2 THR 72 -7.249 1.602 -7.551 584 HG23 THR 72 2HG2 THR 72 -7.194 0.109 -6.613 585 H LYS 73 H LYS 73 -11.600 1.262 -9.176 586 HA LYS 73 HA LYS 73 -13.002 -1.095 -8.952 587 HB2 LYS 73 1HB LYS 73 -13.491 1.544 -10.115 588 HB3 LYS 73 2HB LYS 73 -14.408 0.264 -10.901 589 HG2 LYS 73 1HG LYS 73 -14.388 0.756 -7.932 590 HG3 LYS 73 2HG LYS 73 -15.611 1.377 -9.043 591 HD2 LYS 73 1HD LYS 73 -15.438 -1.341 -9.622 592 HD3 LYS 73 2HD LYS 73 -15.354 -1.251 -7.862 593 HE2 LYS 73 1HE LYS 73 -17.451 -0.314 -7.677 594 HE3 LYS 73 2HE LYS 73 -17.412 0.353 -9.308 595 HZ1 LYS 73 3HZ LYS 73 -18.946 -1.475 -9.214 596 HZ2 LYS 73 1HZ LYS 73 -17.761 -2.505 -8.586 597 HZ3 LYS 73 2HZ LYS 73 -17.622 -1.923 -10.168 598 HA PRO 74 HA PRO 74 -12.677 -1.847 -13.706 599 HB2 PRO 74 1HB PRO 74 -11.001 -0.248 -15.121 600 HB3 PRO 74 2HB PRO 74 -12.701 0.148 -14.846 601 HG2 PRO 74 1HG PRO 74 -10.268 1.147 -13.416 602 HG3 PRO 74 2HG PRO 74 -11.694 2.048 -13.962 603 HD2 PRO 74 1HD PRO 74 -11.361 1.269 -11.391 604 HD3 PRO 74 2HD PRO 74 -12.960 1.390 -12.151 605 H LYS 75 H LYS 75 -9.702 -0.635 -12.209 606 HA LYS 75 HA LYS 75 -7.915 -2.339 -13.570 607 HB2 LYS 75 1HB LYS 75 -7.779 -0.772 -11.016 608 HB3 LYS 75 2HB LYS 75 -6.480 -1.880 -11.441 609 HG2 LYS 75 1HG LYS 75 -7.371 0.110 -13.462 610 HG3 LYS 75 2HG LYS 75 -6.383 0.655 -12.105 611 HD2 LYS 75 1HD LYS 75 -4.605 -0.792 -12.702 612 HD3 LYS 75 2HD LYS 75 -5.616 -1.682 -13.842 613 HE2 LYS 75 1HE LYS 75 -5.009 1.244 -14.174 614 HE3 LYS 75 2HE LYS 75 -3.953 -0.014 -14.815 615 HZ1 LYS 75 3HZ LYS 75 -6.792 0.471 -15.526 616 HZ2 LYS 75 1HZ LYS 75 -5.918 -0.891 -16.023 617 HZ3 LYS 75 2HZ LYS 75 -5.441 0.651 -16.527 618 H GLY 76 H GLY 76 -10.080 -2.865 -10.933 619 HA2 GLY 76 1HA GLY 76 -10.509 -4.699 -9.617 620 HA3 GLY 76 2HA GLY 76 -9.926 -5.630 -10.990 621 H ILE 77 H ILE 77 -8.577 -3.610 -8.377 622 HA ILE 77 HA ILE 77 -6.727 -5.793 -7.746 623 HB ILE 77 HB ILE 77 -4.887 -4.114 -7.435 624 HG12 ILE 77 1HG1 ILE 77 -5.811 -2.198 -9.348 625 HG13 ILE 77 2HG1 ILE 77 -6.993 -2.305 -8.047 626 HG21 ILE 77 1HG2 ILE 77 -4.678 -5.504 -9.303 627 HG22 ILE 77 2HG2 ILE 77 -6.018 -4.725 -10.144 628 HG23 ILE 77 3HG2 ILE 77 -4.484 -3.876 -9.951 629 HD11 ILE 77 3HD1 ILE 77 -5.436 -1.651 -6.432 630 HD12 ILE 77 1HD1 ILE 77 -4.068 -1.956 -7.502 631 HD13 ILE 77 2HD1 ILE 77 -5.140 -0.590 -7.808 632 HA PRO 78 HA PRO 78 -7.663 -4.867 -3.558 633 HB2 PRO 78 1HB PRO 78 -5.344 -5.571 -2.335 634 HB3 PRO 78 2HB PRO 78 -6.475 -6.753 -3.002 635 HG2 PRO 78 1HG PRO 78 -3.949 -5.672 -4.189 636 HG3 PRO 78 2HG PRO 78 -4.546 -7.341 -4.160 637 HD2 PRO 78 1HD PRO 78 -4.781 -5.748 -6.337 638 HD3 PRO 78 2HD PRO 78 -5.981 -6.991 -5.930 639 H ILE 79 H ILE 79 -7.905 -2.781 -3.009 640 HA ILE 79 HA ILE 79 -5.483 -1.118 -2.766 641 HB ILE 79 HB ILE 79 -6.957 -0.207 -4.445 642 HG12 ILE 79 1HG1 ILE 79 -7.365 2.025 -3.485 643 HG13 ILE 79 2HG1 ILE 79 -7.164 1.365 -1.866 644 HG21 ILE 79 1HG2 ILE 79 -9.023 -1.296 -3.664 645 HG22 ILE 79 2HG2 ILE 79 -9.102 -0.147 -2.329 646 HG23 ILE 79 3HG2 ILE 79 -9.249 0.422 -3.991 647 HD11 ILE 79 3HD1 ILE 79 -4.994 1.740 -1.985 648 HD12 ILE 79 1HD1 ILE 79 -4.873 0.678 -3.388 649 HD13 ILE 79 2HD1 ILE 79 -5.196 2.399 -3.608 650 H GLU 80 H GLU 80 -5.014 -0.224 -0.842 651 HA GLU 80 HA GLU 80 -7.004 -0.504 1.313 652 HB2 GLU 80 1HB GLU 80 -3.996 -0.682 1.565 653 HB3 GLU 80 2HB GLU 80 -5.155 -0.845 2.877 654 HG2 GLU 80 1HG GLU 80 -4.628 -2.724 0.605 655 HG3 GLU 80 2HG GLU 80 -4.522 -3.029 2.338 656 H ILE 81 H ILE 81 -7.233 1.177 2.764 657 HA ILE 81 HA ILE 81 -5.822 3.667 2.054 658 HB ILE 81 HB ILE 81 -8.585 3.482 3.254 659 HG12 ILE 81 1HG1 ILE 81 -8.565 2.528 0.984 660 HG13 ILE 81 2HG1 ILE 81 -9.439 4.055 1.031 661 HG21 ILE 81 1HG2 ILE 81 -8.515 5.895 2.169 662 HG22 ILE 81 2HG2 ILE 81 -7.900 5.588 3.793 663 HG23 ILE 81 3HG2 ILE 81 -6.783 5.695 2.433 664 HD11 ILE 81 3HD1 ILE 81 -6.591 3.746 0.115 665 HD12 ILE 81 1HD1 ILE 81 -7.995 3.798 -0.951 666 HD13 ILE 81 2HD1 ILE 81 -7.582 5.203 0.034 667 H ILE 82 H ILE 82 -4.668 4.614 3.605 668 HA ILE 82 HA ILE 82 -4.591 3.440 6.240 669 HB ILE 82 HB ILE 82 -3.072 5.826 5.182 670 HG12 ILE 82 1HG1 ILE 82 -2.264 2.915 5.347 671 HG13 ILE 82 2HG1 ILE 82 -2.626 3.797 3.868 672 HG21 ILE 82 1HG2 ILE 82 -1.530 5.366 7.034 673 HG22 ILE 82 2HG2 ILE 82 -3.151 5.757 7.608 674 HG23 ILE 82 3HG2 ILE 82 -2.601 4.081 7.596 675 HD11 ILE 82 3HD1 ILE 82 -0.721 5.276 4.307 676 HD12 ILE 82 1HD1 ILE 82 -0.348 4.344 5.756 677 HD13 ILE 82 2HD1 ILE 82 -0.242 3.585 4.168 678 H ASN 83 H ASN 83 -5.432 4.237 8.078 679 HA ASN 83 HA ASN 83 -7.339 6.371 7.914 680 HB2 ASN 83 1HB ASN 83 -6.823 4.189 9.660 681 HB3 ASN 83 2HB ASN 83 -6.787 5.659 10.630 682 HD21 ASN 83 2HD2 ASN 83 -8.641 6.917 10.803 683 HD22 ASN 83 1HD2 ASN 83 -10.202 6.310 10.378 684 H THR 84 H THR 84 -7.337 8.287 9.215 685 HA THR 84 HA THR 84 -5.068 9.844 9.029 686 HB THR 84 HB THR 84 -6.749 10.567 11.321 687 HG1 THR 84 HG1 THR 84 -7.953 10.324 8.747 688 HG21 THR 84 3HG2 THR 84 -6.649 12.109 8.782 689 HG22 THR 84 1HG2 THR 84 -5.152 11.933 9.696 690 HG23 THR 84 2HG2 THR 84 -6.564 12.673 10.450 691 H ILE 85 H ILE 85 -6.239 8.004 11.828 692 HA ILE 85 HA ILE 85 -4.200 8.834 13.605 693 HB ILE 85 HB ILE 85 -5.802 6.273 13.684 694 HG12 ILE 85 1HG1 ILE 85 -6.369 8.890 15.088 695 HG13 ILE 85 2HG1 ILE 85 -7.148 8.399 13.588 696 HG21 ILE 85 1HG2 ILE 85 -4.089 7.693 15.698 697 HG22 ILE 85 2HG2 ILE 85 -5.358 6.570 16.185 698 HG23 ILE 85 3HG2 ILE 85 -4.021 6.009 15.181 699 HD11 ILE 85 3HD1 ILE 85 -7.493 7.339 16.342 700 HD12 ILE 85 1HD1 ILE 85 -8.704 7.749 15.127 701 HD13 ILE 85 2HD1 ILE 85 -7.763 6.265 14.970 702 H ASP 86 H ASP 86 -4.613 5.749 11.857 703 HA ASP 86 HA ASP 86 -2.228 4.552 12.560 704 HB2 ASP 86 1HB ASP 86 -4.117 4.291 10.294 705 HB3 ASP 86 2HB ASP 86 -2.507 3.622 10.042 706 H TYR 87 H TYR 87 -2.821 7.086 10.240 707 HA TYR 87 HA TYR 87 -0.228 6.897 9.005 708 HB2 TYR 87 1HB TYR 87 -2.201 7.742 7.776 709 HB3 TYR 87 2HB TYR 87 -2.275 9.122 8.868 710 HD1 TYR 87 HD1 TYR 87 0.031 7.430 6.473 711 HD2 TYR 87 HD2 TYR 87 -1.150 11.078 8.316 712 HE1 TYR 87 HE1 TYR 87 1.575 8.663 5.008 713 HE2 TYR 87 HE2 TYR 87 0.389 12.321 6.856 714 HH TYR 87 HH TYR 87 2.302 12.007 5.506 715 H GLY 88 H GLY 88 -1.775 8.960 11.428 716 HA2 GLY 88 1HA GLY 88 0.409 10.754 11.721 717 HA3 GLY 88 2HA GLY 88 -0.912 10.538 12.859 718 H THR 89 H THR 89 -0.360 7.661 13.156 719 HA THR 89 HA THR 89 1.823 7.928 15.082 720 HB THR 89 HB THR 89 -0.207 6.987 15.985 721 HG1 THR 89 HG1 THR 89 0.902 5.538 17.068 722 HG21 THR 89 3HG2 THR 89 -0.435 4.457 14.814 723 HG22 THR 89 1HG2 THR 89 -0.270 5.581 13.467 724 HG23 THR 89 2HG2 THR 89 -1.555 5.810 14.652 725 H MET 90 H MET 90 1.053 6.400 12.071 726 HA MET 90 HA MET 90 2.283 5.158 10.619 727 HB2 MET 90 1HB MET 90 4.689 5.752 12.335 728 HB3 MET 90 2HB MET 90 4.651 5.393 10.614 729 HG2 MET 90 1HG MET 90 4.656 7.568 10.229 730 HG3 MET 90 2HG MET 90 3.038 7.642 10.922 731 HE1 MET 90 3HE MET 90 6.465 6.869 12.004 732 HE2 MET 90 1HE MET 90 7.067 8.495 12.332 733 HE3 MET 90 2HE MET 90 6.529 7.468 13.661 734 H ASN 91 H ASN 91 1.265 3.220 11.211 735 HA ASN 91 HA ASN 91 2.766 1.519 13.088 736 HB2 ASN 91 1HB ASN 91 -0.103 1.836 12.490 737 HB3 ASN 91 2HB ASN 91 0.437 0.167 12.652 738 HD21 ASN 91 2HD2 ASN 91 2.119 0.027 14.591 739 HD22 ASN 91 1HD2 ASN 91 1.510 0.674 16.073 740 H GLY 92 H GLY 92 4.326 0.743 11.677 741 HA2 GLY 92 1HA GLY 92 4.002 -0.125 9.074 742 HA3 GLY 92 2HA GLY 92 5.200 -0.770 10.187 743 H GLU 93 H GLU 93 3.633 -2.040 12.048 744 HA GLU 93 HA GLU 93 3.148 -4.510 10.878 745 HB2 GLU 93 1HB GLU 93 3.478 -3.990 13.339 746 HB3 GLU 93 2HB GLU 93 1.784 -3.520 13.379 747 HG2 GLU 93 1HG GLU 93 1.055 -5.706 12.924 748 HG3 GLU 93 2HG GLU 93 2.666 -6.225 12.431 749 H LYS 94 H LYS 94 0.789 -2.029 11.850 750 HA LYS 94 HA LYS 94 -1.506 -3.385 10.987 751 HB2 LYS 94 1HB LYS 94 -0.980 -0.415 11.191 752 HB3 LYS 94 2HB LYS 94 -2.569 -1.133 10.961 753 HG2 LYS 94 1HG LYS 94 -0.906 -1.980 13.285 754 HG3 LYS 94 2HG LYS 94 -1.761 -0.437 13.338 755 HD2 LYS 94 1HD LYS 94 -3.771 -1.952 12.499 756 HD3 LYS 94 2HD LYS 94 -2.832 -3.210 13.305 757 HE2 LYS 94 1HE LYS 94 -2.738 -1.499 15.265 758 HE3 LYS 94 2HE LYS 94 -4.126 -0.772 14.457 759 HZ1 LYS 94 3HZ LYS 94 -5.454 -2.508 14.973 760 HZ2 LYS 94 1HZ LYS 94 -4.365 -2.683 16.257 761 HZ3 LYS 94 2HZ LYS 94 -4.213 -3.653 14.881 762 H VAL 95 H VAL 95 0.737 -1.281 9.275 763 HA VAL 95 HA VAL 95 -0.770 -0.952 6.917 764 HB VAL 95 HB VAL 95 2.238 -0.955 7.209 765 HG11 VAL 95 1HG1 VAL 95 1.917 0.701 5.227 766 HG12 VAL 95 2HG1 VAL 95 1.890 -1.037 4.926 767 HG13 VAL 95 3HG1 VAL 95 0.378 -0.134 5.018 768 HG21 VAL 95 3HG2 VAL 95 2.062 0.975 8.295 769 HG22 VAL 95 1HG2 VAL 95 1.098 1.650 6.980 770 HG23 VAL 95 2HG2 VAL 95 0.308 0.794 8.304 771 H LEU 96 H LEU 96 2.153 -2.964 7.290 772 HA LEU 96 HA LEU 96 1.882 -4.433 4.971 773 HB2 LEU 96 1HB LEU 96 3.219 -6.194 6.170 774 HB3 LEU 96 2HB LEU 96 3.913 -4.574 6.155 775 HG LEU 96 HG LEU 96 2.523 -4.610 8.524 776 HD11 LEU 96 1HD1 LEU 96 3.938 -7.252 8.372 777 HD12 LEU 96 2HD1 LEU 96 2.207 -7.097 8.078 778 HD13 LEU 96 3HD1 LEU 96 2.880 -6.638 9.642 779 HD21 LEU 96 3HD2 LEU 96 4.789 -3.734 8.083 780 HD22 LEU 96 1HD2 LEU 96 5.406 -5.387 8.100 781 HD23 LEU 96 2HD2 LEU 96 4.704 -4.693 9.562 782 H GLN 97 H GLN 97 0.385 -4.956 8.110 783 HA GLN 97 HA GLN 97 -0.648 -7.528 7.619 784 HB2 GLN 97 1HB GLN 97 -1.328 -5.318 9.518 785 HB3 GLN 97 2HB GLN 97 -2.410 -6.697 9.380 786 HG2 GLN 97 1HG GLN 97 0.522 -7.043 9.894 787 HG3 GLN 97 2HG GLN 97 -0.626 -6.750 11.200 788 HE21 GLN 97 2HE2 GLN 97 0.353 -8.962 8.686 789 HE22 GLN 97 1HE2 GLN 97 -0.466 -10.347 9.314 790 H LEU 98 H LEU 98 -2.101 -4.309 7.221 791 HA LEU 98 HA LEU 98 -4.608 -5.180 6.309 792 HB2 LEU 98 1HB LEU 98 -3.280 -2.723 6.708 793 HB3 LEU 98 2HB LEU 98 -3.873 -2.718 5.049 794 HG LEU 98 HG LEU 98 -5.548 -3.137 7.524 795 HD11 LEU 98 1HD1 LEU 98 -4.980 -0.868 7.485 796 HD12 LEU 98 2HD1 LEU 98 -6.551 -0.942 6.690 797 HD13 LEU 98 3HD1 LEU 98 -5.084 -0.779 5.727 798 HD21 LEU 98 3HD2 LEU 98 -7.194 -2.531 5.388 799 HD22 LEU 98 1HD2 LEU 98 -6.979 -4.118 6.127 800 HD23 LEU 98 2HD2 LEU 98 -6.027 -3.669 4.712 801 H ALA 99 H ALA 99 -1.707 -4.200 4.501 802 HA ALA 99 HA ALA 99 -2.718 -4.501 1.924 803 HB1 ALA 99 3HB ALA 99 -0.567 -3.433 2.447 804 HB2 ALA 99 1HB ALA 99 0.110 -5.014 2.839 805 HB3 ALA 99 2HB ALA 99 -0.412 -4.661 1.191 806 H ILE 100 H ILE 100 -0.765 -6.858 3.763 807 HA ILE 100 HA ILE 100 -0.971 -8.962 1.949 808 HB ILE 100 HB ILE 100 -0.729 -9.145 4.954 809 HG12 ILE 100 1HG1 ILE 100 1.501 -9.325 2.939 810 HG13 ILE 100 2HG1 ILE 100 1.002 -7.783 3.625 811 HG21 ILE 100 1HG2 ILE 100 -0.820 -11.155 2.845 812 HG22 ILE 100 2HG2 ILE 100 0.604 -11.284 3.876 813 HG23 ILE 100 3HG2 ILE 100 -1.008 -11.332 4.589 814 HD11 ILE 100 3HD1 ILE 100 2.770 -8.415 4.966 815 HD12 ILE 100 1HD1 ILE 100 1.366 -8.938 5.897 816 HD13 ILE 100 2HD1 ILE 100 2.296 -10.113 4.968 817 H ASN 101 H ASN 101 -2.957 -8.305 4.833 818 HA ASN 101 HA ASN 101 -4.673 -10.464 4.685 819 HB2 ASN 101 1HB ASN 101 -4.735 -9.008 6.595 820 HB3 ASN 101 2HB ASN 101 -5.203 -7.633 5.599 821 HD21 ASN 101 2HD2 ASN 101 -7.116 -7.156 6.521 822 HD22 ASN 101 1HD2 ASN 101 -8.477 -8.219 6.545 823 H ALA 102 H ALA 102 -4.848 -7.374 2.979 824 HA ALA 102 HA ALA 102 -7.370 -7.819 1.773 825 HB1 ALA 102 3HB ALA 102 -6.607 -5.588 1.879 826 HB2 ALA 102 1HB ALA 102 -5.085 -5.990 1.085 827 HB3 ALA 102 2HB ALA 102 -6.593 -6.023 0.171 828 H PHE 103 H PHE 103 -4.045 -8.314 0.627 829 HA PHE 103 HA PHE 103 -4.717 -9.207 -1.955 830 HB2 PHE 103 1HB PHE 103 -2.443 -8.479 -1.273 831 HB3 PHE 103 2HB PHE 103 -2.287 -9.945 -0.310 832 HD1 PHE 103 HD2 PHE 103 -2.410 -8.572 -3.702 833 HD2 PHE 103 HD1 PHE 103 -1.898 -12.078 -1.344 834 HE1 PHE 103 HE2 PHE 103 -1.544 -9.766 -5.672 835 HE2 PHE 103 HE1 PHE 103 -1.029 -13.277 -3.308 836 HZ PHE 103 HZ PHE 103 -0.853 -12.122 -5.476 837 H ASN 104 H ASN 104 -4.542 -10.842 1.131 838 HA ASN 104 HA ASN 104 -4.782 -13.475 -0.039 839 HB2 ASN 104 1HB ASN 104 -4.372 -12.357 2.663 840 HB3 ASN 104 2HB ASN 104 -5.301 -13.852 2.604 841 HD21 ASN 104 2HD2 ASN 104 -2.587 -12.687 0.651 842 HD22 ASN 104 1HD2 ASN 104 -1.544 -14.021 0.993 843 H ASN 105 H ASN 105 -6.867 -11.028 1.285 844 HA ASN 105 HA ASN 105 -9.136 -12.755 1.626 845 HB2 ASN 105 1HB ASN 105 -9.054 -10.828 3.029 846 HB3 ASN 105 2HB ASN 105 -8.804 -9.754 1.654 847 HD21 ASN 105 2HD2 ASN 105 -10.549 -9.287 0.286 848 HD22 ASN 105 1HD2 ASN 105 -12.183 -9.517 0.798 849 H LYS 106 H LYS 106 -7.964 -10.549 -0.851 850 HA LYS 106 HA LYS 106 -10.324 -10.712 -2.464 851 HB2 LYS 106 1HB LYS 106 -8.971 -9.560 -4.168 852 HB3 LYS 106 2HB LYS 106 -8.866 -8.765 -2.603 853 HG2 LYS 106 1HG LYS 106 -6.662 -8.911 -2.663 854 HG3 LYS 106 2HG LYS 106 -6.767 -10.670 -2.768 855 HD2 LYS 106 1HD LYS 106 -7.175 -10.338 -5.259 856 HD3 LYS 106 2HD LYS 106 -6.662 -8.667 -5.010 857 HE2 LYS 106 1HE LYS 106 -4.503 -9.241 -4.868 858 HE3 LYS 106 2HE LYS 106 -4.848 -10.616 -3.822 859 HZ1 LYS 106 3HZ LYS 106 -5.659 -10.953 -6.577 860 HZ2 LYS 106 1HZ LYS 106 -4.857 -12.027 -5.544 861 HZ3 LYS 106 2HZ LYS 106 -3.988 -10.820 -6.349 862 H SER 107 H SER 107 -7.424 -12.575 -2.126 863 HA SER 107 HA SER 107 -7.210 -13.810 -4.592 864 HB2 SER 107 1HB SER 107 -5.594 -14.103 -2.739 865 HB3 SER 107 2HB SER 107 -6.773 -15.099 -1.886 866 HG SER 107 HG SER 107 -5.153 -16.244 -3.181 867 H SER 108 H SER 108 -7.870 -15.954 -5.283 868 HA SER 108 HA SER 108 -9.434 -17.533 -5.765 869 HB2 SER 108 1HB SER 108 -9.044 -18.080 -3.317 870 HB3 SER 108 2HB SER 108 -10.490 -17.135 -2.960 871 HG SER 108 HG SER 108 -10.251 -19.648 -4.039 872 H VAL 109 H VAL 109 -11.903 -17.920 -5.781 873 HA VAL 109 HA VAL 109 -13.505 -15.516 -5.570 874 HB VAL 109 HB VAL 109 -12.452 -15.285 -7.797 875 HG11 VAL 109 1HG1 VAL 109 -12.477 -17.899 -8.049 876 HG12 VAL 109 2HG1 VAL 109 -14.044 -17.595 -8.804 877 HG13 VAL 109 3HG1 VAL 109 -12.586 -16.854 -9.465 878 HG21 VAL 109 3HG2 VAL 109 -14.546 -14.231 -7.577 879 HG22 VAL 109 1HG2 VAL 109 -14.640 -15.135 -9.088 880 HG23 VAL 109 2HG2 VAL 109 -15.417 -15.764 -7.635 Start of MODEL 5 1 H1 GLY 1 H GLY 1 11.550 -21.555 -7.957 2 HA2 GLY 1 1HA GLY 1 9.173 -19.988 -8.382 3 HA3 GLY 1 2HA GLY 1 9.431 -21.171 -7.108 4 HA PRO 2 HA PRO 2 11.358 -17.017 -5.529 5 HB2 PRO 2 1HB PRO 2 10.801 -14.800 -6.994 6 HB3 PRO 2 2HB PRO 2 12.231 -15.802 -7.272 7 HG2 PRO 2 1HG PRO 2 9.621 -15.780 -8.736 8 HG3 PRO 2 2HG PRO 2 11.268 -15.875 -9.387 9 HD2 PRO 2 1HD PRO 2 9.678 -18.051 -9.121 10 HD3 PRO 2 2HD PRO 2 11.443 -18.132 -8.952 11 H GLY 3 H GLY 3 9.550 -17.633 -4.133 12 HA2 GLY 3 1HA GLY 3 6.988 -16.383 -4.493 13 HA3 GLY 3 2HA GLY 3 7.517 -17.294 -3.086 14 H SER 4 H SER 4 6.913 -14.214 -4.376 15 HA SER 4 HA SER 4 7.614 -12.989 -1.831 16 HB2 SER 4 1HB SER 4 8.701 -11.052 -3.143 17 HB3 SER 4 2HB SER 4 9.650 -12.522 -2.920 18 HG SER 4 HG SER 4 9.839 -12.332 -5.022 19 H MET 5 H MET 5 6.853 -10.660 -1.776 20 HA MET 5 HA MET 5 4.510 -10.258 -3.506 21 HB2 MET 5 1HB MET 5 3.601 -11.103 -1.463 22 HB3 MET 5 2HB MET 5 4.622 -10.045 -0.498 23 HG2 MET 5 1HG MET 5 3.388 -8.130 -1.120 24 HG3 MET 5 2HG MET 5 2.537 -9.006 -2.390 25 HE1 MET 5 3HE MET 5 2.189 -10.202 1.965 26 HE2 MET 5 1HE MET 5 3.585 -9.511 1.137 27 HE3 MET 5 2HE MET 5 2.336 -8.452 1.794 28 H ASN 6 H ASN 6 4.138 -8.187 -4.151 29 HA ASN 6 HA ASN 6 6.075 -6.168 -3.231 30 HB2 ASN 6 1HB ASN 6 4.609 -5.971 -5.844 31 HB3 ASN 6 2HB ASN 6 6.151 -5.258 -5.381 32 HD21 ASN 6 2HD2 ASN 6 8.011 -6.527 -5.410 33 HD22 ASN 6 1HD2 ASN 6 8.079 -8.025 -6.268 34 H ILE 7 H ILE 7 5.295 -4.483 -2.158 35 HA ILE 7 HA ILE 7 2.406 -3.945 -2.305 36 HB ILE 7 HB ILE 7 4.364 -3.206 -0.127 37 HG12 ILE 7 1HG1 ILE 7 2.339 -4.854 0.883 38 HG13 ILE 7 2HG1 ILE 7 2.798 -5.590 -0.649 39 HG21 ILE 7 1HG2 ILE 7 2.702 -1.537 -0.152 40 HG22 ILE 7 2HG2 ILE 7 1.419 -2.708 -0.454 41 HG23 ILE 7 3HG2 ILE 7 2.219 -2.665 1.116 42 HD11 ILE 7 3HD1 ILE 7 4.039 -5.983 1.751 43 HD12 ILE 7 1HD1 ILE 7 4.735 -6.320 0.166 44 HD13 ILE 7 2HD1 ILE 7 5.078 -4.789 0.974 45 H LEU 8 H LEU 8 1.646 -1.916 -2.739 46 HA LEU 8 HA LEU 8 3.661 0.084 -3.527 47 HB2 LEU 8 1HB LEU 8 2.181 -0.970 -5.316 48 HB3 LEU 8 2HB LEU 8 0.854 -0.067 -4.587 49 HG LEU 8 HG LEU 8 1.863 0.984 -6.619 50 HD11 LEU 8 1HD1 LEU 8 2.416 2.957 -4.528 51 HD12 LEU 8 2HD1 LEU 8 0.867 2.131 -4.363 52 HD13 LEU 8 3HD1 LEU 8 1.250 2.996 -5.851 53 HD21 LEU 8 3HD2 LEU 8 4.260 0.375 -5.405 54 HD22 LEU 8 1HD2 LEU 8 4.111 2.116 -5.162 55 HD23 LEU 8 2HD2 LEU 8 4.039 1.444 -6.791 56 H LEU 9 H LEU 9 3.556 2.079 -2.666 57 HA LEU 9 HA LEU 9 1.227 2.713 -0.974 58 HB2 LEU 9 1HB LEU 9 3.196 2.196 0.373 59 HB3 LEU 9 2HB LEU 9 4.121 3.416 -0.499 60 HG LEU 9 HG LEU 9 2.761 5.178 0.460 61 HD11 LEU 9 1HD1 LEU 9 0.960 3.015 0.994 62 HD12 LEU 9 2HD1 LEU 9 0.683 4.754 1.103 63 HD13 LEU 9 3HD1 LEU 9 1.327 3.875 2.490 64 HD21 LEU 9 3HD2 LEU 9 3.921 5.215 2.382 65 HD22 LEU 9 1HD2 LEU 9 4.643 3.726 1.772 66 HD23 LEU 9 2HD2 LEU 9 3.296 3.652 2.909 67 H VAL 10 H VAL 10 0.328 4.700 -1.179 68 HA VAL 10 HA VAL 10 1.563 6.520 -3.143 69 HB VAL 10 HB VAL 10 -1.378 6.340 -2.494 70 HG11 VAL 10 1HG1 VAL 10 -1.729 7.946 -4.056 71 HG12 VAL 10 2HG1 VAL 10 -0.091 8.410 -3.592 72 HG13 VAL 10 3HG1 VAL 10 -0.357 7.442 -5.042 73 HG21 VAL 10 3HG2 VAL 10 -0.581 4.239 -3.493 74 HG22 VAL 10 1HG2 VAL 10 -1.654 5.122 -4.578 75 HG23 VAL 10 2HG2 VAL 10 0.088 5.148 -4.847 76 H CYS 11 H CYS 11 1.960 8.571 -2.559 77 HA CYS 11 HA CYS 11 0.540 10.045 -0.642 78 HB2 CYS 11 1HB CYS 11 2.278 10.147 1.149 79 HB3 CYS 11 2HB CYS 11 1.485 8.582 1.022 80 HG CYS 11 HG CYS 11 3.728 7.650 -0.653 81 H GLY 12 H GLY 12 3.600 9.487 -2.284 82 HA2 GLY 12 1HA GLY 12 4.785 10.966 -3.623 83 HA3 GLY 12 2HA GLY 12 3.642 12.228 -3.187 84 H ALA 13 H ALA 13 5.686 10.209 -1.105 85 HA ALA 13 HA ALA 13 6.700 12.642 0.157 86 HB1 ALA 13 3HB ALA 13 6.106 9.975 1.056 87 HB2 ALA 13 1HB ALA 13 7.759 10.421 1.482 88 HB3 ALA 13 2HB ALA 13 6.409 11.434 1.998 89 H GLY 14 H GLY 14 9.094 12.211 1.044 90 HA2 GLY 14 1HA GLY 14 10.814 12.502 -1.122 91 HA3 GLY 14 2HA GLY 14 11.324 12.106 0.512 92 H MET 15 H MET 15 12.092 11.180 -2.305 93 HA MET 15 HA MET 15 11.398 8.531 -2.722 94 HB2 MET 15 1HB MET 15 14.058 9.861 -3.267 95 HB3 MET 15 2HB MET 15 13.525 8.336 -3.962 96 HG2 MET 15 1HG MET 15 12.148 10.981 -4.361 97 HG3 MET 15 2HG MET 15 13.285 10.251 -5.491 98 HE1 MET 15 3HE MET 15 8.977 9.954 -5.768 99 HE2 MET 15 1HE MET 15 9.971 11.044 -4.802 100 HE3 MET 15 2HE MET 15 10.170 10.990 -6.554 101 H SER 16 H SER 16 13.919 9.888 -0.650 102 HA SER 16 HA SER 16 14.372 7.191 0.451 103 HB2 SER 16 1HB SER 16 16.534 8.506 1.332 104 HB3 SER 16 2HB SER 16 16.488 7.722 -0.247 105 HG SER 16 HG SER 16 16.388 9.625 -1.211 106 H THR 17 H THR 17 15.275 7.376 2.796 107 HA THR 17 HA THR 17 14.709 7.717 4.978 108 HB THR 17 HB THR 17 14.274 10.601 4.207 109 HG1 THR 17 HG1 THR 17 16.256 10.360 3.420 110 HG21 THR 17 3HG2 THR 17 15.303 10.956 6.469 111 HG22 THR 17 1HG2 THR 17 15.204 9.213 6.720 112 HG23 THR 17 2HG2 THR 17 13.732 10.158 6.496 113 H SER 18 H SER 18 12.708 6.479 4.464 114 HA SER 18 HA SER 18 10.308 8.171 4.729 115 HB2 SER 18 1HB SER 18 10.895 6.071 2.899 116 HB3 SER 18 2HB SER 18 9.618 5.501 3.972 117 HG SER 18 HG SER 18 8.295 6.767 2.963 118 H MET 19 H MET 19 9.304 8.084 6.618 119 HA MET 19 HA MET 19 10.128 6.479 8.755 120 HB2 MET 19 1HB MET 19 7.490 7.904 8.360 121 HB3 MET 19 2HB MET 19 8.078 7.267 9.891 122 HG2 MET 19 1HG MET 19 9.427 9.416 8.272 123 HG3 MET 19 2HG MET 19 8.402 9.687 9.679 124 HE1 MET 19 3HE MET 19 12.665 9.252 9.355 125 HE2 MET 19 1HE MET 19 11.375 10.041 8.447 126 HE3 MET 19 2HE MET 19 11.907 10.714 9.988 127 H LEU 20 H LEU 20 7.101 6.259 6.875 128 HA LEU 20 HA LEU 20 6.095 3.946 8.006 129 HB2 LEU 20 1HB LEU 20 5.753 5.363 5.445 130 HB3 LEU 20 2HB LEU 20 5.273 3.667 5.447 131 HG LEU 20 HG LEU 20 4.195 5.808 7.283 132 HD11 LEU 20 1HD1 LEU 20 3.502 5.995 4.904 133 HD12 LEU 20 2HD1 LEU 20 2.172 5.662 6.011 134 HD13 LEU 20 3HD1 LEU 20 2.833 4.367 5.014 135 HD21 LEU 20 3HD2 LEU 20 2.488 3.959 7.732 136 HD22 LEU 20 1HD2 LEU 20 4.074 3.804 8.487 137 HD23 LEU 20 2HD2 LEU 20 3.685 2.858 7.049 138 H VAL 21 H VAL 21 7.987 4.155 4.986 139 HA VAL 21 HA VAL 21 8.264 1.453 4.486 140 HB VAL 21 HB VAL 21 10.318 3.608 3.967 141 HG11 VAL 21 1HG1 VAL 21 10.451 1.690 1.963 142 HG12 VAL 21 2HG1 VAL 21 11.614 1.937 3.267 143 HG13 VAL 21 3HG1 VAL 21 10.313 0.760 3.455 144 HG21 VAL 21 3HG2 VAL 21 9.085 4.313 2.238 145 HG22 VAL 21 1HG2 VAL 21 8.696 2.667 1.736 146 HG23 VAL 21 2HG2 VAL 21 7.748 3.450 3.000 147 H GLN 22 H GLN 22 10.225 3.526 6.576 148 HA GLN 22 HA GLN 22 12.249 1.703 7.188 149 HB2 GLN 22 1HB GLN 22 11.138 4.140 8.475 150 HB3 GLN 22 2HB GLN 22 12.143 3.097 9.472 151 HG2 GLN 22 1HG GLN 22 13.222 3.751 6.813 152 HG3 GLN 22 2HG GLN 22 13.092 5.094 7.947 153 HE21 GLN 22 2HE2 GLN 22 14.895 5.442 9.005 154 HE22 GLN 22 1HE2 GLN 22 16.022 4.243 9.531 155 H ARG 23 H ARG 23 9.318 2.451 9.081 156 HA ARG 23 HA ARG 23 9.648 0.520 11.050 157 HB2 ARG 23 1HB ARG 23 7.131 1.700 9.869 158 HB3 ARG 23 2HB ARG 23 7.137 0.656 11.285 159 HG2 ARG 23 1HG ARG 23 8.953 2.475 12.057 160 HG3 ARG 23 2HG ARG 23 7.948 3.472 11.003 161 HD2 ARG 23 1HD ARG 23 6.367 3.597 12.557 162 HD3 ARG 23 2HD ARG 23 6.279 1.840 12.659 163 HE ARG 23 HE ARG 23 7.592 3.610 14.486 164 HH11 ARG 23 1HH1 ARG 23 7.593 0.390 13.163 165 HH12 ARG 23 2HH1 ARG 23 8.374 -0.316 14.540 166 HH21 ARG 23 1HH2 ARG 23 8.621 2.693 16.303 167 HH22 ARG 23 2HH2 ARG 23 8.958 0.994 16.325 168 H ILE 24 H ILE 24 7.565 0.271 8.160 169 HA ILE 24 HA ILE 24 6.812 -2.372 8.435 170 HB ILE 24 HB ILE 24 7.355 -0.909 5.848 171 HG12 ILE 24 1HG1 ILE 24 4.585 -1.269 6.738 172 HG13 ILE 24 2HG1 ILE 24 5.542 -0.257 7.814 173 HG21 ILE 24 1HG2 ILE 24 7.152 -3.103 5.175 174 HG22 ILE 24 2HG2 ILE 24 6.046 -3.514 6.484 175 HG23 ILE 24 3HG2 ILE 24 5.475 -2.562 5.114 176 HD11 ILE 24 3HD1 ILE 24 5.074 1.423 6.451 177 HD12 ILE 24 1HD1 ILE 24 6.160 0.672 5.283 178 HD13 ILE 24 2HD1 ILE 24 4.429 0.338 5.221 179 H GLU 25 H GLU 25 9.682 -1.062 6.805 180 HA GLU 25 HA GLU 25 10.684 -3.496 5.837 181 HB2 GLU 25 1HB GLU 25 11.923 -0.841 6.473 182 HB3 GLU 25 2HB GLU 25 12.943 -2.200 6.022 183 HG2 GLU 25 1HG GLU 25 10.620 -1.481 4.301 184 HG3 GLU 25 2HG GLU 25 12.097 -0.521 4.220 185 H LYS 26 H LYS 26 11.098 -1.861 8.932 186 HA LYS 26 HA LYS 26 13.110 -3.548 9.965 187 HB2 LYS 26 1HB LYS 26 11.462 -1.382 10.911 188 HB3 LYS 26 2HB LYS 26 11.531 -2.654 12.122 189 HG2 LYS 26 1HG LYS 26 14.084 -1.828 10.868 190 HG3 LYS 26 2HG LYS 26 13.323 -0.705 11.996 191 HD2 LYS 26 1HD LYS 26 14.732 -2.000 13.341 192 HD3 LYS 26 2HD LYS 26 13.137 -2.718 13.576 193 HE2 LYS 26 1HE LYS 26 13.706 -4.412 11.853 194 HE3 LYS 26 2HE LYS 26 15.328 -3.730 11.766 195 HZ1 LYS 26 3HZ LYS 26 14.193 -4.686 14.322 196 HZ2 LYS 26 1HZ LYS 26 15.817 -4.431 13.918 197 HZ3 LYS 26 2HZ LYS 26 14.976 -5.740 13.256 198 H TYR 27 H TYR 27 9.621 -3.498 10.727 199 HA TYR 27 HA TYR 27 9.515 -5.796 12.250 200 HB2 TYR 27 1HB TYR 27 7.603 -4.346 12.110 201 HB3 TYR 27 2HB TYR 27 7.448 -4.629 10.380 202 HD1 TYR 27 HD1 TYR 27 6.575 -6.771 9.543 203 HD2 TYR 27 HD2 TYR 27 6.754 -5.927 13.710 204 HE1 TYR 27 HE1 TYR 27 5.028 -8.631 9.981 205 HE2 TYR 27 HE2 TYR 27 5.207 -7.786 14.158 206 HH TYR 27 HH TYR 27 3.391 -9.282 11.772 207 H ALA 28 H ALA 28 9.092 -5.499 8.732 208 HA ALA 28 HA ALA 28 8.653 -8.230 8.224 209 HB1 ALA 28 3HB ALA 28 8.060 -7.054 6.389 210 HB2 ALA 28 1HB ALA 28 9.328 -5.849 6.615 211 HB3 ALA 28 2HB ALA 28 9.715 -7.414 5.899 212 H LYS 29 H LYS 29 11.628 -6.286 8.008 213 HA LYS 29 HA LYS 29 13.356 -8.311 7.191 214 HB2 LYS 29 1HB LYS 29 13.916 -5.892 7.244 215 HB3 LYS 29 2HB LYS 29 14.014 -5.978 8.998 216 HG2 LYS 29 1HG LYS 29 16.208 -6.236 8.545 217 HG3 LYS 29 2HG LYS 29 15.729 -7.928 8.396 218 HD2 LYS 29 1HD LYS 29 15.401 -7.528 5.944 219 HD3 LYS 29 2HD LYS 29 16.114 -5.929 6.172 220 HE2 LYS 29 1HE LYS 29 17.434 -8.588 6.711 221 HE3 LYS 29 2HE LYS 29 17.797 -7.482 5.387 222 HZ1 LYS 29 3HZ LYS 29 18.337 -7.120 8.273 223 HZ2 LYS 29 1HZ LYS 29 18.346 -5.816 7.194 224 HZ3 LYS 29 2HZ LYS 29 19.436 -7.093 6.988 225 H SER 30 H SER 30 12.050 -7.579 10.339 226 HA SER 30 HA SER 30 13.880 -9.328 11.733 227 HB2 SER 30 1HB SER 30 12.117 -7.240 12.468 228 HB3 SER 30 2HB SER 30 11.552 -8.692 13.292 229 HG SER 30 HG SER 30 13.091 -8.196 14.645 230 H LYS 31 H LYS 31 10.508 -9.388 10.680 231 HA LYS 31 HA LYS 31 9.926 -11.926 11.850 232 HB2 LYS 31 1HB LYS 31 8.539 -9.967 10.150 233 HB3 LYS 31 2HB LYS 31 8.070 -11.638 9.861 234 HG2 LYS 31 1HG LYS 31 8.028 -10.264 12.541 235 HG3 LYS 31 2HG LYS 31 6.627 -10.520 11.499 236 HD2 LYS 31 1HD LYS 31 7.556 -13.037 11.633 237 HD3 LYS 31 2HD LYS 31 8.112 -12.432 13.195 238 HE2 LYS 31 1HE LYS 31 5.999 -12.185 14.003 239 HE3 LYS 31 2HE LYS 31 5.321 -11.814 12.419 240 HZ1 LYS 31 3HZ LYS 31 5.467 -14.313 13.776 241 HZ2 LYS 31 1HZ LYS 31 6.161 -14.415 12.237 242 HZ3 LYS 31 2HZ LYS 31 4.565 -13.886 12.411 243 H ASN 32 H ASN 32 11.605 -10.953 9.060 244 HA ASN 32 HA ASN 32 12.596 -12.103 7.366 245 HB2 ASN 32 1HB ASN 32 13.089 -13.670 9.349 246 HB3 ASN 32 2HB ASN 32 11.786 -14.672 8.714 247 HD21 ASN 32 2HD2 ASN 32 12.308 -16.147 7.268 248 HD22 ASN 32 1HD2 ASN 32 13.766 -16.186 6.342 249 H ILE 33 H ILE 33 10.315 -11.188 6.565 250 HA ILE 33 HA ILE 33 8.827 -13.431 5.372 251 HB ILE 33 HB ILE 33 7.933 -10.575 5.778 252 HG12 ILE 33 1HG1 ILE 33 6.765 -13.025 7.077 253 HG13 ILE 33 2HG1 ILE 33 8.130 -12.179 7.797 254 HG21 ILE 33 1HG2 ILE 33 6.976 -11.551 3.763 255 HG22 ILE 33 2HG2 ILE 33 6.437 -12.954 4.685 256 HG23 ILE 33 3HG2 ILE 33 5.745 -11.367 5.013 257 HD11 ILE 33 3HD1 ILE 33 5.314 -11.269 7.438 258 HD12 ILE 33 1HD1 ILE 33 6.328 -11.246 8.880 259 HD13 ILE 33 2HD1 ILE 33 6.616 -10.089 7.580 260 H ASN 34 H ASN 34 8.572 -13.566 3.189 261 HA ASN 34 HA ASN 34 10.400 -12.045 1.567 262 HB2 ASN 34 1HB ASN 34 8.574 -14.373 1.110 263 HB3 ASN 34 2HB ASN 34 9.188 -13.480 -0.279 264 HD21 ASN 34 2HD2 ASN 34 9.689 -16.230 0.660 265 HD22 ASN 34 1HD2 ASN 34 11.405 -16.358 0.810 266 H ALA 35 H ALA 35 9.475 -9.936 1.831 267 HA ALA 35 HA ALA 35 7.455 -9.382 -0.178 268 HB1 ALA 35 3HB ALA 35 6.129 -7.973 1.412 269 HB2 ALA 35 1HB ALA 35 6.019 -9.711 1.695 270 HB3 ALA 35 2HB ALA 35 7.041 -8.712 2.729 271 H THR 36 H THR 36 7.172 -6.995 -0.487 272 HA THR 36 HA THR 36 9.401 -5.370 0.462 273 HB THR 36 HB THR 36 10.220 -6.418 -1.627 274 HG1 THR 36 HG1 THR 36 11.116 -4.453 -1.340 275 HG21 THR 36 3HG2 THR 36 8.144 -6.732 -2.816 276 HG22 THR 36 1HG2 THR 36 9.198 -5.693 -3.774 277 HG23 THR 36 2HG2 THR 36 7.862 -4.992 -2.861 278 H ILE 37 H ILE 37 9.068 -3.123 0.249 279 HA ILE 37 HA ILE 37 6.376 -2.315 -0.621 280 HB ILE 37 HB ILE 37 6.468 -2.506 1.862 281 HG12 ILE 37 1HG1 ILE 37 6.216 0.390 1.085 282 HG13 ILE 37 2HG1 ILE 37 5.068 -0.812 0.506 283 HG21 ILE 37 1HG2 ILE 37 8.255 -0.102 1.861 284 HG22 ILE 37 2HG2 ILE 37 7.859 -1.193 3.188 285 HG23 ILE 37 3HG2 ILE 37 8.922 -1.735 1.890 286 HD11 ILE 37 3HD1 ILE 37 4.606 -1.404 2.879 287 HD12 ILE 37 1HD1 ILE 37 5.620 -0.042 3.358 288 HD13 ILE 37 2HD1 ILE 37 4.146 0.238 2.429 289 H GLU 38 H GLU 38 6.180 -0.193 -1.399 290 HA GLU 38 HA GLU 38 8.507 1.518 -1.523 291 HB2 GLU 38 1HB GLU 38 8.706 -0.173 -3.424 292 HB3 GLU 38 2HB GLU 38 7.296 0.606 -4.127 293 HG2 GLU 38 1HG GLU 38 8.452 2.420 -4.781 294 HG3 GLU 38 2HG GLU 38 9.490 2.406 -3.357 295 H ALA 39 H ALA 39 7.960 3.627 -1.705 296 HA ALA 39 HA ALA 39 5.110 4.224 -2.152 297 HB1 ALA 39 3HB ALA 39 6.479 4.728 0.100 298 HB2 ALA 39 1HB ALA 39 6.792 6.224 -0.781 299 HB3 ALA 39 2HB ALA 39 5.132 5.719 -0.459 300 H ILE 40 H ILE 40 4.536 5.671 -3.679 301 HA ILE 40 HA ILE 40 6.498 7.478 -4.823 302 HB ILE 40 HB ILE 40 5.966 6.744 -7.156 303 HG12 ILE 40 1HG1 ILE 40 5.328 4.021 -6.577 304 HG13 ILE 40 2HG1 ILE 40 4.148 5.047 -5.771 305 HG21 ILE 40 1HG2 ILE 40 7.235 4.439 -5.754 306 HG22 ILE 40 2HG2 ILE 40 7.731 5.271 -7.226 307 HG23 ILE 40 3HG2 ILE 40 7.986 6.032 -5.656 308 HD11 ILE 40 3HD1 ILE 40 4.487 4.444 -8.593 309 HD12 ILE 40 1HD1 ILE 40 3.078 5.046 -7.720 310 HD13 ILE 40 2HD1 ILE 40 4.324 6.169 -8.265 311 H ALA 41 H ALA 41 5.297 8.555 -6.876 312 HA ALA 41 HA ALA 41 2.935 9.776 -5.737 313 HB1 ALA 41 3HB ALA 41 3.388 10.751 -8.350 314 HB2 ALA 41 1HB ALA 41 3.727 11.546 -6.812 315 HB3 ALA 41 2HB ALA 41 4.963 10.552 -7.583 316 H GLU 42 H GLU 42 1.327 10.424 -7.759 317 HA GLU 42 HA GLU 42 0.056 7.907 -8.387 318 HB2 GLU 42 1HB GLU 42 -1.739 9.359 -9.338 319 HB3 GLU 42 2HB GLU 42 -1.371 9.687 -7.650 320 HG2 GLU 42 1HG GLU 42 -0.611 11.760 -8.076 321 HG3 GLU 42 2HG GLU 42 0.115 11.297 -9.614 322 H THR 43 H THR 43 1.952 10.313 -10.018 323 HA THR 43 HA THR 43 1.251 9.831 -12.675 324 HB THR 43 HB THR 43 2.662 11.711 -12.103 325 HG1 THR 43 HG1 THR 43 3.322 11.432 -14.091 326 HG21 THR 43 3HG2 THR 43 3.889 10.448 -10.270 327 HG22 THR 43 1HG2 THR 43 4.865 11.534 -11.260 328 HG23 THR 43 2HG2 THR 43 4.917 9.796 -11.546 329 H ARG 44 H ARG 44 3.515 8.145 -10.558 330 HA ARG 44 HA ARG 44 4.176 6.275 -12.710 331 HB2 ARG 44 1HB ARG 44 5.403 6.966 -10.076 332 HB3 ARG 44 2HB ARG 44 5.693 5.366 -10.747 333 HG2 ARG 44 1HG ARG 44 6.920 6.175 -12.508 334 HG3 ARG 44 2HG ARG 44 6.135 7.756 -12.468 335 HD2 ARG 44 1HD ARG 44 7.327 7.724 -10.041 336 HD3 ARG 44 2HD ARG 44 8.465 6.753 -10.973 337 HE ARG 44 HE ARG 44 7.770 9.140 -12.350 338 HH11 ARG 44 1HH1 ARG 44 9.728 7.902 -9.750 339 HH12 ARG 44 2HH1 ARG 44 10.912 9.160 -9.869 340 HH21 ARG 44 1HH2 ARG 44 9.325 10.802 -12.516 341 HH22 ARG 44 2HH2 ARG 44 10.682 10.810 -11.442 342 H LEU 45 H LEU 45 2.105 6.580 -10.042 343 HA LEU 45 HA LEU 45 1.923 4.029 -8.997 344 HB2 LEU 45 1HB LEU 45 0.673 5.687 -7.933 345 HB3 LEU 45 2HB LEU 45 -0.103 6.192 -9.433 346 HG LEU 45 HG LEU 45 -0.685 3.453 -8.445 347 HD11 LEU 45 1HD1 LEU 45 -1.736 4.021 -6.566 348 HD12 LEU 45 2HD1 LEU 45 -2.487 5.429 -7.315 349 HD13 LEU 45 3HD1 LEU 45 -0.854 5.545 -6.657 350 HD21 LEU 45 3HD2 LEU 45 -1.946 3.775 -10.285 351 HD22 LEU 45 1HD2 LEU 45 -1.904 5.533 -10.138 352 HD23 LEU 45 2HD2 LEU 45 -3.023 4.592 -9.151 353 H SER 46 H SER 46 0.435 5.335 -11.927 354 HA SER 46 HA SER 46 -0.973 2.902 -12.519 355 HB2 SER 46 1HB SER 46 -1.862 4.026 -14.354 356 HB3 SER 46 2HB SER 46 -1.540 5.352 -13.238 357 HG SER 46 HG SER 46 -0.611 5.041 -15.686 358 H GLU 47 H GLU 47 2.188 4.103 -13.052 359 HA GLU 47 HA GLU 47 2.705 2.276 -15.266 360 HB2 GLU 47 1HB GLU 47 3.894 4.719 -14.277 361 HB3 GLU 47 2HB GLU 47 5.115 3.469 -14.471 362 HG2 GLU 47 1HG GLU 47 3.906 3.155 -16.800 363 HG3 GLU 47 2HG GLU 47 3.451 4.834 -16.511 364 H VAL 48 H VAL 48 2.606 2.082 -11.980 365 HA VAL 48 HA VAL 48 4.671 -0.023 -11.918 366 HB VAL 48 HB VAL 48 4.983 0.402 -9.546 367 HG11 VAL 48 1HG1 VAL 48 6.510 1.614 -10.818 368 HG12 VAL 48 2HG1 VAL 48 5.276 2.725 -11.418 369 HG13 VAL 48 3HG1 VAL 48 5.820 2.829 -9.742 370 HG21 VAL 48 3HG2 VAL 48 2.813 2.440 -9.958 371 HG22 VAL 48 1HG2 VAL 48 2.879 1.122 -8.787 372 HG23 VAL 48 2HG2 VAL 48 3.933 2.524 -8.598 373 H VAL 49 H VAL 49 1.427 0.941 -11.024 374 HA VAL 49 HA VAL 49 0.767 -1.327 -9.468 375 HB VAL 49 HB VAL 49 -0.534 0.805 -9.491 376 HG11 VAL 49 1HG1 VAL 49 -1.881 -0.201 -11.973 377 HG12 VAL 49 2HG1 VAL 49 -1.953 1.403 -11.239 378 HG13 VAL 49 3HG1 VAL 49 -0.486 0.874 -12.064 379 HG21 VAL 49 3HG2 VAL 49 -1.372 -1.671 -8.920 380 HG22 VAL 49 1HG2 VAL 49 -2.405 -0.251 -8.766 381 HG23 VAL 49 2HG2 VAL 49 -2.519 -1.273 -10.198 382 H ASP 50 H ASP 50 1.313 -0.972 -12.784 383 HA ASP 50 HA ASP 50 -0.525 -2.879 -13.804 384 HB2 ASP 50 1HB ASP 50 1.522 -1.181 -14.841 385 HB3 ASP 50 2HB ASP 50 1.817 -2.817 -15.423 386 H ARG 51 H ARG 51 2.510 -3.126 -12.175 387 HA ARG 51 HA ARG 51 2.566 -6.021 -12.726 388 HB2 ARG 51 1HB ARG 51 5.019 -5.828 -12.056 389 HB3 ARG 51 2HB ARG 51 4.566 -5.141 -13.611 390 HG2 ARG 51 1HG ARG 51 4.553 -3.358 -11.236 391 HG3 ARG 51 2HG ARG 51 6.108 -3.844 -11.915 392 HD2 ARG 51 1HD ARG 51 4.292 -3.074 -14.008 393 HD3 ARG 51 2HD ARG 51 4.418 -1.793 -12.804 394 HE ARG 51 HE ARG 51 6.386 -2.523 -14.704 395 HH11 ARG 51 1HH1 ARG 51 6.006 -1.450 -11.413 396 HH12 ARG 51 2HH1 ARG 51 7.559 -0.686 -11.346 397 HH21 ARG 51 1HH2 ARG 51 8.434 -1.520 -14.628 398 HH22 ARG 51 2HH2 ARG 51 8.939 -0.725 -13.175 399 H PHE 52 H PHE 52 2.853 -3.508 -10.287 400 HA PHE 52 HA PHE 52 3.572 -4.977 -8.067 401 HB2 PHE 52 1HB PHE 52 2.126 -2.461 -8.548 402 HB3 PHE 52 2HB PHE 52 1.754 -3.228 -7.007 403 HD1 PHE 52 HD1 PHE 52 3.881 -4.056 -5.670 404 HD2 PHE 52 HD2 PHE 52 3.894 -1.005 -8.638 405 HE1 PHE 52 HE1 PHE 52 5.954 -3.139 -4.713 406 HE2 PHE 52 HE2 PHE 52 5.968 -0.084 -7.686 407 HZ PHE 52 HZ PHE 52 7.000 -1.151 -5.722 408 H ASP 53 H ASP 53 2.070 -5.476 -6.171 409 HA ASP 53 HA ASP 53 -0.089 -7.179 -7.182 410 HB2 ASP 53 1HB ASP 53 1.333 -7.149 -4.512 411 HB3 ASP 53 2HB ASP 53 0.031 -8.256 -4.940 412 H VAL 54 H VAL 54 0.330 -5.521 -4.065 413 HA VAL 54 HA VAL 54 -2.456 -4.595 -4.288 414 HB VAL 54 HB VAL 54 -0.829 -4.855 -1.759 415 HG11 VAL 54 1HG1 VAL 54 -3.707 -4.245 -2.354 416 HG12 VAL 54 2HG1 VAL 54 -3.200 -4.878 -0.787 417 HG13 VAL 54 3HG1 VAL 54 -2.565 -3.336 -1.364 418 HG21 VAL 54 3HG2 VAL 54 -2.276 -6.877 -1.356 419 HG22 VAL 54 1HG2 VAL 54 -2.736 -6.790 -3.057 420 HG23 VAL 54 2HG2 VAL 54 -1.051 -7.063 -2.611 421 H VAL 55 H VAL 55 -2.992 -2.477 -3.634 422 HA VAL 55 HA VAL 55 -0.714 -0.612 -3.483 423 HB VAL 55 HB VAL 55 -3.330 -0.073 -4.893 424 HG11 VAL 55 1HG1 VAL 55 -1.038 1.581 -4.113 425 HG12 VAL 55 2HG1 VAL 55 -1.539 1.762 -5.796 426 HG13 VAL 55 3HG1 VAL 55 -2.696 2.044 -4.494 427 HG21 VAL 55 3HG2 VAL 55 -1.109 0.008 -6.656 428 HG22 VAL 55 1HG2 VAL 55 -1.055 -1.524 -5.783 429 HG23 VAL 55 2HG2 VAL 55 -2.499 -1.077 -6.691 430 H LEU 56 H LEU 56 -0.972 1.222 -2.191 431 HA LEU 56 HA LEU 56 -3.389 1.307 -0.520 432 HB2 LEU 56 1HB LEU 56 -0.534 1.153 0.321 433 HB3 LEU 56 2HB LEU 56 -1.666 2.076 1.307 434 HG LEU 56 HG LEU 56 -2.805 -0.483 0.773 435 HD11 LEU 56 1HD1 LEU 56 0.096 -0.485 1.285 436 HD12 LEU 56 2HD1 LEU 56 -0.930 -1.709 0.538 437 HD13 LEU 56 3HD1 LEU 56 -0.869 -1.562 2.295 438 HD21 LEU 56 3HD2 LEU 56 -2.212 -0.525 3.388 439 HD22 LEU 56 1HD2 LEU 56 -3.559 0.393 2.714 440 HD23 LEU 56 2HD2 LEU 56 -2.033 1.201 3.072 441 H LEU 57 H LEU 57 -4.130 3.317 0.008 442 HA LEU 57 HA LEU 57 -2.673 5.584 -1.176 443 HB2 LEU 57 1HB LEU 57 -4.760 5.304 -2.266 444 HB3 LEU 57 2HB LEU 57 -5.607 5.104 -0.734 445 HG LEU 57 HG LEU 57 -5.068 7.508 -0.235 446 HD11 LEU 57 1HD1 LEU 57 -3.463 7.221 -2.534 447 HD12 LEU 57 2HD1 LEU 57 -3.716 8.665 -1.555 448 HD13 LEU 57 3HD1 LEU 57 -4.755 8.348 -2.944 449 HD21 LEU 57 3HD2 LEU 57 -6.625 7.461 -2.764 450 HD22 LEU 57 1HD2 LEU 57 -7.004 8.209 -1.212 451 HD23 LEU 57 2HD2 LEU 57 -7.192 6.467 -1.421 452 H ALA 58 H ALA 58 -2.381 7.460 -0.009 453 HA ALA 58 HA ALA 58 -2.465 7.157 2.868 454 HB1 ALA 58 3HB ALA 58 -1.114 8.940 0.953 455 HB2 ALA 58 1HB ALA 58 -1.523 9.656 2.512 456 HB3 ALA 58 2HB ALA 58 -0.517 8.208 2.442 457 HA PRO 59 HA PRO 59 -6.052 9.522 3.757 458 HB2 PRO 59 1HB PRO 59 -5.288 10.947 5.936 459 HB3 PRO 59 2HB PRO 59 -5.592 9.206 5.985 460 HG2 PRO 59 1HG PRO 59 -2.988 10.670 5.789 461 HG3 PRO 59 2HG PRO 59 -3.407 9.259 6.778 462 HD2 PRO 59 1HD PRO 59 -2.041 9.052 4.449 463 HD3 PRO 59 2HD PRO 59 -3.156 7.792 5.017 464 H GLN 60 H GLN 60 -3.095 11.136 3.035 465 HA GLN 60 HA GLN 60 -4.303 13.774 2.955 466 HB2 GLN 60 1HB GLN 60 -1.603 12.688 2.949 467 HB3 GLN 60 2HB GLN 60 -1.812 13.943 1.734 468 HG2 GLN 60 1HG GLN 60 -2.332 15.565 3.320 469 HG3 GLN 60 2HG GLN 60 -2.704 14.366 4.559 470 HE21 GLN 60 2HE2 GLN 60 -1.185 16.125 5.548 471 HE22 GLN 60 1HE2 GLN 60 0.486 15.687 5.589 472 H SER 61 H SER 61 -5.893 13.495 1.355 473 HA SER 61 HA SER 61 -5.143 14.174 -1.251 474 HB2 SER 61 1HB SER 61 -6.218 11.805 -2.093 475 HB3 SER 61 2HB SER 61 -4.490 12.148 -2.023 476 HG SER 61 HG SER 61 -4.293 10.854 -0.359 477 H ARG 62 H ARG 62 -6.813 15.310 -1.958 478 HA ARG 62 HA ARG 62 -9.453 14.840 -0.820 479 HB2 ARG 62 1HB ARG 62 -8.212 17.078 -2.391 480 HB3 ARG 62 2HB ARG 62 -9.958 16.971 -2.211 481 HG2 ARG 62 1HG ARG 62 -9.354 16.757 0.337 482 HG3 ARG 62 2HG ARG 62 -7.871 17.562 -0.180 483 HD2 ARG 62 1HD ARG 62 -9.941 18.961 -1.424 484 HD3 ARG 62 2HD ARG 62 -10.515 18.647 0.213 485 HE ARG 62 HE ARG 62 -8.937 20.105 1.014 486 HH11 ARG 62 1HH1 ARG 62 -8.197 19.303 -2.292 487 HH12 ARG 62 2HH1 ARG 62 -6.946 20.493 -2.438 488 HH21 ARG 62 1HH2 ARG 62 -7.293 21.676 0.834 489 HH22 ARG 62 2HH2 ARG 62 -6.432 21.842 -0.659 490 H PHE 63 H PHE 63 -8.301 15.619 -4.107 491 HA PHE 63 HA PHE 63 -10.580 14.243 -5.249 492 HB2 PHE 63 1HB PHE 63 -8.280 15.713 -6.552 493 HB3 PHE 63 2HB PHE 63 -9.660 15.044 -7.415 494 HD1 PHE 63 HD2 PHE 63 -11.878 16.040 -7.175 495 HD2 PHE 63 HD1 PHE 63 -8.462 17.732 -5.282 496 HE1 PHE 63 HE2 PHE 63 -13.121 18.131 -6.807 497 HE2 PHE 63 HE1 PHE 63 -9.699 19.825 -4.910 498 HZ PHE 63 HZ PHE 63 -12.032 20.028 -5.675 499 H ASN 64 H ASN 64 -7.190 13.694 -4.723 500 HA ASN 64 HA ASN 64 -6.590 11.769 -6.607 501 HB2 ASN 64 1HB ASN 64 -5.433 12.732 -4.206 502 HB3 ASN 64 2HB ASN 64 -5.455 10.975 -4.096 503 HD21 ASN 64 2HD2 ASN 64 -3.603 10.148 -4.708 504 HD22 ASN 64 1HD2 ASN 64 -2.623 10.693 -6.021 505 H LYS 65 H LYS 65 -7.974 11.251 -3.367 506 HA LYS 65 HA LYS 65 -8.249 8.475 -3.539 507 HB2 LYS 65 1HB LYS 65 -9.972 8.745 -1.758 508 HB3 LYS 65 2HB LYS 65 -8.465 9.587 -1.417 509 HG2 LYS 65 1HG LYS 65 -9.558 11.672 -2.304 510 HG3 LYS 65 2HG LYS 65 -11.076 10.771 -2.320 511 HD2 LYS 65 1HD LYS 65 -9.392 10.927 0.157 512 HD3 LYS 65 2HD LYS 65 -10.522 12.218 -0.258 513 HE2 LYS 65 1HE LYS 65 -12.137 10.105 -0.569 514 HE3 LYS 65 2HE LYS 65 -11.038 9.444 0.640 515 HZ1 LYS 65 3HZ LYS 65 -13.191 11.001 1.159 516 HZ2 LYS 65 1HZ LYS 65 -11.918 12.113 1.238 517 HZ3 LYS 65 2HZ LYS 65 -11.900 10.737 2.220 518 H LYS 66 H LYS 66 -10.499 11.068 -4.422 519 HA LYS 66 HA LYS 66 -12.721 9.533 -5.066 520 HB2 LYS 66 1HB LYS 66 -12.039 12.205 -5.233 521 HB3 LYS 66 2HB LYS 66 -12.279 11.754 -6.915 522 HG2 LYS 66 1HG LYS 66 -14.485 10.691 -6.027 523 HG3 LYS 66 2HG LYS 66 -14.235 11.787 -4.666 524 HD2 LYS 66 1HD LYS 66 -15.004 13.498 -5.858 525 HD3 LYS 66 2HD LYS 66 -13.803 13.201 -7.117 526 HE2 LYS 66 1HE LYS 66 -15.307 11.481 -8.078 527 HE3 LYS 66 2HE LYS 66 -16.516 11.906 -6.868 528 HZ1 LYS 66 3HZ LYS 66 -15.390 13.906 -8.737 529 HZ2 LYS 66 1HZ LYS 66 -16.794 14.022 -7.800 530 HZ3 LYS 66 2HZ LYS 66 -16.747 12.974 -9.127 531 H ARG 67 H ARG 67 -10.166 10.673 -7.280 532 HA ARG 67 HA ARG 67 -11.091 9.270 -9.533 533 HB2 ARG 67 1HB ARG 67 -8.641 10.716 -8.767 534 HB3 ARG 67 2HB ARG 67 -8.410 9.471 -9.986 535 HG2 ARG 67 1HG ARG 67 -10.238 10.527 -11.310 536 HG3 ARG 67 2HG ARG 67 -10.261 11.838 -10.130 537 HD2 ARG 67 1HD ARG 67 -7.679 11.071 -11.414 538 HD3 ARG 67 2HD ARG 67 -8.841 12.034 -12.325 539 HE ARG 67 HE ARG 67 -8.608 13.318 -9.924 540 HH11 ARG 67 1HH1 ARG 67 -6.396 12.330 -12.424 541 HH12 ARG 67 2HH1 ARG 67 -5.287 13.631 -12.137 542 HH21 ARG 67 1HH2 ARG 67 -7.157 15.034 -9.537 543 HH22 ARG 67 2HH2 ARG 67 -5.720 15.166 -10.494 544 H LEU 68 H LEU 68 -8.556 8.451 -7.176 545 HA LEU 68 HA LEU 68 -7.684 6.064 -8.244 546 HB2 LEU 68 1HB LEU 68 -7.683 7.328 -5.616 547 HB3 LEU 68 2HB LEU 68 -7.668 5.567 -5.540 548 HG LEU 68 HG LEU 68 -5.679 7.129 -7.170 549 HD11 LEU 68 1HD1 LEU 68 -4.251 7.344 -5.396 550 HD12 LEU 68 2HD1 LEU 68 -4.992 6.022 -4.494 551 HD13 LEU 68 3HD1 LEU 68 -5.798 7.588 -4.585 552 HD21 LEU 68 3HD2 LEU 68 -4.360 5.010 -6.758 553 HD22 LEU 68 1HD2 LEU 68 -5.756 4.861 -7.826 554 HD23 LEU 68 2HD2 LEU 68 -5.860 4.302 -6.156 555 H GLU 69 H GLU 69 -10.514 6.671 -6.219 556 HA GLU 69 HA GLU 69 -11.230 3.925 -5.949 557 HB2 GLU 69 1HB GLU 69 -12.861 6.441 -5.571 558 HB3 GLU 69 2HB GLU 69 -13.402 4.827 -5.133 559 HG2 GLU 69 1HG GLU 69 -11.986 4.684 -3.342 560 HG3 GLU 69 2HG GLU 69 -10.829 5.824 -4.026 561 H GLU 70 H GLU 70 -12.311 6.561 -8.058 562 HA GLU 70 HA GLU 70 -14.308 5.070 -9.397 563 HB2 GLU 70 1HB GLU 70 -12.764 7.489 -10.352 564 HB3 GLU 70 2HB GLU 70 -14.245 6.873 -11.073 565 HG2 GLU 70 1HG GLU 70 -14.301 7.531 -8.185 566 HG3 GLU 70 2HG GLU 70 -14.231 8.868 -9.331 567 H ILE 71 H ILE 71 -10.897 5.085 -9.621 568 HA ILE 71 HA ILE 71 -10.901 3.909 -12.297 569 HB ILE 71 HB ILE 71 -8.586 4.652 -10.503 570 HG12 ILE 71 1HG1 ILE 71 -9.268 5.998 -13.092 571 HG13 ILE 71 2HG1 ILE 71 -10.136 6.449 -11.628 572 HG21 ILE 71 1HG2 ILE 71 -8.714 3.473 -13.258 573 HG22 ILE 71 2HG2 ILE 71 -7.316 4.399 -12.711 574 HG23 ILE 71 3HG2 ILE 71 -7.786 2.926 -11.861 575 HD11 ILE 71 3HD1 ILE 71 -7.223 6.746 -12.246 576 HD12 ILE 71 1HD1 ILE 71 -8.392 7.984 -11.788 577 HD13 ILE 71 2HD1 ILE 71 -7.835 6.812 -10.593 578 H THR 72 H THR 72 -10.063 3.117 -8.958 579 HA THR 72 HA THR 72 -9.042 0.528 -9.497 580 HB THR 72 HB THR 72 -9.495 0.126 -7.035 581 HG1 THR 72 HG1 THR 72 -10.597 1.580 -5.951 582 HG21 THR 72 3HG2 THR 72 -7.406 0.873 -6.853 583 HG22 THR 72 1HG2 THR 72 -8.008 2.526 -6.746 584 HG23 THR 72 2HG2 THR 72 -7.609 1.833 -8.317 585 H LYS 73 H LYS 73 -12.254 1.762 -8.765 586 HA LYS 73 HA LYS 73 -13.611 -0.565 -8.171 587 HB2 LYS 73 1HB LYS 73 -14.292 2.096 -9.065 588 HB3 LYS 73 2HB LYS 73 -15.345 0.907 -9.821 589 HG2 LYS 73 1HG LYS 73 -16.305 0.289 -7.844 590 HG3 LYS 73 2HG LYS 73 -14.879 0.714 -6.893 591 HD2 LYS 73 1HD LYS 73 -15.519 2.871 -6.656 592 HD3 LYS 73 2HD LYS 73 -16.225 2.949 -8.272 593 HE2 LYS 73 1HE LYS 73 -17.629 1.181 -6.394 594 HE3 LYS 73 2HE LYS 73 -17.647 2.889 -5.953 595 HZ1 LYS 73 3HZ LYS 73 -18.189 2.731 -8.677 596 HZ2 LYS 73 1HZ LYS 73 -19.245 3.185 -7.434 597 HZ3 LYS 73 2HZ LYS 73 -19.160 1.568 -7.924 598 HA PRO 74 HA PRO 74 -14.457 -1.336 -12.857 599 HB2 PRO 74 1HB PRO 74 -13.130 0.216 -14.647 600 HB3 PRO 74 2HB PRO 74 -14.705 0.656 -13.977 601 HG2 PRO 74 1HG PRO 74 -11.977 1.595 -13.178 602 HG3 PRO 74 2HG PRO 74 -13.470 2.533 -13.374 603 HD2 PRO 74 1HD PRO 74 -12.548 1.750 -10.952 604 HD3 PRO 74 2HD PRO 74 -14.279 1.911 -11.309 605 H LYS 75 H LYS 75 -11.183 -0.199 -12.124 606 HA LYS 75 HA LYS 75 -9.817 -1.953 -13.860 607 HB2 LYS 75 1HB LYS 75 -9.029 -0.386 -11.426 608 HB3 LYS 75 2HB LYS 75 -7.899 -1.523 -12.148 609 HG2 LYS 75 1HG LYS 75 -9.190 0.414 -13.969 610 HG3 LYS 75 2HG LYS 75 -8.003 1.049 -12.827 611 HD2 LYS 75 1HD LYS 75 -6.321 -0.451 -13.655 612 HD3 LYS 75 2HD LYS 75 -7.498 -1.281 -14.675 613 HE2 LYS 75 1HE LYS 75 -7.733 0.605 -16.090 614 HE3 LYS 75 2HE LYS 75 -6.865 1.647 -14.963 615 HZ1 LYS 75 3HZ LYS 75 -5.806 -0.383 -16.806 616 HZ2 LYS 75 1HZ LYS 75 -4.951 -0.030 -15.390 617 HZ3 LYS 75 2HZ LYS 75 -5.261 1.192 -16.517 618 H GLY 76 H GLY 76 -11.264 -2.398 -10.749 619 HA2 GLY 76 1HA GLY 76 -11.456 -4.233 -9.385 620 HA3 GLY 76 2HA GLY 76 -11.163 -5.183 -10.834 621 H ILE 77 H ILE 77 -9.321 -3.142 -8.560 622 HA ILE 77 HA ILE 77 -7.316 -5.288 -8.420 623 HB ILE 77 HB ILE 77 -5.550 -3.511 -8.246 624 HG12 ILE 77 1HG1 ILE 77 -6.922 -1.504 -9.764 625 HG13 ILE 77 2HG1 ILE 77 -7.827 -1.817 -8.286 626 HG21 ILE 77 1HG2 ILE 77 -6.865 -3.293 -10.920 627 HG22 ILE 77 2HG2 ILE 77 -5.161 -3.508 -10.521 628 HG23 ILE 77 3HG2 ILE 77 -6.284 -4.857 -10.350 629 HD11 ILE 77 3HD1 ILE 77 -5.960 -1.268 -6.932 630 HD12 ILE 77 1HD1 ILE 77 -4.883 -1.224 -8.327 631 HD13 ILE 77 2HD1 ILE 77 -6.131 0.008 -8.137 632 HA PRO 78 HA PRO 78 -7.539 -4.843 -4.058 633 HB2 PRO 78 1HB PRO 78 -5.001 -5.485 -3.336 634 HB3 PRO 78 2HB PRO 78 -6.165 -6.680 -3.921 635 HG2 PRO 78 1HG PRO 78 -3.958 -5.302 -5.402 636 HG3 PRO 78 2HG PRO 78 -4.445 -7.006 -5.451 637 HD2 PRO 78 1HD PRO 78 -5.156 -5.233 -7.369 638 HD3 PRO 78 2HD PRO 78 -6.190 -6.597 -6.899 639 H ILE 79 H ILE 79 -7.863 -2.729 -3.510 640 HA ILE 79 HA ILE 79 -5.443 -1.109 -3.071 641 HB ILE 79 HB ILE 79 -6.558 -0.157 -4.986 642 HG12 ILE 79 1HG1 ILE 79 -6.999 2.106 -4.146 643 HG13 ILE 79 2HG1 ILE 79 -7.157 1.477 -2.509 644 HG21 ILE 79 1HG2 ILE 79 -9.005 0.788 -3.948 645 HG22 ILE 79 2HG2 ILE 79 -8.750 -0.372 -5.251 646 HG23 ILE 79 3HG2 ILE 79 -8.920 -0.937 -3.589 647 HD11 ILE 79 3HD1 ILE 79 -4.840 2.390 -3.809 648 HD12 ILE 79 1HD1 ILE 79 -4.983 1.690 -2.197 649 HD13 ILE 79 2HD1 ILE 79 -4.652 0.651 -3.582 650 H GLU 80 H GLU 80 -5.232 -0.312 -1.076 651 HA GLU 80 HA GLU 80 -7.601 -0.314 0.678 652 HB2 GLU 80 1HB GLU 80 -4.847 -1.359 1.128 653 HB3 GLU 80 2HB GLU 80 -5.681 -0.625 2.491 654 HG2 GLU 80 1HG GLU 80 -5.894 -3.130 2.236 655 HG3 GLU 80 2HG GLU 80 -7.391 -2.225 2.452 656 H ILE 81 H ILE 81 -7.362 1.160 2.580 657 HA ILE 81 HA ILE 81 -5.689 3.500 1.987 658 HB ILE 81 HB ILE 81 -8.601 3.634 2.777 659 HG12 ILE 81 1HG1 ILE 81 -7.223 4.366 0.183 660 HG13 ILE 81 2HG1 ILE 81 -8.297 2.992 0.428 661 HG21 ILE 81 1HG2 ILE 81 -8.213 5.710 3.452 662 HG22 ILE 81 2HG2 ILE 81 -6.492 5.484 3.140 663 HG23 ILE 81 3HG2 ILE 81 -7.543 6.115 1.872 664 HD11 ILE 81 3HD1 ILE 81 -9.636 5.365 1.253 665 HD12 ILE 81 1HD1 ILE 81 -8.960 5.611 -0.357 666 HD13 ILE 81 2HD1 ILE 81 -10.043 4.253 -0.054 667 H ILE 82 H ILE 82 -4.584 4.204 3.694 668 HA ILE 82 HA ILE 82 -4.991 2.960 6.266 669 HB ILE 82 HB ILE 82 -3.021 5.137 5.576 670 HG12 ILE 82 1HG1 ILE 82 -2.642 2.138 5.436 671 HG13 ILE 82 2HG1 ILE 82 -2.789 3.207 4.046 672 HG21 ILE 82 1HG2 ILE 82 -1.993 4.714 7.565 673 HG22 ILE 82 2HG2 ILE 82 -3.650 4.313 8.013 674 HG23 ILE 82 3HG2 ILE 82 -2.513 3.029 7.603 675 HD11 ILE 82 3HD1 ILE 82 -0.519 2.933 4.200 676 HD12 ILE 82 1HD1 ILE 82 -0.756 4.423 5.114 677 HD13 ILE 82 2HD1 ILE 82 -0.533 2.893 5.963 678 H ASN 83 H ASN 83 -6.087 3.773 7.927 679 HA ASN 83 HA ASN 83 -7.665 6.073 7.732 680 HB2 ASN 83 1HB ASN 83 -6.949 4.158 9.874 681 HB3 ASN 83 2HB ASN 83 -7.530 5.731 10.413 682 HD21 ASN 83 2HD2 ASN 83 -8.617 2.860 10.259 683 HD22 ASN 83 1HD2 ASN 83 -10.213 3.078 9.632 684 H THR 84 H THR 84 -7.565 8.053 8.945 685 HA THR 84 HA THR 84 -5.195 9.463 8.671 686 HB THR 84 HB THR 84 -6.420 10.867 10.662 687 HG1 THR 84 HG1 THR 84 -8.124 9.432 10.917 688 HG21 THR 84 3HG2 THR 84 -6.940 12.334 9.005 689 HG22 THR 84 1HG2 THR 84 -7.672 11.094 7.988 690 HG23 THR 84 2HG2 THR 84 -5.917 11.254 8.059 691 H ILE 85 H ILE 85 -6.540 7.921 11.571 692 HA ILE 85 HA ILE 85 -4.494 8.749 13.333 693 HB ILE 85 HB ILE 85 -6.173 6.255 13.589 694 HG12 ILE 85 1HG1 ILE 85 -7.317 8.217 15.174 695 HG13 ILE 85 2HG1 ILE 85 -6.905 9.081 13.698 696 HG21 ILE 85 1HG2 ILE 85 -4.394 7.788 15.396 697 HG22 ILE 85 2HG2 ILE 85 -5.871 7.120 16.087 698 HG23 ILE 85 3HG2 ILE 85 -4.700 6.055 15.309 699 HD11 ILE 85 3HD1 ILE 85 -8.155 6.533 13.143 700 HD12 ILE 85 1HD1 ILE 85 -9.167 7.571 14.149 701 HD13 ILE 85 2HD1 ILE 85 -8.584 8.152 12.589 702 H ASP 86 H ASP 86 -5.023 5.633 11.685 703 HA ASP 86 HA ASP 86 -2.760 4.307 12.566 704 HB2 ASP 86 1HB ASP 86 -4.300 4.121 9.982 705 HB3 ASP 86 2HB ASP 86 -2.935 3.063 10.331 706 H TYR 87 H TYR 87 -3.112 6.605 9.919 707 HA TYR 87 HA TYR 87 -0.484 6.251 8.884 708 HB2 TYR 87 1HB TYR 87 -2.393 7.205 7.587 709 HB3 TYR 87 2HB TYR 87 -2.300 8.652 8.584 710 HD1 TYR 87 HD2 TYR 87 0.068 6.518 6.619 711 HD2 TYR 87 HD1 TYR 87 -1.237 10.444 7.612 712 HE1 TYR 87 HE2 TYR 87 1.747 7.459 5.086 713 HE2 TYR 87 HE1 TYR 87 0.436 11.395 6.083 714 HH TYR 87 HH TYR 87 2.181 10.964 4.762 715 H GLY 88 H GLY 88 -1.945 8.891 10.795 716 HA2 GLY 88 1HA GLY 88 0.321 10.418 11.207 717 HA3 GLY 88 2HA GLY 88 -1.018 10.315 12.341 718 H THR 89 H THR 89 -0.675 7.488 12.874 719 HA THR 89 HA THR 89 1.392 7.720 14.876 720 HB THR 89 HB THR 89 0.644 5.516 15.642 721 HG1 THR 89 HG1 THR 89 -0.048 4.330 13.996 722 HG21 THR 89 3HG2 THR 89 -1.429 7.612 15.083 723 HG22 THR 89 1HG2 THR 89 -0.625 7.223 16.604 724 HG23 THR 89 2HG2 THR 89 -1.845 6.131 15.947 725 H MET 90 H MET 90 1.026 6.290 11.746 726 HA MET 90 HA MET 90 2.469 5.181 10.383 727 HB2 MET 90 1HB MET 90 4.642 5.824 12.372 728 HB3 MET 90 2HB MET 90 4.810 5.532 10.645 729 HG2 MET 90 1HG MET 90 3.487 7.608 10.243 730 HG3 MET 90 2HG MET 90 3.557 7.918 11.977 731 HE1 MET 90 3HE MET 90 5.863 7.358 13.134 732 HE2 MET 90 1HE MET 90 7.075 6.679 12.048 733 HE3 MET 90 2HE MET 90 7.280 8.309 12.689 734 H ASN 91 H ASN 91 1.105 3.384 11.472 735 HA ASN 91 HA ASN 91 2.675 1.609 13.159 736 HB2 ASN 91 1HB ASN 91 -0.170 1.868 12.408 737 HB3 ASN 91 2HB ASN 91 0.401 0.217 12.629 738 HD21 ASN 91 2HD2 ASN 91 1.843 0.005 14.662 739 HD22 ASN 91 1HD2 ASN 91 1.191 0.717 16.095 740 H GLY 92 H GLY 92 4.315 0.890 11.799 741 HA2 GLY 92 1HA GLY 92 4.112 0.022 9.183 742 HA3 GLY 92 2HA GLY 92 5.282 -0.597 10.339 743 H GLU 93 H GLU 93 3.790 -1.970 12.119 744 HA GLU 93 HA GLU 93 3.374 -4.422 10.919 745 HB2 GLU 93 1HB GLU 93 3.659 -4.097 13.345 746 HB3 GLU 93 2HB GLU 93 2.056 -3.382 13.433 747 HG2 GLU 93 1HG GLU 93 1.030 -5.458 12.819 748 HG3 GLU 93 2HG GLU 93 2.602 -6.193 12.515 749 H LYS 94 H LYS 94 0.964 -1.947 11.742 750 HA LYS 94 HA LYS 94 -1.294 -3.373 10.860 751 HB2 LYS 94 1HB LYS 94 -0.817 -0.394 11.044 752 HB3 LYS 94 2HB LYS 94 -2.388 -1.132 10.758 753 HG2 LYS 94 1HG LYS 94 -0.687 -1.580 13.203 754 HG3 LYS 94 2HG LYS 94 -2.055 -0.470 13.100 755 HD2 LYS 94 1HD LYS 94 -3.308 -2.635 12.265 756 HD3 LYS 94 2HD LYS 94 -2.017 -3.449 13.151 757 HE2 LYS 94 1HE LYS 94 -3.546 -3.229 14.829 758 HE3 LYS 94 2HE LYS 94 -2.689 -1.700 15.017 759 HZ1 LYS 94 3HZ LYS 94 -4.677 -0.754 14.822 760 HZ2 LYS 94 1HZ LYS 94 -5.409 -2.178 14.277 761 HZ3 LYS 94 2HZ LYS 94 -4.627 -1.155 13.180 762 H VAL 95 H VAL 95 0.911 -1.179 9.189 763 HA VAL 95 HA VAL 95 -0.517 -0.950 6.782 764 HB VAL 95 HB VAL 95 2.479 -0.855 7.164 765 HG11 VAL 95 1HG1 VAL 95 0.716 0.216 4.964 766 HG12 VAL 95 2HG1 VAL 95 2.442 0.544 5.132 767 HG13 VAL 95 3HG1 VAL 95 1.881 -1.101 4.833 768 HG21 VAL 95 3HG2 VAL 95 2.246 1.126 8.150 769 HG22 VAL 95 1HG2 VAL 95 1.182 1.697 6.865 770 HG23 VAL 95 2HG2 VAL 95 0.512 0.818 8.239 771 H LEU 96 H LEU 96 2.420 -2.904 7.326 772 HA LEU 96 HA LEU 96 2.315 -4.391 5.005 773 HB2 LEU 96 1HB LEU 96 3.594 -6.126 6.292 774 HB3 LEU 96 2HB LEU 96 4.265 -4.496 6.329 775 HG LEU 96 HG LEU 96 2.780 -4.486 8.597 776 HD11 LEU 96 1HD1 LEU 96 2.671 -6.500 9.654 777 HD12 LEU 96 2HD1 LEU 96 4.040 -7.169 8.768 778 HD13 LEU 96 3HD1 LEU 96 2.465 -7.039 7.988 779 HD21 LEU 96 3HD2 LEU 96 5.633 -5.382 8.215 780 HD22 LEU 96 1HD2 LEU 96 4.930 -4.916 9.764 781 HD23 LEU 96 2HD2 LEU 96 5.055 -3.733 8.462 782 H GLN 97 H GLN 97 0.830 -5.123 8.144 783 HA GLN 97 HA GLN 97 -0.200 -7.634 7.565 784 HB2 GLN 97 1HB GLN 97 -1.022 -5.435 9.418 785 HB3 GLN 97 2HB GLN 97 -2.084 -6.821 9.216 786 HG2 GLN 97 1HG GLN 97 0.768 -6.851 10.172 787 HG3 GLN 97 2HG GLN 97 -0.681 -7.165 11.127 788 HE21 GLN 97 2HE2 GLN 97 -2.087 -8.797 9.424 789 HE22 GLN 97 1HE2 GLN 97 -1.235 -10.285 9.217 790 H LEU 98 H LEU 98 -1.793 -4.471 7.176 791 HA LEU 98 HA LEU 98 -4.193 -5.386 6.105 792 HB2 LEU 98 1HB LEU 98 -2.941 -2.906 6.547 793 HB3 LEU 98 2HB LEU 98 -3.419 -2.926 4.851 794 HG LEU 98 HG LEU 98 -5.285 -3.422 7.171 795 HD11 LEU 98 1HD1 LEU 98 -6.145 -1.124 6.138 796 HD12 LEU 98 2HD1 LEU 98 -4.427 -0.956 5.777 797 HD13 LEU 98 3HD1 LEU 98 -4.959 -1.195 7.441 798 HD21 LEU 98 3HD2 LEU 98 -5.519 -3.665 4.267 799 HD22 LEU 98 1HD2 LEU 98 -6.776 -2.674 5.008 800 HD23 LEU 98 2HD2 LEU 98 -6.528 -4.334 5.550 801 H ALA 99 H ALA 99 -1.256 -4.320 4.399 802 HA ALA 99 HA ALA 99 -2.117 -4.674 1.792 803 HB1 ALA 99 3HB ALA 99 0.045 -4.352 1.181 804 HB2 ALA 99 1HB ALA 99 0.171 -3.832 2.862 805 HB3 ALA 99 2HB ALA 99 0.673 -5.460 2.402 806 H ILE 100 H ILE 100 -0.682 -7.049 3.999 807 HA ILE 100 HA ILE 100 -0.526 -9.181 2.178 808 HB ILE 100 HB ILE 100 -0.903 -9.290 5.173 809 HG12 ILE 100 1HG1 ILE 100 1.711 -9.836 3.876 810 HG13 ILE 100 2HG1 ILE 100 1.178 -8.158 3.899 811 HG21 ILE 100 1HG2 ILE 100 0.535 -11.517 4.277 812 HG22 ILE 100 2HG2 ILE 100 -1.104 -11.486 4.923 813 HG23 ILE 100 3HG2 ILE 100 -0.841 -11.361 3.185 814 HD11 ILE 100 3HD1 ILE 100 2.304 -9.756 6.004 815 HD12 ILE 100 1HD1 ILE 100 2.026 -8.016 5.936 816 HD13 ILE 100 2HD1 ILE 100 0.741 -9.092 6.483 817 H ASN 101 H ASN 101 -3.007 -8.486 4.645 818 HA ASN 101 HA ASN 101 -4.739 -10.565 4.107 819 HB2 ASN 101 1HB ASN 101 -5.178 -9.218 6.010 820 HB3 ASN 101 2HB ASN 101 -5.263 -7.747 5.044 821 HD21 ASN 101 2HD2 ASN 101 -7.124 -7.275 3.913 822 HD22 ASN 101 1HD2 ASN 101 -8.614 -8.110 4.180 823 H ALA 102 H ALA 102 -4.555 -7.395 2.536 824 HA ALA 102 HA ALA 102 -6.792 -7.741 0.847 825 HB1 ALA 102 3HB ALA 102 -4.409 -5.926 0.779 826 HB2 ALA 102 1HB ALA 102 -5.582 -5.939 -0.537 827 HB3 ALA 102 2HB ALA 102 -6.098 -5.535 1.100 828 H PHE 103 H PHE 103 -3.340 -8.390 0.401 829 HA PHE 103 HA PHE 103 -3.390 -9.063 -2.306 830 HB2 PHE 103 1HB PHE 103 -1.306 -8.725 -1.069 831 HB3 PHE 103 2HB PHE 103 -1.621 -10.171 -0.115 832 HD1 PHE 103 HD1 PHE 103 -1.430 -9.195 -3.715 833 HD2 PHE 103 HD2 PHE 103 -0.473 -12.057 -0.713 834 HE1 PHE 103 HE1 PHE 103 -0.244 -10.551 -5.391 835 HE2 PHE 103 HE2 PHE 103 0.715 -13.417 -2.384 836 HZ PHE 103 HZ PHE 103 0.832 -12.664 -4.725 837 H ASN 104 H ASN 104 -3.695 -11.182 0.537 838 HA ASN 104 HA ASN 104 -4.117 -13.553 -0.946 839 HB2 ASN 104 1HB ASN 104 -4.641 -12.774 1.914 840 HB3 ASN 104 2HB ASN 104 -5.115 -14.354 1.297 841 HD21 ASN 104 2HD2 ASN 104 -3.252 -13.895 3.363 842 HD22 ASN 104 1HD2 ASN 104 -1.714 -14.472 2.830 843 H ASN 105 H ASN 105 -6.381 -11.383 0.738 844 HA ASN 105 HA ASN 105 -8.746 -12.702 0.191 845 HB2 ASN 105 1HB ASN 105 -8.393 -10.632 1.633 846 HB3 ASN 105 2HB ASN 105 -8.479 -9.695 0.143 847 HD21 ASN 105 2HD2 ASN 105 -10.225 -11.427 2.527 848 HD22 ASN 105 1HD2 ASN 105 -11.810 -11.112 1.916 849 H LYS 106 H LYS 106 -6.919 -10.477 -1.847 850 HA LYS 106 HA LYS 106 -7.084 -9.917 -4.047 851 HB2 LYS 106 1HB LYS 106 -7.287 -12.688 -3.865 852 HB3 LYS 106 2HB LYS 106 -8.604 -12.230 -4.937 853 HG2 LYS 106 1HG LYS 106 -6.652 -10.769 -6.024 854 HG3 LYS 106 2HG LYS 106 -5.683 -12.076 -5.342 855 HD2 LYS 106 1HD LYS 106 -7.340 -13.658 -6.473 856 HD3 LYS 106 2HD LYS 106 -7.893 -12.245 -7.374 857 HE2 LYS 106 1HE LYS 106 -5.648 -11.899 -8.242 858 HE3 LYS 106 2HE LYS 106 -5.053 -13.262 -7.297 859 HZ1 LYS 106 3HZ LYS 106 -5.547 -14.546 -9.015 860 HZ2 LYS 106 1HZ LYS 106 -6.282 -13.268 -9.844 861 HZ3 LYS 106 2HZ LYS 106 -7.187 -14.215 -8.774 862 H SER 107 H SER 107 -9.290 -9.209 -2.227 863 HA SER 107 HA SER 107 -11.144 -8.307 -4.234 864 HB2 SER 107 1HB SER 107 -11.772 -10.623 -2.567 865 HB3 SER 107 2HB SER 107 -12.966 -9.334 -2.418 866 HG SER 107 HG SER 107 -13.164 -10.987 -4.201 867 H SER 108 H SER 108 -12.876 -6.916 -3.241 868 HA SER 108 HA SER 108 -12.384 -5.924 -0.578 869 HB2 SER 108 1HB SER 108 -11.527 -4.411 -3.014 870 HB3 SER 108 2HB SER 108 -12.163 -3.516 -1.634 871 HG SER 108 HG SER 108 -10.067 -5.416 -1.442 872 H VAL 109 H VAL 109 -14.557 -6.532 -0.292 873 HA VAL 109 HA VAL 109 -16.698 -5.701 -1.907 874 HB VAL 109 HB VAL 109 -18.134 -6.174 0.058 875 HG11 VAL 109 1HG1 VAL 109 -17.011 -8.588 0.399 876 HG12 VAL 109 2HG1 VAL 109 -17.900 -8.130 -1.055 877 HG13 VAL 109 3HG1 VAL 109 -16.138 -8.055 -1.037 878 HG21 VAL 109 3HG2 VAL 109 -16.282 -7.350 1.822 879 HG22 VAL 109 1HG2 VAL 109 -15.680 -5.732 1.461 880 HG23 VAL 109 2HG2 VAL 109 -17.308 -5.945 2.108 Start of MODEL 6 1 H1 GLY 1 H GLY 1 15.210 -17.741 -8.018 2 HA2 GLY 1 1HA GLY 1 12.862 -19.439 -7.472 3 HA3 GLY 1 2HA GLY 1 14.016 -18.895 -6.263 4 HA PRO 2 HA PRO 2 11.290 -15.049 -7.375 5 HB2 PRO 2 1HB PRO 2 9.090 -15.531 -8.892 6 HB3 PRO 2 2HB PRO 2 10.659 -15.100 -9.583 7 HG2 PRO 2 1HG PRO 2 9.393 -17.798 -9.296 8 HG3 PRO 2 2HG PRO 2 10.275 -17.118 -10.676 9 HD2 PRO 2 1HD PRO 2 11.414 -18.842 -8.924 10 HD3 PRO 2 2HD PRO 2 12.334 -17.559 -9.738 11 H GLY 3 H GLY 3 10.020 -14.439 -5.731 12 HA2 GLY 3 1HA GLY 3 7.532 -15.515 -5.072 13 HA3 GLY 3 2HA GLY 3 8.726 -16.324 -4.068 14 H SER 4 H SER 4 7.384 -13.175 -4.927 15 HA SER 4 HA SER 4 7.664 -12.294 -2.192 16 HB2 SER 4 1HB SER 4 8.935 -10.251 -2.759 17 HB3 SER 4 2HB SER 4 9.871 -11.711 -3.075 18 HG SER 4 HG SER 4 10.109 -10.487 -4.871 19 H MET 5 H MET 5 6.490 -10.340 -1.750 20 HA MET 5 HA MET 5 4.508 -9.702 -3.836 21 HB2 MET 5 1HB MET 5 3.427 -10.856 -2.024 22 HB3 MET 5 2HB MET 5 4.195 -9.814 -0.834 23 HG2 MET 5 1HG MET 5 2.936 -7.901 -1.737 24 HG3 MET 5 2HG MET 5 2.126 -8.992 -2.858 25 HE1 MET 5 3HE MET 5 3.263 -8.625 0.627 26 HE2 MET 5 1HE MET 5 1.780 -8.471 1.569 27 HE3 MET 5 2HE MET 5 2.496 -10.061 1.308 28 H ASN 6 H ASN 6 5.094 -7.812 -4.706 29 HA ASN 6 HA ASN 6 6.343 -5.749 -3.099 30 HB2 ASN 6 1HB ASN 6 5.540 -5.667 -6.015 31 HB3 ASN 6 2HB ASN 6 6.620 -4.545 -5.191 32 HD21 ASN 6 2HD2 ASN 6 8.724 -5.016 -5.056 33 HD22 ASN 6 1HD2 ASN 6 9.443 -6.489 -5.601 34 H ILE 7 H ILE 7 5.133 -4.437 -1.910 35 HA ILE 7 HA ILE 7 2.365 -3.918 -2.647 36 HB ILE 7 HB ILE 7 3.903 -3.030 -0.204 37 HG12 ILE 7 1HG1 ILE 7 1.910 -4.878 0.490 38 HG13 ILE 7 2HG1 ILE 7 2.694 -5.556 -0.933 39 HG21 ILE 7 1HG2 ILE 7 1.475 -2.798 0.656 40 HG22 ILE 7 2HG2 ILE 7 2.145 -1.530 -0.368 41 HG23 ILE 7 3HG2 ILE 7 1.051 -2.732 -1.054 42 HD11 ILE 7 3HD1 ILE 7 4.465 -6.159 0.245 43 HD12 ILE 7 1HD1 ILE 7 4.635 -4.548 0.941 44 HD13 ILE 7 2HD1 ILE 7 3.558 -5.724 1.693 45 H LEU 8 H LEU 8 1.518 -1.903 -3.094 46 HA LEU 8 HA LEU 8 3.499 0.156 -3.793 47 HB2 LEU 8 1HB LEU 8 1.869 -0.932 -5.507 48 HB3 LEU 8 2HB LEU 8 0.680 0.152 -4.788 49 HG LEU 8 HG LEU 8 1.645 1.055 -6.856 50 HD11 LEU 8 1HD1 LEU 8 1.754 3.212 -6.097 51 HD12 LEU 8 2HD1 LEU 8 2.726 2.787 -4.689 52 HD13 LEU 8 3HD1 LEU 8 1.001 2.424 -4.711 53 HD21 LEU 8 3HD2 LEU 8 3.817 0.956 -7.304 54 HD22 LEU 8 1HD2 LEU 8 4.050 0.076 -5.794 55 HD23 LEU 8 2HD2 LEU 8 4.207 1.832 -5.824 56 H LEU 9 H LEU 9 3.458 2.083 -2.814 57 HA LEU 9 HA LEU 9 1.150 2.700 -1.088 58 HB2 LEU 9 1HB LEU 9 3.266 2.135 0.108 59 HB3 LEU 9 2HB LEU 9 4.011 3.541 -0.650 60 HG LEU 9 HG LEU 9 3.221 3.789 1.757 61 HD11 LEU 9 1HD1 LEU 9 1.813 5.906 0.338 62 HD12 LEU 9 2HD1 LEU 9 3.414 5.575 -0.320 63 HD13 LEU 9 3HD1 LEU 9 3.231 5.987 1.384 64 HD21 LEU 9 3HD2 LEU 9 1.031 3.753 2.305 65 HD22 LEU 9 1HD2 LEU 9 0.921 2.695 0.898 66 HD23 LEU 9 2HD2 LEU 9 0.518 4.405 0.747 67 H VAL 10 H VAL 10 0.290 4.730 -1.161 68 HA VAL 10 HA VAL 10 1.505 6.619 -3.071 69 HB VAL 10 HB VAL 10 -1.458 6.294 -2.595 70 HG11 VAL 10 1HG1 VAL 10 -1.776 8.035 -3.972 71 HG12 VAL 10 2HG1 VAL 10 -0.099 8.435 -3.596 72 HG13 VAL 10 3HG1 VAL 10 -0.485 7.534 -5.063 73 HG21 VAL 10 3HG2 VAL 10 0.182 5.293 -4.922 74 HG22 VAL 10 1HG2 VAL 10 -0.508 4.285 -3.650 75 HG23 VAL 10 2HG2 VAL 10 -1.568 5.171 -4.745 76 H CYS 11 H CYS 11 2.106 8.458 -2.155 77 HA CYS 11 HA CYS 11 0.463 9.992 -0.458 78 HB2 CYS 11 1HB CYS 11 0.982 8.382 1.259 79 HB3 CYS 11 2HB CYS 11 2.699 8.471 0.889 80 HG CYS 11 HG CYS 11 1.209 10.022 3.209 81 H GLY 12 H GLY 12 3.745 9.233 -1.500 82 HA2 GLY 12 1HA GLY 12 4.952 10.873 -2.809 83 HA3 GLY 12 2HA GLY 12 4.206 12.127 -1.829 84 H ALA 13 H ALA 13 4.917 12.398 0.360 85 HA ALA 13 HA ALA 13 7.404 11.053 1.095 86 HB1 ALA 13 3HB ALA 13 7.497 13.962 1.502 87 HB2 ALA 13 1HB ALA 13 8.762 12.842 0.996 88 HB3 ALA 13 2HB ALA 13 7.586 13.432 -0.178 89 H GLY 14 H GLY 14 8.140 12.056 3.337 90 HA2 GLY 14 1HA GLY 14 5.743 12.510 4.992 91 HA3 GLY 14 2HA GLY 14 6.899 11.261 5.430 92 H MET 15 H MET 15 7.155 12.365 7.454 93 HA MET 15 HA MET 15 8.049 15.026 7.672 94 HB2 MET 15 1HB MET 15 7.191 13.229 9.458 95 HB3 MET 15 2HB MET 15 8.923 13.038 9.703 96 HG2 MET 15 1HG MET 15 9.002 14.876 10.925 97 HG3 MET 15 2HG MET 15 8.272 15.819 9.629 98 HE1 MET 15 3HE MET 15 5.213 16.363 9.803 99 HE2 MET 15 1HE MET 15 5.524 17.200 11.324 100 HE3 MET 15 2HE MET 15 6.755 17.182 10.061 101 H SER 16 H SER 16 9.944 12.040 8.166 102 HA SER 16 HA SER 16 12.407 13.514 7.750 103 HB2 SER 16 1HB SER 16 12.666 11.962 9.470 104 HB3 SER 16 2HB SER 16 11.730 10.725 8.629 105 HG SER 16 HG SER 16 13.902 10.189 8.523 106 H THR 17 H THR 17 11.084 10.495 6.382 107 HA THR 17 HA THR 17 11.643 11.335 3.694 108 HB THR 17 HB THR 17 13.894 10.697 4.232 109 HG1 THR 17 HG1 THR 17 14.167 9.130 2.652 110 HG21 THR 17 3HG2 THR 17 13.289 9.286 6.208 111 HG22 THR 17 1HG2 THR 17 14.511 8.571 5.157 112 HG23 THR 17 2HG2 THR 17 12.844 8.000 5.086 113 H SER 18 H SER 18 10.902 8.667 5.891 114 HA SER 18 HA SER 18 8.502 7.986 4.626 115 HB2 SER 18 1HB SER 18 9.358 5.661 3.797 116 HB3 SER 18 2HB SER 18 9.567 7.074 2.762 117 HG SER 18 HG SER 18 11.575 6.406 2.778 118 H MET 19 H MET 19 8.409 8.241 7.052 119 HA MET 19 HA MET 19 9.479 6.469 8.876 120 HB2 MET 19 1HB MET 19 6.932 8.039 8.797 121 HB3 MET 19 2HB MET 19 7.199 6.895 10.105 122 HG2 MET 19 1HG MET 19 8.471 8.348 11.173 123 HG3 MET 19 2HG MET 19 9.535 8.495 9.776 124 HE1 MET 19 3HE MET 19 7.258 9.979 12.113 125 HE2 MET 19 1HE MET 19 8.614 11.096 11.954 126 HE3 MET 19 2HE MET 19 6.983 11.625 11.539 127 H LEU 20 H LEU 20 6.422 6.156 7.082 128 HA LEU 20 HA LEU 20 5.522 3.768 8.135 129 HB2 LEU 20 1HB LEU 20 5.237 5.072 5.466 130 HB3 LEU 20 2HB LEU 20 4.610 3.442 5.703 131 HG LEU 20 HG LEU 20 3.798 5.814 7.379 132 HD11 LEU 20 1HD1 LEU 20 1.629 5.468 5.999 133 HD12 LEU 20 2HD1 LEU 20 2.708 4.735 4.813 134 HD13 LEU 20 3HD1 LEU 20 2.954 6.408 5.313 135 HD21 LEU 20 3HD2 LEU 20 3.162 4.057 8.662 136 HD22 LEU 20 1HD2 LEU 20 3.106 2.937 7.301 137 HD23 LEU 20 2HD2 LEU 20 1.783 4.073 7.563 138 H VAL 21 H VAL 21 7.516 4.173 5.205 139 HA VAL 21 HA VAL 21 7.930 1.471 4.672 140 HB VAL 21 HB VAL 21 9.841 3.749 4.135 141 HG11 VAL 21 1HG1 VAL 21 10.041 0.931 3.667 142 HG12 VAL 21 2HG1 VAL 21 9.964 1.785 2.124 143 HG13 VAL 21 3HG1 VAL 21 11.205 2.205 3.305 144 HG21 VAL 21 3HG2 VAL 21 7.374 2.791 2.769 145 HG22 VAL 21 1HG2 VAL 21 7.963 4.434 3.015 146 HG23 VAL 21 2HG2 VAL 21 8.702 3.408 1.785 147 H GLN 22 H GLN 22 9.669 3.664 6.814 148 HA GLN 22 HA GLN 22 11.866 2.034 7.393 149 HB2 GLN 22 1HB GLN 22 10.552 4.363 8.649 150 HB3 GLN 22 2HB GLN 22 11.533 3.374 9.723 151 HG2 GLN 22 1HG GLN 22 13.450 3.656 8.245 152 HG3 GLN 22 2HG GLN 22 12.468 4.633 7.153 153 HE21 GLN 22 2HE2 GLN 22 14.387 4.593 9.960 154 HE22 GLN 22 1HE2 GLN 22 14.197 6.253 10.400 155 H ARG 23 H ARG 23 8.982 2.539 9.435 156 HA ARG 23 HA ARG 23 9.485 0.526 11.270 157 HB2 ARG 23 1HB ARG 23 6.768 1.424 10.293 158 HB3 ARG 23 2HB ARG 23 7.112 0.618 11.818 159 HG2 ARG 23 1HG ARG 23 8.646 3.070 11.401 160 HG3 ARG 23 2HG ARG 23 6.899 3.309 11.472 161 HD2 ARG 23 1HD ARG 23 7.657 3.507 13.693 162 HD3 ARG 23 2HD ARG 23 6.936 1.902 13.580 163 HE ARG 23 HE ARG 23 9.720 1.796 13.057 164 HH11 ARG 23 1HH1 ARG 23 7.414 2.141 15.642 165 HH12 ARG 23 2HH1 ARG 23 8.463 1.466 16.844 166 HH21 ARG 23 1HH2 ARG 23 11.111 0.905 14.631 167 HH22 ARG 23 2HH2 ARG 23 10.567 0.764 16.267 168 H ILE 24 H ILE 24 7.390 0.337 8.389 169 HA ILE 24 HA ILE 24 6.680 -2.329 8.569 170 HB ILE 24 HB ILE 24 7.202 -0.763 6.040 171 HG12 ILE 24 1HG1 ILE 24 4.535 -1.243 7.354 172 HG13 ILE 24 2HG1 ILE 24 5.533 0.142 7.782 173 HG21 ILE 24 1HG2 ILE 24 6.868 -2.732 5.042 174 HG22 ILE 24 2HG2 ILE 24 6.292 -3.485 6.529 175 HG23 ILE 24 3HG2 ILE 24 5.182 -2.551 5.528 176 HD11 ILE 24 3HD1 ILE 24 3.989 0.900 6.181 177 HD12 ILE 24 1HD1 ILE 24 5.527 0.740 5.334 178 HD13 ILE 24 2HD1 ILE 24 4.278 -0.488 5.132 179 H GLU 25 H GLU 25 9.510 -0.910 6.958 180 HA GLU 25 HA GLU 25 10.570 -3.276 5.910 181 HB2 GLU 25 1HB GLU 25 11.725 -0.617 6.650 182 HB3 GLU 25 2HB GLU 25 12.811 -1.932 6.221 183 HG2 GLU 25 1HG GLU 25 10.553 -0.995 4.471 184 HG3 GLU 25 2HG GLU 25 12.208 -0.401 4.347 185 H LYS 26 H LYS 26 11.008 -1.748 9.066 186 HA LYS 26 HA LYS 26 13.012 -3.468 10.033 187 HB2 LYS 26 1HB LYS 26 11.304 -1.383 11.085 188 HB3 LYS 26 2HB LYS 26 11.465 -2.700 12.241 189 HG2 LYS 26 1HG LYS 26 13.928 -1.668 10.939 190 HG3 LYS 26 2HG LYS 26 13.160 -0.686 12.189 191 HD2 LYS 26 1HD LYS 26 13.667 -2.159 13.844 192 HD3 LYS 26 2HD LYS 26 13.524 -3.563 12.785 193 HE2 LYS 26 1HE LYS 26 15.757 -3.625 12.841 194 HE3 LYS 26 2HE LYS 26 15.694 -2.245 11.746 195 HZ1 LYS 26 3HZ LYS 26 16.857 -2.305 14.224 196 HZ2 LYS 26 1HZ LYS 26 15.419 -1.448 14.470 197 HZ3 LYS 26 2HZ LYS 26 16.527 -0.924 13.305 198 H TYR 27 H TYR 27 9.508 -3.503 10.708 199 HA TYR 27 HA TYR 27 9.396 -5.835 12.177 200 HB2 TYR 27 1HB TYR 27 7.461 -4.414 11.989 201 HB3 TYR 27 2HB TYR 27 7.371 -4.683 10.253 202 HD1 TYR 27 HD1 TYR 27 6.499 -6.778 9.361 203 HD2 TYR 27 HD2 TYR 27 6.670 -6.085 13.556 204 HE1 TYR 27 HE1 TYR 27 4.978 -8.675 9.731 205 HE2 TYR 27 HE2 TYR 27 5.150 -7.981 13.937 206 HH TYR 27 HH TYR 27 4.219 -10.139 11.352 207 H ALA 28 H ALA 28 8.931 -5.506 8.659 208 HA ALA 28 HA ALA 28 8.644 -8.232 8.099 209 HB1 ALA 28 3HB ALA 28 9.224 -7.624 5.780 210 HB2 ALA 28 1HB ALA 28 8.028 -6.537 6.490 211 HB3 ALA 28 2HB ALA 28 9.709 -6.024 6.342 212 H LYS 29 H LYS 29 11.544 -6.174 8.016 213 HA LYS 29 HA LYS 29 13.354 -8.130 7.165 214 HB2 LYS 29 1HB LYS 29 13.876 -5.731 7.196 215 HB3 LYS 29 2HB LYS 29 13.855 -5.744 8.954 216 HG2 LYS 29 1HG LYS 29 15.664 -7.728 7.847 217 HG3 LYS 29 2HG LYS 29 16.061 -6.081 7.349 218 HD2 LYS 29 1HD LYS 29 15.821 -5.470 9.821 219 HD3 LYS 29 2HD LYS 29 15.870 -7.207 10.130 220 HE2 LYS 29 1HE LYS 29 18.090 -6.503 10.369 221 HE3 LYS 29 2HE LYS 29 18.023 -7.209 8.755 222 HZ1 LYS 29 3HZ LYS 29 18.947 -4.720 9.389 223 HZ2 LYS 29 1HZ LYS 29 17.414 -4.419 8.737 224 HZ3 LYS 29 2HZ LYS 29 18.561 -5.275 7.837 225 H SER 30 H SER 30 11.943 -7.515 10.280 226 HA SER 30 HA SER 30 13.842 -9.166 11.705 227 HB2 SER 30 1HB SER 30 12.748 -7.194 12.768 228 HB3 SER 30 2HB SER 30 11.202 -8.035 12.664 229 HG SER 30 HG SER 30 12.785 -8.175 14.647 230 H LYS 31 H LYS 31 10.473 -9.397 10.639 231 HA LYS 31 HA LYS 31 10.060 -12.002 11.730 232 HB2 LYS 31 1HB LYS 31 8.550 -10.211 9.868 233 HB3 LYS 31 2HB LYS 31 8.086 -11.902 9.994 234 HG2 LYS 31 1HG LYS 31 8.269 -10.005 12.325 235 HG3 LYS 31 2HG LYS 31 6.781 -10.404 11.462 236 HD2 LYS 31 1HD LYS 31 6.538 -12.282 12.632 237 HD3 LYS 31 2HD LYS 31 8.175 -12.804 12.226 238 HE2 LYS 31 1HE LYS 31 9.094 -11.681 14.094 239 HE3 LYS 31 2HE LYS 31 7.604 -10.784 14.381 240 HZ1 LYS 31 3HZ LYS 31 7.049 -12.376 15.798 241 HZ2 LYS 31 1HZ LYS 31 8.368 -13.336 15.351 242 HZ3 LYS 31 2HZ LYS 31 6.912 -13.449 14.498 243 H ASN 32 H ASN 32 11.636 -10.834 8.952 244 HA ASN 32 HA ASN 32 12.674 -11.865 7.209 245 HB2 ASN 32 1HB ASN 32 13.300 -13.457 9.133 246 HB3 ASN 32 2HB ASN 32 12.052 -14.520 8.489 247 HD21 ASN 32 2HD2 ASN 32 15.235 -13.336 8.142 248 HD22 ASN 32 1HD2 ASN 32 15.669 -14.255 6.744 249 H ILE 33 H ILE 33 10.412 -11.069 6.370 250 HA ILE 33 HA ILE 33 8.982 -13.364 5.205 251 HB ILE 33 HB ILE 33 8.018 -10.523 5.563 252 HG12 ILE 33 1HG1 ILE 33 6.911 -12.983 6.897 253 HG13 ILE 33 2HG1 ILE 33 8.245 -12.082 7.609 254 HG21 ILE 33 1HG2 ILE 33 6.627 -12.959 4.459 255 HG22 ILE 33 2HG2 ILE 33 5.836 -11.429 4.837 256 HG23 ILE 33 3HG2 ILE 33 7.064 -11.498 3.573 257 HD11 ILE 33 3HD1 ILE 33 6.369 -11.224 8.661 258 HD12 ILE 33 1HD1 ILE 33 6.704 -10.042 7.397 259 HD13 ILE 33 2HD1 ILE 33 5.415 -11.226 7.178 260 H ASN 34 H ASN 34 8.613 -13.462 3.009 261 HA ASN 34 HA ASN 34 10.460 -11.961 1.370 262 HB2 ASN 34 1HB ASN 34 8.501 -14.173 0.730 263 HB3 ASN 34 2HB ASN 34 9.550 -13.422 -0.469 264 HD21 ASN 34 2HD2 ASN 34 10.082 -15.829 -0.545 265 HD22 ASN 34 1HD2 ASN 34 11.414 -16.337 0.431 266 H ALA 35 H ALA 35 9.515 -9.859 1.620 267 HA ALA 35 HA ALA 35 7.458 -9.355 -0.370 268 HB1 ALA 35 3HB ALA 35 6.016 -9.592 1.471 269 HB2 ALA 35 1HB ALA 35 7.107 -8.715 2.544 270 HB3 ALA 35 2HB ALA 35 6.233 -7.853 1.278 271 H THR 36 H THR 36 7.164 -6.973 -0.725 272 HA THR 36 HA THR 36 9.477 -5.370 0.077 273 HB THR 36 HB THR 36 9.065 -4.675 -2.603 274 HG1 THR 36 HG1 THR 36 9.391 -7.496 -2.369 275 HG21 THR 36 3HG2 THR 36 11.331 -5.128 -2.835 276 HG22 THR 36 1HG2 THR 36 11.271 -6.508 -1.741 277 HG23 THR 36 2HG2 THR 36 11.173 -4.869 -1.098 278 H ILE 37 H ILE 37 9.204 -3.060 -0.432 279 HA ILE 37 HA ILE 37 6.428 -2.230 -0.857 280 HB ILE 37 HB ILE 37 6.815 -2.384 1.601 281 HG12 ILE 37 1HG1 ILE 37 6.563 0.523 1.194 282 HG13 ILE 37 2HG1 ILE 37 5.515 -0.453 0.169 283 HG21 ILE 37 1HG2 ILE 37 9.283 -1.337 1.027 284 HG22 ILE 37 2HG2 ILE 37 8.431 0.040 1.722 285 HG23 ILE 37 3HG2 ILE 37 8.570 -1.463 2.635 286 HD11 ILE 37 3HD1 ILE 37 4.799 -1.632 2.300 287 HD12 ILE 37 1HD1 ILE 37 5.595 -0.315 3.160 288 HD13 ILE 37 2HD1 ILE 37 4.250 0.028 2.073 289 H GLU 38 H GLU 38 6.177 -0.112 -1.634 290 HA GLU 38 HA GLU 38 8.481 1.571 -2.052 291 HB2 GLU 38 1HB GLU 38 8.547 -0.144 -3.912 292 HB3 GLU 38 2HB GLU 38 7.033 0.538 -4.489 293 HG2 GLU 38 1HG GLU 38 8.040 2.302 -5.412 294 HG3 GLU 38 2HG GLU 38 9.120 2.527 -4.037 295 H ALA 39 H ALA 39 7.916 3.672 -2.217 296 HA ALA 39 HA ALA 39 5.039 4.266 -2.443 297 HB1 ALA 39 3HB ALA 39 7.104 5.974 -1.069 298 HB2 ALA 39 1HB ALA 39 5.348 6.135 -1.004 299 HB3 ALA 39 2HB ALA 39 6.137 4.753 -0.241 300 H ILE 40 H ILE 40 4.348 5.744 -3.902 301 HA ILE 40 HA ILE 40 6.221 7.512 -5.231 302 HB ILE 40 HB ILE 40 5.410 6.744 -7.508 303 HG12 ILE 40 1HG1 ILE 40 4.987 4.021 -6.466 304 HG13 ILE 40 2HG1 ILE 40 3.705 5.163 -6.079 305 HG21 ILE 40 1HG2 ILE 40 7.284 5.482 -7.772 306 HG22 ILE 40 2HG2 ILE 40 7.628 6.157 -6.180 307 HG23 ILE 40 3HG2 ILE 40 6.977 4.524 -6.324 308 HD11 ILE 40 3HD1 ILE 40 4.741 4.640 -8.854 309 HD12 ILE 40 1HD1 ILE 40 3.311 3.884 -8.153 310 HD13 ILE 40 2HD1 ILE 40 3.352 5.629 -8.405 311 H ALA 41 H ALA 41 4.875 8.597 -7.176 312 HA ALA 41 HA ALA 41 2.617 9.836 -5.864 313 HB1 ALA 41 3HB ALA 41 4.099 11.309 -6.997 314 HB2 ALA 41 1HB ALA 41 3.995 10.371 -8.488 315 HB3 ALA 41 2HB ALA 41 2.594 11.282 -7.916 316 H GLU 42 H GLU 42 0.832 10.472 -7.710 317 HA GLU 42 HA GLU 42 -0.460 7.942 -8.263 318 HB2 GLU 42 1HB GLU 42 -2.380 9.364 -8.953 319 HB3 GLU 42 2HB GLU 42 -1.820 9.693 -7.320 320 HG2 GLU 42 1HG GLU 42 -1.766 11.832 -7.881 321 HG3 GLU 42 2HG GLU 42 -0.373 11.451 -8.892 322 H THR 43 H THR 43 1.282 10.377 -9.987 323 HA THR 43 HA THR 43 0.299 9.994 -12.580 324 HB THR 43 HB THR 43 2.311 11.020 -13.386 325 HG1 THR 43 HG1 THR 43 4.115 10.422 -12.469 326 HG21 THR 43 3HG2 THR 43 1.820 12.219 -10.665 327 HG22 THR 43 1HG2 THR 43 0.700 12.400 -12.015 328 HG23 THR 43 2HG2 THR 43 2.338 13.045 -12.134 329 H ARG 44 H ARG 44 2.812 8.285 -10.777 330 HA ARG 44 HA ARG 44 3.047 6.375 -13.004 331 HB2 ARG 44 1HB ARG 44 5.163 5.666 -11.762 332 HB3 ARG 44 2HB ARG 44 5.191 7.236 -12.554 333 HG2 ARG 44 1HG ARG 44 4.753 8.328 -10.411 334 HG3 ARG 44 2HG ARG 44 4.731 6.751 -9.618 335 HD2 ARG 44 1HD ARG 44 7.065 6.395 -10.419 336 HD3 ARG 44 2HD ARG 44 7.061 8.052 -11.023 337 HE ARG 44 HE ARG 44 6.346 8.229 -8.375 338 HH11 ARG 44 1HH1 ARG 44 9.066 7.009 -10.172 339 HH12 ARG 44 2HH1 ARG 44 10.210 7.335 -8.913 340 HH21 ARG 44 1HH2 ARG 44 7.843 8.662 -6.709 341 HH22 ARG 44 2HH2 ARG 44 9.514 8.274 -6.943 342 H LEU 45 H LEU 45 1.070 6.589 -10.662 343 HA LEU 45 HA LEU 45 1.580 4.232 -9.094 344 HB2 LEU 45 1HB LEU 45 0.377 5.883 -7.966 345 HB3 LEU 45 2HB LEU 45 -0.701 6.160 -9.333 346 HG LEU 45 HG LEU 45 -1.794 4.007 -8.895 347 HD11 LEU 45 1HD1 LEU 45 -0.132 3.862 -6.391 348 HD12 LEU 45 2HD1 LEU 45 0.234 2.953 -7.857 349 HD13 LEU 45 3HD1 LEU 45 -1.282 2.672 -7.001 350 HD21 LEU 45 3HD2 LEU 45 -2.941 5.754 -7.900 351 HD22 LEU 45 1HD2 LEU 45 -1.646 6.087 -6.749 352 HD23 LEU 45 2HD2 LEU 45 -2.664 4.662 -6.542 353 H SER 46 H SER 46 -0.932 5.106 -11.474 354 HA SER 46 HA SER 46 -1.901 2.433 -11.689 355 HB2 SER 46 1HB SER 46 -2.347 4.898 -13.381 356 HB3 SER 46 2HB SER 46 -3.153 3.357 -13.681 357 HG SER 46 HG SER 46 -3.495 5.176 -11.588 358 H GLU 47 H GLU 47 0.803 4.005 -12.947 359 HA GLU 47 HA GLU 47 0.958 2.434 -15.381 360 HB2 GLU 47 1HB GLU 47 2.831 4.436 -14.118 361 HB3 GLU 47 2HB GLU 47 3.201 3.572 -15.602 362 HG2 GLU 47 1HG GLU 47 0.804 5.348 -15.219 363 HG3 GLU 47 2HG GLU 47 2.321 5.853 -15.964 364 H VAL 48 H VAL 48 2.082 2.296 -12.116 365 HA VAL 48 HA VAL 48 3.926 0.105 -12.784 366 HB VAL 48 HB VAL 48 4.923 0.407 -10.605 367 HG11 VAL 48 1HG1 VAL 48 4.547 2.924 -12.203 368 HG12 VAL 48 2HG1 VAL 48 5.647 2.834 -10.825 369 HG13 VAL 48 3HG1 VAL 48 5.904 1.799 -12.231 370 HG21 VAL 48 3HG2 VAL 48 3.138 0.948 -9.184 371 HG22 VAL 48 1HG2 VAL 48 4.131 2.405 -9.218 372 HG23 VAL 48 2HG2 VAL 48 2.651 2.324 -10.174 373 H VAL 49 H VAL 49 0.939 0.858 -11.232 374 HA VAL 49 HA VAL 49 0.633 -1.167 -9.385 375 HB VAL 49 HB VAL 49 -1.014 0.661 -9.829 376 HG11 VAL 49 1HG1 VAL 49 -2.128 -1.115 -11.980 377 HG12 VAL 49 2HG1 VAL 49 -2.572 0.547 -11.584 378 HG13 VAL 49 3HG1 VAL 49 -1.013 0.204 -12.336 379 HG21 VAL 49 3HG2 VAL 49 -1.417 -1.620 -8.592 380 HG22 VAL 49 1HG2 VAL 49 -2.753 -0.509 -8.891 381 HG23 VAL 49 2HG2 VAL 49 -2.520 -1.910 -9.937 382 H ASP 50 H ASP 50 0.552 -1.344 -12.868 383 HA ASP 50 HA ASP 50 -0.716 -3.827 -13.174 384 HB2 ASP 50 1HB ASP 50 0.023 -2.034 -14.940 385 HB3 ASP 50 2HB ASP 50 1.505 -2.986 -15.001 386 H ARG 51 H ARG 51 2.613 -2.974 -12.452 387 HA ARG 51 HA ARG 51 3.485 -5.740 -12.634 388 HB2 ARG 51 1HB ARG 51 5.049 -3.329 -11.698 389 HB3 ARG 51 2HB ARG 51 5.699 -4.893 -12.170 390 HG2 ARG 51 1HG ARG 51 4.162 -3.932 -14.338 391 HG3 ARG 51 2HG ARG 51 5.193 -2.611 -13.782 392 HD2 ARG 51 1HD ARG 51 7.143 -4.106 -13.915 393 HD3 ARG 51 2HD ARG 51 6.099 -5.393 -14.518 394 HE ARG 51 HE ARG 51 6.109 -4.392 -16.580 395 HH11 ARG 51 1HH1 ARG 51 7.335 -2.158 -14.208 396 HH12 ARG 51 2HH1 ARG 51 7.849 -0.991 -15.382 397 HH21 ARG 51 1HH2 ARG 51 6.781 -2.864 -18.135 398 HH22 ARG 51 2HH2 ARG 51 7.532 -1.394 -17.616 399 H PHE 52 H PHE 52 3.089 -3.240 -10.149 400 HA PHE 52 HA PHE 52 4.001 -4.740 -7.967 401 HB2 PHE 52 1HB PHE 52 2.214 -2.360 -8.272 402 HB3 PHE 52 2HB PHE 52 2.336 -3.142 -6.700 403 HD1 PHE 52 HD2 PHE 52 4.404 -3.088 -5.439 404 HD2 PHE 52 HD1 PHE 52 4.079 -1.167 -9.223 405 HE1 PHE 52 HE2 PHE 52 6.475 -1.841 -4.980 406 HE2 PHE 52 HE1 PHE 52 6.149 0.083 -8.770 407 HZ PHE 52 HZ PHE 52 7.350 -0.252 -6.646 408 H ASP 53 H ASP 53 2.290 -5.070 -6.041 409 HA ASP 53 HA ASP 53 0.392 -7.044 -7.087 410 HB2 ASP 53 1HB ASP 53 2.006 -6.802 -4.633 411 HB3 ASP 53 2HB ASP 53 0.371 -7.410 -4.386 412 H VAL 54 H VAL 54 0.352 -5.085 -4.122 413 HA VAL 54 HA VAL 54 -2.432 -4.354 -4.755 414 HB VAL 54 HB VAL 54 -2.843 -4.142 -2.374 415 HG11 VAL 54 1HG1 VAL 54 -3.228 -6.335 -2.118 416 HG12 VAL 54 2HG1 VAL 54 -2.519 -6.491 -3.726 417 HG13 VAL 54 3HG1 VAL 54 -1.524 -6.752 -2.293 418 HG21 VAL 54 3HG2 VAL 54 -1.023 -4.989 -0.798 419 HG22 VAL 54 1HG2 VAL 54 0.091 -4.735 -2.141 420 HG23 VAL 54 2HG2 VAL 54 -0.813 -3.375 -1.478 421 H VAL 55 H VAL 55 -3.130 -2.269 -3.667 422 HA VAL 55 HA VAL 55 -0.959 -0.280 -3.734 423 HB VAL 55 HB VAL 55 -3.729 0.107 -4.876 424 HG11 VAL 55 1HG1 VAL 55 -1.329 1.929 -4.778 425 HG12 VAL 55 2HG1 VAL 55 -2.790 2.240 -5.717 426 HG13 VAL 55 3HG1 VAL 55 -2.873 2.163 -3.957 427 HG21 VAL 55 3HG2 VAL 55 -2.749 -1.160 -6.512 428 HG22 VAL 55 1HG2 VAL 55 -2.192 0.443 -6.993 429 HG23 VAL 55 2HG2 VAL 55 -1.117 -0.631 -6.097 430 H LEU 56 H LEU 56 -1.153 1.472 -2.339 431 HA LEU 56 HA LEU 56 -3.413 1.426 -0.463 432 HB2 LEU 56 1HB LEU 56 -0.529 1.128 0.108 433 HB3 LEU 56 2HB LEU 56 -1.433 2.194 1.181 434 HG LEU 56 HG LEU 56 -2.758 -0.365 0.780 435 HD11 LEU 56 1HD1 LEU 56 -0.327 -0.637 2.445 436 HD12 LEU 56 2HD1 LEU 56 -0.123 -0.740 0.696 437 HD13 LEU 56 3HD1 LEU 56 -1.216 -1.850 1.523 438 HD21 LEU 56 3HD2 LEU 56 -1.730 0.603 3.394 439 HD22 LEU 56 1HD2 LEU 56 -3.289 -0.112 2.984 440 HD23 LEU 56 2HD2 LEU 56 -2.955 1.570 2.571 441 H LEU 57 H LEU 57 -4.141 3.394 0.204 442 HA LEU 57 HA LEU 57 -2.800 5.739 -0.968 443 HB2 LEU 57 1HB LEU 57 -5.430 4.852 -1.212 444 HB3 LEU 57 2HB LEU 57 -5.513 6.207 -0.087 445 HG LEU 57 HG LEU 57 -4.266 6.347 -2.830 446 HD11 LEU 57 1HD1 LEU 57 -6.782 5.901 -2.712 447 HD12 LEU 57 2HD1 LEU 57 -6.237 7.291 -3.651 448 HD13 LEU 57 3HD1 LEU 57 -6.907 7.527 -2.037 449 HD21 LEU 57 3HD2 LEU 57 -3.308 8.081 -1.663 450 HD22 LEU 57 1HD2 LEU 57 -4.708 8.289 -0.610 451 HD23 LEU 57 2HD2 LEU 57 -4.769 8.855 -2.279 452 H ALA 58 H ALA 58 -2.705 7.678 0.249 453 HA ALA 58 HA ALA 58 -2.547 7.200 3.126 454 HB1 ALA 58 3HB ALA 58 -1.279 9.085 1.235 455 HB2 ALA 58 1HB ALA 58 -1.573 9.679 2.870 456 HB3 ALA 58 2HB ALA 58 -0.597 8.231 2.620 457 HA PRO 59 HA PRO 59 -6.071 9.563 4.243 458 HB2 PRO 59 1HB PRO 59 -5.210 10.894 6.446 459 HB3 PRO 59 2HB PRO 59 -5.531 9.156 6.438 460 HG2 PRO 59 1HG PRO 59 -2.919 10.599 6.200 461 HG3 PRO 59 2HG PRO 59 -3.317 9.154 7.148 462 HD2 PRO 59 1HD PRO 59 -2.042 9.026 4.762 463 HD3 PRO 59 2HD PRO 59 -3.149 7.756 5.323 464 H GLN 60 H GLN 60 -3.139 11.161 3.431 465 HA GLN 60 HA GLN 60 -4.376 13.804 3.453 466 HB2 GLN 60 1HB GLN 60 -2.171 14.666 2.961 467 HB3 GLN 60 2HB GLN 60 -2.063 13.528 4.298 468 HG2 GLN 60 1HG GLN 60 -1.497 11.811 2.423 469 HG3 GLN 60 2HG GLN 60 -1.094 13.254 1.494 470 HE21 GLN 60 2HE2 GLN 60 0.762 14.324 1.913 471 HE22 GLN 60 1HE2 GLN 60 1.920 13.834 3.097 472 H SER 61 H SER 61 -5.530 11.994 1.666 473 HA SER 61 HA SER 61 -4.564 12.932 -0.952 474 HB2 SER 61 1HB SER 61 -4.596 10.694 -1.334 475 HB3 SER 61 2HB SER 61 -5.721 10.383 -0.011 476 HG SER 61 HG SER 61 -7.414 10.952 -1.333 477 H ARG 62 H ARG 62 -5.724 14.445 -1.925 478 HA ARG 62 HA ARG 62 -8.410 15.039 -0.969 479 HB2 ARG 62 1HB ARG 62 -6.248 16.557 -2.084 480 HB3 ARG 62 2HB ARG 62 -7.681 16.783 -3.077 481 HG2 ARG 62 1HG ARG 62 -8.947 17.444 -1.086 482 HG3 ARG 62 2HG ARG 62 -7.493 17.240 -0.107 483 HD2 ARG 62 1HD ARG 62 -6.722 18.884 -2.225 484 HD3 ARG 62 2HD ARG 62 -8.314 19.470 -1.748 485 HE ARG 62 HE ARG 62 -7.047 19.242 0.614 486 HH11 ARG 62 1HH1 ARG 62 -6.158 20.745 -2.397 487 HH12 ARG 62 2HH1 ARG 62 -5.188 21.970 -1.650 488 HH21 ARG 62 1HH2 ARG 62 -5.773 20.850 1.611 489 HH22 ARG 62 2HH2 ARG 62 -4.968 22.029 0.631 490 H PHE 63 H PHE 63 -6.933 14.909 -4.216 491 HA PHE 63 HA PHE 63 -9.503 13.989 -5.278 492 HB2 PHE 63 1HB PHE 63 -7.146 15.408 -6.423 493 HB3 PHE 63 2HB PHE 63 -8.084 14.379 -7.501 494 HD1 PHE 63 HD1 PHE 63 -10.750 14.738 -7.140 495 HD2 PHE 63 HD2 PHE 63 -7.701 17.622 -6.434 496 HE1 PHE 63 HE1 PHE 63 -12.396 16.543 -7.434 497 HE2 PHE 63 HE2 PHE 63 -9.342 19.433 -6.726 498 HZ PHE 63 HZ PHE 63 -11.693 18.894 -7.226 499 H ASN 64 H ASN 64 -6.258 12.950 -4.686 500 HA ASN 64 HA ASN 64 -5.916 10.890 -6.489 501 HB2 ASN 64 1HB ASN 64 -5.122 10.771 -3.574 502 HB3 ASN 64 2HB ASN 64 -4.365 9.920 -4.917 503 HD21 ASN 64 2HD2 ASN 64 -3.959 12.392 -2.876 504 HD22 ASN 64 1HD2 ASN 64 -2.971 13.434 -3.837 505 H LYS 65 H LYS 65 -7.887 10.989 -3.591 506 HA LYS 65 HA LYS 65 -8.416 8.233 -3.365 507 HB2 LYS 65 1HB LYS 65 -8.926 9.656 -1.515 508 HB3 LYS 65 2HB LYS 65 -9.976 10.666 -2.500 509 HG2 LYS 65 1HG LYS 65 -11.700 9.145 -2.466 510 HG3 LYS 65 2HG LYS 65 -10.628 7.778 -2.152 511 HD2 LYS 65 1HD LYS 65 -10.931 7.983 0.044 512 HD3 LYS 65 2HD LYS 65 -10.455 9.681 -0.007 513 HE2 LYS 65 1HE LYS 65 -12.857 10.055 -0.925 514 HE3 LYS 65 2HE LYS 65 -13.182 8.468 -0.226 515 HZ1 LYS 65 3HZ LYS 65 -12.802 9.234 1.904 516 HZ2 LYS 65 1HZ LYS 65 -13.578 10.558 1.192 517 HZ3 LYS 65 2HZ LYS 65 -11.898 10.569 1.393 518 H LYS 66 H LYS 66 -10.443 10.813 -4.770 519 HA LYS 66 HA LYS 66 -12.447 9.182 -5.795 520 HB2 LYS 66 1HB LYS 66 -12.662 11.608 -5.671 521 HB3 LYS 66 2HB LYS 66 -11.398 11.802 -6.878 522 HG2 LYS 66 1HG LYS 66 -13.006 11.864 -8.401 523 HG3 LYS 66 2HG LYS 66 -13.253 10.142 -8.097 524 HD2 LYS 66 1HD LYS 66 -15.366 10.832 -7.659 525 HD3 LYS 66 2HD LYS 66 -14.681 11.159 -6.066 526 HE2 LYS 66 1HE LYS 66 -15.848 13.113 -6.635 527 HE3 LYS 66 2HE LYS 66 -14.155 13.488 -6.950 528 HZ1 LYS 66 3HZ LYS 66 -15.701 12.403 -9.170 529 HZ2 LYS 66 1HZ LYS 66 -14.492 13.587 -9.169 530 HZ3 LYS 66 2HZ LYS 66 -16.066 13.984 -8.693 531 H ARG 67 H ARG 67 -9.554 10.428 -7.459 532 HA ARG 67 HA ARG 67 -9.986 9.174 -9.915 533 HB2 ARG 67 1HB ARG 67 -7.908 10.677 -8.674 534 HB3 ARG 67 2HB ARG 67 -7.184 9.244 -9.393 535 HG2 ARG 67 1HG ARG 67 -8.155 9.805 -11.546 536 HG3 ARG 67 2HG ARG 67 -8.947 11.213 -10.836 537 HD2 ARG 67 1HD ARG 67 -6.812 12.221 -10.346 538 HD3 ARG 67 2HD ARG 67 -5.964 10.775 -10.892 539 HE ARG 67 HE ARG 67 -7.631 11.902 -12.924 540 HH11 ARG 67 1HH1 ARG 67 -4.535 12.153 -11.352 541 HH12 ARG 67 2HH1 ARG 67 -3.758 12.893 -12.712 542 HH21 ARG 67 1HH2 ARG 67 -6.620 12.876 -14.721 543 HH22 ARG 67 2HH2 ARG 67 -4.945 13.305 -14.628 544 H LEU 68 H LEU 68 -7.686 8.125 -7.393 545 HA LEU 68 HA LEU 68 -7.042 5.662 -8.445 546 HB2 LEU 68 1HB LEU 68 -6.008 6.785 -6.460 547 HB3 LEU 68 2HB LEU 68 -7.385 6.235 -5.508 548 HG LEU 68 HG LEU 68 -6.747 3.930 -5.839 549 HD11 LEU 68 1HD1 LEU 68 -4.368 3.663 -6.935 550 HD12 LEU 68 2HD1 LEU 68 -4.854 5.122 -7.799 551 HD13 LEU 68 3HD1 LEU 68 -5.834 3.660 -7.915 552 HD21 LEU 68 3HD2 LEU 68 -5.608 4.429 -3.973 553 HD22 LEU 68 1HD2 LEU 68 -4.931 5.904 -4.662 554 HD23 LEU 68 2HD2 LEU 68 -4.185 4.343 -5.012 555 H GLU 69 H GLU 69 -9.891 6.603 -6.640 556 HA GLU 69 HA GLU 69 -10.842 3.969 -6.140 557 HB2 GLU 69 1HB GLU 69 -12.011 6.716 -6.002 558 HB3 GLU 69 2HB GLU 69 -13.096 5.333 -5.958 559 HG2 GLU 69 1HG GLU 69 -10.757 5.385 -4.121 560 HG3 GLU 69 2HG GLU 69 -12.160 6.388 -3.756 561 H GLU 70 H GLU 70 -11.945 6.457 -8.452 562 HA GLU 70 HA GLU 70 -13.722 4.805 -9.848 563 HB2 GLU 70 1HB GLU 70 -13.740 6.505 -11.554 564 HB3 GLU 70 2HB GLU 70 -13.667 7.290 -9.982 565 HG2 GLU 70 1HG GLU 70 -11.363 7.799 -10.251 566 HG3 GLU 70 2HG GLU 70 -11.246 6.790 -11.691 567 H ILE 71 H ILE 71 -10.310 4.904 -9.855 568 HA ILE 71 HA ILE 71 -10.075 3.626 -12.464 569 HB ILE 71 HB ILE 71 -7.943 4.392 -10.466 570 HG12 ILE 71 1HG1 ILE 71 -8.340 5.668 -13.148 571 HG13 ILE 71 2HG1 ILE 71 -9.348 6.169 -11.794 572 HG21 ILE 71 1HG2 ILE 71 -6.816 2.795 -11.611 573 HG22 ILE 71 2HG2 ILE 71 -7.868 2.907 -13.020 574 HG23 ILE 71 3HG2 ILE 71 -6.607 4.112 -12.764 575 HD11 ILE 71 3HD1 ILE 71 -7.597 7.686 -11.782 576 HD12 ILE 71 1HD1 ILE 71 -7.140 6.517 -10.542 577 HD13 ILE 71 2HD1 ILE 71 -6.393 6.447 -12.139 578 H THR 72 H THR 72 -9.720 2.884 -9.044 579 HA THR 72 HA THR 72 -8.600 0.301 -9.374 580 HB THR 72 HB THR 72 -9.576 -0.042 -6.999 581 HG1 THR 72 HG1 THR 72 -10.675 1.575 -6.183 582 HG21 THR 72 3HG2 THR 72 -7.874 2.119 -6.447 583 HG22 THR 72 1HG2 THR 72 -7.324 1.453 -7.984 584 HG23 THR 72 2HG2 THR 72 -7.438 0.415 -6.563 585 H LYS 73 H LYS 73 -11.904 1.503 -9.155 586 HA LYS 73 HA LYS 73 -13.320 -0.821 -8.758 587 HB2 LYS 73 1HB LYS 73 -13.859 1.800 -9.910 588 HB3 LYS 73 2HB LYS 73 -14.829 0.536 -10.653 589 HG2 LYS 73 1HG LYS 73 -14.654 1.044 -7.691 590 HG3 LYS 73 2HG LYS 73 -15.942 1.632 -8.746 591 HD2 LYS 73 1HD LYS 73 -16.180 -0.876 -9.401 592 HD3 LYS 73 2HD LYS 73 -15.316 -1.167 -7.890 593 HE2 LYS 73 1HE LYS 73 -17.311 -1.068 -6.896 594 HE3 LYS 73 2HE LYS 73 -17.241 0.671 -7.178 595 HZ1 LYS 73 3HZ LYS 73 -18.828 -1.360 -8.514 596 HZ2 LYS 73 1HZ LYS 73 -18.177 -0.165 -9.518 597 HZ3 LYS 73 2HZ LYS 73 -19.176 0.270 -8.225 598 HA PRO 74 HA PRO 74 -13.383 -1.705 -13.500 599 HB2 PRO 74 1HB PRO 74 -11.800 -0.175 -15.087 600 HB3 PRO 74 2HB PRO 74 -13.467 0.258 -14.691 601 HG2 PRO 74 1HG PRO 74 -10.913 1.251 -13.484 602 HG3 PRO 74 2HG PRO 74 -12.364 2.163 -13.942 603 HD2 PRO 74 1HD PRO 74 -11.840 1.446 -11.383 604 HD3 PRO 74 2HD PRO 74 -13.492 1.576 -12.019 605 H LYS 75 H LYS 75 -10.282 -0.508 -12.274 606 HA LYS 75 HA LYS 75 -8.634 -2.278 -13.723 607 HB2 LYS 75 1HB LYS 75 -8.275 -0.648 -11.231 608 HB3 LYS 75 2HB LYS 75 -7.031 -1.792 -11.720 609 HG2 LYS 75 1HG LYS 75 -8.079 0.321 -13.577 610 HG3 LYS 75 2HG LYS 75 -6.744 0.616 -12.460 611 HD2 LYS 75 1HD LYS 75 -5.389 -0.197 -14.033 612 HD3 LYS 75 2HD LYS 75 -6.093 -1.783 -13.704 613 HE2 LYS 75 1HE LYS 75 -6.704 -1.773 -15.854 614 HE3 LYS 75 2HE LYS 75 -7.952 -0.629 -15.362 615 HZ1 LYS 75 3HZ LYS 75 -5.328 -0.058 -16.600 616 HZ2 LYS 75 1HZ LYS 75 -6.200 1.140 -15.783 617 HZ3 LYS 75 2HZ LYS 75 -6.868 0.387 -17.142 618 H GLY 76 H GLY 76 -10.593 -2.700 -10.912 619 HA2 GLY 76 1HA GLY 76 -10.962 -4.498 -9.534 620 HA3 GLY 76 2HA GLY 76 -10.471 -5.471 -10.912 621 H ILE 77 H ILE 77 -8.953 -3.395 -8.440 622 HA ILE 77 HA ILE 77 -7.048 -5.565 -7.913 623 HB ILE 77 HB ILE 77 -5.236 -3.842 -7.663 624 HG12 ILE 77 1HG1 ILE 77 -6.318 -1.938 -9.514 625 HG13 ILE 77 2HG1 ILE 77 -7.407 -2.080 -8.138 626 HG21 ILE 77 1HG2 ILE 77 -5.893 -5.321 -9.774 627 HG22 ILE 77 2HG2 ILE 77 -6.087 -3.725 -10.499 628 HG23 ILE 77 3HG2 ILE 77 -4.538 -4.192 -9.797 629 HD11 ILE 77 3HD1 ILE 77 -5.564 -1.597 -6.623 630 HD12 ILE 77 1HD1 ILE 77 -4.463 -1.473 -7.995 631 HD13 ILE 77 2HD1 ILE 77 -5.776 -0.310 -7.810 632 HA PRO 78 HA PRO 78 -7.785 -4.727 -3.667 633 HB2 PRO 78 1HB PRO 78 -5.388 -5.391 -2.578 634 HB3 PRO 78 2HB PRO 78 -6.524 -6.591 -3.204 635 HG2 PRO 78 1HG PRO 78 -4.091 -5.429 -4.503 636 HG3 PRO 78 2HG PRO 78 -4.645 -7.113 -4.470 637 HD2 PRO 78 1HD PRO 78 -5.031 -5.492 -6.605 638 HD3 PRO 78 2HD PRO 78 -6.178 -6.772 -6.158 639 H ILE 79 H ILE 79 -8.064 -2.620 -3.171 640 HA ILE 79 HA ILE 79 -5.642 -0.977 -2.820 641 HB ILE 79 HB ILE 79 -6.886 -0.094 -4.689 642 HG12 ILE 79 1HG1 ILE 79 -7.337 2.182 -3.866 643 HG13 ILE 79 2HG1 ILE 79 -7.348 1.582 -2.212 644 HG21 ILE 79 1HG2 ILE 79 -9.286 0.809 -3.456 645 HG22 ILE 79 2HG2 ILE 79 -9.091 -0.277 -4.832 646 HG23 ILE 79 3HG2 ILE 79 -9.136 -0.929 -3.194 647 HD11 ILE 79 3HD1 ILE 79 -5.159 2.497 -3.745 648 HD12 ILE 79 1HD1 ILE 79 -5.170 1.903 -2.085 649 HD13 ILE 79 2HD1 ILE 79 -4.915 0.780 -3.421 650 H GLU 80 H GLU 80 -5.281 -0.403 -0.788 651 HA GLU 80 HA GLU 80 -7.569 -0.280 1.066 652 HB2 GLU 80 1HB GLU 80 -4.714 -1.128 1.550 653 HB3 GLU 80 2HB GLU 80 -5.839 -0.766 2.853 654 HG2 GLU 80 1HG GLU 80 -6.311 -2.859 0.746 655 HG3 GLU 80 2HG GLU 80 -5.610 -3.182 2.330 656 H ILE 81 H ILE 81 -7.184 1.180 2.964 657 HA ILE 81 HA ILE 81 -5.520 3.500 2.269 658 HB ILE 81 HB ILE 81 -8.381 3.657 3.223 659 HG12 ILE 81 1HG1 ILE 81 -8.306 5.056 0.912 660 HG13 ILE 81 2HG1 ILE 81 -7.087 3.834 0.565 661 HG21 ILE 81 1HG2 ILE 81 -7.970 6.140 2.736 662 HG22 ILE 81 2HG2 ILE 81 -7.292 5.467 4.218 663 HG23 ILE 81 3HG2 ILE 81 -6.256 5.733 2.815 664 HD11 ILE 81 3HD1 ILE 81 -9.944 3.332 1.361 665 HD12 ILE 81 1HD1 ILE 81 -9.244 3.126 -0.244 666 HD13 ILE 81 2HD1 ILE 81 -8.729 2.085 1.083 667 H ILE 82 H ILE 82 -4.449 4.402 3.942 668 HA ILE 82 HA ILE 82 -4.580 3.058 6.502 669 HB ILE 82 HB ILE 82 -2.817 5.385 5.740 670 HG12 ILE 82 1HG1 ILE 82 -2.246 2.423 5.496 671 HG13 ILE 82 2HG1 ILE 82 -2.540 3.517 4.149 672 HG21 ILE 82 1HG2 ILE 82 -1.908 3.329 7.636 673 HG22 ILE 82 2HG2 ILE 82 -1.738 5.083 7.693 674 HG23 ILE 82 3HG2 ILE 82 -3.252 4.328 8.190 675 HD11 ILE 82 3HD1 ILE 82 -0.167 3.312 5.939 676 HD12 ILE 82 1HD1 ILE 82 -0.247 3.377 4.179 677 HD13 ILE 82 2HD1 ILE 82 -0.532 4.835 5.130 678 H ASN 83 H ASN 83 -5.701 3.739 8.199 679 HA ASN 83 HA ASN 83 -7.386 5.972 8.142 680 HB2 ASN 83 1HB ASN 83 -6.823 3.820 9.933 681 HB3 ASN 83 2HB ASN 83 -6.822 5.320 10.856 682 HD21 ASN 83 2HD2 ASN 83 -8.707 5.206 11.902 683 HD22 ASN 83 1HD2 ASN 83 -10.252 5.067 11.142 684 H THR 84 H THR 84 -7.350 7.872 9.515 685 HA THR 84 HA THR 84 -5.100 9.445 9.221 686 HB THR 84 HB THR 84 -7.067 9.820 11.478 687 HG1 THR 84 HG1 THR 84 -8.443 10.760 9.985 688 HG21 THR 84 3HG2 THR 84 -6.368 11.977 11.558 689 HG22 THR 84 1HG2 THR 84 -6.073 12.061 9.822 690 HG23 THR 84 2HG2 THR 84 -4.894 11.287 10.881 691 H ILE 85 H ILE 85 -6.227 7.985 12.279 692 HA ILE 85 HA ILE 85 -3.990 8.664 13.805 693 HB ILE 85 HB ILE 85 -5.744 6.231 14.160 694 HG12 ILE 85 1HG1 ILE 85 -7.038 8.333 14.027 695 HG13 ILE 85 2HG1 ILE 85 -7.094 7.624 15.637 696 HG21 ILE 85 1HG2 ILE 85 -3.741 7.612 15.896 697 HG22 ILE 85 2HG2 ILE 85 -5.101 6.756 16.620 698 HG23 ILE 85 3HG2 ILE 85 -3.961 5.889 15.591 699 HD11 ILE 85 3HD1 ILE 85 -5.294 9.888 14.811 700 HD12 ILE 85 1HD1 ILE 85 -6.826 10.064 15.667 701 HD13 ILE 85 2HD1 ILE 85 -5.478 9.224 16.434 702 H ASP 86 H ASP 86 -4.700 5.650 12.055 703 HA ASP 86 HA ASP 86 -2.451 4.195 12.738 704 HB2 ASP 86 1HB ASP 86 -4.209 4.234 10.312 705 HB3 ASP 86 2HB ASP 86 -2.764 3.226 10.321 706 H TYR 87 H TYR 87 -2.822 6.698 10.289 707 HA TYR 87 HA TYR 87 -0.255 6.333 9.114 708 HB2 TYR 87 1HB TYR 87 -2.129 7.438 7.939 709 HB3 TYR 87 2HB TYR 87 -2.041 8.776 9.080 710 HD1 TYR 87 HD2 TYR 87 0.046 6.929 6.600 711 HD2 TYR 87 HD1 TYR 87 -0.714 10.617 8.582 712 HE1 TYR 87 HE2 TYR 87 1.706 8.037 5.163 713 HE2 TYR 87 HE1 TYR 87 0.943 11.735 7.150 714 HH TYR 87 HH TYR 87 2.690 11.355 5.713 715 H GLY 88 H GLY 88 -1.514 8.946 11.201 716 HA2 GLY 88 1HA GLY 88 0.877 10.268 11.653 717 HA3 GLY 88 2HA GLY 88 -0.470 10.243 12.782 718 H THR 89 H THR 89 -0.257 7.280 13.033 719 HA THR 89 HA THR 89 1.741 7.291 15.134 720 HB THR 89 HB THR 89 0.863 5.057 15.705 721 HG1 THR 89 HG1 THR 89 -0.989 5.478 13.579 722 HG21 THR 89 3HG2 THR 89 -1.715 6.120 15.654 723 HG22 THR 89 1HG2 THR 89 -0.648 7.524 15.689 724 HG23 THR 89 2HG2 THR 89 -0.525 6.291 16.944 725 H MET 90 H MET 90 1.371 6.091 11.910 726 HA MET 90 HA MET 90 2.782 4.994 10.505 727 HB2 MET 90 1HB MET 90 4.933 5.395 12.582 728 HB3 MET 90 2HB MET 90 5.138 5.181 10.849 729 HG2 MET 90 1HG MET 90 5.145 7.374 10.608 730 HG3 MET 90 2HG MET 90 3.480 7.422 11.180 731 HE1 MET 90 3HE MET 90 7.378 8.170 13.174 732 HE2 MET 90 1HE MET 90 6.716 6.771 14.018 733 HE3 MET 90 2HE MET 90 6.923 6.727 12.267 734 H ASN 91 H ASN 91 1.211 3.332 11.854 735 HA ASN 91 HA ASN 91 2.669 1.336 13.313 736 HB2 ASN 91 1HB ASN 91 -0.143 1.773 12.487 737 HB3 ASN 91 2HB ASN 91 0.346 0.097 12.715 738 HD21 ASN 91 2HD2 ASN 91 1.558 -0.313 14.789 739 HD22 ASN 91 1HD2 ASN 91 0.953 0.469 16.206 740 H GLY 92 H GLY 92 4.313 0.711 11.853 741 HA2 GLY 92 1HA GLY 92 4.030 -0.095 9.225 742 HA3 GLY 92 2HA GLY 92 5.235 -0.740 10.329 743 H GLU 93 H GLU 93 3.641 -2.073 12.150 744 HA GLU 93 HA GLU 93 3.254 -4.538 10.929 745 HB2 GLU 93 1HB GLU 93 3.523 -4.144 13.380 746 HB3 GLU 93 2HB GLU 93 1.868 -3.553 13.428 747 HG2 GLU 93 1HG GLU 93 1.218 -5.820 12.449 748 HG3 GLU 93 2HG GLU 93 2.845 -6.333 12.889 749 H LYS 94 H LYS 94 0.810 -2.121 11.855 750 HA LYS 94 HA LYS 94 -1.418 -3.531 10.889 751 HB2 LYS 94 1HB LYS 94 -1.026 -0.546 11.169 752 HB3 LYS 94 2HB LYS 94 -2.574 -1.348 10.943 753 HG2 LYS 94 1HG LYS 94 -1.038 -2.385 13.197 754 HG3 LYS 94 2HG LYS 94 -1.465 -0.679 13.346 755 HD2 LYS 94 1HD LYS 94 -3.691 -1.111 13.496 756 HD3 LYS 94 2HD LYS 94 -3.600 -2.515 12.430 757 HE2 LYS 94 1HE LYS 94 -2.127 -3.233 14.680 758 HE3 LYS 94 2HE LYS 94 -3.530 -2.378 15.319 759 HZ1 LYS 94 3HZ LYS 94 -3.540 -4.962 14.695 760 HZ2 LYS 94 1HZ LYS 94 -4.079 -4.313 13.229 761 HZ3 LYS 94 2HZ LYS 94 -4.926 -3.991 14.656 762 H VAL 95 H VAL 95 0.816 -1.309 9.325 763 HA VAL 95 HA VAL 95 -0.617 -0.918 6.936 764 HB VAL 95 HB VAL 95 2.381 -0.907 7.309 765 HG11 VAL 95 1HG1 VAL 95 1.954 0.897 5.396 766 HG12 VAL 95 2HG1 VAL 95 2.221 -0.812 5.044 767 HG13 VAL 95 3HG1 VAL 95 0.581 -0.162 5.077 768 HG21 VAL 95 3HG2 VAL 95 0.405 0.784 8.421 769 HG22 VAL 95 1HG2 VAL 95 2.158 0.969 8.475 770 HG23 VAL 95 2HG2 VAL 95 1.235 1.699 7.162 771 H LEU 96 H LEU 96 2.305 -2.927 7.334 772 HA LEU 96 HA LEU 96 2.129 -4.306 4.952 773 HB2 LEU 96 1HB LEU 96 3.431 -6.105 6.128 774 HB3 LEU 96 2HB LEU 96 4.113 -4.483 6.211 775 HG LEU 96 HG LEU 96 2.659 -4.596 8.520 776 HD11 LEU 96 1HD1 LEU 96 2.399 -7.112 7.844 777 HD12 LEU 96 2HD1 LEU 96 2.731 -6.659 9.515 778 HD13 LEU 96 3HD1 LEU 96 4.039 -7.236 8.482 779 HD21 LEU 96 3HD2 LEU 96 5.528 -5.458 8.174 780 HD22 LEU 96 1HD2 LEU 96 4.792 -4.792 9.632 781 HD23 LEU 96 2HD2 LEU 96 4.969 -3.785 8.194 782 H GLN 97 H GLN 97 0.800 -5.251 8.113 783 HA GLN 97 HA GLN 97 -0.286 -7.699 7.425 784 HB2 GLN 97 1HB GLN 97 -1.083 -5.606 9.422 785 HB3 GLN 97 2HB GLN 97 -2.068 -7.047 9.211 786 HG2 GLN 97 1HG GLN 97 0.820 -6.929 10.041 787 HG3 GLN 97 2HG GLN 97 -0.560 -7.388 11.036 788 HE21 GLN 97 2HE2 GLN 97 -1.925 -9.035 9.315 789 HE22 GLN 97 1HE2 GLN 97 -0.983 -10.448 9.001 790 H LEU 98 H LEU 98 -1.866 -4.510 7.282 791 HA LEU 98 HA LEU 98 -4.322 -5.340 6.278 792 HB2 LEU 98 1HB LEU 98 -3.586 -3.035 7.110 793 HB3 LEU 98 2HB LEU 98 -3.001 -2.768 5.469 794 HG LEU 98 HG LEU 98 -5.346 -3.202 4.672 795 HD11 LEU 98 1HD1 LEU 98 -5.691 -3.809 7.458 796 HD12 LEU 98 2HD1 LEU 98 -6.804 -4.049 6.112 797 HD13 LEU 98 3HD1 LEU 98 -6.777 -2.509 6.970 798 HD21 LEU 98 3HD2 LEU 98 -4.602 -0.960 4.723 799 HD22 LEU 98 1HD2 LEU 98 -4.722 -0.881 6.480 800 HD23 LEU 98 2HD2 LEU 98 -6.185 -0.966 5.498 801 H ALA 99 H ALA 99 -1.458 -4.217 4.484 802 HA ALA 99 HA ALA 99 -2.428 -4.424 1.909 803 HB1 ALA 99 3HB ALA 99 -0.174 -4.497 1.168 804 HB2 ALA 99 1HB ALA 99 -0.199 -3.511 2.631 805 HB3 ALA 99 2HB ALA 99 0.377 -5.177 2.698 806 H ILE 100 H ILE 100 -0.831 -6.955 3.834 807 HA ILE 100 HA ILE 100 -0.898 -8.981 1.914 808 HB ILE 100 HB ILE 100 -1.079 -9.265 4.916 809 HG12 ILE 100 1HG1 ILE 100 1.451 -9.823 3.514 810 HG13 ILE 100 2HG1 ILE 100 0.953 -8.135 3.483 811 HG21 ILE 100 1HG2 ILE 100 0.193 -11.484 4.068 812 HG22 ILE 100 2HG2 ILE 100 -1.544 -11.397 4.353 813 HG23 ILE 100 3HG2 ILE 100 -0.909 -11.216 2.717 814 HD11 ILE 100 3HD1 ILE 100 0.580 -8.940 6.116 815 HD12 ILE 100 1HD1 ILE 100 2.106 -9.672 5.622 816 HD13 ILE 100 2HD1 ILE 100 1.877 -7.929 5.480 817 H ASN 101 H ASN 101 -3.203 -8.332 4.556 818 HA ASN 101 HA ASN 101 -5.017 -10.352 4.053 819 HB2 ASN 101 1HB ASN 101 -5.335 -7.583 5.180 820 HB3 ASN 101 2HB ASN 101 -6.731 -8.638 4.983 821 HD21 ASN 101 2HD2 ASN 101 -4.557 -7.607 7.145 822 HD22 ASN 101 1HD2 ASN 101 -4.509 -8.966 8.212 823 H ALA 102 H ALA 102 -4.948 -7.081 2.666 824 HA ALA 102 HA ALA 102 -7.255 -7.354 1.076 825 HB1 ALA 102 3HB ALA 102 -5.139 -5.419 1.426 826 HB2 ALA 102 1HB ALA 102 -5.604 -5.570 -0.269 827 HB3 ALA 102 2HB ALA 102 -6.820 -5.177 0.948 828 H PHE 103 H PHE 103 -3.866 -8.110 0.481 829 HA PHE 103 HA PHE 103 -4.034 -8.578 -2.280 830 HB2 PHE 103 1HB PHE 103 -1.887 -8.358 -1.159 831 HB3 PHE 103 2HB PHE 103 -2.201 -9.811 -0.215 832 HD1 PHE 103 HD1 PHE 103 -2.102 -8.754 -3.793 833 HD2 PHE 103 HD2 PHE 103 -1.184 -11.743 -0.907 834 HE1 PHE 103 HE1 PHE 103 -1.035 -10.113 -5.546 835 HE2 PHE 103 HE2 PHE 103 -0.115 -13.107 -2.653 836 HZ PHE 103 HZ PHE 103 -0.039 -12.292 -4.975 837 H ASN 104 H ASN 104 -4.123 -10.926 0.403 838 HA ASN 104 HA ASN 104 -4.739 -13.150 -1.216 839 HB2 ASN 104 1HB ASN 104 -5.124 -12.639 1.737 840 HB3 ASN 104 2HB ASN 104 -5.475 -14.188 0.977 841 HD21 ASN 104 2HD2 ASN 104 -3.256 -12.634 2.726 842 HD22 ASN 104 1HD2 ASN 104 -1.821 -13.446 2.211 843 H ASN 105 H ASN 105 -6.755 -10.842 0.530 844 HA ASN 105 HA ASN 105 -9.216 -12.177 0.136 845 HB2 ASN 105 1HB ASN 105 -8.919 -10.424 1.833 846 HB3 ASN 105 2HB ASN 105 -8.679 -9.228 0.562 847 HD21 ASN 105 2HD2 ASN 105 -10.403 -7.953 0.925 848 HD22 ASN 105 1HD2 ASN 105 -12.046 -8.474 0.799 849 H LYS 106 H LYS 106 -7.368 -9.925 -1.808 850 HA LYS 106 HA LYS 106 -7.601 -9.180 -3.945 851 HB2 LYS 106 1HB LYS 106 -9.449 -11.553 -4.254 852 HB3 LYS 106 2HB LYS 106 -8.658 -10.671 -5.554 853 HG2 LYS 106 1HG LYS 106 -6.520 -11.473 -4.916 854 HG3 LYS 106 2HG LYS 106 -7.147 -12.124 -3.400 855 HD2 LYS 106 1HD LYS 106 -8.645 -13.594 -4.863 856 HD3 LYS 106 2HD LYS 106 -7.588 -13.125 -6.198 857 HE2 LYS 106 1HE LYS 106 -5.729 -14.173 -5.244 858 HE3 LYS 106 2HE LYS 106 -6.472 -14.241 -3.647 859 HZ1 LYS 106 3HZ LYS 106 -7.060 -15.910 -6.016 860 HZ2 LYS 106 1HZ LYS 106 -8.153 -15.785 -4.729 861 HZ3 LYS 106 2HZ LYS 106 -6.602 -16.406 -4.464 862 H SER 107 H SER 107 -9.558 -8.899 -5.726 863 HA SER 107 HA SER 107 -11.759 -7.611 -4.247 864 HB2 SER 107 1HB SER 107 -10.068 -6.020 -5.270 865 HB3 SER 107 2HB SER 107 -10.606 -6.594 -6.848 866 HG SER 107 HG SER 107 -12.681 -5.844 -6.359 867 H SER 108 H SER 108 -13.361 -9.071 -4.537 868 HA SER 108 HA SER 108 -14.457 -9.330 -7.198 869 HB2 SER 108 1HB SER 108 -13.312 -11.684 -5.711 870 HB3 SER 108 2HB SER 108 -14.622 -11.889 -6.873 871 HG SER 108 HG SER 108 -12.111 -10.677 -7.417 872 H VAL 109 H VAL 109 -16.641 -9.789 -7.202 873 HA VAL 109 HA VAL 109 -18.767 -9.721 -6.378 874 HB VAL 109 HB VAL 109 -17.659 -11.520 -4.219 875 HG11 VAL 109 1HG1 VAL 109 -20.399 -10.843 -5.185 876 HG12 VAL 109 2HG1 VAL 109 -20.079 -12.459 -4.554 877 HG13 VAL 109 3HG1 VAL 109 -19.803 -11.045 -3.537 878 HG21 VAL 109 3HG2 VAL 109 -18.851 -13.139 -6.090 879 HG22 VAL 109 1HG2 VAL 109 -18.018 -11.941 -7.083 880 HG23 VAL 109 2HG2 VAL 109 -17.115 -12.891 -5.902 Start of MODEL 7 1 H1 GLY 1 H GLY 1 11.980 -16.778 -10.839 2 HA2 GLY 1 1HA GLY 1 10.370 -15.041 -9.077 3 HA3 GLY 1 2HA GLY 1 9.788 -16.524 -9.820 4 HA PRO 2 HA PRO 2 12.812 -17.893 -6.298 5 HB2 PRO 2 1HB PRO 2 13.688 -15.943 -4.624 6 HB3 PRO 2 2HB PRO 2 14.556 -16.413 -6.090 7 HG2 PRO 2 1HG PRO 2 12.711 -14.099 -5.641 8 HG3 PRO 2 2HG PRO 2 14.259 -14.144 -6.504 9 HD2 PRO 2 1HD PRO 2 11.875 -14.191 -7.787 10 HD3 PRO 2 2HD PRO 2 13.313 -15.022 -8.414 11 H GLY 3 H GLY 3 10.799 -15.069 -5.507 12 HA2 GLY 3 1HA GLY 3 8.654 -15.900 -4.357 13 HA3 GLY 3 2HA GLY 3 9.778 -16.522 -3.158 14 H SER 4 H SER 4 8.117 -13.757 -4.354 15 HA SER 4 HA SER 4 8.480 -12.314 -1.951 16 HB2 SER 4 1HB SER 4 9.636 -10.329 -3.287 17 HB3 SER 4 2HB SER 4 10.593 -11.583 -2.499 18 HG SER 4 HG SER 4 9.961 -11.299 -5.236 19 H MET 5 H MET 5 7.143 -10.499 -1.821 20 HA MET 5 HA MET 5 5.333 -10.154 -4.120 21 HB2 MET 5 1HB MET 5 4.454 -11.119 -1.894 22 HB3 MET 5 2HB MET 5 4.615 -9.481 -1.279 23 HG2 MET 5 1HG MET 5 3.185 -9.682 -3.823 24 HG3 MET 5 2HG MET 5 2.398 -10.491 -2.470 25 HE1 MET 5 3HE MET 5 2.164 -7.570 0.132 26 HE2 MET 5 1HE MET 5 1.302 -9.046 -0.306 27 HE3 MET 5 2HE MET 5 3.046 -9.087 -0.049 28 H ASN 6 H ASN 6 5.257 -8.217 -5.054 29 HA ASN 6 HA ASN 6 6.739 -6.018 -3.840 30 HB2 ASN 6 1HB ASN 6 5.467 -6.141 -6.582 31 HB3 ASN 6 2HB ASN 6 6.658 -4.973 -6.016 32 HD21 ASN 6 2HD2 ASN 6 8.770 -5.869 -5.363 33 HD22 ASN 6 1HD2 ASN 6 9.401 -7.199 -6.269 34 H ILE 7 H ILE 7 5.643 -4.738 -2.508 35 HA ILE 7 HA ILE 7 2.786 -4.298 -2.927 36 HB ILE 7 HB ILE 7 4.547 -3.402 -0.642 37 HG12 ILE 7 1HG1 ILE 7 2.557 -5.678 -0.738 38 HG13 ILE 7 2HG1 ILE 7 4.300 -5.882 -0.882 39 HG21 ILE 7 1HG2 ILE 7 1.815 -2.795 -1.393 40 HG22 ILE 7 2HG2 ILE 7 1.916 -3.518 0.211 41 HG23 ILE 7 3HG2 ILE 7 2.836 -2.060 -0.157 42 HD11 ILE 7 3HD1 ILE 7 4.454 -5.987 1.316 43 HD12 ILE 7 1HD1 ILE 7 3.804 -4.353 1.444 44 HD13 ILE 7 2HD1 ILE 7 2.714 -5.739 1.459 45 H LEU 8 H LEU 8 1.882 -2.349 -3.408 46 HA LEU 8 HA LEU 8 3.750 -0.205 -4.158 47 HB2 LEU 8 1HB LEU 8 2.369 -1.168 -5.964 48 HB3 LEU 8 2HB LEU 8 0.921 -0.674 -5.089 49 HG LEU 8 HG LEU 8 1.450 1.650 -5.427 50 HD11 LEU 8 1HD1 LEU 8 3.584 2.249 -5.559 51 HD12 LEU 8 2HD1 LEU 8 3.560 1.695 -7.232 52 HD13 LEU 8 3HD1 LEU 8 4.090 0.606 -5.951 53 HD21 LEU 8 3HD2 LEU 8 1.642 -0.051 -7.901 54 HD22 LEU 8 1HD2 LEU 8 1.467 1.703 -7.948 55 HD23 LEU 8 2HD2 LEU 8 0.208 0.712 -7.211 56 H LEU 9 H LEU 9 3.420 1.890 -3.479 57 HA LEU 9 HA LEU 9 1.219 2.349 -1.585 58 HB2 LEU 9 1HB LEU 9 3.552 1.899 -0.567 59 HB3 LEU 9 2HB LEU 9 3.942 3.517 -1.147 60 HG LEU 9 HG LEU 9 2.164 4.446 0.254 61 HD11 LEU 9 1HD1 LEU 9 1.190 2.890 2.007 62 HD12 LEU 9 2HD1 LEU 9 1.723 1.564 0.974 63 HD13 LEU 9 3HD1 LEU 9 0.554 2.738 0.369 64 HD21 LEU 9 3HD2 LEU 9 4.258 2.731 1.548 65 HD22 LEU 9 1HD2 LEU 9 3.187 3.763 2.496 66 HD23 LEU 9 2HD2 LEU 9 4.261 4.476 1.291 67 H VAL 10 H VAL 10 0.295 4.359 -1.631 68 HA VAL 10 HA VAL 10 1.337 6.227 -3.660 69 HB VAL 10 HB VAL 10 -1.562 5.908 -2.882 70 HG11 VAL 10 1HG1 VAL 10 -0.212 7.399 -5.130 71 HG12 VAL 10 2HG1 VAL 10 -1.956 7.214 -4.938 72 HG13 VAL 10 3HG1 VAL 10 -1.025 8.106 -3.735 73 HG21 VAL 10 3HG2 VAL 10 -1.880 4.725 -4.977 74 HG22 VAL 10 1HG2 VAL 10 -0.158 4.851 -5.334 75 HG23 VAL 10 2HG2 VAL 10 -0.707 3.872 -3.975 76 H CYS 11 H CYS 11 1.924 8.153 -2.924 77 HA CYS 11 HA CYS 11 0.476 9.696 -1.084 78 HB2 CYS 11 1HB CYS 11 1.205 8.149 0.614 79 HB3 CYS 11 2HB CYS 11 2.870 8.250 0.059 80 HG CYS 11 HG CYS 11 2.562 9.591 2.528 81 H GLY 12 H GLY 12 3.846 8.992 -2.015 82 HA2 GLY 12 1HA GLY 12 4.315 11.127 -3.644 83 HA3 GLY 12 2HA GLY 12 4.559 11.779 -2.030 84 H ALA 13 H ALA 13 6.760 12.165 -2.756 85 HA ALA 13 HA ALA 13 8.455 9.874 -3.238 86 HB1 ALA 13 3HB ALA 13 8.732 12.165 -4.303 87 HB2 ALA 13 1HB ALA 13 9.385 12.689 -2.751 88 HB3 ALA 13 2HB ALA 13 10.189 11.408 -3.658 89 H GLY 14 H GLY 14 8.173 8.711 -1.270 90 HA2 GLY 14 1HA GLY 14 9.707 9.875 0.969 91 HA3 GLY 14 2HA GLY 14 8.216 8.987 1.244 92 H MET 15 H MET 15 10.525 8.033 -1.196 93 HA MET 15 HA MET 15 10.683 5.386 -0.286 94 HB2 MET 15 1HB MET 15 12.256 7.029 -2.230 95 HB3 MET 15 2HB MET 15 12.847 5.436 -1.779 96 HG2 MET 15 1HG MET 15 10.900 4.379 -2.624 97 HG3 MET 15 2HG MET 15 10.076 5.923 -2.829 98 HE1 MET 15 3HE MET 15 9.987 7.221 -4.672 99 HE2 MET 15 1HE MET 15 10.730 6.933 -6.247 100 HE3 MET 15 2HE MET 15 9.540 5.797 -5.614 101 H SER 16 H SER 16 12.458 8.227 0.598 102 HA SER 16 HA SER 16 14.125 6.585 2.388 103 HB2 SER 16 1HB SER 16 15.343 9.140 1.777 104 HB3 SER 16 2HB SER 16 16.009 7.516 1.600 105 HG SER 16 HG SER 16 15.891 8.096 -0.448 106 H THR 17 H THR 17 14.533 7.411 4.444 107 HA THR 17 HA THR 17 13.974 8.450 6.393 108 HB THR 17 HB THR 17 13.404 10.968 4.864 109 HG1 THR 17 HG1 THR 17 15.895 9.645 5.173 110 HG21 THR 17 3HG2 THR 17 15.037 11.643 6.889 111 HG22 THR 17 1HG2 THR 17 14.295 10.200 7.579 112 HG23 THR 17 2HG2 THR 17 13.284 11.546 7.055 113 H SER 18 H SER 18 12.025 7.146 6.492 114 HA SER 18 HA SER 18 9.654 8.825 6.631 115 HB2 SER 18 1HB SER 18 8.710 6.426 5.484 116 HB3 SER 18 2HB SER 18 8.714 8.032 4.758 117 HG SER 18 HG SER 18 10.572 7.578 3.722 118 H MET 19 H MET 19 8.531 8.391 8.417 119 HA MET 19 HA MET 19 9.394 6.489 10.293 120 HB2 MET 19 1HB MET 19 6.701 7.856 10.162 121 HB3 MET 19 2HB MET 19 7.422 7.110 11.582 122 HG2 MET 19 1HG MET 19 8.327 9.053 12.104 123 HG3 MET 19 2HG MET 19 9.296 8.970 10.635 124 HE1 MET 19 3HE MET 19 7.096 10.637 12.711 125 HE2 MET 19 1HE MET 19 6.551 12.062 11.826 126 HE3 MET 19 2HE MET 19 5.557 10.605 11.850 127 H LEU 20 H LEU 20 6.373 6.544 8.394 128 HA LEU 20 HA LEU 20 5.367 4.089 9.146 129 HB2 LEU 20 1HB LEU 20 5.061 5.859 6.809 130 HB3 LEU 20 2HB LEU 20 4.575 4.181 6.569 131 HG LEU 20 HG LEU 20 2.700 5.667 7.183 132 HD11 LEU 20 1HD1 LEU 20 3.483 3.223 8.556 133 HD12 LEU 20 2HD1 LEU 20 1.941 3.673 7.828 134 HD13 LEU 20 3HD1 LEU 20 2.326 4.191 9.469 135 HD21 LEU 20 3HD2 LEU 20 3.854 7.238 8.608 136 HD22 LEU 20 1HD2 LEU 20 4.225 5.962 9.767 137 HD23 LEU 20 2HD2 LEU 20 2.553 6.466 9.515 138 H VAL 21 H VAL 21 7.355 4.759 6.260 139 HA VAL 21 HA VAL 21 7.635 2.152 5.360 140 HB VAL 21 HB VAL 21 9.677 4.373 5.191 141 HG11 VAL 21 1HG1 VAL 21 10.659 2.193 4.715 142 HG12 VAL 21 2HG1 VAL 21 9.385 1.866 3.539 143 HG13 VAL 21 3HG1 VAL 21 10.543 3.165 3.249 144 HG21 VAL 21 3HG2 VAL 21 7.115 4.273 4.134 145 HG22 VAL 21 1HG2 VAL 21 8.428 5.327 3.609 146 HG23 VAL 21 2HG2 VAL 21 8.154 3.786 2.796 147 H GLN 22 H GLN 22 9.646 3.934 7.678 148 HA GLN 22 HA GLN 22 11.613 1.997 8.072 149 HB2 GLN 22 1HB GLN 22 10.579 4.304 9.636 150 HB3 GLN 22 2HB GLN 22 11.566 3.130 10.494 151 HG2 GLN 22 1HG GLN 22 13.333 3.440 8.785 152 HG3 GLN 22 2HG GLN 22 12.351 4.711 8.059 153 HE21 GLN 22 2HE2 GLN 22 14.866 4.150 10.063 154 HE22 GLN 22 1HE2 GLN 22 14.826 5.595 11.007 155 H ARG 23 H ARG 23 8.501 2.456 9.700 156 HA ARG 23 HA ARG 23 8.824 0.392 11.596 157 HB2 ARG 23 1HB ARG 23 6.240 1.451 10.439 158 HB3 ARG 23 2HB ARG 23 6.429 0.580 11.956 159 HG2 ARG 23 1HG ARG 23 8.129 2.914 11.858 160 HG3 ARG 23 2HG ARG 23 6.433 3.327 11.598 161 HD2 ARG 23 1HD ARG 23 5.827 2.131 13.640 162 HD3 ARG 23 2HD ARG 23 7.518 1.701 13.895 163 HE ARG 23 HE ARG 23 7.420 4.461 13.701 164 HH11 ARG 23 1HH1 ARG 23 6.137 1.980 15.780 165 HH12 ARG 23 2HH1 ARG 23 6.101 2.993 17.185 166 HH21 ARG 23 1HH2 ARG 23 7.377 5.805 15.544 167 HH22 ARG 23 2HH2 ARG 23 6.805 5.169 17.050 168 H ILE 24 H ILE 24 7.441 0.455 8.347 169 HA ILE 24 HA ILE 24 6.456 -2.201 8.375 170 HB ILE 24 HB ILE 24 7.249 -0.484 6.021 171 HG12 ILE 24 1HG1 ILE 24 4.423 -1.019 6.820 172 HG13 ILE 24 2HG1 ILE 24 5.343 0.159 7.751 173 HG21 ILE 24 1HG2 ILE 24 5.510 -2.052 4.899 174 HG22 ILE 24 2HG2 ILE 24 7.166 -2.611 5.122 175 HG23 ILE 24 3HG2 ILE 24 5.900 -3.142 6.229 176 HD11 ILE 24 3HD1 ILE 24 4.628 1.622 6.235 177 HD12 ILE 24 1HD1 ILE 24 5.863 0.926 5.187 178 HD13 ILE 24 2HD1 ILE 24 4.197 0.359 5.082 179 H GLU 25 H GLU 25 9.383 -0.801 6.891 180 HA GLU 25 HA GLU 25 10.472 -3.213 5.982 181 HB2 GLU 25 1HB GLU 25 12.543 -2.021 5.721 182 HB3 GLU 25 2HB GLU 25 11.223 -0.941 5.292 183 HG2 GLU 25 1HG GLU 25 11.378 0.089 7.524 184 HG3 GLU 25 2HG GLU 25 12.753 -0.953 7.883 185 H LYS 26 H LYS 26 10.678 -1.602 9.097 186 HA LYS 26 HA LYS 26 12.728 -3.212 10.197 187 HB2 LYS 26 1HB LYS 26 10.636 -1.390 11.314 188 HB3 LYS 26 2HB LYS 26 11.521 -2.443 12.409 189 HG2 LYS 26 1HG LYS 26 13.044 -0.768 10.477 190 HG3 LYS 26 2HG LYS 26 12.351 -0.014 11.913 191 HD2 LYS 26 1HD LYS 26 13.724 -2.511 12.505 192 HD3 LYS 26 2HD LYS 26 14.784 -1.308 11.766 193 HE2 LYS 26 1HE LYS 26 14.098 0.326 13.459 194 HE3 LYS 26 2HE LYS 26 13.049 -0.883 14.198 195 HZ1 LYS 26 3HZ LYS 26 15.897 -1.501 13.847 196 HZ2 LYS 26 1HZ LYS 26 14.816 -2.046 15.030 197 HZ3 LYS 26 2HZ LYS 26 15.436 -0.474 15.111 198 H TYR 27 H TYR 27 9.201 -3.303 10.734 199 HA TYR 27 HA TYR 27 9.104 -5.595 12.282 200 HB2 TYR 27 1HB TYR 27 7.149 -4.216 12.037 201 HB3 TYR 27 2HB TYR 27 7.094 -4.510 10.303 202 HD1 TYR 27 HD2 TYR 27 6.321 -6.669 9.433 203 HD2 TYR 27 HD1 TYR 27 6.307 -5.839 13.607 204 HE1 TYR 27 HE2 TYR 27 4.822 -8.583 9.803 205 HE2 TYR 27 HE1 TYR 27 4.809 -7.753 13.987 206 HH TYR 27 HH TYR 27 3.479 -9.277 12.994 207 H ALA 28 H ALA 28 8.921 -5.303 8.748 208 HA ALA 28 HA ALA 28 8.597 -8.059 8.227 209 HB1 ALA 28 3HB ALA 28 10.001 -6.620 6.131 210 HB2 ALA 28 1HB ALA 28 8.418 -7.395 6.107 211 HB3 ALA 28 2HB ALA 28 8.586 -5.749 6.720 212 H LYS 29 H LYS 29 11.487 -5.982 8.140 213 HA LYS 29 HA LYS 29 13.336 -7.945 7.425 214 HB2 LYS 29 1HB LYS 29 13.813 -5.522 7.427 215 HB3 LYS 29 2HB LYS 29 13.787 -5.527 9.185 216 HG2 LYS 29 1HG LYS 29 15.715 -6.994 9.238 217 HG3 LYS 29 2HG LYS 29 15.721 -7.077 7.475 218 HD2 LYS 29 1HD LYS 29 16.316 -4.795 7.277 219 HD3 LYS 29 2HD LYS 29 15.965 -4.481 8.978 220 HE2 LYS 29 1HE LYS 29 17.943 -5.345 9.684 221 HE3 LYS 29 2HE LYS 29 18.005 -6.544 8.393 222 HZ1 LYS 29 3HZ LYS 29 18.223 -3.974 7.273 223 HZ2 LYS 29 1HZ LYS 29 19.359 -5.229 7.264 224 HZ3 LYS 29 2HZ LYS 29 19.348 -4.108 8.531 225 H SER 30 H SER 30 11.835 -7.241 10.484 226 HA SER 30 HA SER 30 13.691 -8.867 11.996 227 HB2 SER 30 1HB SER 30 11.542 -6.985 12.594 228 HB3 SER 30 2HB SER 30 11.492 -8.416 13.625 229 HG SER 30 HG SER 30 12.832 -6.847 14.541 230 H LYS 31 H LYS 31 10.364 -9.089 10.821 231 HA LYS 31 HA LYS 31 9.852 -11.633 12.011 232 HB2 LYS 31 1HB LYS 31 8.450 -9.798 10.159 233 HB3 LYS 31 2HB LYS 31 8.025 -11.500 10.024 234 HG2 LYS 31 1HG LYS 31 7.991 -10.006 12.631 235 HG3 LYS 31 2HG LYS 31 6.591 -10.124 11.562 236 HD2 LYS 31 1HD LYS 31 7.458 -12.737 11.784 237 HD3 LYS 31 2HD LYS 31 7.706 -12.082 13.405 238 HE2 LYS 31 1HE LYS 31 5.141 -11.418 12.100 239 HE3 LYS 31 2HE LYS 31 5.370 -13.108 12.548 240 HZ1 LYS 31 3HZ LYS 31 5.951 -10.992 14.508 241 HZ2 LYS 31 1HZ LYS 31 5.484 -12.597 14.771 242 HZ3 LYS 31 2HZ LYS 31 4.348 -11.462 14.240 243 H ASN 32 H ASN 32 11.584 -10.628 9.265 244 HA ASN 32 HA ASN 32 12.679 -11.757 7.623 245 HB2 ASN 32 1HB ASN 32 13.131 -13.285 9.669 246 HB3 ASN 32 2HB ASN 32 11.941 -14.358 8.938 247 HD21 ASN 32 2HD2 ASN 32 13.545 -15.937 8.667 248 HD22 ASN 32 1HD2 ASN 32 14.720 -15.821 7.406 249 H ILE 33 H ILE 33 10.455 -10.951 6.665 250 HA ILE 33 HA ILE 33 9.089 -13.275 5.474 251 HB ILE 33 HB ILE 33 8.043 -10.462 5.816 252 HG12 ILE 33 1HG1 ILE 33 6.963 -12.960 7.103 253 HG13 ILE 33 2HG1 ILE 33 8.243 -12.019 7.862 254 HG21 ILE 33 1HG2 ILE 33 7.158 -12.742 4.205 255 HG22 ILE 33 2HG2 ILE 33 5.900 -12.023 5.207 256 HG23 ILE 33 3HG2 ILE 33 6.782 -11.026 4.049 257 HD11 ILE 33 3HD1 ILE 33 5.406 -11.236 7.318 258 HD12 ILE 33 1HD1 ILE 33 6.285 -11.243 8.846 259 HD13 ILE 33 2HD1 ILE 33 6.656 -10.029 7.621 260 H ASN 34 H ASN 34 8.840 -13.397 3.273 261 HA ASN 34 HA ASN 34 10.675 -11.809 1.705 262 HB2 ASN 34 1HB ASN 34 8.774 -13.944 0.726 263 HB3 ASN 34 2HB ASN 34 10.218 -13.347 -0.085 264 HD21 ASN 34 2HD2 ASN 34 12.071 -14.372 0.245 265 HD22 ASN 34 1HD2 ASN 34 12.347 -15.580 1.448 266 H ALA 35 H ALA 35 9.632 -9.753 1.902 267 HA ALA 35 HA ALA 35 7.582 -9.372 -0.134 268 HB1 ALA 35 3HB ALA 35 6.939 -7.757 2.178 269 HB2 ALA 35 1HB ALA 35 5.905 -8.812 1.215 270 HB3 ALA 35 2HB ALA 35 6.856 -9.481 2.541 271 H THR 36 H THR 36 7.241 -7.027 -0.602 272 HA THR 36 HA THR 36 9.486 -5.314 0.159 273 HB THR 36 HB THR 36 9.140 -4.776 -2.563 274 HG1 THR 36 HG1 THR 36 8.891 -6.640 -3.544 275 HG21 THR 36 3HG2 THR 36 11.355 -6.498 -1.498 276 HG22 THR 36 1HG2 THR 36 11.207 -4.808 -1.018 277 HG23 THR 36 2HG2 THR 36 11.426 -5.225 -2.717 278 H ILE 37 H ILE 37 9.154 -3.046 -0.488 279 HA ILE 37 HA ILE 37 6.410 -2.303 -1.132 280 HB ILE 37 HB ILE 37 6.518 -2.467 1.353 281 HG12 ILE 37 1HG1 ILE 37 6.242 0.439 0.722 282 HG13 ILE 37 2HG1 ILE 37 5.195 -0.700 -0.117 283 HG21 ILE 37 1HG2 ILE 37 7.998 -0.005 1.734 284 HG22 ILE 37 2HG2 ILE 37 8.153 -1.556 2.559 285 HG23 ILE 37 3HG2 ILE 37 8.997 -1.280 1.036 286 HD11 ILE 37 3HD1 ILE 37 4.183 0.277 1.909 287 HD12 ILE 37 1HD1 ILE 37 4.296 -1.482 1.963 288 HD13 ILE 37 2HD1 ILE 37 5.441 -0.496 2.873 289 H GLU 38 H GLU 38 6.197 -0.261 -2.029 290 HA GLU 38 HA GLU 38 8.441 1.553 -2.115 291 HB2 GLU 38 1HB GLU 38 9.023 -0.053 -3.888 292 HB3 GLU 38 2HB GLU 38 7.470 0.238 -4.658 293 HG2 GLU 38 1HG GLU 38 8.111 2.224 -5.523 294 HG3 GLU 38 2HG GLU 38 9.156 2.608 -4.158 295 H ALA 39 H ALA 39 7.864 3.630 -2.702 296 HA ALA 39 HA ALA 39 4.980 4.057 -3.128 297 HB1 ALA 39 3HB ALA 39 6.624 5.027 -1.103 298 HB2 ALA 39 1HB ALA 39 6.380 6.397 -2.185 299 HB3 ALA 39 2HB ALA 39 4.989 5.560 -1.491 300 H ILE 40 H ILE 40 4.293 5.441 -4.714 301 HA ILE 40 HA ILE 40 6.269 6.915 -6.274 302 HB ILE 40 HB ILE 40 4.972 5.994 -8.372 303 HG12 ILE 40 1HG1 ILE 40 4.408 3.612 -8.133 304 HG13 ILE 40 2HG1 ILE 40 4.768 3.696 -6.412 305 HG21 ILE 40 1HG2 ILE 40 6.944 5.074 -8.869 306 HG22 ILE 40 2HG2 ILE 40 7.449 5.567 -7.254 307 HG23 ILE 40 3HG2 ILE 40 6.845 3.933 -7.528 308 HD11 ILE 40 3HD1 ILE 40 2.581 5.201 -7.826 309 HD12 ILE 40 1HD1 ILE 40 2.375 3.758 -6.834 310 HD13 ILE 40 2HD1 ILE 40 2.933 5.262 -6.099 311 H ALA 41 H ALA 41 5.012 8.075 -8.163 312 HA ALA 41 HA ALA 41 3.156 9.819 -6.939 313 HB1 ALA 41 3HB ALA 41 3.595 11.107 -8.700 314 HB2 ALA 41 1HB ALA 41 4.703 9.845 -9.240 315 HB3 ALA 41 2HB ALA 41 3.041 9.873 -9.831 316 H GLU 42 H GLU 42 1.112 10.324 -8.571 317 HA GLU 42 HA GLU 42 -0.579 7.981 -8.211 318 HB2 GLU 42 1HB GLU 42 -2.434 9.566 -8.738 319 HB3 GLU 42 2HB GLU 42 -1.468 10.038 -7.348 320 HG2 GLU 42 1HG GLU 42 -0.397 11.198 -9.746 321 HG3 GLU 42 2HG GLU 42 -2.111 11.580 -9.583 322 H THR 43 H THR 43 0.881 9.848 -10.742 323 HA THR 43 HA THR 43 -0.782 8.765 -12.837 324 HB THR 43 HB THR 43 0.180 11.019 -13.060 325 HG1 THR 43 HG1 THR 43 -0.145 10.346 -15.062 326 HG21 THR 43 3HG2 THR 43 2.315 10.585 -11.909 327 HG22 THR 43 1HG2 THR 43 2.557 11.320 -13.493 328 HG23 THR 43 2HG2 THR 43 2.835 9.593 -13.272 329 H ARG 44 H ARG 44 2.171 7.928 -11.248 330 HA ARG 44 HA ARG 44 3.030 6.124 -13.350 331 HB2 ARG 44 1HB ARG 44 4.370 7.510 -11.389 332 HB3 ARG 44 2HB ARG 44 4.340 5.876 -10.741 333 HG2 ARG 44 1HG ARG 44 5.137 5.271 -13.185 334 HG3 ARG 44 2HG ARG 44 5.708 6.941 -13.146 335 HD2 ARG 44 1HD ARG 44 6.742 6.295 -10.873 336 HD3 ARG 44 2HD ARG 44 6.499 4.633 -11.406 337 HE ARG 44 HE ARG 44 7.860 6.217 -13.357 338 HH11 ARG 44 1HH1 ARG 44 8.274 4.388 -10.423 339 HH12 ARG 44 2HH1 ARG 44 9.945 4.043 -10.720 340 HH21 ARG 44 1HH2 ARG 44 10.060 5.769 -13.759 341 HH22 ARG 44 2HH2 ARG 44 10.961 4.830 -12.617 342 H LEU 45 H LEU 45 1.088 6.032 -10.530 343 HA LEU 45 HA LEU 45 1.394 3.417 -9.647 344 HB2 LEU 45 1HB LEU 45 0.076 4.821 -8.326 345 HB3 LEU 45 2HB LEU 45 -0.936 5.300 -9.687 346 HG LEU 45 HG LEU 45 -1.024 2.451 -8.851 347 HD11 LEU 45 1HD1 LEU 45 -1.267 3.147 -6.695 348 HD12 LEU 45 2HD1 LEU 45 -2.930 3.332 -7.250 349 HD13 LEU 45 3HD1 LEU 45 -1.871 4.739 -7.155 350 HD21 LEU 45 3HD2 LEU 45 -2.889 4.494 -10.000 351 HD22 LEU 45 1HD2 LEU 45 -3.505 3.009 -9.277 352 HD23 LEU 45 2HD2 LEU 45 -2.409 2.929 -10.656 353 H SER 46 H SER 46 -0.546 4.689 -12.308 354 HA SER 46 HA SER 46 -1.745 2.157 -12.922 355 HB2 SER 46 1HB SER 46 -3.065 3.972 -13.586 356 HB3 SER 46 2HB SER 46 -1.691 4.848 -14.259 357 HG SER 46 HG SER 46 -3.367 3.154 -15.484 358 H GLU 47 H GLU 47 1.287 3.512 -13.477 359 HA GLU 47 HA GLU 47 1.758 1.885 -15.872 360 HB2 GLU 47 1HB GLU 47 3.000 4.327 -14.738 361 HB3 GLU 47 2HB GLU 47 4.078 3.209 -15.560 362 HG2 GLU 47 1HG GLU 47 2.362 3.299 -17.474 363 HG3 GLU 47 2HG GLU 47 1.766 4.748 -16.665 364 H VAL 48 H VAL 48 2.144 1.802 -12.541 365 HA VAL 48 HA VAL 48 4.362 -0.129 -12.742 366 HB VAL 48 HB VAL 48 4.857 0.311 -10.403 367 HG11 VAL 48 1HG1 VAL 48 5.382 2.830 -10.648 368 HG12 VAL 48 2HG1 VAL 48 6.123 1.692 -11.775 369 HG13 VAL 48 3HG1 VAL 48 4.725 2.644 -12.274 370 HG21 VAL 48 3HG2 VAL 48 2.243 1.542 -10.465 371 HG22 VAL 48 1HG2 VAL 48 3.212 1.026 -9.084 372 HG23 VAL 48 2HG2 VAL 48 3.449 2.629 -9.780 373 H VAL 49 H VAL 49 1.083 0.375 -11.774 374 HA VAL 49 HA VAL 49 0.746 -1.789 -10.011 375 HB VAL 49 HB VAL 49 -0.925 -0.004 -10.261 376 HG11 VAL 49 1HG1 VAL 49 -2.474 -0.045 -12.179 377 HG12 VAL 49 2HG1 VAL 49 -0.816 0.329 -12.657 378 HG13 VAL 49 3HG1 VAL 49 -1.473 -1.284 -12.937 379 HG21 VAL 49 3HG2 VAL 49 -2.086 -2.705 -10.937 380 HG22 VAL 49 1HG2 VAL 49 -1.532 -2.224 -9.333 381 HG23 VAL 49 2HG2 VAL 49 -2.890 -1.385 -10.086 382 H ASP 50 H ASP 50 1.292 -1.715 -13.370 383 HA ASP 50 HA ASP 50 -0.089 -4.058 -14.152 384 HB2 ASP 50 1HB ASP 50 0.996 -2.184 -15.603 385 HB3 ASP 50 2HB ASP 50 2.456 -3.161 -15.468 386 H ARG 51 H ARG 51 3.144 -3.477 -12.877 387 HA ARG 51 HA ARG 51 3.721 -6.347 -12.986 388 HB2 ARG 51 1HB ARG 51 6.004 -5.803 -12.667 389 HB3 ARG 51 2HB ARG 51 5.385 -4.626 -13.818 390 HG2 ARG 51 1HG ARG 51 6.496 -3.201 -12.467 391 HG3 ARG 51 2HG ARG 51 4.979 -3.254 -11.568 392 HD2 ARG 51 1HD ARG 51 5.847 -4.728 -9.969 393 HD3 ARG 51 2HD ARG 51 7.208 -5.178 -10.996 394 HE ARG 51 HE ARG 51 7.304 -2.419 -10.380 395 HH11 ARG 51 1HH1 ARG 51 7.840 -5.561 -8.980 396 HH12 ARG 51 2HH1 ARG 51 9.012 -4.995 -7.837 397 HH21 ARG 51 1HH2 ARG 51 8.846 -1.662 -8.879 398 HH22 ARG 51 2HH2 ARG 51 9.584 -2.777 -7.780 399 H PHE 52 H PHE 52 3.188 -3.706 -10.755 400 HA PHE 52 HA PHE 52 4.088 -4.906 -8.394 401 HB2 PHE 52 1HB PHE 52 2.277 -2.673 -9.092 402 HB3 PHE 52 2HB PHE 52 2.051 -3.370 -7.491 403 HD1 PHE 52 HD1 PHE 52 4.360 -3.785 -6.201 404 HD2 PHE 52 HD2 PHE 52 3.714 -0.903 -9.266 405 HE1 PHE 52 HE1 PHE 52 6.260 -2.467 -5.358 406 HE2 PHE 52 HE2 PHE 52 5.613 0.419 -8.429 407 HZ PHE 52 HZ PHE 52 6.890 -0.363 -6.474 408 H ASP 53 H ASP 53 2.315 -5.240 -6.538 409 HA ASP 53 HA ASP 53 0.447 -7.276 -7.565 410 HB2 ASP 53 1HB ASP 53 2.230 -7.233 -5.165 411 HB3 ASP 53 2HB ASP 53 0.712 -8.123 -5.079 412 H VAL 54 H VAL 54 0.864 -5.498 -4.502 413 HA VAL 54 HA VAL 54 -2.023 -4.921 -4.554 414 HB VAL 54 HB VAL 54 -1.099 -6.270 -2.626 415 HG11 VAL 54 1HG1 VAL 54 0.563 -5.520 -1.346 416 HG12 VAL 54 2HG1 VAL 54 0.824 -4.278 -2.572 417 HG13 VAL 54 3HG1 VAL 54 -0.190 -3.935 -1.170 418 HG21 VAL 54 3HG2 VAL 54 -3.159 -4.580 -2.714 419 HG22 VAL 54 1HG2 VAL 54 -2.717 -5.460 -1.252 420 HG23 VAL 54 2HG2 VAL 54 -2.211 -3.784 -1.458 421 H VAL 55 H VAL 55 -2.718 -2.853 -3.661 422 HA VAL 55 HA VAL 55 -0.693 -0.729 -3.877 423 HB VAL 55 HB VAL 55 -3.481 -0.500 -5.011 424 HG11 VAL 55 1HG1 VAL 55 -1.055 1.279 -5.225 425 HG12 VAL 55 2HG1 VAL 55 -2.586 1.535 -6.062 426 HG13 VAL 55 3HG1 VAL 55 -2.519 1.614 -4.301 427 HG21 VAL 55 3HG2 VAL 55 -2.397 -0.607 -7.226 428 HG22 VAL 55 1HG2 VAL 55 -0.873 -1.013 -6.437 429 HG23 VAL 55 2HG2 VAL 55 -2.247 -2.115 -6.324 430 H LEU 56 H LEU 56 -1.035 1.094 -2.598 431 HA LEU 56 HA LEU 56 -3.334 1.054 -0.783 432 HB2 LEU 56 1HB LEU 56 -0.568 0.545 -0.080 433 HB3 LEU 56 2HB LEU 56 -1.227 1.922 0.802 434 HG LEU 56 HG LEU 56 -2.922 -0.486 0.782 435 HD11 LEU 56 1HD1 LEU 56 -1.304 -1.163 2.830 436 HD12 LEU 56 2HD1 LEU 56 -0.118 -0.562 1.671 437 HD13 LEU 56 3HD1 LEU 56 -1.206 -1.874 1.218 438 HD21 LEU 56 3HD2 LEU 56 -2.584 0.285 3.355 439 HD22 LEU 56 1HD2 LEU 56 -3.796 0.960 2.266 440 HD23 LEU 56 2HD2 LEU 56 -2.264 1.800 2.508 441 H LEU 57 H LEU 57 -3.885 3.079 0.104 442 HA LEU 57 HA LEU 57 -2.581 5.374 -1.208 443 HB2 LEU 57 1HB LEU 57 -5.235 4.514 -1.412 444 HB3 LEU 57 2HB LEU 57 -5.277 5.920 -0.350 445 HG LEU 57 HG LEU 57 -3.988 5.942 -3.073 446 HD11 LEU 57 1HD1 LEU 57 -6.120 7.297 -3.615 447 HD12 LEU 57 2HD1 LEU 57 -6.820 6.437 -2.242 448 HD13 LEU 57 3HD1 LEU 57 -6.201 5.534 -3.625 449 HD21 LEU 57 3HD2 LEU 57 -4.252 7.834 -0.879 450 HD22 LEU 57 1HD2 LEU 57 -4.854 8.472 -2.409 451 HD23 LEU 57 2HD2 LEU 57 -3.198 7.877 -2.294 452 H ALA 58 H ALA 58 -2.557 7.369 -0.028 453 HA ALA 58 HA ALA 58 -2.239 6.940 2.830 454 HB1 ALA 58 3HB ALA 58 -1.147 8.759 0.856 455 HB2 ALA 58 1HB ALA 58 -1.670 9.600 2.315 456 HB3 ALA 58 2HB ALA 58 -0.507 8.279 2.428 457 HA PRO 59 HA PRO 59 -5.925 8.901 4.180 458 HB2 PRO 59 1HB PRO 59 -5.075 10.326 6.329 459 HB3 PRO 59 2HB PRO 59 -5.203 8.563 6.334 460 HG2 PRO 59 1HG PRO 59 -2.787 10.287 5.935 461 HG3 PRO 59 2HG PRO 59 -2.960 8.809 6.900 462 HD2 PRO 59 1HD PRO 59 -1.836 8.816 4.438 463 HD3 PRO 59 2HD PRO 59 -2.757 7.433 5.063 464 H GLN 60 H GLN 60 -3.139 10.984 3.653 465 HA GLN 60 HA GLN 60 -4.770 13.377 3.536 466 HB2 GLN 60 1HB GLN 60 -1.825 12.867 3.132 467 HB3 GLN 60 2HB GLN 60 -2.561 14.446 2.880 468 HG2 GLN 60 1HG GLN 60 -3.460 13.697 5.380 469 HG3 GLN 60 2HG GLN 60 -1.794 13.121 5.338 470 HE21 GLN 60 2HE2 GLN 60 -3.758 15.974 4.602 471 HE22 GLN 60 1HE2 GLN 60 -2.572 17.131 5.092 472 H SER 61 H SER 61 -6.080 13.413 1.795 473 HA SER 61 HA SER 61 -4.949 13.864 -0.776 474 HB2 SER 61 1HB SER 61 -5.762 11.146 -0.103 475 HB3 SER 61 2HB SER 61 -6.623 11.771 -1.509 476 HG SER 61 HG SER 61 -3.834 11.495 -1.132 477 H ARG 62 H ARG 62 -6.241 15.243 -1.799 478 HA ARG 62 HA ARG 62 -8.937 15.659 -0.777 479 HB2 ARG 62 1HB ARG 62 -7.490 17.611 -1.057 480 HB3 ARG 62 2HB ARG 62 -7.305 17.245 -2.767 481 HG2 ARG 62 1HG ARG 62 -9.767 17.552 -3.024 482 HG3 ARG 62 2HG ARG 62 -9.812 18.108 -1.349 483 HD2 ARG 62 1HD ARG 62 -9.481 20.143 -2.226 484 HD3 ARG 62 2HD ARG 62 -7.802 19.629 -2.381 485 HE ARG 62 HE ARG 62 -9.218 18.807 -4.659 486 HH11 ARG 62 1HH1 ARG 62 -8.078 21.714 -3.120 487 HH12 ARG 62 2HH1 ARG 62 -7.920 22.594 -4.605 488 HH21 ARG 62 1HH2 ARG 62 -9.015 19.954 -6.620 489 HH22 ARG 62 2HH2 ARG 62 -8.454 21.592 -6.594 490 H PHE 63 H PHE 63 -7.533 15.634 -4.058 491 HA PHE 63 HA PHE 63 -10.041 14.448 -5.027 492 HB2 PHE 63 1HB PHE 63 -8.472 16.591 -5.983 493 HB3 PHE 63 2HB PHE 63 -8.281 15.283 -7.146 494 HD1 PHE 63 HD2 PHE 63 -10.686 17.540 -5.531 495 HD2 PHE 63 HD1 PHE 63 -10.087 14.589 -8.539 496 HE1 PHE 63 HE2 PHE 63 -12.867 18.109 -6.519 497 HE2 PHE 63 HE1 PHE 63 -12.266 15.154 -9.532 498 HZ PHE 63 HZ PHE 63 -13.660 16.914 -8.521 499 H ASN 64 H ASN 64 -6.624 13.937 -4.734 500 HA ASN 64 HA ASN 64 -6.125 12.017 -6.653 501 HB2 ASN 64 1HB ASN 64 -5.042 12.370 -3.862 502 HB3 ASN 64 2HB ASN 64 -4.458 11.096 -4.929 503 HD21 ASN 64 2HD2 ASN 64 -2.438 12.342 -4.491 504 HD22 ASN 64 1HD2 ASN 64 -2.057 13.634 -5.574 505 H LYS 65 H LYS 65 -7.324 11.506 -3.341 506 HA LYS 65 HA LYS 65 -7.566 8.724 -3.473 507 HB2 LYS 65 1HB LYS 65 -9.190 8.979 -1.606 508 HB3 LYS 65 2HB LYS 65 -7.694 9.869 -1.354 509 HG2 LYS 65 1HG LYS 65 -9.027 11.575 -0.826 510 HG3 LYS 65 2HG LYS 65 -9.256 11.744 -2.567 511 HD2 LYS 65 1HD LYS 65 -11.436 11.458 -2.194 512 HD3 LYS 65 2HD LYS 65 -11.064 9.772 -1.826 513 HE2 LYS 65 1HE LYS 65 -10.605 10.557 0.548 514 HE3 LYS 65 2HE LYS 65 -11.365 12.078 0.081 515 HZ1 LYS 65 3HZ LYS 65 -12.800 9.576 -0.444 516 HZ2 LYS 65 1HZ LYS 65 -13.410 11.114 -0.087 517 HZ3 LYS 65 2HZ LYS 65 -12.754 10.158 1.143 518 H LYS 66 H LYS 66 -9.825 11.284 -4.377 519 HA LYS 66 HA LYS 66 -12.077 9.701 -4.865 520 HB2 LYS 66 1HB LYS 66 -11.468 12.382 -5.057 521 HB3 LYS 66 2HB LYS 66 -11.741 11.930 -6.735 522 HG2 LYS 66 1HG LYS 66 -13.947 11.700 -6.441 523 HG3 LYS 66 2HG LYS 66 -13.758 10.912 -4.873 524 HD2 LYS 66 1HD LYS 66 -13.022 13.743 -4.871 525 HD3 LYS 66 2HD LYS 66 -14.716 13.447 -5.271 526 HE2 LYS 66 1HE LYS 66 -14.589 11.835 -3.202 527 HE3 LYS 66 2HE LYS 66 -13.217 12.852 -2.761 528 HZ1 LYS 66 3HZ LYS 66 -14.848 14.043 -1.785 529 HZ2 LYS 66 1HZ LYS 66 -16.057 13.493 -2.833 530 HZ3 LYS 66 2HZ LYS 66 -14.999 14.716 -3.329 531 H ARG 67 H ARG 67 -9.636 10.872 -7.188 532 HA ARG 67 HA ARG 67 -10.636 9.437 -9.392 533 HB2 ARG 67 1HB ARG 67 -7.860 10.487 -8.830 534 HB3 ARG 67 2HB ARG 67 -8.375 9.840 -10.381 535 HG2 ARG 67 1HG ARG 67 -9.658 12.198 -9.022 536 HG3 ARG 67 2HG ARG 67 -8.397 12.317 -10.251 537 HD2 ARG 67 1HD ARG 67 -9.880 11.040 -11.795 538 HD3 ARG 67 2HD ARG 67 -11.148 11.131 -10.573 539 HE ARG 67 HE ARG 67 -10.275 13.725 -11.052 540 HH11 ARG 67 1HH1 ARG 67 -11.841 11.145 -12.786 541 HH12 ARG 67 2HH1 ARG 67 -12.712 12.208 -13.842 542 HH21 ARG 67 1HH2 ARG 67 -11.415 15.135 -12.435 543 HH22 ARG 67 2HH2 ARG 67 -12.468 14.477 -13.642 544 H LEU 68 H LEU 68 -8.020 8.690 -7.108 545 HA LEU 68 HA LEU 68 -7.079 6.343 -8.197 546 HB2 LEU 68 1HB LEU 68 -7.114 7.577 -5.552 547 HB3 LEU 68 2HB LEU 68 -7.030 5.817 -5.500 548 HG LEU 68 HG LEU 68 -4.819 6.945 -5.394 549 HD11 LEU 68 1HD1 LEU 68 -4.292 5.608 -7.817 550 HD12 LEU 68 2HD1 LEU 68 -5.634 4.766 -7.044 551 HD13 LEU 68 3HD1 LEU 68 -4.119 4.995 -6.172 552 HD21 LEU 68 3HD2 LEU 68 -5.475 7.744 -8.228 553 HD22 LEU 68 1HD2 LEU 68 -3.906 7.927 -7.443 554 HD23 LEU 68 2HD2 LEU 68 -5.298 8.835 -6.852 555 H GLU 69 H GLU 69 -9.485 6.496 -5.561 556 HA GLU 69 HA GLU 69 -10.223 3.807 -5.673 557 HB2 GLU 69 1HB GLU 69 -11.415 6.281 -4.545 558 HB3 GLU 69 2HB GLU 69 -12.484 4.899 -4.735 559 HG2 GLU 69 1HG GLU 69 -9.883 4.352 -3.466 560 HG3 GLU 69 2HG GLU 69 -11.004 5.355 -2.547 561 H GLU 70 H GLU 70 -11.480 6.609 -7.405 562 HA GLU 70 HA GLU 70 -13.721 5.363 -8.562 563 HB2 GLU 70 1HB GLU 70 -12.091 7.785 -9.206 564 HB3 GLU 70 2HB GLU 70 -13.259 7.210 -10.386 565 HG2 GLU 70 1HG GLU 70 -14.066 7.669 -7.545 566 HG3 GLU 70 2HG GLU 70 -13.971 9.008 -8.687 567 H ILE 71 H ILE 71 -10.344 5.255 -9.330 568 HA ILE 71 HA ILE 71 -10.827 4.063 -11.945 569 HB ILE 71 HB ILE 71 -8.230 4.671 -10.528 570 HG12 ILE 71 1HG1 ILE 71 -9.121 6.070 -13.004 571 HG13 ILE 71 2HG1 ILE 71 -9.900 6.515 -11.491 572 HG21 ILE 71 1HG2 ILE 71 -7.440 3.132 -11.966 573 HG22 ILE 71 2HG2 ILE 71 -8.863 3.218 -13.004 574 HG23 ILE 71 3HG2 ILE 71 -7.592 4.434 -13.145 575 HD11 ILE 71 3HD1 ILE 71 -7.046 6.824 -12.308 576 HD12 ILE 71 1HD1 ILE 71 -8.163 8.024 -11.656 577 HD13 ILE 71 2HD1 ILE 71 -7.493 6.778 -10.603 578 H THR 72 H THR 72 -9.743 3.179 -8.729 579 HA THR 72 HA THR 72 -8.803 0.584 -9.369 580 HB THR 72 HB THR 72 -8.856 0.128 -6.992 581 HG1 THR 72 HG1 THR 72 -10.729 0.957 -6.234 582 HG21 THR 72 3HG2 THR 72 -7.072 1.431 -6.681 583 HG22 THR 72 1HG2 THR 72 -8.073 2.881 -6.629 584 HG23 THR 72 2HG2 THR 72 -7.494 2.264 -8.177 585 H LYS 73 H LYS 73 -11.952 1.859 -8.453 586 HA LYS 73 HA LYS 73 -13.323 -0.455 -7.847 587 HB2 LYS 73 1HB LYS 73 -13.989 2.237 -8.589 588 HB3 LYS 73 2HB LYS 73 -15.073 1.124 -9.414 589 HG2 LYS 73 1HG LYS 73 -15.180 0.071 -6.963 590 HG3 LYS 73 2HG LYS 73 -14.815 1.745 -6.538 591 HD2 LYS 73 1HD LYS 73 -16.846 1.627 -8.582 592 HD3 LYS 73 2HD LYS 73 -17.313 0.666 -7.177 593 HE2 LYS 73 1HE LYS 73 -18.129 2.846 -6.778 594 HE3 LYS 73 2HE LYS 73 -16.696 2.670 -5.765 595 HZ1 LYS 73 3HZ LYS 73 -17.109 4.343 -8.128 596 HZ2 LYS 73 1HZ LYS 73 -15.561 3.706 -7.882 597 HZ3 LYS 73 2HZ LYS 73 -16.271 4.680 -6.697 598 HA PRO 74 HA PRO 74 -14.407 -1.107 -12.502 599 HB2 PRO 74 1HB PRO 74 -13.138 0.460 -14.321 600 HB3 PRO 74 2HB PRO 74 -14.671 0.913 -13.564 601 HG2 PRO 74 1HG PRO 74 -11.892 1.786 -12.880 602 HG3 PRO 74 2HG PRO 74 -13.374 2.753 -12.984 603 HD2 PRO 74 1HD PRO 74 -12.352 1.902 -10.625 604 HD3 PRO 74 2HD PRO 74 -14.096 2.101 -10.895 605 H LYS 75 H LYS 75 -11.081 -0.047 -11.899 606 HA LYS 75 HA LYS 75 -9.830 -1.782 -13.738 607 HB2 LYS 75 1HB LYS 75 -8.903 -0.287 -11.308 608 HB3 LYS 75 2HB LYS 75 -7.828 -1.429 -12.104 609 HG2 LYS 75 1HG LYS 75 -9.180 0.791 -13.602 610 HG3 LYS 75 2HG LYS 75 -7.637 1.012 -12.772 611 HD2 LYS 75 1HD LYS 75 -7.957 -1.290 -14.641 612 HD3 LYS 75 2HD LYS 75 -7.722 0.328 -15.310 613 HE2 LYS 75 1HE LYS 75 -5.540 -0.233 -15.115 614 HE3 LYS 75 2HE LYS 75 -5.781 0.327 -13.461 615 HZ1 LYS 75 3HZ LYS 75 -6.400 -2.468 -13.972 616 HZ2 LYS 75 1HZ LYS 75 -5.639 -1.751 -12.642 617 HZ3 LYS 75 2HZ LYS 75 -4.764 -2.046 -14.059 618 H GLY 76 H GLY 76 -11.140 -2.278 -10.574 619 HA2 GLY 76 1HA GLY 76 -11.335 -4.156 -9.269 620 HA3 GLY 76 2HA GLY 76 -11.060 -5.070 -10.744 621 H ILE 77 H ILE 77 -9.190 -3.076 -8.452 622 HA ILE 77 HA ILE 77 -7.163 -5.209 -8.415 623 HB ILE 77 HB ILE 77 -5.427 -3.412 -8.156 624 HG12 ILE 77 1HG1 ILE 77 -6.846 -1.360 -9.569 625 HG13 ILE 77 2HG1 ILE 77 -7.731 -1.759 -8.101 626 HG21 ILE 77 1HG2 ILE 77 -6.971 -3.878 -10.667 627 HG22 ILE 77 2HG2 ILE 77 -5.623 -2.742 -10.670 628 HG23 ILE 77 3HG2 ILE 77 -5.354 -4.426 -10.223 629 HD11 ILE 77 3HD1 ILE 77 -5.792 -1.302 -6.756 630 HD12 ILE 77 1HD1 ILE 77 -4.813 -1.038 -8.199 631 HD13 ILE 77 2HD1 ILE 77 -6.121 0.078 -7.805 632 HA PRO 78 HA PRO 78 -7.358 -4.997 -4.034 633 HB2 PRO 78 1HB PRO 78 -4.803 -5.625 -3.365 634 HB3 PRO 78 2HB PRO 78 -5.947 -6.810 -4.005 635 HG2 PRO 78 1HG PRO 78 -3.779 -5.313 -5.424 636 HG3 PRO 78 2HG PRO 78 -4.232 -7.022 -5.560 637 HD2 PRO 78 1HD PRO 78 -4.993 -5.164 -7.377 638 HD3 PRO 78 2HD PRO 78 -5.996 -6.572 -6.973 639 H ILE 79 H ILE 79 -7.751 -2.752 -3.770 640 HA ILE 79 HA ILE 79 -5.353 -1.145 -3.178 641 HB ILE 79 HB ILE 79 -6.753 -0.264 -5.026 642 HG12 ILE 79 1HG1 ILE 79 -7.154 2.043 -3.850 643 HG13 ILE 79 2HG1 ILE 79 -6.376 1.267 -2.474 644 HG21 ILE 79 1HG2 ILE 79 -8.899 -1.123 -3.889 645 HG22 ILE 79 2HG2 ILE 79 -8.855 0.397 -2.997 646 HG23 ILE 79 3HG2 ILE 79 -8.964 0.411 -4.758 647 HD11 ILE 79 3HD1 ILE 79 -4.364 0.965 -3.667 648 HD12 ILE 79 1HD1 ILE 79 -5.127 1.383 -5.201 649 HD13 ILE 79 2HD1 ILE 79 -4.884 2.623 -3.970 650 H GLU 80 H GLU 80 -5.108 -0.296 -1.190 651 HA GLU 80 HA GLU 80 -7.372 -0.478 0.682 652 HB2 GLU 80 1HB GLU 80 -4.692 -1.676 0.876 653 HB3 GLU 80 2HB GLU 80 -5.204 -0.804 2.314 654 HG2 GLU 80 1HG GLU 80 -6.885 -2.912 0.991 655 HG3 GLU 80 2HG GLU 80 -5.722 -3.261 2.269 656 H ILE 81 H ILE 81 -7.117 0.933 2.600 657 HA ILE 81 HA ILE 81 -5.433 3.285 2.086 658 HB ILE 81 HB ILE 81 -8.349 3.388 2.873 659 HG12 ILE 81 1HG1 ILE 81 -7.653 4.900 0.528 660 HG13 ILE 81 2HG1 ILE 81 -7.124 3.233 0.329 661 HG21 ILE 81 1HG2 ILE 81 -6.330 5.594 2.484 662 HG22 ILE 81 2HG2 ILE 81 -8.062 5.835 2.710 663 HG23 ILE 81 3HG2 ILE 81 -7.096 5.118 3.999 664 HD11 ILE 81 3HD1 ILE 81 -9.880 3.771 1.312 665 HD12 ILE 81 1HD1 ILE 81 -9.512 3.973 -0.402 666 HD13 ILE 81 2HD1 ILE 81 -9.259 2.411 0.378 667 H ILE 82 H ILE 82 -4.513 4.185 3.858 668 HA ILE 82 HA ILE 82 -4.753 2.728 6.352 669 HB ILE 82 HB ILE 82 -2.999 5.113 5.769 670 HG12 ILE 82 1HG1 ILE 82 -2.335 2.173 5.510 671 HG13 ILE 82 2HG1 ILE 82 -2.594 3.273 4.161 672 HG21 ILE 82 1HG2 ILE 82 -1.646 4.224 7.618 673 HG22 ILE 82 2HG2 ILE 82 -3.280 4.640 8.131 674 HG23 ILE 82 3HG2 ILE 82 -2.842 2.953 7.866 675 HD11 ILE 82 3HD1 ILE 82 -0.340 3.230 6.132 676 HD12 ILE 82 1HD1 ILE 82 -0.277 3.098 4.375 677 HD13 ILE 82 2HD1 ILE 82 -0.680 4.640 5.128 678 H ASN 83 H ASN 83 -5.364 3.599 8.330 679 HA ASN 83 HA ASN 83 -7.303 5.732 8.165 680 HB2 ASN 83 1HB ASN 83 -6.500 3.721 10.215 681 HB3 ASN 83 2HB ASN 83 -7.307 5.185 10.771 682 HD21 ASN 83 2HD2 ASN 83 -9.385 5.695 9.800 683 HD22 ASN 83 1HD2 ASN 83 -10.418 4.401 9.307 684 H THR 84 H THR 84 -7.261 7.665 9.361 685 HA THR 84 HA THR 84 -4.913 9.109 9.345 686 HB THR 84 HB THR 84 -6.429 10.233 11.427 687 HG1 THR 84 HG1 THR 84 -8.538 10.200 10.326 688 HG21 THR 84 3HG2 THR 84 -5.364 11.492 9.653 689 HG22 THR 84 1HG2 THR 84 -7.089 11.858 9.678 690 HG23 THR 84 2HG2 THR 84 -6.435 10.768 8.455 691 H ILE 85 H ILE 85 -6.224 7.065 11.870 692 HA ILE 85 HA ILE 85 -4.451 7.933 13.925 693 HB ILE 85 HB ILE 85 -5.856 5.268 13.769 694 HG12 ILE 85 1HG1 ILE 85 -7.287 7.035 15.434 695 HG13 ILE 85 2HG1 ILE 85 -6.960 7.927 13.951 696 HG21 ILE 85 1HG2 ILE 85 -5.457 5.036 16.012 697 HG22 ILE 85 2HG2 ILE 85 -4.009 5.914 15.524 698 HG23 ILE 85 3HG2 ILE 85 -5.347 6.775 16.286 699 HD11 ILE 85 3HD1 ILE 85 -8.676 5.574 14.416 700 HD12 ILE 85 1HD1 ILE 85 -8.893 6.947 13.332 701 HD13 ILE 85 2HD1 ILE 85 -7.802 5.635 12.885 702 H ASP 86 H ASP 86 -4.582 4.843 12.142 703 HA ASP 86 HA ASP 86 -2.177 3.795 12.997 704 HB2 ASP 86 1HB ASP 86 -3.361 3.473 10.232 705 HB3 ASP 86 2HB ASP 86 -2.231 2.377 11.021 706 H TYR 87 H TYR 87 -2.779 6.259 10.606 707 HA TYR 87 HA TYR 87 -0.152 6.192 9.463 708 HB2 TYR 87 1HB TYR 87 -2.179 7.036 8.264 709 HB3 TYR 87 2HB TYR 87 -2.190 8.424 9.346 710 HD1 TYR 87 HD2 TYR 87 -0.326 6.745 6.642 711 HD2 TYR 87 HD1 TYR 87 -0.681 10.247 9.031 712 HE1 TYR 87 HE2 TYR 87 1.222 7.921 5.136 713 HE2 TYR 87 HE1 TYR 87 0.867 11.434 7.532 714 HH TYR 87 HH TYR 87 2.802 9.888 5.290 715 H GLY 88 H GLY 88 -1.834 8.493 11.613 716 HA2 GLY 88 1HA GLY 88 0.327 10.192 12.087 717 HA3 GLY 88 2HA GLY 88 -1.025 9.956 13.184 718 H THR 89 H THR 89 -0.677 7.292 13.869 719 HA THR 89 HA THR 89 1.466 7.530 15.769 720 HB THR 89 HB THR 89 -0.645 6.467 16.417 721 HG1 THR 89 HG1 THR 89 0.345 4.535 17.320 722 HG21 THR 89 3HG2 THR 89 -1.664 5.060 15.022 723 HG22 THR 89 1HG2 THR 89 -0.386 3.883 15.322 724 HG23 THR 89 2HG2 THR 89 -0.244 5.015 13.978 725 H MET 90 H MET 90 1.094 6.172 12.643 726 HA MET 90 HA MET 90 2.516 5.051 11.266 727 HB2 MET 90 1HB MET 90 4.675 5.503 13.319 728 HB3 MET 90 2HB MET 90 4.860 5.288 11.584 729 HG2 MET 90 1HG MET 90 4.881 7.485 11.371 730 HG3 MET 90 2HG MET 90 3.195 7.507 11.885 731 HE1 MET 90 3HE MET 90 7.026 8.123 13.346 732 HE2 MET 90 1HE MET 90 6.578 7.563 14.958 733 HE3 MET 90 2HE MET 90 6.398 6.489 13.570 734 H ASN 91 H ASN 91 1.345 3.108 11.692 735 HA ASN 91 HA ASN 91 2.705 1.237 13.511 736 HB2 ASN 91 1HB ASN 91 -0.108 1.726 12.874 737 HB3 ASN 91 2HB ASN 91 0.333 0.023 12.788 738 HD21 ASN 91 2HD2 ASN 91 2.006 -0.447 14.725 739 HD22 ASN 91 1HD2 ASN 91 1.362 -0.027 16.273 740 H GLY 92 H GLY 92 4.328 0.590 12.077 741 HA2 GLY 92 1HA GLY 92 4.074 -0.115 9.417 742 HA3 GLY 92 2HA GLY 92 5.245 -0.825 10.516 743 H GLU 93 H GLU 93 3.669 -2.230 12.249 744 HA GLU 93 HA GLU 93 3.226 -4.621 10.929 745 HB2 GLU 93 1HB GLU 93 3.455 -4.241 13.425 746 HB3 GLU 93 2HB GLU 93 1.760 -3.777 13.427 747 HG2 GLU 93 1HG GLU 93 1.066 -5.941 12.782 748 HG3 GLU 93 2HG GLU 93 2.715 -6.429 12.394 749 H LYS 94 H LYS 94 0.820 -2.196 11.923 750 HA LYS 94 HA LYS 94 -1.428 -3.525 10.888 751 HB2 LYS 94 1HB LYS 94 -0.934 -0.578 11.346 752 HB3 LYS 94 2HB LYS 94 -2.503 -1.266 10.951 753 HG2 LYS 94 1HG LYS 94 -1.016 -2.335 13.297 754 HG3 LYS 94 2HG LYS 94 -1.832 -0.775 13.431 755 HD2 LYS 94 1HD LYS 94 -3.918 -1.884 12.618 756 HD3 LYS 94 2HD LYS 94 -3.069 -3.430 12.709 757 HE2 LYS 94 1HE LYS 94 -2.845 -3.274 15.056 758 HE3 LYS 94 2HE LYS 94 -3.301 -1.572 15.063 759 HZ1 LYS 94 3HZ LYS 94 -5.527 -2.310 14.240 760 HZ2 LYS 94 1HZ LYS 94 -5.157 -2.801 15.817 761 HZ3 LYS 94 2HZ LYS 94 -5.052 -3.906 14.540 762 H VAL 95 H VAL 95 0.855 -1.280 9.424 763 HA VAL 95 HA VAL 95 -0.548 -0.792 7.036 764 HB VAL 95 HB VAL 95 2.441 -0.820 7.472 765 HG11 VAL 95 1HG1 VAL 95 2.023 1.022 5.555 766 HG12 VAL 95 2HG1 VAL 95 2.412 -0.666 5.219 767 HG13 VAL 95 3HG1 VAL 95 0.735 -0.119 5.172 768 HG21 VAL 95 3HG2 VAL 95 2.150 1.009 8.698 769 HG22 VAL 95 1HG2 VAL 95 1.402 1.800 7.311 770 HG23 VAL 95 2HG2 VAL 95 0.405 0.915 8.465 771 H LEU 96 H LEU 96 2.350 -2.843 7.382 772 HA LEU 96 HA LEU 96 2.170 -4.142 4.955 773 HB2 LEU 96 1HB LEU 96 3.439 -5.999 6.091 774 HB3 LEU 96 2HB LEU 96 4.149 -4.390 6.199 775 HG LEU 96 HG LEU 96 2.642 -4.588 8.507 776 HD11 LEU 96 1HD1 LEU 96 2.929 -6.666 9.481 777 HD12 LEU 96 2HD1 LEU 96 4.188 -7.142 8.343 778 HD13 LEU 96 3HD1 LEU 96 2.506 -7.080 7.821 779 HD21 LEU 96 3HD2 LEU 96 4.796 -4.694 9.623 780 HD22 LEU 96 1HD2 LEU 96 4.875 -3.598 8.244 781 HD23 LEU 96 2HD2 LEU 96 5.569 -5.216 8.125 782 H GLN 97 H GLN 97 0.678 -5.024 8.042 783 HA GLN 97 HA GLN 97 -0.387 -7.493 7.293 784 HB2 GLN 97 1HB GLN 97 -1.162 -5.438 9.334 785 HB3 GLN 97 2HB GLN 97 -2.188 -6.841 9.069 786 HG2 GLN 97 1HG GLN 97 0.711 -7.298 9.508 787 HG3 GLN 97 2HG GLN 97 -0.280 -6.825 10.888 788 HE21 GLN 97 2HE2 GLN 97 0.296 -9.262 8.469 789 HE22 GLN 97 1HE2 GLN 97 -0.609 -10.519 9.233 790 H LEU 98 H LEU 98 -1.839 -4.253 7.123 791 HA LEU 98 HA LEU 98 -4.319 -5.025 6.085 792 HB2 LEU 98 1HB LEU 98 -3.480 -2.740 6.980 793 HB3 LEU 98 2HB LEU 98 -3.001 -2.453 5.309 794 HG LEU 98 HG LEU 98 -5.342 -2.742 4.607 795 HD11 LEU 98 1HD1 LEU 98 -6.150 -4.227 6.309 796 HD12 LEU 98 2HD1 LEU 98 -7.097 -2.740 6.360 797 HD13 LEU 98 3HD1 LEU 98 -5.841 -3.028 7.565 798 HD21 LEU 98 3HD2 LEU 98 -4.624 -0.669 6.646 799 HD22 LEU 98 1HD2 LEU 98 -6.217 -0.683 5.889 800 HD23 LEU 98 2HD2 LEU 98 -4.771 -0.509 4.895 801 H ALA 99 H ALA 99 -1.408 -3.883 4.379 802 HA ALA 99 HA ALA 99 -2.337 -4.017 1.781 803 HB1 ALA 99 3HB ALA 99 -0.192 -3.675 1.154 804 HB2 ALA 99 1HB ALA 99 0.017 -3.364 2.878 805 HB3 ALA 99 2HB ALA 99 0.436 -4.941 2.209 806 H ILE 100 H ILE 100 -0.533 -6.575 3.501 807 HA ILE 100 HA ILE 100 -0.713 -8.537 1.548 808 HB ILE 100 HB ILE 100 -0.711 -8.941 4.542 809 HG12 ILE 100 1HG1 ILE 100 1.652 -9.058 2.672 810 HG13 ILE 100 2HG1 ILE 100 1.171 -7.568 3.477 811 HG21 ILE 100 1HG2 ILE 100 -1.080 -11.077 3.970 812 HG22 ILE 100 2HG2 ILE 100 -0.681 -10.792 2.276 813 HG23 ILE 100 3HG2 ILE 100 0.605 -11.066 3.450 814 HD11 ILE 100 3HD1 ILE 100 1.273 -9.385 5.535 815 HD12 ILE 100 1HD1 ILE 100 2.623 -9.858 4.503 816 HD13 ILE 100 2HD1 ILE 100 2.520 -8.209 5.119 817 H ASN 101 H ASN 101 -2.973 -7.762 4.163 818 HA ASN 101 HA ASN 101 -4.740 -9.892 3.843 819 HB2 ASN 101 1HB ASN 101 -4.674 -8.049 5.658 820 HB3 ASN 101 2HB ASN 101 -5.678 -7.121 4.548 821 HD21 ASN 101 2HD2 ASN 101 -7.017 -7.355 6.606 822 HD22 ASN 101 1HD2 ASN 101 -8.123 -8.681 6.639 823 H ALA 102 H ALA 102 -4.725 -6.705 2.279 824 HA ALA 102 HA ALA 102 -7.085 -7.081 0.777 825 HB1 ALA 102 3HB ALA 102 -6.715 -4.923 0.424 826 HB2 ALA 102 1HB ALA 102 -5.076 -5.069 1.060 827 HB3 ALA 102 2HB ALA 102 -5.386 -5.347 -0.655 828 H PHE 103 H PHE 103 -3.672 -7.669 0.038 829 HA PHE 103 HA PHE 103 -4.025 -8.379 -2.664 830 HB2 PHE 103 1HB PHE 103 -1.838 -7.808 -1.583 831 HB3 PHE 103 2HB PHE 103 -1.874 -9.380 -0.791 832 HD1 PHE 103 HD1 PHE 103 -2.769 -8.421 -4.272 833 HD2 PHE 103 HD2 PHE 103 -0.150 -10.605 -1.724 834 HE1 PHE 103 HE1 PHE 103 -1.697 -9.432 -6.243 835 HE2 PHE 103 HE2 PHE 103 0.926 -11.617 -3.690 836 HZ PHE 103 HZ PHE 103 0.153 -11.031 -5.953 837 H ASN 104 H ASN 104 -4.033 -10.293 0.309 838 HA ASN 104 HA ASN 104 -4.267 -12.813 -0.986 839 HB2 ASN 104 1HB ASN 104 -4.341 -11.795 1.774 840 HB3 ASN 104 2HB ASN 104 -5.329 -13.227 1.503 841 HD21 ASN 104 2HD2 ASN 104 -2.734 -12.689 2.938 842 HD22 ASN 104 1HD2 ASN 104 -1.659 -13.903 2.339 843 H ASN 105 H ASN 105 -6.632 -10.697 0.626 844 HA ASN 105 HA ASN 105 -8.876 -12.328 0.105 845 HB2 ASN 105 1HB ASN 105 -8.438 -10.089 1.601 846 HB3 ASN 105 2HB ASN 105 -9.362 -9.424 0.258 847 HD21 ASN 105 2HD2 ASN 105 -11.096 -11.397 -0.344 848 HD22 ASN 105 1HD2 ASN 105 -12.147 -11.707 0.993 849 H LYS 106 H LYS 106 -7.174 -9.969 -1.796 850 HA LYS 106 HA LYS 106 -7.398 -9.252 -3.943 851 HB2 LYS 106 1HB LYS 106 -9.108 -11.728 -4.252 852 HB3 LYS 106 2HB LYS 106 -8.369 -10.809 -5.558 853 HG2 LYS 106 1HG LYS 106 -6.139 -11.344 -4.443 854 HG3 LYS 106 2HG LYS 106 -7.037 -12.538 -3.502 855 HD2 LYS 106 1HD LYS 106 -7.910 -13.258 -5.882 856 HD3 LYS 106 2HD LYS 106 -6.417 -12.482 -6.417 857 HE2 LYS 106 1HE LYS 106 -5.435 -13.953 -4.414 858 HE3 LYS 106 2HE LYS 106 -6.823 -14.956 -4.836 859 HZ1 LYS 106 3HZ LYS 106 -5.194 -15.784 -6.202 860 HZ2 LYS 106 1HZ LYS 106 -4.463 -14.279 -6.454 861 HZ3 LYS 106 2HZ LYS 106 -5.919 -14.653 -7.229 862 H SER 107 H SER 107 -9.250 -8.951 -5.753 863 HA SER 107 HA SER 107 -11.505 -7.699 -4.330 864 HB2 SER 107 1HB SER 107 -9.713 -6.729 -6.395 865 HB3 SER 107 2HB SER 107 -11.397 -6.604 -6.902 866 HG SER 107 HG SER 107 -11.807 -5.239 -5.281 867 H SER 108 H SER 108 -13.184 -9.058 -4.430 868 HA SER 108 HA SER 108 -13.907 -10.144 -7.072 869 HB2 SER 108 1HB SER 108 -14.882 -11.596 -4.686 870 HB3 SER 108 2HB SER 108 -14.293 -12.221 -6.226 871 HG SER 108 HG SER 108 -12.349 -12.364 -5.420 872 H VAL 109 H VAL 109 -15.041 -8.901 -3.977 873 HA VAL 109 HA VAL 109 -17.702 -8.484 -5.169 874 HB VAL 109 HB VAL 109 -17.033 -8.508 -2.226 875 HG11 VAL 109 1HG1 VAL 109 -19.735 -8.881 -3.472 876 HG12 VAL 109 2HG1 VAL 109 -19.328 -8.407 -1.821 877 HG13 VAL 109 3HG1 VAL 109 -19.090 -7.272 -3.150 878 HG21 VAL 109 3HG2 VAL 109 -18.529 -10.734 -2.631 879 HG22 VAL 109 1HG2 VAL 109 -17.564 -10.701 -4.107 880 HG23 VAL 109 2HG2 VAL 109 -16.768 -10.722 -2.533 Start of MODEL 8 1 H1 GLY 1 H GLY 1 12.937 -19.505 -1.798 2 HA2 GLY 1 1HA GLY 1 13.896 -17.766 -2.960 3 HA3 GLY 1 2HA GLY 1 14.033 -18.843 -4.341 4 HA PRO 2 HA PRO 2 10.768 -16.819 -6.443 5 HB2 PRO 2 1HB PRO 2 9.252 -18.842 -7.430 6 HB3 PRO 2 2HB PRO 2 10.859 -18.454 -8.054 7 HG2 PRO 2 1HG PRO 2 10.042 -20.589 -6.120 8 HG3 PRO 2 2HG PRO 2 11.174 -20.686 -7.481 9 HD2 PRO 2 1HD PRO 2 11.999 -20.418 -4.915 10 HD3 PRO 2 2HD PRO 2 12.893 -19.723 -6.283 11 H GLY 3 H GLY 3 9.345 -15.666 -5.275 12 HA2 GLY 3 1HA GLY 3 6.794 -16.054 -4.828 13 HA3 GLY 3 2HA GLY 3 7.439 -17.065 -3.544 14 H SER 4 H SER 4 7.506 -13.758 -4.822 15 HA SER 4 HA SER 4 7.728 -12.798 -2.048 16 HB2 SER 4 1HB SER 4 8.916 -10.780 -3.425 17 HB3 SER 4 2HB SER 4 9.801 -12.097 -2.655 18 HG SER 4 HG SER 4 9.837 -11.473 -5.179 19 H MET 5 H MET 5 6.454 -11.083 -1.495 20 HA MET 5 HA MET 5 4.430 -10.313 -3.462 21 HB2 MET 5 1HB MET 5 3.997 -11.174 -1.014 22 HB3 MET 5 2HB MET 5 4.317 -9.499 -0.585 23 HG2 MET 5 1HG MET 5 2.538 -8.802 -2.150 24 HG3 MET 5 2HG MET 5 2.180 -10.501 -2.450 25 HE1 MET 5 3HE MET 5 2.607 -8.139 0.953 26 HE2 MET 5 1HE MET 5 1.808 -7.468 -0.469 27 HE3 MET 5 2HE MET 5 0.862 -7.879 0.962 28 H ASN 6 H ASN 6 4.072 -8.228 -4.095 29 HA ASN 6 HA ASN 6 6.048 -6.239 -3.188 30 HB2 ASN 6 1HB ASN 6 4.628 -6.185 -5.848 31 HB3 ASN 6 2HB ASN 6 6.060 -5.283 -5.362 32 HD21 ASN 6 2HD2 ASN 6 4.907 -8.007 -6.924 33 HD22 ASN 6 1HD2 ASN 6 6.396 -8.871 -7.071 34 H ILE 7 H ILE 7 5.239 -4.619 -2.046 35 HA ILE 7 HA ILE 7 2.378 -3.996 -2.303 36 HB ILE 7 HB ILE 7 4.283 -3.326 -0.057 37 HG12 ILE 7 1HG1 ILE 7 2.220 -4.925 0.905 38 HG13 ILE 7 2HG1 ILE 7 2.628 -5.649 -0.647 39 HG21 ILE 7 1HG2 ILE 7 1.356 -2.766 -0.452 40 HG22 ILE 7 2HG2 ILE 7 2.134 -2.726 1.129 41 HG23 ILE 7 3HG2 ILE 7 2.655 -1.614 -0.138 42 HD11 ILE 7 3HD1 ILE 7 4.589 -6.425 0.097 43 HD12 ILE 7 1HD1 ILE 7 4.931 -4.970 1.031 44 HD13 ILE 7 2HD1 ILE 7 3.863 -6.210 1.689 45 H LEU 8 H LEU 8 1.681 -1.970 -2.798 46 HA LEU 8 HA LEU 8 3.756 0.034 -3.400 47 HB2 LEU 8 1HB LEU 8 2.427 -1.063 -5.319 48 HB3 LEU 8 2HB LEU 8 1.085 -0.068 -4.758 49 HG LEU 8 HG LEU 8 2.313 0.894 -6.687 50 HD11 LEU 8 1HD1 LEU 8 2.842 2.766 -4.453 51 HD12 LEU 8 2HD1 LEU 8 1.193 2.172 -4.641 52 HD13 LEU 8 3HD1 LEU 8 1.980 3.021 -5.971 53 HD21 LEU 8 3HD2 LEU 8 4.527 1.056 -6.731 54 HD22 LEU 8 1HD2 LEU 8 4.567 0.143 -5.222 55 HD23 LEU 8 2HD2 LEU 8 4.553 1.906 -5.185 56 H LEU 9 H LEU 9 3.558 2.000 -2.508 57 HA LEU 9 HA LEU 9 1.038 2.629 -1.115 58 HB2 LEU 9 1HB LEU 9 3.145 2.058 0.270 59 HB3 LEU 9 2HB LEU 9 3.706 3.655 -0.222 60 HG LEU 9 HG LEU 9 1.020 3.677 0.923 61 HD11 LEU 9 1HD1 LEU 9 3.280 3.032 2.793 62 HD12 LEU 9 2HD1 LEU 9 2.168 1.806 2.185 63 HD13 LEU 9 3HD1 LEU 9 1.558 3.148 3.152 64 HD21 LEU 9 3HD2 LEU 9 3.595 5.177 1.259 65 HD22 LEU 9 1HD2 LEU 9 2.231 5.435 2.348 66 HD23 LEU 9 2HD2 LEU 9 2.052 5.747 0.621 67 H VAL 10 H VAL 10 0.164 4.605 -1.438 68 HA VAL 10 HA VAL 10 1.627 6.430 -3.230 69 HB VAL 10 HB VAL 10 -1.364 6.286 -2.852 70 HG11 VAL 10 1HG1 VAL 10 0.468 7.868 -4.603 71 HG12 VAL 10 2HG1 VAL 10 -1.158 7.470 -5.164 72 HG13 VAL 10 3HG1 VAL 10 -0.938 8.397 -3.680 73 HG21 VAL 10 3HG2 VAL 10 0.293 5.141 -5.099 74 HG22 VAL 10 1HG2 VAL 10 -0.483 4.201 -3.823 75 HG23 VAL 10 2HG2 VAL 10 -1.466 5.110 -4.971 76 H CYS 11 H CYS 11 2.138 8.391 -2.503 77 HA CYS 11 HA CYS 11 0.559 9.971 -0.810 78 HB2 CYS 11 1HB CYS 11 1.112 8.432 0.959 79 HB3 CYS 11 2HB CYS 11 2.822 8.501 0.549 80 HG CYS 11 HG CYS 11 3.073 10.044 2.631 81 H GLY 12 H GLY 12 4.079 9.390 -0.830 82 HA2 GLY 12 1HA GLY 12 5.163 10.962 -2.611 83 HA3 GLY 12 2HA GLY 12 4.457 12.200 -1.583 84 H ALA 13 H ALA 13 5.437 12.740 0.322 85 HA ALA 13 HA ALA 13 7.181 13.040 1.758 86 HB1 ALA 13 3HB ALA 13 8.002 10.240 1.848 87 HB2 ALA 13 1HB ALA 13 7.413 11.294 3.134 88 HB3 ALA 13 2HB ALA 13 6.268 10.477 2.069 89 H GLY 14 H GLY 14 7.796 13.277 -1.033 90 HA2 GLY 14 1HA GLY 14 9.911 13.942 -1.909 91 HA3 GLY 14 2HA GLY 14 10.680 12.746 -0.874 92 H MET 15 H MET 15 11.183 10.808 -1.709 93 HA MET 15 HA MET 15 9.848 9.900 -4.141 94 HB2 MET 15 1HB MET 15 12.346 11.156 -4.227 95 HB3 MET 15 2HB MET 15 12.699 9.438 -4.353 96 HG2 MET 15 1HG MET 15 11.897 9.307 -6.427 97 HG3 MET 15 2HG MET 15 10.486 10.292 -6.045 98 HE1 MET 15 3HE MET 15 10.596 13.141 -6.176 99 HE2 MET 15 1HE MET 15 11.082 13.395 -7.853 100 HE3 MET 15 2HE MET 15 10.033 12.040 -7.435 101 H SER 16 H SER 16 12.318 9.194 -1.690 102 HA SER 16 HA SER 16 11.168 6.550 -1.319 103 HB2 SER 16 1HB SER 16 14.134 6.789 -1.828 104 HB3 SER 16 2HB SER 16 13.163 5.320 -1.718 105 HG SER 16 HG SER 16 13.767 6.130 -3.899 106 H THR 17 H THR 17 12.425 5.382 0.499 107 HA THR 17 HA THR 17 13.026 5.326 2.693 108 HB THR 17 HB THR 17 14.365 7.975 2.117 109 HG1 THR 17 HG1 THR 17 16.166 6.731 1.613 110 HG21 THR 17 3HG2 THR 17 15.788 6.461 4.014 111 HG22 THR 17 1HG2 THR 17 14.096 6.413 4.511 112 HG23 THR 17 2HG2 THR 17 14.904 7.963 4.280 113 H SER 18 H SER 18 10.741 5.597 3.182 114 HA SER 18 HA SER 18 10.148 8.224 4.383 115 HB2 SER 18 1HB SER 18 8.274 6.194 3.149 116 HB3 SER 18 2HB SER 18 7.730 7.592 4.076 117 HG SER 18 HG SER 18 9.304 7.670 1.713 118 H MET 19 H MET 19 8.611 8.109 6.246 119 HA MET 19 HA MET 19 9.646 6.554 8.306 120 HB2 MET 19 1HB MET 19 7.023 8.008 8.019 121 HB3 MET 19 2HB MET 19 7.470 7.172 9.500 122 HG2 MET 19 1HG MET 19 8.371 9.109 10.113 123 HG3 MET 19 2HG MET 19 9.683 8.690 9.013 124 HE1 MET 19 3HE MET 19 10.624 10.191 7.865 125 HE2 MET 19 1HE MET 19 9.809 10.125 6.302 126 HE3 MET 19 2HE MET 19 10.002 11.670 7.131 127 H LEU 20 H LEU 20 6.485 6.159 6.693 128 HA LEU 20 HA LEU 20 5.691 3.817 7.915 129 HB2 LEU 20 1HB LEU 20 5.115 5.120 5.319 130 HB3 LEU 20 2HB LEU 20 4.646 3.429 5.487 131 HG LEU 20 HG LEU 20 3.738 5.670 7.293 132 HD11 LEU 20 1HD1 LEU 20 2.673 4.554 4.776 133 HD12 LEU 20 2HD1 LEU 20 2.488 6.161 5.478 134 HD13 LEU 20 3HD1 LEU 20 1.510 4.821 6.075 135 HD21 LEU 20 3HD2 LEU 20 3.665 3.709 8.564 136 HD22 LEU 20 1HD2 LEU 20 3.165 2.726 7.188 137 HD23 LEU 20 2HD2 LEU 20 2.032 3.865 7.915 138 H VAL 21 H VAL 21 7.503 4.140 4.864 139 HA VAL 21 HA VAL 21 7.829 1.419 4.341 140 HB VAL 21 HB VAL 21 9.715 3.677 3.652 141 HG11 VAL 21 1HG1 VAL 21 9.953 1.848 1.659 142 HG12 VAL 21 2HG1 VAL 21 11.050 1.978 3.036 143 HG13 VAL 21 3HG1 VAL 21 9.736 0.803 3.062 144 HG21 VAL 21 3HG2 VAL 21 8.548 3.775 1.533 145 HG22 VAL 21 1HG2 VAL 21 7.494 2.449 2.023 146 HG23 VAL 21 2HG2 VAL 21 7.401 4.003 2.853 147 H GLN 22 H GLN 22 9.759 3.624 6.310 148 HA GLN 22 HA GLN 22 11.936 1.930 6.796 149 HB2 GLN 22 1HB GLN 22 10.861 4.404 7.922 150 HB3 GLN 22 2HB GLN 22 11.688 3.408 9.113 151 HG2 GLN 22 1HG GLN 22 13.437 3.333 7.033 152 HG3 GLN 22 2HG GLN 22 12.762 4.953 6.875 153 HE21 GLN 22 2HE2 GLN 22 15.296 3.423 8.053 154 HE22 GLN 22 1HE2 GLN 22 15.651 4.380 9.447 155 H ARG 23 H ARG 23 9.184 2.611 8.966 156 HA ARG 23 HA ARG 23 9.733 0.696 10.884 157 HB2 ARG 23 1HB ARG 23 7.061 1.736 9.930 158 HB3 ARG 23 2HB ARG 23 7.276 0.764 11.379 159 HG2 ARG 23 1HG ARG 23 8.977 2.613 12.046 160 HG3 ARG 23 2HG ARG 23 8.112 3.576 10.846 161 HD2 ARG 23 1HD ARG 23 6.419 3.914 12.250 162 HD3 ARG 23 2HD ARG 23 6.259 2.184 12.551 163 HE ARG 23 HE ARG 23 7.309 2.499 14.547 164 HH11 ARG 23 1HH1 ARG 23 8.101 5.162 12.449 165 HH12 ARG 23 2HH1 ARG 23 8.977 6.031 13.666 166 HH21 ARG 23 1HH2 ARG 23 8.458 3.634 16.158 167 HH22 ARG 23 2HH2 ARG 23 9.180 5.160 15.775 168 H ILE 24 H ILE 24 7.512 0.361 8.113 169 HA ILE 24 HA ILE 24 6.823 -2.299 8.483 170 HB ILE 24 HB ILE 24 7.163 -0.856 5.851 171 HG12 ILE 24 1HG1 ILE 24 4.594 -1.284 7.365 172 HG13 ILE 24 2HG1 ILE 24 5.606 0.127 7.652 173 HG21 ILE 24 1HG2 ILE 24 6.803 -2.894 4.996 174 HG22 ILE 24 2HG2 ILE 24 6.277 -3.552 6.544 175 HG23 ILE 24 3HG2 ILE 24 5.138 -2.665 5.531 176 HD11 ILE 24 3HD1 ILE 24 4.015 0.852 6.123 177 HD12 ILE 24 1HD1 ILE 24 5.436 0.523 5.133 178 HD13 ILE 24 2HD1 ILE 24 4.106 -0.634 5.178 179 H GLU 25 H GLU 25 9.497 -0.958 6.557 180 HA GLU 25 HA GLU 25 10.515 -3.352 5.569 181 HB2 GLU 25 1HB GLU 25 11.715 -0.671 6.142 182 HB3 GLU 25 2HB GLU 25 12.764 -2.001 5.675 183 HG2 GLU 25 1HG GLU 25 10.363 -1.380 4.023 184 HG3 GLU 25 2HG GLU 25 11.805 -0.375 3.882 185 H LYS 26 H LYS 26 11.087 -1.737 8.651 186 HA LYS 26 HA LYS 26 13.172 -3.417 9.545 187 HB2 LYS 26 1HB LYS 26 11.329 -1.447 10.783 188 HB3 LYS 26 2HB LYS 26 12.081 -2.610 11.866 189 HG2 LYS 26 1HG LYS 26 14.279 -1.906 11.164 190 HG3 LYS 26 2HG LYS 26 13.577 -0.815 9.966 191 HD2 LYS 26 1HD LYS 26 12.430 -0.269 12.528 192 HD3 LYS 26 2HD LYS 26 14.189 -0.275 12.669 193 HE2 LYS 26 1HE LYS 26 14.432 1.560 11.363 194 HE3 LYS 26 2HE LYS 26 13.068 1.137 10.330 195 HZ1 LYS 26 3HZ LYS 26 11.669 2.344 11.562 196 HZ2 LYS 26 1HZ LYS 26 13.054 3.099 12.171 197 HZ3 LYS 26 2HZ LYS 26 12.335 1.832 13.031 198 H TYR 27 H TYR 27 9.719 -3.399 10.449 199 HA TYR 27 HA TYR 27 9.694 -5.673 12.011 200 HB2 TYR 27 1HB TYR 27 7.761 -4.236 11.890 201 HB3 TYR 27 2HB TYR 27 7.547 -4.590 10.180 202 HD1 TYR 27 HD2 TYR 27 7.148 -5.880 13.592 203 HD2 TYR 27 HD1 TYR 27 6.531 -6.660 9.455 204 HE1 TYR 27 HE2 TYR 27 5.652 -7.743 14.172 205 HE2 TYR 27 HE1 TYR 27 5.032 -8.525 10.025 206 HH TYR 27 HH TYR 27 3.502 -8.987 12.428 207 H ALA 28 H ALA 28 9.159 -5.438 8.504 208 HA ALA 28 HA ALA 28 8.768 -8.197 8.069 209 HB1 ALA 28 3HB ALA 28 8.843 -5.838 6.498 210 HB2 ALA 28 1HB ALA 28 9.919 -7.021 5.752 211 HB3 ALA 28 2HB ALA 28 8.230 -7.433 6.058 212 H LYS 29 H LYS 29 11.657 -6.155 7.656 213 HA LYS 29 HA LYS 29 13.404 -8.158 6.802 214 HB2 LYS 29 1HB LYS 29 13.843 -5.691 6.754 215 HB3 LYS 29 2HB LYS 29 14.127 -5.755 8.488 216 HG2 LYS 29 1HG LYS 29 15.687 -7.651 6.859 217 HG3 LYS 29 2HG LYS 29 16.069 -5.941 6.646 218 HD2 LYS 29 1HD LYS 29 16.972 -5.759 8.704 219 HD3 LYS 29 2HD LYS 29 15.760 -6.811 9.439 220 HE2 LYS 29 1HE LYS 29 17.248 -8.458 9.481 221 HE3 LYS 29 2HE LYS 29 17.322 -8.416 7.720 222 HZ1 LYS 29 3HZ LYS 29 19.081 -7.066 9.668 223 HZ2 LYS 29 1HZ LYS 29 18.963 -6.510 8.074 224 HZ3 LYS 29 2HZ LYS 29 19.504 -8.083 8.384 225 H SER 30 H SER 30 12.227 -7.365 9.977 226 HA SER 30 HA SER 30 14.212 -8.965 11.341 227 HB2 SER 30 1HB SER 30 13.067 -6.871 12.282 228 HB3 SER 30 2HB SER 30 11.661 -7.901 12.549 229 HG SER 30 HG SER 30 13.572 -7.603 14.204 230 H LYS 31 H LYS 31 10.783 -9.210 10.511 231 HA LYS 31 HA LYS 31 10.404 -11.735 11.787 232 HB2 LYS 31 1HB LYS 31 8.796 -10.168 9.779 233 HB3 LYS 31 2HB LYS 31 8.295 -11.759 10.334 234 HG2 LYS 31 1HG LYS 31 8.899 -9.593 12.303 235 HG3 LYS 31 2HG LYS 31 7.337 -9.658 11.483 236 HD2 LYS 31 1HD LYS 31 6.655 -11.455 12.660 237 HD3 LYS 31 2HD LYS 31 8.249 -12.212 12.614 238 HE2 LYS 31 1HE LYS 31 8.997 -10.584 14.343 239 HE3 LYS 31 2HE LYS 31 7.336 -10.003 14.451 240 HZ1 LYS 31 3HZ LYS 31 8.487 -12.521 15.383 241 HZ2 LYS 31 1HZ LYS 31 6.892 -12.554 14.822 242 HZ3 LYS 31 2HZ LYS 31 7.316 -11.536 16.104 243 H ASN 32 H ASN 32 11.833 -10.771 8.857 244 HA ASN 32 HA ASN 32 12.755 -11.925 7.128 245 HB2 ASN 32 1HB ASN 32 13.360 -13.438 9.190 246 HB3 ASN 32 2HB ASN 32 12.183 -14.538 8.479 247 HD21 ASN 32 2HD2 ASN 32 12.780 -15.788 6.829 248 HD22 ASN 32 1HD2 ASN 32 14.306 -15.700 6.020 249 H ILE 33 H ILE 33 10.431 -11.144 6.405 250 HA ILE 33 HA ILE 33 8.953 -13.492 5.414 251 HB ILE 33 HB ILE 33 7.958 -10.663 5.782 252 HG12 ILE 33 1HG1 ILE 33 7.002 -13.116 7.243 253 HG13 ILE 33 2HG1 ILE 33 8.362 -12.170 7.839 254 HG21 ILE 33 1HG2 ILE 33 5.763 -11.572 5.194 255 HG22 ILE 33 2HG2 ILE 33 6.915 -11.758 3.873 256 HG23 ILE 33 3HG2 ILE 33 6.499 -13.143 4.880 257 HD11 ILE 33 3HD1 ILE 33 6.570 -11.306 9.004 258 HD12 ILE 33 1HD1 ILE 33 6.742 -10.171 7.666 259 HD13 ILE 33 2HD1 ILE 33 5.485 -11.408 7.618 260 H ASN 34 H ASN 34 8.446 -13.653 3.253 261 HA ASN 34 HA ASN 34 10.164 -12.221 1.447 262 HB2 ASN 34 1HB ASN 34 7.943 -14.088 0.634 263 HB3 ASN 34 2HB ASN 34 9.450 -13.745 -0.212 264 HD21 ASN 34 2HD2 ASN 34 11.386 -14.111 1.506 265 HD22 ASN 34 1HD2 ASN 34 11.377 -15.706 2.173 266 H ALA 35 H ALA 35 9.357 -10.070 1.759 267 HA ALA 35 HA ALA 35 7.192 -9.453 -0.072 268 HB1 ALA 35 3HB ALA 35 5.977 -9.742 2.002 269 HB2 ALA 35 1HB ALA 35 7.069 -8.628 2.826 270 HB3 ALA 35 2HB ALA 35 6.000 -8.037 1.552 271 H THR 36 H THR 36 6.983 -7.057 -0.385 272 HA THR 36 HA THR 36 9.372 -5.536 0.325 273 HB THR 36 HB THR 36 8.955 -4.869 -2.361 274 HG1 THR 36 HG1 THR 36 9.290 -6.991 -3.331 275 HG21 THR 36 3HG2 THR 36 11.196 -5.193 -2.501 276 HG22 THR 36 1HG2 THR 36 11.125 -6.776 -1.725 277 HG23 THR 36 2HG2 THR 36 11.060 -5.310 -0.746 278 H ILE 37 H ILE 37 9.104 -3.294 0.246 279 HA ILE 37 HA ILE 37 6.402 -2.328 -0.399 280 HB ILE 37 HB ILE 37 6.554 -2.597 2.035 281 HG12 ILE 37 1HG1 ILE 37 6.692 0.337 1.848 282 HG13 ILE 37 2HG1 ILE 37 5.637 -0.416 0.657 283 HG21 ILE 37 1HG2 ILE 37 8.767 -0.555 1.951 284 HG22 ILE 37 2HG2 ILE 37 8.125 -1.384 3.369 285 HG23 ILE 37 3HG2 ILE 37 9.028 -2.288 2.152 286 HD11 ILE 37 3HD1 ILE 37 4.633 0.318 2.892 287 HD12 ILE 37 1HD1 ILE 37 4.226 -1.286 2.283 288 HD13 ILE 37 2HD1 ILE 37 5.430 -1.106 3.559 289 H GLU 38 H GLU 38 6.264 -0.230 -1.179 290 HA GLU 38 HA GLU 38 8.599 1.457 -1.308 291 HB2 GLU 38 1HB GLU 38 8.715 -0.287 -3.228 292 HB3 GLU 38 2HB GLU 38 7.421 0.657 -3.953 293 HG2 GLU 38 1HG GLU 38 8.823 2.234 -4.638 294 HG3 GLU 38 2HG GLU 38 9.615 2.325 -3.066 295 H ALA 39 H ALA 39 8.084 3.578 -1.607 296 HA ALA 39 HA ALA 39 5.234 4.182 -2.053 297 HB1 ALA 39 3HB ALA 39 5.578 6.185 -0.656 298 HB2 ALA 39 1HB ALA 39 5.879 4.685 0.220 299 HB3 ALA 39 2HB ALA 39 7.234 5.661 -0.350 300 H ILE 40 H ILE 40 4.689 5.656 -3.571 301 HA ILE 40 HA ILE 40 6.685 7.441 -4.689 302 HB ILE 40 HB ILE 40 6.148 6.714 -7.033 303 HG12 ILE 40 1HG1 ILE 40 5.537 3.982 -6.397 304 HG13 ILE 40 2HG1 ILE 40 4.326 5.031 -5.669 305 HG21 ILE 40 1HG2 ILE 40 7.455 4.450 -5.586 306 HG22 ILE 40 2HG2 ILE 40 7.911 5.221 -7.105 307 HG23 ILE 40 3HG2 ILE 40 8.191 6.053 -5.575 308 HD11 ILE 40 3HD1 ILE 40 4.659 4.246 -8.408 309 HD12 ILE 40 1HD1 ILE 40 3.315 5.085 -7.634 310 HD13 ILE 40 2HD1 ILE 40 4.688 6.003 -8.257 311 H ALA 41 H ALA 41 5.523 8.538 -6.752 312 HA ALA 41 HA ALA 41 3.145 9.763 -5.642 313 HB1 ALA 41 3HB ALA 41 4.890 10.368 -8.005 314 HB2 ALA 41 1HB ALA 41 3.348 11.189 -7.758 315 HB3 ALA 41 2HB ALA 41 4.626 11.327 -6.549 316 H GLU 42 H GLU 42 1.553 10.441 -7.632 317 HA GLU 42 HA GLU 42 0.310 7.940 -8.363 318 HB2 GLU 42 1HB GLU 42 -1.535 9.308 -9.157 319 HB3 GLU 42 2HB GLU 42 -1.032 9.845 -7.561 320 HG2 GLU 42 1HG GLU 42 -1.011 11.891 -8.417 321 HG3 GLU 42 2HG GLU 42 0.477 11.414 -9.232 322 H THR 43 H THR 43 2.272 10.353 -9.878 323 HA THR 43 HA THR 43 1.601 9.978 -12.565 324 HB THR 43 HB THR 43 3.037 11.815 -11.858 325 HG1 THR 43 HG1 THR 43 3.893 11.754 -13.788 326 HG21 THR 43 3HG2 THR 43 4.335 10.009 -10.305 327 HG22 THR 43 1HG2 THR 43 4.980 11.595 -10.729 328 HG23 THR 43 2HG2 THR 43 5.470 10.170 -11.646 329 H ARG 44 H ARG 44 3.739 8.157 -10.444 330 HA ARG 44 HA ARG 44 4.242 6.265 -12.644 331 HB2 ARG 44 1HB ARG 44 5.840 6.832 -10.144 332 HB3 ARG 44 2HB ARG 44 6.179 5.500 -11.241 333 HG2 ARG 44 1HG ARG 44 6.825 6.940 -12.971 334 HG3 ARG 44 2HG ARG 44 6.092 8.342 -12.190 335 HD2 ARG 44 1HD ARG 44 7.769 7.979 -10.315 336 HD3 ARG 44 2HD ARG 44 8.587 6.859 -11.403 337 HE ARG 44 HE ARG 44 8.118 9.429 -12.582 338 HH11 ARG 44 1HH1 ARG 44 10.249 7.590 -10.535 339 HH12 ARG 44 2HH1 ARG 44 11.631 8.582 -10.861 340 HH21 ARG 44 1HH2 ARG 44 9.930 10.744 -13.019 341 HH22 ARG 44 2HH2 ARG 44 11.447 10.377 -12.273 342 H LEU 45 H LEU 45 1.978 6.535 -10.583 343 HA LEU 45 HA LEU 45 2.206 4.139 -9.001 344 HB2 LEU 45 1HB LEU 45 0.960 5.829 -7.982 345 HB3 LEU 45 2HB LEU 45 0.057 6.177 -9.454 346 HG LEU 45 HG LEU 45 -1.193 4.094 -9.186 347 HD11 LEU 45 1HD1 LEU 45 0.659 2.883 -8.009 348 HD12 LEU 45 2HD1 LEU 45 -0.941 2.669 -7.302 349 HD13 LEU 45 3HD1 LEU 45 0.216 3.765 -6.547 350 HD21 LEU 45 3HD2 LEU 45 -2.235 4.718 -6.887 351 HD22 LEU 45 1HD2 LEU 45 -2.346 5.852 -8.232 352 HD23 LEU 45 2HD2 LEU 45 -1.140 6.099 -6.969 353 H SER 46 H SER 46 0.171 5.177 -11.733 354 HA SER 46 HA SER 46 -0.992 2.590 -12.084 355 HB2 SER 46 1HB SER 46 -1.783 3.613 -14.287 356 HB3 SER 46 2HB SER 46 -2.308 4.427 -12.813 357 HG SER 46 HG SER 46 -1.094 6.106 -13.291 358 H GLU 47 H GLU 47 1.983 3.957 -12.946 359 HA GLU 47 HA GLU 47 2.384 2.299 -15.294 360 HB2 GLU 47 1HB GLU 47 3.375 4.721 -14.619 361 HB3 GLU 47 2HB GLU 47 4.686 3.690 -14.063 362 HG2 GLU 47 1HG GLU 47 3.868 2.852 -16.666 363 HG3 GLU 47 2HG GLU 47 4.167 4.589 -16.674 364 H VAL 48 H VAL 48 3.015 2.208 -11.900 365 HA VAL 48 HA VAL 48 4.828 -0.080 -12.227 366 HB VAL 48 HB VAL 48 5.452 0.218 -9.909 367 HG11 VAL 48 1HG1 VAL 48 6.307 2.618 -10.044 368 HG12 VAL 48 2HG1 VAL 48 6.777 1.520 -11.344 369 HG13 VAL 48 3HG1 VAL 48 5.489 2.696 -11.604 370 HG21 VAL 48 3HG2 VAL 48 4.540 2.272 -8.700 371 HG22 VAL 48 1HG2 VAL 48 3.251 2.263 -9.904 372 HG23 VAL 48 2HG2 VAL 48 3.468 0.878 -8.835 373 H VAL 49 H VAL 49 1.675 0.840 -11.137 374 HA VAL 49 HA VAL 49 0.998 -1.176 -9.379 375 HB VAL 49 HB VAL 49 -0.466 0.745 -10.012 376 HG11 VAL 49 1HG1 VAL 49 -1.354 -0.931 -12.342 377 HG12 VAL 49 2HG1 VAL 49 -1.760 0.746 -11.974 378 HG13 VAL 49 3HG1 VAL 49 -0.129 0.327 -12.503 379 HG21 VAL 49 3HG2 VAL 49 -1.365 -1.058 -8.683 380 HG22 VAL 49 1HG2 VAL 49 -2.585 -0.522 -9.838 381 HG23 VAL 49 2HG2 VAL 49 -1.688 -2.011 -10.132 382 H ASP 50 H ASP 50 1.394 -1.319 -12.842 383 HA ASP 50 HA ASP 50 0.049 -3.740 -13.339 384 HB2 ASP 50 1HB ASP 50 0.934 -2.032 -15.032 385 HB3 ASP 50 2HB ASP 50 2.497 -2.823 -14.840 386 H ARG 51 H ARG 51 3.292 -3.036 -12.199 387 HA ARG 51 HA ARG 51 4.106 -5.814 -12.357 388 HB2 ARG 51 1HB ARG 51 5.564 -3.498 -11.078 389 HB3 ARG 51 2HB ARG 51 6.243 -5.055 -11.531 390 HG2 ARG 51 1HG ARG 51 5.167 -4.109 -13.889 391 HG3 ARG 51 2HG ARG 51 5.840 -2.669 -13.123 392 HD2 ARG 51 1HD ARG 51 7.918 -4.171 -12.717 393 HD3 ARG 51 2HD ARG 51 7.222 -5.179 -13.986 394 HE ARG 51 HE ARG 51 7.411 -2.416 -14.724 395 HH11 ARG 51 1HH1 ARG 51 9.147 -5.427 -14.521 396 HH12 ARG 51 2HH1 ARG 51 10.278 -5.009 -15.765 397 HH21 ARG 51 1HH2 ARG 51 8.894 -1.854 -16.363 398 HH22 ARG 51 2HH2 ARG 51 10.134 -2.976 -16.812 399 H PHE 52 H PHE 52 3.398 -3.421 -9.837 400 HA PHE 52 HA PHE 52 3.915 -5.100 -7.636 401 HB2 PHE 52 1HB PHE 52 2.342 -2.575 -8.018 402 HB3 PHE 52 2HB PHE 52 2.258 -3.438 -6.485 403 HD1 PHE 52 HD2 PHE 52 4.199 -3.593 -5.035 404 HD2 PHE 52 HD1 PHE 52 4.351 -1.446 -8.708 405 HE1 PHE 52 HE2 PHE 52 6.283 -2.507 -4.309 406 HE2 PHE 52 HE1 PHE 52 6.437 -0.357 -7.988 407 HZ PHE 52 HZ PHE 52 7.404 -0.886 -5.786 408 H ASP 53 H ASP 53 1.916 -5.365 -5.991 409 HA ASP 53 HA ASP 53 -0.131 -6.884 -7.469 410 HB2 ASP 53 1HB ASP 53 1.225 -7.450 -4.839 411 HB3 ASP 53 2HB ASP 53 -0.298 -8.216 -5.282 412 H VAL 54 H VAL 54 0.322 -5.470 -4.222 413 HA VAL 54 HA VAL 54 -2.472 -4.547 -4.335 414 HB VAL 54 HB VAL 54 -0.769 -4.861 -1.864 415 HG11 VAL 54 1HG1 VAL 54 -3.575 -4.056 -2.408 416 HG12 VAL 54 2HG1 VAL 54 -3.255 -5.015 -0.962 417 HG13 VAL 54 3HG1 VAL 54 -2.442 -3.466 -1.192 418 HG21 VAL 54 3HG2 VAL 54 -1.038 -7.063 -2.074 419 HG22 VAL 54 1HG2 VAL 54 -2.767 -6.802 -1.838 420 HG23 VAL 54 2HG2 VAL 54 -2.098 -6.862 -3.469 421 H VAL 55 H VAL 55 -2.993 -2.446 -3.630 422 HA VAL 55 HA VAL 55 -0.718 -0.582 -3.458 423 HB VAL 55 HB VAL 55 -3.326 0.041 -4.843 424 HG11 VAL 55 1HG1 VAL 55 -1.991 1.943 -5.753 425 HG12 VAL 55 2HG1 VAL 55 -2.251 2.010 -4.009 426 HG13 VAL 55 3HG1 VAL 55 -0.691 1.492 -4.651 427 HG21 VAL 55 3HG2 VAL 55 -2.445 -1.477 -6.329 428 HG22 VAL 55 1HG2 VAL 55 -1.688 0.014 -6.890 429 HG23 VAL 55 2HG2 VAL 55 -0.778 -1.113 -5.882 430 H LEU 56 H LEU 56 -1.049 1.305 -2.211 431 HA LEU 56 HA LEU 56 -3.446 1.305 -0.510 432 HB2 LEU 56 1HB LEU 56 -0.586 1.207 0.297 433 HB3 LEU 56 2HB LEU 56 -1.695 2.165 1.276 434 HG LEU 56 HG LEU 56 -2.823 -0.429 0.818 435 HD11 LEU 56 1HD1 LEU 56 0.066 -0.357 1.359 436 HD12 LEU 56 2HD1 LEU 56 -0.936 -1.644 0.690 437 HD13 LEU 56 3HD1 LEU 56 -0.883 -1.385 2.433 438 HD21 LEU 56 3HD2 LEU 56 -3.367 1.133 2.645 439 HD22 LEU 56 1HD2 LEU 56 -1.761 0.871 3.325 440 HD23 LEU 56 2HD2 LEU 56 -2.908 -0.465 3.237 441 H LEU 57 H LEU 57 -4.385 3.239 -0.324 442 HA LEU 57 HA LEU 57 -3.011 5.553 -1.469 443 HB2 LEU 57 1HB LEU 57 -5.508 4.630 -1.886 444 HB3 LEU 57 2HB LEU 57 -5.818 5.782 -0.589 445 HG LEU 57 HG LEU 57 -4.442 6.479 -3.180 446 HD11 LEU 57 1HD1 LEU 57 -7.302 6.330 -2.436 447 HD12 LEU 57 2HD1 LEU 57 -6.523 6.132 -4.005 448 HD13 LEU 57 3HD1 LEU 57 -6.781 7.748 -3.346 449 HD21 LEU 57 3HD2 LEU 57 -5.345 8.032 -0.783 450 HD22 LEU 57 1HD2 LEU 57 -5.228 8.801 -2.367 451 HD23 LEU 57 2HD2 LEU 57 -3.796 8.081 -1.628 452 H ALA 58 H ALA 58 -2.485 7.336 -0.323 453 HA ALA 58 HA ALA 58 -2.395 7.151 2.525 454 HB1 ALA 58 3HB ALA 58 -1.339 8.937 0.462 455 HB2 ALA 58 1HB ALA 58 -1.740 9.743 1.980 456 HB3 ALA 58 2HB ALA 58 -0.612 8.387 1.972 457 HA PRO 59 HA PRO 59 -6.046 9.242 3.768 458 HB2 PRO 59 1HB PRO 59 -5.174 10.777 5.830 459 HB3 PRO 59 2HB PRO 59 -5.323 9.019 5.938 460 HG2 PRO 59 1HG PRO 59 -2.888 10.685 5.437 461 HG3 PRO 59 2HG PRO 59 -3.078 9.269 6.486 462 HD2 PRO 59 1HD PRO 59 -1.957 9.119 4.025 463 HD3 PRO 59 2HD PRO 59 -2.895 7.786 4.731 464 H GLN 60 H GLN 60 -3.441 10.964 2.458 465 HA GLN 60 HA GLN 60 -4.772 13.553 2.590 466 HB2 GLN 60 1HB GLN 60 -2.105 12.783 2.519 467 HB3 GLN 60 2HB GLN 60 -2.401 13.415 0.904 468 HG2 GLN 60 1HG GLN 60 -2.372 15.503 1.633 469 HG3 GLN 60 2HG GLN 60 -3.538 15.144 2.904 470 HE21 GLN 60 2HE2 GLN 60 -0.126 15.065 2.070 471 HE22 GLN 60 1HE2 GLN 60 0.464 15.165 3.690 472 H SER 61 H SER 61 -4.109 14.702 0.211 473 HA SER 61 HA SER 61 -4.770 14.954 -1.954 474 HB2 SER 61 1HB SER 61 -4.207 13.244 -3.306 475 HB3 SER 61 2HB SER 61 -3.792 12.363 -1.836 476 HG SER 61 HG SER 61 -5.381 11.075 -2.261 477 H ARG 62 H ARG 62 -6.676 15.782 -2.464 478 HA ARG 62 HA ARG 62 -9.095 14.635 -1.317 479 HB2 ARG 62 1HB ARG 62 -8.524 17.120 -1.254 480 HB3 ARG 62 2HB ARG 62 -8.893 17.146 -2.973 481 HG2 ARG 62 1HG ARG 62 -11.137 16.027 -2.156 482 HG3 ARG 62 2HG ARG 62 -10.706 16.830 -0.645 483 HD2 ARG 62 1HD ARG 62 -11.199 18.857 -1.455 484 HD3 ARG 62 2HD ARG 62 -10.395 18.534 -2.991 485 HE ARG 62 HE ARG 62 -12.869 17.144 -2.791 486 HH11 ARG 62 1HH1 ARG 62 -11.475 20.270 -3.422 487 HH12 ARG 62 2HH1 ARG 62 -12.801 20.811 -4.395 488 HH21 ARG 62 1HH2 ARG 62 -14.622 17.843 -4.072 489 HH22 ARG 62 2HH2 ARG 62 -14.592 19.430 -4.764 490 H PHE 63 H PHE 63 -8.309 16.016 -4.513 491 HA PHE 63 HA PHE 63 -10.397 14.641 -5.835 492 HB2 PHE 63 1HB PHE 63 -9.364 15.439 -7.901 493 HB3 PHE 63 2HB PHE 63 -9.411 16.725 -6.699 494 HD1 PHE 63 HD2 PHE 63 -7.372 17.528 -5.655 495 HD2 PHE 63 HD1 PHE 63 -7.281 14.476 -8.621 496 HE1 PHE 63 HE2 PHE 63 -4.950 17.868 -5.925 497 HE2 PHE 63 HE1 PHE 63 -4.858 14.810 -8.895 498 HZ PHE 63 HZ PHE 63 -3.690 16.508 -7.546 499 H ASN 64 H ASN 64 -6.980 13.946 -5.357 500 HA ASN 64 HA ASN 64 -6.677 11.845 -7.160 501 HB2 ASN 64 1HB ASN 64 -5.171 13.001 -5.039 502 HB3 ASN 64 2HB ASN 64 -5.179 11.256 -4.801 503 HD21 ASN 64 2HD2 ASN 64 -3.380 10.435 -5.571 504 HD22 ASN 64 1HD2 ASN 64 -2.631 10.846 -7.072 505 H LYS 65 H LYS 65 -8.203 11.948 -4.030 506 HA LYS 65 HA LYS 65 -8.284 9.150 -3.562 507 HB2 LYS 65 1HB LYS 65 -8.598 10.603 -1.699 508 HB3 LYS 65 2HB LYS 65 -9.918 11.449 -2.495 509 HG2 LYS 65 1HG LYS 65 -10.697 9.944 -0.725 510 HG3 LYS 65 2HG LYS 65 -11.331 9.500 -2.311 511 HD2 LYS 65 1HD LYS 65 -10.198 7.541 -2.361 512 HD3 LYS 65 2HD LYS 65 -8.793 8.214 -1.531 513 HE2 LYS 65 1HE LYS 65 -10.024 6.480 -0.228 514 HE3 LYS 65 2HE LYS 65 -9.875 8.034 0.592 515 HZ1 LYS 65 3HZ LYS 65 -12.139 6.837 0.575 516 HZ2 LYS 65 1HZ LYS 65 -12.275 7.427 -1.005 517 HZ3 LYS 65 2HZ LYS 65 -12.098 8.503 0.287 518 H LYS 66 H LYS 66 -10.784 11.419 -4.711 519 HA LYS 66 HA LYS 66 -12.752 9.508 -5.244 520 HB2 LYS 66 1HB LYS 66 -13.235 11.900 -5.150 521 HB3 LYS 66 2HB LYS 66 -12.262 12.172 -6.588 522 HG2 LYS 66 1HG LYS 66 -14.360 10.190 -6.982 523 HG3 LYS 66 2HG LYS 66 -14.972 11.783 -6.531 524 HD2 LYS 66 1HD LYS 66 -13.135 12.490 -8.368 525 HD3 LYS 66 2HD LYS 66 -13.593 10.902 -8.989 526 HE2 LYS 66 1HE LYS 66 -15.976 12.227 -8.258 527 HE3 LYS 66 2HE LYS 66 -15.002 13.383 -9.164 528 HZ1 LYS 66 3HZ LYS 66 -16.054 10.771 -10.039 529 HZ2 LYS 66 1HZ LYS 66 -14.714 11.459 -10.811 530 HZ3 LYS 66 2HZ LYS 66 -16.194 12.279 -10.792 531 H ARG 67 H ARG 67 -10.135 10.751 -7.262 532 HA ARG 67 HA ARG 67 -10.921 9.485 -9.660 533 HB2 ARG 67 1HB ARG 67 -8.820 11.162 -8.810 534 HB3 ARG 67 2HB ARG 67 -8.059 9.722 -9.473 535 HG2 ARG 67 1HG ARG 67 -8.610 10.252 -11.571 536 HG3 ARG 67 2HG ARG 67 -10.235 10.768 -11.116 537 HD2 ARG 67 1HD ARG 67 -9.632 12.927 -10.941 538 HD3 ARG 67 2HD ARG 67 -8.087 12.534 -10.186 539 HE ARG 67 HE ARG 67 -7.094 12.634 -12.247 540 HH11 ARG 67 1HH1 ARG 67 -10.547 12.432 -12.649 541 HH12 ARG 67 2HH1 ARG 67 -10.495 12.718 -14.358 542 HH21 ARG 67 1HH2 ARG 67 -7.014 13.012 -14.496 543 HH22 ARG 67 2HH2 ARG 67 -8.485 13.047 -15.407 544 H LEU 68 H LEU 68 -8.252 8.600 -7.459 545 HA LEU 68 HA LEU 68 -7.623 6.153 -8.557 546 HB2 LEU 68 1HB LEU 68 -7.346 7.376 -5.879 547 HB3 LEU 68 2HB LEU 68 -7.152 5.626 -5.971 548 HG LEU 68 HG LEU 68 -5.299 5.858 -7.487 549 HD11 LEU 68 1HD1 LEU 68 -6.320 8.604 -7.726 550 HD12 LEU 68 2HD1 LEU 68 -5.479 7.595 -8.902 551 HD13 LEU 68 3HD1 LEU 68 -4.564 8.451 -7.661 552 HD21 LEU 68 3HD2 LEU 68 -5.084 7.729 -5.132 553 HD22 LEU 68 1HD2 LEU 68 -3.718 7.092 -6.048 554 HD23 LEU 68 2HD2 LEU 68 -4.758 5.996 -5.138 555 H GLU 69 H GLU 69 -10.192 6.950 -6.286 556 HA GLU 69 HA GLU 69 -10.953 4.254 -5.766 557 HB2 GLU 69 1HB GLU 69 -12.120 6.945 -5.225 558 HB3 GLU 69 2HB GLU 69 -13.176 5.545 -5.109 559 HG2 GLU 69 1HG GLU 69 -10.564 5.450 -3.702 560 HG3 GLU 69 2HG GLU 69 -11.843 6.459 -3.030 561 H GLU 70 H GLU 70 -12.302 6.806 -7.846 562 HA GLU 70 HA GLU 70 -14.376 5.230 -8.930 563 HB2 GLU 70 1HB GLU 70 -12.989 7.709 -9.944 564 HB3 GLU 70 2HB GLU 70 -14.354 6.973 -10.770 565 HG2 GLU 70 1HG GLU 70 -14.626 7.643 -7.888 566 HG3 GLU 70 2HG GLU 70 -14.682 8.946 -9.073 567 H ILE 71 H ILE 71 -11.015 5.241 -9.478 568 HA ILE 71 HA ILE 71 -11.257 4.005 -12.115 569 HB ILE 71 HB ILE 71 -8.793 4.774 -10.546 570 HG12 ILE 71 1HG1 ILE 71 -9.665 6.069 -13.099 571 HG13 ILE 71 2HG1 ILE 71 -10.442 6.544 -11.593 572 HG21 ILE 71 1HG2 ILE 71 -7.927 4.517 -13.070 573 HG22 ILE 71 2HG2 ILE 71 -7.880 3.204 -11.894 574 HG23 ILE 71 3HG2 ILE 71 -9.194 3.292 -13.069 575 HD11 ILE 71 3HD1 ILE 71 -8.779 7.959 -11.266 576 HD12 ILE 71 1HD1 ILE 71 -7.698 6.579 -11.069 577 HD13 ILE 71 2HD1 ILE 71 -7.900 7.322 -12.657 578 H THR 72 H THR 72 -10.208 3.271 -8.831 579 HA THR 72 HA THR 72 -9.200 0.680 -9.383 580 HB THR 72 HB THR 72 -9.585 0.329 -6.874 581 HG1 THR 72 HG1 THR 72 -11.102 1.813 -6.338 582 HG21 THR 72 3HG2 THR 72 -7.452 0.964 -6.802 583 HG22 THR 72 1HG2 THR 72 -7.953 2.654 -6.757 584 HG23 THR 72 2HG2 THR 72 -7.663 1.861 -8.306 585 H LYS 73 H LYS 73 -12.371 1.895 -8.430 586 HA LYS 73 HA LYS 73 -13.669 -0.441 -7.764 587 HB2 LYS 73 1HB LYS 73 -14.423 2.216 -8.576 588 HB3 LYS 73 2HB LYS 73 -15.503 1.041 -9.314 589 HG2 LYS 73 1HG LYS 73 -15.487 0.090 -6.818 590 HG3 LYS 73 2HG LYS 73 -15.165 1.792 -6.479 591 HD2 LYS 73 1HD LYS 73 -17.155 2.211 -8.105 592 HD3 LYS 73 2HD LYS 73 -17.559 0.529 -7.755 593 HE2 LYS 73 1HE LYS 73 -18.389 1.068 -5.762 594 HE3 LYS 73 2HE LYS 73 -16.939 1.975 -5.336 595 HZ1 LYS 73 3HZ LYS 73 -19.482 2.945 -6.127 596 HZ2 LYS 73 1HZ LYS 73 -18.285 3.527 -7.172 597 HZ3 LYS 73 2HZ LYS 73 -18.160 3.800 -5.508 598 HA PRO 74 HA PRO 74 -14.813 -1.214 -12.387 599 HB2 PRO 74 1HB PRO 74 -13.612 0.345 -14.257 600 HB3 PRO 74 2HB PRO 74 -15.143 0.776 -13.486 601 HG2 PRO 74 1HG PRO 74 -12.374 1.730 -12.865 602 HG3 PRO 74 2HG PRO 74 -13.882 2.659 -12.964 603 HD2 PRO 74 1HD PRO 74 -12.803 1.882 -10.605 604 HD3 PRO 74 2HD PRO 74 -14.555 2.033 -10.850 605 H LYS 75 H LYS 75 -11.508 -0.085 -11.819 606 HA LYS 75 HA LYS 75 -10.233 -1.802 -13.659 607 HB2 LYS 75 1HB LYS 75 -9.167 0.195 -12.660 608 HB3 LYS 75 2HB LYS 75 -9.125 -0.622 -11.103 609 HG2 LYS 75 1HG LYS 75 -7.216 -1.616 -11.618 610 HG3 LYS 75 2HG LYS 75 -7.908 -2.277 -13.102 611 HD2 LYS 75 1HD LYS 75 -7.412 -0.195 -14.273 612 HD3 LYS 75 2HD LYS 75 -6.756 0.497 -12.787 613 HE2 LYS 75 1HE LYS 75 -4.910 -0.240 -14.093 614 HE3 LYS 75 2HE LYS 75 -5.093 -1.382 -12.762 615 HZ1 LYS 75 3HZ LYS 75 -6.605 -2.177 -15.041 616 HZ2 LYS 75 1HZ LYS 75 -5.427 -3.036 -14.182 617 HZ3 LYS 75 2HZ LYS 75 -4.969 -1.990 -15.431 618 H GLY 76 H GLY 76 -11.494 -2.301 -10.470 619 HA2 GLY 76 1HA GLY 76 -11.644 -4.176 -9.154 620 HA3 GLY 76 2HA GLY 76 -11.388 -5.093 -10.631 621 H ILE 77 H ILE 77 -9.500 -3.076 -8.374 622 HA ILE 77 HA ILE 77 -7.467 -5.199 -8.334 623 HB ILE 77 HB ILE 77 -5.711 -3.415 -8.206 624 HG12 ILE 77 1HG1 ILE 77 -7.141 -1.387 -9.633 625 HG13 ILE 77 2HG1 ILE 77 -8.003 -1.734 -8.137 626 HG21 ILE 77 1HG2 ILE 77 -7.355 -3.708 -10.709 627 HG22 ILE 77 2HG2 ILE 77 -5.777 -2.924 -10.671 628 HG23 ILE 77 3HG2 ILE 77 -5.927 -4.626 -10.236 629 HD11 ILE 77 3HD1 ILE 77 -6.196 0.092 -8.145 630 HD12 ILE 77 1HD1 ILE 77 -6.226 -1.066 -6.815 631 HD13 ILE 77 2HD1 ILE 77 -5.054 -1.252 -8.121 632 HA PRO 78 HA PRO 78 -7.546 -4.804 -3.961 633 HB2 PRO 78 1HB PRO 78 -4.980 -5.429 -3.334 634 HB3 PRO 78 2HB PRO 78 -6.151 -6.629 -3.893 635 HG2 PRO 78 1HG PRO 78 -4.009 -5.213 -5.431 636 HG3 PRO 78 2HG PRO 78 -4.480 -6.921 -5.483 637 HD2 PRO 78 1HD PRO 78 -5.273 -5.134 -7.356 638 HD3 PRO 78 2HD PRO 78 -6.278 -6.514 -6.867 639 H ILE 79 H ILE 79 -7.885 -2.672 -3.446 640 HA ILE 79 HA ILE 79 -5.463 -1.059 -3.000 641 HB ILE 79 HB ILE 79 -6.549 -0.111 -4.932 642 HG12 ILE 79 1HG1 ILE 79 -6.990 2.158 -4.110 643 HG13 ILE 79 2HG1 ILE 79 -7.174 1.540 -2.472 644 HG21 ILE 79 1HG2 ILE 79 -9.046 0.100 -3.254 645 HG22 ILE 79 2HG2 ILE 79 -8.851 0.639 -4.921 646 HG23 ILE 79 3HG2 ILE 79 -8.780 -1.080 -4.537 647 HD11 ILE 79 3HD1 ILE 79 -4.658 0.695 -3.509 648 HD12 ILE 79 1HD1 ILE 79 -4.834 2.434 -3.742 649 HD13 ILE 79 2HD1 ILE 79 -5.003 1.739 -2.130 650 H GLU 80 H GLU 80 -5.254 -0.323 -0.988 651 HA GLU 80 HA GLU 80 -7.641 -0.310 0.741 652 HB2 GLU 80 1HB GLU 80 -4.846 -1.242 1.237 653 HB3 GLU 80 2HB GLU 80 -5.765 -0.573 2.579 654 HG2 GLU 80 1HG GLU 80 -5.846 -3.067 2.334 655 HG3 GLU 80 2HG GLU 80 -7.408 -2.256 2.422 656 H ILE 81 H ILE 81 -7.620 1.255 2.494 657 HA ILE 81 HA ILE 81 -6.004 3.639 1.865 658 HB ILE 81 HB ILE 81 -8.864 3.584 2.835 659 HG12 ILE 81 1HG1 ILE 81 -9.029 4.936 0.566 660 HG13 ILE 81 2HG1 ILE 81 -7.579 4.020 0.172 661 HG21 ILE 81 1HG2 ILE 81 -8.572 6.114 2.272 662 HG22 ILE 81 2HG2 ILE 81 -8.024 5.486 3.826 663 HG23 ILE 81 3HG2 ILE 81 -6.861 5.776 2.532 664 HD11 ILE 81 3HD1 ILE 81 -10.353 3.177 0.265 665 HD12 ILE 81 1HD1 ILE 81 -8.970 2.449 -0.552 666 HD13 ILE 81 2HD1 ILE 81 -9.276 2.098 1.149 667 H ILE 82 H ILE 82 -4.688 4.199 3.457 668 HA ILE 82 HA ILE 82 -4.837 3.011 6.045 669 HB ILE 82 HB ILE 82 -3.149 5.381 5.253 670 HG12 ILE 82 1HG1 ILE 82 -2.508 2.436 4.983 671 HG13 ILE 82 2HG1 ILE 82 -2.860 3.526 3.647 672 HG21 ILE 82 1HG2 ILE 82 -2.616 3.232 7.293 673 HG22 ILE 82 2HG2 ILE 82 -1.709 4.722 7.035 674 HG23 ILE 82 3HG2 ILE 82 -3.350 4.788 7.676 675 HD11 ILE 82 3HD1 ILE 82 -0.477 3.532 5.467 676 HD12 ILE 82 1HD1 ILE 82 -0.523 3.300 3.720 677 HD13 ILE 82 2HD1 ILE 82 -0.875 4.885 4.409 678 H ASN 83 H ASN 83 -6.028 3.641 7.710 679 HA ASN 83 HA ASN 83 -7.693 5.898 7.677 680 HB2 ASN 83 1HB ASN 83 -6.925 3.846 9.681 681 HB3 ASN 83 2HB ASN 83 -7.619 5.339 10.306 682 HD21 ASN 83 2HD2 ASN 83 -8.416 2.342 9.610 683 HD22 ASN 83 1HD2 ASN 83 -10.043 2.542 9.064 684 H THR 84 H THR 84 -7.650 7.797 8.977 685 HA THR 84 HA THR 84 -5.321 9.273 8.886 686 HB THR 84 HB THR 84 -7.348 9.808 11.035 687 HG1 THR 84 HG1 THR 84 -8.477 10.927 9.189 688 HG21 THR 84 3HG2 THR 84 -6.163 11.698 11.120 689 HG22 THR 84 1HG2 THR 84 -6.807 12.090 9.526 690 HG23 THR 84 2HG2 THR 84 -5.255 11.265 9.670 691 H ILE 85 H ILE 85 -6.575 7.288 11.520 692 HA ILE 85 HA ILE 85 -4.663 8.078 13.455 693 HB ILE 85 HB ILE 85 -6.210 5.488 13.295 694 HG12 ILE 85 1HG1 ILE 85 -7.343 7.081 15.255 695 HG13 ILE 85 2HG1 ILE 85 -6.976 8.227 13.969 696 HG21 ILE 85 1HG2 ILE 85 -4.528 6.748 15.420 697 HG22 ILE 85 2HG2 ILE 85 -5.872 5.695 15.858 698 HG23 ILE 85 3HG2 ILE 85 -4.556 5.077 14.860 699 HD11 ILE 85 3HD1 ILE 85 -8.133 6.460 12.450 700 HD12 ILE 85 1HD1 ILE 85 -8.847 5.912 13.966 701 HD13 ILE 85 2HD1 ILE 85 -9.100 7.571 13.420 702 H ASP 86 H ASP 86 -4.882 5.147 11.436 703 HA ASP 86 HA ASP 86 -2.535 3.916 12.209 704 HB2 ASP 86 1HB ASP 86 -4.146 3.900 9.694 705 HB3 ASP 86 2HB ASP 86 -2.563 3.129 9.681 706 H TYR 87 H TYR 87 -3.009 6.459 9.804 707 HA TYR 87 HA TYR 87 -0.274 6.477 8.958 708 HB2 TYR 87 1HB TYR 87 -2.210 7.244 7.554 709 HB3 TYR 87 2HB TYR 87 -2.336 8.657 8.596 710 HD1 TYR 87 HD1 TYR 87 -0.159 6.920 6.166 711 HD2 TYR 87 HD2 TYR 87 -0.877 10.511 8.331 712 HE1 TYR 87 HE1 TYR 87 1.509 8.081 4.780 713 HE2 TYR 87 HE2 TYR 87 0.788 11.683 6.950 714 HH TYR 87 HH TYR 87 3.057 10.266 5.210 715 H GLY 88 H GLY 88 -2.235 8.429 11.168 716 HA2 GLY 88 1HA GLY 88 -0.341 10.407 11.751 717 HA3 GLY 88 2HA GLY 88 -1.643 9.907 12.820 718 H THR 89 H THR 89 -0.930 7.289 13.344 719 HA THR 89 HA THR 89 1.273 7.717 15.177 720 HB THR 89 HB THR 89 -0.656 6.559 16.051 721 HG1 THR 89 HG1 THR 89 0.780 5.481 17.157 722 HG21 THR 89 3HG2 THR 89 -0.540 5.174 13.522 723 HG22 THR 89 1HG2 THR 89 -1.856 5.257 14.692 724 HG23 THR 89 2HG2 THR 89 -0.602 4.029 14.861 725 H MET 90 H MET 90 0.700 6.150 12.144 726 HA MET 90 HA MET 90 2.069 5.060 10.694 727 HB2 MET 90 1HB MET 90 4.354 5.927 12.465 728 HB3 MET 90 2HB MET 90 4.424 5.505 10.759 729 HG2 MET 90 1HG MET 90 2.929 7.476 10.321 730 HG3 MET 90 2HG MET 90 3.174 7.935 12.005 731 HE1 MET 90 3HE MET 90 5.764 7.827 12.966 732 HE2 MET 90 1HE MET 90 6.440 6.627 11.863 733 HE3 MET 90 2HE MET 90 7.162 8.232 11.969 734 H ASN 91 H ASN 91 1.151 3.058 11.397 735 HA ASN 91 HA ASN 91 2.871 1.480 13.186 736 HB2 ASN 91 1HB ASN 91 -0.032 1.582 12.724 737 HB3 ASN 91 2HB ASN 91 0.629 -0.048 12.819 738 HD21 ASN 91 2HD2 ASN 91 0.338 -0.833 14.767 739 HD22 ASN 91 1HD2 ASN 91 0.559 0.017 16.255 740 H GLY 92 H GLY 92 4.425 0.723 11.800 741 HA2 GLY 92 1HA GLY 92 4.134 -0.107 9.180 742 HA3 GLY 92 2HA GLY 92 5.347 -0.737 10.285 743 H GLU 93 H GLU 93 3.889 -2.124 12.104 744 HA GLU 93 HA GLU 93 3.459 -4.571 10.893 745 HB2 GLU 93 1HB GLU 93 3.800 -4.270 13.313 746 HB3 GLU 93 2HB GLU 93 2.202 -3.552 13.447 747 HG2 GLU 93 1HG GLU 93 1.164 -5.629 12.807 748 HG3 GLU 93 2HG GLU 93 2.741 -6.363 12.520 749 H LYS 94 H LYS 94 1.046 -2.134 11.823 750 HA LYS 94 HA LYS 94 -1.218 -3.559 10.963 751 HB2 LYS 94 1HB LYS 94 -0.714 -0.598 11.265 752 HB3 LYS 94 2HB LYS 94 -2.289 -1.268 10.859 753 HG2 LYS 94 1HG LYS 94 -0.780 -2.093 13.320 754 HG3 LYS 94 2HG LYS 94 -1.872 -0.707 13.293 755 HD2 LYS 94 1HD LYS 94 -3.641 -2.288 12.407 756 HD3 LYS 94 2HD LYS 94 -2.534 -3.604 12.806 757 HE2 LYS 94 1HE LYS 94 -2.594 -2.033 15.094 758 HE3 LYS 94 2HE LYS 94 -4.263 -2.040 14.530 759 HZ1 LYS 94 3HZ LYS 94 -2.871 -4.074 15.866 760 HZ2 LYS 94 1HZ LYS 94 -3.277 -4.643 14.325 761 HZ3 LYS 94 2HZ LYS 94 -4.486 -4.065 15.358 762 H VAL 95 H VAL 95 0.920 -1.308 9.278 763 HA VAL 95 HA VAL 95 -0.561 -1.053 6.910 764 HB VAL 95 HB VAL 95 2.448 -0.983 7.143 765 HG11 VAL 95 1HG1 VAL 95 1.868 -0.990 4.864 766 HG12 VAL 95 2HG1 VAL 95 0.492 0.082 5.126 767 HG13 VAL 95 3HG1 VAL 95 2.135 0.706 5.267 768 HG21 VAL 95 3HG2 VAL 95 1.391 1.621 7.135 769 HG22 VAL 95 1HG2 VAL 95 0.470 0.714 8.334 770 HG23 VAL 95 2HG2 VAL 95 2.227 0.799 8.453 771 H LEU 96 H LEU 96 2.409 -2.987 7.326 772 HA LEU 96 HA LEU 96 2.230 -4.444 4.989 773 HB2 LEU 96 1HB LEU 96 3.581 -6.179 6.202 774 HB3 LEU 96 2HB LEU 96 4.233 -4.542 6.227 775 HG LEU 96 HG LEU 96 2.810 -4.612 8.557 776 HD11 LEU 96 1HD1 LEU 96 2.614 -7.163 7.939 777 HD12 LEU 96 2HD1 LEU 96 2.893 -6.640 9.599 778 HD13 LEU 96 3HD1 LEU 96 4.241 -7.217 8.618 779 HD21 LEU 96 3HD2 LEU 96 5.061 -3.738 8.264 780 HD22 LEU 96 1HD2 LEU 96 5.695 -5.377 8.116 781 HD23 LEU 96 2HD2 LEU 96 4.997 -4.837 9.643 782 H GLN 97 H GLN 97 0.783 -5.137 8.140 783 HA GLN 97 HA GLN 97 -0.205 -7.691 7.593 784 HB2 GLN 97 1HB GLN 97 -0.992 -5.510 9.483 785 HB3 GLN 97 2HB GLN 97 -2.040 -6.910 9.309 786 HG2 GLN 97 1HG GLN 97 0.883 -7.087 9.987 787 HG3 GLN 97 2HG GLN 97 -0.406 -7.038 11.188 788 HE21 GLN 97 2HE2 GLN 97 1.256 -8.937 8.851 789 HE22 GLN 97 1HE2 GLN 97 0.464 -10.436 9.183 790 H LEU 98 H LEU 98 -1.762 -4.521 7.179 791 HA LEU 98 HA LEU 98 -4.212 -5.465 6.201 792 HB2 LEU 98 1HB LEU 98 -2.993 -2.975 6.658 793 HB3 LEU 98 2HB LEU 98 -3.492 -2.974 4.968 794 HG LEU 98 HG LEU 98 -5.403 -3.700 7.167 795 HD11 LEU 98 1HD1 LEU 98 -6.099 -1.443 7.358 796 HD12 LEU 98 2HD1 LEU 98 -5.042 -0.932 6.044 797 HD13 LEU 98 3HD1 LEU 98 -4.350 -1.453 7.580 798 HD21 LEU 98 3HD2 LEU 98 -5.568 -3.780 4.410 799 HD22 LEU 98 1HD2 LEU 98 -6.379 -2.274 4.836 800 HD23 LEU 98 2HD2 LEU 98 -6.923 -3.797 5.540 801 H ALA 99 H ALA 99 -1.347 -4.306 4.430 802 HA ALA 99 HA ALA 99 -2.251 -4.630 1.844 803 HB1 ALA 99 3HB ALA 99 -0.111 -4.270 1.205 804 HB2 ALA 99 1HB ALA 99 0.074 -3.837 2.904 805 HB3 ALA 99 2HB ALA 99 0.546 -5.442 2.346 806 H ILE 100 H ILE 100 -0.391 -7.029 3.725 807 HA ILE 100 HA ILE 100 -0.497 -9.107 1.890 808 HB ILE 100 HB ILE 100 -0.509 -9.333 4.903 809 HG12 ILE 100 1HG1 ILE 100 1.881 -9.518 3.078 810 HG13 ILE 100 2HG1 ILE 100 1.344 -7.978 3.739 811 HG21 ILE 100 1HG2 ILE 100 -0.194 -11.313 2.711 812 HG22 ILE 100 2HG2 ILE 100 0.804 -11.502 4.151 813 HG23 ILE 100 3HG2 ILE 100 -0.954 -11.486 4.292 814 HD11 ILE 100 3HD1 ILE 100 2.020 -8.490 5.845 815 HD12 ILE 100 1HD1 ILE 100 1.770 -10.221 5.627 816 HD13 ILE 100 2HD1 ILE 100 3.186 -9.440 4.923 817 H ASN 101 H ASN 101 -2.755 -8.348 4.526 818 HA ASN 101 HA ASN 101 -4.467 -10.508 4.291 819 HB2 ASN 101 1HB ASN 101 -4.812 -7.681 5.204 820 HB3 ASN 101 2HB ASN 101 -6.245 -8.689 5.015 821 HD21 ASN 101 2HD2 ASN 101 -5.930 -7.873 7.440 822 HD22 ASN 101 1HD2 ASN 101 -5.264 -9.081 8.482 823 H ALA 102 H ALA 102 -4.581 -7.410 2.558 824 HA ALA 102 HA ALA 102 -6.908 -7.964 1.067 825 HB1 ALA 102 3HB ALA 102 -5.334 -6.250 -0.481 826 HB2 ALA 102 1HB ALA 102 -6.605 -5.803 0.657 827 HB3 ALA 102 2HB ALA 102 -4.927 -5.882 1.195 828 H PHE 103 H PHE 103 -3.469 -8.439 0.352 829 HA PHE 103 HA PHE 103 -3.684 -9.255 -2.296 830 HB2 PHE 103 1HB PHE 103 -1.542 -8.778 -1.158 831 HB3 PHE 103 2HB PHE 103 -1.722 -10.260 -0.224 832 HD1 PHE 103 HD1 PHE 103 -1.554 -9.044 -3.737 833 HD2 PHE 103 HD2 PHE 103 -0.791 -12.221 -1.010 834 HE1 PHE 103 HE1 PHE 103 -0.417 -10.299 -5.522 835 HE2 PHE 103 HE2 PHE 103 0.347 -13.480 -2.790 836 HZ PHE 103 HZ PHE 103 0.537 -12.520 -5.049 837 H ASN 104 H ASN 104 -3.776 -11.224 0.662 838 HA ASN 104 HA ASN 104 -4.155 -13.694 -0.669 839 HB2 ASN 104 1HB ASN 104 -5.131 -13.151 2.124 840 HB3 ASN 104 2HB ASN 104 -4.456 -14.636 1.461 841 HD21 ASN 104 2HD2 ASN 104 -2.191 -13.702 0.237 842 HD22 ASN 104 1HD2 ASN 104 -1.102 -13.087 1.429 843 H ASN 105 H ASN 105 -6.457 -11.612 1.089 844 HA ASN 105 HA ASN 105 -8.769 -13.043 0.625 845 HB2 ASN 105 1HB ASN 105 -8.094 -10.323 1.400 846 HB3 ASN 105 2HB ASN 105 -9.571 -10.380 0.442 847 HD21 ASN 105 2HD2 ASN 105 -8.852 -9.981 3.389 848 HD22 ASN 105 1HD2 ASN 105 -9.965 -11.012 4.215 849 H LYS 106 H LYS 106 -7.199 -10.651 -1.456 850 HA LYS 106 HA LYS 106 -7.408 -10.186 -3.672 851 HB2 LYS 106 1HB LYS 106 -8.074 -13.005 -3.423 852 HB3 LYS 106 2HB LYS 106 -8.911 -12.256 -4.777 853 HG2 LYS 106 1HG LYS 106 -6.576 -11.309 -5.377 854 HG3 LYS 106 2HG LYS 106 -5.978 -12.589 -4.318 855 HD2 LYS 106 1HD LYS 106 -7.996 -13.546 -6.175 856 HD3 LYS 106 2HD LYS 106 -6.609 -12.834 -7.003 857 HE2 LYS 106 1HE LYS 106 -5.125 -14.273 -5.617 858 HE3 LYS 106 2HE LYS 106 -6.564 -15.048 -4.956 859 HZ1 LYS 106 3HZ LYS 106 -6.091 -14.945 -7.868 860 HZ2 LYS 106 1HZ LYS 106 -7.081 -16.001 -6.994 861 HZ3 LYS 106 2HZ LYS 106 -5.399 -16.159 -6.916 862 H SER 107 H SER 107 -9.119 -9.944 -5.483 863 HA SER 107 HA SER 107 -11.128 -9.144 -6.209 864 HB2 SER 107 1HB SER 107 -12.406 -9.844 -3.579 865 HB3 SER 107 2HB SER 107 -13.125 -9.827 -5.190 866 HG SER 107 HG SER 107 -12.094 -11.707 -5.675 867 H SER 108 H SER 108 -11.288 -8.544 -2.700 868 HA SER 108 HA SER 108 -11.461 -6.626 -1.489 869 HB2 SER 108 1HB SER 108 -9.259 -6.250 -2.849 870 HB3 SER 108 2HB SER 108 -10.223 -5.072 -3.740 871 HG SER 108 HG SER 108 -9.118 -4.868 -1.284 872 H VAL 109 H VAL 109 -13.646 -7.373 -3.153 873 HA VAL 109 HA VAL 109 -14.767 -5.370 -4.699 874 HB VAL 109 HB VAL 109 -15.730 -7.625 -4.492 875 HG11 VAL 109 1HG1 VAL 109 -17.307 -7.082 -2.109 876 HG12 VAL 109 2HG1 VAL 109 -16.403 -8.528 -2.563 877 HG13 VAL 109 3HG1 VAL 109 -15.577 -7.182 -1.777 878 HG21 VAL 109 3HG2 VAL 109 -18.120 -6.928 -4.407 879 HG22 VAL 109 1HG2 VAL 109 -17.589 -5.341 -3.850 880 HG23 VAL 109 2HG2 VAL 109 -17.118 -5.918 -5.449 Start of MODEL 9 1 H1 GLY 1 H GLY 1 13.098 -19.308 -8.380 2 HA2 GLY 1 1HA GLY 1 11.379 -17.295 -9.606 3 HA3 GLY 1 2HA GLY 1 10.652 -18.866 -9.304 4 HA PRO 2 HA PRO 2 11.769 -16.921 -4.999 5 HB2 PRO 2 1HB PRO 2 12.285 -14.256 -5.021 6 HB3 PRO 2 2HB PRO 2 13.548 -15.480 -5.188 7 HG2 PRO 2 1HG PRO 2 12.183 -13.865 -7.307 8 HG3 PRO 2 2HG PRO 2 13.903 -14.263 -7.137 9 HD2 PRO 2 1HD PRO 2 12.264 -15.584 -8.840 10 HD3 PRO 2 2HD PRO 2 13.633 -16.371 -8.030 11 H GLY 3 H GLY 3 9.642 -17.168 -4.457 12 HA2 GLY 3 1HA GLY 3 7.579 -15.440 -5.448 13 HA3 GLY 3 2HA GLY 3 7.405 -16.661 -4.195 14 H SER 4 H SER 4 7.316 -13.409 -4.817 15 HA SER 4 HA SER 4 7.303 -12.798 -1.972 16 HB2 SER 4 1HB SER 4 8.650 -10.610 -3.141 17 HB3 SER 4 2HB SER 4 9.290 -11.765 -1.972 18 HG SER 4 HG SER 4 9.549 -11.722 -4.764 19 H MET 5 H MET 5 6.124 -10.923 -1.439 20 HA MET 5 HA MET 5 4.171 -10.182 -3.465 21 HB2 MET 5 1HB MET 5 3.787 -10.790 -0.911 22 HB3 MET 5 2HB MET 5 4.093 -9.071 -0.699 23 HG2 MET 5 1HG MET 5 2.180 -9.739 -2.820 24 HG3 MET 5 2HG MET 5 1.667 -10.154 -1.187 25 HE1 MET 5 3HE MET 5 0.973 -8.644 0.560 26 HE2 MET 5 1HE MET 5 2.567 -7.928 0.796 27 HE3 MET 5 2HE MET 5 1.155 -6.889 0.603 28 H ASN 6 H ASN 6 3.542 -7.924 -3.755 29 HA ASN 6 HA ASN 6 5.731 -6.025 -3.253 30 HB2 ASN 6 1HB ASN 6 4.206 -6.316 -5.851 31 HB3 ASN 6 2HB ASN 6 5.420 -5.087 -5.506 32 HD21 ASN 6 2HD2 ASN 6 4.836 -8.254 -6.568 33 HD22 ASN 6 1HD2 ASN 6 6.481 -8.752 -6.749 34 H ILE 7 H ILE 7 4.936 -4.512 -1.956 35 HA ILE 7 HA ILE 7 2.116 -3.744 -2.200 36 HB ILE 7 HB ILE 7 4.075 -3.012 -0.020 37 HG12 ILE 7 1HG1 ILE 7 1.949 -5.166 -0.077 38 HG13 ILE 7 2HG1 ILE 7 3.689 -5.436 -0.094 39 HG21 ILE 7 1HG2 ILE 7 1.505 -2.021 -0.686 40 HG22 ILE 7 2HG2 ILE 7 1.356 -2.957 0.801 41 HG23 ILE 7 3HG2 ILE 7 2.506 -1.625 0.711 42 HD11 ILE 7 3HD1 ILE 7 1.985 -5.229 2.126 43 HD12 ILE 7 1HD1 ILE 7 3.739 -5.409 2.112 44 HD13 ILE 7 2HD1 ILE 7 3.017 -3.799 2.141 45 H LEU 8 H LEU 8 1.496 -1.794 -2.911 46 HA LEU 8 HA LEU 8 3.606 0.139 -3.589 47 HB2 LEU 8 1HB LEU 8 1.787 -0.978 -5.239 48 HB3 LEU 8 2HB LEU 8 0.914 0.469 -4.740 49 HG LEU 8 HG LEU 8 3.566 0.334 -6.168 50 HD11 LEU 8 1HD1 LEU 8 0.784 1.144 -6.935 51 HD12 LEU 8 2HD1 LEU 8 1.888 0.039 -7.753 52 HD13 LEU 8 3HD1 LEU 8 2.192 1.775 -7.791 53 HD21 LEU 8 3HD2 LEU 8 3.906 2.162 -4.809 54 HD22 LEU 8 1HD2 LEU 8 2.192 2.572 -4.747 55 HD23 LEU 8 2HD2 LEU 8 3.127 2.906 -6.205 56 H LEU 9 H LEU 9 3.561 2.162 -2.784 57 HA LEU 9 HA LEU 9 1.259 2.892 -1.094 58 HB2 LEU 9 1HB LEU 9 3.425 2.410 0.088 59 HB3 LEU 9 2HB LEU 9 4.102 3.816 -0.733 60 HG LEU 9 HG LEU 9 2.547 5.274 0.424 61 HD11 LEU 9 1HD1 LEU 9 1.463 2.706 1.555 62 HD12 LEU 9 2HD1 LEU 9 0.603 3.940 0.633 63 HD13 LEU 9 3HD1 LEU 9 1.151 4.287 2.273 64 HD21 LEU 9 3HD2 LEU 9 3.274 4.624 2.841 65 HD22 LEU 9 1HD2 LEU 9 4.488 5.105 1.655 66 HD23 LEU 9 2HD2 LEU 9 4.237 3.396 2.017 67 H VAL 10 H VAL 10 0.277 4.792 -1.466 68 HA VAL 10 HA VAL 10 1.465 6.554 -3.507 69 HB VAL 10 HB VAL 10 -1.461 6.353 -2.794 70 HG11 VAL 10 1HG1 VAL 10 -0.530 7.357 -5.412 71 HG12 VAL 10 2HG1 VAL 10 -1.868 7.899 -4.396 72 HG13 VAL 10 3HG1 VAL 10 -0.217 8.390 -4.017 73 HG21 VAL 10 3HG2 VAL 10 -1.750 5.039 -4.817 74 HG22 VAL 10 1HG2 VAL 10 -0.013 5.091 -5.121 75 HG23 VAL 10 2HG2 VAL 10 -0.638 4.226 -3.716 76 H CYS 11 H CYS 11 2.625 7.877 -2.109 77 HA CYS 11 HA CYS 11 0.979 9.756 -0.585 78 HB2 CYS 11 1HB CYS 11 2.761 9.735 1.224 79 HB3 CYS 11 2HB CYS 11 1.717 8.320 1.154 80 HG CYS 11 HG CYS 11 5.020 8.550 0.747 81 H GLY 12 H GLY 12 4.159 8.982 -1.935 82 HA2 GLY 12 1HA GLY 12 5.346 10.428 -3.385 83 HA3 GLY 12 2HA GLY 12 4.417 11.781 -2.757 84 H ALA 13 H ALA 13 5.717 13.172 -1.778 85 HA ALA 13 HA ALA 13 7.237 14.038 -0.317 86 HB1 ALA 13 3HB ALA 13 8.167 11.863 1.190 87 HB2 ALA 13 1HB ALA 13 6.953 13.056 1.653 88 HB3 ALA 13 2HB ALA 13 6.459 11.550 0.878 89 H GLY 14 H GLY 14 8.591 10.761 -0.534 90 HA2 GLY 14 1HA GLY 14 10.855 11.895 -2.055 91 HA3 GLY 14 2HA GLY 14 11.115 10.830 -0.682 92 H MET 15 H MET 15 11.424 8.754 -1.124 93 HA MET 15 HA MET 15 9.943 7.331 -3.086 94 HB2 MET 15 1HB MET 15 11.974 6.725 -4.488 95 HB3 MET 15 2HB MET 15 11.314 8.337 -4.728 96 HG2 MET 15 1HG MET 15 13.170 9.346 -3.994 97 HG3 MET 15 2HG MET 15 13.409 8.181 -2.694 98 HE1 MET 15 3HE MET 15 15.460 7.259 -2.525 99 HE2 MET 15 1HE MET 15 16.603 6.817 -3.794 100 HE3 MET 15 2HE MET 15 16.277 8.517 -3.455 101 H SER 16 H SER 16 9.594 5.910 -1.388 102 HA SER 16 HA SER 16 9.978 4.140 -0.010 103 HB2 SER 16 1HB SER 16 11.096 3.478 -2.362 104 HB3 SER 16 2HB SER 16 12.539 3.439 -1.349 105 HG SER 16 HG SER 16 11.817 1.491 -0.940 106 H THR 17 H THR 17 10.761 6.456 1.109 107 HA THR 17 HA THR 17 12.856 5.590 2.892 108 HB THR 17 HB THR 17 13.306 8.251 1.565 109 HG1 THR 17 HG1 THR 17 14.736 5.922 0.833 110 HG21 THR 17 3HG2 THR 17 15.724 7.297 2.309 111 HG22 THR 17 1HG2 THR 17 14.695 6.534 3.520 112 HG23 THR 17 2HG2 THR 17 14.701 8.290 3.346 113 H SER 18 H SER 18 10.179 6.025 3.377 114 HA SER 18 HA SER 18 10.177 8.547 4.901 115 HB2 SER 18 1HB SER 18 7.876 7.014 3.677 116 HB3 SER 18 2HB SER 18 7.665 8.359 4.797 117 HG SER 18 HG SER 18 9.178 8.579 2.416 118 H MET 19 H MET 19 8.483 8.366 6.782 119 HA MET 19 HA MET 19 9.519 6.658 8.706 120 HB2 MET 19 1HB MET 19 6.705 7.752 8.715 121 HB3 MET 19 2HB MET 19 7.685 7.318 10.108 122 HG2 MET 19 1HG MET 19 9.131 9.231 8.612 123 HG3 MET 19 2HG MET 19 7.478 9.816 8.781 124 HE1 MET 19 3HE MET 19 9.886 7.680 10.994 125 HE2 MET 19 1HE MET 19 10.872 9.090 10.606 126 HE3 MET 19 2HE MET 19 10.329 8.824 12.263 127 H LEU 20 H LEU 20 6.436 6.327 6.944 128 HA LEU 20 HA LEU 20 5.589 3.925 8.004 129 HB2 LEU 20 1HB LEU 20 5.098 5.438 5.545 130 HB3 LEU 20 2HB LEU 20 4.803 3.707 5.398 131 HG LEU 20 HG LEU 20 3.516 5.520 7.438 132 HD11 LEU 20 1HD1 LEU 20 2.773 6.015 5.160 133 HD12 LEU 20 2HD1 LEU 20 1.493 5.263 6.113 134 HD13 LEU 20 3HD1 LEU 20 2.379 4.313 4.920 135 HD21 LEU 20 3HD2 LEU 20 3.722 3.247 8.243 136 HD22 LEU 20 1HD2 LEU 20 3.049 2.623 6.737 137 HD23 LEU 20 2HD2 LEU 20 2.041 3.583 7.822 138 H VAL 21 H VAL 21 7.517 4.374 5.037 139 HA VAL 21 HA VAL 21 7.917 1.712 4.397 140 HB VAL 21 HB VAL 21 9.871 3.988 4.024 141 HG11 VAL 21 1HG1 VAL 21 11.265 2.464 3.208 142 HG12 VAL 21 2HG1 VAL 21 10.070 1.185 3.432 143 HG13 VAL 21 3HG1 VAL 21 10.087 2.127 1.940 144 HG21 VAL 21 3HG2 VAL 21 8.330 3.074 1.721 145 HG22 VAL 21 1HG2 VAL 21 7.332 3.758 3.003 146 HG23 VAL 21 2HG2 VAL 21 8.640 4.710 2.300 147 H GLN 22 H GLN 22 9.776 3.773 6.596 148 HA GLN 22 HA GLN 22 11.851 1.989 7.162 149 HB2 GLN 22 1HB GLN 22 10.916 4.499 8.153 150 HB3 GLN 22 2HB GLN 22 11.246 3.449 9.525 151 HG2 GLN 22 1HG GLN 22 13.322 3.420 7.465 152 HG3 GLN 22 2HG GLN 22 13.087 4.984 8.246 153 HE21 GLN 22 2HE2 GLN 22 13.675 1.568 8.875 154 HE22 GLN 22 1HE2 GLN 22 14.522 1.801 10.363 155 H ARG 23 H ARG 23 8.861 2.576 9.018 156 HA ARG 23 HA ARG 23 9.226 0.621 10.954 157 HB2 ARG 23 1HB ARG 23 6.609 1.526 9.738 158 HB3 ARG 23 2HB ARG 23 6.799 0.707 11.284 159 HG2 ARG 23 1HG ARG 23 8.425 3.108 11.082 160 HG3 ARG 23 2HG ARG 23 6.700 3.424 10.885 161 HD2 ARG 23 1HD ARG 23 6.233 2.277 12.978 162 HD3 ARG 23 2HD ARG 23 7.943 1.890 13.164 163 HE ARG 23 HE ARG 23 6.667 4.351 13.820 164 HH11 ARG 23 1HH1 ARG 23 9.649 2.968 12.674 165 HH12 ARG 23 2HH1 ARG 23 10.632 4.265 13.271 166 HH21 ARG 23 1HH2 ARG 23 7.949 6.064 14.611 167 HH22 ARG 23 2HH2 ARG 23 9.663 6.024 14.374 168 H ILE 24 H ILE 24 7.216 0.333 8.017 169 HA ILE 24 HA ILE 24 6.608 -2.357 8.227 170 HB ILE 24 HB ILE 24 7.073 -0.798 5.682 171 HG12 ILE 24 1HG1 ILE 24 4.326 -1.347 6.551 172 HG13 ILE 24 2HG1 ILE 24 5.218 -0.304 7.654 173 HG21 ILE 24 1HG2 ILE 24 7.056 -3.089 5.110 174 HG22 ILE 24 2HG2 ILE 24 5.730 -3.433 6.219 175 HG23 ILE 24 3HG2 ILE 24 5.435 -2.491 4.759 176 HD11 ILE 24 3HD1 ILE 24 5.699 0.594 5.009 177 HD12 ILE 24 1HD1 ILE 24 3.962 0.366 5.213 178 HD13 ILE 24 2HD1 ILE 24 4.852 1.414 6.320 179 H GLU 25 H GLU 25 9.419 -0.834 6.698 180 HA GLU 25 HA GLU 25 10.566 -3.164 5.637 181 HB2 GLU 25 1HB GLU 25 11.633 -0.473 6.402 182 HB3 GLU 25 2HB GLU 25 12.751 -1.750 5.948 183 HG2 GLU 25 1HG GLU 25 10.496 -1.354 4.110 184 HG3 GLU 25 2HG GLU 25 11.633 -0.010 4.217 185 H LYS 26 H LYS 26 10.911 -1.618 8.795 186 HA LYS 26 HA LYS 26 12.962 -3.274 9.784 187 HB2 LYS 26 1HB LYS 26 11.032 -1.347 10.902 188 HB3 LYS 26 2HB LYS 26 11.582 -2.578 12.032 189 HG2 LYS 26 1HG LYS 26 13.501 -0.951 10.398 190 HG3 LYS 26 2HG LYS 26 12.880 -0.394 11.954 191 HD2 LYS 26 1HD LYS 26 14.127 -3.106 11.672 192 HD3 LYS 26 2HD LYS 26 15.125 -1.668 11.899 193 HE2 LYS 26 1HE LYS 26 14.581 -1.499 14.065 194 HE3 LYS 26 2HE LYS 26 12.877 -1.828 13.755 195 HZ1 LYS 26 3HZ LYS 26 14.200 -4.211 13.328 196 HZ2 LYS 26 1HZ LYS 26 13.209 -3.816 14.642 197 HZ3 LYS 26 2HZ LYS 26 14.880 -3.574 14.740 198 H TYR 27 H TYR 27 9.461 -3.393 10.472 199 HA TYR 27 HA TYR 27 9.417 -5.733 11.934 200 HB2 TYR 27 1HB TYR 27 7.451 -4.341 11.758 201 HB3 TYR 27 2HB TYR 27 7.343 -4.637 10.026 202 HD1 TYR 27 HD2 TYR 27 6.611 -6.839 9.189 203 HD2 TYR 27 HD1 TYR 27 6.620 -5.933 13.346 204 HE1 TYR 27 HE2 TYR 27 5.140 -8.765 9.605 205 HE2 TYR 27 HE1 TYR 27 5.150 -7.858 13.774 206 HH TYR 27 HH TYR 27 3.939 -9.490 12.866 207 H ALA 28 H ALA 28 8.977 -5.383 8.417 208 HA ALA 28 HA ALA 28 8.717 -8.114 7.839 209 HB1 ALA 28 3HB ALA 28 8.391 -5.932 6.375 210 HB2 ALA 28 1HB ALA 28 10.024 -6.343 5.846 211 HB3 ALA 28 2HB ALA 28 8.710 -7.504 5.643 212 H LYS 29 H LYS 29 11.584 -6.012 7.783 213 HA LYS 29 HA LYS 29 13.427 -7.933 6.920 214 HB2 LYS 29 1HB LYS 29 13.930 -5.539 6.961 215 HB3 LYS 29 2HB LYS 29 13.867 -5.542 8.719 216 HG2 LYS 29 1HG LYS 29 15.920 -6.459 8.929 217 HG3 LYS 29 2HG LYS 29 15.753 -7.441 7.472 218 HD2 LYS 29 1HD LYS 29 15.796 -4.982 6.376 219 HD3 LYS 29 2HD LYS 29 16.787 -4.693 7.807 220 HE2 LYS 29 1HE LYS 29 17.773 -7.072 6.877 221 HE3 LYS 29 2HE LYS 29 17.373 -6.224 5.384 222 HZ1 LYS 29 3HZ LYS 29 19.529 -5.558 5.826 223 HZ2 LYS 29 1HZ LYS 29 19.279 -5.446 7.496 224 HZ3 LYS 29 2HZ LYS 29 18.622 -4.280 6.462 225 H SER 30 H SER 30 12.008 -7.355 10.042 226 HA SER 30 HA SER 30 13.923 -8.998 11.453 227 HB2 SER 30 1HB SER 30 13.130 -7.386 12.896 228 HB3 SER 30 2HB SER 30 11.510 -7.405 12.198 229 HG SER 30 HG SER 30 12.415 -8.711 14.344 230 H LYS 31 H LYS 31 10.560 -9.255 10.378 231 HA LYS 31 HA LYS 31 10.166 -11.869 11.455 232 HB2 LYS 31 1HB LYS 31 8.646 -10.164 9.498 233 HB3 LYS 31 2HB LYS 31 8.163 -11.823 9.827 234 HG2 LYS 31 1HG LYS 31 8.412 -9.649 11.896 235 HG3 LYS 31 2HG LYS 31 6.904 -10.188 11.154 236 HD2 LYS 31 1HD LYS 31 7.685 -12.543 11.991 237 HD3 LYS 31 2HD LYS 31 8.672 -11.595 13.106 238 HE2 LYS 31 1HE LYS 31 6.907 -11.263 14.410 239 HE3 LYS 31 2HE LYS 31 6.047 -10.499 13.074 240 HZ1 LYS 31 3HZ LYS 31 4.777 -12.287 12.803 241 HZ2 LYS 31 1HZ LYS 31 5.359 -12.834 14.294 242 HZ3 LYS 31 2HZ LYS 31 6.091 -13.351 12.860 243 H ASN 32 H ASN 32 11.743 -10.674 8.690 244 HA ASN 32 HA ASN 32 12.797 -11.688 6.948 245 HB2 ASN 32 1HB ASN 32 13.396 -13.294 8.885 246 HB3 ASN 32 2HB ASN 32 12.195 -14.368 8.174 247 HD21 ASN 32 2HD2 ASN 32 15.016 -14.815 8.455 248 HD22 ASN 32 1HD2 ASN 32 15.651 -15.029 6.863 249 H ILE 33 H ILE 33 10.524 -10.906 6.111 250 HA ILE 33 HA ILE 33 9.147 -13.210 4.897 251 HB ILE 33 HB ILE 33 8.094 -10.414 5.348 252 HG12 ILE 33 1HG1 ILE 33 7.074 -12.951 6.609 253 HG13 ILE 33 2HG1 ILE 33 8.378 -12.026 7.345 254 HG21 ILE 33 1HG2 ILE 33 7.159 -12.669 3.721 255 HG22 ILE 33 2HG2 ILE 33 5.937 -11.962 4.777 256 HG23 ILE 33 3HG2 ILE 33 6.783 -10.950 3.606 257 HD11 ILE 33 3HD1 ILE 33 5.523 -11.239 6.927 258 HD12 ILE 33 1HD1 ILE 33 6.457 -11.285 8.422 259 HD13 ILE 33 2HD1 ILE 33 6.780 -10.036 7.218 260 H ASN 34 H ASN 34 8.771 -13.251 2.701 261 HA ASN 34 HA ASN 34 10.556 -11.624 1.107 262 HB2 ASN 34 1HB ASN 34 8.613 -13.687 0.074 263 HB3 ASN 34 2HB ASN 34 10.107 -13.131 -0.674 264 HD21 ASN 34 2HD2 ASN 34 12.019 -14.037 -0.095 265 HD22 ASN 34 1HD2 ASN 34 12.157 -15.375 0.990 266 H ALA 35 H ALA 35 9.554 -9.571 1.346 267 HA ALA 35 HA ALA 35 7.408 -9.145 -0.574 268 HB1 ALA 35 3HB ALA 35 5.914 -8.075 0.867 269 HB2 ALA 35 1HB ALA 35 6.427 -9.504 1.765 270 HB3 ALA 35 2HB ALA 35 7.114 -7.926 2.151 271 H THR 36 H THR 36 7.115 -6.855 -1.103 272 HA THR 36 HA THR 36 9.453 -5.197 -0.437 273 HB THR 36 HB THR 36 8.785 -4.431 -3.019 274 HG1 THR 36 HG1 THR 36 8.948 -7.275 -2.937 275 HG21 THR 36 3HG2 THR 36 11.037 -4.812 -1.799 276 HG22 THR 36 1HG2 THR 36 10.972 -5.039 -3.547 277 HG23 THR 36 2HG2 THR 36 10.945 -6.439 -2.475 278 H ILE 37 H ILE 37 9.127 -2.904 -0.700 279 HA ILE 37 HA ILE 37 6.397 -1.971 -1.061 280 HB ILE 37 HB ILE 37 6.431 -2.469 1.316 281 HG12 ILE 37 1HG1 ILE 37 6.728 0.466 1.446 282 HG13 ILE 37 2HG1 ILE 37 5.637 -0.124 0.196 283 HG21 ILE 37 1HG2 ILE 37 8.861 -2.365 1.640 284 HG22 ILE 37 2HG2 ILE 37 8.798 -0.610 1.483 285 HG23 ILE 37 3HG2 ILE 37 7.997 -1.403 2.838 286 HD11 ILE 37 3HD1 ILE 37 4.595 -1.519 2.099 287 HD12 ILE 37 1HD1 ILE 37 5.427 -0.383 3.161 288 HD13 ILE 37 2HD1 ILE 37 4.238 0.205 1.998 289 H GLU 38 H GLU 38 6.341 -0.031 -2.023 290 HA GLU 38 HA GLU 38 8.574 1.815 -1.740 291 HB2 GLU 38 1HB GLU 38 9.077 0.297 -3.689 292 HB3 GLU 38 2HB GLU 38 7.647 0.947 -4.479 293 HG2 GLU 38 1HG GLU 38 8.669 2.855 -5.043 294 HG3 GLU 38 2HG GLU 38 9.513 2.977 -3.500 295 H ALA 39 H ALA 39 8.040 3.954 -2.138 296 HA ALA 39 HA ALA 39 5.166 4.459 -2.533 297 HB1 ALA 39 3HB ALA 39 6.083 6.770 -1.472 298 HB2 ALA 39 1HB ALA 39 5.435 5.432 -0.523 299 HB3 ALA 39 2HB ALA 39 7.179 5.609 -0.725 300 H ILE 40 H ILE 40 4.509 5.677 -4.200 301 HA ILE 40 HA ILE 40 6.395 7.444 -5.552 302 HB ILE 40 HB ILE 40 5.702 6.551 -7.785 303 HG12 ILE 40 1HG1 ILE 40 5.088 3.883 -6.968 304 HG13 ILE 40 2HG1 ILE 40 3.971 4.977 -6.160 305 HG21 ILE 40 1HG2 ILE 40 7.772 5.851 -6.239 306 HG22 ILE 40 2HG2 ILE 40 7.021 4.271 -6.447 307 HG23 ILE 40 3HG2 ILE 40 7.518 5.202 -7.859 308 HD11 ILE 40 3HD1 ILE 40 4.014 5.901 -8.755 309 HD12 ILE 40 1HD1 ILE 40 4.087 4.148 -8.932 310 HD13 ILE 40 2HD1 ILE 40 2.769 4.889 -8.022 311 H ALA 41 H ALA 41 5.065 8.381 -7.598 312 HA ALA 41 HA ALA 41 2.740 9.642 -6.395 313 HB1 ALA 41 3HB ALA 41 3.871 11.326 -7.388 314 HB2 ALA 41 1HB ALA 41 4.585 10.273 -8.610 315 HB3 ALA 41 2HB ALA 41 2.922 10.834 -8.791 316 H GLU 42 H GLU 42 0.724 9.872 -7.557 317 HA GLU 42 HA GLU 42 -0.328 7.445 -8.453 318 HB2 GLU 42 1HB GLU 42 -2.293 8.781 -9.170 319 HB3 GLU 42 2HB GLU 42 -1.765 9.153 -7.535 320 HG2 GLU 42 1HG GLU 42 -0.546 10.847 -9.572 321 HG3 GLU 42 2HG GLU 42 -2.302 10.980 -9.488 322 H THR 43 H THR 43 1.359 9.935 -10.146 323 HA THR 43 HA THR 43 0.436 9.512 -12.757 324 HB THR 43 HB THR 43 1.807 11.443 -12.215 325 HG1 THR 43 HG1 THR 43 2.010 11.019 -14.343 326 HG21 THR 43 3HG2 THR 43 4.230 9.678 -12.049 327 HG22 THR 43 1HG2 THR 43 3.282 10.060 -10.611 328 HG23 THR 43 2HG2 THR 43 4.042 11.355 -11.536 329 H ARG 44 H ARG 44 2.909 7.863 -10.866 330 HA ARG 44 HA ARG 44 3.342 6.007 -13.108 331 HB2 ARG 44 1HB ARG 44 5.060 6.850 -10.798 332 HB3 ARG 44 2HB ARG 44 5.351 5.314 -11.603 333 HG2 ARG 44 1HG ARG 44 6.054 6.305 -13.546 334 HG3 ARG 44 2HG ARG 44 5.138 7.783 -13.250 335 HD2 ARG 44 1HD ARG 44 6.887 7.738 -11.142 336 HD3 ARG 44 2HD ARG 44 7.854 7.060 -12.451 337 HE ARG 44 HE ARG 44 6.691 9.281 -13.533 338 HH11 ARG 44 1HH1 ARG 44 8.695 8.647 -10.759 339 HH12 ARG 44 2HH1 ARG 44 9.447 10.207 -10.781 340 HH21 ARG 44 1HH2 ARG 44 7.673 11.340 -13.573 341 HH22 ARG 44 2HH2 ARG 44 8.864 11.738 -12.383 342 H LEU 45 H LEU 45 1.197 6.120 -10.909 343 HA LEU 45 HA LEU 45 1.631 3.795 -9.305 344 HB2 LEU 45 1HB LEU 45 0.185 5.363 -8.367 345 HB3 LEU 45 2HB LEU 45 -0.719 5.562 -9.866 346 HG LEU 45 HG LEU 45 -0.876 2.876 -8.685 347 HD11 LEU 45 1HD1 LEU 45 -2.754 3.996 -7.152 348 HD12 LEU 45 2HD1 LEU 45 -1.566 5.298 -7.134 349 HD13 LEU 45 3HD1 LEU 45 -1.114 3.684 -6.584 350 HD21 LEU 45 3HD2 LEU 45 -2.644 4.849 -10.049 351 HD22 LEU 45 1HD2 LEU 45 -3.376 3.569 -9.081 352 HD23 LEU 45 2HD2 LEU 45 -2.327 3.157 -10.438 353 H SER 46 H SER 46 -0.588 4.469 -12.015 354 HA SER 46 HA SER 46 -1.335 1.727 -12.298 355 HB2 SER 46 1HB SER 46 -1.876 4.253 -13.800 356 HB3 SER 46 2HB SER 46 -2.194 2.713 -14.600 357 HG SER 46 HG SER 46 -3.955 3.713 -13.307 358 H GLU 47 H GLU 47 1.393 3.467 -13.206 359 HA GLU 47 HA GLU 47 1.957 1.918 -15.596 360 HB2 GLU 47 1HB GLU 47 3.026 4.330 -14.327 361 HB3 GLU 47 2HB GLU 47 4.274 3.273 -14.972 362 HG2 GLU 47 1HG GLU 47 1.981 3.788 -16.746 363 HG3 GLU 47 2HG GLU 47 3.026 5.166 -16.405 364 H VAL 48 H VAL 48 2.638 1.835 -12.217 365 HA VAL 48 HA VAL 48 4.688 -0.236 -12.633 366 HB VAL 48 HB VAL 48 5.435 0.163 -10.371 367 HG11 VAL 48 1HG1 VAL 48 6.057 2.616 -10.578 368 HG12 VAL 48 2HG1 VAL 48 6.503 1.573 -11.929 369 HG13 VAL 48 3HG1 VAL 48 5.097 2.629 -12.057 370 HG21 VAL 48 3HG2 VAL 48 4.384 2.185 -9.161 371 HG22 VAL 48 1HG2 VAL 48 3.006 1.911 -10.227 372 HG23 VAL 48 2HG2 VAL 48 3.532 0.642 -9.120 373 H VAL 49 H VAL 49 1.512 0.369 -11.458 374 HA VAL 49 HA VAL 49 1.105 -1.608 -9.580 375 HB VAL 49 HB VAL 49 -0.583 0.094 -10.302 376 HG11 VAL 49 1HG1 VAL 49 -1.312 -1.843 -12.481 377 HG12 VAL 49 2HG1 VAL 49 -1.913 -0.204 -12.218 378 HG13 VAL 49 3HG1 VAL 49 -0.256 -0.460 -12.766 379 HG21 VAL 49 3HG2 VAL 49 -1.325 -1.589 -8.813 380 HG22 VAL 49 1HG2 VAL 49 -2.545 -1.488 -10.083 381 HG23 VAL 49 2HG2 VAL 49 -1.370 -2.803 -10.091 382 H ASP 50 H ASP 50 1.472 -1.910 -13.035 383 HA ASP 50 HA ASP 50 0.370 -4.400 -13.513 384 HB2 ASP 50 1HB ASP 50 1.267 -2.939 -15.280 385 HB3 ASP 50 2HB ASP 50 2.904 -3.260 -14.714 386 H ARG 51 H ARG 51 3.311 -3.568 -11.851 387 HA ARG 51 HA ARG 51 4.112 -6.384 -11.723 388 HB2 ARG 51 1HB ARG 51 5.611 -3.940 -10.765 389 HB3 ARG 51 2HB ARG 51 6.239 -5.580 -10.871 390 HG2 ARG 51 1HG ARG 51 5.188 -4.636 -13.406 391 HG3 ARG 51 2HG ARG 51 6.480 -3.610 -12.779 392 HD2 ARG 51 1HD ARG 51 7.253 -5.481 -14.245 393 HD3 ARG 51 2HD ARG 51 7.980 -5.457 -12.639 394 HE ARG 51 HE ARG 51 5.713 -7.111 -12.593 395 HH11 ARG 51 1HH1 ARG 51 8.934 -7.011 -13.909 396 HH12 ARG 51 2HH1 ARG 51 9.118 -8.734 -13.934 397 HH21 ARG 51 1HH2 ARG 51 5.943 -9.381 -12.620 398 HH22 ARG 51 2HH2 ARG 51 7.417 -10.081 -13.200 399 H PHE 52 H PHE 52 3.405 -3.611 -9.626 400 HA PHE 52 HA PHE 52 3.785 -4.864 -7.163 401 HB2 PHE 52 1HB PHE 52 2.103 -2.547 -8.063 402 HB3 PHE 52 2HB PHE 52 1.995 -3.126 -6.403 403 HD1 PHE 52 HD1 PHE 52 3.903 -2.942 -4.895 404 HD2 PHE 52 HD2 PHE 52 4.041 -1.386 -8.854 405 HE1 PHE 52 HE1 PHE 52 5.886 -1.612 -4.300 406 HE2 PHE 52 HE2 PHE 52 6.023 -0.053 -8.265 407 HZ PHE 52 HZ PHE 52 6.950 -0.166 -5.986 408 H ASP 53 H ASP 53 1.689 -4.936 -5.607 409 HA ASP 53 HA ASP 53 -0.252 -6.724 -6.917 410 HB2 ASP 53 1HB ASP 53 1.313 -7.075 -4.401 411 HB3 ASP 53 2HB ASP 53 -0.328 -7.714 -4.453 412 H VAL 54 H VAL 54 0.218 -4.916 -3.874 413 HA VAL 54 HA VAL 54 -2.630 -4.176 -3.978 414 HB VAL 54 HB VAL 54 -2.325 -3.624 -1.534 415 HG11 VAL 54 1HG1 VAL 54 -2.020 -6.217 -0.993 416 HG12 VAL 54 2HG1 VAL 54 -3.486 -5.566 -1.727 417 HG13 VAL 54 3HG1 VAL 54 -2.257 -6.329 -2.736 418 HG21 VAL 54 3HG2 VAL 54 -0.425 -4.596 -0.368 419 HG22 VAL 54 1HG2 VAL 54 0.247 -5.155 -1.899 420 HG23 VAL 54 2HG2 VAL 54 0.122 -3.427 -1.570 421 H VAL 55 H VAL 55 -3.260 -2.049 -3.736 422 HA VAL 55 HA VAL 55 -1.098 -0.044 -3.820 423 HB VAL 55 HB VAL 55 -3.748 0.135 -5.259 424 HG11 VAL 55 1HG1 VAL 55 -2.789 2.292 -4.528 425 HG12 VAL 55 2HG1 VAL 55 -1.318 1.913 -5.427 426 HG13 VAL 55 3HG1 VAL 55 -2.845 2.128 -6.284 427 HG21 VAL 55 3HG2 VAL 55 -1.013 -0.677 -6.180 428 HG22 VAL 55 1HG2 VAL 55 -2.564 -1.468 -6.465 429 HG23 VAL 55 2HG2 VAL 55 -2.176 0.038 -7.296 430 H LEU 56 H LEU 56 -1.122 0.813 -1.823 431 HA LEU 56 HA LEU 56 -3.703 1.509 -0.612 432 HB2 LEU 56 1HB LEU 56 -0.998 1.587 0.700 433 HB3 LEU 56 2HB LEU 56 -2.579 1.624 1.479 434 HG LEU 56 HG LEU 56 -1.118 -0.702 0.283 435 HD11 LEU 56 1HD1 LEU 56 -1.125 -1.549 2.383 436 HD12 LEU 56 2HD1 LEU 56 -2.675 -0.816 2.796 437 HD13 LEU 56 3HD1 LEU 56 -1.207 0.163 2.801 438 HD21 LEU 56 3HD2 LEU 56 -3.474 -1.803 0.963 439 HD22 LEU 56 1HD2 LEU 56 -3.071 -1.297 -0.678 440 HD23 LEU 56 2HD2 LEU 56 -4.030 -0.241 0.359 441 H LEU 57 H LEU 57 -4.257 3.579 -0.131 442 HA LEU 57 HA LEU 57 -2.525 5.672 -1.231 443 HB2 LEU 57 1HB LEU 57 -4.723 5.674 -2.155 444 HB3 LEU 57 2HB LEU 57 -5.456 5.609 -0.554 445 HG LEU 57 HG LEU 57 -4.601 7.898 -0.122 446 HD11 LEU 57 1HD1 LEU 57 -3.158 7.375 -2.539 447 HD12 LEU 57 2HD1 LEU 57 -3.009 8.730 -1.420 448 HD13 LEU 57 3HD1 LEU 57 -4.170 8.805 -2.744 449 HD21 LEU 57 3HD2 LEU 57 -6.097 8.934 -2.032 450 HD22 LEU 57 1HD2 LEU 57 -6.804 7.999 -0.714 451 HD23 LEU 57 2HD2 LEU 57 -6.534 7.244 -2.286 452 H ALA 58 H ALA 58 -2.148 7.618 -0.070 453 HA ALA 58 HA ALA 58 -1.951 7.188 2.803 454 HB1 ALA 58 3HB ALA 58 -0.598 8.908 0.824 455 HB2 ALA 58 1HB ALA 58 -0.795 9.588 2.440 456 HB3 ALA 58 2HB ALA 58 0.052 8.055 2.224 457 HA PRO 59 HA PRO 59 -5.207 9.859 4.037 458 HB2 PRO 59 1HB PRO 59 -4.132 11.145 6.172 459 HB3 PRO 59 2HB PRO 59 -4.599 9.440 6.212 460 HG2 PRO 59 1HG PRO 59 -1.889 10.655 5.827 461 HG3 PRO 59 2HG PRO 59 -2.361 9.263 6.819 462 HD2 PRO 59 1HD PRO 59 -1.216 8.992 4.381 463 HD3 PRO 59 2HD PRO 59 -2.397 7.829 5.015 464 H GLN 60 H GLN 60 -5.757 12.179 4.553 465 HA GLN 60 HA GLN 60 -5.815 14.377 3.971 466 HB2 GLN 60 1HB GLN 60 -2.847 14.207 3.476 467 HB3 GLN 60 2HB GLN 60 -3.789 15.619 3.936 468 HG2 GLN 60 1HG GLN 60 -4.255 13.828 5.983 469 HG3 GLN 60 2HG GLN 60 -2.555 13.586 5.588 470 HE21 GLN 60 2HE2 GLN 60 -4.721 15.405 7.334 471 HE22 GLN 60 1HE2 GLN 60 -3.700 16.743 7.724 472 H SER 61 H SER 61 -6.685 12.837 2.022 473 HA SER 61 HA SER 61 -5.443 13.936 -0.415 474 HB2 SER 61 1HB SER 61 -6.507 11.834 -1.516 475 HB3 SER 61 2HB SER 61 -5.009 11.645 -0.605 476 HG SER 61 HG SER 61 -7.559 11.272 0.562 477 H ARG 62 H ARG 62 -6.717 15.185 -1.611 478 HA ARG 62 HA ARG 62 -9.539 15.393 -0.915 479 HB2 ARG 62 1HB ARG 62 -7.896 17.371 -1.253 480 HB3 ARG 62 2HB ARG 62 -8.139 17.079 -2.970 481 HG2 ARG 62 1HG ARG 62 -10.538 17.434 -2.698 482 HG3 ARG 62 2HG ARG 62 -10.299 17.720 -0.974 483 HD2 ARG 62 1HD ARG 62 -9.068 19.352 -3.191 484 HD3 ARG 62 2HD ARG 62 -10.506 19.807 -2.278 485 HE ARG 62 HE ARG 62 -8.450 19.313 -0.457 486 HH11 ARG 62 1HH1 ARG 62 -9.245 21.573 -2.984 487 HH12 ARG 62 2HH1 ARG 62 -8.356 22.879 -2.274 488 HH21 ARG 62 1HH2 ARG 62 -7.278 21.026 0.488 489 HH22 ARG 62 2HH2 ARG 62 -7.237 22.567 -0.299 490 H PHE 63 H PHE 63 -7.765 15.423 -4.012 491 HA PHE 63 HA PHE 63 -10.057 14.080 -5.255 492 HB2 PHE 63 1HB PHE 63 -7.697 15.424 -6.587 493 HB3 PHE 63 2HB PHE 63 -9.154 14.835 -7.382 494 HD1 PHE 63 HD2 PHE 63 -11.385 15.894 -6.638 495 HD2 PHE 63 HD1 PHE 63 -7.570 17.622 -5.882 496 HE1 PHE 63 HE2 PHE 63 -12.446 18.092 -6.323 497 HE2 PHE 63 HE1 PHE 63 -8.624 19.822 -5.563 498 HZ PHE 63 HZ PHE 63 -11.066 20.059 -5.786 499 H ASN 64 H ASN 64 -6.810 13.571 -4.277 500 HA ASN 64 HA ASN 64 -5.875 11.652 -6.022 501 HB2 ASN 64 1HB ASN 64 -4.956 12.714 -3.703 502 HB3 ASN 64 2HB ASN 64 -5.381 11.093 -3.160 503 HD21 ASN 64 2HD2 ASN 64 -2.768 12.263 -3.341 504 HD22 ASN 64 1HD2 ASN 64 -1.855 11.288 -4.437 505 H LYS 65 H LYS 65 -7.680 11.039 -3.007 506 HA LYS 65 HA LYS 65 -7.975 8.274 -3.397 507 HB2 LYS 65 1HB LYS 65 -9.713 8.394 -1.681 508 HB3 LYS 65 2HB LYS 65 -8.313 9.355 -1.224 509 HG2 LYS 65 1HG LYS 65 -9.676 11.061 -0.868 510 HG3 LYS 65 2HG LYS 65 -10.009 11.103 -2.601 511 HD2 LYS 65 1HD LYS 65 -11.935 9.774 -2.371 512 HD3 LYS 65 2HD LYS 65 -11.483 9.254 -0.747 513 HE2 LYS 65 1HE LYS 65 -12.802 10.873 0.023 514 HE3 LYS 65 2HE LYS 65 -11.606 12.021 -0.576 515 HZ1 LYS 65 3HZ LYS 65 -13.242 11.217 -2.711 516 HZ2 LYS 65 1HZ LYS 65 -13.081 12.759 -2.031 517 HZ3 LYS 65 2HZ LYS 65 -14.241 11.684 -1.428 518 H LYS 66 H LYS 66 -9.794 11.004 -4.583 519 HA LYS 66 HA LYS 66 -12.141 9.660 -5.361 520 HB2 LYS 66 1HB LYS 66 -11.024 12.276 -5.642 521 HB3 LYS 66 2HB LYS 66 -11.605 11.747 -7.216 522 HG2 LYS 66 1HG LYS 66 -13.790 11.198 -6.130 523 HG3 LYS 66 2HG LYS 66 -13.180 11.966 -4.663 524 HD2 LYS 66 1HD LYS 66 -14.050 13.852 -5.503 525 HD3 LYS 66 2HD LYS 66 -12.653 13.852 -6.583 526 HE2 LYS 66 1HE LYS 66 -14.020 12.488 -8.186 527 HE3 LYS 66 2HE LYS 66 -15.409 12.770 -7.139 528 HZ1 LYS 66 3HZ LYS 66 -14.620 14.373 -9.178 529 HZ2 LYS 66 1HZ LYS 66 -14.007 15.178 -7.822 530 HZ3 LYS 66 2HZ LYS 66 -15.659 14.826 -7.921 531 H ARG 67 H ARG 67 -9.582 10.843 -7.547 532 HA ARG 67 HA ARG 67 -10.349 9.343 -9.759 533 HB2 ARG 67 1HB ARG 67 -7.854 10.725 -8.916 534 HB3 ARG 67 2HB ARG 67 -7.731 9.580 -10.245 535 HG2 ARG 67 1HG ARG 67 -8.894 10.894 -11.669 536 HG3 ARG 67 2HG ARG 67 -9.928 11.548 -10.397 537 HD2 ARG 67 1HD ARG 67 -8.144 12.988 -9.636 538 HD3 ARG 67 2HD ARG 67 -7.028 12.271 -10.798 539 HE ARG 67 HE ARG 67 -9.328 13.390 -12.062 540 HH11 ARG 67 1HH1 ARG 67 -6.233 14.164 -10.671 541 HH12 ARG 67 2HH1 ARG 67 -6.021 15.601 -11.616 542 HH21 ARG 67 1HH2 ARG 67 -9.062 15.280 -13.312 543 HH22 ARG 67 2HH2 ARG 67 -7.631 16.234 -13.118 544 H LEU 68 H LEU 68 -7.906 8.589 -7.288 545 HA LEU 68 HA LEU 68 -6.941 6.209 -8.280 546 HB2 LEU 68 1HB LEU 68 -7.350 7.243 -5.507 547 HB3 LEU 68 2HB LEU 68 -6.775 5.594 -5.751 548 HG LEU 68 HG LEU 68 -5.364 7.952 -6.968 549 HD11 LEU 68 1HD1 LEU 68 -5.417 8.452 -4.634 550 HD12 LEU 68 2HD1 LEU 68 -3.820 7.812 -5.015 551 HD13 LEU 68 3HD1 LEU 68 -5.011 6.789 -4.212 552 HD21 LEU 68 3HD2 LEU 68 -5.069 5.236 -7.286 553 HD22 LEU 68 1HD2 LEU 68 -3.844 5.633 -6.081 554 HD23 LEU 68 2HD2 LEU 68 -3.847 6.459 -7.639 555 H GLU 69 H GLU 69 -9.654 6.576 -5.992 556 HA GLU 69 HA GLU 69 -10.390 3.864 -5.988 557 HB2 GLU 69 1HB GLU 69 -11.811 6.407 -5.267 558 HB3 GLU 69 2HB GLU 69 -12.680 4.879 -5.267 559 HG2 GLU 69 1HG GLU 69 -10.180 5.425 -3.684 560 HG3 GLU 69 2HG GLU 69 -11.820 5.534 -3.048 561 H GLU 70 H GLU 70 -11.471 6.590 -7.963 562 HA GLU 70 HA GLU 70 -13.545 5.248 -9.314 563 HB2 GLU 70 1HB GLU 70 -11.860 7.641 -10.030 564 HB3 GLU 70 2HB GLU 70 -13.132 7.045 -11.088 565 HG2 GLU 70 1HG GLU 70 -14.061 7.376 -8.368 566 HG3 GLU 70 2HG GLU 70 -13.406 8.871 -9.032 567 H ILE 71 H ILE 71 -10.117 5.143 -9.656 568 HA ILE 71 HA ILE 71 -10.257 3.922 -12.302 569 HB ILE 71 HB ILE 71 -7.864 4.555 -10.571 570 HG12 ILE 71 1HG1 ILE 71 -8.435 5.920 -13.158 571 HG13 ILE 71 2HG1 ILE 71 -9.396 6.384 -11.759 572 HG21 ILE 71 1HG2 ILE 71 -6.893 3.002 -11.876 573 HG22 ILE 71 2HG2 ILE 71 -8.174 3.068 -13.086 574 HG23 ILE 71 3HG2 ILE 71 -6.899 4.287 -13.085 575 HD11 ILE 71 3HD1 ILE 71 -7.137 6.675 -10.573 576 HD12 ILE 71 1HD1 ILE 71 -6.456 6.670 -12.199 577 HD13 ILE 71 2HD1 ILE 71 -7.643 7.893 -11.744 578 H THR 72 H THR 72 -9.546 3.089 -8.963 579 HA THR 72 HA THR 72 -8.561 0.478 -9.458 580 HB THR 72 HB THR 72 -8.963 0.056 -7.072 581 HG1 THR 72 HG1 THR 72 -10.574 2.322 -7.372 582 HG21 THR 72 3HG2 THR 72 -7.082 1.174 -6.657 583 HG22 THR 72 1HG2 THR 72 -7.948 2.710 -6.676 584 HG23 THR 72 2HG2 THR 72 -7.300 2.043 -8.175 585 H LYS 73 H LYS 73 -11.781 1.781 -8.888 586 HA LYS 73 HA LYS 73 -13.224 -0.513 -8.396 587 HB2 LYS 73 1HB LYS 73 -13.794 2.158 -9.410 588 HB3 LYS 73 2HB LYS 73 -14.878 0.947 -10.081 589 HG2 LYS 73 1HG LYS 73 -14.651 0.460 -7.299 590 HG3 LYS 73 2HG LYS 73 -14.958 2.182 -7.533 591 HD2 LYS 73 1HD LYS 73 -16.969 1.782 -8.674 592 HD3 LYS 73 2HD LYS 73 -16.569 0.086 -8.957 593 HE2 LYS 73 1HE LYS 73 -18.119 -0.047 -7.243 594 HE3 LYS 73 2HE LYS 73 -16.587 -0.090 -6.371 595 HZ1 LYS 73 3HZ LYS 73 -16.829 2.131 -5.715 596 HZ2 LYS 73 1HZ LYS 73 -18.360 1.450 -5.481 597 HZ3 LYS 73 2HZ LYS 73 -18.068 2.431 -6.827 598 HA PRO 74 HA PRO 74 -13.815 -1.246 -13.127 599 HB2 PRO 74 1HB PRO 74 -12.354 0.283 -14.830 600 HB3 PRO 74 2HB PRO 74 -13.954 0.755 -14.248 601 HG2 PRO 74 1HG PRO 74 -11.257 1.630 -13.290 602 HG3 PRO 74 2HG PRO 74 -12.714 2.601 -13.566 603 HD2 PRO 74 1HD PRO 74 -11.951 1.788 -11.099 604 HD3 PRO 74 2HD PRO 74 -13.656 1.990 -11.553 605 H LYS 75 H LYS 75 -10.567 -0.194 -12.186 606 HA LYS 75 HA LYS 75 -9.137 -1.962 -13.856 607 HB2 LYS 75 1HB LYS 75 -8.470 -0.429 -11.366 608 HB3 LYS 75 2HB LYS 75 -7.323 -1.596 -12.012 609 HG2 LYS 75 1HG LYS 75 -8.445 0.413 -13.882 610 HG3 LYS 75 2HG LYS 75 -7.267 0.959 -12.686 611 HD2 LYS 75 1HD LYS 75 -5.562 -0.213 -13.634 612 HD3 LYS 75 2HD LYS 75 -6.620 -1.513 -14.188 613 HE2 LYS 75 1HE LYS 75 -7.532 0.481 -15.725 614 HE3 LYS 75 2HE LYS 75 -5.871 1.029 -15.505 615 HZ1 LYS 75 3HZ LYS 75 -6.882 -1.141 -17.083 616 HZ2 LYS 75 1HZ LYS 75 -5.602 -1.612 -16.080 617 HZ3 LYS 75 2HZ LYS 75 -5.394 -0.340 -17.177 618 H GLY 76 H GLY 76 -10.785 -2.406 -10.846 619 HA2 GLY 76 1HA GLY 76 -11.144 -4.267 -9.554 620 HA3 GLY 76 2HA GLY 76 -10.691 -5.204 -10.970 621 H ILE 77 H ILE 77 -9.139 -3.190 -8.469 622 HA ILE 77 HA ILE 77 -7.172 -5.335 -8.089 623 HB ILE 77 HB ILE 77 -5.393 -3.580 -7.812 624 HG12 ILE 77 1HG1 ILE 77 -6.566 -1.633 -9.560 625 HG13 ILE 77 2HG1 ILE 77 -7.617 -1.854 -8.166 626 HG21 ILE 77 1HG2 ILE 77 -5.090 -3.263 -10.284 627 HG22 ILE 77 2HG2 ILE 77 -5.360 -4.927 -9.769 628 HG23 ILE 77 3HG2 ILE 77 -6.675 -4.007 -10.502 629 HD11 ILE 77 3HD1 ILE 77 -4.685 -1.188 -8.065 630 HD12 ILE 77 1HD1 ILE 77 -6.015 -0.056 -7.817 631 HD13 ILE 77 2HD1 ILE 77 -5.755 -1.378 -6.677 632 HA PRO 78 HA PRO 78 -7.800 -4.693 -3.791 633 HB2 PRO 78 1HB PRO 78 -5.354 -5.329 -2.799 634 HB3 PRO 78 2HB PRO 78 -6.473 -6.536 -3.443 635 HG2 PRO 78 1HG PRO 78 -4.113 -5.248 -4.760 636 HG3 PRO 78 2HG PRO 78 -4.617 -6.948 -4.783 637 HD2 PRO 78 1HD PRO 78 -5.114 -5.253 -6.836 638 HD3 PRO 78 2HD PRO 78 -6.209 -6.585 -6.410 639 H ILE 79 H ILE 79 -8.145 -2.468 -3.628 640 HA ILE 79 HA ILE 79 -5.752 -0.852 -3.038 641 HB ILE 79 HB ILE 79 -6.971 -0.055 -5.016 642 HG12 ILE 79 1HG1 ILE 79 -7.706 2.230 -3.587 643 HG13 ILE 79 2HG1 ILE 79 -6.445 1.485 -2.610 644 HG21 ILE 79 1HG2 ILE 79 -9.218 0.780 -4.882 645 HG22 ILE 79 2HG2 ILE 79 -9.200 -0.884 -4.297 646 HG23 ILE 79 3HG2 ILE 79 -9.282 0.454 -3.150 647 HD11 ILE 79 3HD1 ILE 79 -5.056 2.626 -3.930 648 HD12 ILE 79 1HD1 ILE 79 -5.363 1.340 -5.097 649 HD13 ILE 79 2HD1 ILE 79 -6.274 2.847 -5.187 650 H GLU 80 H GLU 80 -5.563 -0.003 -1.062 651 HA GLU 80 HA GLU 80 -7.956 0.094 0.653 652 HB2 GLU 80 1HB GLU 80 -5.675 -1.544 1.001 653 HB3 GLU 80 2HB GLU 80 -5.583 -0.284 2.223 654 HG2 GLU 80 1HG GLU 80 -8.082 -1.876 1.783 655 HG3 GLU 80 2HG GLU 80 -6.785 -2.442 2.833 656 H ILE 81 H ILE 81 -7.594 1.527 2.603 657 HA ILE 81 HA ILE 81 -5.808 3.779 1.987 658 HB ILE 81 HB ILE 81 -8.701 4.051 2.815 659 HG12 ILE 81 1HG1 ILE 81 -7.295 4.763 0.232 660 HG13 ILE 81 2HG1 ILE 81 -8.449 3.453 0.452 661 HG21 ILE 81 1HG2 ILE 81 -7.526 6.497 1.962 662 HG22 ILE 81 2HG2 ILE 81 -8.207 6.089 3.536 663 HG23 ILE 81 3HG2 ILE 81 -6.501 5.787 3.209 664 HD11 ILE 81 3HD1 ILE 81 -8.949 6.132 -0.263 665 HD12 ILE 81 1HD1 ILE 81 -10.110 4.830 -0.013 666 HD13 ILE 81 2HD1 ILE 81 -9.650 5.873 1.334 667 H ILE 82 H ILE 82 -4.634 4.408 3.676 668 HA ILE 82 HA ILE 82 -4.936 3.127 6.214 669 HB ILE 82 HB ILE 82 -3.156 5.485 5.612 670 HG12 ILE 82 1HG1 ILE 82 -2.584 2.544 5.181 671 HG13 ILE 82 2HG1 ILE 82 -2.818 3.738 3.909 672 HG21 ILE 82 1HG2 ILE 82 -2.711 3.207 7.524 673 HG22 ILE 82 2HG2 ILE 82 -1.838 4.735 7.428 674 HG23 ILE 82 3HG2 ILE 82 -3.510 4.709 7.987 675 HD11 ILE 82 3HD1 ILE 82 -0.835 4.960 4.836 676 HD12 ILE 82 1HD1 ILE 82 -0.557 3.564 5.877 677 HD13 ILE 82 2HD1 ILE 82 -0.492 3.384 4.123 678 H ASN 83 H ASN 83 -5.762 3.894 8.089 679 HA ASN 83 HA ASN 83 -7.496 6.182 7.952 680 HB2 ASN 83 1HB ASN 83 -6.923 4.047 9.957 681 HB3 ASN 83 2HB ASN 83 -7.688 5.531 10.517 682 HD21 ASN 83 2HD2 ASN 83 -8.461 2.571 9.886 683 HD22 ASN 83 1HD2 ASN 83 -9.997 2.750 9.114 684 H THR 84 H THR 84 -7.404 8.028 9.306 685 HA THR 84 HA THR 84 -4.982 9.341 9.433 686 HB THR 84 HB THR 84 -6.875 10.097 11.566 687 HG1 THR 84 HG1 THR 84 -8.305 10.930 9.792 688 HG21 THR 84 3HG2 THR 84 -6.383 11.948 9.367 689 HG22 THR 84 1HG2 THR 84 -4.898 11.330 10.091 690 HG23 THR 84 2HG2 THR 84 -6.096 12.146 11.096 691 H ILE 85 H ILE 85 -6.479 7.239 11.811 692 HA ILE 85 HA ILE 85 -4.645 7.860 13.915 693 HB ILE 85 HB ILE 85 -6.355 5.388 13.650 694 HG12 ILE 85 1HG1 ILE 85 -7.551 7.199 15.431 695 HG13 ILE 85 2HG1 ILE 85 -7.103 8.157 14.023 696 HG21 ILE 85 1HG2 ILE 85 -5.332 6.760 16.127 697 HG22 ILE 85 2HG2 ILE 85 -6.158 5.206 16.022 698 HG23 ILE 85 3HG2 ILE 85 -4.534 5.387 15.361 699 HD11 ILE 85 3HD1 ILE 85 -9.233 6.233 14.357 700 HD12 ILE 85 1HD1 ILE 85 -9.005 7.469 13.119 701 HD13 ILE 85 2HD1 ILE 85 -8.241 5.889 12.940 702 H ASP 86 H ASP 86 -5.033 5.050 11.758 703 HA ASP 86 HA ASP 86 -2.865 3.561 12.630 704 HB2 ASP 86 1HB ASP 86 -4.270 3.776 9.987 705 HB3 ASP 86 2HB ASP 86 -2.843 2.756 10.148 706 H TYR 87 H TYR 87 -2.972 6.107 10.167 707 HA TYR 87 HA TYR 87 -0.203 5.897 9.504 708 HB2 TYR 87 1HB TYR 87 -1.887 6.814 7.944 709 HB3 TYR 87 2HB TYR 87 -2.122 8.187 9.020 710 HD1 TYR 87 HD2 TYR 87 -0.425 9.926 9.208 711 HD2 TYR 87 HD1 TYR 87 0.103 6.629 6.573 712 HE1 TYR 87 HE2 TYR 87 1.394 11.131 8.075 713 HE2 TYR 87 HE1 TYR 87 1.925 7.825 5.431 714 HH TYR 87 HH TYR 87 3.028 10.998 6.561 715 H GLY 88 H GLY 88 -2.090 8.235 11.420 716 HA2 GLY 88 1HA GLY 88 -0.058 9.951 12.171 717 HA3 GLY 88 2HA GLY 88 -1.465 9.596 13.162 718 H THR 89 H THR 89 -0.852 6.791 13.493 719 HA THR 89 HA THR 89 1.068 7.062 15.646 720 HB THR 89 HB THR 89 0.392 4.864 16.348 721 HG1 THR 89 HG1 THR 89 -1.129 4.689 13.944 722 HG21 THR 89 3HG2 THR 89 -1.433 7.001 15.957 723 HG22 THR 89 1HG2 THR 89 -1.460 5.757 17.205 724 HG23 THR 89 2HG2 THR 89 -2.303 5.493 15.679 725 H MET 90 H MET 90 0.952 5.800 12.429 726 HA MET 90 HA MET 90 2.528 4.864 11.085 727 HB2 MET 90 1HB MET 90 4.560 5.501 13.218 728 HB3 MET 90 2HB MET 90 4.822 5.347 11.485 729 HG2 MET 90 1HG MET 90 3.212 7.354 11.298 730 HG3 MET 90 2HG MET 90 3.561 7.586 13.010 731 HE1 MET 90 3HE MET 90 6.030 6.975 13.705 732 HE2 MET 90 1HE MET 90 7.139 6.525 12.408 733 HE3 MET 90 2HE MET 90 7.284 8.103 13.184 734 H ASN 91 H ASN 91 1.277 2.896 11.875 735 HA ASN 91 HA ASN 91 2.953 1.104 13.482 736 HB2 ASN 91 1HB ASN 91 0.046 1.300 12.929 737 HB3 ASN 91 2HB ASN 91 0.701 -0.325 13.103 738 HD21 ASN 91 2HD2 ASN 91 0.012 -0.938 15.044 739 HD22 ASN 91 1HD2 ASN 91 0.296 -0.083 16.518 740 H GLY 92 H GLY 92 4.487 0.430 12.008 741 HA2 GLY 92 1HA GLY 92 4.134 -0.245 9.351 742 HA3 GLY 92 2HA GLY 92 5.353 -0.959 10.396 743 H GLU 93 H GLU 93 3.849 -2.392 12.174 744 HA GLU 93 HA GLU 93 3.360 -4.766 10.820 745 HB2 GLU 93 1HB GLU 93 3.771 -4.573 13.261 746 HB3 GLU 93 2HB GLU 93 2.154 -3.910 13.456 747 HG2 GLU 93 1HG GLU 93 1.284 -6.047 12.443 748 HG3 GLU 93 2HG GLU 93 2.920 -6.684 12.601 749 H LYS 94 H LYS 94 1.033 -2.337 11.964 750 HA LYS 94 HA LYS 94 -1.289 -3.657 11.095 751 HB2 LYS 94 1HB LYS 94 -0.678 -0.747 11.593 752 HB3 LYS 94 2HB LYS 94 -2.277 -1.303 11.117 753 HG2 LYS 94 1HG LYS 94 -0.839 -2.378 13.525 754 HG3 LYS 94 2HG LYS 94 -1.890 -0.960 13.587 755 HD2 LYS 94 1HD LYS 94 -3.794 -2.210 13.019 756 HD3 LYS 94 2HD LYS 94 -2.832 -3.576 12.448 757 HE2 LYS 94 1HE LYS 94 -2.092 -3.188 15.120 758 HE3 LYS 94 2HE LYS 94 -3.847 -3.021 15.087 759 HZ1 LYS 94 3HZ LYS 94 -2.190 -5.352 14.408 760 HZ2 LYS 94 1HZ LYS 94 -3.699 -5.170 13.665 761 HZ3 LYS 94 2HZ LYS 94 -3.593 -5.270 15.349 762 H VAL 95 H VAL 95 0.885 -1.408 9.464 763 HA VAL 95 HA VAL 95 -0.670 -0.977 7.160 764 HB VAL 95 HB VAL 95 2.342 -0.944 7.396 765 HG11 VAL 95 1HG1 VAL 95 1.943 0.819 5.513 766 HG12 VAL 95 2HG1 VAL 95 1.972 -0.901 5.120 767 HG13 VAL 95 3HG1 VAL 95 0.431 -0.058 5.279 768 HG21 VAL 95 3HG2 VAL 95 0.446 0.680 8.667 769 HG22 VAL 95 1HG2 VAL 95 2.182 0.962 8.529 770 HG23 VAL 95 2HG2 VAL 95 1.080 1.640 7.330 771 H LEU 96 H LEU 96 2.268 -2.988 7.397 772 HA LEU 96 HA LEU 96 2.003 -4.312 4.989 773 HB2 LEU 96 1HB LEU 96 3.345 -6.138 6.079 774 HB3 LEU 96 2HB LEU 96 4.035 -4.519 6.161 775 HG LEU 96 HG LEU 96 2.658 -4.688 8.525 776 HD11 LEU 96 1HD1 LEU 96 4.088 -7.299 8.374 777 HD12 LEU 96 2HD1 LEU 96 2.418 -7.194 7.816 778 HD13 LEU 96 3HD1 LEU 96 2.820 -6.769 9.480 779 HD21 LEU 96 3HD2 LEU 96 4.890 -3.785 8.238 780 HD22 LEU 96 1HD2 LEU 96 5.533 -5.403 7.954 781 HD23 LEU 96 2HD2 LEU 96 4.882 -4.977 9.537 782 H GLN 97 H GLN 97 0.582 -5.105 8.121 783 HA GLN 97 HA GLN 97 -0.466 -7.619 7.454 784 HB2 GLN 97 1HB GLN 97 -1.144 -5.547 9.505 785 HB3 GLN 97 2HB GLN 97 -2.216 -6.924 9.283 786 HG2 GLN 97 1HG GLN 97 0.720 -7.299 9.728 787 HG3 GLN 97 2HG GLN 97 -0.392 -7.064 11.076 788 HE21 GLN 97 2HE2 GLN 97 0.463 -9.142 8.397 789 HE22 GLN 97 1HE2 GLN 97 -0.337 -10.555 8.986 790 H LEU 98 H LEU 98 -1.930 -4.386 7.274 791 HA LEU 98 HA LEU 98 -4.447 -5.196 6.342 792 HB2 LEU 98 1HB LEU 98 -3.183 -2.794 6.947 793 HB3 LEU 98 2HB LEU 98 -3.605 -2.655 5.241 794 HG LEU 98 HG LEU 98 -5.533 -3.240 7.488 795 HD11 LEU 98 1HD1 LEU 98 -5.523 -0.764 5.818 796 HD12 LEU 98 2HD1 LEU 98 -4.457 -0.889 7.216 797 HD13 LEU 98 3HD1 LEU 98 -6.203 -1.035 7.423 798 HD21 LEU 98 3HD2 LEU 98 -5.716 -3.615 4.650 799 HD22 LEU 98 1HD2 LEU 98 -6.854 -2.372 5.170 800 HD23 LEU 98 2HD2 LEU 98 -6.904 -3.974 5.905 801 H ALA 99 H ALA 99 -1.647 -3.967 4.510 802 HA ALA 99 HA ALA 99 -2.694 -4.208 1.956 803 HB1 ALA 99 3HB ALA 99 -0.118 -3.776 3.121 804 HB2 ALA 99 1HB ALA 99 0.028 -4.895 1.767 805 HB3 ALA 99 2HB ALA 99 -0.710 -3.311 1.527 806 H ILE 100 H ILE 100 -0.575 -6.575 3.591 807 HA ILE 100 HA ILE 100 -0.742 -8.586 1.687 808 HB ILE 100 HB ILE 100 -0.466 -8.922 4.677 809 HG12 ILE 100 1HG1 ILE 100 1.756 -8.923 2.645 810 HG13 ILE 100 2HG1 ILE 100 1.201 -7.431 3.395 811 HG21 ILE 100 1HG2 ILE 100 -0.632 -11.098 4.223 812 HG22 ILE 100 2HG2 ILE 100 -0.546 -10.823 2.484 813 HG23 ILE 100 3HG2 ILE 100 0.937 -10.944 3.431 814 HD11 ILE 100 3HD1 ILE 100 2.976 -9.442 4.413 815 HD12 ILE 100 1HD1 ILE 100 2.619 -7.834 5.042 816 HD13 ILE 100 2HD1 ILE 100 1.611 -9.206 5.504 817 H ASN 101 H ASN 101 -2.760 -8.100 4.577 818 HA ASN 101 HA ASN 101 -4.381 -10.326 4.381 819 HB2 ASN 101 1HB ASN 101 -4.451 -8.786 6.285 820 HB3 ASN 101 2HB ASN 101 -5.168 -7.540 5.268 821 HD21 ASN 101 2HD2 ASN 101 -7.115 -7.302 6.171 822 HD22 ASN 101 1HD2 ASN 101 -8.285 -8.562 6.343 823 H ALA 102 H ALA 102 -4.847 -7.147 2.859 824 HA ALA 102 HA ALA 102 -7.270 -7.753 1.565 825 HB1 ALA 102 3HB ALA 102 -7.067 -5.546 1.331 826 HB2 ALA 102 1HB ALA 102 -5.315 -5.604 1.525 827 HB3 ALA 102 2HB ALA 102 -6.038 -5.892 -0.058 828 H PHE 103 H PHE 103 -3.902 -8.029 0.494 829 HA PHE 103 HA PHE 103 -4.342 -8.727 -2.159 830 HB2 PHE 103 1HB PHE 103 -2.121 -8.210 -1.186 831 HB3 PHE 103 2HB PHE 103 -2.148 -9.760 -0.351 832 HD1 PHE 103 HD1 PHE 103 -2.806 -8.579 -3.833 833 HD2 PHE 103 HD2 PHE 103 -0.788 -11.336 -1.294 834 HE1 PHE 103 HE1 PHE 103 -1.800 -9.652 -5.805 835 HE2 PHE 103 HE2 PHE 103 0.222 -12.413 -3.261 836 HZ PHE 103 HZ PHE 103 -0.282 -11.572 -5.520 837 H ASN 104 H ASN 104 -3.843 -10.922 0.608 838 HA ASN 104 HA ASN 104 -4.329 -13.301 -0.791 839 HB2 ASN 104 1HB ASN 104 -4.354 -12.512 2.093 840 HB3 ASN 104 2HB ASN 104 -5.012 -14.083 1.641 841 HD21 ASN 104 2HD2 ASN 104 -2.796 -13.780 3.281 842 HD22 ASN 104 1HD2 ASN 104 -1.407 -14.400 2.462 843 H ASN 105 H ASN 105 -6.513 -11.179 1.013 844 HA ASN 105 HA ASN 105 -8.811 -12.762 0.890 845 HB2 ASN 105 1HB ASN 105 -8.835 -10.883 2.346 846 HB3 ASN 105 2HB ASN 105 -8.431 -9.774 1.039 847 HD21 ASN 105 2HD2 ASN 105 -10.919 -11.429 2.705 848 HD22 ASN 105 1HD2 ASN 105 -12.254 -10.774 1.825 849 H LYS 106 H LYS 106 -7.445 -10.491 -1.428 850 HA LYS 106 HA LYS 106 -9.686 -10.805 -3.244 851 HB2 LYS 106 1HB LYS 106 -7.406 -8.999 -2.975 852 HB3 LYS 106 2HB LYS 106 -7.685 -9.498 -4.638 853 HG2 LYS 106 1HG LYS 106 -9.812 -8.339 -2.853 854 HG3 LYS 106 2HG LYS 106 -8.832 -7.391 -3.976 855 HD2 LYS 106 1HD LYS 106 -9.716 -9.370 -5.606 856 HD3 LYS 106 2HD LYS 106 -11.081 -9.217 -4.498 857 HE2 LYS 106 1HE LYS 106 -9.866 -6.762 -5.686 858 HE3 LYS 106 2HE LYS 106 -10.952 -7.750 -6.662 859 HZ1 LYS 106 3HZ LYS 106 -12.060 -7.310 -4.095 860 HZ2 LYS 106 1HZ LYS 106 -12.689 -6.899 -5.612 861 HZ3 LYS 106 2HZ LYS 106 -11.655 -5.830 -4.806 862 H SER 107 H SER 107 -9.359 -11.485 -5.484 863 HA SER 107 HA SER 107 -7.395 -13.672 -5.645 864 HB2 SER 107 1HB SER 107 -9.237 -14.053 -7.698 865 HB3 SER 107 2HB SER 107 -9.198 -14.911 -6.158 866 HG SER 107 HG SER 107 -11.026 -13.987 -5.740 867 H SER 108 H SER 108 -5.658 -13.094 -6.767 868 HA SER 108 HA SER 108 -5.988 -11.311 -9.081 869 HB2 SER 108 1HB SER 108 -3.789 -10.566 -8.765 870 HB3 SER 108 2HB SER 108 -4.379 -10.772 -7.117 871 HG SER 108 HG SER 108 -2.271 -11.895 -8.217 872 H VAL 109 H VAL 109 -6.606 -14.132 -9.175 873 HA VAL 109 HA VAL 109 -4.860 -14.855 -11.392 874 HB VAL 109 HB VAL 109 -4.523 -17.142 -10.597 875 HG11 VAL 109 1HG1 VAL 109 -2.843 -16.686 -8.925 876 HG12 VAL 109 2HG1 VAL 109 -2.840 -15.391 -10.124 877 HG13 VAL 109 3HG1 VAL 109 -3.591 -15.135 -8.548 878 HG21 VAL 109 3HG2 VAL 109 -5.774 -17.997 -8.973 879 HG22 VAL 109 1HG2 VAL 109 -5.066 -16.860 -7.826 880 HG23 VAL 109 2HG2 VAL 109 -6.525 -16.422 -8.714 Start of MODEL 10 1 H1 GLY 1 H GLY 1 11.016 -14.604 -11.997 2 HA2 GLY 1 1HA GLY 1 12.805 -12.315 -11.453 3 HA3 GLY 1 2HA GLY 1 11.051 -12.220 -11.378 4 HA PRO 2 HA PRO 2 12.869 -13.054 -7.129 5 HB2 PRO 2 1HB PRO 2 11.882 -10.819 -5.944 6 HB3 PRO 2 2HB PRO 2 13.455 -10.865 -6.748 7 HG2 PRO 2 1HG PRO 2 10.833 -9.848 -7.773 8 HG3 PRO 2 2HG PRO 2 12.448 -9.132 -7.927 9 HD2 PRO 2 1HD PRO 2 11.274 -10.524 -9.931 10 HD3 PRO 2 2HD PRO 2 13.031 -10.513 -9.676 11 H GLY 3 H GLY 3 11.705 -13.808 -5.353 12 HA2 GLY 3 1HA GLY 3 8.823 -14.123 -5.844 13 HA3 GLY 3 2HA GLY 3 9.807 -15.168 -4.831 14 H SER 4 H SER 4 8.756 -11.771 -5.037 15 HA SER 4 HA SER 4 8.086 -11.875 -2.191 16 HB2 SER 4 1HB SER 4 9.266 -9.862 -1.656 17 HB3 SER 4 2HB SER 4 10.412 -10.919 -2.480 18 HG SER 4 HG SER 4 10.687 -9.128 -3.601 19 H MET 5 H MET 5 6.529 -10.339 -1.531 20 HA MET 5 HA MET 5 4.785 -9.489 -3.694 21 HB2 MET 5 1HB MET 5 4.022 -10.658 -1.544 22 HB3 MET 5 2HB MET 5 4.284 -9.112 -0.748 23 HG2 MET 5 1HG MET 5 2.708 -8.790 -3.138 24 HG3 MET 5 2HG MET 5 1.985 -9.972 -2.049 25 HE1 MET 5 3HE MET 5 1.463 -9.611 0.343 26 HE2 MET 5 1HE MET 5 2.846 -8.701 0.952 27 HE3 MET 5 2HE MET 5 1.216 -8.054 1.136 28 H ASN 6 H ASN 6 5.254 -7.602 -4.623 29 HA ASN 6 HA ASN 6 6.528 -5.467 -3.156 30 HB2 ASN 6 1HB ASN 6 6.329 -6.222 -5.871 31 HB3 ASN 6 2HB ASN 6 5.572 -4.638 -5.738 32 HD21 ASN 6 2HD2 ASN 6 7.017 -3.388 -3.855 33 HD22 ASN 6 1HD2 ASN 6 8.661 -3.219 -4.359 34 H ILE 7 H ILE 7 5.564 -3.784 -2.215 35 HA ILE 7 HA ILE 7 2.662 -3.492 -2.564 36 HB ILE 7 HB ILE 7 4.433 -2.466 -0.343 37 HG12 ILE 7 1HG1 ILE 7 2.376 -4.683 -0.303 38 HG13 ILE 7 2HG1 ILE 7 4.115 -4.942 -0.406 39 HG21 ILE 7 1HG2 ILE 7 2.761 -1.006 -0.050 40 HG22 ILE 7 2HG2 ILE 7 1.672 -1.900 -1.109 41 HG23 ILE 7 3HG2 ILE 7 1.862 -2.389 0.575 42 HD11 ILE 7 3HD1 ILE 7 4.437 -4.518 1.776 43 HD12 ILE 7 1HD1 ILE 7 3.200 -3.261 1.829 44 HD13 ILE 7 2HD1 ILE 7 2.733 -4.961 1.890 45 H LEU 8 H LEU 8 1.736 -1.554 -3.109 46 HA LEU 8 HA LEU 8 3.598 0.551 -3.991 47 HB2 LEU 8 1HB LEU 8 2.097 -0.716 -5.662 48 HB3 LEU 8 2HB LEU 8 0.785 0.243 -4.981 49 HG LEU 8 HG LEU 8 1.694 1.155 -7.096 50 HD11 LEU 8 1HD1 LEU 8 2.456 3.218 -5.147 51 HD12 LEU 8 2HD1 LEU 8 0.871 2.488 -4.895 52 HD13 LEU 8 3HD1 LEU 8 1.252 3.257 -6.436 53 HD21 LEU 8 3HD2 LEU 8 4.059 2.352 -5.984 54 HD22 LEU 8 1HD2 LEU 8 3.873 1.390 -7.451 55 HD23 LEU 8 2HD2 LEU 8 4.163 0.593 -5.905 56 H LEU 9 H LEU 9 3.481 2.483 -3.050 57 HA LEU 9 HA LEU 9 1.081 3.114 -1.461 58 HB2 LEU 9 1HB LEU 9 3.273 2.608 -0.232 59 HB3 LEU 9 2HB LEU 9 3.827 4.160 -0.855 60 HG LEU 9 HG LEU 9 1.506 4.911 0.299 61 HD11 LEU 9 1HD1 LEU 9 1.862 3.659 2.633 62 HD12 LEU 9 2HD1 LEU 9 2.314 2.353 1.539 63 HD13 LEU 9 3HD1 LEU 9 0.723 3.101 1.407 64 HD21 LEU 9 3HD2 LEU 9 3.233 6.207 0.958 65 HD22 LEU 9 1HD2 LEU 9 4.338 4.842 1.121 66 HD23 LEU 9 2HD2 LEU 9 3.169 5.188 2.397 67 H VAL 10 H VAL 10 0.049 4.938 -1.959 68 HA VAL 10 HA VAL 10 1.304 6.753 -3.893 69 HB VAL 10 HB VAL 10 -1.602 6.668 -3.084 70 HG11 VAL 10 1HG1 VAL 10 -1.901 7.832 -5.262 71 HG12 VAL 10 2HG1 VAL 10 -0.979 8.763 -4.079 72 HG13 VAL 10 3HG1 VAL 10 -0.147 7.938 -5.399 73 HG21 VAL 10 3HG2 VAL 10 -0.275 5.343 -5.450 74 HG22 VAL 10 1HG2 VAL 10 -0.926 4.514 -4.035 75 HG23 VAL 10 2HG2 VAL 10 -2.008 5.388 -5.119 76 H CYS 11 H CYS 11 2.477 8.201 -2.736 77 HA CYS 11 HA CYS 11 1.015 10.147 -1.189 78 HB2 CYS 11 1HB CYS 11 1.631 8.324 0.449 79 HB3 CYS 11 2HB CYS 11 3.317 8.722 0.148 80 HG CYS 11 HG CYS 11 3.249 11.221 1.245 81 H GLY 12 H GLY 12 1.960 12.137 -1.247 82 HA2 GLY 12 1HA GLY 12 4.054 12.550 -3.136 83 HA3 GLY 12 2HA GLY 12 3.307 13.782 -2.129 84 H ALA 13 H ALA 13 4.008 13.796 0.189 85 HA ALA 13 HA ALA 13 6.803 14.060 0.346 86 HB1 ALA 13 3HB ALA 13 6.485 14.594 2.650 87 HB2 ALA 13 1HB ALA 13 5.129 15.276 1.750 88 HB3 ALA 13 2HB ALA 13 4.914 13.792 2.677 89 H GLY 14 H GLY 14 8.329 12.568 0.576 90 HA2 GLY 14 1HA GLY 14 8.755 10.677 2.376 91 HA3 GLY 14 2HA GLY 14 7.566 9.863 1.371 92 H MET 15 H MET 15 10.832 11.048 1.575 93 HA MET 15 HA MET 15 11.450 9.686 -0.965 94 HB2 MET 15 1HB MET 15 12.636 12.111 0.344 95 HB3 MET 15 2HB MET 15 13.594 11.156 -0.779 96 HG2 MET 15 1HG MET 15 12.710 12.345 -2.418 97 HG3 MET 15 2HG MET 15 11.171 11.557 -2.078 98 HE1 MET 15 3HE MET 15 11.548 14.152 -3.513 99 HE2 MET 15 1HE MET 15 9.841 14.040 -3.080 100 HE3 MET 15 2HE MET 15 10.748 15.509 -2.718 101 H SER 16 H SER 16 11.455 7.723 0.425 102 HA SER 16 HA SER 16 12.587 6.027 1.434 103 HB2 SER 16 1HB SER 16 15.230 7.344 1.328 104 HB3 SER 16 2HB SER 16 14.744 5.742 0.774 105 HG SER 16 HG SER 16 14.483 6.523 -1.154 106 H THR 17 H THR 17 13.936 5.478 3.363 107 HA THR 17 HA THR 17 14.242 5.642 5.615 108 HB THR 17 HB THR 17 14.830 8.526 5.606 109 HG1 THR 17 HG1 THR 17 15.793 8.397 3.707 110 HG21 THR 17 3HG2 THR 17 15.586 6.218 7.022 111 HG22 THR 17 1HG2 THR 17 16.152 7.867 7.274 112 HG23 THR 17 2HG2 THR 17 17.037 6.787 6.197 113 H SER 18 H SER 18 11.584 6.296 4.503 114 HA SER 18 HA SER 18 10.504 8.405 6.129 115 HB2 SER 18 1HB SER 18 9.121 8.271 4.339 116 HB3 SER 18 2HB SER 18 9.515 6.578 4.041 117 HG SER 18 HG SER 18 7.314 6.969 4.724 118 H MET 19 H MET 19 8.772 8.077 7.697 119 HA MET 19 HA MET 19 9.494 6.301 9.738 120 HB2 MET 19 1HB MET 19 6.773 7.558 9.370 121 HB3 MET 19 2HB MET 19 7.503 7.024 10.878 122 HG2 MET 19 1HG MET 19 9.302 8.753 10.459 123 HG3 MET 19 2HG MET 19 8.260 9.381 9.184 124 HE1 MET 19 3HE MET 19 8.887 10.061 13.156 125 HE2 MET 19 1HE MET 19 9.591 10.587 11.626 126 HE3 MET 19 2HE MET 19 8.428 11.616 12.460 127 H LEU 20 H LEU 20 6.703 6.174 7.523 128 HA LEU 20 HA LEU 20 5.596 3.791 8.390 129 HB2 LEU 20 1HB LEU 20 5.620 5.243 5.792 130 HB3 LEU 20 2HB LEU 20 4.964 3.609 5.838 131 HG LEU 20 HG LEU 20 3.229 5.348 6.016 132 HD11 LEU 20 1HD1 LEU 20 3.372 3.014 7.345 133 HD12 LEU 20 2HD1 LEU 20 1.972 4.085 7.394 134 HD13 LEU 20 3HD1 LEU 20 3.160 4.127 8.697 135 HD21 LEU 20 3HD2 LEU 20 4.625 7.002 7.228 136 HD22 LEU 20 1HD2 LEU 20 4.496 6.000 8.674 137 HD23 LEU 20 2HD2 LEU 20 3.050 6.732 7.976 138 H VAL 21 H VAL 21 7.700 4.137 5.526 139 HA VAL 21 HA VAL 21 8.118 1.458 5.020 140 HB VAL 21 HB VAL 21 8.860 3.155 3.463 141 HG11 VAL 21 1HG1 VAL 21 11.085 3.826 5.376 142 HG12 VAL 21 2HG1 VAL 21 10.683 4.631 3.859 143 HG13 VAL 21 3HG1 VAL 21 9.599 4.765 5.245 144 HG21 VAL 21 3HG2 VAL 21 10.519 1.886 2.631 145 HG22 VAL 21 1HG2 VAL 21 11.492 2.025 4.094 146 HG23 VAL 21 2HG2 VAL 21 10.184 0.845 4.014 147 H GLN 22 H GLN 22 9.768 3.554 7.320 148 HA GLN 22 HA GLN 22 11.889 1.870 8.006 149 HB2 GLN 22 1HB GLN 22 10.531 4.188 9.218 150 HB3 GLN 22 2HB GLN 22 11.366 3.141 10.356 151 HG2 GLN 22 1HG GLN 22 12.825 3.963 7.911 152 HG3 GLN 22 2HG GLN 22 12.563 5.173 9.167 153 HE21 GLN 22 2HE2 GLN 22 13.312 4.657 11.325 154 HE22 GLN 22 1HE2 GLN 22 14.701 3.649 11.520 155 H ARG 23 H ARG 23 8.836 2.325 9.803 156 HA ARG 23 HA ARG 23 9.188 0.252 11.617 157 HB2 ARG 23 1HB ARG 23 6.601 1.305 10.457 158 HB3 ARG 23 2HB ARG 23 6.735 0.314 11.905 159 HG2 ARG 23 1HG ARG 23 8.337 2.795 11.850 160 HG3 ARG 23 2HG ARG 23 6.585 2.976 11.963 161 HD2 ARG 23 1HD ARG 23 8.323 1.331 13.798 162 HD3 ARG 23 2HD ARG 23 7.614 2.900 14.176 163 HE ARG 23 HE ARG 23 5.576 1.116 13.425 164 HH11 ARG 23 1HH1 ARG 23 7.821 1.701 16.021 165 HH12 ARG 23 2HH1 ARG 23 6.804 0.995 17.234 166 HH21 ARG 23 1HH2 ARG 23 4.228 0.184 15.013 167 HH22 ARG 23 2HH2 ARG 23 4.761 0.132 16.659 168 H ILE 24 H ILE 24 7.288 0.182 8.598 169 HA ILE 24 HA ILE 24 6.557 -2.481 8.626 170 HB ILE 24 HB ILE 24 7.272 -0.829 6.200 171 HG12 ILE 24 1HG1 ILE 24 4.507 -1.343 7.267 172 HG13 ILE 24 2HG1 ILE 24 5.473 -0.000 7.866 173 HG21 ILE 24 1HG2 ILE 24 5.697 -3.381 6.481 174 HG22 ILE 24 2HG2 ILE 24 5.712 -2.381 5.029 175 HG23 ILE 24 3HG2 ILE 24 7.200 -3.142 5.591 176 HD11 ILE 24 3HD1 ILE 24 4.327 -0.433 5.144 177 HD12 ILE 24 1HD1 ILE 24 4.191 0.966 6.208 178 HD13 ILE 24 2HD1 ILE 24 5.712 0.634 5.379 179 H GLU 25 H GLU 25 9.518 -1.033 7.306 180 HA GLU 25 HA GLU 25 10.625 -3.391 6.263 181 HB2 GLU 25 1HB GLU 25 11.761 -0.757 7.127 182 HB3 GLU 25 2HB GLU 25 12.844 -2.072 6.694 183 HG2 GLU 25 1HG GLU 25 10.664 -1.061 4.890 184 HG3 GLU 25 2HG GLU 25 12.318 -0.454 4.858 185 H LYS 26 H LYS 26 10.772 -1.950 9.472 186 HA LYS 26 HA LYS 26 12.748 -3.655 10.547 187 HB2 LYS 26 1HB LYS 26 10.938 -1.612 11.513 188 HB3 LYS 26 2HB LYS 26 11.041 -2.947 12.651 189 HG2 LYS 26 1HG LYS 26 13.486 -1.630 11.517 190 HG3 LYS 26 2HG LYS 26 12.669 -1.025 12.960 191 HD2 LYS 26 1HD LYS 26 13.377 -2.748 14.244 192 HD3 LYS 26 2HD LYS 26 13.257 -3.917 12.926 193 HE2 LYS 26 1HE LYS 26 15.299 -2.624 11.961 194 HE3 LYS 26 2HE LYS 26 15.494 -2.054 13.617 195 HZ1 LYS 26 3HZ LYS 26 16.552 -4.319 12.688 196 HZ2 LYS 26 1HZ LYS 26 15.100 -4.910 13.326 197 HZ3 LYS 26 2HZ LYS 26 16.176 -4.060 14.316 198 H TYR 27 H TYR 27 9.221 -3.715 11.104 199 HA TYR 27 HA TYR 27 9.079 -6.124 12.442 200 HB2 TYR 27 1HB TYR 27 7.158 -4.666 12.291 201 HB3 TYR 27 2HB TYR 27 7.079 -4.878 10.546 202 HD1 TYR 27 HD1 TYR 27 6.310 -7.022 9.592 203 HD2 TYR 27 HD2 TYR 27 6.242 -6.299 13.785 204 HE1 TYR 27 HE1 TYR 27 4.778 -8.923 9.888 205 HE2 TYR 27 HE2 TYR 27 4.711 -8.199 14.093 206 HH TYR 27 HH TYR 27 3.323 -9.640 13.009 207 H ALA 28 H ALA 28 8.902 -5.553 8.942 208 HA ALA 28 HA ALA 28 8.498 -8.236 8.190 209 HB1 ALA 28 3HB ALA 28 9.994 -6.385 6.400 210 HB2 ALA 28 1HB ALA 28 8.696 -7.519 6.025 211 HB3 ALA 28 2HB ALA 28 8.328 -5.994 6.830 212 H LYS 29 H LYS 29 11.482 -6.283 8.224 213 HA LYS 29 HA LYS 29 13.240 -8.302 7.439 214 HB2 LYS 29 1HB LYS 29 13.597 -5.796 9.062 215 HB3 LYS 29 2HB LYS 29 14.948 -6.884 8.769 216 HG2 LYS 29 1HG LYS 29 13.410 -6.107 6.385 217 HG3 LYS 29 2HG LYS 29 14.306 -4.810 7.180 218 HD2 LYS 29 1HD LYS 29 16.365 -5.965 6.933 219 HD3 LYS 29 2HD LYS 29 15.549 -7.455 6.454 220 HE2 LYS 29 1HE LYS 29 14.616 -5.825 4.551 221 HE3 LYS 29 2HE LYS 29 16.147 -5.016 4.882 222 HZ1 LYS 29 3HZ LYS 29 16.372 -6.654 3.122 223 HZ2 LYS 29 1HZ LYS 29 15.829 -7.878 4.156 224 HZ3 LYS 29 2HZ LYS 29 17.298 -7.099 4.467 225 H SER 30 H SER 30 11.701 -7.712 10.482 226 HA SER 30 HA SER 30 13.507 -9.400 11.983 227 HB2 SER 30 1HB SER 30 11.322 -7.561 12.587 228 HB3 SER 30 2HB SER 30 11.252 -9.036 13.552 229 HG SER 30 HG SER 30 13.422 -8.634 14.168 230 H LYS 31 H LYS 31 10.159 -9.566 10.819 231 HA LYS 31 HA LYS 31 9.720 -12.211 11.805 232 HB2 LYS 31 1HB LYS 31 8.230 -10.274 10.110 233 HB3 LYS 31 2HB LYS 31 7.791 -11.971 9.968 234 HG2 LYS 31 1HG LYS 31 6.379 -10.831 11.582 235 HG3 LYS 31 2HG LYS 31 7.360 -12.072 12.365 236 HD2 LYS 31 1HD LYS 31 8.979 -10.278 13.003 237 HD3 LYS 31 2HD LYS 31 7.831 -9.093 12.376 238 HE2 LYS 31 1HE LYS 31 7.010 -9.070 14.460 239 HE3 LYS 31 2HE LYS 31 6.253 -10.600 14.019 240 HZ1 LYS 31 3HZ LYS 31 8.258 -11.728 14.889 241 HZ2 LYS 31 1HZ LYS 31 7.402 -10.878 16.075 242 HZ3 LYS 31 2HZ LYS 31 8.832 -10.236 15.441 243 H ASN 32 H ASN 32 11.417 -10.979 9.163 244 HA ASN 32 HA ASN 32 12.424 -11.929 7.359 245 HB2 ASN 32 1HB ASN 32 11.992 -14.245 9.191 246 HB3 ASN 32 2HB ASN 32 12.501 -14.579 7.538 247 HD21 ASN 32 2HD2 ASN 32 14.596 -14.664 7.220 248 HD22 ASN 32 1HD2 ASN 32 15.808 -13.897 8.184 249 H ILE 33 H ILE 33 10.207 -11.096 6.490 250 HA ILE 33 HA ILE 33 8.773 -13.345 5.239 251 HB ILE 33 HB ILE 33 7.807 -10.522 5.708 252 HG12 ILE 33 1HG1 ILE 33 6.384 -12.825 6.884 253 HG13 ILE 33 2HG1 ILE 33 7.982 -12.517 7.553 254 HG21 ILE 33 1HG2 ILE 33 5.606 -11.974 5.074 255 HG22 ILE 33 2HG2 ILE 33 6.516 -10.988 3.930 256 HG23 ILE 33 3HG2 ILE 33 6.820 -12.722 4.036 257 HD11 ILE 33 3HD1 ILE 33 5.758 -10.499 7.373 258 HD12 ILE 33 1HD1 ILE 33 6.204 -11.409 8.816 259 HD13 ILE 33 2HD1 ILE 33 7.339 -10.255 8.113 260 H ASN 34 H ASN 34 8.434 -13.362 3.039 261 HA ASN 34 HA ASN 34 10.300 -11.805 1.478 262 HB2 ASN 34 1HB ASN 34 8.683 -14.231 1.092 263 HB3 ASN 34 2HB ASN 34 8.828 -13.225 -0.347 264 HD21 ASN 34 2HD2 ASN 34 11.097 -12.488 -0.826 265 HD22 ASN 34 1HD2 ASN 34 12.351 -13.660 -0.626 266 H ALA 35 H ALA 35 9.372 -9.706 1.809 267 HA ALA 35 HA ALA 35 7.335 -9.099 -0.175 268 HB1 ALA 35 3HB ALA 35 6.970 -8.558 2.759 269 HB2 ALA 35 1HB ALA 35 6.103 -7.662 1.512 270 HB3 ALA 35 2HB ALA 35 5.886 -9.406 1.656 271 H THR 36 H THR 36 7.069 -6.704 -0.435 272 HA THR 36 HA THR 36 9.315 -5.107 0.509 273 HB THR 36 HB THR 36 9.046 -4.543 -2.279 274 HG1 THR 36 HG1 THR 36 9.648 -7.263 -1.660 275 HG21 THR 36 3HG2 THR 36 10.992 -4.057 -0.834 276 HG22 THR 36 1HG2 THR 36 11.440 -4.940 -2.292 277 HG23 THR 36 2HG2 THR 36 11.334 -5.784 -0.747 278 H ILE 37 H ILE 37 9.076 -2.802 -0.050 279 HA ILE 37 HA ILE 37 6.343 -2.007 -0.746 280 HB ILE 37 HB ILE 37 6.500 -2.114 1.735 281 HG12 ILE 37 1HG1 ILE 37 6.278 0.749 0.816 282 HG13 ILE 37 2HG1 ILE 37 5.066 -0.460 0.409 283 HG21 ILE 37 1HG2 ILE 37 9.012 -1.136 1.418 284 HG22 ILE 37 2HG2 ILE 37 8.137 0.314 1.906 285 HG23 ILE 37 3HG2 ILE 37 8.115 -1.118 2.936 286 HD11 ILE 37 3HD1 ILE 37 5.727 -0.350 3.251 287 HD12 ILE 37 1HD1 ILE 37 5.019 1.132 2.609 288 HD13 ILE 37 2HD1 ILE 37 4.159 -0.399 2.445 289 H GLU 38 H GLU 38 6.144 0.091 -1.585 290 HA GLU 38 HA GLU 38 8.462 1.792 -1.821 291 HB2 GLU 38 1HB GLU 38 8.700 0.039 -3.639 292 HB3 GLU 38 2HB GLU 38 7.248 0.715 -4.364 293 HG2 GLU 38 1HG GLU 38 8.320 2.813 -4.731 294 HG3 GLU 38 2HG GLU 38 9.731 2.313 -3.801 295 H ALA 39 H ALA 39 7.968 3.860 -2.780 296 HA ALA 39 HA ALA 39 5.082 4.430 -2.936 297 HB1 ALA 39 3HB ALA 39 6.645 6.677 -1.978 298 HB2 ALA 39 1HB ALA 39 5.180 5.951 -1.314 299 HB3 ALA 39 2HB ALA 39 6.759 5.279 -0.909 300 H ILE 40 H ILE 40 4.436 5.987 -4.415 301 HA ILE 40 HA ILE 40 6.418 7.398 -5.992 302 HB ILE 40 HB ILE 40 5.382 6.554 -8.146 303 HG12 ILE 40 1HG1 ILE 40 4.717 3.969 -6.965 304 HG13 ILE 40 2HG1 ILE 40 3.651 5.255 -6.411 305 HG21 ILE 40 1HG2 ILE 40 7.596 5.813 -6.906 306 HG22 ILE 40 2HG2 ILE 40 6.748 4.269 -6.829 307 HG23 ILE 40 3HG2 ILE 40 7.060 5.026 -8.391 308 HD11 ILE 40 3HD1 ILE 40 4.216 4.948 -9.322 309 HD12 ILE 40 1HD1 ILE 40 3.050 3.889 -8.528 310 HD13 ILE 40 2HD1 ILE 40 2.806 5.637 -8.515 311 H ALA 41 H ALA 41 5.088 8.477 -7.951 312 HA ALA 41 HA ALA 41 3.151 10.157 -6.656 313 HB1 ALA 41 3HB ALA 41 4.200 10.090 -9.480 314 HB2 ALA 41 1HB ALA 41 3.048 11.286 -8.884 315 HB3 ALA 41 2HB ALA 41 4.665 11.192 -8.184 316 H GLU 42 H GLU 42 1.182 10.761 -8.226 317 HA GLU 42 HA GLU 42 -0.374 8.306 -8.401 318 HB2 GLU 42 1HB GLU 42 -2.298 9.872 -8.737 319 HB3 GLU 42 2HB GLU 42 -1.438 10.098 -7.220 320 HG2 GLU 42 1HG GLU 42 -0.219 11.789 -9.117 321 HG3 GLU 42 2HG GLU 42 -1.963 11.984 -9.288 322 H THR 43 H THR 43 1.619 9.856 -10.428 323 HA THR 43 HA THR 43 -0.062 9.639 -12.811 324 HB THR 43 HB THR 43 1.256 11.654 -12.701 325 HG1 THR 43 HG1 THR 43 1.144 10.220 -14.732 326 HG21 THR 43 3HG2 THR 43 3.910 10.676 -13.031 327 HG22 THR 43 1HG2 THR 43 3.227 9.943 -11.580 328 HG23 THR 43 2HG2 THR 43 3.267 11.698 -11.745 329 H ARG 44 H ARG 44 2.569 8.050 -11.185 330 HA ARG 44 HA ARG 44 2.885 6.209 -13.458 331 HB2 ARG 44 1HB ARG 44 4.713 6.991 -11.205 332 HB3 ARG 44 2HB ARG 44 4.965 5.494 -12.095 333 HG2 ARG 44 1HG ARG 44 5.362 6.649 -14.115 334 HG3 ARG 44 2HG ARG 44 4.771 8.170 -13.443 335 HD2 ARG 44 1HD ARG 44 6.702 8.573 -12.301 336 HD3 ARG 44 2HD ARG 44 7.050 6.861 -12.070 337 HE ARG 44 HE ARG 44 7.306 7.419 -14.787 338 HH11 ARG 44 1HH1 ARG 44 8.841 8.269 -11.780 339 HH12 ARG 44 2HH1 ARG 44 10.398 8.522 -12.496 340 HH21 ARG 44 1HH2 ARG 44 9.351 7.748 -15.741 341 HH22 ARG 44 2HH2 ARG 44 10.687 8.227 -14.749 342 H LEU 45 H LEU 45 0.846 6.313 -11.161 343 HA LEU 45 HA LEU 45 1.329 4.016 -9.555 344 HB2 LEU 45 1HB LEU 45 -0.156 5.577 -8.653 345 HB3 LEU 45 2HB LEU 45 -1.084 5.693 -10.147 346 HG LEU 45 HG LEU 45 -1.109 3.059 -8.811 347 HD11 LEU 45 1HD1 LEU 45 -1.915 5.536 -7.448 348 HD12 LEU 45 2HD1 LEU 45 -1.515 3.951 -6.788 349 HD13 LEU 45 3HD1 LEU 45 -3.120 4.248 -7.456 350 HD21 LEU 45 3HD2 LEU 45 -3.658 3.698 -9.322 351 HD22 LEU 45 1HD2 LEU 45 -2.571 3.029 -10.538 352 HD23 LEU 45 2HD2 LEU 45 -2.858 4.768 -10.472 353 H SER 46 H SER 46 -0.957 4.568 -12.240 354 HA SER 46 HA SER 46 -1.592 1.793 -12.474 355 HB2 SER 46 1HB SER 46 -3.352 3.036 -13.264 356 HB3 SER 46 2HB SER 46 -2.307 4.288 -13.932 357 HG SER 46 HG SER 46 -3.482 2.405 -15.264 358 H GLU 47 H GLU 47 1.060 3.599 -13.420 359 HA GLU 47 HA GLU 47 1.628 2.057 -15.819 360 HB2 GLU 47 1HB GLU 47 3.138 4.265 -14.416 361 HB3 GLU 47 2HB GLU 47 3.728 3.446 -15.856 362 HG2 GLU 47 1HG GLU 47 1.041 4.759 -15.831 363 HG3 GLU 47 2HG GLU 47 2.509 5.693 -16.112 364 H VAL 48 H VAL 48 2.345 2.019 -12.459 365 HA VAL 48 HA VAL 48 4.479 0.036 -12.892 366 HB VAL 48 HB VAL 48 5.279 0.508 -10.664 367 HG11 VAL 48 1HG1 VAL 48 6.249 1.928 -12.269 368 HG12 VAL 48 2HG1 VAL 48 4.797 2.923 -12.388 369 HG13 VAL 48 3HG1 VAL 48 5.792 2.983 -10.933 370 HG21 VAL 48 3HG2 VAL 48 2.775 2.135 -10.472 371 HG22 VAL 48 1HG2 VAL 48 3.424 0.945 -9.345 372 HG23 VAL 48 2HG2 VAL 48 4.176 2.535 -9.478 373 H VAL 49 H VAL 49 1.312 0.542 -11.664 374 HA VAL 49 HA VAL 49 1.035 -1.412 -9.730 375 HB VAL 49 HB VAL 49 -0.729 0.224 -10.423 376 HG11 VAL 49 1HG1 VAL 49 -1.338 -1.779 -12.591 377 HG12 VAL 49 2HG1 VAL 49 -2.183 -0.266 -12.263 378 HG13 VAL 49 3HG1 VAL 49 -0.525 -0.239 -12.863 379 HG21 VAL 49 3HG2 VAL 49 -2.093 -1.027 -9.192 380 HG22 VAL 49 1HG2 VAL 49 -2.330 -2.153 -10.529 381 HG23 VAL 49 2HG2 VAL 49 -0.988 -2.385 -9.408 382 H ASP 50 H ASP 50 1.306 -1.753 -13.189 383 HA ASP 50 HA ASP 50 0.291 -4.333 -13.520 384 HB2 ASP 50 1HB ASP 50 0.901 -2.806 -15.379 385 HB3 ASP 50 2HB ASP 50 2.603 -3.074 -15.011 386 H ARG 51 H ARG 51 3.234 -3.236 -12.080 387 HA ARG 51 HA ARG 51 4.354 -5.944 -12.083 388 HB2 ARG 51 1HB ARG 51 5.663 -3.436 -11.036 389 HB3 ARG 51 2HB ARG 51 6.433 -4.966 -11.440 390 HG2 ARG 51 1HG ARG 51 5.550 -4.486 -13.832 391 HG3 ARG 51 2HG ARG 51 5.417 -2.824 -13.252 392 HD2 ARG 51 1HD ARG 51 7.959 -4.094 -12.583 393 HD3 ARG 51 2HD ARG 51 7.668 -3.979 -14.317 394 HE ARG 51 HE ARG 51 7.076 -1.502 -13.172 395 HH11 ARG 51 1HH1 ARG 51 9.822 -3.569 -13.720 396 HH12 ARG 51 2HH1 ARG 51 10.954 -2.261 -13.811 397 HH21 ARG 51 1HH2 ARG 51 8.556 0.230 -13.289 398 HH22 ARG 51 2HH2 ARG 51 10.233 -0.100 -13.565 399 H PHE 52 H PHE 52 3.464 -3.327 -9.860 400 HA PHE 52 HA PHE 52 4.096 -4.692 -7.479 401 HB2 PHE 52 1HB PHE 52 2.293 -2.375 -8.124 402 HB3 PHE 52 2HB PHE 52 2.368 -3.032 -6.492 403 HD1 PHE 52 HD1 PHE 52 4.174 -1.201 -9.087 404 HD2 PHE 52 HD2 PHE 52 4.348 -2.771 -5.134 405 HE1 PHE 52 HE1 PHE 52 6.168 0.167 -8.634 406 HE2 PHE 52 HE2 PHE 52 6.342 -1.405 -4.676 407 HZ PHE 52 HZ PHE 52 7.255 0.067 -6.426 408 H ASP 53 H ASP 53 2.120 -4.909 -5.802 409 HA ASP 53 HA ASP 53 0.178 -6.719 -7.082 410 HB2 ASP 53 1HB ASP 53 1.573 -6.922 -4.415 411 HB3 ASP 53 2HB ASP 53 0.132 -7.860 -4.800 412 H VAL 54 H VAL 54 0.603 -4.869 -4.058 413 HA VAL 54 HA VAL 54 -2.270 -4.231 -4.150 414 HB VAL 54 HB VAL 54 -2.001 -3.667 -1.722 415 HG11 VAL 54 1HG1 VAL 54 -2.399 -5.830 -1.049 416 HG12 VAL 54 2HG1 VAL 54 -2.678 -5.959 -2.786 417 HG13 VAL 54 3HG1 VAL 54 -1.147 -6.500 -2.095 418 HG21 VAL 54 3HG2 VAL 54 0.705 -3.807 -2.299 419 HG22 VAL 54 1HG2 VAL 54 -0.022 -3.684 -0.697 420 HG23 VAL 54 2HG2 VAL 54 0.390 -5.266 -1.361 421 H VAL 55 H VAL 55 -2.969 -2.109 -3.747 422 HA VAL 55 HA VAL 55 -0.884 -0.034 -3.923 423 HB VAL 55 HB VAL 55 -3.546 0.053 -5.347 424 HG11 VAL 55 1HG1 VAL 55 -1.947 1.927 -6.504 425 HG12 VAL 55 2HG1 VAL 55 -3.137 2.257 -5.244 426 HG13 VAL 55 3HG1 VAL 55 -1.441 2.021 -4.818 427 HG21 VAL 55 3HG2 VAL 55 -2.019 -0.028 -7.401 428 HG22 VAL 55 1HG2 VAL 55 -0.788 -0.649 -6.301 429 HG23 VAL 55 2HG2 VAL 55 -2.295 -1.537 -6.530 430 H LEU 56 H LEU 56 -0.933 0.821 -1.924 431 HA LEU 56 HA LEU 56 -3.536 1.441 -0.716 432 HB2 LEU 56 1HB LEU 56 -0.838 1.574 0.608 433 HB3 LEU 56 2HB LEU 56 -2.422 1.573 1.381 434 HG LEU 56 HG LEU 56 -0.919 -0.719 0.164 435 HD11 LEU 56 1HD1 LEU 56 -0.868 -1.567 2.262 436 HD12 LEU 56 2HD1 LEU 56 -2.430 -0.877 2.702 437 HD13 LEU 56 3HD1 LEU 56 -0.990 0.141 2.688 438 HD21 LEU 56 3HD2 LEU 56 -3.257 -1.850 0.897 439 HD22 LEU 56 1HD2 LEU 56 -2.868 -1.372 -0.756 440 HD23 LEU 56 2HD2 LEU 56 -3.832 -0.306 0.267 441 H LEU 57 H LEU 57 -4.145 3.495 -0.246 442 HA LEU 57 HA LEU 57 -2.474 5.632 -1.346 443 HB2 LEU 57 1HB LEU 57 -4.684 5.607 -2.222 444 HB3 LEU 57 2HB LEU 57 -5.388 5.485 -0.611 445 HG LEU 57 HG LEU 57 -4.509 7.796 -0.160 446 HD11 LEU 57 1HD1 LEU 57 -4.326 8.901 -2.655 447 HD12 LEU 57 2HD1 LEU 57 -3.458 7.378 -2.852 448 HD13 LEU 57 3HD1 LEU 57 -2.963 8.520 -1.601 449 HD21 LEU 57 3HD2 LEU 57 -6.851 7.019 -1.171 450 HD22 LEU 57 1HD2 LEU 57 -6.302 8.034 -2.504 451 HD23 LEU 57 2HD2 LEU 57 -6.454 8.713 -0.883 452 H ALA 58 H ALA 58 -2.049 7.545 -0.182 453 HA ALA 58 HA ALA 58 -1.862 7.122 2.698 454 HB1 ALA 58 3HB ALA 58 -0.579 9.425 2.384 455 HB2 ALA 58 1HB ALA 58 0.183 7.870 2.048 456 HB3 ALA 58 2HB ALA 58 -0.466 8.839 0.725 457 HA PRO 59 HA PRO 59 -5.015 9.933 3.884 458 HB2 PRO 59 1HB PRO 59 -3.902 11.204 6.009 459 HB3 PRO 59 2HB PRO 59 -4.433 9.519 6.068 460 HG2 PRO 59 1HG PRO 59 -1.678 10.624 5.680 461 HG3 PRO 59 2HG PRO 59 -2.207 9.263 6.688 462 HD2 PRO 59 1HD PRO 59 -1.063 8.917 4.258 463 HD3 PRO 59 2HD PRO 59 -2.290 7.809 4.902 464 H GLN 60 H GLN 60 -4.625 11.131 1.802 465 HA GLN 60 HA GLN 60 -4.583 13.888 2.239 466 HB2 GLN 60 1HB GLN 60 -1.984 12.791 2.102 467 HB3 GLN 60 2HB GLN 60 -2.253 13.627 0.578 468 HG2 GLN 60 1HG GLN 60 -3.119 15.541 2.149 469 HG3 GLN 60 2HG GLN 60 -2.122 14.713 3.342 470 HE21 GLN 60 2HE2 GLN 60 -0.935 16.749 3.322 471 HE22 GLN 60 1HE2 GLN 60 0.289 16.990 2.128 472 H SER 61 H SER 61 -4.483 15.133 0.127 473 HA SER 61 HA SER 61 -5.246 15.483 -1.988 474 HB2 SER 61 1HB SER 61 -3.571 13.257 -2.186 475 HB3 SER 61 2HB SER 61 -5.041 12.779 -3.034 476 HG SER 61 HG SER 61 -3.509 13.873 -4.380 477 H ARG 62 H ARG 62 -7.359 15.864 -2.049 478 HA ARG 62 HA ARG 62 -9.284 13.856 -1.283 479 HB2 ARG 62 1HB ARG 62 -9.235 16.644 -1.297 480 HB3 ARG 62 2HB ARG 62 -10.404 16.222 -2.540 481 HG2 ARG 62 1HG ARG 62 -11.543 14.763 -0.863 482 HG3 ARG 62 2HG ARG 62 -10.454 15.426 0.359 483 HD2 ARG 62 1HD ARG 62 -12.173 17.166 -1.389 484 HD3 ARG 62 2HD ARG 62 -12.745 16.510 0.145 485 HE ARG 62 HE ARG 62 -10.302 17.772 0.610 486 HH11 ARG 62 1HH1 ARG 62 -13.544 18.593 -0.357 487 HH12 ARG 62 2HH1 ARG 62 -13.483 20.186 0.321 488 HH21 ARG 62 1HH2 ARG 62 -10.208 19.869 1.506 489 HH22 ARG 62 2HH2 ARG 62 -11.584 20.911 1.380 490 H PHE 63 H PHE 63 -8.620 15.727 -4.243 491 HA PHE 63 HA PHE 63 -10.489 14.396 -5.865 492 HB2 PHE 63 1HB PHE 63 -8.280 16.281 -6.250 493 HB3 PHE 63 2HB PHE 63 -8.520 15.197 -7.616 494 HD1 PHE 63 HD1 PHE 63 -10.443 17.422 -5.329 495 HD2 PHE 63 HD2 PHE 63 -10.063 15.759 -9.229 496 HE1 PHE 63 HE1 PHE 63 -12.309 18.825 -6.106 497 HE2 PHE 63 HE2 PHE 63 -11.928 17.160 -10.012 498 HZ PHE 63 HZ PHE 63 -13.053 18.696 -8.450 499 H ASN 64 H ASN 64 -7.097 13.743 -5.157 500 HA ASN 64 HA ASN 64 -6.717 11.711 -7.076 501 HB2 ASN 64 1HB ASN 64 -5.087 13.024 -5.333 502 HB3 ASN 64 2HB ASN 64 -5.212 11.451 -4.551 503 HD21 ASN 64 2HD2 ASN 64 -5.044 12.516 -7.932 504 HD22 ASN 64 1HD2 ASN 64 -3.702 11.512 -8.358 505 H LYS 65 H LYS 65 -7.967 11.689 -3.794 506 HA LYS 65 HA LYS 65 -7.947 8.894 -3.401 507 HB2 LYS 65 1HB LYS 65 -8.197 10.288 -1.488 508 HB3 LYS 65 2HB LYS 65 -9.586 11.112 -2.183 509 HG2 LYS 65 1HG LYS 65 -11.015 9.339 -1.761 510 HG3 LYS 65 2HG LYS 65 -9.694 8.177 -1.627 511 HD2 LYS 65 1HD LYS 65 -10.186 8.433 0.586 512 HD3 LYS 65 2HD LYS 65 -9.019 9.744 0.402 513 HE2 LYS 65 1HE LYS 65 -11.551 10.765 -0.324 514 HE3 LYS 65 2HE LYS 65 -11.763 9.873 1.183 515 HZ1 LYS 65 3HZ LYS 65 -10.515 12.392 0.746 516 HZ2 LYS 65 1HZ LYS 65 -9.454 11.322 1.517 517 HZ3 LYS 65 2HZ LYS 65 -10.963 11.657 2.202 518 H LYS 66 H LYS 66 -10.574 11.083 -4.403 519 HA LYS 66 HA LYS 66 -12.515 9.107 -4.815 520 HB2 LYS 66 1HB LYS 66 -13.093 11.465 -4.676 521 HB3 LYS 66 2HB LYS 66 -12.185 11.802 -6.145 522 HG2 LYS 66 1HG LYS 66 -13.741 10.468 -7.443 523 HG3 LYS 66 2HG LYS 66 -14.632 10.054 -5.977 524 HD2 LYS 66 1HD LYS 66 -14.210 12.920 -6.727 525 HD3 LYS 66 2HD LYS 66 -15.491 11.980 -7.496 526 HE2 LYS 66 1HE LYS 66 -16.710 11.813 -5.575 527 HE3 LYS 66 2HE LYS 66 -15.286 11.869 -4.537 528 HZ1 LYS 66 3HZ LYS 66 -15.096 14.239 -5.000 529 HZ2 LYS 66 1HZ LYS 66 -16.599 13.874 -4.314 530 HZ3 LYS 66 2HZ LYS 66 -16.478 14.179 -5.973 531 H ARG 67 H ARG 67 -10.238 10.602 -7.099 532 HA ARG 67 HA ARG 67 -11.089 9.186 -9.375 533 HB2 ARG 67 1HB ARG 67 -9.179 11.141 -8.803 534 HB3 ARG 67 2HB ARG 67 -8.250 9.778 -9.413 535 HG2 ARG 67 1HG ARG 67 -9.709 9.727 -11.407 536 HG3 ARG 67 2HG ARG 67 -10.531 11.167 -10.802 537 HD2 ARG 67 1HD ARG 67 -7.941 11.955 -10.671 538 HD3 ARG 67 2HD ARG 67 -7.892 10.879 -12.067 539 HE ARG 67 HE ARG 67 -10.040 12.798 -12.123 540 HH11 ARG 67 1HH1 ARG 67 -6.718 12.163 -12.947 541 HH12 ARG 67 2HH1 ARG 67 -6.666 13.355 -14.203 542 HH21 ARG 67 1HH2 ARG 67 -9.984 14.370 -13.774 543 HH22 ARG 67 2HH2 ARG 67 -8.524 14.611 -14.671 544 H LEU 68 H LEU 68 -8.322 8.590 -7.206 545 HA LEU 68 HA LEU 68 -7.320 6.305 -8.362 546 HB2 LEU 68 1HB LEU 68 -7.443 7.259 -5.531 547 HB3 LEU 68 2HB LEU 68 -6.760 5.677 -5.900 548 HG LEU 68 HG LEU 68 -5.742 8.163 -7.238 549 HD11 LEU 68 1HD1 LEU 68 -5.355 8.828 -5.075 550 HD12 LEU 68 2HD1 LEU 68 -3.896 7.895 -5.407 551 HD13 LEU 68 3HD1 LEU 68 -5.209 7.176 -4.475 552 HD21 LEU 68 3HD2 LEU 68 -3.957 6.875 -7.876 553 HD22 LEU 68 1HD2 LEU 68 -5.239 5.665 -7.879 554 HD23 LEU 68 2HD2 LEU 68 -4.126 5.766 -6.515 555 H GLU 69 H GLU 69 -9.761 6.454 -5.766 556 HA GLU 69 HA GLU 69 -10.271 3.678 -5.727 557 HB2 GLU 69 1HB GLU 69 -12.017 5.989 -4.859 558 HB3 GLU 69 2HB GLU 69 -12.333 4.300 -4.486 559 HG2 GLU 69 1HG GLU 69 -10.161 4.209 -3.295 560 HG3 GLU 69 2HG GLU 69 -9.982 5.939 -3.576 561 H GLU 70 H GLU 70 -11.700 6.345 -7.528 562 HA GLU 70 HA GLU 70 -13.890 4.900 -8.591 563 HB2 GLU 70 1HB GLU 70 -12.508 7.461 -9.276 564 HB3 GLU 70 2HB GLU 70 -13.646 6.776 -10.428 565 HG2 GLU 70 1HG GLU 70 -14.586 6.954 -7.644 566 HG3 GLU 70 2HG GLU 70 -14.332 8.486 -8.477 567 H ILE 71 H ILE 71 -10.540 4.977 -9.361 568 HA ILE 71 HA ILE 71 -10.970 3.788 -11.996 569 HB ILE 71 HB ILE 71 -8.404 4.597 -10.625 570 HG12 ILE 71 1HG1 ILE 71 -9.532 5.918 -13.063 571 HG13 ILE 71 2HG1 ILE 71 -10.182 6.341 -11.483 572 HG21 ILE 71 1HG2 ILE 71 -7.871 4.416 -13.301 573 HG22 ILE 71 2HG2 ILE 71 -7.470 3.195 -12.095 574 HG23 ILE 71 3HG2 ILE 71 -8.953 3.049 -13.039 575 HD11 ILE 71 3HD1 ILE 71 -8.567 7.912 -11.623 576 HD12 ILE 71 1HD1 ILE 71 -7.595 6.610 -10.939 577 HD13 ILE 71 2HD1 ILE 71 -7.544 6.929 -12.672 578 H THR 72 H THR 72 -9.600 3.025 -8.836 579 HA THR 72 HA THR 72 -8.571 0.482 -9.519 580 HB THR 72 HB THR 72 -8.490 0.047 -7.105 581 HG1 THR 72 HG1 THR 72 -9.249 1.920 -5.772 582 HG21 THR 72 3HG2 THR 72 -6.641 1.287 -7.066 583 HG22 THR 72 1HG2 THR 72 -7.598 2.751 -6.851 584 HG23 THR 72 2HG2 THR 72 -7.225 2.171 -8.475 585 H LYS 73 H LYS 73 -11.693 1.555 -8.270 586 HA LYS 73 HA LYS 73 -12.854 -0.843 -7.581 587 HB2 LYS 73 1HB LYS 73 -13.759 1.808 -8.235 588 HB3 LYS 73 2HB LYS 73 -14.855 0.621 -8.931 589 HG2 LYS 73 1HG LYS 73 -15.532 -0.156 -6.893 590 HG3 LYS 73 2HG LYS 73 -14.021 0.286 -6.097 591 HD2 LYS 73 1HD LYS 73 -14.777 2.327 -5.557 592 HD3 LYS 73 2HD LYS 73 -15.498 2.577 -7.148 593 HE2 LYS 73 1HE LYS 73 -17.355 2.556 -5.776 594 HE3 LYS 73 2HE LYS 73 -17.281 0.880 -6.318 595 HZ1 LYS 73 3HZ LYS 73 -15.776 1.404 -3.918 596 HZ2 LYS 73 1HZ LYS 73 -16.869 0.159 -4.259 597 HZ3 LYS 73 2HZ LYS 73 -17.438 1.667 -3.746 598 HA PRO 74 HA PRO 74 -14.352 -1.520 -12.117 599 HB2 PRO 74 1HB PRO 74 -13.369 0.140 -14.027 600 HB3 PRO 74 2HB PRO 74 -14.844 0.489 -13.117 601 HG2 PRO 74 1HG PRO 74 -12.068 1.528 -12.697 602 HG3 PRO 74 2HG PRO 74 -13.610 2.402 -12.640 603 HD2 PRO 74 1HD PRO 74 -12.310 1.595 -10.406 604 HD3 PRO 74 2HD PRO 74 -14.080 1.686 -10.500 605 H LYS 75 H LYS 75 -11.056 -0.376 -11.651 606 HA LYS 75 HA LYS 75 -9.836 -1.882 -13.699 607 HB2 LYS 75 1HB LYS 75 -8.905 -0.479 -11.243 608 HB3 LYS 75 2HB LYS 75 -7.813 -1.645 -11.979 609 HG2 LYS 75 1HG LYS 75 -9.085 0.464 -13.665 610 HG3 LYS 75 2HG LYS 75 -7.691 0.856 -12.656 611 HD2 LYS 75 1HD LYS 75 -6.598 -1.209 -13.744 612 HD3 LYS 75 2HD LYS 75 -7.878 -1.065 -14.952 613 HE2 LYS 75 1HE LYS 75 -6.508 0.357 -15.998 614 HE3 LYS 75 2HE LYS 75 -6.948 1.511 -14.740 615 HZ1 LYS 75 3HZ LYS 75 -4.435 0.335 -15.259 616 HZ2 LYS 75 1HZ LYS 75 -4.931 -0.081 -13.696 617 HZ3 LYS 75 2HZ LYS 75 -4.830 1.547 -14.145 618 H GLY 76 H GLY 76 -10.789 -2.660 -10.423 619 HA2 GLY 76 1HA GLY 76 -11.048 -4.729 -9.432 620 HA3 GLY 76 2HA GLY 76 -10.559 -5.467 -10.950 621 H ILE 77 H ILE 77 -9.128 -3.543 -8.311 622 HA ILE 77 HA ILE 77 -6.971 -5.508 -8.129 623 HB ILE 77 HB ILE 77 -5.287 -3.658 -7.950 624 HG12 ILE 77 1HG1 ILE 77 -6.658 -1.739 -9.564 625 HG13 ILE 77 2HG1 ILE 77 -7.633 -2.059 -8.134 626 HG21 ILE 77 1HG2 ILE 77 -4.942 -3.481 -10.307 627 HG22 ILE 77 2HG2 ILE 77 -5.628 -5.071 -9.979 628 HG23 ILE 77 3HG2 ILE 77 -6.647 -3.790 -10.633 629 HD11 ILE 77 3HD1 ILE 77 -5.814 -0.189 -8.129 630 HD12 ILE 77 1HD1 ILE 77 -6.065 -1.203 -6.708 631 HD13 ILE 77 2HD1 ILE 77 -4.724 -1.538 -7.806 632 HA PRO 78 HA PRO 78 -7.394 -4.935 -3.796 633 HB2 PRO 78 1HB PRO 78 -4.863 -5.438 -2.952 634 HB3 PRO 78 2HB PRO 78 -5.948 -6.702 -3.544 635 HG2 PRO 78 1HG PRO 78 -3.743 -5.275 -4.979 636 HG3 PRO 78 2HG PRO 78 -4.152 -7.000 -4.991 637 HD2 PRO 78 1HD PRO 78 -4.859 -5.322 -6.994 638 HD3 PRO 78 2HD PRO 78 -5.852 -6.715 -6.521 639 H ILE 79 H ILE 79 -7.852 -2.708 -3.667 640 HA ILE 79 HA ILE 79 -5.519 -0.991 -3.117 641 HB ILE 79 HB ILE 79 -6.783 -0.263 -5.096 642 HG12 ILE 79 1HG1 ILE 79 -7.584 2.013 -3.705 643 HG13 ILE 79 2HG1 ILE 79 -6.312 1.323 -2.704 644 HG21 ILE 79 1HG2 ILE 79 -9.005 -1.032 -3.643 645 HG22 ILE 79 2HG2 ILE 79 -9.112 0.727 -3.683 646 HG23 ILE 79 3HG2 ILE 79 -9.008 -0.184 -5.189 647 HD11 ILE 79 3HD1 ILE 79 -6.159 2.641 -5.308 648 HD12 ILE 79 1HD1 ILE 79 -4.952 2.496 -4.030 649 HD13 ILE 79 2HD1 ILE 79 -5.194 1.171 -5.170 650 H GLU 80 H GLU 80 -5.355 -0.121 -1.149 651 HA GLU 80 HA GLU 80 -7.743 -0.078 0.569 652 HB2 GLU 80 1HB GLU 80 -5.512 -1.731 0.919 653 HB3 GLU 80 2HB GLU 80 -5.301 -0.431 2.083 654 HG2 GLU 80 1HG GLU 80 -6.500 -2.400 2.979 655 HG3 GLU 80 2HG GLU 80 -7.413 -0.897 3.093 656 H ILE 81 H ILE 81 -7.357 1.344 2.549 657 HA ILE 81 HA ILE 81 -5.640 3.637 1.902 658 HB ILE 81 HB ILE 81 -8.516 3.841 2.801 659 HG12 ILE 81 1HG1 ILE 81 -7.189 4.602 0.190 660 HG13 ILE 81 2HG1 ILE 81 -8.308 3.265 0.430 661 HG21 ILE 81 1HG2 ILE 81 -6.343 5.622 3.151 662 HG22 ILE 81 2HG2 ILE 81 -7.418 6.318 1.939 663 HG23 ILE 81 3HG2 ILE 81 -8.046 5.883 3.529 664 HD11 ILE 81 3HD1 ILE 81 -10.012 4.605 0.020 665 HD12 ILE 81 1HD1 ILE 81 -9.539 5.652 1.358 666 HD13 ILE 81 2HD1 ILE 81 -8.887 5.934 -0.257 667 H ILE 82 H ILE 82 -4.423 4.261 3.561 668 HA ILE 82 HA ILE 82 -4.642 2.968 6.100 669 HB ILE 82 HB ILE 82 -2.918 5.357 5.461 670 HG12 ILE 82 1HG1 ILE 82 -2.307 2.427 5.014 671 HG13 ILE 82 2HG1 ILE 82 -2.594 3.616 3.749 672 HG21 ILE 82 1HG2 ILE 82 -2.591 3.101 7.434 673 HG22 ILE 82 2HG2 ILE 82 -1.464 4.435 7.190 674 HG23 ILE 82 3HG2 ILE 82 -3.080 4.750 7.821 675 HD11 ILE 82 3HD1 ILE 82 -0.441 4.097 3.734 676 HD12 ILE 82 1HD1 ILE 82 -0.544 4.620 5.415 677 HD13 ILE 82 2HD1 ILE 82 -0.163 2.940 5.035 678 H ASN 83 H ASN 83 -5.176 3.841 8.093 679 HA ASN 83 HA ASN 83 -7.112 5.974 8.017 680 HB2 ASN 83 1HB ASN 83 -6.751 3.735 9.604 681 HB3 ASN 83 2HB ASN 83 -6.312 5.061 10.674 682 HD21 ASN 83 2HD2 ASN 83 -8.078 4.903 11.983 683 HD22 ASN 83 1HD2 ASN 83 -9.683 5.277 11.464 684 H THR 84 H THR 84 -7.015 7.918 9.197 685 HA THR 84 HA THR 84 -4.685 9.381 9.017 686 HB THR 84 HB THR 84 -6.640 10.026 11.193 687 HG1 THR 84 HG1 THR 84 -8.028 10.871 9.540 688 HG21 THR 84 3HG2 THR 84 -5.654 12.018 11.061 689 HG22 THR 84 1HG2 THR 84 -6.080 12.140 9.354 690 HG23 THR 84 2HG2 THR 84 -4.561 11.381 9.833 691 H ILE 85 H ILE 85 -6.084 8.073 12.031 692 HA ILE 85 HA ILE 85 -3.949 8.732 13.700 693 HB ILE 85 HB ILE 85 -5.818 6.376 13.977 694 HG12 ILE 85 1HG1 ILE 85 -6.590 8.408 15.724 695 HG13 ILE 85 2HG1 ILE 85 -6.219 9.246 14.222 696 HG21 ILE 85 1HG2 ILE 85 -5.313 6.896 16.468 697 HG22 ILE 85 2HG2 ILE 85 -4.147 5.970 15.523 698 HG23 ILE 85 3HG2 ILE 85 -3.870 7.685 15.830 699 HD11 ILE 85 3HD1 ILE 85 -7.818 7.973 13.024 700 HD12 ILE 85 1HD1 ILE 85 -8.048 6.868 14.378 701 HD13 ILE 85 2HD1 ILE 85 -8.599 8.539 14.501 702 H ASP 86 H ASP 86 -4.576 5.759 11.871 703 HA ASP 86 HA ASP 86 -2.441 4.233 12.799 704 HB2 ASP 86 1HB ASP 86 -3.736 4.255 10.066 705 HB3 ASP 86 2HB ASP 86 -2.633 3.005 10.635 706 H TYR 87 H TYR 87 -2.576 6.447 10.022 707 HA TYR 87 HA TYR 87 0.065 6.058 9.155 708 HB2 TYR 87 1HB TYR 87 -1.687 7.156 7.800 709 HB3 TYR 87 2HB TYR 87 -1.639 8.544 8.883 710 HD1 TYR 87 HD1 TYR 87 0.439 6.567 6.519 711 HD2 TYR 87 HD2 TYR 87 -0.101 10.277 8.529 712 HE1 TYR 87 HE1 TYR 87 2.230 7.559 5.155 713 HE2 TYR 87 HE2 TYR 87 1.687 11.280 7.172 714 HH TYR 87 HH TYR 87 3.922 9.789 5.682 715 H GLY 88 H GLY 88 -1.291 8.721 11.112 716 HA2 GLY 88 1HA GLY 88 1.052 10.083 11.650 717 HA3 GLY 88 2HA GLY 88 -0.328 10.029 12.736 718 H THR 89 H THR 89 -0.242 7.234 13.282 719 HA THR 89 HA THR 89 1.801 7.249 15.308 720 HB THR 89 HB THR 89 0.862 5.121 16.034 721 HG1 THR 89 HG1 THR 89 0.347 4.143 14.087 722 HG21 THR 89 3HG2 THR 89 -0.567 6.498 17.070 723 HG22 THR 89 1HG2 THR 89 -1.720 6.087 15.801 724 HG23 THR 89 2HG2 THR 89 -0.720 7.532 15.651 725 H MET 90 H MET 90 1.472 6.006 12.117 726 HA MET 90 HA MET 90 2.875 4.836 10.764 727 HB2 MET 90 1HB MET 90 4.979 5.121 12.905 728 HB3 MET 90 2HB MET 90 5.218 4.926 11.174 729 HG2 MET 90 1HG MET 90 5.366 7.122 10.999 730 HG3 MET 90 2HG MET 90 3.669 7.233 11.463 731 HE1 MET 90 3HE MET 90 7.049 6.446 12.746 732 HE2 MET 90 1HE MET 90 7.405 7.688 13.946 733 HE3 MET 90 2HE MET 90 6.560 6.216 14.426 734 H ASN 91 H ASN 91 1.273 3.130 11.653 735 HA ASN 91 HA ASN 91 2.530 1.108 13.319 736 HB2 ASN 91 1HB ASN 91 -0.217 1.586 12.257 737 HB3 ASN 91 2HB ASN 91 0.235 -0.065 12.672 738 HD21 ASN 91 2HD2 ASN 91 1.374 -0.211 14.869 739 HD22 ASN 91 1HD2 ASN 91 0.626 0.666 16.156 740 H GLY 92 H GLY 92 4.234 0.455 11.934 741 HA2 GLY 92 1HA GLY 92 4.065 -0.311 9.285 742 HA3 GLY 92 2HA GLY 92 5.188 -1.008 10.442 743 H GLU 93 H GLU 93 3.569 -2.371 12.146 744 HA GLU 93 HA GLU 93 3.123 -4.777 10.853 745 HB2 GLU 93 1HB GLU 93 3.328 -4.435 13.326 746 HB3 GLU 93 2HB GLU 93 1.677 -3.831 13.332 747 HG2 GLU 93 1HG GLU 93 0.961 -6.026 12.374 748 HG3 GLU 93 2HG GLU 93 2.606 -6.602 12.633 749 H LYS 94 H LYS 94 0.784 -2.233 11.658 750 HA LYS 94 HA LYS 94 -1.497 -3.558 10.675 751 HB2 LYS 94 1HB LYS 94 -0.908 -0.610 10.985 752 HB3 LYS 94 2HB LYS 94 -2.492 -1.258 10.579 753 HG2 LYS 94 1HG LYS 94 -0.985 -1.991 13.077 754 HG3 LYS 94 2HG LYS 94 -2.162 -0.678 12.987 755 HD2 LYS 94 1HD LYS 94 -3.812 -2.134 13.300 756 HD3 LYS 94 2HD LYS 94 -3.335 -2.998 11.837 757 HE2 LYS 94 1HE LYS 94 -1.635 -4.212 13.217 758 HE3 LYS 94 2HE LYS 94 -2.340 -3.457 14.645 759 HZ1 LYS 94 3HZ LYS 94 -3.436 -5.549 12.915 760 HZ2 LYS 94 1HZ LYS 94 -4.522 -4.468 13.634 761 HZ3 LYS 94 2HZ LYS 94 -3.494 -5.402 14.601 762 H VAL 95 H VAL 95 0.810 -1.365 9.138 763 HA VAL 95 HA VAL 95 -0.526 -1.038 6.694 764 HB VAL 95 HB VAL 95 2.454 -1.035 7.192 765 HG11 VAL 95 1HG1 VAL 95 2.208 -1.170 4.875 766 HG12 VAL 95 2HG1 VAL 95 0.769 -0.149 4.874 767 HG13 VAL 95 3HG1 VAL 95 2.354 0.560 5.183 768 HG21 VAL 95 3HG2 VAL 95 2.154 0.871 8.293 769 HG22 VAL 95 1HG2 VAL 95 1.383 1.569 6.868 770 HG23 VAL 95 2HG2 VAL 95 0.409 0.733 8.077 771 H LEU 96 H LEU 96 2.333 -3.095 7.273 772 HA LEU 96 HA LEU 96 2.260 -4.514 4.909 773 HB2 LEU 96 1HB LEU 96 3.429 -6.331 6.202 774 HB3 LEU 96 2HB LEU 96 4.162 -4.730 6.275 775 HG LEU 96 HG LEU 96 2.565 -4.744 8.503 776 HD11 LEU 96 1HD1 LEU 96 2.541 -6.776 9.550 777 HD12 LEU 96 2HD1 LEU 96 3.917 -7.391 8.637 778 HD13 LEU 96 3HD1 LEU 96 2.331 -7.282 7.874 779 HD21 LEU 96 3HD2 LEU 96 5.464 -5.481 8.149 780 HD22 LEU 96 1HD2 LEU 96 4.719 -5.165 9.716 781 HD23 LEU 96 2HD2 LEU 96 4.787 -3.890 8.500 782 H GLN 97 H GLN 97 0.776 -5.433 8.014 783 HA GLN 97 HA GLN 97 -0.356 -7.837 7.271 784 HB2 GLN 97 1HB GLN 97 -1.215 -5.722 9.223 785 HB3 GLN 97 2HB GLN 97 -2.184 -7.169 8.984 786 HG2 GLN 97 1HG GLN 97 0.691 -7.593 9.473 787 HG3 GLN 97 2HG GLN 97 -0.252 -6.963 10.822 788 HE21 GLN 97 2HE2 GLN 97 0.291 -9.651 8.707 789 HE22 GLN 97 1HE2 GLN 97 -0.662 -10.799 9.579 790 H LEU 98 H LEU 98 -1.773 -4.588 6.987 791 HA LEU 98 HA LEU 98 -4.237 -5.325 5.921 792 HB2 LEU 98 1HB LEU 98 -3.399 -3.033 6.711 793 HB3 LEU 98 2HB LEU 98 -2.765 -2.849 5.077 794 HG LEU 98 HG LEU 98 -5.025 -3.032 4.170 795 HD11 LEU 98 1HD1 LEU 98 -6.048 -4.487 5.781 796 HD12 LEU 98 2HD1 LEU 98 -6.953 -2.974 5.729 797 HD13 LEU 98 3HD1 LEU 98 -5.841 -3.290 7.060 798 HD21 LEU 98 3HD2 LEU 98 -5.878 -0.905 4.967 799 HD22 LEU 98 1HD2 LEU 98 -4.125 -0.830 4.791 800 HD23 LEU 98 2HD2 LEU 98 -4.844 -0.999 6.393 801 H ALA 99 H ALA 99 -1.298 -4.314 4.174 802 HA ALA 99 HA ALA 99 -2.233 -4.656 1.586 803 HB1 ALA 99 3HB ALA 99 0.121 -4.876 0.928 804 HB2 ALA 99 1HB ALA 99 -0.122 -3.561 2.080 805 HB3 ALA 99 2HB ALA 99 0.566 -5.093 2.621 806 H ILE 100 H ILE 100 -0.885 -7.029 3.820 807 HA ILE 100 HA ILE 100 -0.649 -9.165 2.000 808 HB ILE 100 HB ILE 100 -1.125 -9.246 4.982 809 HG12 ILE 100 1HG1 ILE 100 1.503 -9.840 3.708 810 HG13 ILE 100 2HG1 ILE 100 1.003 -8.156 3.808 811 HG21 ILE 100 1HG2 ILE 100 -1.572 -11.411 4.534 812 HG22 ILE 100 2HG2 ILE 100 -0.777 -11.361 2.962 813 HG23 ILE 100 3HG2 ILE 100 0.184 -11.533 4.429 814 HD11 ILE 100 3HD1 ILE 100 0.553 -9.351 6.336 815 HD12 ILE 100 1HD1 ILE 100 2.180 -9.775 5.804 816 HD13 ILE 100 2HD1 ILE 100 1.698 -8.082 5.901 817 H ASN 101 H ASN 101 -3.132 -8.751 4.533 818 HA ASN 101 HA ASN 101 -4.855 -10.737 3.659 819 HB2 ASN 101 1HB ASN 101 -6.318 -9.962 5.241 820 HB3 ASN 101 2HB ASN 101 -4.870 -9.114 5.777 821 HD21 ASN 101 2HD2 ASN 101 -7.924 -8.823 4.133 822 HD22 ASN 101 1HD2 ASN 101 -8.027 -7.100 4.208 823 H ALA 102 H ALA 102 -4.499 -7.431 2.553 824 HA ALA 102 HA ALA 102 -6.880 -7.287 1.032 825 HB1 ALA 102 3HB ALA 102 -5.958 -5.215 1.454 826 HB2 ALA 102 1HB ALA 102 -4.320 -5.747 1.072 827 HB3 ALA 102 2HB ALA 102 -5.488 -5.482 -0.224 828 H PHE 103 H PHE 103 -3.548 -8.171 0.184 829 HA PHE 103 HA PHE 103 -4.013 -8.554 -2.570 830 HB2 PHE 103 1HB PHE 103 -1.764 -8.303 -1.485 831 HB3 PHE 103 2HB PHE 103 -1.933 -9.944 -0.872 832 HD1 PHE 103 HD2 PHE 103 -2.786 -8.517 -4.201 833 HD2 PHE 103 HD1 PHE 103 -0.353 -11.211 -1.980 834 HE1 PHE 103 HE2 PHE 103 -1.847 -9.392 -6.299 835 HE2 PHE 103 HE1 PHE 103 0.592 -12.090 -4.075 836 HZ PHE 103 HZ PHE 103 -0.156 -11.181 -6.239 837 H ASN 104 H ASN 104 -3.844 -10.896 0.108 838 HA ASN 104 HA ASN 104 -4.441 -13.174 -1.414 839 HB2 ASN 104 1HB ASN 104 -4.339 -12.477 1.443 840 HB3 ASN 104 2HB ASN 104 -5.445 -13.792 1.055 841 HD21 ASN 104 2HD2 ASN 104 -2.130 -12.679 0.565 842 HD22 ASN 104 1HD2 ASN 104 -1.422 -14.253 0.511 843 H ASN 105 H ASN 105 -6.604 -11.289 0.710 844 HA ASN 105 HA ASN 105 -8.969 -12.602 0.086 845 HB2 ASN 105 1HB ASN 105 -8.517 -10.814 1.883 846 HB3 ASN 105 2HB ASN 105 -8.859 -9.640 0.616 847 HD21 ASN 105 2HD2 ASN 105 -10.597 -8.995 2.042 848 HD22 ASN 105 1HD2 ASN 105 -12.096 -9.852 1.989 849 H LYS 106 H LYS 106 -7.345 -9.960 -1.583 850 HA LYS 106 HA LYS 106 -7.612 -9.071 -3.659 851 HB2 LYS 106 1HB LYS 106 -8.267 -11.814 -3.912 852 HB3 LYS 106 2HB LYS 106 -9.456 -10.919 -4.849 853 HG2 LYS 106 1HG LYS 106 -6.919 -9.805 -5.415 854 HG3 LYS 106 2HG LYS 106 -6.772 -11.562 -5.519 855 HD2 LYS 106 1HD LYS 106 -8.674 -11.638 -7.049 856 HD3 LYS 106 2HD LYS 106 -8.851 -9.886 -6.928 857 HE2 LYS 106 1HE LYS 106 -7.673 -10.220 -8.923 858 HE3 LYS 106 2HE LYS 106 -6.437 -9.762 -7.752 859 HZ1 LYS 106 3HZ LYS 106 -5.776 -12.024 -7.527 860 HZ2 LYS 106 1HZ LYS 106 -5.831 -11.677 -9.182 861 HZ3 LYS 106 2HZ LYS 106 -7.073 -12.571 -8.465 862 H SER 107 H SER 107 -9.525 -8.610 -5.372 863 HA SER 107 HA SER 107 -11.655 -7.398 -3.755 864 HB2 SER 107 1HB SER 107 -10.770 -5.648 -4.960 865 HB3 SER 107 2HB SER 107 -10.317 -6.673 -6.322 866 HG SER 107 HG SER 107 -12.065 -5.927 -7.207 867 H SER 108 H SER 108 -11.400 -8.661 -7.083 868 HA SER 108 HA SER 108 -13.358 -10.657 -6.772 869 HB2 SER 108 1HB SER 108 -14.875 -8.723 -6.515 870 HB3 SER 108 2HB SER 108 -14.360 -8.121 -8.091 871 HG SER 108 HG SER 108 -16.371 -9.502 -7.884 872 H VAL 109 H VAL 109 -11.670 -11.695 -7.936 873 HA VAL 109 HA VAL 109 -10.676 -12.548 -9.798 874 HB VAL 109 HB VAL 109 -12.971 -11.265 -11.285 875 HG11 VAL 109 1HG1 VAL 109 -11.028 -12.038 -12.649 876 HG12 VAL 109 2HG1 VAL 109 -11.315 -13.668 -12.036 877 HG13 VAL 109 3HG1 VAL 109 -12.544 -12.862 -13.012 878 HG21 VAL 109 3HG2 VAL 109 -14.059 -12.611 -9.751 879 HG22 VAL 109 1HG2 VAL 109 -13.836 -13.710 -11.111 880 HG23 VAL 109 2HG2 VAL 109 -12.759 -13.802 -9.716 Start of MODEL 11 1 H1 GLY 1 H GLY 1 13.842 -17.441 -9.038 2 HA2 GLY 1 1HA GLY 1 14.405 -17.301 -6.565 3 HA3 GLY 1 2HA GLY 1 14.036 -15.593 -6.745 4 HA PRO 2 HA PRO 2 10.208 -17.932 -5.428 5 HB2 PRO 2 1HB PRO 2 9.707 -16.414 -3.233 6 HB3 PRO 2 2HB PRO 2 10.747 -17.842 -3.196 7 HG2 PRO 2 1HG PRO 2 11.506 -14.952 -3.360 8 HG3 PRO 2 2HG PRO 2 12.226 -16.243 -2.382 9 HD2 PRO 2 1HD PRO 2 13.332 -15.381 -4.698 10 HD3 PRO 2 2HD PRO 2 13.460 -17.064 -4.147 11 H GLY 3 H GLY 3 8.012 -16.927 -4.992 12 HA2 GLY 3 1HA GLY 3 7.474 -14.984 -7.003 13 HA3 GLY 3 2HA GLY 3 6.312 -15.645 -5.863 14 H SER 4 H SER 4 7.045 -14.856 -3.464 15 HA SER 4 HA SER 4 7.017 -13.112 -2.003 16 HB2 SER 4 1HB SER 4 8.694 -11.560 -2.213 17 HB3 SER 4 2HB SER 4 9.238 -12.711 -3.433 18 HG SER 4 HG SER 4 8.316 -10.153 -3.727 19 H MET 5 H MET 5 6.419 -10.646 -1.875 20 HA MET 5 HA MET 5 4.293 -10.071 -3.824 21 HB2 MET 5 1HB MET 5 3.360 -11.030 -1.712 22 HB3 MET 5 2HB MET 5 4.043 -9.664 -0.840 23 HG2 MET 5 1HG MET 5 2.582 -8.144 -1.835 24 HG3 MET 5 2HG MET 5 2.158 -9.263 -3.128 25 HE1 MET 5 3HE MET 5 2.564 -9.357 0.595 26 HE2 MET 5 1HE MET 5 1.140 -8.334 0.790 27 HE3 MET 5 2HE MET 5 1.068 -10.039 1.234 28 H ASN 6 H ASN 6 3.817 -7.864 -4.149 29 HA ASN 6 HA ASN 6 5.838 -6.007 -3.074 30 HB2 ASN 6 1HB ASN 6 4.577 -5.635 -5.777 31 HB3 ASN 6 2HB ASN 6 6.086 -4.968 -5.159 32 HD21 ASN 6 2HD2 ASN 6 7.915 -5.966 -5.651 33 HD22 ASN 6 1HD2 ASN 6 8.041 -7.534 -6.366 34 H ILE 7 H ILE 7 5.125 -4.125 -2.240 35 HA ILE 7 HA ILE 7 2.236 -3.574 -2.440 36 HB ILE 7 HB ILE 7 4.090 -2.894 -0.154 37 HG12 ILE 7 1HG1 ILE 7 2.016 -4.542 0.737 38 HG13 ILE 7 2HG1 ILE 7 2.534 -5.262 -0.783 39 HG21 ILE 7 1HG2 ILE 7 1.264 -2.209 -0.777 40 HG22 ILE 7 2HG2 ILE 7 1.708 -2.508 0.902 41 HG23 ILE 7 3HG2 ILE 7 2.521 -1.237 -0.010 42 HD11 ILE 7 3HD1 ILE 7 3.642 -5.900 1.522 43 HD12 ILE 7 1HD1 ILE 7 4.573 -5.837 0.026 44 HD13 ILE 7 2HD1 ILE 7 4.631 -4.485 1.158 45 H LEU 8 H LEU 8 1.553 -1.483 -2.796 46 HA LEU 8 HA LEU 8 3.664 0.445 -3.508 47 HB2 LEU 8 1HB LEU 8 2.164 -0.530 -5.342 48 HB3 LEU 8 2HB LEU 8 0.884 0.456 -4.639 49 HG LEU 8 HG LEU 8 1.992 1.457 -6.636 50 HD11 LEU 8 1HD1 LEU 8 1.484 3.481 -5.844 51 HD12 LEU 8 2HD1 LEU 8 2.692 3.384 -4.562 52 HD13 LEU 8 3HD1 LEU 8 1.105 2.650 -4.334 53 HD21 LEU 8 3HD2 LEU 8 4.317 0.619 -5.502 54 HD22 LEU 8 1HD2 LEU 8 4.314 2.330 -5.074 55 HD23 LEU 8 2HD2 LEU 8 4.198 1.845 -6.766 56 H LEU 9 H LEU 9 3.627 2.409 -2.583 57 HA LEU 9 HA LEU 9 1.269 3.118 -0.965 58 HB2 LEU 9 1HB LEU 9 3.447 2.422 0.232 59 HB3 LEU 9 2HB LEU 9 4.053 3.994 -0.286 60 HG LEU 9 HG LEU 9 1.506 4.293 1.016 61 HD11 LEU 9 1HD1 LEU 9 1.904 2.328 2.259 62 HD12 LEU 9 2HD1 LEU 9 2.375 3.667 3.305 63 HD13 LEU 9 3HD1 LEU 9 3.609 2.718 2.477 64 HD21 LEU 9 3HD2 LEU 9 3.045 5.661 2.563 65 HD22 LEU 9 1HD2 LEU 9 2.880 6.165 0.881 66 HD23 LEU 9 2HD2 LEU 9 4.312 5.273 1.397 67 H VAL 10 H VAL 10 0.316 4.950 -1.539 68 HA VAL 10 HA VAL 10 1.766 6.808 -3.286 69 HB VAL 10 HB VAL 10 -1.197 6.731 -2.707 70 HG11 VAL 10 1HG1 VAL 10 -0.194 8.887 -3.511 71 HG12 VAL 10 2HG1 VAL 10 0.261 8.043 -4.993 72 HG13 VAL 10 3HG1 VAL 10 -1.441 8.208 -4.557 73 HG21 VAL 10 3HG2 VAL 10 -0.393 4.653 -3.785 74 HG22 VAL 10 1HG2 VAL 10 -1.470 5.592 -4.819 75 HG23 VAL 10 2HG2 VAL 10 0.270 5.624 -5.100 76 H CYS 11 H CYS 11 2.704 8.461 -2.289 77 HA CYS 11 HA CYS 11 1.288 10.347 -0.775 78 HB2 CYS 11 1HB CYS 11 1.284 8.736 1.018 79 HB3 CYS 11 2HB CYS 11 3.010 8.449 0.826 80 HG CYS 11 HG CYS 11 1.418 10.941 2.430 81 H GLY 12 H GLY 12 2.274 12.105 -1.519 82 HA2 GLY 12 1HA GLY 12 4.961 12.124 -2.443 83 HA3 GLY 12 2HA GLY 12 3.925 13.529 -2.247 84 H ALA 13 H ALA 13 6.778 12.312 -1.328 85 HA ALA 13 HA ALA 13 6.758 13.854 1.170 86 HB1 ALA 13 3HB ALA 13 7.379 12.148 2.465 87 HB2 ALA 13 1HB ALA 13 6.869 11.100 1.140 88 HB3 ALA 13 2HB ALA 13 8.561 11.577 1.288 89 H GLY 14 H GLY 14 8.378 15.279 1.306 90 HA2 GLY 14 1HA GLY 14 10.320 15.391 -0.841 91 HA3 GLY 14 2HA GLY 14 10.093 16.586 0.428 92 H MET 15 H MET 15 10.947 13.121 0.374 93 HA MET 15 HA MET 15 13.569 13.671 1.433 94 HB2 MET 15 1HB MET 15 13.167 12.186 3.455 95 HB3 MET 15 2HB MET 15 12.468 13.799 3.522 96 HG2 MET 15 1HG MET 15 10.621 11.899 2.379 97 HG3 MET 15 2HG MET 15 11.173 11.390 3.973 98 HE1 MET 15 3HE MET 15 10.070 13.948 6.390 99 HE2 MET 15 1HE MET 15 9.427 12.326 6.139 100 HE3 MET 15 2HE MET 15 11.154 12.626 5.952 101 H SER 16 H SER 16 14.982 11.999 1.100 102 HA SER 16 HA SER 16 14.372 10.088 -0.840 103 HB2 SER 16 1HB SER 16 16.561 8.985 0.184 104 HB3 SER 16 2HB SER 16 16.638 10.486 -0.739 105 HG SER 16 HG SER 16 17.566 11.218 1.002 106 H THR 17 H THR 17 14.771 9.687 2.672 107 HA THR 17 HA THR 17 13.857 6.936 2.528 108 HB THR 17 HB THR 17 14.311 6.805 4.891 109 HG1 THR 17 HG1 THR 17 13.719 8.664 5.822 110 HG21 THR 17 3HG2 THR 17 16.268 6.618 3.499 111 HG22 THR 17 1HG2 THR 17 16.694 7.534 4.944 112 HG23 THR 17 2HG2 THR 17 16.428 8.372 3.415 113 H SER 18 H SER 18 12.243 6.307 4.359 114 HA SER 18 HA SER 18 10.136 8.278 4.743 115 HB2 SER 18 1HB SER 18 9.687 5.675 3.263 116 HB3 SER 18 2HB SER 18 8.398 6.726 3.852 117 HG SER 18 HG SER 18 8.669 7.451 1.849 118 H MET 19 H MET 19 9.304 8.095 6.718 119 HA MET 19 HA MET 19 10.222 6.307 8.622 120 HB2 MET 19 1HB MET 19 7.647 7.883 8.538 121 HB3 MET 19 2HB MET 19 8.212 7.015 9.959 122 HG2 MET 19 1HG MET 19 9.499 8.712 10.541 123 HG3 MET 19 2HG MET 19 10.310 8.683 8.977 124 HE1 MET 19 3HE MET 19 10.806 10.971 9.469 125 HE2 MET 19 1HE MET 19 10.293 11.417 7.842 126 HE3 MET 19 2HE MET 19 9.743 12.359 9.229 127 H LEU 20 H LEU 20 7.082 6.238 6.933 128 HA LEU 20 HA LEU 20 6.056 3.923 8.027 129 HB2 LEU 20 1HB LEU 20 5.675 5.403 5.504 130 HB3 LEU 20 2HB LEU 20 5.128 3.728 5.505 131 HG LEU 20 HG LEU 20 4.223 5.825 7.476 132 HD11 LEU 20 1HD1 LEU 20 2.737 4.716 5.103 133 HD12 LEU 20 2HD1 LEU 20 3.524 6.294 5.141 134 HD13 LEU 20 3HD1 LEU 20 2.181 5.953 6.231 135 HD21 LEU 20 3HD2 LEU 20 2.956 4.242 8.467 136 HD22 LEU 20 1HD2 LEU 20 4.190 3.157 7.824 137 HD23 LEU 20 2HD2 LEU 20 2.667 3.374 6.958 138 H VAL 21 H VAL 21 7.923 4.184 5.000 139 HA VAL 21 HA VAL 21 8.085 1.486 4.391 140 HB VAL 21 HB VAL 21 10.196 3.591 3.901 141 HG11 VAL 21 1HG1 VAL 21 10.323 1.821 1.825 142 HG12 VAL 21 2HG1 VAL 21 11.404 1.831 3.220 143 HG13 VAL 21 3HG1 VAL 21 10.003 0.759 3.196 144 HG21 VAL 21 3HG2 VAL 21 8.052 2.647 2.012 145 HG22 VAL 21 1HG2 VAL 21 7.868 4.062 3.048 146 HG23 VAL 21 2HG2 VAL 21 9.137 4.024 1.824 147 H GLN 22 H GLN 22 10.090 3.414 6.561 148 HA GLN 22 HA GLN 22 12.079 1.495 7.057 149 HB2 GLN 22 1HB GLN 22 11.166 4.003 8.302 150 HB3 GLN 22 2HB GLN 22 11.961 2.884 9.401 151 HG2 GLN 22 1HG GLN 22 13.675 2.822 7.320 152 HG3 GLN 22 2HG GLN 22 13.062 4.470 7.189 153 HE21 GLN 22 2HE2 GLN 22 14.058 5.952 8.347 154 HE22 GLN 22 1HE2 GLN 22 15.039 5.666 9.740 155 H ARG 23 H ARG 23 9.120 2.265 8.883 156 HA ARG 23 HA ARG 23 9.417 0.336 10.879 157 HB2 ARG 23 1HB ARG 23 6.795 1.290 9.721 158 HB3 ARG 23 2HB ARG 23 7.072 0.644 11.333 159 HG2 ARG 23 1HG ARG 23 8.792 2.885 10.912 160 HG3 ARG 23 2HG ARG 23 7.133 3.327 10.505 161 HD2 ARG 23 1HD ARG 23 6.442 3.193 12.640 162 HD3 ARG 23 2HD ARG 23 7.410 1.756 12.965 163 HE ARG 23 HE ARG 23 8.097 4.439 13.584 164 HH11 ARG 23 1HH1 ARG 23 9.457 1.407 12.547 165 HH12 ARG 23 2HH1 ARG 23 11.021 1.730 13.218 166 HH21 ARG 23 1HH2 ARG 23 10.152 4.877 14.469 167 HH22 ARG 23 2HH2 ARG 23 11.416 3.704 14.312 168 H ILE 24 H ILE 24 7.444 0.147 7.912 169 HA ILE 24 HA ILE 24 6.617 -2.491 8.186 170 HB ILE 24 HB ILE 24 7.189 -1.010 5.615 171 HG12 ILE 24 1HG1 ILE 24 4.409 -1.341 6.481 172 HG13 ILE 24 2HG1 ILE 24 5.371 -0.361 7.583 173 HG21 ILE 24 1HG2 ILE 24 5.297 -2.627 4.850 174 HG22 ILE 24 2HG2 ILE 24 6.963 -3.199 4.927 175 HG23 ILE 24 3HG2 ILE 24 5.833 -3.600 6.220 176 HD11 ILE 24 3HD1 ILE 24 4.278 0.302 5.004 177 HD12 ILE 24 1HD1 ILE 24 4.961 1.352 6.246 178 HD13 ILE 24 2HD1 ILE 24 6.017 0.588 5.058 179 H GLU 25 H GLU 25 9.500 -1.201 6.561 180 HA GLU 25 HA GLU 25 10.481 -3.636 5.579 181 HB2 GLU 25 1HB GLU 25 11.772 -1.014 6.267 182 HB3 GLU 25 2HB GLU 25 12.750 -2.382 5.756 183 HG2 GLU 25 1HG GLU 25 10.463 -1.854 4.020 184 HG3 GLU 25 2HG GLU 25 11.627 -0.532 4.102 185 H LYS 26 H LYS 26 10.881 -2.049 8.698 186 HA LYS 26 HA LYS 26 12.876 -3.766 9.719 187 HB2 LYS 26 1HB LYS 26 11.241 -1.595 10.685 188 HB3 LYS 26 2HB LYS 26 11.310 -2.880 11.884 189 HG2 LYS 26 1HG LYS 26 13.068 -1.299 12.300 190 HG3 LYS 26 2HG LYS 26 13.773 -2.824 11.758 191 HD2 LYS 26 1HD LYS 26 14.428 -1.957 9.733 192 HD3 LYS 26 2HD LYS 26 13.166 -0.723 9.733 193 HE2 LYS 26 1HE LYS 26 14.349 0.627 11.262 194 HE3 LYS 26 2HE LYS 26 15.451 -0.682 11.684 195 HZ1 LYS 26 3HZ LYS 26 16.751 -0.259 9.928 196 HZ2 LYS 26 1HZ LYS 26 16.007 1.260 9.924 197 HZ3 LYS 26 2HZ LYS 26 15.452 0.045 8.887 198 H TYR 27 H TYR 27 9.382 -3.684 10.452 199 HA TYR 27 HA TYR 27 9.237 -5.992 11.957 200 HB2 TYR 27 1HB TYR 27 7.347 -4.505 11.799 201 HB3 TYR 27 2HB TYR 27 7.195 -4.806 10.071 202 HD1 TYR 27 HD1 TYR 27 6.235 -6.893 9.250 203 HD2 TYR 27 HD2 TYR 27 6.545 -6.113 13.421 204 HE1 TYR 27 HE1 TYR 27 4.667 -8.732 9.704 205 HE2 TYR 27 HE2 TYR 27 4.978 -7.951 13.887 206 HH TYR 27 HH TYR 27 2.966 -9.223 11.808 207 H ALA 28 H ALA 28 8.881 -5.657 8.438 208 HA ALA 28 HA ALA 28 8.410 -8.383 7.904 209 HB1 ALA 28 3HB ALA 28 8.351 -6.112 6.419 210 HB2 ALA 28 1HB ALA 28 9.815 -6.884 5.809 211 HB3 ALA 28 2HB ALA 28 8.277 -7.744 5.756 212 H LYS 29 H LYS 29 11.400 -6.458 7.735 213 HA LYS 29 HA LYS 29 13.117 -8.494 6.912 214 HB2 LYS 29 1HB LYS 29 13.758 -6.130 6.927 215 HB3 LYS 29 2HB LYS 29 13.717 -6.117 8.685 216 HG2 LYS 29 1HG LYS 29 15.722 -7.125 8.876 217 HG3 LYS 29 2HG LYS 29 15.467 -8.144 7.457 218 HD2 LYS 29 1HD LYS 29 15.763 -6.024 6.079 219 HD3 LYS 29 2HD LYS 29 16.363 -5.274 7.561 220 HE2 LYS 29 1HE LYS 29 18.111 -6.971 7.719 221 HE3 LYS 29 2HE LYS 29 17.499 -7.749 6.259 222 HZ1 LYS 29 3HZ LYS 29 18.239 -4.914 6.133 223 HZ2 LYS 29 1HZ LYS 29 18.306 -6.099 4.928 224 HZ3 LYS 29 2HZ LYS 29 19.475 -6.069 6.150 225 H SER 30 H SER 30 11.779 -7.780 10.047 226 HA SER 30 HA SER 30 13.594 -9.548 11.445 227 HB2 SER 30 1HB SER 30 11.128 -8.045 12.348 228 HB3 SER 30 2HB SER 30 12.118 -9.042 13.414 229 HG SER 30 HG SER 30 13.819 -7.654 13.118 230 H LYS 31 H LYS 31 10.223 -9.561 10.383 231 HA LYS 31 HA LYS 31 9.610 -12.099 11.538 232 HB2 LYS 31 1HB LYS 31 8.248 -10.119 9.836 233 HB3 LYS 31 2HB LYS 31 7.755 -11.784 9.558 234 HG2 LYS 31 1HG LYS 31 7.808 -10.528 12.288 235 HG3 LYS 31 2HG LYS 31 6.394 -10.493 11.231 236 HD2 LYS 31 1HD LYS 31 7.392 -13.164 11.353 237 HD3 LYS 31 2HD LYS 31 7.217 -12.546 12.997 238 HE2 LYS 31 1HE LYS 31 5.017 -12.117 11.027 239 HE3 LYS 31 2HE LYS 31 5.203 -13.701 11.780 240 HZ1 LYS 31 3HZ LYS 31 5.316 -12.241 13.937 241 HZ2 LYS 31 1HZ LYS 31 3.829 -12.695 13.269 242 HZ3 LYS 31 2HZ LYS 31 4.444 -11.144 12.990 243 H ASN 32 H ASN 32 11.306 -11.129 8.758 244 HA ASN 32 HA ASN 32 12.285 -12.282 7.059 245 HB2 ASN 32 1HB ASN 32 11.446 -14.877 8.318 246 HB3 ASN 32 2HB ASN 32 12.916 -14.506 7.421 247 HD21 ASN 32 2HD2 ASN 32 13.787 -12.245 8.667 248 HD22 ASN 32 1HD2 ASN 32 14.202 -12.601 10.306 249 H ILE 33 H ILE 33 10.054 -11.333 6.219 250 HA ILE 33 HA ILE 33 8.536 -13.551 5.014 251 HB ILE 33 HB ILE 33 7.656 -10.695 5.454 252 HG12 ILE 33 1HG1 ILE 33 6.476 -13.158 6.721 253 HG13 ILE 33 2HG1 ILE 33 7.839 -12.320 7.455 254 HG21 ILE 33 1HG2 ILE 33 6.311 -13.048 4.158 255 HG22 ILE 33 2HG2 ILE 33 5.411 -11.667 4.781 256 HG23 ILE 33 3HG2 ILE 33 6.591 -11.440 3.491 257 HD11 ILE 33 3HD1 ILE 33 6.454 -10.248 7.467 258 HD12 ILE 33 1HD1 ILE 33 5.089 -11.227 6.932 259 HD13 ILE 33 2HD1 ILE 33 5.847 -11.547 8.493 260 H ASN 34 H ASN 34 8.311 -13.670 2.831 261 HA ASN 34 HA ASN 34 10.152 -12.149 1.234 262 HB2 ASN 34 1HB ASN 34 8.078 -14.191 0.401 263 HB3 ASN 34 2HB ASN 34 9.363 -13.558 -0.623 264 HD21 ASN 34 2HD2 ASN 34 11.572 -13.976 0.051 265 HD22 ASN 34 1HD2 ASN 34 11.929 -15.441 0.894 266 H ALA 35 H ALA 35 9.273 -10.025 1.532 267 HA ALA 35 HA ALA 35 7.269 -9.392 -0.469 268 HB1 ALA 35 3HB ALA 35 6.451 -7.831 1.700 269 HB2 ALA 35 1HB ALA 35 5.577 -9.168 0.951 270 HB3 ALA 35 2HB ALA 35 6.631 -9.468 2.335 271 H THR 36 H THR 36 7.039 -6.993 -0.733 272 HA THR 36 HA THR 36 9.297 -5.432 0.249 273 HB THR 36 HB THR 36 10.189 -6.389 -1.801 274 HG1 THR 36 HG1 THR 36 10.618 -4.145 -1.304 275 HG21 THR 36 3HG2 THR 36 8.204 -6.947 -3.012 276 HG22 THR 36 1HG2 THR 36 9.107 -5.787 -3.987 277 HG23 THR 36 2HG2 THR 36 7.696 -5.259 -3.070 278 H ILE 37 H ILE 37 9.010 -3.176 0.076 279 HA ILE 37 HA ILE 37 6.367 -2.281 -0.844 280 HB ILE 37 HB ILE 37 6.324 -2.584 1.625 281 HG12 ILE 37 1HG1 ILE 37 6.201 0.349 0.939 282 HG13 ILE 37 2HG1 ILE 37 5.023 -0.801 0.315 283 HG21 ILE 37 1HG2 ILE 37 8.737 -2.004 1.947 284 HG22 ILE 37 2HG2 ILE 37 8.300 -0.314 1.709 285 HG23 ILE 37 3HG2 ILE 37 7.633 -1.213 3.072 286 HD11 ILE 37 3HD1 ILE 37 3.926 -0.065 2.163 287 HD12 ILE 37 1HD1 ILE 37 4.801 -1.427 2.862 288 HD13 ILE 37 2HD1 ILE 37 5.410 0.215 3.073 289 H GLU 38 H GLU 38 6.247 -0.116 -1.516 290 HA GLU 38 HA GLU 38 8.646 1.513 -1.489 291 HB2 GLU 38 1HB GLU 38 8.724 -0.075 -3.511 292 HB3 GLU 38 2HB GLU 38 7.405 0.890 -4.158 293 HG2 GLU 38 1HG GLU 38 8.962 2.194 -5.044 294 HG3 GLU 38 2HG GLU 38 9.269 2.775 -3.407 295 H ALA 39 H ALA 39 8.242 3.686 -1.764 296 HA ALA 39 HA ALA 39 5.403 4.430 -2.049 297 HB1 ALA 39 3HB ALA 39 7.519 5.851 -0.436 298 HB2 ALA 39 1HB ALA 39 5.820 6.306 -0.566 299 HB3 ALA 39 2HB ALA 39 6.272 4.792 0.220 300 H ILE 40 H ILE 40 4.866 5.947 -3.518 301 HA ILE 40 HA ILE 40 6.883 7.700 -4.650 302 HB ILE 40 HB ILE 40 6.259 7.067 -6.991 303 HG12 ILE 40 1HG1 ILE 40 5.526 4.354 -6.481 304 HG13 ILE 40 2HG1 ILE 40 4.409 5.400 -5.611 305 HG21 ILE 40 1HG2 ILE 40 7.881 5.377 -7.153 306 HG22 ILE 40 2HG2 ILE 40 8.328 6.301 -5.720 307 HG23 ILE 40 3HG2 ILE 40 7.508 4.749 -5.548 308 HD11 ILE 40 3HD1 ILE 40 4.554 6.601 -8.063 309 HD12 ILE 40 1HD1 ILE 40 4.663 4.888 -8.463 310 HD13 ILE 40 2HD1 ILE 40 3.292 5.490 -7.531 311 H ALA 41 H ALA 41 5.685 8.894 -6.641 312 HA ALA 41 HA ALA 41 3.378 10.148 -5.410 313 HB1 ALA 41 3HB ALA 41 3.882 11.274 -7.951 314 HB2 ALA 41 1HB ALA 41 4.240 11.955 -6.363 315 HB3 ALA 41 2HB ALA 41 5.445 10.969 -7.193 316 H GLU 42 H GLU 42 1.809 10.985 -7.394 317 HA GLU 42 HA GLU 42 0.471 8.551 -8.206 318 HB2 GLU 42 1HB GLU 42 -1.302 10.109 -9.012 319 HB3 GLU 42 2HB GLU 42 -0.910 10.302 -7.310 320 HG2 GLU 42 1HG GLU 42 -0.017 12.367 -7.600 321 HG3 GLU 42 2HG GLU 42 0.527 12.025 -9.241 322 H THR 43 H THR 43 2.525 10.933 -9.604 323 HA THR 43 HA THR 43 1.768 10.717 -12.308 324 HB THR 43 HB THR 43 3.193 12.536 -11.598 325 HG1 THR 43 HG1 THR 43 3.567 12.089 -13.715 326 HG21 THR 43 3HG2 THR 43 5.701 11.119 -11.370 327 HG22 THR 43 1HG2 THR 43 4.551 10.575 -10.149 328 HG23 THR 43 2HG2 THR 43 4.968 12.285 -10.269 329 H ARG 44 H ARG 44 3.846 8.763 -10.273 330 HA ARG 44 HA ARG 44 4.407 7.012 -12.575 331 HB2 ARG 44 1HB ARG 44 5.915 7.232 -9.963 332 HB3 ARG 44 2HB ARG 44 6.336 6.187 -11.312 333 HG2 ARG 44 1HG ARG 44 6.897 8.036 -12.685 334 HG3 ARG 44 2HG ARG 44 6.200 9.180 -11.537 335 HD2 ARG 44 1HD ARG 44 7.926 8.286 -9.877 336 HD3 ARG 44 2HD ARG 44 8.713 7.557 -11.276 337 HE ARG 44 HE ARG 44 8.377 10.174 -11.971 338 HH11 ARG 44 1HH1 ARG 44 9.888 8.506 -9.315 339 HH12 ARG 44 2HH1 ARG 44 11.086 9.731 -9.057 340 HH21 ARG 44 1HH2 ARG 44 9.948 11.793 -11.641 341 HH22 ARG 44 2HH2 ARG 44 11.119 11.600 -10.380 342 H LEU 45 H LEU 45 2.078 7.177 -10.572 343 HA LEU 45 HA LEU 45 2.193 4.779 -9.037 344 HB2 LEU 45 1HB LEU 45 0.733 6.414 -8.228 345 HB3 LEU 45 2HB LEU 45 0.006 6.675 -9.813 346 HG LEU 45 HG LEU 45 -0.384 3.990 -8.653 347 HD11 LEU 45 1HD1 LEU 45 -0.931 6.343 -7.100 348 HD12 LEU 45 2HD1 LEU 45 -1.162 4.646 -6.683 349 HD13 LEU 45 3HD1 LEU 45 -2.434 5.525 -7.530 350 HD21 LEU 45 3HD2 LEU 45 -1.621 4.198 -10.542 351 HD22 LEU 45 1HD2 LEU 45 -1.807 5.943 -10.363 352 HD23 LEU 45 2HD2 LEU 45 -2.797 4.847 -9.399 353 H SER 46 H SER 46 0.294 5.646 -11.932 354 HA SER 46 HA SER 46 -0.533 2.957 -12.400 355 HB2 SER 46 1HB SER 46 -2.042 4.435 -13.324 356 HB3 SER 46 2HB SER 46 -0.786 5.556 -13.850 357 HG SER 46 HG SER 46 -0.478 4.406 -15.636 358 H GLU 47 H GLU 47 2.361 4.575 -12.939 359 HA GLU 47 HA GLU 47 3.113 3.079 -15.311 360 HB2 GLU 47 1HB GLU 47 4.165 5.371 -13.820 361 HB3 GLU 47 2HB GLU 47 5.415 4.268 -14.379 362 HG2 GLU 47 1HG GLU 47 5.290 5.639 -16.180 363 HG3 GLU 47 2HG GLU 47 4.077 4.446 -16.642 364 H VAL 48 H VAL 48 3.352 2.797 -11.893 365 HA VAL 48 HA VAL 48 5.322 0.625 -12.167 366 HB VAL 48 HB VAL 48 5.854 0.902 -9.829 367 HG11 VAL 48 1HG1 VAL 48 7.154 2.292 -11.231 368 HG12 VAL 48 2HG1 VAL 48 5.840 3.454 -11.422 369 HG13 VAL 48 3HG1 VAL 48 6.662 3.299 -9.869 370 HG21 VAL 48 3HG2 VAL 48 4.820 2.902 -8.616 371 HG22 VAL 48 1HG2 VAL 48 3.567 2.847 -9.858 372 HG23 VAL 48 2HG2 VAL 48 3.823 1.460 -8.800 373 H VAL 49 H VAL 49 2.079 1.390 -11.367 374 HA VAL 49 HA VAL 49 1.337 -0.591 -9.593 375 HB VAL 49 HB VAL 49 -0.153 1.222 -10.456 376 HG11 VAL 49 1HG1 VAL 49 0.411 0.810 -12.866 377 HG12 VAL 49 2HG1 VAL 49 -0.627 -0.616 -12.795 378 HG13 VAL 49 3HG1 VAL 49 -1.310 0.987 -12.524 379 HG21 VAL 49 3HG2 VAL 49 -1.307 -1.559 -10.654 380 HG22 VAL 49 1HG2 VAL 49 -1.007 -0.686 -9.151 381 HG23 VAL 49 2HG2 VAL 49 -2.195 -0.076 -10.303 382 H ASP 50 H ASP 50 2.078 -0.843 -12.995 383 HA ASP 50 HA ASP 50 0.924 -3.361 -13.499 384 HB2 ASP 50 1HB ASP 50 2.739 -3.439 -15.336 385 HB3 ASP 50 2HB ASP 50 1.533 -2.157 -15.413 386 H ARG 51 H ARG 51 4.011 -2.401 -12.131 387 HA ARG 51 HA ARG 51 5.069 -5.083 -12.143 388 HB2 ARG 51 1HB ARG 51 6.081 -2.616 -10.718 389 HB3 ARG 51 2HB ARG 51 6.967 -4.119 -10.944 390 HG2 ARG 51 1HG ARG 51 6.038 -3.087 -13.467 391 HG3 ARG 51 2HG ARG 51 6.987 -1.882 -12.596 392 HD2 ARG 51 1HD ARG 51 8.677 -3.772 -12.218 393 HD3 ARG 51 2HD ARG 51 7.799 -4.632 -13.481 394 HE ARG 51 HE ARG 51 9.587 -2.412 -13.819 395 HH11 ARG 51 1HH1 ARG 51 6.877 -4.126 -15.175 396 HH12 ARG 51 2HH1 ARG 51 7.188 -3.599 -16.796 397 HH21 ARG 51 1HH2 ARG 51 10.006 -1.712 -15.949 398 HH22 ARG 51 2HH2 ARG 51 8.968 -2.227 -17.235 399 H PHE 52 H PHE 52 3.792 -2.832 -9.717 400 HA PHE 52 HA PHE 52 4.117 -4.644 -7.538 401 HB2 PHE 52 1HB PHE 52 2.519 -2.102 -7.855 402 HB3 PHE 52 2HB PHE 52 2.590 -3.011 -6.349 403 HD1 PHE 52 HD2 PHE 52 4.796 -3.298 -5.203 404 HD2 PHE 52 HD1 PHE 52 4.245 -0.639 -8.480 405 HE1 PHE 52 HE2 PHE 52 6.863 -2.114 -4.585 406 HE2 PHE 52 HE1 PHE 52 6.311 0.549 -7.868 407 HZ PHE 52 HZ PHE 52 7.622 -0.188 -5.918 408 H ASP 53 H ASP 53 2.078 -5.120 -6.142 409 HA ASP 53 HA ASP 53 -0.019 -6.197 -7.911 410 HB2 ASP 53 1HB ASP 53 1.276 -7.437 -5.484 411 HB3 ASP 53 2HB ASP 53 -0.255 -8.013 -6.139 412 H VAL 54 H VAL 54 0.736 -4.970 -4.679 413 HA VAL 54 HA VAL 54 -2.128 -4.422 -4.272 414 HB VAL 54 HB VAL 54 0.031 -4.441 -2.162 415 HG11 VAL 54 1HG1 VAL 54 -1.976 -4.704 -0.660 416 HG12 VAL 54 2HG1 VAL 54 -1.816 -3.135 -1.452 417 HG13 VAL 54 3HG1 VAL 54 -2.974 -4.317 -2.062 418 HG21 VAL 54 3HG2 VAL 54 -0.999 -6.634 -1.495 419 HG22 VAL 54 1HG2 VAL 54 -1.850 -6.624 -3.040 420 HG23 VAL 54 2HG2 VAL 54 -0.087 -6.667 -3.004 421 H VAL 55 H VAL 55 -2.821 -2.381 -3.685 422 HA VAL 55 HA VAL 55 -0.807 -0.234 -3.825 423 HB VAL 55 HB VAL 55 -3.603 -0.156 -4.966 424 HG11 VAL 55 1HG1 VAL 55 -2.949 2.000 -4.060 425 HG12 VAL 55 2HG1 VAL 55 -1.430 1.935 -4.956 426 HG13 VAL 55 3HG1 VAL 55 -2.962 2.054 -5.821 427 HG21 VAL 55 3HG2 VAL 55 -2.673 -1.088 -6.764 428 HG22 VAL 55 1HG2 VAL 55 -1.749 0.402 -6.960 429 HG23 VAL 55 2HG2 VAL 55 -1.055 -0.957 -6.076 430 H LEU 56 H LEU 56 -1.088 1.528 -2.476 431 HA LEU 56 HA LEU 56 -3.386 1.527 -0.665 432 HB2 LEU 56 1HB LEU 56 -0.570 1.030 0.063 433 HB3 LEU 56 2HB LEU 56 -1.449 2.160 1.091 434 HG LEU 56 HG LEU 56 -2.835 -0.380 0.555 435 HD11 LEU 56 1HD1 LEU 56 -0.082 -0.382 1.407 436 HD12 LEU 56 2HD1 LEU 56 -1.152 -1.739 1.055 437 HD13 LEU 56 3HD1 LEU 56 -1.136 -1.024 2.667 438 HD21 LEU 56 3HD2 LEU 56 -2.216 1.082 3.117 439 HD22 LEU 56 1HD2 LEU 56 -3.431 -0.172 2.867 440 HD23 LEU 56 2HD2 LEU 56 -3.620 1.406 2.099 441 H LEU 57 H LEU 57 -4.073 3.527 -0.104 442 HA LEU 57 HA LEU 57 -2.530 5.794 -1.162 443 HB2 LEU 57 1HB LEU 57 -5.443 5.275 -0.795 444 HB3 LEU 57 2HB LEU 57 -4.858 6.937 -0.769 445 HG LEU 57 HG LEU 57 -5.717 6.288 -2.971 446 HD11 LEU 57 1HD1 LEU 57 -4.247 7.690 -3.860 447 HD12 LEU 57 2HD1 LEU 57 -2.963 6.486 -3.767 448 HD13 LEU 57 3HD1 LEU 57 -3.285 7.539 -2.390 449 HD21 LEU 57 3HD2 LEU 57 -3.419 4.535 -3.545 450 HD22 LEU 57 1HD2 LEU 57 -5.088 4.448 -4.111 451 HD23 LEU 57 2HD2 LEU 57 -4.669 3.850 -2.505 452 H ALA 58 H ALA 58 -2.394 7.736 0.069 453 HA ALA 58 HA ALA 58 -2.512 7.251 2.966 454 HB1 ALA 58 3HB ALA 58 -0.702 8.834 1.225 455 HB2 ALA 58 1HB ALA 58 -1.002 9.424 2.860 456 HB3 ALA 58 2HB ALA 58 -0.332 7.810 2.613 457 HA PRO 59 HA PRO 59 -5.563 10.331 3.648 458 HB2 PRO 59 1HB PRO 59 -4.687 11.526 5.923 459 HB3 PRO 59 2HB PRO 59 -5.365 9.894 5.895 460 HG2 PRO 59 1HG PRO 59 -2.498 10.755 5.944 461 HG3 PRO 59 2HG PRO 59 -3.293 9.457 6.854 462 HD2 PRO 59 1HD PRO 59 -1.818 8.986 4.633 463 HD3 PRO 59 2HD PRO 59 -3.222 7.995 5.074 464 H GLN 60 H GLN 60 -5.088 11.615 1.769 465 HA GLN 60 HA GLN 60 -4.610 14.315 2.307 466 HB2 GLN 60 1HB GLN 60 -2.220 12.767 1.893 467 HB3 GLN 60 2HB GLN 60 -2.408 13.929 0.586 468 HG2 GLN 60 1HG GLN 60 -2.351 15.755 2.046 469 HG3 GLN 60 2HG GLN 60 -2.649 14.744 3.459 470 HE21 GLN 60 2HE2 GLN 60 -0.668 16.351 3.822 471 HE22 GLN 60 1HE2 GLN 60 0.871 15.588 3.638 472 H SER 61 H SER 61 -4.243 11.800 -0.165 473 HA SER 61 HA SER 61 -4.663 13.306 -2.443 474 HB2 SER 61 1HB SER 61 -5.024 10.465 -1.703 475 HB3 SER 61 2HB SER 61 -5.929 11.004 -3.118 476 HG SER 61 HG SER 61 -3.269 10.541 -2.844 477 H ARG 62 H ARG 62 -6.220 14.787 -2.651 478 HA ARG 62 HA ARG 62 -8.815 14.488 -1.476 479 HB2 ARG 62 1HB ARG 62 -7.370 16.560 -3.008 480 HB3 ARG 62 2HB ARG 62 -9.118 16.561 -3.195 481 HG2 ARG 62 1HG ARG 62 -8.593 16.292 -0.441 482 HG3 ARG 62 2HG ARG 62 -7.539 17.571 -1.051 483 HD2 ARG 62 1HD ARG 62 -10.532 17.397 -1.389 484 HD3 ARG 62 2HD ARG 62 -9.663 18.493 -0.317 485 HE ARG 62 HE ARG 62 -10.120 18.837 -3.107 486 HH11 ARG 62 1HH1 ARG 62 -7.850 19.480 -0.547 487 HH12 ARG 62 2HH1 ARG 62 -7.174 20.876 -1.320 488 HH21 ARG 62 1HH2 ARG 62 -9.238 20.672 -4.135 489 HH22 ARG 62 2HH2 ARG 62 -7.965 21.553 -3.361 490 H PHE 63 H PHE 63 -7.886 15.011 -4.882 491 HA PHE 63 HA PHE 63 -10.364 13.809 -5.770 492 HB2 PHE 63 1HB PHE 63 -8.057 15.129 -7.185 493 HB3 PHE 63 2HB PHE 63 -9.329 14.297 -8.074 494 HD1 PHE 63 HD1 PHE 63 -11.638 15.142 -8.010 495 HD2 PHE 63 HD2 PHE 63 -8.423 17.256 -6.188 496 HE1 PHE 63 HE1 PHE 63 -13.027 17.171 -7.921 497 HE2 PHE 63 HE2 PHE 63 -9.808 19.288 -6.096 498 HZ PHE 63 HZ PHE 63 -12.113 19.247 -6.961 499 H ASN 64 H ASN 64 -6.943 13.017 -5.696 500 HA ASN 64 HA ASN 64 -6.848 10.858 -7.412 501 HB2 ASN 64 1HB ASN 64 -5.167 11.985 -5.444 502 HB3 ASN 64 2HB ASN 64 -5.296 10.271 -5.059 503 HD21 ASN 64 2HD2 ASN 64 -3.375 9.524 -5.701 504 HD22 ASN 64 1HD2 ASN 64 -2.754 9.647 -7.309 505 H LYS 65 H LYS 65 -7.832 10.929 -4.011 506 HA LYS 65 HA LYS 65 -8.143 8.211 -3.561 507 HB2 LYS 65 1HB LYS 65 -8.331 9.733 -1.730 508 HB3 LYS 65 2HB LYS 65 -9.679 10.575 -2.484 509 HG2 LYS 65 1HG LYS 65 -11.188 8.919 -1.949 510 HG3 LYS 65 2HG LYS 65 -9.939 7.679 -1.811 511 HD2 LYS 65 1HD LYS 65 -9.938 7.997 0.390 512 HD3 LYS 65 2HD LYS 65 -9.327 9.631 0.117 513 HE2 LYS 65 1HE LYS 65 -11.582 10.492 -0.006 514 HE3 LYS 65 2HE LYS 65 -12.244 8.863 0.128 515 HZ1 LYS 65 3HZ LYS 65 -10.951 8.813 2.333 516 HZ2 LYS 65 1HZ LYS 65 -12.403 9.679 2.268 517 HZ3 LYS 65 2HZ LYS 65 -10.926 10.498 2.196 518 H LYS 66 H LYS 66 -10.704 10.498 -4.538 519 HA LYS 66 HA LYS 66 -12.724 8.646 -4.956 520 HB2 LYS 66 1HB LYS 66 -13.012 11.117 -4.946 521 HB3 LYS 66 2HB LYS 66 -12.261 11.182 -6.536 522 HG2 LYS 66 1HG LYS 66 -14.264 10.921 -7.434 523 HG3 LYS 66 2HG LYS 66 -14.323 9.298 -6.742 524 HD2 LYS 66 1HD LYS 66 -15.631 9.951 -4.979 525 HD3 LYS 66 2HD LYS 66 -15.010 11.602 -4.989 526 HE2 LYS 66 1HE LYS 66 -16.229 11.826 -7.240 527 HE3 LYS 66 2HE LYS 66 -17.083 10.358 -6.766 528 HZ1 LYS 66 3HZ LYS 66 -17.448 13.044 -5.855 529 HZ2 LYS 66 1HZ LYS 66 -17.250 11.963 -4.570 530 HZ3 LYS 66 2HZ LYS 66 -18.474 11.708 -5.707 531 H ARG 67 H ARG 67 -10.531 10.022 -7.412 532 HA ARG 67 HA ARG 67 -11.380 8.563 -9.595 533 HB2 ARG 67 1HB ARG 67 -8.699 9.689 -8.840 534 HB3 ARG 67 2HB ARG 67 -8.905 8.789 -10.336 535 HG2 ARG 67 1HG ARG 67 -10.265 10.399 -11.275 536 HG3 ARG 67 2HG ARG 67 -10.731 11.064 -9.709 537 HD2 ARG 67 1HD ARG 67 -8.850 12.339 -9.536 538 HD3 ARG 67 2HD ARG 67 -7.865 11.202 -10.455 539 HE ARG 67 HE ARG 67 -9.354 13.427 -11.485 540 HH11 ARG 67 1HH1 ARG 67 -8.016 10.301 -12.234 541 HH12 ARG 67 2HH1 ARG 67 -7.906 10.610 -13.934 542 HH21 ARG 67 1HH2 ARG 67 -9.212 13.846 -13.723 543 HH22 ARG 67 2HH2 ARG 67 -8.585 12.627 -14.780 544 H LEU 68 H LEU 68 -8.544 7.749 -7.583 545 HA LEU 68 HA LEU 68 -7.998 5.267 -8.643 546 HB2 LEU 68 1HB LEU 68 -7.540 6.554 -6.013 547 HB3 LEU 68 2HB LEU 68 -7.307 4.809 -6.108 548 HG LEU 68 HG LEU 68 -5.583 5.077 -7.763 549 HD11 LEU 68 1HD1 LEU 68 -6.120 8.039 -7.615 550 HD12 LEU 68 2HD1 LEU 68 -6.566 6.985 -8.956 551 HD13 LEU 68 3HD1 LEU 68 -4.866 7.247 -8.569 552 HD21 LEU 68 3HD2 LEU 68 -4.281 5.282 -5.970 553 HD22 LEU 68 1HD2 LEU 68 -5.457 6.303 -5.144 554 HD23 LEU 68 2HD2 LEU 68 -4.297 7.021 -6.261 555 H GLU 69 H GLU 69 -10.465 6.171 -6.328 556 HA GLU 69 HA GLU 69 -11.153 3.528 -5.536 557 HB2 GLU 69 1HB GLU 69 -12.286 6.242 -5.185 558 HB3 GLU 69 2HB GLU 69 -13.425 4.909 -5.059 559 HG2 GLU 69 1HG GLU 69 -11.852 3.877 -3.384 560 HG3 GLU 69 2HG GLU 69 -10.976 5.406 -3.394 561 H GLU 70 H GLU 70 -12.826 5.843 -7.677 562 HA GLU 70 HA GLU 70 -14.764 4.049 -8.607 563 HB2 GLU 70 1HB GLU 70 -15.109 5.648 -10.442 564 HB3 GLU 70 2HB GLU 70 -14.991 6.458 -8.885 565 HG2 GLU 70 1HG GLU 70 -12.725 7.127 -9.355 566 HG3 GLU 70 2HG GLU 70 -12.737 6.218 -10.865 567 H ILE 71 H ILE 71 -11.434 4.291 -9.318 568 HA ILE 71 HA ILE 71 -11.668 2.886 -11.861 569 HB ILE 71 HB ILE 71 -9.215 3.844 -10.381 570 HG12 ILE 71 1HG1 ILE 71 -10.219 4.970 -12.971 571 HG13 ILE 71 2HG1 ILE 71 -10.955 5.491 -11.459 572 HG21 ILE 71 1HG2 ILE 71 -9.545 2.062 -12.637 573 HG22 ILE 71 2HG2 ILE 71 -8.584 3.479 -13.056 574 HG23 ILE 71 3HG2 ILE 71 -8.097 2.451 -11.709 575 HD11 ILE 71 3HD1 ILE 71 -9.289 7.069 -11.973 576 HD12 ILE 71 1HD1 ILE 71 -8.632 6.072 -10.675 577 HD13 ILE 71 2HD1 ILE 71 -8.106 5.815 -12.339 578 H THR 72 H THR 72 -10.586 2.344 -8.559 579 HA THR 72 HA THR 72 -9.422 -0.202 -8.999 580 HB THR 72 HB THR 72 -9.878 -0.462 -6.463 581 HG1 THR 72 HG1 THR 72 -11.511 1.261 -6.510 582 HG21 THR 72 3HG2 THR 72 -7.922 0.967 -7.952 583 HG22 THR 72 1HG2 THR 72 -7.742 0.163 -6.393 584 HG23 THR 72 2HG2 THR 72 -8.231 1.856 -6.461 585 H LYS 73 H LYS 73 -12.672 0.864 -8.161 586 HA LYS 73 HA LYS 73 -13.852 -1.496 -7.384 587 HB2 LYS 73 1HB LYS 73 -14.735 1.054 -8.390 588 HB3 LYS 73 2HB LYS 73 -15.727 -0.232 -9.066 589 HG2 LYS 73 1HG LYS 73 -15.195 -0.317 -6.155 590 HG3 LYS 73 2HG LYS 73 -16.284 0.938 -6.751 591 HD2 LYS 73 1HD LYS 73 -17.847 -0.587 -7.497 592 HD3 LYS 73 2HD LYS 73 -16.659 -1.883 -7.658 593 HE2 LYS 73 1HE LYS 73 -16.522 -2.082 -5.240 594 HE3 LYS 73 2HE LYS 73 -17.646 -0.739 -5.047 595 HZ1 LYS 73 3HZ LYS 73 -19.049 -2.379 -6.623 596 HZ2 LYS 73 1HZ LYS 73 -19.157 -2.373 -4.934 597 HZ3 LYS 73 2HZ LYS 73 -18.172 -3.505 -5.715 598 HA PRO 74 HA PRO 74 -14.825 -2.629 -11.970 599 HB2 PRO 74 1HB PRO 74 -13.680 -1.115 -13.913 600 HB3 PRO 74 2HB PRO 74 -15.253 -0.736 -13.201 601 HG2 PRO 74 1HG PRO 74 -12.566 0.430 -12.586 602 HG3 PRO 74 2HG PRO 74 -14.126 1.252 -12.775 603 HD2 PRO 74 1HD PRO 74 -13.057 0.694 -10.350 604 HD3 PRO 74 2HD PRO 74 -14.809 0.718 -10.639 605 H LYS 75 H LYS 75 -11.610 -1.236 -11.454 606 HA LYS 75 HA LYS 75 -10.195 -3.003 -13.135 607 HB2 LYS 75 1HB LYS 75 -9.430 -1.232 -10.839 608 HB3 LYS 75 2HB LYS 75 -8.251 -2.345 -11.522 609 HG2 LYS 75 1HG LYS 75 -9.681 -0.706 -13.490 610 HG3 LYS 75 2HG LYS 75 -8.649 0.192 -12.373 611 HD2 LYS 75 1HD LYS 75 -7.180 -0.310 -14.085 612 HD3 LYS 75 2HD LYS 75 -6.889 -1.636 -12.957 613 HE2 LYS 75 1HE LYS 75 -9.039 -2.323 -14.720 614 HE3 LYS 75 2HE LYS 75 -7.651 -1.789 -15.667 615 HZ1 LYS 75 3HZ LYS 75 -6.367 -3.508 -14.929 616 HZ2 LYS 75 1HZ LYS 75 -7.881 -4.263 -14.920 617 HZ3 LYS 75 2HZ LYS 75 -7.215 -3.689 -13.476 618 H GLY 76 H GLY 76 -11.522 -3.366 -9.968 619 HA2 GLY 76 1HA GLY 76 -11.523 -5.114 -8.481 620 HA3 GLY 76 2HA GLY 76 -11.235 -6.130 -9.886 621 H ILE 77 H ILE 77 -9.319 -3.740 -8.055 622 HA ILE 77 HA ILE 77 -7.204 -5.780 -7.830 623 HB ILE 77 HB ILE 77 -5.570 -3.875 -7.822 624 HG12 ILE 77 1HG1 ILE 77 -7.158 -2.028 -9.325 625 HG13 ILE 77 2HG1 ILE 77 -7.971 -2.354 -7.798 626 HG21 ILE 77 1HG2 ILE 77 -5.510 -3.657 -10.232 627 HG22 ILE 77 2HG2 ILE 77 -5.959 -5.303 -9.788 628 HG23 ILE 77 3HG2 ILE 77 -7.192 -4.174 -10.346 629 HD11 ILE 77 3HD1 ILE 77 -6.228 -1.497 -6.543 630 HD12 ILE 77 1HD1 ILE 77 -5.063 -1.675 -7.855 631 HD13 ILE 77 2HD1 ILE 77 -6.292 -0.413 -7.933 632 HA PRO 78 HA PRO 78 -7.232 -5.173 -3.481 633 HB2 PRO 78 1HB PRO 78 -4.616 -5.585 -2.877 634 HB3 PRO 78 2HB PRO 78 -5.710 -6.890 -3.354 635 HG2 PRO 78 1HG PRO 78 -3.700 -5.407 -5.003 636 HG3 PRO 78 2HG PRO 78 -4.050 -7.144 -4.962 637 HD2 PRO 78 1HD PRO 78 -5.000 -5.511 -6.902 638 HD3 PRO 78 2HD PRO 78 -5.896 -6.932 -6.326 639 H ILE 79 H ILE 79 -7.728 -3.017 -3.152 640 HA ILE 79 HA ILE 79 -5.417 -1.209 -2.868 641 HB ILE 79 HB ILE 79 -6.744 -0.455 -4.744 642 HG12 ILE 79 1HG1 ILE 79 -7.335 1.813 -3.947 643 HG13 ILE 79 2HG1 ILE 79 -7.218 1.245 -2.285 644 HG21 ILE 79 1HG2 ILE 79 -9.066 -0.497 -2.822 645 HG22 ILE 79 2HG2 ILE 79 -9.106 0.218 -4.433 646 HG23 ILE 79 3HG2 ILE 79 -8.848 -1.515 -4.245 647 HD11 ILE 79 3HD1 ILE 79 -4.800 0.560 -3.542 648 HD12 ILE 79 1HD1 ILE 79 -5.168 2.222 -4.003 649 HD13 ILE 79 2HD1 ILE 79 -5.078 1.778 -2.298 650 H GLU 80 H GLU 80 -5.240 -0.082 -0.998 651 HA GLU 80 HA GLU 80 -7.473 -0.178 0.905 652 HB2 GLU 80 1HB GLU 80 -4.636 -1.055 1.389 653 HB3 GLU 80 2HB GLU 80 -5.677 -0.542 2.709 654 HG2 GLU 80 1HG GLU 80 -6.183 -2.832 0.822 655 HG3 GLU 80 2HG GLU 80 -5.684 -2.949 2.509 656 H ILE 81 H ILE 81 -7.007 1.301 2.827 657 HA ILE 81 HA ILE 81 -5.443 3.650 2.009 658 HB ILE 81 HB ILE 81 -8.250 3.752 3.121 659 HG12 ILE 81 1HG1 ILE 81 -7.164 4.522 0.403 660 HG13 ILE 81 2HG1 ILE 81 -8.181 3.128 0.747 661 HG21 ILE 81 1HG2 ILE 81 -6.366 5.977 2.347 662 HG22 ILE 81 2HG2 ILE 81 -8.049 6.180 2.831 663 HG23 ILE 81 3HG2 ILE 81 -6.869 5.558 3.984 664 HD11 ILE 81 3HD1 ILE 81 -9.650 5.210 1.752 665 HD12 ILE 81 1HD1 ILE 81 -8.900 5.910 0.317 666 HD13 ILE 81 2HD1 ILE 81 -9.877 4.448 0.178 667 H ILE 82 H ILE 82 -4.411 4.726 3.635 668 HA ILE 82 HA ILE 82 -4.307 3.372 6.203 669 HB ILE 82 HB ILE 82 -2.703 5.764 5.300 670 HG12 ILE 82 1HG1 ILE 82 -2.008 2.823 5.127 671 HG13 ILE 82 2HG1 ILE 82 -2.394 3.864 3.761 672 HG21 ILE 82 1HG2 ILE 82 -2.141 3.721 7.445 673 HG22 ILE 82 2HG2 ILE 82 -1.170 5.140 7.057 674 HG23 ILE 82 3HG2 ILE 82 -2.787 5.337 7.733 675 HD11 ILE 82 3HD1 ILE 82 -0.361 5.223 4.987 676 HD12 ILE 82 1HD1 ILE 82 0.099 3.537 5.222 677 HD13 ILE 82 2HD1 ILE 82 -0.196 4.153 3.595 678 H ASN 83 H ASN 83 -5.786 3.916 7.667 679 HA ASN 83 HA ASN 83 -7.368 6.177 7.720 680 HB2 ASN 83 1HB ASN 83 -6.714 4.014 9.572 681 HB3 ASN 83 2HB ASN 83 -7.108 5.518 10.399 682 HD21 ASN 83 2HD2 ASN 83 -8.301 2.836 8.689 683 HD22 ASN 83 1HD2 ASN 83 -9.968 3.289 8.672 684 H THR 84 H THR 84 -7.371 8.031 9.129 685 HA THR 84 HA THR 84 -5.090 9.581 9.020 686 HB THR 84 HB THR 84 -7.148 9.928 11.195 687 HG1 THR 84 HG1 THR 84 -7.428 10.933 8.557 688 HG21 THR 84 3HG2 THR 84 -5.347 11.767 9.637 689 HG22 THR 84 1HG2 THR 84 -5.430 11.533 11.383 690 HG23 THR 84 2HG2 THR 84 -6.741 12.360 10.540 691 H ILE 85 H ILE 85 -6.331 7.739 11.801 692 HA ILE 85 HA ILE 85 -4.256 8.436 13.576 693 HB ILE 85 HB ILE 85 -5.946 5.931 13.596 694 HG12 ILE 85 1HG1 ILE 85 -6.683 7.961 15.514 695 HG13 ILE 85 2HG1 ILE 85 -6.727 8.618 13.882 696 HG21 ILE 85 1HG2 ILE 85 -4.458 5.383 15.197 697 HG22 ILE 85 2HG2 ILE 85 -3.931 7.050 15.428 698 HG23 ILE 85 3HG2 ILE 85 -5.420 6.483 16.183 699 HD11 ILE 85 3HD1 ILE 85 -8.849 7.820 14.068 700 HD12 ILE 85 1HD1 ILE 85 -8.049 6.407 13.382 701 HD13 ILE 85 2HD1 ILE 85 -8.375 6.481 15.113 702 H ASP 86 H ASP 86 -4.739 5.512 11.598 703 HA ASP 86 HA ASP 86 -2.441 4.140 12.311 704 HB2 ASP 86 1HB ASP 86 -4.195 4.164 9.902 705 HB3 ASP 86 2HB ASP 86 -2.645 3.337 9.780 706 H TYR 87 H TYR 87 -2.878 6.633 9.841 707 HA TYR 87 HA TYR 87 -0.220 6.475 8.836 708 HB2 TYR 87 1HB TYR 87 -2.063 7.404 7.506 709 HB3 TYR 87 2HB TYR 87 -2.232 8.729 8.653 710 HD1 TYR 87 HD2 TYR 87 0.342 7.152 6.450 711 HD2 TYR 87 HD1 TYR 87 -1.163 10.729 8.196 712 HE1 TYR 87 HE2 TYR 87 1.985 8.461 5.170 713 HE2 TYR 87 HE1 TYR 87 0.475 12.047 6.920 714 HH TYR 87 HH TYR 87 2.380 11.917 5.680 715 H GLY 88 H GLY 88 -1.826 8.967 10.831 716 HA2 GLY 88 1HA GLY 88 0.389 10.520 11.401 717 HA3 GLY 88 2HA GLY 88 -0.994 10.343 12.471 718 H THR 89 H THR 89 -0.500 7.429 12.745 719 HA THR 89 HA THR 89 1.492 7.640 14.861 720 HB THR 89 HB THR 89 0.708 5.426 15.572 721 HG1 THR 89 HG1 THR 89 0.151 4.570 13.528 722 HG21 THR 89 3HG2 THR 89 -0.844 7.816 15.497 723 HG22 THR 89 1HG2 THR 89 -0.833 6.548 16.722 724 HG23 THR 89 2HG2 THR 89 -1.932 6.435 15.347 725 H MET 90 H MET 90 1.110 6.271 11.704 726 HA MET 90 HA MET 90 2.526 5.140 10.330 727 HB2 MET 90 1HB MET 90 4.729 5.777 12.284 728 HB3 MET 90 2HB MET 90 4.864 5.504 10.552 729 HG2 MET 90 1HG MET 90 3.546 7.581 10.188 730 HG3 MET 90 2HG MET 90 3.620 7.871 11.924 731 HE1 MET 90 3HE MET 90 6.021 7.709 13.185 732 HE2 MET 90 1HE MET 90 6.807 6.518 12.147 733 HE3 MET 90 2HE MET 90 7.554 8.095 12.402 734 H ASN 91 H ASN 91 1.184 3.337 11.422 735 HA ASN 91 HA ASN 91 2.800 1.561 13.075 736 HB2 ASN 91 1HB ASN 91 -0.059 1.910 12.529 737 HB3 ASN 91 2HB ASN 91 0.446 0.224 12.569 738 HD21 ASN 91 2HD2 ASN 91 0.952 -0.708 14.476 739 HD22 ASN 91 1HD2 ASN 91 0.845 0.092 16.004 740 H GLY 92 H GLY 92 4.362 0.773 11.683 741 HA2 GLY 92 1HA GLY 92 4.064 -0.069 9.068 742 HA3 GLY 92 2HA GLY 92 5.242 -0.733 10.189 743 H GLU 93 H GLU 93 3.661 -2.018 12.016 744 HA GLU 93 HA GLU 93 3.177 -4.474 10.834 745 HB2 GLU 93 1HB GLU 93 3.458 -4.054 13.280 746 HB3 GLU 93 2HB GLU 93 1.822 -3.412 13.318 747 HG2 GLU 93 1HG GLU 93 0.883 -5.519 12.798 748 HG3 GLU 93 2HG GLU 93 2.459 -6.196 12.389 749 H LYS 94 H LYS 94 0.810 -1.969 11.720 750 HA LYS 94 HA LYS 94 -1.463 -3.325 10.777 751 HB2 LYS 94 1HB LYS 94 -0.930 -0.367 11.088 752 HB3 LYS 94 2HB LYS 94 -2.511 -1.050 10.730 753 HG2 LYS 94 1HG LYS 94 -0.955 -1.891 13.149 754 HG3 LYS 94 2HG LYS 94 -1.978 -0.453 13.155 755 HD2 LYS 94 1HD LYS 94 -3.928 -1.711 12.763 756 HD3 LYS 94 2HD LYS 94 -3.009 -3.138 12.280 757 HE2 LYS 94 1HE LYS 94 -2.144 -3.296 14.603 758 HE3 LYS 94 2HE LYS 94 -3.197 -1.953 15.048 759 HZ1 LYS 94 3HZ LYS 94 -3.866 -4.729 14.485 760 HZ2 LYS 94 1HZ LYS 94 -4.963 -3.568 13.925 761 HZ3 LYS 94 2HZ LYS 94 -4.576 -3.643 15.569 762 H VAL 95 H VAL 95 0.836 -1.192 9.179 763 HA VAL 95 HA VAL 95 -0.584 -0.798 6.783 764 HB VAL 95 HB VAL 95 2.412 -0.871 7.173 765 HG11 VAL 95 1HG1 VAL 95 0.657 -0.139 4.899 766 HG12 VAL 95 2HG1 VAL 95 2.064 0.883 5.201 767 HG13 VAL 95 3HG1 VAL 95 2.273 -0.844 4.903 768 HG21 VAL 95 3HG2 VAL 95 1.390 1.765 6.938 769 HG22 VAL 95 1HG2 VAL 95 0.453 0.927 8.175 770 HG23 VAL 95 2HG2 VAL 95 2.208 1.023 8.313 771 H LEU 96 H LEU 96 2.273 -2.892 7.212 772 HA LEU 96 HA LEU 96 2.049 -4.304 4.853 773 HB2 LEU 96 1HB LEU 96 3.294 -6.125 6.056 774 HB3 LEU 96 2HB LEU 96 4.028 -4.524 6.113 775 HG LEU 96 HG LEU 96 2.577 -4.550 8.425 776 HD11 LEU 96 1HD1 LEU 96 3.855 -7.242 8.418 777 HD12 LEU 96 2HD1 LEU 96 2.216 -7.062 7.795 778 HD13 LEU 96 3HD1 LEU 96 2.583 -6.599 9.457 779 HD21 LEU 96 3HD2 LEU 96 5.422 -5.461 8.005 780 HD22 LEU 96 1HD2 LEU 96 4.734 -4.908 9.532 781 HD23 LEU 96 2HD2 LEU 96 4.873 -3.793 8.173 782 H GLN 97 H GLN 97 0.677 -5.133 8.026 783 HA GLN 97 HA GLN 97 -0.485 -7.563 7.377 784 HB2 GLN 97 1HB GLN 97 -1.199 -5.419 9.347 785 HB3 GLN 97 2HB GLN 97 -2.239 -6.824 9.157 786 HG2 GLN 97 1HG GLN 97 0.654 -6.804 9.978 787 HG3 GLN 97 2HG GLN 97 -0.740 -7.198 10.983 788 HE21 GLN 97 2HE2 GLN 97 -2.170 -8.813 9.284 789 HE22 GLN 97 1HE2 GLN 97 -1.283 -10.266 8.986 790 H LEU 98 H LEU 98 -1.897 -4.310 7.122 791 HA LEU 98 HA LEU 98 -4.407 -5.069 6.160 792 HB2 LEU 98 1HB LEU 98 -3.584 -2.779 6.949 793 HB3 LEU 98 2HB LEU 98 -2.986 -2.565 5.305 794 HG LEU 98 HG LEU 98 -5.367 -2.958 4.531 795 HD11 LEU 98 1HD1 LEU 98 -6.736 -2.063 6.791 796 HD12 LEU 98 2HD1 LEU 98 -5.699 -3.371 7.359 797 HD13 LEU 98 3HD1 LEU 98 -6.834 -3.655 6.039 798 HD21 LEU 98 3HD2 LEU 98 -4.230 -0.735 4.709 799 HD22 LEU 98 1HD2 LEU 98 -4.971 -0.551 6.298 800 HD23 LEU 98 2HD2 LEU 98 -5.986 -0.679 4.862 801 H ALA 99 H ALA 99 -1.491 -4.118 4.354 802 HA ALA 99 HA ALA 99 -2.481 -4.335 1.779 803 HB1 ALA 99 3HB ALA 99 -0.166 -3.554 2.628 804 HB2 ALA 99 1HB ALA 99 0.297 -5.243 2.426 805 HB3 ALA 99 2HB ALA 99 -0.283 -4.316 1.042 806 H ILE 100 H ILE 100 -1.009 -6.867 3.793 807 HA ILE 100 HA ILE 100 -1.118 -8.936 1.910 808 HB ILE 100 HB ILE 100 -1.309 -9.144 4.918 809 HG12 ILE 100 1HG1 ILE 100 1.153 -9.586 3.247 810 HG13 ILE 100 2HG1 ILE 100 0.716 -7.973 3.803 811 HG21 ILE 100 1HG2 ILE 100 -0.294 -11.435 4.435 812 HG22 ILE 100 2HG2 ILE 100 -2.007 -11.218 4.082 813 HG23 ILE 100 3HG2 ILE 100 -0.827 -11.187 2.772 814 HD11 ILE 100 3HD1 ILE 100 1.919 -10.188 5.246 815 HD12 ILE 100 1HD1 ILE 100 1.914 -8.462 5.609 816 HD13 ILE 100 2HD1 ILE 100 0.549 -9.469 6.092 817 H ASN 101 H ASN 101 -3.397 -8.162 4.542 818 HA ASN 101 HA ASN 101 -5.274 -10.134 4.068 819 HB2 ASN 101 1HB ASN 101 -5.880 -7.300 4.936 820 HB3 ASN 101 2HB ASN 101 -6.869 -8.726 5.237 821 HD21 ASN 101 2HD2 ASN 101 -6.141 -7.173 7.317 822 HD22 ASN 101 1HD2 ASN 101 -4.967 -7.982 8.294 823 H ALA 102 H ALA 102 -5.085 -6.892 2.633 824 HA ALA 102 HA ALA 102 -7.415 -7.036 1.085 825 HB1 ALA 102 3HB ALA 102 -6.828 -4.939 0.667 826 HB2 ALA 102 1HB ALA 102 -5.260 -5.228 1.424 827 HB3 ALA 102 2HB ALA 102 -5.469 -5.501 -0.306 828 H PHE 103 H PHE 103 -4.049 -7.817 0.237 829 HA PHE 103 HA PHE 103 -4.434 -8.498 -2.423 830 HB2 PHE 103 1HB PHE 103 -2.218 -8.279 -1.362 831 HB3 PHE 103 2HB PHE 103 -2.506 -9.768 -0.468 832 HD1 PHE 103 HD2 PHE 103 -2.226 -8.414 -3.913 833 HD2 PHE 103 HD1 PHE 103 -1.920 -11.821 -1.381 834 HE1 PHE 103 HE2 PHE 103 -1.280 -9.709 -5.778 835 HE2 PHE 103 HE1 PHE 103 -0.973 -13.123 -3.242 836 HZ PHE 103 HZ PHE 103 -0.652 -12.068 -5.445 837 H ASN 104 H ASN 104 -4.454 -10.673 0.400 838 HA ASN 104 HA ASN 104 -5.205 -12.978 -1.047 839 HB2 ASN 104 1HB ASN 104 -4.813 -12.236 1.746 840 HB3 ASN 104 2HB ASN 104 -6.139 -13.375 1.538 841 HD21 ASN 104 2HD2 ASN 104 -2.780 -12.951 1.638 842 HD22 ASN 104 1HD2 ASN 104 -2.321 -14.568 1.237 843 H ASN 105 H ASN 105 -7.034 -10.392 0.432 844 HA ASN 105 HA ASN 105 -9.560 -11.611 0.494 845 HB2 ASN 105 1HB ASN 105 -9.003 -9.474 1.630 846 HB3 ASN 105 2HB ASN 105 -8.935 -8.682 0.059 847 HD21 ASN 105 2HD2 ASN 105 -10.998 -10.187 2.425 848 HD22 ASN 105 1HD2 ASN 105 -12.488 -9.558 1.816 849 H LYS 106 H LYS 106 -8.032 -9.593 -2.003 850 HA LYS 106 HA LYS 106 -10.229 -9.951 -3.830 851 HB2 LYS 106 1HB LYS 106 -7.509 -8.675 -4.081 852 HB3 LYS 106 2HB LYS 106 -8.611 -8.815 -5.445 853 HG2 LYS 106 1HG LYS 106 -9.747 -7.632 -3.000 854 HG3 LYS 106 2HG LYS 106 -8.501 -6.684 -3.813 855 HD2 LYS 106 1HD LYS 106 -9.916 -6.093 -5.428 856 HD3 LYS 106 2HD LYS 106 -10.367 -7.773 -5.722 857 HE2 LYS 106 1HE LYS 106 -11.743 -7.418 -3.494 858 HE3 LYS 106 2HE LYS 106 -11.655 -5.727 -3.987 859 HZ1 LYS 106 3HZ LYS 106 -12.357 -7.121 -6.252 860 HZ2 LYS 106 1HZ LYS 106 -13.366 -6.146 -5.308 861 HZ3 LYS 106 2HZ LYS 106 -13.286 -7.809 -5.017 862 H SER 107 H SER 107 -7.208 -11.514 -3.163 863 HA SER 107 HA SER 107 -6.209 -13.374 -4.011 864 HB2 SER 107 1HB SER 107 -8.917 -13.916 -4.020 865 HB3 SER 107 2HB SER 107 -8.435 -14.293 -5.674 866 HG SER 107 HG SER 107 -7.190 -15.295 -3.325 867 H SER 108 H SER 108 -5.694 -14.541 -6.146 868 HA SER 108 HA SER 108 -6.056 -12.989 -8.549 869 HB2 SER 108 1HB SER 108 -3.231 -13.334 -7.537 870 HB3 SER 108 2HB SER 108 -3.775 -12.395 -8.927 871 HG SER 108 HG SER 108 -3.554 -10.894 -7.388 872 H VAL 109 H VAL 109 -7.009 -15.053 -9.082 873 HA VAL 109 HA VAL 109 -4.996 -16.929 -10.094 874 HB VAL 109 HB VAL 109 -7.467 -17.799 -8.589 875 HG11 VAL 109 1HG1 VAL 109 -5.573 -19.185 -10.363 876 HG12 VAL 109 2HG1 VAL 109 -5.935 -20.011 -8.846 877 HG13 VAL 109 3HG1 VAL 109 -7.242 -19.579 -9.950 878 HG21 VAL 109 3HG2 VAL 109 -5.927 -18.663 -6.913 879 HG22 VAL 109 1HG2 VAL 109 -4.557 -18.040 -7.832 880 HG23 VAL 109 2HG2 VAL 109 -5.716 -16.924 -7.110 Start of MODEL 12 1 H1 GLY 1 H GLY 1 15.837 -16.615 -6.599 2 HA2 GLY 1 1HA GLY 1 14.015 -16.383 -8.268 3 HA3 GLY 1 2HA GLY 1 13.614 -17.581 -7.045 4 HA PRO 2 HA PRO 2 10.430 -14.067 -7.288 5 HB2 PRO 2 1HB PRO 2 8.417 -15.471 -8.450 6 HB3 PRO 2 2HB PRO 2 9.615 -14.563 -9.379 7 HG2 PRO 2 1HG PRO 2 9.504 -17.494 -8.783 8 HG3 PRO 2 2HG PRO 2 9.900 -16.676 -10.306 9 HD2 PRO 2 1HD PRO 2 11.797 -17.679 -8.656 10 HD3 PRO 2 2HD PRO 2 12.066 -16.235 -9.653 11 H GLY 3 H GLY 3 7.923 -14.536 -6.638 12 HA2 GLY 3 1HA GLY 3 6.495 -15.891 -5.241 13 HA3 GLY 3 2HA GLY 3 7.938 -16.521 -4.460 14 H SER 4 H SER 4 7.539 -13.124 -5.160 15 HA SER 4 HA SER 4 7.039 -12.617 -2.304 16 HB2 SER 4 1HB SER 4 8.715 -10.993 -2.178 17 HB3 SER 4 2HB SER 4 9.465 -12.240 -3.172 18 HG SER 4 HG SER 4 9.502 -9.902 -3.886 19 H MET 5 H MET 5 5.677 -10.942 -1.813 20 HA MET 5 HA MET 5 4.068 -9.936 -4.013 21 HB2 MET 5 1HB MET 5 3.309 -10.832 -1.629 22 HB3 MET 5 2HB MET 5 3.549 -9.148 -1.186 23 HG2 MET 5 1HG MET 5 2.056 -9.322 -3.628 24 HG3 MET 5 2HG MET 5 1.302 -10.307 -2.376 25 HE1 MET 5 3HE MET 5 0.383 -9.332 -0.062 26 HE2 MET 5 1HE MET 5 2.048 -8.845 0.260 27 HE3 MET 5 2HE MET 5 0.734 -7.690 0.480 28 H ASN 6 H ASN 6 3.680 -7.740 -4.421 29 HA ASN 6 HA ASN 6 5.701 -5.910 -3.300 30 HB2 ASN 6 1HB ASN 6 4.522 -5.952 -6.087 31 HB3 ASN 6 2HB ASN 6 5.594 -4.697 -5.474 32 HD21 ASN 6 2HD2 ASN 6 7.752 -5.304 -4.882 33 HD22 ASN 6 1HD2 ASN 6 8.513 -6.645 -5.663 34 H ILE 7 H ILE 7 4.754 -4.554 -1.931 35 HA ILE 7 HA ILE 7 1.978 -3.756 -2.351 36 HB ILE 7 HB ILE 7 3.812 -3.193 -0.019 37 HG12 ILE 7 1HG1 ILE 7 1.745 -4.841 0.823 38 HG13 ILE 7 2HG1 ILE 7 2.172 -5.491 -0.755 39 HG21 ILE 7 1HG2 ILE 7 0.994 -2.454 -0.634 40 HG22 ILE 7 2HG2 ILE 7 1.437 -2.807 1.036 41 HG23 ILE 7 3HG2 ILE 7 2.260 -1.517 0.159 42 HD11 ILE 7 3HD1 ILE 7 4.129 -6.297 -0.029 43 HD12 ILE 7 1HD1 ILE 7 4.449 -4.894 0.990 44 HD13 ILE 7 2HD1 ILE 7 3.376 -6.173 1.561 45 H LEU 8 H LEU 8 1.406 -1.837 -3.137 46 HA LEU 8 HA LEU 8 3.504 0.162 -3.581 47 HB2 LEU 8 1HB LEU 8 1.966 -0.788 -5.427 48 HB3 LEU 8 2HB LEU 8 0.742 0.275 -4.737 49 HG LEU 8 HG LEU 8 1.876 1.227 -6.718 50 HD11 LEU 8 1HD1 LEU 8 1.793 3.346 -5.904 51 HD12 LEU 8 2HD1 LEU 8 2.735 2.954 -4.466 52 HD13 LEU 8 3HD1 LEU 8 1.032 2.507 -4.553 53 HD21 LEU 8 3HD2 LEU 8 4.317 1.903 -5.259 54 HD22 LEU 8 1HD2 LEU 8 4.098 1.385 -6.931 55 HD23 LEU 8 2HD2 LEU 8 4.162 0.187 -5.638 56 H LEU 9 H LEU 9 3.494 2.091 -2.595 57 HA LEU 9 HA LEU 9 1.131 2.792 -0.978 58 HB2 LEU 9 1HB LEU 9 3.150 2.105 0.319 59 HB3 LEU 9 2HB LEU 9 4.000 3.485 -0.370 60 HG LEU 9 HG LEU 9 3.093 3.732 1.993 61 HD11 LEU 9 1HD1 LEU 9 3.362 5.897 1.600 62 HD12 LEU 9 2HD1 LEU 9 1.851 5.969 0.693 63 HD13 LEU 9 3HD1 LEU 9 3.354 5.543 -0.128 64 HD21 LEU 9 3HD2 LEU 9 0.479 4.487 0.847 65 HD22 LEU 9 1HD2 LEU 9 0.876 3.799 2.422 66 HD23 LEU 9 2HD2 LEU 9 0.795 2.758 1.001 67 H VAL 10 H VAL 10 0.378 4.863 -1.063 68 HA VAL 10 HA VAL 10 1.805 6.732 -2.838 69 HB VAL 10 HB VAL 10 -1.197 6.453 -2.647 70 HG11 VAL 10 1HG1 VAL 10 -1.357 8.326 -3.843 71 HG12 VAL 10 2HG1 VAL 10 0.343 8.603 -3.463 72 HG13 VAL 10 3HG1 VAL 10 -0.105 7.802 -4.970 73 HG21 VAL 10 3HG2 VAL 10 0.615 5.602 -4.901 74 HG22 VAL 10 1HG2 VAL 10 -0.106 4.504 -3.725 75 HG23 VAL 10 2HG2 VAL 10 -1.137 5.421 -4.822 76 H CYS 11 H CYS 11 2.386 8.524 -1.820 77 HA CYS 11 HA CYS 11 0.600 9.994 -0.154 78 HB2 CYS 11 1HB CYS 11 1.345 8.237 1.438 79 HB3 CYS 11 2HB CYS 11 3.008 8.759 1.199 80 HG CYS 11 HG CYS 11 2.689 11.243 2.355 81 H GLY 12 H GLY 12 1.326 12.095 0.262 82 HA2 GLY 12 1HA GLY 12 3.190 13.128 -1.602 83 HA3 GLY 12 2HA GLY 12 2.450 14.023 -0.282 84 H ALA 13 H ALA 13 5.191 12.112 -1.282 85 HA ALA 13 HA ALA 13 6.522 12.219 1.260 86 HB1 ALA 13 3HB ALA 13 8.322 11.751 -0.928 87 HB2 ALA 13 1HB ALA 13 7.806 10.654 0.352 88 HB3 ALA 13 2HB ALA 13 6.855 10.793 -1.127 89 H GLY 14 H GLY 14 8.691 13.231 1.502 90 HA2 GLY 14 1HA GLY 14 9.138 15.602 -0.145 91 HA3 GLY 14 2HA GLY 14 8.787 15.874 1.556 92 H MET 15 H MET 15 10.901 13.784 -0.421 93 HA MET 15 HA MET 15 13.106 13.262 -0.242 94 HB2 MET 15 1HB MET 15 12.903 16.018 0.494 95 HB3 MET 15 2HB MET 15 14.117 15.252 1.511 96 HG2 MET 15 1HG MET 15 15.464 15.794 -0.204 97 HG3 MET 15 2HG MET 15 14.865 14.271 -0.855 98 HE1 MET 15 3HE MET 15 15.654 14.759 -2.894 99 HE2 MET 15 1HE MET 15 14.189 14.702 -3.875 100 HE3 MET 15 2HE MET 15 15.261 16.098 -3.974 101 H SER 16 H SER 16 14.870 12.737 1.394 102 HA SER 16 HA SER 16 15.546 11.592 3.240 103 HB2 SER 16 1HB SER 16 13.925 13.722 4.220 104 HB3 SER 16 2HB SER 16 13.571 12.286 5.180 105 HG SER 16 HG SER 16 15.331 12.884 6.185 106 H THR 17 H THR 17 14.832 9.915 4.859 107 HA THR 17 HA THR 17 13.175 8.012 3.551 108 HB THR 17 HB THR 17 15.101 7.383 4.990 109 HG1 THR 17 HG1 THR 17 12.740 6.259 6.082 110 HG21 THR 17 3HG2 THR 17 14.698 9.034 6.783 111 HG22 THR 17 1HG2 THR 17 14.871 7.394 7.405 112 HG23 THR 17 2HG2 THR 17 13.271 8.123 7.275 113 H SER 18 H SER 18 11.299 6.947 4.521 114 HA SER 18 HA SER 18 9.588 8.891 5.921 115 HB2 SER 18 1HB SER 18 9.099 6.980 3.718 116 HB3 SER 18 2HB SER 18 7.824 7.083 4.932 117 HG SER 18 HG SER 18 8.477 8.835 2.981 118 H MET 19 H MET 19 8.707 8.380 7.838 119 HA MET 19 HA MET 19 9.686 6.316 9.408 120 HB2 MET 19 1HB MET 19 7.012 7.692 9.720 121 HB3 MET 19 2HB MET 19 7.904 6.849 10.980 122 HG2 MET 19 1HG MET 19 8.810 8.790 11.521 123 HG3 MET 19 2HG MET 19 9.691 8.730 9.997 124 HE1 MET 19 3HE MET 19 9.365 12.008 10.040 125 HE2 MET 19 1HE MET 19 8.018 12.196 11.164 126 HE3 MET 19 2HE MET 19 9.316 11.057 11.525 127 H LEU 20 H LEU 20 6.717 6.451 7.487 128 HA LEU 20 HA LEU 20 5.514 4.096 8.305 129 HB2 LEU 20 1HB LEU 20 5.486 5.701 5.808 130 HB3 LEU 20 2HB LEU 20 4.801 4.079 5.745 131 HG LEU 20 HG LEU 20 3.123 5.866 6.122 132 HD11 LEU 20 1HD1 LEU 20 1.842 4.571 7.508 133 HD12 LEU 20 2HD1 LEU 20 3.176 4.230 8.609 134 HD13 LEU 20 3HD1 LEU 20 3.089 3.410 7.050 135 HD21 LEU 20 3HD2 LEU 20 4.784 7.176 7.607 136 HD22 LEU 20 1HD2 LEU 20 4.195 6.138 8.905 137 HD23 LEU 20 2HD2 LEU 20 3.071 7.181 8.033 138 H VAL 21 H VAL 21 7.342 4.390 5.258 139 HA VAL 21 HA VAL 21 7.642 1.695 4.748 140 HB VAL 21 HB VAL 21 8.216 3.351 3.081 141 HG11 VAL 21 1HG1 VAL 21 10.240 4.702 3.234 142 HG12 VAL 21 2HG1 VAL 21 9.152 5.047 4.580 143 HG13 VAL 21 3HG1 VAL 21 10.575 4.036 4.832 144 HG21 VAL 21 3HG2 VAL 21 9.340 1.051 3.169 145 HG22 VAL 21 1HG2 VAL 21 10.061 2.276 2.125 146 HG23 VAL 21 2HG2 VAL 21 10.783 1.919 3.693 147 H GLN 22 H GLN 22 9.558 3.777 6.833 148 HA GLN 22 HA GLN 22 11.750 2.110 7.267 149 HB2 GLN 22 1HB GLN 22 10.546 4.430 8.578 150 HB3 GLN 22 2HB GLN 22 11.371 3.356 9.700 151 HG2 GLN 22 1HG GLN 22 12.938 3.843 7.315 152 HG3 GLN 22 2HG GLN 22 12.522 5.335 8.157 153 HE21 GLN 22 2HE2 GLN 22 14.682 2.827 7.981 154 HE22 GLN 22 1HE2 GLN 22 15.436 3.004 9.525 155 H ARG 23 H ARG 23 8.834 2.448 9.298 156 HA ARG 23 HA ARG 23 9.436 0.342 11.045 157 HB2 ARG 23 1HB ARG 23 6.704 1.364 10.245 158 HB3 ARG 23 2HB ARG 23 7.077 0.422 11.683 159 HG2 ARG 23 1HG ARG 23 8.759 2.727 11.614 160 HG3 ARG 23 2HG ARG 23 7.080 3.217 11.385 161 HD2 ARG 23 1HD ARG 23 7.524 3.227 13.729 162 HD3 ARG 23 2HD ARG 23 6.490 1.841 13.385 163 HE ARG 23 HE ARG 23 9.047 0.864 13.275 164 HH11 ARG 23 1HH1 ARG 23 7.115 2.527 15.646 165 HH12 ARG 23 2HH1 ARG 23 7.909 1.793 16.999 166 HH21 ARG 23 1HH2 ARG 23 10.100 -0.110 15.048 167 HH22 ARG 23 2HH2 ARG 23 9.607 0.293 16.658 168 H ILE 24 H ILE 24 7.503 0.398 8.071 169 HA ILE 24 HA ILE 24 6.574 -2.223 8.119 170 HB ILE 24 HB ILE 24 7.334 -0.591 5.693 171 HG12 ILE 24 1HG1 ILE 24 4.575 -0.948 6.847 172 HG13 ILE 24 2HG1 ILE 24 5.634 0.353 7.380 173 HG21 ILE 24 1HG2 ILE 24 5.382 -2.112 4.776 174 HG22 ILE 24 2HG2 ILE 24 7.055 -2.666 4.778 175 HG23 ILE 24 3HG2 ILE 24 5.949 -3.199 6.044 176 HD11 ILE 24 3HD1 ILE 24 4.139 0.034 4.874 177 HD12 ILE 24 1HD1 ILE 24 4.594 1.492 5.755 178 HD13 ILE 24 2HD1 ILE 24 5.770 0.687 4.715 179 H GLU 25 H GLU 25 9.477 -0.960 6.475 180 HA GLU 25 HA GLU 25 10.438 -3.414 5.552 181 HB2 GLU 25 1HB GLU 25 11.712 -0.768 6.135 182 HB3 GLU 25 2HB GLU 25 12.727 -2.146 5.732 183 HG2 GLU 25 1HG GLU 25 10.771 -2.195 3.789 184 HG3 GLU 25 2HG GLU 25 11.089 -0.477 4.021 185 H LYS 26 H LYS 26 11.013 -1.720 8.601 186 HA LYS 26 HA LYS 26 12.974 -3.424 9.643 187 HB2 LYS 26 1HB LYS 26 11.210 -1.330 10.652 188 HB3 LYS 26 2HB LYS 26 11.531 -2.576 11.850 189 HG2 LYS 26 1HG LYS 26 13.752 -1.282 10.310 190 HG3 LYS 26 2HG LYS 26 13.084 -0.548 11.770 191 HD2 LYS 26 1HD LYS 26 13.661 -2.488 13.072 192 HD3 LYS 26 2HD LYS 26 14.170 -3.359 11.624 193 HE2 LYS 26 1HE LYS 26 16.227 -2.614 12.052 194 HE3 LYS 26 2HE LYS 26 15.652 -1.025 11.547 195 HZ1 LYS 26 3HZ LYS 26 16.178 -2.044 14.225 196 HZ2 LYS 26 1HZ LYS 26 14.850 -1.010 14.059 197 HZ3 LYS 26 2HZ LYS 26 16.391 -0.487 13.597 198 H TYR 27 H TYR 27 9.474 -3.407 10.345 199 HA TYR 27 HA TYR 27 9.371 -5.687 11.904 200 HB2 TYR 27 1HB TYR 27 7.441 -4.280 11.736 201 HB3 TYR 27 2HB TYR 27 7.329 -4.538 9.999 202 HD1 TYR 27 HD2 TYR 27 6.457 -6.643 9.107 203 HD2 TYR 27 HD1 TYR 27 6.617 -5.927 13.298 204 HE1 TYR 27 HE2 TYR 27 4.917 -8.525 9.482 205 HE2 TYR 27 HE1 TYR 27 5.080 -7.808 13.684 206 HH TYR 27 HH TYR 27 3.606 -9.221 12.664 207 H ALA 28 H ALA 28 8.819 -5.469 8.389 208 HA ALA 28 HA ALA 28 8.470 -8.188 7.899 209 HB1 ALA 28 3HB ALA 28 9.852 -6.940 5.709 210 HB2 ALA 28 1HB ALA 28 8.172 -7.467 5.821 211 HB3 ALA 28 2HB ALA 28 8.628 -5.852 6.365 212 H LYS 29 H LYS 29 11.452 -6.250 7.713 213 HA LYS 29 HA LYS 29 13.165 -8.352 6.989 214 HB2 LYS 29 1HB LYS 29 13.570 -5.673 8.269 215 HB3 LYS 29 2HB LYS 29 14.919 -6.794 8.152 216 HG2 LYS 29 1HG LYS 29 13.286 -6.043 5.752 217 HG3 LYS 29 2HG LYS 29 14.645 -5.060 6.303 218 HD2 LYS 29 1HD LYS 29 15.996 -7.239 6.237 219 HD3 LYS 29 2HD LYS 29 14.659 -7.886 5.284 220 HE2 LYS 29 1HE LYS 29 15.833 -7.079 3.542 221 HE3 LYS 29 2HE LYS 29 15.104 -5.543 4.006 222 HZ1 LYS 29 3HZ LYS 29 17.767 -6.041 3.803 223 HZ2 LYS 29 1HZ LYS 29 17.496 -6.123 5.471 224 HZ3 LYS 29 2HZ LYS 29 17.070 -4.730 4.613 225 H SER 30 H SER 30 11.788 -7.446 10.033 226 HA SER 30 HA SER 30 13.671 -8.939 11.626 227 HB2 SER 30 1HB SER 30 12.823 -7.312 12.980 228 HB3 SER 30 2HB SER 30 11.278 -7.264 12.132 229 HG SER 30 HG SER 30 11.700 -8.347 14.430 230 H LYS 31 H LYS 31 10.272 -9.339 10.662 231 HA LYS 31 HA LYS 31 10.020 -11.916 11.865 232 HB2 LYS 31 1HB LYS 31 8.343 -10.179 10.132 233 HB3 LYS 31 2HB LYS 31 7.981 -11.901 10.128 234 HG2 LYS 31 1HG LYS 31 8.209 -10.329 12.673 235 HG3 LYS 31 2HG LYS 31 6.700 -10.443 11.765 236 HD2 LYS 31 1HD LYS 31 8.137 -12.969 12.377 237 HD3 LYS 31 2HD LYS 31 7.319 -12.149 13.709 238 HE2 LYS 31 1HE LYS 31 5.322 -12.822 12.991 239 HE3 LYS 31 2HE LYS 31 5.645 -12.241 11.358 240 HZ1 LYS 31 3HZ LYS 31 5.417 -14.469 10.996 241 HZ2 LYS 31 1HZ LYS 31 6.064 -14.911 12.496 242 HZ3 LYS 31 2HZ LYS 31 7.087 -14.394 11.254 243 H ASN 32 H ASN 32 11.403 -10.797 8.969 244 HA ASN 32 HA ASN 32 12.385 -11.854 7.210 245 HB2 ASN 32 1HB ASN 32 13.037 -13.403 9.244 246 HB3 ASN 32 2HB ASN 32 11.945 -14.538 8.455 247 HD21 ASN 32 2HD2 ASN 32 13.465 -15.992 7.825 248 HD22 ASN 32 1HD2 ASN 32 14.688 -15.653 6.653 249 H ILE 33 H ILE 33 10.045 -11.168 6.478 250 HA ILE 33 HA ILE 33 8.631 -13.549 5.481 251 HB ILE 33 HB ILE 33 7.617 -10.716 5.752 252 HG12 ILE 33 1HG1 ILE 33 6.294 -12.888 7.225 253 HG13 ILE 33 2HG1 ILE 33 7.948 -12.576 7.742 254 HG21 ILE 33 1HG2 ILE 33 6.604 -13.075 4.339 255 HG22 ILE 33 2HG2 ILE 33 5.430 -12.296 5.400 256 HG23 ILE 33 3HG2 ILE 33 6.217 -11.368 4.124 257 HD11 ILE 33 3HD1 ILE 33 5.712 -10.566 7.619 258 HD12 ILE 33 1HD1 ILE 33 6.380 -11.308 9.072 259 HD13 ILE 33 2HD1 ILE 33 7.373 -10.222 8.099 260 H ASN 34 H ASN 34 8.188 -13.782 3.317 261 HA ASN 34 HA ASN 34 9.928 -12.373 1.512 262 HB2 ASN 34 1HB ASN 34 8.121 -14.727 1.359 263 HB3 ASN 34 2HB ASN 34 8.440 -13.872 -0.147 264 HD21 ASN 34 2HD2 ASN 34 9.215 -16.520 0.419 265 HD22 ASN 34 1HD2 ASN 34 10.942 -16.582 0.411 266 H ALA 35 H ALA 35 9.069 -10.232 1.735 267 HA ALA 35 HA ALA 35 6.937 -9.719 -0.167 268 HB1 ALA 35 3HB ALA 35 6.713 -8.616 2.627 269 HB2 ALA 35 1HB ALA 35 5.567 -8.422 1.300 270 HB3 ALA 35 2HB ALA 35 5.805 -10.008 2.037 271 H THR 36 H THR 36 6.688 -7.341 -0.566 272 HA THR 36 HA THR 36 9.047 -5.761 0.135 273 HB THR 36 HB THR 36 8.705 -5.108 -2.529 274 HG1 THR 36 HG1 THR 36 8.685 -7.949 -2.287 275 HG21 THR 36 3HG2 THR 36 10.769 -5.679 -0.946 276 HG22 THR 36 1HG2 THR 36 10.915 -5.652 -2.703 277 HG23 THR 36 2HG2 THR 36 10.716 -7.188 -1.857 278 H ILE 37 H ILE 37 8.777 -3.498 -0.144 279 HA ILE 37 HA ILE 37 6.130 -2.536 -0.900 280 HB ILE 37 HB ILE 37 6.018 -2.996 1.542 281 HG12 ILE 37 1HG1 ILE 37 5.957 -0.024 1.266 282 HG13 ILE 37 2HG1 ILE 37 4.925 -0.981 0.209 283 HG21 ILE 37 1HG2 ILE 37 8.370 -2.549 2.064 284 HG22 ILE 37 2HG2 ILE 37 8.113 -0.836 1.737 285 HG23 ILE 37 3HG2 ILE 37 7.285 -1.609 3.088 286 HD11 ILE 37 3HD1 ILE 37 3.993 -2.070 2.253 287 HD12 ILE 37 1HD1 ILE 37 4.897 -0.898 3.212 288 HD13 ILE 37 2HD1 ILE 37 3.642 -0.347 2.101 289 H GLU 38 H GLU 38 6.066 -0.345 -1.465 290 HA GLU 38 HA GLU 38 8.442 1.282 -1.223 291 HB2 GLU 38 1HB GLU 38 8.985 -0.035 -3.204 292 HB3 GLU 38 2HB GLU 38 7.447 0.397 -3.936 293 HG2 GLU 38 1HG GLU 38 8.127 2.501 -4.469 294 HG3 GLU 38 2HG GLU 38 9.259 2.598 -3.121 295 H ALA 39 H ALA 39 8.050 3.467 -1.516 296 HA ALA 39 HA ALA 39 5.230 4.192 -1.983 297 HB1 ALA 39 3HB ALA 39 7.223 5.417 -0.086 298 HB2 ALA 39 1HB ALA 39 5.659 6.134 -0.472 299 HB3 ALA 39 2HB ALA 39 5.736 4.559 0.321 300 H ILE 40 H ILE 40 4.940 5.291 -3.798 301 HA ILE 40 HA ILE 40 7.067 7.123 -4.692 302 HB ILE 40 HB ILE 40 6.237 6.650 -7.040 303 HG12 ILE 40 1HG1 ILE 40 5.328 3.973 -6.215 304 HG13 ILE 40 2HG1 ILE 40 4.239 5.283 -5.771 305 HG21 ILE 40 1HG2 ILE 40 8.149 5.529 -7.107 306 HG22 ILE 40 2HG2 ILE 40 8.053 5.225 -5.373 307 HG23 ILE 40 3HG2 ILE 40 7.317 4.093 -6.507 308 HD11 ILE 40 3HD1 ILE 40 5.286 4.881 -8.558 309 HD12 ILE 40 1HD1 ILE 40 3.775 4.186 -7.970 310 HD13 ILE 40 2HD1 ILE 40 3.975 5.937 -8.031 311 H ALA 41 H ALA 41 6.000 8.541 -6.594 312 HA ALA 41 HA ALA 41 3.900 10.031 -5.269 313 HB1 ALA 41 3HB ALA 41 4.951 11.739 -6.215 314 HB2 ALA 41 1HB ALA 41 5.999 10.630 -7.100 315 HB3 ALA 41 2HB ALA 41 4.465 11.147 -7.804 316 H GLU 42 H GLU 42 2.388 11.113 -7.177 317 HA GLU 42 HA GLU 42 0.740 8.880 -8.014 318 HB2 GLU 42 1HB GLU 42 -0.899 10.620 -8.632 319 HB3 GLU 42 2HB GLU 42 -0.352 10.777 -6.969 320 HG2 GLU 42 1HG GLU 42 0.598 12.776 -7.329 321 HG3 GLU 42 2HG GLU 42 1.180 12.330 -8.932 322 H THR 43 H THR 43 2.982 11.098 -9.403 323 HA THR 43 HA THR 43 2.122 11.127 -12.069 324 HB THR 43 HB THR 43 3.839 12.661 -11.317 325 HG1 THR 43 HG1 THR 43 3.833 11.815 -13.559 326 HG21 THR 43 3HG2 THR 43 5.994 12.024 -10.605 327 HG22 THR 43 1HG2 THR 43 5.779 10.365 -11.161 328 HG23 THR 43 2HG2 THR 43 4.894 10.944 -9.750 329 H ARG 44 H ARG 44 4.122 8.826 -10.294 330 HA ARG 44 HA ARG 44 4.177 7.106 -12.684 331 HB2 ARG 44 1HB ARG 44 6.037 7.241 -10.309 332 HB3 ARG 44 2HB ARG 44 6.084 5.950 -11.504 333 HG2 ARG 44 1HG ARG 44 7.099 7.232 -13.042 334 HG3 ARG 44 2HG ARG 44 6.183 8.674 -12.599 335 HD2 ARG 44 1HD ARG 44 7.625 8.623 -10.447 336 HD3 ARG 44 2HD ARG 44 8.686 7.573 -11.383 337 HE ARG 44 HE ARG 44 8.019 9.987 -12.766 338 HH11 ARG 44 1HH1 ARG 44 10.126 8.585 -10.376 339 HH12 ARG 44 2HH1 ARG 44 11.389 9.746 -10.619 340 HH21 ARG 44 1HH2 ARG 44 9.674 11.522 -13.095 341 HH22 ARG 44 2HH2 ARG 44 11.131 11.417 -12.165 342 H LEU 45 H LEU 45 2.143 7.474 -10.410 343 HA LEU 45 HA LEU 45 2.152 4.973 -9.010 344 HB2 LEU 45 1HB LEU 45 1.131 6.725 -7.855 345 HB3 LEU 45 2HB LEU 45 0.210 7.239 -9.268 346 HG LEU 45 HG LEU 45 -1.172 5.184 -9.043 347 HD11 LEU 45 1HD1 LEU 45 0.046 3.608 -7.899 348 HD12 LEU 45 2HD1 LEU 45 -1.012 4.213 -6.624 349 HD13 LEU 45 3HD1 LEU 45 0.658 4.773 -6.724 350 HD21 LEU 45 3HD2 LEU 45 -1.098 7.471 -7.248 351 HD22 LEU 45 1HD2 LEU 45 -1.913 6.075 -6.543 352 HD23 LEU 45 2HD2 LEU 45 -2.463 6.729 -8.085 353 H SER 46 H SER 46 -0.079 6.363 -11.425 354 HA SER 46 HA SER 46 -1.384 3.883 -11.912 355 HB2 SER 46 1HB SER 46 -1.443 6.602 -13.147 356 HB3 SER 46 2HB SER 46 -2.125 5.254 -14.057 357 HG SER 46 HG SER 46 -3.623 4.944 -12.501 358 H GLU 47 H GLU 47 1.593 5.118 -12.895 359 HA GLU 47 HA GLU 47 1.682 3.721 -15.434 360 HB2 GLU 47 1HB GLU 47 2.870 5.777 -15.397 361 HB3 GLU 47 2HB GLU 47 3.687 5.363 -13.897 362 HG2 GLU 47 1HG GLU 47 5.217 5.199 -15.750 363 HG3 GLU 47 2HG GLU 47 4.923 3.601 -15.065 364 H VAL 48 H VAL 48 2.480 3.134 -12.137 365 HA VAL 48 HA VAL 48 3.982 0.715 -12.891 366 HB VAL 48 HB VAL 48 4.969 0.721 -10.691 367 HG11 VAL 48 1HG1 VAL 48 6.127 2.972 -10.756 368 HG12 VAL 48 2HG1 VAL 48 6.200 2.015 -12.237 369 HG13 VAL 48 3HG1 VAL 48 5.074 3.368 -12.115 370 HG21 VAL 48 3HG2 VAL 48 3.310 1.479 -9.239 371 HG22 VAL 48 1HG2 VAL 48 4.502 2.778 -9.217 372 HG23 VAL 48 2HG2 VAL 48 3.029 2.948 -10.173 373 H VAL 49 H VAL 49 1.045 1.840 -11.644 374 HA VAL 49 HA VAL 49 0.337 -0.137 -9.802 375 HB VAL 49 HB VAL 49 -0.952 1.961 -10.257 376 HG11 VAL 49 1HG1 VAL 49 -0.908 1.541 -12.783 377 HG12 VAL 49 2HG1 VAL 49 -2.272 0.458 -12.495 378 HG13 VAL 49 3HG1 VAL 49 -2.399 2.169 -12.084 379 HG21 VAL 49 3HG2 VAL 49 -1.868 -0.589 -9.488 380 HG22 VAL 49 1HG2 VAL 49 -2.550 0.981 -9.066 381 HG23 VAL 49 2HG2 VAL 49 -3.131 0.120 -10.493 382 H ASP 50 H ASP 50 0.697 -0.292 -13.215 383 HA ASP 50 HA ASP 50 -0.943 -2.665 -13.517 384 HB2 ASP 50 1HB ASP 50 -0.326 -0.693 -15.251 385 HB3 ASP 50 2HB ASP 50 0.917 -1.865 -15.681 386 H ARG 51 H ARG 51 1.892 -2.217 -12.089 387 HA ARG 51 HA ARG 51 3.020 -4.753 -13.084 388 HB2 ARG 51 1HB ARG 51 4.477 -2.377 -11.911 389 HB3 ARG 51 2HB ARG 51 5.228 -3.908 -12.338 390 HG2 ARG 51 1HG ARG 51 4.194 -3.416 -14.690 391 HG3 ARG 51 2HG ARG 51 4.183 -1.752 -14.102 392 HD2 ARG 51 1HD ARG 51 6.699 -2.954 -13.480 393 HD3 ARG 51 2HD ARG 51 6.343 -3.211 -15.188 394 HE ARG 51 HE ARG 51 5.798 -0.551 -14.663 395 HH11 ARG 51 1HH1 ARG 51 8.554 -2.676 -14.551 396 HH12 ARG 51 2HH1 ARG 51 9.700 -1.421 -14.891 397 HH21 ARG 51 1HH2 ARG 51 7.297 1.109 -15.111 398 HH22 ARG 51 2HH2 ARG 51 8.984 0.732 -15.208 399 H PHE 52 H PHE 52 2.612 -2.681 -10.234 400 HA PHE 52 HA PHE 52 3.540 -4.563 -8.347 401 HB2 PHE 52 1HB PHE 52 1.846 -2.091 -8.170 402 HB3 PHE 52 2HB PHE 52 2.086 -3.108 -6.753 403 HD1 PHE 52 HD1 PHE 52 3.710 -0.878 -9.165 404 HD2 PHE 52 HD2 PHE 52 4.204 -3.204 -5.634 405 HE1 PHE 52 HE1 PHE 52 5.851 0.251 -8.725 406 HE2 PHE 52 HE2 PHE 52 6.345 -2.077 -5.188 407 HZ PHE 52 HZ PHE 52 7.172 -0.347 -6.734 408 H ASP 53 H ASP 53 1.817 -5.048 -6.436 409 HA ASP 53 HA ASP 53 -0.272 -6.657 -7.738 410 HB2 ASP 53 1HB ASP 53 1.186 -6.990 -5.117 411 HB3 ASP 53 2HB ASP 53 -0.253 -7.919 -5.528 412 H VAL 54 H VAL 54 0.191 -5.122 -4.550 413 HA VAL 54 HA VAL 54 -2.648 -4.346 -4.616 414 HB VAL 54 HB VAL 54 -2.610 -4.266 -2.210 415 HG11 VAL 54 1HG1 VAL 54 -1.303 -6.782 -2.171 416 HG12 VAL 54 2HG1 VAL 54 -3.034 -6.445 -2.230 417 HG13 VAL 54 3HG1 VAL 54 -2.115 -6.616 -3.726 418 HG21 VAL 54 3HG2 VAL 54 -0.596 -4.875 -0.928 419 HG22 VAL 54 1HG2 VAL 54 0.326 -4.920 -2.432 420 HG23 VAL 54 2HG2 VAL 54 -0.371 -3.400 -1.870 421 H VAL 55 H VAL 55 -3.241 -2.271 -3.756 422 HA VAL 55 HA VAL 55 -1.068 -0.284 -3.811 423 HB VAL 55 HB VAL 55 -3.826 0.124 -4.973 424 HG11 VAL 55 1HG1 VAL 55 -2.184 2.072 -5.975 425 HG12 VAL 55 2HG1 VAL 55 -3.305 2.275 -4.628 426 HG13 VAL 55 3HG1 VAL 55 -1.609 1.908 -4.316 427 HG21 VAL 55 3HG2 VAL 55 -1.188 -0.266 -6.385 428 HG22 VAL 55 1HG2 VAL 55 -2.513 -1.428 -6.329 429 HG23 VAL 55 2HG2 VAL 55 -2.728 0.114 -7.156 430 H LEU 56 H LEU 56 -1.188 1.371 -2.344 431 HA LEU 56 HA LEU 56 -3.543 1.494 -0.599 432 HB2 LEU 56 1HB LEU 56 -0.696 1.462 0.390 433 HB3 LEU 56 2HB LEU 56 -2.147 1.613 1.380 434 HG LEU 56 HG LEU 56 -1.252 -0.820 -0.164 435 HD11 LEU 56 1HD1 LEU 56 -1.776 -1.018 2.699 436 HD12 LEU 56 2HD1 LEU 56 -0.444 0.066 2.296 437 HD13 LEU 56 3HD1 LEU 56 -0.412 -1.610 1.749 438 HD21 LEU 56 3HD2 LEU 56 -3.876 -0.015 0.636 439 HD22 LEU 56 1HD2 LEU 56 -3.379 -1.417 1.583 440 HD23 LEU 56 2HD2 LEU 56 -3.365 -1.493 -0.180 441 H LEU 57 H LEU 57 -4.156 3.510 -0.054 442 HA LEU 57 HA LEU 57 -2.448 5.719 -0.975 443 HB2 LEU 57 1HB LEU 57 -5.376 5.279 -0.873 444 HB3 LEU 57 2HB LEU 57 -4.801 6.921 -0.591 445 HG LEU 57 HG LEU 57 -5.482 6.417 -2.947 446 HD11 LEU 57 1HD1 LEU 57 -2.986 7.175 -3.737 447 HD12 LEU 57 2HD1 LEU 57 -2.978 7.614 -2.029 448 HD13 LEU 57 3HD1 LEU 57 -4.222 8.259 -3.098 449 HD21 LEU 57 3HD2 LEU 57 -4.196 5.021 -4.327 450 HD22 LEU 57 1HD2 LEU 57 -4.457 4.085 -2.856 451 HD23 LEU 57 2HD2 LEU 57 -2.908 4.881 -3.131 452 H ALA 58 H ALA 58 -2.311 7.637 0.309 453 HA ALA 58 HA ALA 58 -2.584 7.083 3.183 454 HB1 ALA 58 3HB ALA 58 -0.372 7.571 2.956 455 HB2 ALA 58 1HB ALA 58 -0.633 8.631 1.571 456 HB3 ALA 58 2HB ALA 58 -0.992 9.203 3.201 457 HA PRO 59 HA PRO 59 -5.547 10.258 3.806 458 HB2 PRO 59 1HB PRO 59 -4.734 11.368 6.147 459 HB3 PRO 59 2HB PRO 59 -5.467 9.762 6.049 460 HG2 PRO 59 1HG PRO 59 -2.577 10.514 6.247 461 HG3 PRO 59 2HG PRO 59 -3.458 9.226 7.088 462 HD2 PRO 59 1HD PRO 59 -1.901 8.753 4.924 463 HD3 PRO 59 2HD PRO 59 -3.360 7.804 5.277 464 H GLN 60 H GLN 60 -4.604 11.409 1.880 465 HA GLN 60 HA GLN 60 -4.314 14.136 2.403 466 HB2 GLN 60 1HB GLN 60 -1.943 12.853 2.921 467 HB3 GLN 60 2HB GLN 60 -1.725 13.371 1.255 468 HG2 GLN 60 1HG GLN 60 -2.319 15.675 1.947 469 HG3 GLN 60 2HG GLN 60 -2.376 15.116 3.618 470 HE21 GLN 60 2HE2 GLN 60 -0.704 16.304 4.392 471 HE22 GLN 60 1HE2 GLN 60 0.937 16.097 3.894 472 H SER 61 H SER 61 -5.714 12.343 0.653 473 HA SER 61 HA SER 61 -4.768 13.315 -1.965 474 HB2 SER 61 1HB SER 61 -6.602 11.119 -2.236 475 HB3 SER 61 2HB SER 61 -4.922 11.228 -2.763 476 HG SER 61 HG SER 61 -4.293 10.550 -0.689 477 H ARG 62 H ARG 62 -6.094 14.603 -3.073 478 HA ARG 62 HA ARG 62 -8.726 15.171 -1.962 479 HB2 ARG 62 1HB ARG 62 -7.121 16.533 -4.132 480 HB3 ARG 62 2HB ARG 62 -8.711 17.062 -3.595 481 HG2 ARG 62 1HG ARG 62 -7.094 16.807 -1.294 482 HG3 ARG 62 2HG ARG 62 -6.156 17.679 -2.509 483 HD2 ARG 62 1HD ARG 62 -7.712 19.402 -2.651 484 HD3 ARG 62 2HD ARG 62 -9.003 18.422 -1.957 485 HE ARG 62 HE ARG 62 -6.934 18.781 -0.068 486 HH11 ARG 62 1HH1 ARG 62 -9.528 20.498 -1.631 487 HH12 ARG 62 2HH1 ARG 62 -9.765 21.601 -0.317 488 HH21 ARG 62 1HH2 ARG 62 -7.236 20.227 1.669 489 HH22 ARG 62 2HH2 ARG 62 -8.460 21.447 1.560 490 H PHE 63 H PHE 63 -7.491 14.816 -5.292 491 HA PHE 63 HA PHE 63 -10.078 13.660 -6.048 492 HB2 PHE 63 1HB PHE 63 -8.265 15.483 -7.322 493 HB3 PHE 63 2HB PHE 63 -8.464 14.058 -8.338 494 HD1 PHE 63 HD1 PHE 63 -10.612 16.304 -6.266 495 HD2 PHE 63 HD2 PHE 63 -10.113 14.173 -9.917 496 HE1 PHE 63 HE1 PHE 63 -12.763 17.187 -7.071 497 HE2 PHE 63 HE2 PHE 63 -12.264 15.053 -10.728 498 HZ PHE 63 HZ PHE 63 -13.590 16.563 -9.304 499 H ASN 64 H ASN 64 -6.679 12.964 -5.821 500 HA ASN 64 HA ASN 64 -6.397 10.784 -7.490 501 HB2 ASN 64 1HB ASN 64 -5.179 10.940 -4.730 502 HB3 ASN 64 2HB ASN 64 -4.525 10.134 -6.153 503 HD21 ASN 64 2HD2 ASN 64 -4.540 12.936 -4.316 504 HD22 ASN 64 1HD2 ASN 64 -3.684 13.966 -5.409 505 H LYS 65 H LYS 65 -7.805 10.931 -4.262 506 HA LYS 65 HA LYS 65 -8.056 8.185 -3.783 507 HB2 LYS 65 1HB LYS 65 -8.408 9.703 -1.978 508 HB3 LYS 65 2HB LYS 65 -9.686 10.544 -2.846 509 HG2 LYS 65 1HG LYS 65 -11.242 8.916 -2.413 510 HG3 LYS 65 2HG LYS 65 -10.026 7.652 -2.225 511 HD2 LYS 65 1HD LYS 65 -10.854 8.064 -0.055 512 HD3 LYS 65 2HD LYS 65 -9.289 8.878 -0.126 513 HE2 LYS 65 1HE LYS 65 -10.221 10.965 -0.094 514 HE3 LYS 65 2HE LYS 65 -11.708 10.432 -0.876 515 HZ1 LYS 65 3HZ LYS 65 -11.720 11.058 1.621 516 HZ2 LYS 65 1HZ LYS 65 -11.087 9.505 1.846 517 HZ3 LYS 65 2HZ LYS 65 -12.592 9.705 1.100 518 H LYS 66 H LYS 66 -10.540 10.444 -4.997 519 HA LYS 66 HA LYS 66 -12.513 8.581 -5.554 520 HB2 LYS 66 1HB LYS 66 -12.833 11.034 -5.614 521 HB3 LYS 66 2HB LYS 66 -11.905 11.105 -7.106 522 HG2 LYS 66 1HG LYS 66 -13.938 11.033 -8.055 523 HG3 LYS 66 2HG LYS 66 -13.767 9.294 -7.804 524 HD2 LYS 66 1HD LYS 66 -15.869 9.735 -6.923 525 HD3 LYS 66 2HD LYS 66 -14.834 9.768 -5.492 526 HE2 LYS 66 1HE LYS 66 -14.665 12.316 -6.029 527 HE3 LYS 66 2HE LYS 66 -16.142 12.028 -6.948 528 HZ1 LYS 66 3HZ LYS 66 -16.012 11.020 -4.204 529 HZ2 LYS 66 1HZ LYS 66 -17.337 11.609 -5.076 530 HZ3 LYS 66 2HZ LYS 66 -16.207 12.686 -4.423 531 H ARG 67 H ARG 67 -10.060 9.874 -7.795 532 HA ARG 67 HA ARG 67 -10.747 8.351 -10.020 533 HB2 ARG 67 1HB ARG 67 -7.965 9.234 -9.235 534 HB3 ARG 67 2HB ARG 67 -8.513 8.820 -10.853 535 HG2 ARG 67 1HG ARG 67 -10.255 10.816 -9.953 536 HG3 ARG 67 2HG ARG 67 -8.635 11.330 -9.475 537 HD2 ARG 67 1HD ARG 67 -8.872 12.204 -11.619 538 HD3 ARG 67 2HD ARG 67 -7.958 10.717 -11.877 539 HE ARG 67 HE ARG 67 -9.716 9.900 -13.087 540 HH11 ARG 67 1HH1 ARG 67 -10.821 12.587 -11.168 541 HH12 ARG 67 2HH1 ARG 67 -12.393 12.627 -11.892 542 HH21 ARG 67 1HH2 ARG 67 -11.784 9.942 -14.048 543 HH22 ARG 67 2HH2 ARG 67 -12.940 11.121 -13.530 544 H LEU 68 H LEU 68 -8.188 7.674 -7.626 545 HA LEU 68 HA LEU 68 -7.345 5.230 -8.568 546 HB2 LEU 68 1HB LEU 68 -7.466 6.464 -5.862 547 HB3 LEU 68 2HB LEU 68 -7.029 4.762 -5.993 548 HG LEU 68 HG LEU 68 -5.530 6.627 -7.726 549 HD11 LEU 68 1HD1 LEU 68 -4.088 6.738 -5.386 550 HD12 LEU 68 2HD1 LEU 68 -5.745 7.025 -4.855 551 HD13 LEU 68 3HD1 LEU 68 -5.026 8.055 -6.092 552 HD21 LEU 68 3HD2 LEU 68 -5.030 4.141 -6.146 553 HD22 LEU 68 1HD2 LEU 68 -3.677 5.144 -6.668 554 HD23 LEU 68 2HD2 LEU 68 -4.773 4.451 -7.863 555 H GLU 69 H GLU 69 -10.121 5.943 -6.504 556 HA GLU 69 HA GLU 69 -10.819 3.225 -6.032 557 HB2 GLU 69 1HB GLU 69 -12.269 5.839 -5.717 558 HB3 GLU 69 2HB GLU 69 -13.093 4.309 -5.451 559 HG2 GLU 69 1HG GLU 69 -10.553 5.043 -4.031 560 HG3 GLU 69 2HG GLU 69 -12.148 5.465 -3.413 561 H GLU 70 H GLU 70 -12.025 5.693 -8.286 562 HA GLU 70 HA GLU 70 -13.981 4.059 -9.497 563 HB2 GLU 70 1HB GLU 70 -12.523 6.463 -10.608 564 HB3 GLU 70 2HB GLU 70 -13.967 5.745 -11.307 565 HG2 GLU 70 1HG GLU 70 -14.004 6.661 -8.471 566 HG3 GLU 70 2HG GLU 70 -14.148 7.838 -9.776 567 H ILE 71 H ILE 71 -10.584 4.116 -9.756 568 HA ILE 71 HA ILE 71 -10.584 2.789 -12.361 569 HB ILE 71 HB ILE 71 -8.273 3.671 -10.628 570 HG12 ILE 71 1HG1 ILE 71 -8.964 4.852 -13.291 571 HG13 ILE 71 2HG1 ILE 71 -9.866 5.364 -11.869 572 HG21 ILE 71 1HG2 ILE 71 -8.434 2.115 -13.140 573 HG22 ILE 71 2HG2 ILE 71 -7.175 3.345 -13.037 574 HG23 ILE 71 3HG2 ILE 71 -7.245 2.052 -11.839 575 HD11 ILE 71 3HD1 ILE 71 -7.168 5.475 -11.143 576 HD12 ILE 71 1HD1 ILE 71 -7.270 6.167 -12.762 577 HD13 ILE 71 2HD1 ILE 71 -8.260 6.824 -11.458 578 H THR 72 H THR 72 -9.773 2.196 -8.980 579 HA THR 72 HA THR 72 -8.673 -0.386 -9.354 580 HB THR 72 HB THR 72 -9.197 -0.673 -6.885 581 HG1 THR 72 HG1 THR 72 -10.735 0.674 -6.275 582 HG21 THR 72 3HG2 THR 72 -7.135 0.135 -6.662 583 HG22 THR 72 1HG2 THR 72 -7.767 1.780 -6.705 584 HG23 THR 72 2HG2 THR 72 -7.296 0.977 -8.202 585 H LYS 73 H LYS 73 -11.937 0.777 -8.695 586 HA LYS 73 HA LYS 73 -13.229 -1.572 -8.059 587 HB2 LYS 73 1HB LYS 73 -13.988 1.031 -9.117 588 HB3 LYS 73 2HB LYS 73 -15.029 -0.253 -9.722 589 HG2 LYS 73 1HG LYS 73 -14.728 -0.720 -6.970 590 HG3 LYS 73 2HG LYS 73 -15.014 1.012 -7.157 591 HD2 LYS 73 1HD LYS 73 -16.908 0.230 -8.778 592 HD3 LYS 73 2HD LYS 73 -16.762 -1.296 -7.902 593 HE2 LYS 73 1HE LYS 73 -17.815 -0.474 -6.114 594 HE3 LYS 73 2HE LYS 73 -16.838 0.994 -6.120 595 HZ1 LYS 73 3HZ LYS 73 -18.403 1.492 -8.184 596 HZ2 LYS 73 1HZ LYS 73 -18.833 1.905 -6.600 597 HZ3 LYS 73 2HZ LYS 73 -19.453 0.498 -7.305 598 HA PRO 74 HA PRO 74 -13.994 -2.501 -12.731 599 HB2 PRO 74 1HB PRO 74 -12.693 -0.962 -14.550 600 HB3 PRO 74 2HB PRO 74 -14.290 -0.552 -13.910 601 HG2 PRO 74 1HG PRO 74 -11.601 0.493 -13.109 602 HG3 PRO 74 2HG PRO 74 -13.118 1.377 -13.349 603 HD2 PRO 74 1HD PRO 74 -12.204 0.695 -10.894 604 HD3 PRO 74 2HD PRO 74 -13.935 0.792 -11.275 605 H LYS 75 H LYS 75 -10.783 -1.306 -11.883 606 HA LYS 75 HA LYS 75 -9.303 -2.991 -13.594 607 HB2 LYS 75 1HB LYS 75 -8.346 -0.998 -12.522 608 HB3 LYS 75 2HB LYS 75 -8.499 -1.767 -10.948 609 HG2 LYS 75 1HG LYS 75 -6.301 -2.172 -11.394 610 HG3 LYS 75 2HG LYS 75 -7.030 -3.630 -12.071 611 HD2 LYS 75 1HD LYS 75 -7.151 -2.061 -14.229 612 HD3 LYS 75 2HD LYS 75 -5.760 -1.323 -13.433 613 HE2 LYS 75 1HE LYS 75 -4.438 -3.024 -14.001 614 HE3 LYS 75 2HE LYS 75 -5.591 -4.208 -13.388 615 HZ1 LYS 75 3HZ LYS 75 -6.309 -4.649 -15.434 616 HZ2 LYS 75 1HZ LYS 75 -4.944 -3.825 -15.998 617 HZ3 LYS 75 2HZ LYS 75 -6.423 -3.016 -15.859 618 H GLY 76 H GLY 76 -10.626 -3.437 -10.370 619 HA2 GLY 76 1HA GLY 76 -11.027 -5.396 -9.218 620 HA3 GLY 76 2HA GLY 76 -10.418 -6.286 -10.606 621 H ILE 77 H ILE 77 -9.150 -4.095 -8.092 622 HA ILE 77 HA ILE 77 -7.116 -6.091 -7.452 623 HB ILE 77 HB ILE 77 -5.347 -4.322 -7.405 624 HG12 ILE 77 1HG1 ILE 77 -6.462 -2.575 -9.363 625 HG13 ILE 77 2HG1 ILE 77 -7.581 -2.655 -8.007 626 HG21 ILE 77 1HG2 ILE 77 -5.402 -5.925 -9.204 627 HG22 ILE 77 2HG2 ILE 77 -6.604 -4.967 -10.068 628 HG23 ILE 77 3HG2 ILE 77 -4.969 -4.343 -9.851 629 HD11 ILE 77 3HD1 ILE 77 -5.944 -1.883 -6.494 630 HD12 ILE 77 1HD1 ILE 77 -4.650 -2.098 -7.672 631 HD13 ILE 77 2HD1 ILE 77 -5.858 -0.835 -7.908 632 HA PRO 78 HA PRO 78 -7.852 -4.859 -3.303 633 HB2 PRO 78 1HB PRO 78 -5.430 -5.344 -2.175 634 HB3 PRO 78 2HB PRO 78 -6.536 -6.632 -2.670 635 HG2 PRO 78 1HG PRO 78 -4.144 -5.537 -4.098 636 HG3 PRO 78 2HG PRO 78 -4.650 -7.223 -3.896 637 HD2 PRO 78 1HD PRO 78 -5.096 -5.834 -6.175 638 HD3 PRO 78 2HD PRO 78 -6.203 -7.094 -5.594 639 H ILE 79 H ILE 79 -8.164 -2.756 -2.875 640 HA ILE 79 HA ILE 79 -5.793 -1.015 -2.728 641 HB ILE 79 HB ILE 79 -6.993 -0.330 -4.692 642 HG12 ILE 79 1HG1 ILE 79 -7.536 1.989 -4.107 643 HG13 ILE 79 2HG1 ILE 79 -7.644 1.547 -2.406 644 HG21 ILE 79 1HG2 ILE 79 -9.177 -0.662 -4.887 645 HG22 ILE 79 2HG2 ILE 79 -9.277 -1.088 -3.179 646 HG23 ILE 79 3HG2 ILE 79 -9.471 0.591 -3.682 647 HD11 ILE 79 3HD1 ILE 79 -5.446 1.705 -2.126 648 HD12 ILE 79 1HD1 ILE 79 -5.103 0.806 -3.605 649 HD13 ILE 79 2HD1 ILE 79 -5.431 2.537 -3.680 650 H GLU 80 H GLU 80 -5.468 -0.401 -0.703 651 HA GLU 80 HA GLU 80 -7.813 0.022 1.032 652 HB2 GLU 80 1HB GLU 80 -5.806 -1.809 1.425 653 HB3 GLU 80 2HB GLU 80 -5.247 -0.442 2.380 654 HG2 GLU 80 1HG GLU 80 -6.544 -1.990 3.726 655 HG3 GLU 80 2HG GLU 80 -7.342 -0.421 3.611 656 H ILE 81 H ILE 81 -7.267 1.518 2.924 657 HA ILE 81 HA ILE 81 -5.463 3.679 2.078 658 HB ILE 81 HB ILE 81 -8.259 4.101 3.139 659 HG12 ILE 81 1HG1 ILE 81 -7.126 4.667 0.391 660 HG13 ILE 81 2HG1 ILE 81 -8.182 3.315 0.785 661 HG21 ILE 81 1HG2 ILE 81 -6.693 5.807 3.897 662 HG22 ILE 81 2HG2 ILE 81 -6.176 6.084 2.234 663 HG23 ILE 81 3HG2 ILE 81 -7.826 6.473 2.720 664 HD11 ILE 81 3HD1 ILE 81 -8.827 6.083 0.223 665 HD12 ILE 81 1HD1 ILE 81 -9.852 4.649 0.187 666 HD13 ILE 81 2HD1 ILE 81 -9.577 5.498 1.708 667 H ILE 82 H ILE 82 -4.215 4.476 3.658 668 HA ILE 82 HA ILE 82 -4.292 3.258 6.253 669 HB ILE 82 HB ILE 82 -2.587 5.594 5.394 670 HG12 ILE 82 1HG1 ILE 82 -1.985 2.637 5.165 671 HG13 ILE 82 2HG1 ILE 82 -2.367 3.701 3.815 672 HG21 ILE 82 1HG2 ILE 82 -2.076 3.473 7.472 673 HG22 ILE 82 2HG2 ILE 82 -1.106 4.909 7.148 674 HG23 ILE 82 3HG2 ILE 82 -2.726 5.075 7.824 675 HD11 ILE 82 3HD1 ILE 82 -0.354 4.915 4.097 676 HD12 ILE 82 1HD1 ILE 82 -0.023 4.133 5.643 677 HD13 ILE 82 2HD1 ILE 82 0.061 3.202 4.147 678 H ASN 83 H ASN 83 -5.475 3.910 7.914 679 HA ASN 83 HA ASN 83 -7.061 6.232 7.892 680 HB2 ASN 83 1HB ASN 83 -6.597 3.987 9.663 681 HB3 ASN 83 2HB ASN 83 -6.769 5.484 10.576 682 HD21 ASN 83 2HD2 ASN 83 -8.720 6.534 10.613 683 HD22 ASN 83 1HD2 ASN 83 -10.175 5.839 9.994 684 H THR 84 H THR 84 -6.932 8.137 9.133 685 HA THR 84 HA THR 84 -4.518 9.470 9.133 686 HB THR 84 HB THR 84 -6.321 10.342 11.284 687 HG1 THR 84 HG1 THR 84 -7.263 10.126 8.600 688 HG21 THR 84 3HG2 THR 84 -4.450 11.508 9.682 689 HG22 THR 84 1HG2 THR 84 -5.688 12.386 10.580 690 HG23 THR 84 2HG2 THR 84 -5.947 11.986 8.881 691 H ILE 85 H ILE 85 -6.000 7.589 11.722 692 HA ILE 85 HA ILE 85 -4.148 8.289 13.744 693 HB ILE 85 HB ILE 85 -5.757 5.743 13.536 694 HG12 ILE 85 1HG1 ILE 85 -6.489 8.351 14.883 695 HG13 ILE 85 2HG1 ILE 85 -7.139 7.806 13.341 696 HG21 ILE 85 1HG2 ILE 85 -5.528 5.628 15.939 697 HG22 ILE 85 2HG2 ILE 85 -3.932 5.716 15.195 698 HG23 ILE 85 3HG2 ILE 85 -4.630 7.146 15.954 699 HD11 ILE 85 3HD1 ILE 85 -8.795 6.970 14.573 700 HD12 ILE 85 1HD1 ILE 85 -7.660 5.674 14.950 701 HD13 ILE 85 2HD1 ILE 85 -7.850 7.032 16.061 702 H ASP 86 H ASP 86 -4.431 5.284 11.838 703 HA ASP 86 HA ASP 86 -2.080 4.086 12.714 704 HB2 ASP 86 1HB ASP 86 -3.733 3.825 10.229 705 HB3 ASP 86 2HB ASP 86 -2.191 2.979 10.338 706 H TYR 87 H TYR 87 -2.610 6.410 10.122 707 HA TYR 87 HA TYR 87 -0.033 6.268 8.982 708 HB2 TYR 87 1HB TYR 87 -1.905 7.282 7.793 709 HB3 TYR 87 2HB TYR 87 -2.021 8.549 9.009 710 HD1 TYR 87 HD1 TYR 87 0.113 7.188 6.309 711 HD2 TYR 87 HD2 TYR 87 -0.644 10.475 8.902 712 HE1 TYR 87 HE1 TYR 87 1.687 8.564 5.014 713 HE2 TYR 87 HE2 TYR 87 0.928 11.860 7.614 714 HH TYR 87 HH TYR 87 3.069 10.554 5.314 715 H GLY 88 H GLY 88 -1.396 8.841 11.054 716 HA2 GLY 88 1HA GLY 88 0.955 10.222 11.534 717 HA3 GLY 88 2HA GLY 88 -0.409 10.176 12.641 718 H THR 89 H THR 89 -0.243 7.312 13.093 719 HA THR 89 HA THR 89 1.745 7.365 15.174 720 HB THR 89 HB THR 89 0.910 5.133 15.770 721 HG1 THR 89 HG1 THR 89 0.292 4.110 13.971 722 HG21 THR 89 3HG2 THR 89 -0.611 6.307 16.901 723 HG22 THR 89 1HG2 THR 89 -1.707 6.114 15.533 724 HG23 THR 89 2HG2 THR 89 -0.670 7.537 15.638 725 H MET 90 H MET 90 1.511 6.127 11.954 726 HA MET 90 HA MET 90 2.996 5.057 10.605 727 HB2 MET 90 1HB MET 90 5.062 5.536 12.750 728 HB3 MET 90 2HB MET 90 5.335 5.303 11.029 729 HG2 MET 90 1HG MET 90 5.287 7.490 10.748 730 HG3 MET 90 2HG MET 90 3.608 7.507 11.280 731 HE1 MET 90 3HE MET 90 6.921 7.364 14.325 732 HE2 MET 90 1HE MET 90 6.905 6.646 12.713 733 HE3 MET 90 2HE MET 90 7.465 8.304 12.934 734 H ASN 91 H ASN 91 1.523 3.244 11.518 735 HA ASN 91 HA ASN 91 3.024 1.303 13.104 736 HB2 ASN 91 1HB ASN 91 0.175 1.781 12.505 737 HB3 ASN 91 2HB ASN 91 0.645 0.086 12.583 738 HD21 ASN 91 2HD2 ASN 91 1.700 -0.654 14.526 739 HD22 ASN 91 1HD2 ASN 91 1.334 0.105 16.034 740 H GLY 92 H GLY 92 4.576 0.706 11.536 741 HA2 GLY 92 1HA GLY 92 4.131 -0.062 8.918 742 HA3 GLY 92 2HA GLY 92 5.404 -0.719 9.935 743 H GLU 93 H GLU 93 4.038 -2.141 11.807 744 HA GLU 93 HA GLU 93 3.546 -4.564 10.577 745 HB2 GLU 93 1HB GLU 93 3.982 -4.241 13.005 746 HB3 GLU 93 2HB GLU 93 2.347 -3.622 13.187 747 HG2 GLU 93 1HG GLU 93 1.430 -5.757 12.515 748 HG3 GLU 93 2HG GLU 93 3.052 -6.386 12.227 749 H LYS 94 H LYS 94 1.164 -2.168 11.688 750 HA LYS 94 HA LYS 94 -1.126 -3.575 10.876 751 HB2 LYS 94 1HB LYS 94 -0.663 -0.606 11.191 752 HB3 LYS 94 2HB LYS 94 -2.243 -1.338 10.943 753 HG2 LYS 94 1HG LYS 94 -0.535 -2.254 13.209 754 HG3 LYS 94 2HG LYS 94 -1.436 -0.742 13.340 755 HD2 LYS 94 1HD LYS 94 -3.434 -2.212 12.501 756 HD3 LYS 94 2HD LYS 94 -2.443 -3.544 13.101 757 HE2 LYS 94 1HE LYS 94 -2.544 -2.795 15.296 758 HE3 LYS 94 2HE LYS 94 -2.961 -1.150 14.820 759 HZ1 LYS 94 3HZ LYS 94 -5.129 -1.636 14.771 760 HZ2 LYS 94 1HZ LYS 94 -4.718 -2.989 15.700 761 HZ3 LYS 94 2HZ LYS 94 -4.894 -3.137 14.025 762 H VAL 95 H VAL 95 0.929 -1.262 9.173 763 HA VAL 95 HA VAL 95 -0.650 -0.924 6.884 764 HB VAL 95 HB VAL 95 2.362 -0.843 7.101 765 HG11 VAL 95 1HG1 VAL 95 1.864 -0.996 4.807 766 HG12 VAL 95 2HG1 VAL 95 0.461 0.064 4.957 767 HG13 VAL 95 3HG1 VAL 95 2.089 0.725 5.116 768 HG21 VAL 95 3HG2 VAL 95 2.063 1.006 8.297 769 HG22 VAL 95 1HG2 VAL 95 1.274 1.736 6.899 770 HG23 VAL 95 2HG2 VAL 95 0.313 0.891 8.113 771 H LEU 96 H LEU 96 2.320 -2.891 7.087 772 HA LEU 96 HA LEU 96 2.000 -4.273 4.717 773 HB2 LEU 96 1HB LEU 96 3.414 -6.046 5.793 774 HB3 LEU 96 2HB LEU 96 4.072 -4.412 5.835 775 HG LEU 96 HG LEU 96 2.793 -4.547 8.238 776 HD11 LEU 96 1HD1 LEU 96 2.396 -7.011 7.684 777 HD12 LEU 96 2HD1 LEU 96 3.091 -6.627 9.256 778 HD13 LEU 96 3HD1 LEU 96 4.125 -7.220 7.957 779 HD21 LEU 96 3HD2 LEU 96 5.006 -4.755 9.195 780 HD22 LEU 96 1HD2 LEU 96 5.066 -3.722 7.767 781 HD23 LEU 96 2HD2 LEU 96 5.634 -5.389 7.673 782 H GLN 97 H GLN 97 0.712 -5.032 7.916 783 HA GLN 97 HA GLN 97 -0.324 -7.571 7.322 784 HB2 GLN 97 1HB GLN 97 -0.957 -5.487 9.377 785 HB3 GLN 97 2HB GLN 97 -1.994 -6.899 9.222 786 HG2 GLN 97 1HG GLN 97 0.963 -7.213 9.513 787 HG3 GLN 97 2HG GLN 97 -0.058 -6.931 10.922 788 HE21 GLN 97 2HE2 GLN 97 0.809 -9.145 8.402 789 HE22 GLN 97 1HE2 GLN 97 -0.007 -10.524 9.049 790 H LEU 98 H LEU 98 -1.720 -4.341 6.993 791 HA LEU 98 HA LEU 98 -4.313 -5.187 6.247 792 HB2 LEU 98 1HB LEU 98 -2.939 -2.738 6.620 793 HB3 LEU 98 2HB LEU 98 -3.675 -2.696 5.020 794 HG LEU 98 HG LEU 98 -5.082 -3.082 7.659 795 HD11 LEU 98 1HD1 LEU 98 -5.104 -0.869 5.615 796 HD12 LEU 98 2HD1 LEU 98 -4.497 -0.790 7.268 797 HD13 LEU 98 3HD1 LEU 98 -6.224 -0.987 6.972 798 HD21 LEU 98 3HD2 LEU 98 -5.895 -3.701 4.902 799 HD22 LEU 98 1HD2 LEU 98 -7.047 -2.740 5.828 800 HD23 LEU 98 2HD2 LEU 98 -6.518 -4.309 6.436 801 H ALA 99 H ALA 99 -1.571 -4.033 4.286 802 HA ALA 99 HA ALA 99 -2.709 -4.314 1.776 803 HB1 ALA 99 3HB ALA 99 -0.315 -3.481 2.647 804 HB2 ALA 99 1HB ALA 99 0.139 -5.059 2.004 805 HB3 ALA 99 2HB ALA 99 -0.647 -3.874 0.960 806 H ILE 100 H ILE 100 -0.696 -6.697 3.508 807 HA ILE 100 HA ILE 100 -0.906 -8.751 1.626 808 HB ILE 100 HB ILE 100 -0.584 -9.012 4.618 809 HG12 ILE 100 1HG1 ILE 100 1.595 -9.107 2.540 810 HG13 ILE 100 2HG1 ILE 100 1.095 -7.592 3.282 811 HG21 ILE 100 1HG2 ILE 100 0.524 -11.174 4.001 812 HG22 ILE 100 2HG2 ILE 100 -1.218 -11.128 3.729 813 HG23 ILE 100 3HG2 ILE 100 -0.109 -10.958 2.370 814 HD11 ILE 100 3HD1 ILE 100 2.431 -9.952 4.539 815 HD12 ILE 100 1HD1 ILE 100 2.919 -8.257 4.544 816 HD13 ILE 100 2HD1 ILE 100 1.540 -8.782 5.511 817 H ASN 101 H ASN 101 -2.835 -8.173 4.562 818 HA ASN 101 HA ASN 101 -4.523 -10.353 4.424 819 HB2 ASN 101 1HB ASN 101 -4.638 -8.992 6.362 820 HB3 ASN 101 2HB ASN 101 -4.985 -7.545 5.421 821 HD21 ASN 101 2HD2 ASN 101 -6.856 -7.045 6.488 822 HD22 ASN 101 1HD2 ASN 101 -8.297 -7.990 6.362 823 H ALA 102 H ALA 102 -5.011 -7.143 2.962 824 HA ALA 102 HA ALA 102 -7.459 -7.736 1.711 825 HB1 ALA 102 3HB ALA 102 -6.287 -5.460 2.104 826 HB2 ALA 102 1HB ALA 102 -5.520 -5.777 0.548 827 HB3 ALA 102 2HB ALA 102 -7.278 -5.680 0.662 828 H PHE 103 H PHE 103 -4.117 -8.108 0.652 829 HA PHE 103 HA PHE 103 -4.572 -8.674 -2.044 830 HB2 PHE 103 1HB PHE 103 -2.338 -8.252 -1.046 831 HB3 PHE 103 2HB PHE 103 -2.410 -9.833 -0.274 832 HD1 PHE 103 HD1 PHE 103 -3.023 -8.490 -3.705 833 HD2 PHE 103 HD2 PHE 103 -1.100 -11.412 -1.280 834 HE1 PHE 103 HE1 PHE 103 -2.044 -9.511 -5.719 835 HE2 PHE 103 HE2 PHE 103 -0.118 -12.437 -3.290 836 HZ PHE 103 HZ PHE 103 -0.588 -11.486 -5.513 837 H ASN 104 H ASN 104 -4.176 -10.956 0.666 838 HA ASN 104 HA ASN 104 -4.728 -13.275 -0.824 839 HB2 ASN 104 1HB ASN 104 -4.425 -12.570 2.009 840 HB3 ASN 104 2HB ASN 104 -5.522 -13.920 1.729 841 HD21 ASN 104 2HD2 ASN 104 -2.448 -13.195 2.419 842 HD22 ASN 104 1HD2 ASN 104 -1.643 -14.565 1.740 843 H ASN 105 H ASN 105 -6.822 -11.206 1.154 844 HA ASN 105 HA ASN 105 -9.167 -12.713 0.942 845 HB2 ASN 105 1HB ASN 105 -8.417 -10.089 1.871 846 HB3 ASN 105 2HB ASN 105 -9.936 -10.003 0.984 847 HD21 ASN 105 2HD2 ASN 105 -11.565 -10.030 2.340 848 HD22 ASN 105 1HD2 ASN 105 -11.715 -11.039 3.734 849 H LYS 106 H LYS 106 -7.744 -10.333 -1.218 850 HA LYS 106 HA LYS 106 -8.265 -9.657 -3.329 851 HB2 LYS 106 1HB LYS 106 -9.210 -12.503 -3.275 852 HB3 LYS 106 2HB LYS 106 -9.476 -11.515 -4.707 853 HG2 LYS 106 1HG LYS 106 -6.858 -11.045 -4.282 854 HG3 LYS 106 2HG LYS 106 -6.996 -12.685 -3.644 855 HD2 LYS 106 1HD LYS 106 -8.257 -13.187 -5.842 856 HD3 LYS 106 2HD LYS 106 -7.534 -11.684 -6.420 857 HE2 LYS 106 1HE LYS 106 -5.972 -13.238 -7.092 858 HE3 LYS 106 2HE LYS 106 -5.321 -12.735 -5.532 859 HZ1 LYS 106 3HZ LYS 106 -6.381 -14.685 -4.531 860 HZ2 LYS 106 1HZ LYS 106 -5.268 -15.122 -5.727 861 HZ3 LYS 106 2HZ LYS 106 -6.926 -15.178 -6.055 862 H SER 107 H SER 107 -9.735 -8.096 -2.270 863 HA SER 107 HA SER 107 -12.193 -7.933 -3.602 864 HB2 SER 107 1HB SER 107 -12.286 -9.534 -1.231 865 HB3 SER 107 2HB SER 107 -13.200 -8.053 -0.947 866 HG SER 107 HG SER 107 -13.950 -10.177 -2.321 867 H SER 108 H SER 108 -12.242 -5.814 -3.899 868 HA SER 108 HA SER 108 -11.055 -3.994 -2.006 869 HB2 SER 108 1HB SER 108 -12.653 -2.798 -4.152 870 HB3 SER 108 2HB SER 108 -10.953 -2.559 -3.746 871 HG SER 108 HG SER 108 -11.273 -3.563 -5.804 872 H VAL 109 H VAL 109 -12.539 -1.790 -1.938 873 HA VAL 109 HA VAL 109 -14.889 -2.630 -0.403 874 HB VAL 109 HB VAL 109 -14.858 -0.405 0.588 875 HG11 VAL 109 1HG1 VAL 109 -13.541 -1.517 2.013 876 HG12 VAL 109 2HG1 VAL 109 -12.606 -2.259 0.714 877 HG13 VAL 109 3HG1 VAL 109 -12.212 -0.632 1.266 878 HG21 VAL 109 3HG2 VAL 109 -14.109 0.945 -1.232 879 HG22 VAL 109 1HG2 VAL 109 -12.934 1.115 0.072 880 HG23 VAL 109 2HG2 VAL 109 -12.571 0.085 -1.313 Start of MODEL 13 1 H1 GLY 1 H GLY 1 9.860 -23.006 -2.645 2 HA2 GLY 1 1HA GLY 1 11.904 -22.419 -4.654 3 HA3 GLY 1 2HA GLY 1 10.231 -22.446 -5.191 4 HA PRO 2 HA PRO 2 11.488 -18.206 -3.524 5 HB2 PRO 2 1HB PRO 2 11.334 -16.861 -5.878 6 HB3 PRO 2 2HB PRO 2 12.818 -17.630 -5.306 7 HG2 PRO 2 1HG PRO 2 10.814 -18.625 -7.293 8 HG3 PRO 2 2HG PRO 2 12.585 -18.681 -7.367 9 HD2 PRO 2 1HD PRO 2 11.087 -20.822 -6.653 10 HD3 PRO 2 2HD PRO 2 12.708 -20.527 -5.992 11 H GLY 3 H GLY 3 10.085 -16.380 -3.335 12 HA2 GLY 3 1HA GLY 3 7.697 -15.975 -4.700 13 HA3 GLY 3 2HA GLY 3 7.328 -17.043 -3.354 14 H SER 4 H SER 4 7.166 -13.952 -4.247 15 HA SER 4 HA SER 4 7.144 -13.025 -1.492 16 HB2 SER 4 1HB SER 4 8.403 -10.896 -2.349 17 HB3 SER 4 2HB SER 4 9.328 -12.325 -1.890 18 HG SER 4 HG SER 4 9.043 -11.138 -4.336 19 H MET 5 H MET 5 6.297 -10.711 -1.399 20 HA MET 5 HA MET 5 4.262 -10.348 -3.499 21 HB2 MET 5 1HB MET 5 3.633 -10.987 -1.011 22 HB3 MET 5 2HB MET 5 3.859 -9.263 -0.746 23 HG2 MET 5 1HG MET 5 2.239 -9.761 -3.081 24 HG3 MET 5 2HG MET 5 1.567 -10.539 -1.649 25 HE1 MET 5 3HE MET 5 0.811 -9.217 0.551 26 HE2 MET 5 1HE MET 5 2.489 -8.690 0.680 27 HE3 MET 5 2HE MET 5 1.183 -7.511 0.808 28 H ASN 6 H ASN 6 3.627 -8.165 -3.975 29 HA ASN 6 HA ASN 6 5.716 -6.190 -3.323 30 HB2 ASN 6 1HB ASN 6 4.150 -6.494 -5.894 31 HB3 ASN 6 2HB ASN 6 5.268 -5.179 -5.547 32 HD21 ASN 6 2HD2 ASN 6 5.419 -7.047 -7.699 33 HD22 ASN 6 1HD2 ASN 6 6.899 -7.920 -7.516 34 H ILE 7 H ILE 7 4.961 -4.657 -2.032 35 HA ILE 7 HA ILE 7 2.113 -3.949 -2.170 36 HB ILE 7 HB ILE 7 4.111 -3.311 0.003 37 HG12 ILE 7 1HG1 ILE 7 2.129 -5.008 0.999 38 HG13 ILE 7 2HG1 ILE 7 2.546 -5.689 -0.569 39 HG21 ILE 7 1HG2 ILE 7 1.126 -2.928 -0.158 40 HG22 ILE 7 2HG2 ILE 7 2.084 -2.730 1.309 41 HG23 ILE 7 3HG2 ILE 7 2.357 -1.668 -0.072 42 HD11 ILE 7 3HD1 ILE 7 4.806 -4.919 1.155 43 HD12 ILE 7 1HD1 ILE 7 3.834 -6.287 1.695 44 HD13 ILE 7 2HD1 ILE 7 4.598 -6.321 0.106 45 H LEU 8 H LEU 8 1.448 -1.945 -2.708 46 HA LEU 8 HA LEU 8 3.533 0.014 -3.402 47 HB2 LEU 8 1HB LEU 8 2.190 -0.796 -5.286 48 HB3 LEU 8 2HB LEU 8 0.726 -0.252 -4.469 49 HG LEU 8 HG LEU 8 1.377 2.051 -4.725 50 HD11 LEU 8 1HD1 LEU 8 3.990 0.897 -5.137 51 HD12 LEU 8 2HD1 LEU 8 3.539 2.553 -4.739 52 HD13 LEU 8 3HD1 LEU 8 3.578 2.031 -6.422 53 HD21 LEU 8 3HD2 LEU 8 1.331 0.263 -7.090 54 HD22 LEU 8 1HD2 LEU 8 1.779 1.949 -7.350 55 HD23 LEU 8 2HD2 LEU 8 0.223 1.553 -6.620 56 H LEU 9 H LEU 9 3.377 2.117 -2.708 57 HA LEU 9 HA LEU 9 1.193 2.711 -0.820 58 HB2 LEU 9 1HB LEU 9 3.520 2.273 0.151 59 HB3 LEU 9 2HB LEU 9 3.973 3.816 -0.572 60 HG LEU 9 HG LEU 9 2.321 4.961 0.813 61 HD11 LEU 9 1HD1 LEU 9 1.491 3.375 2.780 62 HD12 LEU 9 2HD1 LEU 9 1.564 2.178 1.487 63 HD13 LEU 9 3HD1 LEU 9 0.561 3.617 1.302 64 HD21 LEU 9 3HD2 LEU 9 4.599 3.470 1.840 65 HD22 LEU 9 1HD2 LEU 9 3.421 3.876 3.088 66 HD23 LEU 9 2HD2 LEU 9 4.133 5.151 2.101 67 H VAL 10 H VAL 10 0.106 4.551 -1.149 68 HA VAL 10 HA VAL 10 1.196 6.457 -3.118 69 HB VAL 10 HB VAL 10 -1.721 5.914 -2.552 70 HG11 VAL 10 1HG1 VAL 10 -2.036 7.219 -4.661 71 HG12 VAL 10 2HG1 VAL 10 -1.408 8.161 -3.307 72 HG13 VAL 10 3HG1 VAL 10 -0.324 7.634 -4.594 73 HG21 VAL 10 3HG2 VAL 10 -0.567 4.007 -3.638 74 HG22 VAL 10 1HG2 VAL 10 -1.795 4.750 -4.662 75 HG23 VAL 10 2HG2 VAL 10 -0.087 5.084 -4.949 76 H CYS 11 H CYS 11 1.241 8.588 -2.613 77 HA CYS 11 HA CYS 11 -0.336 9.861 -0.675 78 HB2 CYS 11 1HB CYS 11 0.863 8.582 0.978 79 HB3 CYS 11 2HB CYS 11 2.410 9.013 0.259 80 HG CYS 11 HG CYS 11 1.074 10.407 2.759 81 H GLY 12 H GLY 12 3.170 10.142 -1.227 82 HA2 GLY 12 1HA GLY 12 3.762 11.710 -3.143 83 HA3 GLY 12 2HA GLY 12 2.659 12.824 -2.350 84 H ALA 13 H ALA 13 5.817 11.425 -2.341 85 HA ALA 13 HA ALA 13 6.547 13.104 -0.031 86 HB1 ALA 13 3HB ALA 13 8.643 11.404 -0.270 87 HB2 ALA 13 1HB ALA 13 7.255 11.134 0.784 88 HB3 ALA 13 2HB ALA 13 7.314 10.378 -0.809 89 H GLY 14 H GLY 14 8.462 11.579 -2.613 90 HA2 GLY 14 1HA GLY 14 9.107 13.274 -4.441 91 HA3 GLY 14 2HA GLY 14 9.725 14.198 -3.079 92 H MET 15 H MET 15 10.567 11.681 -1.711 93 HA MET 15 HA MET 15 12.829 10.936 -3.436 94 HB2 MET 15 1HB MET 15 14.288 10.967 -1.418 95 HB3 MET 15 2HB MET 15 13.696 12.556 -1.882 96 HG2 MET 15 1HG MET 15 11.836 12.122 -0.153 97 HG3 MET 15 2HG MET 15 12.909 10.861 0.449 98 HE1 MET 15 3HE MET 15 11.915 12.817 2.297 99 HE2 MET 15 1HE MET 15 12.988 14.119 2.811 100 HE3 MET 15 2HE MET 15 11.904 14.359 1.440 101 H SER 16 H SER 16 14.068 9.032 -2.275 102 HA SER 16 HA SER 16 12.070 6.958 -1.874 103 HB2 SER 16 1HB SER 16 13.690 5.431 -2.503 104 HB3 SER 16 2HB SER 16 14.249 6.866 -3.363 105 HG SER 16 HG SER 16 15.953 6.939 -2.124 106 H THR 17 H THR 17 13.070 5.134 -0.288 107 HA THR 17 HA THR 17 13.096 4.551 1.924 108 HB THR 17 HB THR 17 14.937 5.915 3.225 109 HG1 THR 17 HG1 THR 17 16.144 7.207 2.009 110 HG21 THR 17 3HG2 THR 17 15.805 4.269 0.858 111 HG22 THR 17 1HG2 THR 17 15.041 3.559 2.279 112 HG23 THR 17 2HG2 THR 17 16.581 4.405 2.436 113 H SER 18 H SER 18 10.898 5.577 2.049 114 HA SER 18 HA SER 18 10.813 8.083 3.537 115 HB2 SER 18 1HB SER 18 9.108 6.873 1.664 116 HB3 SER 18 2HB SER 18 8.237 6.811 3.195 117 HG SER 18 HG SER 18 8.654 9.078 3.393 118 H MET 19 H MET 19 9.152 8.143 5.376 119 HA MET 19 HA MET 19 10.058 6.593 7.493 120 HB2 MET 19 1HB MET 19 7.385 7.978 7.219 121 HB3 MET 19 2HB MET 19 8.093 7.421 8.729 122 HG2 MET 19 1HG MET 19 9.795 9.209 7.142 123 HG3 MET 19 2HG MET 19 8.312 9.932 7.762 124 HE1 MET 19 3HE MET 19 11.590 10.700 8.766 125 HE2 MET 19 1HE MET 19 12.148 9.456 9.885 126 HE3 MET 19 2HE MET 19 11.769 9.034 8.215 127 H LEU 20 H LEU 20 7.019 6.247 5.665 128 HA LEU 20 HA LEU 20 5.986 4.036 6.959 129 HB2 LEU 20 1HB LEU 20 5.648 5.315 4.355 130 HB3 LEU 20 2HB LEU 20 5.294 3.588 4.341 131 HG LEU 20 HG LEU 20 3.310 5.062 4.694 132 HD11 LEU 20 1HD1 LEU 20 2.323 3.678 6.375 133 HD12 LEU 20 2HD1 LEU 20 3.905 3.251 7.027 134 HD13 LEU 20 3HD1 LEU 20 3.429 2.684 5.427 135 HD21 LEU 20 3HD2 LEU 20 4.610 5.593 7.364 136 HD22 LEU 20 1HD2 LEU 20 2.996 6.102 6.867 137 HD23 LEU 20 2HD2 LEU 20 4.419 6.769 6.064 138 H VAL 21 H VAL 21 7.858 3.952 3.919 139 HA VAL 21 HA VAL 21 8.162 1.220 3.705 140 HB VAL 21 HB VAL 21 10.203 3.314 2.944 141 HG11 VAL 21 1HG1 VAL 21 10.267 0.463 2.793 142 HG12 VAL 21 2HG1 VAL 21 10.206 1.131 1.160 143 HG13 VAL 21 3HG1 VAL 21 11.482 1.629 2.271 144 HG21 VAL 21 3HG2 VAL 21 9.068 2.840 0.641 145 HG22 VAL 21 1HG2 VAL 21 7.712 2.313 1.637 146 HG23 VAL 21 2HG2 VAL 21 8.320 3.963 1.777 147 H GLN 22 H GLN 22 10.131 3.515 5.540 148 HA GLN 22 HA GLN 22 12.185 1.799 6.313 149 HB2 GLN 22 1HB GLN 22 11.116 4.375 7.202 150 HB3 GLN 22 2HB GLN 22 11.865 3.447 8.495 151 HG2 GLN 22 1HG GLN 22 13.946 3.417 7.422 152 HG3 GLN 22 2HG GLN 22 13.251 3.915 5.880 153 HE21 GLN 22 2HE2 GLN 22 14.345 4.941 8.999 154 HE22 GLN 22 1HE2 GLN 22 14.311 6.640 8.684 155 H ARG 23 H ARG 23 9.350 2.727 8.275 156 HA ARG 23 HA ARG 23 9.722 0.939 10.348 157 HB2 ARG 23 1HB ARG 23 7.212 2.113 9.164 158 HB3 ARG 23 2HB ARG 23 7.174 1.073 10.581 159 HG2 ARG 23 1HG ARG 23 9.066 2.863 11.317 160 HG3 ARG 23 2HG ARG 23 8.020 3.867 10.310 161 HD2 ARG 23 1HD ARG 23 6.537 4.004 11.955 162 HD3 ARG 23 2HD ARG 23 6.384 2.248 11.984 163 HE ARG 23 HE ARG 23 7.896 3.892 13.804 164 HH11 ARG 23 1HH1 ARG 23 7.467 0.704 12.473 165 HH12 ARG 23 2HH1 ARG 23 8.203 -0.099 13.820 166 HH21 ARG 23 1HH2 ARG 23 8.867 2.847 15.583 167 HH22 ARG 23 2HH2 ARG 23 8.998 1.121 15.588 168 H ILE 24 H ILE 24 7.570 0.470 7.539 169 HA ILE 24 HA ILE 24 6.791 -2.127 8.041 170 HB ILE 24 HB ILE 24 7.327 -0.891 5.338 171 HG12 ILE 24 1HG1 ILE 24 4.569 -1.177 6.344 172 HG13 ILE 24 2HG1 ILE 24 5.562 -0.017 7.220 173 HG21 ILE 24 1HG2 ILE 24 7.080 -3.088 4.773 174 HG22 ILE 24 2HG2 ILE 24 6.098 -3.456 6.190 175 HG23 ILE 24 3HG2 ILE 24 5.385 -2.607 4.819 176 HD11 ILE 24 3HD1 ILE 24 4.295 0.222 4.655 177 HD12 ILE 24 1HD1 ILE 24 5.054 1.459 5.655 178 HD13 ILE 24 2HD1 ILE 24 6.029 0.515 4.528 179 H GLU 25 H GLU 25 9.693 -0.991 6.360 180 HA GLU 25 HA GLU 25 10.655 -3.491 5.535 181 HB2 GLU 25 1HB GLU 25 11.840 -0.796 5.954 182 HB3 GLU 25 2HB GLU 25 12.951 -2.154 5.841 183 HG2 GLU 25 1HG GLU 25 11.635 -2.744 3.697 184 HG3 GLU 25 2HG GLU 25 11.074 -1.075 3.783 185 H LYS 26 H LYS 26 11.139 -1.682 8.533 186 HA LYS 26 HA LYS 26 13.043 -3.414 9.681 187 HB2 LYS 26 1HB LYS 26 11.392 -1.163 10.550 188 HB3 LYS 26 2HB LYS 26 11.674 -2.341 11.825 189 HG2 LYS 26 1HG LYS 26 13.867 -1.108 10.176 190 HG3 LYS 26 2HG LYS 26 13.325 -0.474 11.731 191 HD2 LYS 26 1HD LYS 26 13.773 -2.845 12.620 192 HD3 LYS 26 2HD LYS 26 14.692 -3.078 11.130 193 HE2 LYS 26 1HE LYS 26 16.265 -2.387 12.740 194 HE3 LYS 26 2HE LYS 26 15.950 -0.963 11.750 195 HZ1 LYS 26 3HZ LYS 26 14.343 -1.348 14.167 196 HZ2 LYS 26 1HZ LYS 26 14.864 0.085 13.434 197 HZ3 LYS 26 2HZ LYS 26 15.944 -0.837 14.352 198 H TYR 27 H TYR 27 9.552 -3.128 10.363 199 HA TYR 27 HA TYR 27 9.290 -5.280 12.068 200 HB2 TYR 27 1HB TYR 27 7.463 -3.742 11.727 201 HB3 TYR 27 2HB TYR 27 7.326 -4.208 10.035 202 HD1 TYR 27 HD1 TYR 27 6.389 -6.407 9.426 203 HD2 TYR 27 HD2 TYR 27 6.487 -5.073 13.466 204 HE1 TYR 27 HE1 TYR 27 4.744 -8.133 10.031 205 HE2 TYR 27 HE2 TYR 27 4.844 -6.796 14.081 206 HH TYR 27 HH TYR 27 3.859 -9.281 11.838 207 H ALA 28 H ALA 28 8.907 -5.274 8.529 208 HA ALA 28 HA ALA 28 8.393 -8.024 8.259 209 HB1 ALA 28 3HB ALA 28 8.706 -7.724 5.935 210 HB2 ALA 28 1HB ALA 28 8.013 -6.217 6.536 211 HB3 ALA 28 2HB ALA 28 9.738 -6.315 6.181 212 H LYS 29 H LYS 29 11.419 -6.181 8.025 213 HA LYS 29 HA LYS 29 13.114 -8.279 7.320 214 HB2 LYS 29 1HB LYS 29 13.803 -5.932 7.254 215 HB3 LYS 29 2HB LYS 29 13.721 -5.844 9.008 216 HG2 LYS 29 1HG LYS 29 15.755 -6.712 9.248 217 HG3 LYS 29 2HG LYS 29 15.434 -7.998 8.082 218 HD2 LYS 29 1HD LYS 29 15.646 -5.985 6.369 219 HD3 LYS 29 2HD LYS 29 16.623 -5.304 7.671 220 HE2 LYS 29 1HE LYS 29 18.102 -7.185 7.631 221 HE3 LYS 29 2HE LYS 29 17.051 -8.055 6.516 222 HZ1 LYS 29 3HZ LYS 29 18.582 -7.234 5.071 223 HZ2 LYS 29 1HZ LYS 29 18.900 -5.848 5.988 224 HZ3 LYS 29 2HZ LYS 29 17.494 -5.939 5.053 225 H SER 30 H SER 30 11.811 -7.341 10.429 226 HA SER 30 HA SER 30 13.536 -9.077 11.939 227 HB2 SER 30 1HB SER 30 11.207 -7.308 12.564 228 HB3 SER 30 2HB SER 30 11.658 -8.555 13.727 229 HG SER 30 HG SER 30 12.708 -6.503 14.058 230 H LYS 31 H LYS 31 10.191 -9.170 10.791 231 HA LYS 31 HA LYS 31 9.586 -11.679 12.011 232 HB2 LYS 31 1HB LYS 31 8.239 -10.065 9.849 233 HB3 LYS 31 2HB LYS 31 7.612 -11.612 10.404 234 HG2 LYS 31 1HG LYS 31 8.122 -9.309 12.263 235 HG3 LYS 31 2HG LYS 31 6.585 -9.548 11.428 236 HD2 LYS 31 1HD LYS 31 6.449 -11.811 12.446 237 HD3 LYS 31 2HD LYS 31 7.912 -11.446 13.363 238 HE2 LYS 31 1HE LYS 31 6.703 -10.417 14.915 239 HE3 LYS 31 2HE LYS 31 6.065 -9.305 13.705 240 HZ1 LYS 31 3HZ LYS 31 4.212 -10.358 14.648 241 HZ2 LYS 31 1HZ LYS 31 4.927 -11.891 14.587 242 HZ3 LYS 31 2HZ LYS 31 4.431 -11.131 13.159 243 H ASN 32 H ASN 32 11.319 -10.769 9.230 244 HA ASN 32 HA ASN 32 12.349 -11.961 7.590 245 HB2 ASN 32 1HB ASN 32 12.688 -13.505 9.686 246 HB3 ASN 32 2HB ASN 32 11.534 -14.547 8.861 247 HD21 ASN 32 2HD2 ASN 32 12.443 -16.062 7.697 248 HD22 ASN 32 1HD2 ASN 32 13.955 -15.948 6.868 249 H ILE 33 H ILE 33 9.987 -11.077 6.825 250 HA ILE 33 HA ILE 33 8.571 -13.353 5.611 251 HB ILE 33 HB ILE 33 7.642 -10.503 5.985 252 HG12 ILE 33 1HG1 ILE 33 6.258 -12.818 7.229 253 HG13 ILE 33 2HG1 ILE 33 7.807 -12.352 7.924 254 HG21 ILE 33 1HG2 ILE 33 6.273 -10.959 4.283 255 HG22 ILE 33 2HG2 ILE 33 6.681 -12.674 4.306 256 HG23 ILE 33 3HG2 ILE 33 5.443 -12.048 5.395 257 HD11 ILE 33 3HD1 ILE 33 5.330 -10.673 7.663 258 HD12 ILE 33 1HD1 ILE 33 6.105 -11.242 9.141 259 HD13 ILE 33 2HD1 ILE 33 6.902 -10.030 8.138 260 H ASN 34 H ASN 34 8.410 -13.558 3.437 261 HA ASN 34 HA ASN 34 10.215 -12.020 1.814 262 HB2 ASN 34 1HB ASN 34 8.217 -14.121 0.948 263 HB3 ASN 34 2HB ASN 34 9.595 -13.535 0.021 264 HD21 ASN 34 2HD2 ASN 34 9.352 -16.177 0.397 265 HD22 ASN 34 1HD2 ASN 34 10.536 -16.750 1.516 266 H ALA 35 H ALA 35 9.250 -9.923 2.028 267 HA ALA 35 HA ALA 35 7.256 -9.435 -0.023 268 HB1 ALA 35 3HB ALA 35 5.520 -8.977 1.284 269 HB2 ALA 35 1HB ALA 35 6.437 -9.636 2.639 270 HB3 ALA 35 2HB ALA 35 6.491 -7.907 2.295 271 H THR 36 H THR 36 6.938 -7.057 -0.370 272 HA THR 36 HA THR 36 9.097 -5.366 0.609 273 HB THR 36 HB THR 36 10.064 -6.418 -1.391 274 HG1 THR 36 HG1 THR 36 9.379 -3.726 -2.001 275 HG21 THR 36 3HG2 THR 36 8.147 -6.961 -2.693 276 HG22 THR 36 1HG2 THR 36 9.071 -5.781 -3.621 277 HG23 THR 36 2HG2 THR 36 7.624 -5.278 -2.746 278 H ILE 37 H ILE 37 8.720 -3.135 0.329 279 HA ILE 37 HA ILE 37 6.146 -2.353 -0.824 280 HB ILE 37 HB ILE 37 5.790 -2.740 1.609 281 HG12 ILE 37 1HG1 ILE 37 5.600 0.203 0.982 282 HG13 ILE 37 2HG1 ILE 37 4.582 -0.987 0.179 283 HG21 ILE 37 1HG2 ILE 37 6.787 -1.229 3.228 284 HG22 ILE 37 2HG2 ILE 37 8.040 -2.113 2.361 285 HG23 ILE 37 3HG2 ILE 37 7.701 -0.433 1.949 286 HD11 ILE 37 3HD1 ILE 37 4.469 -1.423 2.990 287 HD12 ILE 37 1HD1 ILE 37 4.165 0.280 2.654 288 HD13 ILE 37 2HD1 ILE 37 3.178 -0.960 1.881 289 H GLU 38 H GLU 38 6.024 -0.194 -1.488 290 HA GLU 38 HA GLU 38 8.226 1.609 -1.027 291 HB2 GLU 38 1HB GLU 38 8.997 0.086 -2.888 292 HB3 GLU 38 2HB GLU 38 7.685 0.732 -3.865 293 HG2 GLU 38 1HG GLU 38 8.710 2.725 -4.180 294 HG3 GLU 38 2HG GLU 38 9.507 2.692 -2.609 295 H ALA 39 H ALA 39 7.850 3.738 -1.961 296 HA ALA 39 HA ALA 39 4.988 4.220 -2.483 297 HB1 ALA 39 3HB ALA 39 5.945 5.052 -0.280 298 HB2 ALA 39 1HB ALA 39 6.848 6.226 -1.239 299 HB3 ALA 39 2HB ALA 39 5.084 6.232 -1.268 300 H ILE 40 H ILE 40 4.418 5.665 -4.086 301 HA ILE 40 HA ILE 40 6.494 7.055 -5.571 302 HB ILE 40 HB ILE 40 5.350 6.095 -7.733 303 HG12 ILE 40 1HG1 ILE 40 4.744 3.724 -7.490 304 HG13 ILE 40 2HG1 ILE 40 4.978 3.839 -5.750 305 HG21 ILE 40 1HG2 ILE 40 7.120 4.019 -6.767 306 HG22 ILE 40 2HG2 ILE 40 7.362 5.199 -8.054 307 HG23 ILE 40 3HG2 ILE 40 7.726 5.630 -6.383 308 HD11 ILE 40 3HD1 ILE 40 2.601 3.927 -6.571 309 HD12 ILE 40 1HD1 ILE 40 3.098 5.233 -5.495 310 HD13 ILE 40 2HD1 ILE 40 2.981 5.517 -7.232 311 H ALA 41 H ALA 41 5.367 8.181 -7.559 312 HA ALA 41 HA ALA 41 3.284 9.814 -6.448 313 HB1 ALA 41 3HB ALA 41 3.453 10.620 -9.030 314 HB2 ALA 41 1HB ALA 41 4.501 11.196 -7.733 315 HB3 ALA 41 2HB ALA 41 5.044 9.897 -8.796 316 H GLU 42 H GLU 42 1.366 10.388 -7.910 317 HA GLU 42 HA GLU 42 -0.206 8.048 -8.248 318 HB2 GLU 42 1HB GLU 42 -1.940 9.595 -9.083 319 HB3 GLU 42 2HB GLU 42 -1.234 10.137 -7.568 320 HG2 GLU 42 1HG GLU 42 0.350 11.422 -9.331 321 HG3 GLU 42 2HG GLU 42 -1.162 11.364 -10.233 322 H THR 43 H THR 43 1.431 10.233 -10.481 323 HA THR 43 HA THR 43 0.367 9.143 -12.863 324 HB THR 43 HB THR 43 1.463 11.356 -12.771 325 HG1 THR 43 HG1 THR 43 2.718 9.518 -14.556 326 HG21 THR 43 3HG2 THR 43 4.181 10.355 -13.044 327 HG22 THR 43 1HG2 THR 43 3.496 10.016 -11.456 328 HG23 THR 43 2HG2 THR 43 3.559 11.674 -12.053 329 H ARG 44 H ARG 44 2.898 8.129 -10.730 330 HA ARG 44 HA ARG 44 3.988 6.264 -12.692 331 HB2 ARG 44 1HB ARG 44 4.837 6.677 -9.822 332 HB3 ARG 44 2HB ARG 44 5.724 5.823 -11.077 333 HG2 ARG 44 1HG ARG 44 6.174 7.842 -12.248 334 HG3 ARG 44 2HG ARG 44 5.068 8.753 -11.218 335 HD2 ARG 44 1HD ARG 44 6.510 8.673 -9.391 336 HD3 ARG 44 2HD ARG 44 7.414 7.308 -10.046 337 HE ARG 44 HE ARG 44 7.679 9.553 -11.739 338 HH11 ARG 44 1HH1 ARG 44 8.720 8.327 -8.651 339 HH12 ARG 44 2HH1 ARG 44 10.209 9.212 -8.655 340 HH21 ARG 44 1HH2 ARG 44 9.636 10.725 -11.755 341 HH22 ARG 44 2HH2 ARG 44 10.729 10.577 -10.420 342 H LEU 45 H LEU 45 1.785 6.358 -10.061 343 HA LEU 45 HA LEU 45 1.891 3.812 -9.010 344 HB2 LEU 45 1HB LEU 45 0.423 5.320 -7.993 345 HB3 LEU 45 2HB LEU 45 -0.390 5.690 -9.512 346 HG LEU 45 HG LEU 45 -0.624 2.910 -8.519 347 HD11 LEU 45 1HD1 LEU 45 -1.528 5.274 -7.000 348 HD12 LEU 45 2HD1 LEU 45 -1.153 3.641 -6.449 349 HD13 LEU 45 3HD1 LEU 45 -2.705 3.979 -7.216 350 HD21 LEU 45 3HD2 LEU 45 -3.100 3.961 -9.179 351 HD22 LEU 45 1HD2 LEU 45 -2.059 2.987 -10.218 352 HD23 LEU 45 2HD2 LEU 45 -1.985 4.748 -10.298 353 H SER 46 H SER 46 -0.103 4.877 -11.768 354 HA SER 46 HA SER 46 -0.977 2.255 -12.422 355 HB2 SER 46 1HB SER 46 -2.441 3.772 -13.313 356 HB3 SER 46 2HB SER 46 -1.174 4.952 -13.657 357 HG SER 46 HG SER 46 -2.010 4.037 -15.572 358 H GLU 47 H GLU 47 1.972 3.812 -12.849 359 HA GLU 47 HA GLU 47 2.686 2.271 -15.230 360 HB2 GLU 47 1HB GLU 47 3.502 4.789 -14.141 361 HB3 GLU 47 2HB GLU 47 4.908 3.742 -14.259 362 HG2 GLU 47 1HG GLU 47 4.203 3.296 -16.648 363 HG3 GLU 47 2HG GLU 47 3.068 4.631 -16.456 364 H VAL 48 H VAL 48 2.754 1.957 -11.906 365 HA VAL 48 HA VAL 48 5.032 0.090 -12.021 366 HB VAL 48 HB VAL 48 5.308 0.392 -9.620 367 HG11 VAL 48 1HG1 VAL 48 5.408 3.175 -10.043 368 HG12 VAL 48 2HG1 VAL 48 6.720 2.004 -10.204 369 HG13 VAL 48 3HG1 VAL 48 5.723 2.413 -11.602 370 HG21 VAL 48 3HG2 VAL 48 2.936 0.850 -9.102 371 HG22 VAL 48 1HG2 VAL 48 4.033 2.020 -8.369 372 HG23 VAL 48 2HG2 VAL 48 3.114 2.455 -9.812 373 H VAL 49 H VAL 49 1.676 0.496 -11.298 374 HA VAL 49 HA VAL 49 1.111 -1.638 -9.645 375 HB VAL 49 HB VAL 49 -1.113 -1.752 -10.858 376 HG11 VAL 49 1HG1 VAL 49 0.003 0.257 -9.193 377 HG12 VAL 49 2HG1 VAL 49 -1.092 1.038 -10.335 378 HG13 VAL 49 3HG1 VAL 49 -1.675 -0.271 -9.306 379 HG21 VAL 49 3HG2 VAL 49 -1.597 -0.012 -12.489 380 HG22 VAL 49 1HG2 VAL 49 0.072 0.553 -12.404 381 HG23 VAL 49 2HG2 VAL 49 -0.286 -1.045 -13.060 382 H ASP 50 H ASP 50 1.946 -1.648 -13.031 383 HA ASP 50 HA ASP 50 1.034 -4.143 -13.821 384 HB2 ASP 50 1HB ASP 50 2.424 -2.201 -15.050 385 HB3 ASP 50 2HB ASP 50 3.734 -3.343 -14.762 386 H ARG 51 H ARG 51 3.677 -3.306 -11.734 387 HA ARG 51 HA ARG 51 4.566 -6.108 -11.682 388 HB2 ARG 51 1HB ARG 51 5.948 -3.627 -10.643 389 HB3 ARG 51 2HB ARG 51 6.600 -5.259 -10.585 390 HG2 ARG 51 1HG ARG 51 5.868 -3.880 -13.152 391 HG3 ARG 51 2HG ARG 51 7.474 -3.789 -12.426 392 HD2 ARG 51 1HD ARG 51 7.199 -6.421 -12.383 393 HD3 ARG 51 2HD ARG 51 6.088 -6.084 -13.710 394 HE ARG 51 HE ARG 51 8.944 -5.931 -13.773 395 HH11 ARG 51 1HH1 ARG 51 6.013 -4.645 -15.144 396 HH12 ARG 51 2HH1 ARG 51 6.760 -4.181 -16.636 397 HH21 ARG 51 1HH2 ARG 51 9.939 -5.325 -15.734 398 HH22 ARG 51 2HH2 ARG 51 8.993 -4.569 -16.972 399 H PHE 52 H PHE 52 3.662 -3.399 -9.581 400 HA PHE 52 HA PHE 52 3.897 -4.694 -7.123 401 HB2 PHE 52 1HB PHE 52 2.248 -2.390 -8.100 402 HB3 PHE 52 2HB PHE 52 1.997 -3.015 -6.473 403 HD1 PHE 52 HD1 PHE 52 4.108 -3.220 -4.988 404 HD2 PHE 52 HD2 PHE 52 3.877 -0.801 -8.481 405 HE1 PHE 52 HE1 PHE 52 6.004 -1.877 -4.178 406 HE2 PHE 52 HE2 PHE 52 5.773 0.546 -7.679 407 HZ PHE 52 HZ PHE 52 6.840 0.008 -5.524 408 H ASP 53 H ASP 53 1.714 -4.866 -5.715 409 HA ASP 53 HA ASP 53 -0.133 -6.612 -7.204 410 HB2 ASP 53 1HB ASP 53 1.049 -7.072 -4.458 411 HB3 ASP 53 2HB ASP 53 -0.291 -8.006 -5.122 412 H VAL 54 H VAL 54 0.235 -4.966 -4.058 413 HA VAL 54 HA VAL 54 -2.630 -4.299 -4.170 414 HB VAL 54 HB VAL 54 -2.351 -3.837 -1.693 415 HG11 VAL 54 1HG1 VAL 54 -1.832 -6.671 -2.584 416 HG12 VAL 54 2HG1 VAL 54 -2.599 -6.158 -1.079 417 HG13 VAL 54 3HG1 VAL 54 -3.404 -5.873 -2.624 418 HG21 VAL 54 3HG2 VAL 54 0.105 -3.648 -1.720 419 HG22 VAL 54 1HG2 VAL 54 -0.461 -4.848 -0.558 420 HG23 VAL 54 2HG2 VAL 54 0.220 -5.367 -2.100 421 H VAL 55 H VAL 55 -3.318 -2.204 -3.892 422 HA VAL 55 HA VAL 55 -1.211 -0.142 -3.847 423 HB VAL 55 HB VAL 55 -3.869 0.058 -5.268 424 HG11 VAL 55 1HG1 VAL 55 -1.463 1.868 -5.159 425 HG12 VAL 55 2HG1 VAL 55 -2.776 2.045 -6.324 426 HG13 VAL 55 3HG1 VAL 55 -3.098 2.217 -4.599 427 HG21 VAL 55 3HG2 VAL 55 -1.125 -0.372 -6.448 428 HG22 VAL 55 1HG2 VAL 55 -2.382 -1.602 -6.318 429 HG23 VAL 55 2HG2 VAL 55 -2.635 -0.188 -7.341 430 H LEU 56 H LEU 56 -1.269 0.532 -1.768 431 HA LEU 56 HA LEU 56 -3.872 1.181 -0.577 432 HB2 LEU 56 1HB LEU 56 -1.197 1.095 0.796 433 HB3 LEU 56 2HB LEU 56 -2.790 1.144 1.549 434 HG LEU 56 HG LEU 56 -1.403 -1.158 0.220 435 HD11 LEU 56 1HD1 LEU 56 -1.519 -0.427 2.802 436 HD12 LEU 56 2HD1 LEU 56 -1.405 -2.104 2.267 437 HD13 LEU 56 3HD1 LEU 56 -2.972 -1.422 2.702 438 HD21 LEU 56 3HD2 LEU 56 -3.808 -2.201 0.832 439 HD22 LEU 56 1HD2 LEU 56 -3.373 -1.621 -0.776 440 HD23 LEU 56 2HD2 LEU 56 -4.294 -0.585 0.316 441 H LEU 57 H LEU 57 -4.469 3.226 -0.187 442 HA LEU 57 HA LEU 57 -2.531 5.346 -0.814 443 HB2 LEU 57 1HB LEU 57 -4.412 5.437 -2.263 444 HB3 LEU 57 2HB LEU 57 -5.536 5.265 -0.916 445 HG LEU 57 HG LEU 57 -4.773 7.526 -0.123 446 HD11 LEU 57 1HD1 LEU 57 -3.671 7.891 -2.886 447 HD12 LEU 57 2HD1 LEU 57 -2.645 7.376 -1.547 448 HD13 LEU 57 3HD1 LEU 57 -3.484 8.924 -1.469 449 HD21 LEU 57 3HD2 LEU 57 -6.806 7.781 -1.068 450 HD22 LEU 57 1HD2 LEU 57 -6.349 6.928 -2.543 451 HD23 LEU 57 2HD2 LEU 57 -5.882 8.614 -2.319 452 H ALA 58 H ALA 58 -2.149 7.006 0.596 453 HA ALA 58 HA ALA 58 -2.528 6.523 3.351 454 HB1 ALA 58 3HB ALA 58 -1.221 8.532 1.699 455 HB2 ALA 58 1HB ALA 58 -1.903 9.197 3.184 456 HB3 ALA 58 2HB ALA 58 -0.747 7.866 3.261 457 HA PRO 59 HA PRO 59 -6.384 8.379 4.320 458 HB2 PRO 59 1HB PRO 59 -5.859 9.623 6.675 459 HB3 PRO 59 2HB PRO 59 -5.970 7.866 6.521 460 HG2 PRO 59 1HG PRO 59 -3.538 9.609 6.606 461 HG3 PRO 59 2HG PRO 59 -3.832 8.059 7.416 462 HD2 PRO 59 1HD PRO 59 -2.372 8.262 5.145 463 HD3 PRO 59 2HD PRO 59 -3.359 6.835 5.521 464 H GLN 60 H GLN 60 -3.608 10.358 3.877 465 HA GLN 60 HA GLN 60 -5.108 12.846 4.024 466 HB2 GLN 60 1HB GLN 60 -2.246 12.092 3.844 467 HB3 GLN 60 2HB GLN 60 -2.703 13.619 3.102 468 HG2 GLN 60 1HG GLN 60 -3.849 14.129 5.341 469 HG3 GLN 60 2HG GLN 60 -2.882 12.798 5.973 470 HE21 GLN 60 2HE2 GLN 60 -0.517 12.947 5.482 471 HE22 GLN 60 1HE2 GLN 60 0.216 14.507 5.601 472 H SER 61 H SER 61 -6.538 12.786 2.320 473 HA SER 61 HA SER 61 -5.551 13.585 -0.214 474 HB2 SER 61 1HB SER 61 -6.340 10.723 0.152 475 HB3 SER 61 2HB SER 61 -6.740 11.526 -1.367 476 HG SER 61 HG SER 61 -4.412 12.162 -1.329 477 H ARG 62 H ARG 62 -7.008 15.017 -0.845 478 HA ARG 62 HA ARG 62 -9.755 14.805 0.104 479 HB2 ARG 62 1HB ARG 62 -10.007 17.094 -0.710 480 HB3 ARG 62 2HB ARG 62 -8.594 16.954 0.326 481 HG2 ARG 62 1HG ARG 62 -7.292 16.642 -1.883 482 HG3 ARG 62 2HG ARG 62 -8.731 17.337 -2.633 483 HD2 ARG 62 1HD ARG 62 -8.224 19.010 -0.489 484 HD3 ARG 62 2HD ARG 62 -6.619 18.621 -1.107 485 HE ARG 62 HE ARG 62 -8.540 20.319 -2.324 486 HH11 ARG 62 1HH1 ARG 62 -6.055 17.990 -3.046 487 HH12 ARG 62 2HH1 ARG 62 -5.706 18.653 -4.609 488 HH21 ARG 62 1HH2 ARG 62 -8.089 21.201 -4.378 489 HH22 ARG 62 2HH2 ARG 62 -6.863 20.480 -5.364 490 H PHE 63 H PHE 63 -7.935 14.833 -2.913 491 HA PHE 63 HA PHE 63 -10.409 14.109 -4.339 492 HB2 PHE 63 1HB PHE 63 -8.807 16.257 -4.874 493 HB3 PHE 63 2HB PHE 63 -8.141 15.047 -5.965 494 HD1 PHE 63 HD2 PHE 63 -9.847 13.783 -7.448 495 HD2 PHE 63 HD1 PHE 63 -10.655 17.483 -5.509 496 HE1 PHE 63 HE2 PHE 63 -11.672 14.216 -9.042 497 HE2 PHE 63 HE1 PHE 63 -12.482 17.922 -7.098 498 HZ PHE 63 HZ PHE 63 -12.991 16.287 -8.868 499 H ASN 64 H ASN 64 -7.102 13.297 -3.663 500 HA ASN 64 HA ASN 64 -6.497 11.487 -5.655 501 HB2 ASN 64 1HB ASN 64 -5.487 12.142 -3.063 502 HB3 ASN 64 2HB ASN 64 -5.553 10.388 -3.208 503 HD21 ASN 64 2HD2 ASN 64 -3.465 9.895 -3.473 504 HD22 ASN 64 1HD2 ASN 64 -2.469 10.478 -4.759 505 H LYS 65 H LYS 65 -8.125 10.813 -2.560 506 HA LYS 65 HA LYS 65 -8.537 8.100 -2.856 507 HB2 LYS 65 1HB LYS 65 -10.557 8.445 -1.395 508 HB3 LYS 65 2HB LYS 65 -9.065 9.140 -0.774 509 HG2 LYS 65 1HG LYS 65 -9.800 11.339 -1.713 510 HG3 LYS 65 2HG LYS 65 -11.355 10.589 -2.078 511 HD2 LYS 65 1HD LYS 65 -10.448 10.144 0.666 512 HD3 LYS 65 2HD LYS 65 -10.703 11.845 0.271 513 HE2 LYS 65 1HE LYS 65 -12.926 10.832 -0.803 514 HE3 LYS 65 2HE LYS 65 -12.647 9.614 0.440 515 HZ1 LYS 65 3HZ LYS 65 -14.060 11.649 1.023 516 HZ2 LYS 65 1HZ LYS 65 -12.591 12.486 1.108 517 HZ3 LYS 65 2HZ LYS 65 -12.872 11.165 2.126 518 H LYS 66 H LYS 66 -10.627 10.754 -3.959 519 HA LYS 66 HA LYS 66 -12.683 9.212 -5.037 520 HB2 LYS 66 1HB LYS 66 -12.702 11.700 -4.695 521 HB3 LYS 66 2HB LYS 66 -11.691 11.850 -6.126 522 HG2 LYS 66 1HG LYS 66 -13.915 12.282 -6.800 523 HG3 LYS 66 2HG LYS 66 -13.500 10.678 -7.409 524 HD2 LYS 66 1HD LYS 66 -14.905 9.609 -5.942 525 HD3 LYS 66 2HD LYS 66 -14.806 10.899 -4.740 526 HE2 LYS 66 1HE LYS 66 -16.168 12.334 -6.201 527 HE3 LYS 66 2HE LYS 66 -16.292 11.015 -7.363 528 HZ1 LYS 66 3HZ LYS 66 -17.536 11.273 -4.714 529 HZ2 LYS 66 1HZ LYS 66 -17.216 9.730 -5.327 530 HZ3 LYS 66 2HZ LYS 66 -18.227 10.786 -6.179 531 H ARG 67 H ARG 67 -9.929 10.682 -6.769 532 HA ARG 67 HA ARG 67 -10.405 9.560 -9.258 533 HB2 ARG 67 1HB ARG 67 -8.038 10.672 -7.866 534 HB3 ARG 67 2HB ARG 67 -7.712 9.665 -9.269 535 HG2 ARG 67 1HG ARG 67 -9.308 11.119 -10.554 536 HG3 ARG 67 2HG ARG 67 -9.322 12.199 -9.158 537 HD2 ARG 67 1HD ARG 67 -7.611 13.191 -10.239 538 HD3 ARG 67 2HD ARG 67 -6.667 11.897 -9.503 539 HE ARG 67 HE ARG 67 -6.288 11.076 -11.593 540 HH11 ARG 67 1HH1 ARG 67 -9.140 13.070 -11.691 541 HH12 ARG 67 2HH1 ARG 67 -9.333 12.937 -13.408 542 HH21 ARG 67 1HH2 ARG 67 -6.532 10.892 -13.854 543 HH22 ARG 67 2HH2 ARG 67 -7.850 11.697 -14.636 544 H LEU 68 H LEU 68 -8.028 8.371 -6.873 545 HA LEU 68 HA LEU 68 -7.356 6.009 -8.120 546 HB2 LEU 68 1HB LEU 68 -7.484 6.803 -5.237 547 HB3 LEU 68 2HB LEU 68 -7.014 5.168 -5.696 548 HG LEU 68 HG LEU 68 -5.531 7.302 -7.068 549 HD11 LEU 68 1HD1 LEU 68 -4.282 8.082 -5.262 550 HD12 LEU 68 2HD1 LEU 68 -4.879 6.823 -4.181 551 HD13 LEU 68 3HD1 LEU 68 -5.946 8.137 -4.677 552 HD21 LEU 68 3HD2 LEU 68 -4.003 5.384 -5.560 553 HD22 LEU 68 1HD2 LEU 68 -4.089 5.629 -7.304 554 HD23 LEU 68 2HD2 LEU 68 -5.258 4.579 -6.504 555 H GLU 69 H GLU 69 -10.195 6.757 -6.215 556 HA GLU 69 HA GLU 69 -11.090 4.077 -5.894 557 HB2 GLU 69 1HB GLU 69 -12.269 6.785 -5.508 558 HB3 GLU 69 2HB GLU 69 -13.372 5.422 -5.629 559 HG2 GLU 69 1HG GLU 69 -11.062 5.261 -3.758 560 HG3 GLU 69 2HG GLU 69 -12.475 6.214 -3.311 561 H GLU 70 H GLU 70 -12.268 6.698 -8.010 562 HA GLU 70 HA GLU 70 -14.029 5.110 -9.502 563 HB2 GLU 70 1HB GLU 70 -14.109 6.928 -11.079 564 HB3 GLU 70 2HB GLU 70 -14.032 7.598 -9.456 565 HG2 GLU 70 1HG GLU 70 -11.743 8.178 -9.715 566 HG3 GLU 70 2HG GLU 70 -11.626 7.281 -11.227 567 H ILE 71 H ILE 71 -10.622 5.283 -9.535 568 HA ILE 71 HA ILE 71 -10.391 4.205 -12.235 569 HB ILE 71 HB ILE 71 -8.250 4.876 -10.213 570 HG12 ILE 71 1HG1 ILE 71 -8.719 6.338 -12.785 571 HG13 ILE 71 2HG1 ILE 71 -9.715 6.712 -11.384 572 HG21 ILE 71 1HG2 ILE 71 -7.134 4.798 -12.755 573 HG22 ILE 71 2HG2 ILE 71 -6.914 3.615 -11.467 574 HG23 ILE 71 3HG2 ILE 71 -8.172 3.375 -12.680 575 HD11 ILE 71 3HD1 ILE 71 -8.133 8.095 -10.709 576 HD12 ILE 71 1HD1 ILE 71 -7.074 6.706 -10.465 577 HD13 ILE 71 2HD1 ILE 71 -7.059 7.567 -12.004 578 H THR 72 H THR 72 -9.998 3.226 -8.883 579 HA THR 72 HA THR 72 -8.810 0.704 -9.406 580 HB THR 72 HB THR 72 -9.764 0.166 -7.055 581 HG1 THR 72 HG1 THR 72 -11.212 1.651 -6.537 582 HG21 THR 72 3HG2 THR 72 -7.555 0.585 -6.847 583 HG22 THR 72 1HG2 THR 72 -8.102 2.122 -6.179 584 HG23 THR 72 2HG2 THR 72 -7.624 2.016 -7.874 585 H LYS 73 H LYS 73 -12.144 1.795 -9.051 586 HA LYS 73 HA LYS 73 -13.489 -0.594 -8.830 587 HB2 LYS 73 1HB LYS 73 -14.118 2.098 -9.713 588 HB3 LYS 73 2HB LYS 73 -15.037 0.898 -10.612 589 HG2 LYS 73 1HG LYS 73 -16.467 0.875 -8.920 590 HG3 LYS 73 2HG LYS 73 -15.218 0.065 -7.971 591 HD2 LYS 73 1HD LYS 73 -14.602 1.997 -6.884 592 HD3 LYS 73 2HD LYS 73 -15.163 3.039 -8.194 593 HE2 LYS 73 1HE LYS 73 -17.307 1.491 -6.973 594 HE3 LYS 73 2HE LYS 73 -16.486 2.548 -5.825 595 HZ1 LYS 73 3HZ LYS 73 -18.159 3.227 -8.099 596 HZ2 LYS 73 1HZ LYS 73 -16.796 4.204 -7.877 597 HZ3 LYS 73 2HZ LYS 73 -17.933 4.046 -6.635 598 HA PRO 74 HA PRO 74 -13.598 -1.091 -13.627 599 HB2 PRO 74 1HB PRO 74 -12.081 0.607 -15.104 600 HB3 PRO 74 2HB PRO 74 -13.753 0.959 -14.653 601 HG2 PRO 74 1HG PRO 74 -11.211 1.924 -13.401 602 HG3 PRO 74 2HG PRO 74 -12.693 2.827 -13.765 603 HD2 PRO 74 1HD PRO 74 -12.111 1.921 -11.279 604 HD3 PRO 74 2HD PRO 74 -13.776 2.054 -11.883 605 H LYS 75 H LYS 75 -10.516 0.086 -12.339 606 HA LYS 75 HA LYS 75 -8.838 -1.507 -13.951 607 HB2 LYS 75 1HB LYS 75 -8.074 0.467 -12.659 608 HB3 LYS 75 2HB LYS 75 -8.303 -0.442 -11.171 609 HG2 LYS 75 1HG LYS 75 -5.995 -0.511 -11.678 610 HG3 LYS 75 2HG LYS 75 -6.646 -2.108 -12.049 611 HD2 LYS 75 1HD LYS 75 -6.949 -0.810 -14.432 612 HD3 LYS 75 2HD LYS 75 -5.455 -0.097 -13.818 613 HE2 LYS 75 1HE LYS 75 -4.357 -2.148 -13.762 614 HE3 LYS 75 2HE LYS 75 -5.862 -3.064 -13.779 615 HZ1 LYS 75 3HZ LYS 75 -4.365 -2.786 -15.919 616 HZ2 LYS 75 1HZ LYS 75 -5.293 -1.382 -16.096 617 HZ3 LYS 75 2HZ LYS 75 -6.051 -2.892 -16.015 618 H GLY 76 H GLY 76 -10.747 -2.218 -11.162 619 HA2 GLY 76 1HA GLY 76 -11.049 -4.137 -9.937 620 HA3 GLY 76 2HA GLY 76 -10.548 -4.977 -11.399 621 H ILE 77 H ILE 77 -9.063 -3.075 -8.771 622 HA ILE 77 HA ILE 77 -7.073 -5.215 -8.472 623 HB ILE 77 HB ILE 77 -5.337 -3.451 -8.040 624 HG12 ILE 77 1HG1 ILE 77 -6.513 -1.408 -9.671 625 HG13 ILE 77 2HG1 ILE 77 -7.587 -1.745 -8.318 626 HG21 ILE 77 1HG2 ILE 77 -5.229 -2.835 -10.589 627 HG22 ILE 77 2HG2 ILE 77 -5.001 -4.498 -10.050 628 HG23 ILE 77 3HG2 ILE 77 -6.557 -3.989 -10.702 629 HD11 ILE 77 3HD1 ILE 77 -5.865 -1.256 -6.744 630 HD12 ILE 77 1HD1 ILE 77 -4.658 -1.139 -8.023 631 HD13 ILE 77 2HD1 ILE 77 -5.941 0.067 -7.908 632 HA PRO 78 HA PRO 78 -7.812 -4.876 -4.158 633 HB2 PRO 78 1HB PRO 78 -5.378 -5.536 -3.153 634 HB3 PRO 78 2HB PRO 78 -6.460 -6.716 -3.903 635 HG2 PRO 78 1HG PRO 78 -4.095 -5.302 -5.073 636 HG3 PRO 78 2HG PRO 78 -4.567 -7.005 -5.222 637 HD2 PRO 78 1HD PRO 78 -5.048 -5.184 -7.168 638 HD3 PRO 78 2HD PRO 78 -6.128 -6.560 -6.860 639 H ILE 79 H ILE 79 -8.202 -2.676 -3.846 640 HA ILE 79 HA ILE 79 -5.853 -1.061 -3.099 641 HB ILE 79 HB ILE 79 -7.130 -0.205 -5.062 642 HG12 ILE 79 1HG1 ILE 79 -7.708 2.039 -3.472 643 HG13 ILE 79 2HG1 ILE 79 -6.384 1.213 -2.658 644 HG21 ILE 79 1HG2 ILE 79 -9.320 0.827 -3.418 645 HG22 ILE 79 2HG2 ILE 79 -9.342 0.155 -5.048 646 HG23 ILE 79 3HG2 ILE 79 -9.349 -0.921 -3.650 647 HD11 ILE 79 3HD1 ILE 79 -6.420 2.693 -5.181 648 HD12 ILE 79 1HD1 ILE 79 -5.103 2.412 -4.041 649 HD13 ILE 79 2HD1 ILE 79 -5.525 1.174 -5.225 650 H GLU 80 H GLU 80 -5.767 -0.187 -1.106 651 HA GLU 80 HA GLU 80 -8.182 -0.221 0.559 652 HB2 GLU 80 1HB GLU 80 -5.954 -1.976 0.860 653 HB3 GLU 80 2HB GLU 80 -5.961 -0.861 2.219 654 HG2 GLU 80 1HG GLU 80 -8.130 -2.754 1.368 655 HG3 GLU 80 2HG GLU 80 -7.211 -2.752 2.873 656 H ILE 81 H ILE 81 -7.704 0.955 2.707 657 HA ILE 81 HA ILE 81 -5.930 3.252 2.198 658 HB ILE 81 HB ILE 81 -8.605 3.450 3.578 659 HG12 ILE 81 1HG1 ILE 81 -8.882 2.860 1.191 660 HG13 ILE 81 2HG1 ILE 81 -9.456 4.487 1.544 661 HG21 ILE 81 1HG2 ILE 81 -6.359 5.261 3.128 662 HG22 ILE 81 2HG2 ILE 81 -7.919 5.932 2.653 663 HG23 ILE 81 3HG2 ILE 81 -7.674 5.351 4.301 664 HD11 ILE 81 3HD1 ILE 81 -8.084 4.101 -0.584 665 HD12 ILE 81 1HD1 ILE 81 -7.679 5.482 0.434 666 HD13 ILE 81 2HD1 ILE 81 -6.694 4.021 0.499 667 H ILE 82 H ILE 82 -4.560 3.725 3.795 668 HA ILE 82 HA ILE 82 -4.432 2.082 6.120 669 HB ILE 82 HB ILE 82 -2.906 4.641 5.650 670 HG12 ILE 82 1HG1 ILE 82 -2.193 1.835 4.767 671 HG13 ILE 82 2HG1 ILE 82 -2.703 3.139 3.699 672 HG21 ILE 82 1HG2 ILE 82 -2.118 2.176 7.191 673 HG22 ILE 82 2HG2 ILE 82 -1.282 3.727 7.141 674 HG23 ILE 82 3HG2 ILE 82 -2.858 3.600 7.923 675 HD11 ILE 82 3HD1 ILE 82 -0.256 3.268 5.439 676 HD12 ILE 82 1HD1 ILE 82 -0.249 2.725 3.760 677 HD13 ILE 82 2HD1 ILE 82 -0.725 4.378 4.151 678 H ASN 83 H ASN 83 -5.227 2.407 8.101 679 HA ASN 83 HA ASN 83 -7.198 4.249 8.674 680 HB2 ASN 83 1HB ASN 83 -5.462 2.469 10.296 681 HB3 ASN 83 2HB ASN 83 -6.285 3.764 11.159 682 HD21 ASN 83 2HD2 ASN 83 -7.089 1.481 8.559 683 HD22 ASN 83 1HD2 ASN 83 -8.586 0.963 9.248 684 H THR 84 H THR 84 -7.271 6.308 9.364 685 HA THR 84 HA THR 84 -5.178 8.069 9.018 686 HB THR 84 HB THR 84 -7.096 8.820 11.142 687 HG1 THR 84 HG1 THR 84 -8.735 9.032 9.390 688 HG21 THR 84 3HG2 THR 84 -5.517 10.076 9.150 689 HG22 THR 84 1HG2 THR 84 -6.538 10.833 10.371 690 HG23 THR 84 2HG2 THR 84 -7.208 10.427 8.791 691 H ILE 85 H ILE 85 -6.211 6.438 11.986 692 HA ILE 85 HA ILE 85 -4.420 7.752 13.728 693 HB ILE 85 HB ILE 85 -5.482 4.949 14.073 694 HG12 ILE 85 1HG1 ILE 85 -7.097 6.667 15.539 695 HG13 ILE 85 2HG1 ILE 85 -6.874 7.512 14.011 696 HG21 ILE 85 1HG2 ILE 85 -3.690 6.289 15.598 697 HG22 ILE 85 2HG2 ILE 85 -5.203 6.762 16.367 698 HG23 ILE 85 3HG2 ILE 85 -4.791 5.055 16.210 699 HD11 ILE 85 3HD1 ILE 85 -8.338 6.191 13.021 700 HD12 ILE 85 1HD1 ILE 85 -7.442 4.755 13.513 701 HD13 ILE 85 2HD1 ILE 85 -8.663 5.440 14.584 702 H ASP 86 H ASP 86 -4.176 4.715 11.916 703 HA ASP 86 HA ASP 86 -1.685 3.901 12.938 704 HB2 ASP 86 1HB ASP 86 -3.175 3.276 10.400 705 HB3 ASP 86 2HB ASP 86 -1.573 2.611 10.704 706 H TYR 87 H TYR 87 -2.330 5.237 9.692 707 HA TYR 87 HA TYR 87 0.335 5.757 9.052 708 HB2 TYR 87 1HB TYR 87 -1.514 5.718 7.407 709 HB3 TYR 87 2HB TYR 87 -2.116 7.234 8.067 710 HD1 TYR 87 HD2 TYR 87 0.659 5.673 6.202 711 HD2 TYR 87 HD1 TYR 87 -1.129 9.320 7.468 712 HE1 TYR 87 HE2 TYR 87 2.117 6.917 4.660 713 HE2 TYR 87 HE1 TYR 87 0.322 10.573 5.928 714 HH TYR 87 HH TYR 87 2.767 10.018 4.842 715 H GLY 88 H GLY 88 -1.972 7.609 10.905 716 HA2 GLY 88 1HA GLY 88 -0.636 10.102 10.839 717 HA3 GLY 88 2HA GLY 88 -1.793 9.588 12.057 718 H THR 89 H THR 89 -0.620 7.541 13.317 719 HA THR 89 HA THR 89 1.659 8.839 14.606 720 HB THR 89 HB THR 89 -0.245 8.079 16.011 721 HG1 THR 89 HG1 THR 89 1.699 8.214 17.071 722 HG21 THR 89 3HG2 THR 89 0.078 5.690 14.496 723 HG22 THR 89 1HG2 THR 89 -1.148 6.067 15.705 724 HG23 THR 89 2HG2 THR 89 0.371 5.314 16.193 725 H MET 90 H MET 90 1.636 7.183 12.017 726 HA MET 90 HA MET 90 3.044 5.757 10.944 727 HB2 MET 90 1HB MET 90 4.820 6.011 13.372 728 HB3 MET 90 2HB MET 90 5.303 5.562 11.742 729 HG2 MET 90 1HG MET 90 3.997 8.096 11.667 730 HG3 MET 90 2HG MET 90 5.253 8.121 12.903 731 HE1 MET 90 3HE MET 90 5.533 7.795 8.427 732 HE2 MET 90 1HE MET 90 5.588 6.171 9.115 733 HE3 MET 90 2HE MET 90 4.227 7.233 9.474 734 H ASN 91 H ASN 91 1.966 3.855 10.853 735 HA ASN 91 HA ASN 91 2.532 1.914 12.991 736 HB2 ASN 91 1HB ASN 91 0.071 2.957 12.682 737 HB3 ASN 91 2HB ASN 91 -0.032 1.635 11.522 738 HD21 ASN 91 2HD2 ASN 91 1.515 -0.269 12.767 739 HD22 ASN 91 1HD2 ASN 91 0.741 -0.768 14.228 740 H GLY 92 H GLY 92 4.263 1.162 11.656 741 HA2 GLY 92 1HA GLY 92 4.002 0.331 8.994 742 HA3 GLY 92 2HA GLY 92 5.200 -0.272 10.129 743 H GLU 93 H GLU 93 3.660 -1.555 11.991 744 HA GLU 93 HA GLU 93 3.258 -4.056 10.902 745 HB2 GLU 93 1HB GLU 93 3.458 -3.521 13.337 746 HB3 GLU 93 2HB GLU 93 1.797 -2.946 13.303 747 HG2 GLU 93 1HG GLU 93 1.109 -5.219 12.536 748 HG3 GLU 93 2HG GLU 93 2.767 -5.749 12.812 749 H LYS 94 H LYS 94 0.840 -1.534 11.525 750 HA LYS 94 HA LYS 94 -1.383 -3.017 10.610 751 HB2 LYS 94 1HB LYS 94 -0.900 -0.054 10.903 752 HB3 LYS 94 2HB LYS 94 -2.441 -0.715 10.373 753 HG2 LYS 94 1HG LYS 94 -1.282 -1.780 12.884 754 HG3 LYS 94 2HG LYS 94 -1.945 -0.144 12.907 755 HD2 LYS 94 1HD LYS 94 -3.978 -1.276 11.706 756 HD3 LYS 94 2HD LYS 94 -3.325 -2.749 12.428 757 HE2 LYS 94 1HE LYS 94 -3.273 -1.316 14.607 758 HE3 LYS 94 2HE LYS 94 -4.451 -0.318 13.755 759 HZ1 LYS 94 3HZ LYS 94 -5.633 -2.558 13.356 760 HZ2 LYS 94 1HZ LYS 94 -5.768 -1.822 14.873 761 HZ3 LYS 94 2HZ LYS 94 -4.697 -3.112 14.652 762 H VAL 95 H VAL 95 0.749 -0.682 9.006 763 HA VAL 95 HA VAL 95 -0.546 -0.474 6.565 764 HB VAL 95 HB VAL 95 2.434 -0.479 7.065 765 HG11 VAL 95 1HG1 VAL 95 2.355 1.022 4.977 766 HG12 VAL 95 2HG1 VAL 95 2.223 -0.724 4.756 767 HG13 VAL 95 3HG1 VAL 95 0.779 0.286 4.685 768 HG21 VAL 95 3HG2 VAL 95 0.540 1.257 8.051 769 HG22 VAL 95 1HG2 VAL 95 2.258 1.605 7.852 770 HG23 VAL 95 2HG2 VAL 95 1.111 2.074 6.596 771 H LEU 96 H LEU 96 2.248 -2.596 7.228 772 HA LEU 96 HA LEU 96 2.092 -4.066 4.865 773 HB2 LEU 96 1HB LEU 96 3.363 -5.817 6.147 774 HB3 LEU 96 2HB LEU 96 4.075 -4.205 6.127 775 HG LEU 96 HG LEU 96 2.609 -4.164 8.441 776 HD11 LEU 96 1HD1 LEU 96 3.988 -6.811 8.524 777 HD12 LEU 96 2HD1 LEU 96 2.326 -6.703 7.945 778 HD13 LEU 96 3HD1 LEU 96 2.728 -6.165 9.576 779 HD21 LEU 96 3HD2 LEU 96 4.911 -3.362 8.076 780 HD22 LEU 96 1HD2 LEU 96 5.482 -5.030 8.134 781 HD23 LEU 96 2HD2 LEU 96 4.748 -4.299 9.562 782 H GLN 97 H GLN 97 0.663 -4.718 8.044 783 HA GLN 97 HA GLN 97 -0.421 -7.217 7.552 784 HB2 GLN 97 1HB GLN 97 -1.168 -4.951 9.346 785 HB3 GLN 97 2HB GLN 97 -2.286 -6.298 9.184 786 HG2 GLN 97 1HG GLN 97 0.564 -6.900 9.755 787 HG3 GLN 97 2HG GLN 97 -0.433 -6.245 11.053 788 HE21 GLN 97 2HE2 GLN 97 -0.256 -8.830 8.662 789 HE22 GLN 97 1HE2 GLN 97 -1.142 -9.991 9.585 790 H LEU 98 H LEU 98 -1.897 -4.032 6.988 791 HA LEU 98 HA LEU 98 -4.336 -4.979 5.966 792 HB2 LEU 98 1HB LEU 98 -3.609 -2.602 6.703 793 HB3 LEU 98 2HB LEU 98 -3.079 -2.428 5.031 794 HG LEU 98 HG LEU 98 -5.398 -2.898 4.293 795 HD11 LEU 98 1HD1 LEU 98 -6.789 -2.313 6.686 796 HD12 LEU 98 2HD1 LEU 98 -5.703 -3.664 7.014 797 HD13 LEU 98 3HD1 LEU 98 -6.871 -3.771 5.697 798 HD21 LEU 98 3HD2 LEU 98 -4.582 -0.563 5.910 799 HD22 LEU 98 1HD2 LEU 98 -6.302 -0.711 5.549 800 HD23 LEU 98 2HD2 LEU 98 -5.127 -0.653 4.234 801 H ALA 99 H ALA 99 -1.372 -3.941 4.294 802 HA ALA 99 HA ALA 99 -2.182 -4.243 1.675 803 HB1 ALA 99 3HB ALA 99 0.166 -3.630 2.890 804 HB2 ALA 99 1HB ALA 99 0.538 -5.211 2.203 805 HB3 ALA 99 2HB ALA 99 -0.023 -3.905 1.158 806 H ILE 100 H ILE 100 -0.539 -6.716 3.657 807 HA ILE 100 HA ILE 100 -0.707 -8.799 1.810 808 HB ILE 100 HB ILE 100 -0.737 -9.015 4.823 809 HG12 ILE 100 1HG1 ILE 100 1.628 -9.201 2.954 810 HG13 ILE 100 2HG1 ILE 100 1.169 -7.715 3.778 811 HG21 ILE 100 1HG2 ILE 100 0.605 -11.182 3.632 812 HG22 ILE 100 2HG2 ILE 100 -0.918 -11.204 4.519 813 HG23 ILE 100 3HG2 ILE 100 -0.920 -10.995 2.767 814 HD11 ILE 100 3HD1 ILE 100 1.626 -8.652 5.901 815 HD12 ILE 100 1HD1 ILE 100 1.787 -10.273 5.226 816 HD13 ILE 100 2HD1 ILE 100 2.996 -9.041 4.860 817 H ASN 101 H ASN 101 -2.928 -7.917 4.439 818 HA ASN 101 HA ASN 101 -4.737 -9.991 4.244 819 HB2 ASN 101 1HB ASN 101 -4.652 -7.425 5.476 820 HB3 ASN 101 2HB ASN 101 -6.211 -7.582 4.670 821 HD21 ASN 101 2HD2 ASN 101 -7.533 -7.902 6.351 822 HD22 ASN 101 1HD2 ASN 101 -7.405 -9.212 7.469 823 H ALA 102 H ALA 102 -4.802 -6.897 2.485 824 HA ALA 102 HA ALA 102 -7.094 -7.513 0.945 825 HB1 ALA 102 3HB ALA 102 -5.476 -5.686 -0.485 826 HB2 ALA 102 1HB ALA 102 -6.904 -5.352 0.494 827 HB3 ALA 102 2HB ALA 102 -5.302 -5.321 1.231 828 H PHE 103 H PHE 103 -3.662 -8.066 0.478 829 HA PHE 103 HA PHE 103 -3.669 -8.693 -2.247 830 HB2 PHE 103 1HB PHE 103 -1.599 -8.348 -1.005 831 HB3 PHE 103 2HB PHE 103 -1.914 -9.784 -0.037 832 HD1 PHE 103 HD1 PHE 103 -1.376 -8.688 -3.548 833 HD2 PHE 103 HD2 PHE 103 -1.068 -11.834 -0.698 834 HE1 PHE 103 HE1 PHE 103 -0.165 -10.057 -5.196 835 HE2 PHE 103 HE2 PHE 103 0.144 -13.207 -2.340 836 HZ PHE 103 HZ PHE 103 0.598 -12.319 -4.592 837 H ASN 104 H ASN 104 -3.965 -10.855 0.568 838 HA ASN 104 HA ASN 104 -4.512 -13.144 -1.083 839 HB2 ASN 104 1HB ASN 104 -4.916 -14.293 1.090 840 HB3 ASN 104 2HB ASN 104 -3.357 -13.478 1.019 841 HD21 ASN 104 2HD2 ASN 104 -2.854 -12.516 2.835 842 HD22 ASN 104 1HD2 ASN 104 -3.950 -11.746 3.924 843 H ASN 105 H ASN 105 -6.362 -10.680 0.484 844 HA ASN 105 HA ASN 105 -8.833 -12.040 0.671 845 HB2 ASN 105 1HB ASN 105 -8.440 -9.997 1.925 846 HB3 ASN 105 2HB ASN 105 -8.230 -9.085 0.433 847 HD21 ASN 105 2HD2 ASN 105 -9.883 -7.688 0.594 848 HD22 ASN 105 1HD2 ASN 105 -11.548 -8.145 0.664 849 H LYS 106 H LYS 106 -7.425 -9.966 -1.833 850 HA LYS 106 HA LYS 106 -7.985 -9.591 -4.007 851 HB2 LYS 106 1HB LYS 106 -8.758 -12.439 -3.548 852 HB3 LYS 106 2HB LYS 106 -9.218 -11.679 -5.065 853 HG2 LYS 106 1HG LYS 106 -6.393 -11.632 -4.062 854 HG3 LYS 106 2HG LYS 106 -7.031 -12.972 -5.017 855 HD2 LYS 106 1HD LYS 106 -7.804 -11.024 -6.612 856 HD3 LYS 106 2HD LYS 106 -6.496 -10.151 -5.813 857 HE2 LYS 106 1HE LYS 106 -4.923 -11.893 -6.447 858 HE3 LYS 106 2HE LYS 106 -6.224 -12.820 -7.193 859 HZ1 LYS 106 3HZ LYS 106 -4.760 -11.385 -8.689 860 HZ2 LYS 106 1HZ LYS 106 -5.621 -10.066 -8.070 861 HZ3 LYS 106 2HZ LYS 106 -6.435 -11.290 -8.907 862 H SER 107 H SER 107 -9.555 -8.062 -2.783 863 HA SER 107 HA SER 107 -12.311 -8.643 -2.704 864 HB2 SER 107 1HB SER 107 -11.403 -5.838 -3.169 865 HB3 SER 107 2HB SER 107 -12.598 -6.459 -2.029 866 HG SER 107 HG SER 107 -10.663 -5.761 -0.998 867 H SER 108 H SER 108 -10.272 -7.152 -5.178 868 HA SER 108 HA SER 108 -12.262 -6.332 -6.947 869 HB2 SER 108 1HB SER 108 -10.519 -6.409 -8.683 870 HB3 SER 108 2HB SER 108 -9.902 -5.694 -7.193 871 HG SER 108 HG SER 108 -8.691 -7.440 -6.831 872 H VAL 109 H VAL 109 -13.873 -7.585 -7.634 873 HA VAL 109 HA VAL 109 -13.800 -10.385 -7.844 874 HB VAL 109 HB VAL 109 -15.892 -9.088 -7.644 875 HG11 VAL 109 1HG1 VAL 109 -15.028 -7.384 -9.410 876 HG12 VAL 109 2HG1 VAL 109 -15.773 -8.487 -10.569 877 HG13 VAL 109 3HG1 VAL 109 -16.753 -7.738 -9.308 878 HG21 VAL 109 3HG2 VAL 109 -15.758 -11.440 -8.591 879 HG22 VAL 109 1HG2 VAL 109 -17.218 -10.524 -8.968 880 HG23 VAL 109 2HG2 VAL 109 -15.951 -10.704 -10.181 Start of MODEL 14 1 H1 GLY 1 H GLY 1 10.105 -18.997 -9.769 2 HA2 GLY 1 1HA GLY 1 12.414 -19.086 -8.369 3 HA3 GLY 1 2HA GLY 1 12.591 -17.597 -9.286 4 HA PRO 2 HA PRO 2 10.389 -16.700 -5.275 5 HB2 PRO 2 1HB PRO 2 12.052 -14.694 -4.513 6 HB3 PRO 2 2HB PRO 2 12.354 -16.392 -4.125 7 HG2 PRO 2 1HG PRO 2 13.521 -14.711 -6.310 8 HG3 PRO 2 2HG PRO 2 14.328 -15.873 -5.240 9 HD2 PRO 2 1HD PRO 2 13.623 -16.480 -7.783 10 HD3 PRO 2 2HD PRO 2 13.636 -17.687 -6.482 11 H GLY 3 H GLY 3 8.611 -15.542 -5.667 12 HA2 GLY 3 1HA GLY 3 8.753 -13.236 -7.462 13 HA3 GLY 3 2HA GLY 3 7.286 -14.034 -6.912 14 H SER 4 H SER 4 7.673 -14.016 -4.171 15 HA SER 4 HA SER 4 7.365 -12.717 -2.328 16 HB2 SER 4 1HB SER 4 8.959 -11.135 -1.917 17 HB3 SER 4 2HB SER 4 9.686 -11.826 -3.368 18 HG SER 4 HG SER 4 9.382 -9.993 -4.330 19 H MET 5 H MET 5 6.254 -10.765 -1.531 20 HA MET 5 HA MET 5 4.194 -9.949 -3.441 21 HB2 MET 5 1HB MET 5 4.028 -10.795 -0.834 22 HB3 MET 5 2HB MET 5 3.920 -9.048 -0.662 23 HG2 MET 5 1HG MET 5 2.108 -9.124 -2.424 24 HG3 MET 5 2HG MET 5 2.116 -10.874 -2.215 25 HE1 MET 5 3HE MET 5 1.660 -7.459 -0.713 26 HE2 MET 5 1HE MET 5 0.705 -7.695 0.751 27 HE3 MET 5 2HE MET 5 2.435 -8.032 0.764 28 H ASN 6 H ASN 6 4.218 -8.006 -4.350 29 HA ASN 6 HA ASN 6 6.017 -5.965 -3.261 30 HB2 ASN 6 1HB ASN 6 4.647 -5.989 -5.956 31 HB3 ASN 6 2HB ASN 6 5.966 -4.939 -5.442 32 HD21 ASN 6 2HD2 ASN 6 6.113 -6.447 -7.738 33 HD22 ASN 6 1HD2 ASN 6 7.310 -7.677 -7.537 34 H ILE 7 H ILE 7 5.140 -4.467 -2.008 35 HA ILE 7 HA ILE 7 2.295 -3.832 -2.297 36 HB ILE 7 HB ILE 7 4.229 -3.100 -0.095 37 HG12 ILE 7 1HG1 ILE 7 1.988 -5.133 -0.189 38 HG13 ILE 7 2HG1 ILE 7 3.710 -5.497 -0.164 39 HG21 ILE 7 1HG2 ILE 7 2.235 -2.365 1.132 40 HG22 ILE 7 2HG2 ILE 7 2.486 -1.427 -0.339 41 HG23 ILE 7 3HG2 ILE 7 1.249 -2.683 -0.295 42 HD11 ILE 7 3HD1 ILE 7 1.926 -5.053 2.015 43 HD12 ILE 7 1HD1 ILE 7 3.612 -5.567 2.040 44 HD13 ILE 7 2HD1 ILE 7 3.215 -3.849 2.054 45 H LEU 8 H LEU 8 1.551 -1.842 -2.841 46 HA LEU 8 HA LEU 8 3.574 0.159 -3.595 47 HB2 LEU 8 1HB LEU 8 2.251 -0.780 -5.453 48 HB3 LEU 8 2HB LEU 8 0.781 -0.200 -4.673 49 HG LEU 8 HG LEU 8 1.748 1.153 -6.629 50 HD11 LEU 8 1HD1 LEU 8 1.471 3.199 -4.684 51 HD12 LEU 8 2HD1 LEU 8 0.377 1.884 -4.256 52 HD13 LEU 8 3HD1 LEU 8 0.284 2.623 -5.855 53 HD21 LEU 8 3HD2 LEU 8 3.429 2.548 -4.630 54 HD22 LEU 8 1HD2 LEU 8 3.632 2.391 -6.374 55 HD23 LEU 8 2HD2 LEU 8 4.063 1.050 -5.313 56 H LEU 9 H LEU 9 3.496 2.146 -2.724 57 HA LEU 9 HA LEU 9 1.151 2.831 -1.076 58 HB2 LEU 9 1HB LEU 9 3.102 2.243 0.293 59 HB3 LEU 9 2HB LEU 9 4.040 3.492 -0.522 60 HG LEU 9 HG LEU 9 2.541 5.202 0.429 61 HD11 LEU 9 1HD1 LEU 9 1.378 3.557 2.488 62 HD12 LEU 9 2HD1 LEU 9 0.846 3.040 0.888 63 HD13 LEU 9 3HD1 LEU 9 0.607 4.711 1.399 64 HD21 LEU 9 3HD2 LEU 9 3.193 4.641 2.906 65 HD22 LEU 9 1HD2 LEU 9 4.435 5.016 1.711 66 HD23 LEU 9 2HD2 LEU 9 4.110 3.339 2.146 67 H VAL 10 H VAL 10 0.291 4.821 -1.332 68 HA VAL 10 HA VAL 10 1.744 6.743 -3.024 69 HB VAL 10 HB VAL 10 -1.196 6.067 -3.200 70 HG11 VAL 10 1HG1 VAL 10 0.404 8.180 -4.640 71 HG12 VAL 10 2HG1 VAL 10 -1.260 7.730 -5.018 72 HG13 VAL 10 3HG1 VAL 10 -0.873 8.454 -3.456 73 HG21 VAL 10 3HG2 VAL 10 1.161 5.172 -4.641 74 HG22 VAL 10 1HG2 VAL 10 -0.482 4.530 -4.650 75 HG23 VAL 10 2HG2 VAL 10 -0.053 5.873 -5.710 76 H CYS 11 H CYS 11 2.241 8.362 -1.686 77 HA CYS 11 HA CYS 11 0.131 9.377 0.103 78 HB2 CYS 11 1HB CYS 11 3.106 9.673 0.532 79 HB3 CYS 11 2HB CYS 11 1.818 10.060 1.667 80 HG CYS 11 HG CYS 11 1.374 6.953 0.983 81 H GLY 12 H GLY 12 2.783 10.217 -2.065 82 HA2 GLY 12 1HA GLY 12 2.540 12.046 -3.606 83 HA3 GLY 12 2HA GLY 12 1.536 12.861 -2.415 84 H ALA 13 H ALA 13 3.509 12.065 -0.279 85 HA ALA 13 HA ALA 13 5.889 13.565 -0.977 86 HB1 ALA 13 3HB ALA 13 3.935 15.135 -0.179 87 HB2 ALA 13 1HB ALA 13 4.448 14.589 1.417 88 HB3 ALA 13 2HB ALA 13 5.594 15.405 0.352 89 H GLY 14 H GLY 14 7.122 11.792 -0.448 90 HA2 GLY 14 1HA GLY 14 8.355 11.398 1.832 91 HA3 GLY 14 2HA GLY 14 6.821 10.638 2.230 92 H MET 15 H MET 15 9.786 9.804 1.588 93 HA MET 15 HA MET 15 9.185 7.184 0.778 94 HB2 MET 15 1HB MET 15 10.360 7.248 -1.457 95 HB3 MET 15 2HB MET 15 8.768 7.996 -1.416 96 HG2 MET 15 1HG MET 15 9.818 10.201 -1.235 97 HG3 MET 15 2HG MET 15 11.405 9.440 -1.308 98 HE1 MET 15 3HE MET 15 12.323 10.323 -4.359 99 HE2 MET 15 1HE MET 15 12.645 9.375 -2.906 100 HE3 MET 15 2HE MET 15 12.298 8.560 -4.432 101 H SER 16 H SER 16 11.588 9.760 0.862 102 HA SER 16 HA SER 16 13.868 8.088 0.949 103 HB2 SER 16 1HB SER 16 14.829 10.259 2.128 104 HB3 SER 16 2HB SER 16 14.448 10.253 0.407 105 HG SER 16 HG SER 16 13.231 11.892 0.914 106 H THR 17 H THR 17 13.501 6.451 2.451 107 HA THR 17 HA THR 17 13.411 5.427 4.488 108 HB THR 17 HB THR 17 15.010 6.121 6.087 109 HG1 THR 17 HG1 THR 17 15.397 8.172 6.523 110 HG21 THR 17 3HG2 THR 17 16.387 7.396 3.816 111 HG22 THR 17 1HG2 THR 17 15.697 5.808 3.486 112 HG23 THR 17 2HG2 THR 17 16.861 6.008 4.796 113 H SER 18 H SER 18 11.117 6.896 3.961 114 HA SER 18 HA SER 18 10.355 8.714 5.950 115 HB2 SER 18 1HB SER 18 9.063 7.238 3.813 116 HB3 SER 18 2HB SER 18 8.027 7.336 5.236 117 HG SER 18 HG SER 18 7.644 9.165 4.074 118 H MET 19 H MET 19 8.722 8.347 7.657 119 HA MET 19 HA MET 19 9.597 6.441 9.515 120 HB2 MET 19 1HB MET 19 7.095 8.113 9.362 121 HB3 MET 19 2HB MET 19 7.425 7.040 10.715 122 HG2 MET 19 1HG MET 19 9.070 8.359 11.546 123 HG3 MET 19 2HG MET 19 9.548 8.955 9.959 124 HE1 MET 19 3HE MET 19 8.961 9.911 12.920 125 HE2 MET 19 1HE MET 19 8.422 11.581 12.741 126 HE3 MET 19 2HE MET 19 7.273 10.329 13.211 127 H LEU 20 H LEU 20 6.539 6.538 7.679 128 HA LEU 20 HA LEU 20 5.476 4.130 8.505 129 HB2 LEU 20 1HB LEU 20 5.240 5.750 6.018 130 HB3 LEU 20 2HB LEU 20 4.541 4.132 6.040 131 HG LEU 20 HG LEU 20 2.916 5.939 6.538 132 HD11 LEU 20 1HD1 LEU 20 1.866 4.818 8.391 133 HD12 LEU 20 2HD1 LEU 20 3.394 4.068 8.852 134 HD13 LEU 20 3HD1 LEU 20 2.613 3.618 7.336 135 HD21 LEU 20 3HD2 LEU 20 3.009 7.163 8.576 136 HD22 LEU 20 1HD2 LEU 20 4.570 7.361 7.778 137 HD23 LEU 20 2HD2 LEU 20 4.410 6.247 9.136 138 H VAL 21 H VAL 21 7.250 4.611 5.444 139 HA VAL 21 HA VAL 21 7.508 1.963 4.715 140 HB VAL 21 HB VAL 21 8.136 3.732 3.194 141 HG11 VAL 21 1HG1 VAL 21 10.024 5.145 3.481 142 HG12 VAL 21 2HG1 VAL 21 9.106 5.206 4.987 143 HG13 VAL 21 3HG1 VAL 21 10.574 4.234 4.886 144 HG21 VAL 21 3HG2 VAL 21 10.793 2.666 3.245 145 HG22 VAL 21 1HG2 VAL 21 9.637 1.396 3.649 146 HG23 VAL 21 2HG2 VAL 21 9.467 2.296 2.142 147 H GLN 22 H GLN 22 9.524 3.853 6.910 148 HA GLN 22 HA GLN 22 11.590 1.983 7.248 149 HB2 GLN 22 1HB GLN 22 10.571 4.316 8.794 150 HB3 GLN 22 2HB GLN 22 11.666 3.207 9.609 151 HG2 GLN 22 1HG GLN 22 12.623 3.932 6.975 152 HG3 GLN 22 2HG GLN 22 12.365 5.341 8.002 153 HE21 GLN 22 2HE2 GLN 22 14.429 5.871 8.443 154 HE22 GLN 22 1HE2 GLN 22 15.543 4.852 9.281 155 H ARG 23 H ARG 23 8.586 2.485 9.070 156 HA ARG 23 HA ARG 23 9.048 0.469 10.988 157 HB2 ARG 23 1HB ARG 23 6.475 1.690 9.980 158 HB3 ARG 23 2HB ARG 23 6.572 0.598 11.355 159 HG2 ARG 23 1HG ARG 23 8.099 3.182 11.209 160 HG3 ARG 23 2HG ARG 23 6.478 3.052 11.896 161 HD2 ARG 23 1HD ARG 23 7.231 1.566 13.595 162 HD3 ARG 23 2HD ARG 23 8.803 1.376 12.817 163 HE ARG 23 HE ARG 23 9.482 3.358 13.763 164 HH11 ARG 23 1HH1 ARG 23 6.035 3.014 14.116 165 HH12 ARG 23 2HH1 ARG 23 5.881 4.360 15.194 166 HH21 ARG 23 1HH2 ARG 23 9.290 5.132 15.182 167 HH22 ARG 23 2HH2 ARG 23 7.732 5.565 15.800 168 H ILE 24 H ILE 24 7.530 0.439 7.811 169 HA ILE 24 HA ILE 24 6.496 -2.201 7.982 170 HB ILE 24 HB ILE 24 7.193 -0.571 5.535 171 HG12 ILE 24 1HG1 ILE 24 4.415 -1.040 6.545 172 HG13 ILE 24 2HG1 ILE 24 5.405 0.200 7.307 173 HG21 ILE 24 1HG2 ILE 24 5.399 -2.142 4.536 174 HG22 ILE 24 2HG2 ILE 24 7.044 -2.743 4.736 175 HG23 ILE 24 3HG2 ILE 24 5.795 -3.192 5.897 176 HD11 ILE 24 3HD1 ILE 24 3.864 0.399 4.971 177 HD12 ILE 24 1HD1 ILE 24 4.932 1.612 5.678 178 HD13 ILE 24 2HD1 ILE 24 5.554 0.485 4.473 179 H GLU 25 H GLU 25 9.369 -0.883 6.327 180 HA GLU 25 HA GLU 25 10.382 -3.341 5.443 181 HB2 GLU 25 1HB GLU 25 12.444 -2.184 5.025 182 HB3 GLU 25 2HB GLU 25 11.118 -1.094 4.643 183 HG2 GLU 25 1HG GLU 25 11.421 0.044 6.771 184 HG3 GLU 25 2HG GLU 25 12.730 -1.062 7.185 185 H LYS 26 H LYS 26 10.756 -1.626 8.484 186 HA LYS 26 HA LYS 26 12.838 -3.236 9.534 187 HB2 LYS 26 1HB LYS 26 10.844 -1.333 10.708 188 HB3 LYS 26 2HB LYS 26 11.816 -2.340 11.774 189 HG2 LYS 26 1HG LYS 26 13.832 -1.367 11.009 190 HG3 LYS 26 2HG LYS 26 13.014 -0.570 9.662 191 HD2 LYS 26 1HD LYS 26 11.913 0.949 11.107 192 HD3 LYS 26 2HD LYS 26 12.353 0.016 12.540 193 HE2 LYS 26 1HE LYS 26 14.552 1.040 10.829 194 HE3 LYS 26 2HE LYS 26 13.666 2.209 11.807 195 HZ1 LYS 26 3HZ LYS 26 14.650 -0.257 13.065 196 HZ2 LYS 26 1HZ LYS 26 14.384 1.267 13.751 197 HZ3 LYS 26 2HZ LYS 26 15.737 1.005 12.771 198 H TYR 27 H TYR 27 9.360 -3.184 10.339 199 HA TYR 27 HA TYR 27 9.292 -5.413 11.964 200 HB2 TYR 27 1HB TYR 27 7.358 -4.012 11.800 201 HB3 TYR 27 2HB TYR 27 7.203 -4.323 10.074 202 HD1 TYR 27 HD1 TYR 27 6.303 -6.450 9.270 203 HD2 TYR 27 HD2 TYR 27 6.572 -5.608 13.432 204 HE1 TYR 27 HE1 TYR 27 4.772 -8.318 9.740 205 HE2 TYR 27 HE2 TYR 27 5.042 -7.474 13.915 206 HH TYR 27 HH TYR 27 3.564 -8.928 12.990 207 H ALA 28 H ALA 28 8.849 -5.274 8.441 208 HA ALA 28 HA ALA 28 8.428 -8.031 8.059 209 HB1 ALA 28 3HB ALA 28 8.362 -5.812 6.457 210 HB2 ALA 28 1HB ALA 28 9.770 -6.681 5.845 211 HB3 ALA 28 2HB ALA 28 8.196 -7.478 5.904 212 H LYS 29 H LYS 29 11.380 -6.074 7.663 213 HA LYS 29 HA LYS 29 13.123 -8.099 6.931 214 HB2 LYS 29 1HB LYS 29 13.827 -5.812 6.804 215 HB3 LYS 29 2HB LYS 29 13.606 -5.586 8.534 216 HG2 LYS 29 1HG LYS 29 15.573 -6.585 9.060 217 HG3 LYS 29 2HG LYS 29 15.515 -7.681 7.677 218 HD2 LYS 29 1HD LYS 29 17.249 -6.244 7.117 219 HD3 LYS 29 2HD LYS 29 15.872 -5.534 6.271 220 HE2 LYS 29 1HE LYS 29 15.583 -3.914 8.054 221 HE3 LYS 29 2HE LYS 29 16.891 -4.658 8.972 222 HZ1 LYS 29 3HZ LYS 29 17.070 -2.658 7.033 223 HZ2 LYS 29 1HZ LYS 29 17.839 -4.031 6.410 224 HZ3 LYS 29 2HZ LYS 29 18.328 -3.389 7.896 225 H SER 30 H SER 30 11.883 -7.249 10.088 226 HA SER 30 HA SER 30 13.718 -8.981 11.493 227 HB2 SER 30 1HB SER 30 12.921 -6.965 12.606 228 HB3 SER 30 2HB SER 30 11.250 -7.501 12.437 229 HG SER 30 HG SER 30 11.568 -9.032 13.944 230 H LYS 31 H LYS 31 10.352 -9.056 10.450 231 HA LYS 31 HA LYS 31 9.731 -11.524 11.743 232 HB2 LYS 31 1HB LYS 31 8.388 -9.695 9.836 233 HB3 LYS 31 2HB LYS 31 7.857 -11.371 9.813 234 HG2 LYS 31 1HG LYS 31 7.969 -9.679 12.299 235 HG3 LYS 31 2HG LYS 31 6.528 -9.884 11.299 236 HD2 LYS 31 1HD LYS 31 7.661 -12.447 11.904 237 HD3 LYS 31 2HD LYS 31 7.430 -11.533 13.395 238 HE2 LYS 31 1HE LYS 31 5.149 -11.429 13.137 239 HE3 LYS 31 2HE LYS 31 5.234 -11.577 11.382 240 HZ1 LYS 31 3HZ LYS 31 4.668 -13.689 11.714 241 HZ2 LYS 31 1HZ LYS 31 4.989 -13.622 13.373 242 HZ3 LYS 31 2HZ LYS 31 6.241 -13.936 12.280 243 H ASN 32 H ASN 32 11.458 -10.717 8.933 244 HA ASN 32 HA ASN 32 12.453 -11.964 7.313 245 HB2 ASN 32 1HB ASN 32 11.577 -14.447 8.780 246 HB3 ASN 32 2HB ASN 32 13.004 -14.218 7.772 247 HD21 ASN 32 2HD2 ASN 32 11.999 -14.552 10.848 248 HD22 ASN 32 1HD2 ASN 32 13.281 -13.744 11.676 249 H ILE 33 H ILE 33 10.122 -11.052 6.521 250 HA ILE 33 HA ILE 33 8.677 -13.334 5.346 251 HB ILE 33 HB ILE 33 7.727 -10.492 5.729 252 HG12 ILE 33 1HG1 ILE 33 6.616 -12.956 7.053 253 HG13 ILE 33 2HG1 ILE 33 7.959 -12.067 7.763 254 HG21 ILE 33 1HG2 ILE 33 5.554 -11.331 4.974 255 HG22 ILE 33 2HG2 ILE 33 6.786 -11.505 3.725 256 HG23 ILE 33 3HG2 ILE 33 6.275 -12.910 4.662 257 HD11 ILE 33 3HD1 ILE 33 5.123 -11.221 7.383 258 HD12 ILE 33 1HD1 ILE 33 6.122 -11.179 8.836 259 HD13 ILE 33 2HD1 ILE 33 6.404 -10.018 7.539 260 H ASN 34 H ASN 34 8.295 -13.415 3.151 261 HA ASN 34 HA ASN 34 10.155 -11.947 1.509 262 HB2 ASN 34 1HB ASN 34 9.088 -13.331 -0.344 263 HB3 ASN 34 2HB ASN 34 9.901 -14.234 0.931 264 HD21 ASN 34 2HD2 ASN 34 7.162 -14.022 -0.895 265 HD22 ASN 34 1HD2 ASN 34 6.095 -14.961 0.089 266 H ALA 35 H ALA 35 9.298 -9.812 1.809 267 HA ALA 35 HA ALA 35 7.267 -9.176 -0.163 268 HB1 ALA 35 3HB ALA 35 5.738 -9.359 1.560 269 HB2 ALA 35 1HB ALA 35 6.872 -8.761 2.771 270 HB3 ALA 35 2HB ALA 35 6.151 -7.646 1.611 271 H THR 36 H THR 36 7.049 -6.777 -0.436 272 HA THR 36 HA THR 36 9.321 -5.220 0.512 273 HB THR 36 HB THR 36 10.214 -6.196 -1.522 274 HG1 THR 36 HG1 THR 36 11.013 -4.220 -1.566 275 HG21 THR 36 3HG2 THR 36 9.157 -5.774 -3.704 276 HG22 THR 36 1HG2 THR 36 7.784 -5.031 -2.886 277 HG23 THR 36 2HG2 THR 36 8.127 -6.745 -2.653 278 H ILE 37 H ILE 37 8.981 -3.007 0.487 279 HA ILE 37 HA ILE 37 6.326 -2.119 -0.434 280 HB ILE 37 HB ILE 37 6.298 -2.252 1.989 281 HG12 ILE 37 1HG1 ILE 37 5.768 0.123 2.503 282 HG13 ILE 37 2HG1 ILE 37 6.506 0.591 0.974 283 HG21 ILE 37 1HG2 ILE 37 8.972 -1.522 1.806 284 HG22 ILE 37 2HG2 ILE 37 8.186 -0.147 2.581 285 HG23 ILE 37 3HG2 ILE 37 8.039 -1.758 3.283 286 HD11 ILE 37 3HD1 ILE 37 4.826 -0.825 -0.189 287 HD12 ILE 37 1HD1 ILE 37 4.041 -1.084 1.369 288 HD13 ILE 37 2HD1 ILE 37 4.143 0.542 0.691 289 H GLU 38 H GLU 38 6.189 -0.118 -1.390 290 HA GLU 38 HA GLU 38 8.521 1.608 -1.484 291 HB2 GLU 38 1HB GLU 38 8.795 -0.087 -3.330 292 HB3 GLU 38 2HB GLU 38 7.330 0.563 -4.054 293 HG2 GLU 38 1HG GLU 38 8.914 1.722 -5.208 294 HG3 GLU 38 2HG GLU 38 8.617 2.835 -3.874 295 H ALA 39 H ALA 39 7.962 3.701 -1.613 296 HA ALA 39 HA ALA 39 5.133 4.313 -2.153 297 HB1 ALA 39 3HB ALA 39 5.253 5.226 -0.116 298 HB2 ALA 39 1HB ALA 39 7.017 5.226 -0.119 299 HB3 ALA 39 2HB ALA 39 6.132 6.535 -0.904 300 H ILE 40 H ILE 40 4.638 5.535 -3.856 301 HA ILE 40 HA ILE 40 6.674 7.315 -4.987 302 HB ILE 40 HB ILE 40 6.025 6.615 -7.283 303 HG12 ILE 40 1HG1 ILE 40 5.065 3.988 -6.629 304 HG13 ILE 40 2HG1 ILE 40 4.018 5.192 -5.884 305 HG21 ILE 40 1HG2 ILE 40 7.007 4.121 -6.035 306 HG22 ILE 40 2HG2 ILE 40 7.675 5.065 -7.366 307 HG23 ILE 40 3HG2 ILE 40 7.921 5.592 -5.701 308 HD11 ILE 40 3HD1 ILE 40 4.398 4.499 -8.708 309 HD12 ILE 40 1HD1 ILE 40 2.981 5.128 -7.868 310 HD13 ILE 40 2HD1 ILE 40 4.272 6.223 -8.362 311 H ALA 41 H ALA 41 5.474 8.463 -7.012 312 HA ALA 41 HA ALA 41 3.238 9.853 -5.786 313 HB1 ALA 41 3HB ALA 41 4.163 11.593 -6.803 314 HB2 ALA 41 1HB ALA 41 5.311 10.535 -7.625 315 HB3 ALA 41 2HB ALA 41 3.747 10.884 -8.363 316 H GLU 42 H GLU 42 1.679 10.685 -7.781 317 HA GLU 42 HA GLU 42 0.249 8.273 -8.505 318 HB2 GLU 42 1HB GLU 42 -1.542 9.765 -9.191 319 HB3 GLU 42 2HB GLU 42 -0.954 10.227 -7.600 320 HG2 GLU 42 1HG GLU 42 -0.780 12.292 -8.371 321 HG3 GLU 42 2HG GLU 42 0.573 11.734 -9.352 322 H THR 43 H THR 43 2.408 10.490 -9.976 323 HA THR 43 HA THR 43 1.599 10.286 -12.667 324 HB THR 43 HB THR 43 3.158 12.014 -11.978 325 HG1 THR 43 HG1 THR 43 4.596 10.266 -13.695 326 HG21 THR 43 3HG2 THR 43 5.412 11.559 -11.292 327 HG22 THR 43 1HG2 THR 43 5.201 9.830 -11.568 328 HG23 THR 43 2HG2 THR 43 4.330 10.627 -10.258 329 H ARG 44 H ARG 44 3.729 8.304 -10.674 330 HA ARG 44 HA ARG 44 4.193 6.506 -12.942 331 HB2 ARG 44 1HB ARG 44 5.517 6.745 -10.241 332 HB3 ARG 44 2HB ARG 44 5.845 5.426 -11.357 333 HG2 ARG 44 1HG ARG 44 7.247 6.669 -12.546 334 HG3 ARG 44 2HG ARG 44 6.088 7.996 -12.655 335 HD2 ARG 44 1HD ARG 44 6.813 8.299 -10.109 336 HD3 ARG 44 2HD ARG 44 8.281 7.534 -10.713 337 HE ARG 44 HE ARG 44 7.389 10.200 -11.236 338 HH11 ARG 44 1HH1 ARG 44 9.218 7.531 -12.519 339 HH12 ARG 44 2HH1 ARG 44 10.211 8.527 -13.531 340 HH21 ARG 44 1HH2 ARG 44 8.690 11.523 -12.563 341 HH22 ARG 44 2HH2 ARG 44 9.911 10.798 -13.554 342 H LEU 45 H LEU 45 2.030 6.878 -10.488 343 HA LEU 45 HA LEU 45 1.745 4.423 -9.262 344 HB2 LEU 45 1HB LEU 45 0.415 6.277 -8.572 345 HB3 LEU 45 2HB LEU 45 -0.336 6.403 -10.161 346 HG LEU 45 HG LEU 45 -1.272 4.045 -9.641 347 HD11 LEU 45 1HD1 LEU 45 -1.119 3.203 -7.573 348 HD12 LEU 45 2HD1 LEU 45 -1.315 4.780 -6.809 349 HD13 LEU 45 3HD1 LEU 45 0.266 4.282 -7.408 350 HD21 LEU 45 3HD2 LEU 45 -2.152 6.718 -8.820 351 HD22 LEU 45 1HD2 LEU 45 -2.953 5.389 -7.982 352 HD23 LEU 45 2HD2 LEU 45 -2.997 5.474 -9.742 353 H SER 46 H SER 46 0.207 5.493 -12.295 354 HA SER 46 HA SER 46 -0.932 2.943 -12.850 355 HB2 SER 46 1HB SER 46 -1.862 3.932 -14.709 356 HB3 SER 46 2HB SER 46 -1.517 5.373 -13.753 357 HG SER 46 HG SER 46 -0.388 5.969 -15.415 358 H GLU 47 H GLU 47 2.210 4.069 -13.018 359 HA GLU 47 HA GLU 47 2.944 2.253 -15.204 360 HB2 GLU 47 1HB GLU 47 4.070 4.737 -14.115 361 HB3 GLU 47 2HB GLU 47 5.268 3.500 -14.461 362 HG2 GLU 47 1HG GLU 47 3.454 3.654 -16.649 363 HG3 GLU 47 2HG GLU 47 4.015 5.277 -16.253 364 H VAL 48 H VAL 48 2.592 2.176 -11.941 365 HA VAL 48 HA VAL 48 4.726 0.164 -11.632 366 HB VAL 48 HB VAL 48 4.865 0.715 -9.266 367 HG11 VAL 48 1HG1 VAL 48 5.808 2.259 -11.361 368 HG12 VAL 48 2HG1 VAL 48 5.153 3.438 -10.222 369 HG13 VAL 48 3HG1 VAL 48 6.383 2.289 -9.694 370 HG21 VAL 48 3HG2 VAL 48 2.835 2.862 -9.881 371 HG22 VAL 48 1HG2 VAL 48 2.568 1.422 -8.898 372 HG23 VAL 48 2HG2 VAL 48 3.690 2.667 -8.350 373 H VAL 49 H VAL 49 1.406 1.069 -10.985 374 HA VAL 49 HA VAL 49 0.727 -1.164 -9.376 375 HB VAL 49 HB VAL 49 -1.613 -0.592 -9.883 376 HG11 VAL 49 1HG1 VAL 49 0.326 1.064 -8.639 377 HG12 VAL 49 2HG1 VAL 49 -0.847 2.107 -9.445 378 HG13 VAL 49 3HG1 VAL 49 -1.391 0.911 -8.268 379 HG21 VAL 49 3HG2 VAL 49 -1.717 1.690 -11.262 380 HG22 VAL 49 1HG2 VAL 49 -0.315 0.960 -12.045 381 HG23 VAL 49 2HG2 VAL 49 -1.859 0.109 -12.031 382 H ASP 50 H ASP 50 1.442 -0.903 -12.661 383 HA ASP 50 HA ASP 50 -0.310 -2.915 -13.676 384 HB2 ASP 50 1HB ASP 50 1.086 -1.044 -14.913 385 HB3 ASP 50 2HB ASP 50 2.309 -2.309 -14.984 386 H ARG 51 H ARG 51 2.614 -2.965 -11.895 387 HA ARG 51 HA ARG 51 2.912 -5.847 -12.441 388 HB2 ARG 51 1HB ARG 51 5.118 -4.034 -11.472 389 HB3 ARG 51 2HB ARG 51 5.261 -5.672 -12.092 390 HG2 ARG 51 1HG ARG 51 4.422 -4.779 -14.298 391 HG3 ARG 51 2HG ARG 51 4.642 -3.164 -13.622 392 HD2 ARG 51 1HD ARG 51 7.029 -4.337 -13.037 393 HD3 ARG 51 2HD ARG 51 6.626 -5.101 -14.574 394 HE ARG 51 HE ARG 51 7.487 -2.426 -14.186 395 HH11 ARG 51 1HH1 ARG 51 5.362 -4.392 -16.120 396 HH12 ARG 51 2HH1 ARG 51 5.407 -3.328 -17.487 397 HH21 ARG 51 1HH2 ARG 51 7.555 -1.017 -15.979 398 HH22 ARG 51 2HH2 ARG 51 6.656 -1.409 -17.405 399 H PHE 52 H PHE 52 2.856 -3.304 -10.029 400 HA PHE 52 HA PHE 52 3.590 -4.734 -7.763 401 HB2 PHE 52 1HB PHE 52 2.019 -2.290 -8.307 402 HB3 PHE 52 2HB PHE 52 1.718 -3.054 -6.751 403 HD1 PHE 52 HD2 PHE 52 4.014 -3.829 -5.552 404 HD2 PHE 52 HD1 PHE 52 3.589 -0.632 -8.328 405 HE1 PHE 52 HE2 PHE 52 6.041 -2.773 -4.640 406 HE2 PHE 52 HE1 PHE 52 5.616 0.429 -7.422 407 HZ PHE 52 HZ PHE 52 6.844 -0.641 -5.574 408 H ASP 53 H ASP 53 1.880 -5.083 -5.903 409 HA ASP 53 HA ASP 53 -0.170 -6.882 -7.010 410 HB2 ASP 53 1HB ASP 53 1.538 -6.997 -4.558 411 HB3 ASP 53 2HB ASP 53 -0.042 -7.774 -4.530 412 H VAL 54 H VAL 54 0.358 -4.971 -4.040 413 HA VAL 54 HA VAL 54 -2.518 -4.342 -4.043 414 HB VAL 54 HB VAL 54 -2.110 -3.714 -1.619 415 HG11 VAL 54 1HG1 VAL 54 -2.321 -6.331 -2.848 416 HG12 VAL 54 2HG1 VAL 54 -1.600 -6.407 -1.240 417 HG13 VAL 54 3HG1 VAL 54 -3.182 -5.661 -1.463 418 HG21 VAL 54 3HG2 VAL 54 -0.154 -4.547 -0.516 419 HG22 VAL 54 1HG2 VAL 54 0.424 -5.300 -2.003 420 HG23 VAL 54 2HG2 VAL 54 0.368 -3.542 -1.868 421 H VAL 55 H VAL 55 -3.219 -2.230 -3.757 422 HA VAL 55 HA VAL 55 -1.144 -0.150 -4.000 423 HB VAL 55 HB VAL 55 -3.885 -0.047 -5.263 424 HG11 VAL 55 1HG1 VAL 55 -2.135 1.722 -6.521 425 HG12 VAL 55 2HG1 VAL 55 -3.454 2.129 -5.421 426 HG13 VAL 55 3HG1 VAL 55 -1.818 1.910 -4.797 427 HG21 VAL 55 3HG2 VAL 55 -2.757 -0.407 -7.397 428 HG22 VAL 55 1HG2 VAL 55 -1.218 -0.601 -6.558 429 HG23 VAL 55 2HG2 VAL 55 -2.509 -1.778 -6.315 430 H LEU 56 H LEU 56 -1.088 0.663 -1.974 431 HA LEU 56 HA LEU 56 -3.628 1.355 -0.673 432 HB2 LEU 56 1HB LEU 56 -0.887 1.376 0.564 433 HB3 LEU 56 2HB LEU 56 -2.443 1.429 1.389 434 HG LEU 56 HG LEU 56 -1.053 -0.904 0.125 435 HD11 LEU 56 1HD1 LEU 56 -1.035 -1.786 2.215 436 HD12 LEU 56 2HD1 LEU 56 -2.550 -1.013 2.678 437 HD13 LEU 56 3HD1 LEU 56 -1.054 -0.078 2.651 438 HD21 LEU 56 3HD2 LEU 56 -3.954 -0.397 0.276 439 HD22 LEU 56 1HD2 LEU 56 -3.412 -1.973 0.854 440 HD23 LEU 56 2HD2 LEU 56 -3.038 -1.462 -0.792 441 H LEU 57 H LEU 57 -4.223 3.415 -0.391 442 HA LEU 57 HA LEU 57 -2.300 5.508 -1.160 443 HB2 LEU 57 1HB LEU 57 -4.145 5.478 -2.661 444 HB3 LEU 57 2HB LEU 57 -5.301 5.396 -1.334 445 HG LEU 57 HG LEU 57 -4.437 7.724 -0.690 446 HD11 LEU 57 1HD1 LEU 57 -2.500 7.366 -2.428 447 HD12 LEU 57 2HD1 LEU 57 -3.201 8.962 -2.164 448 HD13 LEU 57 3HD1 LEU 57 -3.695 8.002 -3.559 449 HD21 LEU 57 3HD2 LEU 57 -6.512 8.047 -1.447 450 HD22 LEU 57 1HD2 LEU 57 -6.314 6.870 -2.746 451 HD23 LEU 57 2HD2 LEU 57 -5.752 8.528 -2.966 452 H ALA 58 H ALA 58 -1.649 6.887 0.352 453 HA ALA 58 HA ALA 58 -2.579 6.697 3.035 454 HB1 ALA 58 3HB ALA 58 -0.411 7.319 3.113 455 HB2 ALA 58 1HB ALA 58 -0.498 8.211 1.594 456 HB3 ALA 58 2HB ALA 58 -1.101 8.941 3.082 457 HA PRO 59 HA PRO 59 -5.734 9.739 3.241 458 HB2 PRO 59 1HB PRO 59 -5.239 10.933 5.628 459 HB3 PRO 59 2HB PRO 59 -5.885 9.293 5.489 460 HG2 PRO 59 1HG PRO 59 -3.072 10.184 5.989 461 HG3 PRO 59 2HG PRO 59 -3.984 8.873 6.760 462 HD2 PRO 59 1HD PRO 59 -2.175 8.430 4.793 463 HD3 PRO 59 2HD PRO 59 -3.619 7.421 5.007 464 H GLN 60 H GLN 60 -4.661 10.905 1.404 465 HA GLN 60 HA GLN 60 -4.480 13.656 1.960 466 HB2 GLN 60 1HB GLN 60 -2.197 12.683 2.752 467 HB3 GLN 60 2HB GLN 60 -1.833 12.591 1.033 468 HG2 GLN 60 1HG GLN 60 -1.655 14.832 0.804 469 HG3 GLN 60 2HG GLN 60 -2.880 15.166 2.028 470 HE21 GLN 60 2HE2 GLN 60 -0.973 16.793 2.319 471 HE22 GLN 60 1HE2 GLN 60 0.167 16.352 3.539 472 H SER 61 H SER 61 -6.020 13.573 0.273 473 HA SER 61 HA SER 61 -5.046 14.166 -2.277 474 HB2 SER 61 1HB SER 61 -6.110 12.094 -3.430 475 HB3 SER 61 2HB SER 61 -4.500 11.936 -2.730 476 HG SER 61 HG SER 61 -5.265 10.652 -1.218 477 H ARG 62 H ARG 62 -6.498 15.699 -2.680 478 HA ARG 62 HA ARG 62 -9.181 15.624 -1.748 479 HB2 ARG 62 1HB ARG 62 -7.442 17.532 -2.929 480 HB3 ARG 62 2HB ARG 62 -8.898 17.468 -3.914 481 HG2 ARG 62 1HG ARG 62 -10.270 18.114 -2.134 482 HG3 ARG 62 2HG ARG 62 -9.032 17.743 -0.933 483 HD2 ARG 62 1HD ARG 62 -7.682 19.601 -1.711 484 HD3 ARG 62 2HD ARG 62 -8.845 19.939 -2.992 485 HE ARG 62 HE ARG 62 -10.149 20.023 -0.502 486 HH11 ARG 62 1HH1 ARG 62 -7.837 21.807 -2.397 487 HH12 ARG 62 2HH1 ARG 62 -8.241 23.336 -1.689 488 HH21 ARG 62 1HH2 ARG 62 -10.690 22.031 0.438 489 HH22 ARG 62 2HH2 ARG 62 -9.864 23.461 -0.077 490 H PHE 63 H PHE 63 -7.825 15.463 -5.044 491 HA PHE 63 HA PHE 63 -10.353 14.274 -5.951 492 HB2 PHE 63 1HB PHE 63 -8.254 15.925 -7.269 493 HB3 PHE 63 2HB PHE 63 -9.110 14.748 -8.260 494 HD1 PHE 63 HD2 PHE 63 -9.942 17.305 -5.667 495 HD2 PHE 63 HD1 PHE 63 -10.915 15.540 -9.416 496 HE1 PHE 63 HE2 PHE 63 -11.809 18.887 -5.923 497 HE2 PHE 63 HE1 PHE 63 -12.783 17.120 -9.679 498 HZ PHE 63 HZ PHE 63 -13.233 18.795 -7.930 499 H ASN 64 H ASN 64 -6.889 13.764 -5.788 500 HA ASN 64 HA ASN 64 -6.571 11.586 -7.456 501 HB2 ASN 64 1HB ASN 64 -5.091 12.825 -5.330 502 HB3 ASN 64 2HB ASN 64 -4.993 11.075 -5.163 503 HD21 ASN 64 2HD2 ASN 64 -4.517 13.739 -7.414 504 HD22 ASN 64 1HD2 ASN 64 -3.305 12.957 -8.366 505 H LYS 65 H LYS 65 -7.865 11.712 -4.190 506 HA LYS 65 HA LYS 65 -7.913 8.949 -3.668 507 HB2 LYS 65 1HB LYS 65 -8.228 10.467 -1.853 508 HB3 LYS 65 2HB LYS 65 -9.606 11.224 -2.640 509 HG2 LYS 65 1HG LYS 65 -11.024 9.472 -2.143 510 HG3 LYS 65 2HG LYS 65 -9.699 8.325 -1.931 511 HD2 LYS 65 1HD LYS 65 -10.096 8.663 0.263 512 HD3 LYS 65 2HD LYS 65 -9.123 10.114 0.014 513 HE2 LYS 65 1HE LYS 65 -11.625 10.940 -0.740 514 HE3 LYS 65 2HE LYS 65 -11.976 9.834 0.588 515 HZ1 LYS 65 3HZ LYS 65 -9.801 11.631 1.138 516 HZ2 LYS 65 1HZ LYS 65 -11.160 11.258 2.076 517 HZ3 LYS 65 2HZ LYS 65 -11.267 12.429 0.860 518 H LYS 66 H LYS 66 -10.561 11.077 -4.758 519 HA LYS 66 HA LYS 66 -12.465 9.097 -5.186 520 HB2 LYS 66 1HB LYS 66 -13.028 11.465 -5.188 521 HB3 LYS 66 2HB LYS 66 -12.081 11.715 -6.648 522 HG2 LYS 66 1HG LYS 66 -13.618 10.229 -7.869 523 HG3 LYS 66 2HG LYS 66 -14.589 10.068 -6.405 524 HD2 LYS 66 1HD LYS 66 -14.408 12.767 -6.615 525 HD3 LYS 66 2HD LYS 66 -14.396 12.295 -8.315 526 HE2 LYS 66 1HE LYS 66 -16.485 11.228 -8.141 527 HE3 LYS 66 2HE LYS 66 -16.427 11.223 -6.379 528 HZ1 LYS 66 3HZ LYS 66 -17.818 12.990 -7.756 529 HZ2 LYS 66 1HZ LYS 66 -16.347 13.825 -7.688 530 HZ3 LYS 66 2HZ LYS 66 -17.121 13.355 -6.258 531 H ARG 67 H ARG 67 -10.026 10.397 -7.405 532 HA ARG 67 HA ARG 67 -10.821 8.947 -9.679 533 HB2 ARG 67 1HB ARG 67 -8.680 10.701 -8.941 534 HB3 ARG 67 2HB ARG 67 -8.009 9.298 -9.763 535 HG2 ARG 67 1HG ARG 67 -8.565 10.198 -11.702 536 HG3 ARG 67 2HG ARG 67 -10.266 10.107 -11.241 537 HD2 ARG 67 1HD ARG 67 -10.370 12.302 -10.671 538 HD3 ARG 67 2HD ARG 67 -8.698 12.347 -10.114 539 HE ARG 67 HE ARG 67 -8.683 12.027 -12.889 540 HH11 ARG 67 1HH1 ARG 67 -9.587 14.400 -10.508 541 HH12 ARG 67 2HH1 ARG 67 -9.288 15.752 -11.550 542 HH21 ARG 67 1HH2 ARG 67 -8.286 13.798 -14.272 543 HH22 ARG 67 2HH2 ARG 67 -8.549 15.408 -13.691 544 H LEU 68 H LEU 68 -8.229 8.275 -7.326 545 HA LEU 68 HA LEU 68 -7.304 5.890 -8.343 546 HB2 LEU 68 1HB LEU 68 -7.298 7.220 -5.746 547 HB3 LEU 68 2HB LEU 68 -7.214 5.463 -5.630 548 HG LEU 68 HG LEU 68 -5.256 5.638 -7.277 549 HD11 LEU 68 1HD1 LEU 68 -5.070 8.444 -6.237 550 HD12 LEU 68 2HD1 LEU 68 -5.843 8.075 -7.778 551 HD13 LEU 68 3HD1 LEU 68 -4.145 7.676 -7.527 552 HD21 LEU 68 3HD2 LEU 68 -4.963 6.774 -4.498 553 HD22 LEU 68 1HD2 LEU 68 -3.680 6.055 -5.470 554 HD23 LEU 68 2HD2 LEU 68 -5.023 5.059 -4.909 555 H GLU 69 H GLU 69 -9.848 6.277 -5.872 556 HA GLU 69 HA GLU 69 -10.533 3.551 -5.745 557 HB2 GLU 69 1HB GLU 69 -11.827 6.101 -4.900 558 HB3 GLU 69 2HB GLU 69 -12.814 4.647 -4.939 559 HG2 GLU 69 1HG GLU 69 -10.217 4.361 -3.599 560 HG3 GLU 69 2HG GLU 69 -11.359 5.450 -2.815 561 H GLU 70 H GLU 70 -11.804 6.217 -7.689 562 HA GLU 70 HA GLU 70 -13.956 4.813 -8.844 563 HB2 GLU 70 1HB GLU 70 -12.415 7.271 -9.582 564 HB3 GLU 70 2HB GLU 70 -13.560 6.592 -10.731 565 HG2 GLU 70 1HG GLU 70 -14.362 7.196 -7.911 566 HG3 GLU 70 2HG GLU 70 -14.362 8.443 -9.157 567 H ILE 71 H ILE 71 -10.565 4.744 -9.441 568 HA ILE 71 HA ILE 71 -10.888 3.473 -12.048 569 HB ILE 71 HB ILE 71 -8.380 4.179 -10.522 570 HG12 ILE 71 1HG1 ILE 71 -9.173 5.483 -13.082 571 HG13 ILE 71 2HG1 ILE 71 -10.030 5.960 -11.621 572 HG21 ILE 71 1HG2 ILE 71 -8.856 2.630 -12.970 573 HG22 ILE 71 2HG2 ILE 71 -7.617 3.877 -13.104 574 HG23 ILE 71 3HG2 ILE 71 -7.478 2.624 -11.871 575 HD11 ILE 71 3HD1 ILE 71 -7.087 6.173 -12.175 576 HD12 ILE 71 1HD1 ILE 71 -8.244 7.481 -11.934 577 HD13 ILE 71 2HD1 ILE 71 -7.803 6.434 -10.585 578 H THR 72 H THR 72 -9.881 2.721 -8.765 579 HA THR 72 HA THR 72 -8.910 0.112 -9.294 580 HB THR 72 HB THR 72 -9.093 -0.263 -6.871 581 HG1 THR 72 HG1 THR 72 -10.865 0.764 -6.161 582 HG21 THR 72 3HG2 THR 72 -8.068 2.402 -6.620 583 HG22 THR 72 1HG2 THR 72 -7.559 1.719 -8.162 584 HG23 THR 72 2HG2 THR 72 -7.189 0.874 -6.660 585 H LYS 73 H LYS 73 -12.083 1.395 -8.479 586 HA LYS 73 HA LYS 73 -13.447 -0.905 -7.804 587 HB2 LYS 73 1HB LYS 73 -14.126 1.746 -8.733 588 HB3 LYS 73 2HB LYS 73 -15.219 0.552 -9.421 589 HG2 LYS 73 1HG LYS 73 -16.024 -0.096 -7.346 590 HG3 LYS 73 2HG LYS 73 -14.625 0.555 -6.490 591 HD2 LYS 73 1HD LYS 73 -16.207 2.151 -6.008 592 HD3 LYS 73 2HD LYS 73 -15.483 2.836 -7.465 593 HE2 LYS 73 1HE LYS 73 -17.288 2.161 -8.807 594 HE3 LYS 73 2HE LYS 73 -17.888 1.041 -7.584 595 HZ1 LYS 73 3HZ LYS 73 -18.657 2.808 -6.264 596 HZ2 LYS 73 1HZ LYS 73 -19.145 3.189 -7.839 597 HZ3 LYS 73 2HZ LYS 73 -17.809 3.969 -7.155 598 HA PRO 74 HA PRO 74 -14.448 -1.749 -12.446 599 HB2 PRO 74 1HB PRO 74 -13.164 -0.243 -14.305 600 HB3 PRO 74 2HB PRO 74 -14.712 0.225 -13.592 601 HG2 PRO 74 1HG PRO 74 -11.952 1.150 -12.898 602 HG3 PRO 74 2HG PRO 74 -13.440 2.099 -13.064 603 HD2 PRO 74 1HD PRO 74 -12.450 1.350 -10.657 604 HD3 PRO 74 2HD PRO 74 -14.190 1.522 -10.961 605 H LYS 75 H LYS 75 -11.140 -0.631 -11.841 606 HA LYS 75 HA LYS 75 -9.848 -2.431 -13.587 607 HB2 LYS 75 1HB LYS 75 -8.966 -0.830 -11.207 608 HB3 LYS 75 2HB LYS 75 -7.871 -1.988 -11.948 609 HG2 LYS 75 1HG LYS 75 -9.179 -0.142 -13.819 610 HG3 LYS 75 2HG LYS 75 -8.071 0.606 -12.667 611 HD2 LYS 75 1HD LYS 75 -7.145 -1.860 -14.024 612 HD3 LYS 75 2HD LYS 75 -7.264 -0.398 -15.008 613 HE2 LYS 75 1HE LYS 75 -5.949 0.745 -13.135 614 HE3 LYS 75 2HE LYS 75 -5.595 -0.883 -12.558 615 HZ1 LYS 75 3HZ LYS 75 -5.109 -0.539 -15.368 616 HZ2 LYS 75 1HZ LYS 75 -4.113 -1.202 -14.172 617 HZ3 LYS 75 2HZ LYS 75 -4.156 0.473 -14.406 618 H GLY 76 H GLY 76 -11.206 -2.809 -10.429 619 HA2 GLY 76 1HA GLY 76 -11.430 -4.644 -9.068 620 HA3 GLY 76 2HA GLY 76 -11.057 -5.612 -10.487 621 H ILE 77 H ILE 77 -9.376 -3.483 -8.172 622 HA ILE 77 HA ILE 77 -7.310 -5.556 -7.914 623 HB ILE 77 HB ILE 77 -5.594 -3.733 -7.752 624 HG12 ILE 77 1HG1 ILE 77 -6.951 -1.804 -9.371 625 HG13 ILE 77 2HG1 ILE 77 -7.914 -2.098 -7.928 626 HG21 ILE 77 1HG2 ILE 77 -6.995 -3.910 -10.415 627 HG22 ILE 77 2HG2 ILE 77 -5.296 -3.534 -10.133 628 HG23 ILE 77 3HG2 ILE 77 -5.917 -5.142 -9.761 629 HD11 ILE 77 3HD1 ILE 77 -4.987 -1.584 -7.685 630 HD12 ILE 77 1HD1 ILE 77 -6.112 -0.245 -7.918 631 HD13 ILE 77 2HD1 ILE 77 -6.278 -1.305 -6.517 632 HA PRO 78 HA PRO 78 -7.680 -4.963 -3.579 633 HB2 PRO 78 1HB PRO 78 -5.149 -5.503 -2.758 634 HB3 PRO 78 2HB PRO 78 -6.258 -6.752 -3.335 635 HG2 PRO 78 1HG PRO 78 -4.046 -5.361 -4.796 636 HG3 PRO 78 2HG PRO 78 -4.481 -7.080 -4.799 637 HD2 PRO 78 1HD PRO 78 -5.182 -5.398 -6.801 638 HD3 PRO 78 2HD PRO 78 -6.191 -6.775 -6.313 639 H ILE 79 H ILE 79 -8.103 -2.742 -3.417 640 HA ILE 79 HA ILE 79 -5.741 -1.049 -2.923 641 HB ILE 79 HB ILE 79 -7.122 -0.353 -4.878 642 HG12 ILE 79 1HG1 ILE 79 -7.657 2.000 -3.452 643 HG13 ILE 79 2HG1 ILE 79 -6.303 1.251 -2.611 644 HG21 ILE 79 1HG2 ILE 79 -9.336 -0.023 -4.785 645 HG22 ILE 79 2HG2 ILE 79 -9.260 -0.987 -3.311 646 HG23 ILE 79 3HG2 ILE 79 -9.249 0.774 -3.214 647 HD11 ILE 79 3HD1 ILE 79 -5.034 2.274 -4.121 648 HD12 ILE 79 1HD1 ILE 79 -5.574 1.020 -5.237 649 HD13 ILE 79 2HD1 ILE 79 -6.400 2.578 -5.195 650 H GLU 80 H GLU 80 -5.567 -0.033 -1.006 651 HA GLU 80 HA GLU 80 -7.897 0.031 0.775 652 HB2 GLU 80 1HB GLU 80 -5.178 -0.735 1.808 653 HB3 GLU 80 2HB GLU 80 -6.737 -0.895 2.606 654 HG2 GLU 80 1HG GLU 80 -5.830 -2.474 0.210 655 HG3 GLU 80 2HG GLU 80 -5.847 -3.050 1.875 656 H ILE 81 H ILE 81 -7.450 1.431 2.732 657 HA ILE 81 HA ILE 81 -5.685 3.676 2.003 658 HB ILE 81 HB ILE 81 -8.378 3.908 3.351 659 HG12 ILE 81 1HG1 ILE 81 -8.562 3.300 0.965 660 HG13 ILE 81 2HG1 ILE 81 -9.144 4.933 1.271 661 HG21 ILE 81 1HG2 ILE 81 -7.945 6.376 2.756 662 HG22 ILE 81 2HG2 ILE 81 -7.108 5.687 4.146 663 HG23 ILE 81 3HG2 ILE 81 -6.256 5.890 2.615 664 HD11 ILE 81 3HD1 ILE 81 -7.064 5.848 0.415 665 HD12 ILE 81 1HD1 ILE 81 -6.445 4.218 0.146 666 HD13 ILE 81 2HD1 ILE 81 -7.831 4.800 -0.777 667 H ILE 82 H ILE 82 -4.331 4.376 3.543 668 HA ILE 82 HA ILE 82 -4.088 2.912 5.981 669 HB ILE 82 HB ILE 82 -2.677 5.483 5.276 670 HG12 ILE 82 1HG1 ILE 82 -1.857 2.643 4.626 671 HG13 ILE 82 2HG1 ILE 82 -2.443 3.824 3.459 672 HG21 ILE 82 1HG2 ILE 82 -1.050 4.857 6.852 673 HG22 ILE 82 2HG2 ILE 82 -2.597 4.544 7.637 674 HG23 ILE 82 3HG2 ILE 82 -1.668 3.208 6.958 675 HD11 ILE 82 3HD1 ILE 82 0.187 3.348 4.174 676 HD12 ILE 82 1HD1 ILE 82 -0.426 4.709 3.235 677 HD13 ILE 82 2HD1 ILE 82 -0.224 4.862 4.981 678 H ASN 83 H ASN 83 -5.259 3.233 7.743 679 HA ASN 83 HA ASN 83 -7.068 5.271 8.181 680 HB2 ASN 83 1HB ASN 83 -6.338 2.986 9.521 681 HB3 ASN 83 2HB ASN 83 -5.853 4.248 10.650 682 HD21 ASN 83 2HD2 ASN 83 -7.407 5.542 11.593 683 HD22 ASN 83 1HD2 ASN 83 -9.091 5.163 11.538 684 H THR 84 H THR 84 -7.069 7.137 9.476 685 HA THR 84 HA THR 84 -4.921 8.858 9.204 686 HB THR 84 HB THR 84 -6.637 9.291 11.585 687 HG1 THR 84 HG1 THR 84 -8.427 8.924 10.534 688 HG21 THR 84 3HG2 THR 84 -4.994 10.874 10.166 689 HG22 THR 84 1HG2 THR 84 -6.391 11.483 11.052 690 HG23 THR 84 2HG2 THR 84 -6.508 11.186 9.318 691 H ILE 85 H ILE 85 -5.985 7.413 12.293 692 HA ILE 85 HA ILE 85 -3.806 8.161 13.821 693 HB ILE 85 HB ILE 85 -5.325 5.570 14.126 694 HG12 ILE 85 1HG1 ILE 85 -6.248 7.610 15.890 695 HG13 ILE 85 2HG1 ILE 85 -6.263 8.261 14.255 696 HG21 ILE 85 1HG2 ILE 85 -3.348 7.007 15.749 697 HG22 ILE 85 2HG2 ILE 85 -4.778 6.467 16.627 698 HG23 ILE 85 3HG2 ILE 85 -3.791 5.301 15.745 699 HD11 ILE 85 3HD1 ILE 85 -8.176 7.218 13.901 700 HD12 ILE 85 1HD1 ILE 85 -7.351 5.673 14.104 701 HD13 ILE 85 2HD1 ILE 85 -8.093 6.467 15.494 702 H ASP 86 H ASP 86 -4.247 5.195 11.920 703 HA ASP 86 HA ASP 86 -1.872 3.914 12.621 704 HB2 ASP 86 1HB ASP 86 -3.430 3.817 10.031 705 HB3 ASP 86 2HB ASP 86 -2.123 2.710 10.443 706 H TYR 87 H TYR 87 -2.531 6.259 10.054 707 HA TYR 87 HA TYR 87 0.000 6.163 8.831 708 HB2 TYR 87 1HB TYR 87 -2.058 7.202 7.850 709 HB3 TYR 87 2HB TYR 87 -1.856 8.548 8.967 710 HD1 TYR 87 HD1 TYR 87 -0.046 6.692 6.286 711 HD2 TYR 87 HD2 TYR 87 -0.577 10.383 8.336 712 HE1 TYR 87 HE1 TYR 87 1.452 7.795 4.677 713 HE2 TYR 87 HE2 TYR 87 0.920 11.496 6.731 714 HH TYR 87 HH TYR 87 2.895 10.652 5.168 715 H GLY 88 H GLY 88 -1.305 8.587 11.109 716 HA2 GLY 88 1HA GLY 88 1.071 10.012 11.472 717 HA3 GLY 88 2HA GLY 88 -0.256 9.956 12.622 718 H THR 89 H THR 89 -0.220 7.268 13.314 719 HA THR 89 HA THR 89 1.921 7.243 15.198 720 HB THR 89 HB THR 89 1.034 5.080 15.921 721 HG1 THR 89 HG1 THR 89 0.457 4.291 13.819 722 HG21 THR 89 3HG2 THR 89 -0.384 6.372 17.060 723 HG22 THR 89 1HG2 THR 89 -1.560 6.101 15.775 724 HG23 THR 89 2HG2 THR 89 -0.508 7.515 15.723 725 H MET 90 H MET 90 1.565 6.092 11.996 726 HA MET 90 HA MET 90 2.954 4.963 10.595 727 HB2 MET 90 1HB MET 90 5.048 5.175 12.757 728 HB3 MET 90 2HB MET 90 5.307 4.978 11.029 729 HG2 MET 90 1HG MET 90 5.432 7.168 10.804 730 HG3 MET 90 2HG MET 90 3.773 7.318 11.378 731 HE1 MET 90 3HE MET 90 6.874 5.942 13.065 732 HE2 MET 90 1HE MET 90 7.665 7.464 12.654 733 HE3 MET 90 2HE MET 90 7.273 7.099 14.335 734 H ASN 91 H ASN 91 1.279 3.293 11.606 735 HA ASN 91 HA ASN 91 2.541 1.177 13.118 736 HB2 ASN 91 1HB ASN 91 -0.207 1.755 12.124 737 HB3 ASN 91 2HB ASN 91 0.210 0.072 12.433 738 HD21 ASN 91 2HD2 ASN 91 1.646 0.014 14.605 739 HD22 ASN 91 1HD2 ASN 91 0.836 0.733 15.952 740 H GLY 92 H GLY 92 4.240 0.714 11.570 741 HA2 GLY 92 1HA GLY 92 3.921 -0.062 8.937 742 HA3 GLY 92 2HA GLY 92 5.171 -0.685 10.003 743 H GLU 93 H GLU 93 3.706 -2.116 11.832 744 HA GLU 93 HA GLU 93 3.350 -4.562 10.573 745 HB2 GLU 93 1HB GLU 93 3.710 -4.309 12.992 746 HB3 GLU 93 2HB GLU 93 2.102 -3.617 13.160 747 HG2 GLU 93 1HG GLU 93 1.189 -5.773 12.259 748 HG3 GLU 93 2HG GLU 93 2.819 -6.431 12.390 749 H LYS 94 H LYS 94 0.871 -2.233 11.616 750 HA LYS 94 HA LYS 94 -1.353 -3.694 10.723 751 HB2 LYS 94 1HB LYS 94 -1.032 -0.698 10.984 752 HB3 LYS 94 2HB LYS 94 -2.564 -1.548 10.831 753 HG2 LYS 94 1HG LYS 94 -0.609 -1.820 13.105 754 HG3 LYS 94 2HG LYS 94 -2.132 -0.929 13.138 755 HD2 LYS 94 1HD LYS 94 -3.186 -3.194 12.443 756 HD3 LYS 94 2HD LYS 94 -1.670 -3.888 13.025 757 HE2 LYS 94 1HE LYS 94 -2.399 -3.758 15.118 758 HE3 LYS 94 2HE LYS 94 -2.598 -2.014 14.953 759 HZ1 LYS 94 3HZ LYS 94 -4.672 -3.734 13.817 760 HZ2 LYS 94 1HZ LYS 94 -4.808 -2.210 14.539 761 HZ3 LYS 94 2HZ LYS 94 -4.614 -3.588 15.501 762 H VAL 95 H VAL 95 0.737 -1.373 9.090 763 HA VAL 95 HA VAL 95 -0.790 -1.051 6.751 764 HB VAL 95 HB VAL 95 2.209 -0.880 7.073 765 HG11 VAL 95 1HG1 VAL 95 0.354 -0.156 4.844 766 HG12 VAL 95 2HG1 VAL 95 1.843 0.757 5.089 767 HG13 VAL 95 3HG1 VAL 95 1.912 -0.978 4.781 768 HG21 VAL 95 3HG2 VAL 95 1.845 0.986 8.221 769 HG22 VAL 95 1HG2 VAL 95 0.991 1.660 6.834 770 HG23 VAL 95 2HG2 VAL 95 0.102 0.765 8.066 771 H LEU 96 H LEU 96 2.233 -2.922 7.047 772 HA LEU 96 HA LEU 96 2.042 -4.306 4.669 773 HB2 LEU 96 1HB LEU 96 3.461 -6.046 5.801 774 HB3 LEU 96 2HB LEU 96 4.075 -4.396 5.854 775 HG LEU 96 HG LEU 96 2.684 -4.593 8.215 776 HD11 LEU 96 1HD1 LEU 96 2.585 -7.113 7.572 777 HD12 LEU 96 2HD1 LEU 96 3.000 -6.641 9.219 778 HD13 LEU 96 3HD1 LEU 96 4.270 -7.119 8.094 779 HD21 LEU 96 3HD2 LEU 96 5.602 -5.220 7.785 780 HD22 LEU 96 1HD2 LEU 96 4.857 -4.595 9.256 781 HD23 LEU 96 2HD2 LEU 96 4.912 -3.596 7.803 782 H GLN 97 H GLN 97 0.648 -5.108 7.812 783 HA GLN 97 HA GLN 97 -0.282 -7.678 7.186 784 HB2 GLN 97 1HB GLN 97 -1.073 -5.603 9.196 785 HB3 GLN 97 2HB GLN 97 -2.060 -7.046 9.002 786 HG2 GLN 97 1HG GLN 97 0.889 -7.084 9.591 787 HG3 GLN 97 2HG GLN 97 -0.373 -7.189 10.817 788 HE21 GLN 97 2HE2 GLN 97 1.406 -8.850 8.408 789 HE22 GLN 97 1HE2 GLN 97 0.702 -10.410 8.643 790 H LEU 98 H LEU 98 -2.043 -4.578 7.150 791 HA LEU 98 HA LEU 98 -4.460 -5.505 6.167 792 HB2 LEU 98 1HB LEU 98 -3.596 -3.117 6.929 793 HB3 LEU 98 2HB LEU 98 -3.451 -2.887 5.187 794 HG LEU 98 HG LEU 98 -6.012 -3.731 6.530 795 HD11 LEU 98 1HD1 LEU 98 -5.559 -0.952 5.567 796 HD12 LEU 98 2HD1 LEU 98 -4.948 -1.412 7.157 797 HD13 LEU 98 3HD1 LEU 98 -6.669 -1.557 6.798 798 HD21 LEU 98 3HD2 LEU 98 -6.839 -2.594 4.334 799 HD22 LEU 98 1HD2 LEU 98 -6.237 -4.252 4.298 800 HD23 LEU 98 2HD2 LEU 98 -5.199 -2.926 3.772 801 H ALA 99 H ALA 99 -1.664 -4.288 4.335 802 HA ALA 99 HA ALA 99 -2.714 -4.535 1.773 803 HB1 ALA 99 3HB ALA 99 -0.118 -4.132 2.950 804 HB2 ALA 99 1HB ALA 99 -0.010 -5.185 1.539 805 HB3 ALA 99 2HB ALA 99 -0.742 -3.586 1.395 806 H ILE 100 H ILE 100 -0.552 -6.864 3.404 807 HA ILE 100 HA ILE 100 -0.709 -8.895 1.527 808 HB ILE 100 HB ILE 100 -0.437 -9.205 4.520 809 HG12 ILE 100 1HG1 ILE 100 1.792 -9.209 2.496 810 HG13 ILE 100 2HG1 ILE 100 1.220 -7.711 3.222 811 HG21 ILE 100 1HG2 ILE 100 0.274 -11.093 2.279 812 HG22 ILE 100 2HG2 ILE 100 0.659 -11.335 3.983 813 HG23 ILE 100 3HG2 ILE 100 -1.023 -11.305 3.455 814 HD11 ILE 100 3HD1 ILE 100 2.467 -8.067 5.006 815 HD12 ILE 100 1HD1 ILE 100 1.695 -9.629 5.278 816 HD13 ILE 100 2HD1 ILE 100 3.112 -9.515 4.234 817 H ASN 101 H ASN 101 -2.854 -8.199 4.249 818 HA ASN 101 HA ASN 101 -4.426 -10.507 4.136 819 HB2 ASN 101 1HB ASN 101 -4.527 -8.926 6.005 820 HB3 ASN 101 2HB ASN 101 -5.232 -7.705 4.949 821 HD21 ASN 101 2HD2 ASN 101 -7.224 -7.444 5.700 822 HD22 ASN 101 1HD2 ASN 101 -8.380 -8.707 5.927 823 H ALA 102 H ALA 102 -4.823 -7.381 2.500 824 HA ALA 102 HA ALA 102 -7.241 -8.003 1.195 825 HB1 ALA 102 3HB ALA 102 -7.095 -5.854 0.671 826 HB2 ALA 102 1HB ALA 102 -5.449 -5.813 1.305 827 HB3 ALA 102 2HB ALA 102 -5.732 -6.192 -0.395 828 H PHE 103 H PHE 103 -3.861 -8.237 0.129 829 HA PHE 103 HA PHE 103 -4.321 -9.073 -2.488 830 HB2 PHE 103 1HB PHE 103 -2.110 -8.391 -1.554 831 HB3 PHE 103 2HB PHE 103 -2.033 -9.933 -0.708 832 HD1 PHE 103 HD2 PHE 103 -2.509 -8.567 -4.144 833 HD2 PHE 103 HD1 PHE 103 -0.939 -11.688 -1.711 834 HE1 PHE 103 HE2 PHE 103 -1.492 -9.601 -6.131 835 HE2 PHE 103 HE1 PHE 103 0.081 -12.725 -3.695 836 HZ PHE 103 HZ PHE 103 -0.195 -11.683 -5.909 837 H ASN 104 H ASN 104 -3.777 -11.054 0.420 838 HA ASN 104 HA ASN 104 -4.082 -13.547 -0.837 839 HB2 ASN 104 1HB ASN 104 -3.960 -12.538 1.918 840 HB3 ASN 104 2HB ASN 104 -4.919 -14.004 1.738 841 HD21 ASN 104 2HD2 ASN 104 -1.767 -12.596 1.539 842 HD22 ASN 104 1HD2 ASN 104 -0.887 -14.075 1.386 843 H ASN 105 H ASN 105 -6.416 -11.404 0.728 844 HA ASN 105 HA ASN 105 -8.625 -13.137 0.656 845 HB2 ASN 105 1HB ASN 105 -8.220 -10.211 0.968 846 HB3 ASN 105 2HB ASN 105 -9.832 -10.740 0.495 847 HD21 ASN 105 2HD2 ASN 105 -11.083 -11.881 1.930 848 HD22 ASN 105 1HD2 ASN 105 -10.674 -12.056 3.599 849 H LYS 106 H LYS 106 -7.351 -10.849 -1.708 850 HA LYS 106 HA LYS 106 -9.522 -11.278 -3.556 851 HB2 LYS 106 1HB LYS 106 -7.243 -9.491 -3.325 852 HB3 LYS 106 2HB LYS 106 -7.414 -10.113 -4.961 853 HG2 LYS 106 1HG LYS 106 -9.965 -9.292 -3.906 854 HG3 LYS 106 2HG LYS 106 -8.785 -7.982 -3.814 855 HD2 LYS 106 1HD LYS 106 -8.769 -7.700 -6.036 856 HD3 LYS 106 2HD LYS 106 -8.699 -9.437 -6.342 857 HE2 LYS 106 1HE LYS 106 -10.740 -8.560 -7.265 858 HE3 LYS 106 2HE LYS 106 -11.127 -9.571 -5.874 859 HZ1 LYS 106 3HZ LYS 106 -11.488 -6.722 -6.246 860 HZ2 LYS 106 1HZ LYS 106 -10.899 -7.174 -4.725 861 HZ3 LYS 106 2HZ LYS 106 -12.361 -7.809 -5.288 862 H SER 107 H SER 107 -6.024 -11.655 -4.098 863 HA SER 107 HA SER 107 -4.817 -13.210 -5.239 864 HB2 SER 107 1HB SER 107 -7.118 -15.072 -4.602 865 HB3 SER 107 2HB SER 107 -5.481 -15.543 -5.056 866 HG SER 107 HG SER 107 -6.224 -15.365 -2.678 867 H SER 108 H SER 108 -4.987 -14.843 -7.138 868 HA SER 108 HA SER 108 -7.204 -14.533 -8.921 869 HB2 SER 108 1HB SER 108 -5.214 -12.524 -9.016 870 HB3 SER 108 2HB SER 108 -4.971 -13.542 -10.436 871 HG SER 108 HG SER 108 -6.896 -12.981 -11.196 872 H VAL 109 H VAL 109 -6.310 -15.280 -11.269 873 HA VAL 109 HA VAL 109 -4.583 -17.622 -10.804 874 HB VAL 109 HB VAL 109 -7.047 -17.548 -12.551 875 HG11 VAL 109 1HG1 VAL 109 -4.744 -19.258 -12.549 876 HG12 VAL 109 2HG1 VAL 109 -6.184 -20.181 -12.111 877 HG13 VAL 109 3HG1 VAL 109 -6.144 -19.271 -13.622 878 HG21 VAL 109 3HG2 VAL 109 -7.663 -19.431 -10.834 879 HG22 VAL 109 1HG2 VAL 109 -6.523 -18.569 -9.799 880 HG23 VAL 109 2HG2 VAL 109 -7.939 -17.734 -10.439 Start of MODEL 15 1 H1 GLY 1 H GLY 1 15.415 -15.064 -6.350 2 HA2 GLY 1 1HA GLY 1 13.161 -14.429 -6.053 3 HA3 GLY 1 2HA GLY 1 13.218 -14.872 -7.753 4 HA PRO 2 HA PRO 2 11.376 -18.680 -5.387 5 HB2 PRO 2 1HB PRO 2 10.660 -18.249 -2.804 6 HB3 PRO 2 2HB PRO 2 12.260 -18.838 -3.272 7 HG2 PRO 2 1HG PRO 2 11.398 -16.060 -2.562 8 HG3 PRO 2 2HG PRO 2 12.863 -16.935 -2.078 9 HD2 PRO 2 1HD PRO 2 12.854 -15.093 -4.063 10 HD3 PRO 2 2HD PRO 2 13.930 -16.506 -4.074 11 H GLY 3 H GLY 3 10.314 -15.402 -4.867 12 HA2 GLY 3 1HA GLY 3 7.978 -15.374 -6.140 13 HA3 GLY 3 2HA GLY 3 7.515 -16.182 -4.649 14 H SER 4 H SER 4 7.652 -15.029 -2.665 15 HA SER 4 HA SER 4 7.372 -13.213 -1.323 16 HB2 SER 4 1HB SER 4 8.806 -11.457 -3.284 17 HB3 SER 4 2HB SER 4 8.880 -11.457 -1.522 18 HG SER 4 HG SER 4 10.651 -12.477 -3.017 19 H MET 5 H MET 5 6.578 -10.806 -1.402 20 HA MET 5 HA MET 5 4.517 -10.611 -3.499 21 HB2 MET 5 1HB MET 5 3.838 -11.150 -1.030 22 HB3 MET 5 2HB MET 5 4.125 -9.435 -0.772 23 HG2 MET 5 1HG MET 5 2.542 -9.643 -3.084 24 HG3 MET 5 2HG MET 5 1.847 -10.739 -1.891 25 HE1 MET 5 3HE MET 5 1.560 -8.180 1.168 26 HE2 MET 5 1HE MET 5 1.106 -9.813 0.679 27 HE3 MET 5 2HE MET 5 2.807 -9.350 0.731 28 H ASN 6 H ASN 6 3.775 -8.412 -3.966 29 HA ASN 6 HA ASN 6 5.855 -6.392 -3.446 30 HB2 ASN 6 1HB ASN 6 4.264 -6.582 -6.004 31 HB3 ASN 6 2HB ASN 6 5.675 -5.579 -5.685 32 HD21 ASN 6 2HD2 ASN 6 4.617 -8.357 -7.106 33 HD22 ASN 6 1HD2 ASN 6 6.118 -9.206 -7.220 34 H ILE 7 H ILE 7 5.122 -4.652 -2.434 35 HA ILE 7 HA ILE 7 2.265 -3.972 -2.700 36 HB ILE 7 HB ILE 7 4.014 -3.494 -0.285 37 HG12 ILE 7 1HG1 ILE 7 1.746 -5.207 0.173 38 HG13 ILE 7 2HG1 ILE 7 2.732 -5.862 -1.130 39 HG21 ILE 7 1HG2 ILE 7 2.336 -1.795 -0.466 40 HG22 ILE 7 2HG2 ILE 7 1.088 -2.995 -0.797 41 HG23 ILE 7 3HG2 ILE 7 1.841 -2.923 0.796 42 HD11 ILE 7 3HD1 ILE 7 3.928 -6.793 0.496 43 HD12 ILE 7 1HD1 ILE 7 4.607 -5.184 0.738 44 HD13 ILE 7 2HD1 ILE 7 3.253 -5.728 1.728 45 H LEU 8 H LEU 8 1.702 -1.806 -2.872 46 HA LEU 8 HA LEU 8 3.936 0.067 -3.290 47 HB2 LEU 8 1HB LEU 8 2.940 -0.594 -5.419 48 HB3 LEU 8 2HB LEU 8 1.352 -0.101 -4.835 49 HG LEU 8 HG LEU 8 2.185 2.237 -4.707 50 HD11 LEU 8 1HD1 LEU 8 4.690 0.951 -5.141 51 HD12 LEU 8 2HD1 LEU 8 4.357 2.649 -4.805 52 HD13 LEU 8 3HD1 LEU 8 4.381 2.068 -6.469 53 HD21 LEU 8 3HD2 LEU 8 2.320 2.547 -7.209 54 HD22 LEU 8 1HD2 LEU 8 0.911 1.667 -6.617 55 HD23 LEU 8 2HD2 LEU 8 2.257 0.789 -7.344 56 H LEU 9 H LEU 9 3.579 2.241 -2.726 57 HA LEU 9 HA LEU 9 1.177 2.737 -1.096 58 HB2 LEU 9 1HB LEU 9 3.107 2.324 0.347 59 HB3 LEU 9 2HB LEU 9 4.000 3.600 -0.480 60 HG LEU 9 HG LEU 9 2.238 5.206 0.350 61 HD11 LEU 9 1HD1 LEU 9 1.252 2.689 1.518 62 HD12 LEU 9 2HD1 LEU 9 0.382 4.155 1.070 63 HD13 LEU 9 3HD1 LEU 9 1.264 4.085 2.594 64 HD21 LEU 9 3HD2 LEU 9 4.539 4.721 1.378 65 HD22 LEU 9 1HD2 LEU 9 3.646 3.836 2.616 66 HD23 LEU 9 2HD2 LEU 9 3.346 5.557 2.375 67 H VAL 10 H VAL 10 0.121 4.578 -1.521 68 HA VAL 10 HA VAL 10 1.447 6.550 -3.267 69 HB VAL 10 HB VAL 10 -1.509 5.937 -3.161 70 HG11 VAL 10 1HG1 VAL 10 0.032 7.593 -5.152 71 HG12 VAL 10 2HG1 VAL 10 -1.718 7.397 -5.044 72 HG13 VAL 10 3HG1 VAL 10 -0.847 8.265 -3.779 73 HG21 VAL 10 3HG2 VAL 10 0.501 5.198 -5.286 74 HG22 VAL 10 1HG2 VAL 10 -0.192 4.080 -4.110 75 HG23 VAL 10 2HG2 VAL 10 -1.228 4.854 -5.309 76 H CYS 11 H CYS 11 2.076 8.114 -1.883 77 HA CYS 11 HA CYS 11 -0.028 9.385 -0.269 78 HB2 CYS 11 1HB CYS 11 1.774 9.901 1.432 79 HB3 CYS 11 2HB CYS 11 1.283 8.214 1.337 80 HG CYS 11 HG CYS 11 3.676 8.253 -0.714 81 H GLY 12 H GLY 12 3.087 9.728 -1.904 82 HA2 GLY 12 1HA GLY 12 2.557 12.056 -3.244 83 HA3 GLY 12 2HA GLY 12 3.138 12.587 -1.673 84 H ALA 13 H ALA 13 5.124 13.356 -2.057 85 HA ALA 13 HA ALA 13 6.917 11.961 -3.873 86 HB1 ALA 13 3HB ALA 13 6.610 14.646 -3.006 87 HB2 ALA 13 1HB ALA 13 8.231 14.109 -2.563 88 HB3 ALA 13 2HB ALA 13 7.694 14.005 -4.241 89 H GLY 14 H GLY 14 8.625 10.740 -3.289 90 HA2 GLY 14 1HA GLY 14 9.811 10.885 -0.678 91 HA3 GLY 14 2HA GLY 14 8.807 9.457 -0.879 92 H MET 15 H MET 15 11.344 11.229 -2.654 93 HA MET 15 HA MET 15 12.229 8.992 -4.124 94 HB2 MET 15 1HB MET 15 14.182 10.349 -4.669 95 HB3 MET 15 2HB MET 15 12.712 11.307 -4.790 96 HG2 MET 15 1HG MET 15 13.307 11.961 -2.326 97 HG3 MET 15 2HG MET 15 14.927 11.468 -2.812 98 HE1 MET 15 3HE MET 15 15.139 14.039 -1.846 99 HE2 MET 15 1HE MET 15 14.798 15.454 -2.842 100 HE3 MET 15 2HE MET 15 13.480 14.612 -2.028 101 H SER 16 H SER 16 12.919 10.117 -0.913 102 HA SER 16 HA SER 16 14.551 7.740 -0.455 103 HB2 SER 16 1HB SER 16 16.393 8.873 0.467 104 HB3 SER 16 2HB SER 16 16.007 9.810 -0.977 105 HG SER 16 HG SER 16 15.304 11.426 0.234 106 H THR 17 H THR 17 12.951 10.575 0.932 107 HA THR 17 HA THR 17 12.886 9.613 3.597 108 HB THR 17 HB THR 17 10.846 11.294 3.680 109 HG1 THR 17 HG1 THR 17 11.413 12.935 1.954 110 HG21 THR 17 3HG2 THR 17 12.718 13.178 3.526 111 HG22 THR 17 1HG2 THR 17 13.776 11.768 3.532 112 HG23 THR 17 2HG2 THR 17 12.653 12.034 4.865 113 H SER 18 H SER 18 12.140 7.469 3.510 114 HA SER 18 HA SER 18 9.247 7.219 3.011 115 HB2 SER 18 1HB SER 18 11.073 4.860 2.730 116 HB3 SER 18 2HB SER 18 9.506 5.156 1.976 117 HG SER 18 HG SER 18 10.601 5.844 0.333 118 H MET 19 H MET 19 9.090 7.796 5.302 119 HA MET 19 HA MET 19 10.200 6.342 7.398 120 HB2 MET 19 1HB MET 19 7.518 7.729 7.244 121 HB3 MET 19 2HB MET 19 8.257 7.153 8.733 122 HG2 MET 19 1HG MET 19 10.158 8.762 7.384 123 HG3 MET 19 2HG MET 19 8.625 9.630 7.408 124 HE1 MET 19 3HE MET 19 8.092 11.092 10.325 125 HE2 MET 19 1HE MET 19 9.700 11.664 9.877 126 HE3 MET 19 2HE MET 19 8.529 11.252 8.624 127 H LEU 20 H LEU 20 7.000 5.903 5.884 128 HA LEU 20 HA LEU 20 6.142 3.711 7.319 129 HB2 LEU 20 1HB LEU 20 5.550 4.880 4.697 130 HB3 LEU 20 2HB LEU 20 5.175 3.163 4.829 131 HG LEU 20 HG LEU 20 4.087 5.351 6.600 132 HD11 LEU 20 1HD1 LEU 20 2.787 3.722 4.423 133 HD12 LEU 20 2HD1 LEU 20 3.157 5.444 4.361 134 HD13 LEU 20 3HD1 LEU 20 1.954 4.840 5.502 135 HD21 LEU 20 3HD2 LEU 20 2.509 3.226 7.042 136 HD22 LEU 20 1HD2 LEU 20 3.920 3.609 8.029 137 HD23 LEU 20 2HD2 LEU 20 4.041 2.403 6.748 138 H VAL 21 H VAL 21 8.004 3.712 4.285 139 HA VAL 21 HA VAL 21 8.234 0.959 3.955 140 HB VAL 21 HB VAL 21 10.264 3.075 3.223 141 HG11 VAL 21 1HG1 VAL 21 11.555 1.389 2.569 142 HG12 VAL 21 2HG1 VAL 21 10.305 0.210 2.974 143 HG13 VAL 21 3HG1 VAL 21 10.320 0.971 1.382 144 HG21 VAL 21 3HG2 VAL 21 9.196 3.109 1.054 145 HG22 VAL 21 1HG2 VAL 21 8.058 1.862 1.562 146 HG23 VAL 21 2HG2 VAL 21 8.001 3.461 2.303 147 H GLN 22 H GLN 22 10.346 3.195 5.728 148 HA GLN 22 HA GLN 22 12.320 1.367 6.470 149 HB2 GLN 22 1HB GLN 22 11.573 4.059 7.153 150 HB3 GLN 22 2HB GLN 22 12.016 3.179 8.611 151 HG2 GLN 22 1HG GLN 22 14.106 2.467 7.331 152 HG3 GLN 22 2HG GLN 22 13.680 3.736 6.184 153 HE21 GLN 22 2HE2 GLN 22 15.852 3.270 8.306 154 HE22 GLN 22 1HE2 GLN 22 15.915 4.778 9.146 155 H ARG 23 H ARG 23 9.323 2.286 8.134 156 HA ARG 23 HA ARG 23 9.698 0.723 10.432 157 HB2 ARG 23 1HB ARG 23 7.023 1.330 9.178 158 HB3 ARG 23 2HB ARG 23 7.381 1.063 10.879 159 HG2 ARG 23 1HG ARG 23 8.989 3.210 10.162 160 HG3 ARG 23 2HG ARG 23 7.456 3.501 9.337 161 HD2 ARG 23 1HD ARG 23 6.290 3.125 11.501 162 HD3 ARG 23 2HD ARG 23 7.866 2.998 12.281 163 HE ARG 23 HE ARG 23 6.550 5.401 11.404 164 HH11 ARG 23 1HH1 ARG 23 9.601 3.919 12.186 165 HH12 ARG 23 2HH1 ARG 23 10.385 5.420 12.551 166 HH21 ARG 23 1HH2 ARG 23 7.572 7.385 11.881 167 HH22 ARG 23 2HH2 ARG 23 9.230 7.390 12.378 168 H ILE 24 H ILE 24 7.588 0.008 7.642 169 HA ILE 24 HA ILE 24 6.947 -2.599 8.317 170 HB ILE 24 HB ILE 24 7.314 -1.477 5.536 171 HG12 ILE 24 1HG1 ILE 24 4.610 -1.841 6.639 172 HG13 ILE 24 2HG1 ILE 24 5.570 -0.615 7.461 173 HG21 ILE 24 1HG2 ILE 24 7.163 -3.718 5.107 174 HG22 ILE 24 2HG2 ILE 24 6.232 -4.047 6.567 175 HG23 ILE 24 3HG2 ILE 24 5.450 -3.305 5.172 176 HD11 ILE 24 3HD1 ILE 24 4.264 -0.526 4.890 177 HD12 ILE 24 1HD1 ILE 24 4.913 0.784 5.876 178 HD13 ILE 24 2HD1 ILE 24 5.971 -0.098 4.774 179 H GLU 25 H GLU 25 9.724 -1.395 6.479 180 HA GLU 25 HA GLU 25 10.794 -3.843 5.681 181 HB2 GLU 25 1HB GLU 25 11.902 -1.114 6.131 182 HB3 GLU 25 2HB GLU 25 13.038 -2.441 5.939 183 HG2 GLU 25 1HG GLU 25 11.158 -2.739 3.886 184 HG3 GLU 25 2HG GLU 25 11.543 -1.021 3.951 185 H LYS 26 H LYS 26 11.556 -1.913 8.576 186 HA LYS 26 HA LYS 26 13.401 -3.677 9.709 187 HB2 LYS 26 1HB LYS 26 11.800 -1.388 10.618 188 HB3 LYS 26 2HB LYS 26 12.206 -2.528 11.894 189 HG2 LYS 26 1HG LYS 26 14.283 -1.429 10.030 190 HG3 LYS 26 2HG LYS 26 13.798 -0.584 11.502 191 HD2 LYS 26 1HD LYS 26 14.331 -2.694 12.763 192 HD3 LYS 26 2HD LYS 26 15.032 -3.325 11.271 193 HE2 LYS 26 1HE LYS 26 15.990 -0.657 11.956 194 HE3 LYS 26 2HE LYS 26 16.356 -1.862 13.189 195 HZ1 LYS 26 3HZ LYS 26 18.040 -2.500 11.923 196 HZ2 LYS 26 1HZ LYS 26 17.567 -1.480 10.659 197 HZ3 LYS 26 2HZ LYS 26 16.936 -3.046 10.763 198 H TYR 27 H TYR 27 9.961 -3.288 10.584 199 HA TYR 27 HA TYR 27 9.763 -5.416 12.336 200 HB2 TYR 27 1HB TYR 27 7.956 -3.854 12.160 201 HB3 TYR 27 2HB TYR 27 7.706 -4.242 10.460 202 HD1 TYR 27 HD1 TYR 27 6.637 -6.360 9.815 203 HD2 TYR 27 HD2 TYR 27 7.055 -5.246 13.899 204 HE1 TYR 27 HE1 TYR 27 4.969 -8.056 10.442 205 HE2 TYR 27 HE2 TYR 27 5.389 -6.939 14.538 206 HH TYR 27 HH TYR 27 4.116 -9.233 12.212 207 H ALA 28 H ALA 28 8.820 -5.459 8.893 208 HA ALA 28 HA ALA 28 8.263 -8.149 8.651 209 HB1 ALA 28 3HB ALA 28 9.649 -6.697 6.433 210 HB2 ALA 28 1HB ALA 28 8.322 -7.858 6.354 211 HB3 ALA 28 2HB ALA 28 8.028 -6.220 6.942 212 H LYS 29 H LYS 29 11.379 -6.559 7.953 213 HA LYS 29 HA LYS 29 12.863 -8.790 7.297 214 HB2 LYS 29 1HB LYS 29 13.590 -6.189 8.607 215 HB3 LYS 29 2HB LYS 29 14.811 -7.429 8.356 216 HG2 LYS 29 1HG LYS 29 13.333 -7.032 5.937 217 HG3 LYS 29 2HG LYS 29 13.932 -5.485 6.540 218 HD2 LYS 29 1HD LYS 29 15.751 -6.152 5.328 219 HD3 LYS 29 2HD LYS 29 16.149 -6.885 6.884 220 HE2 LYS 29 1HE LYS 29 14.716 -8.879 5.837 221 HE3 LYS 29 2HE LYS 29 15.295 -8.148 4.342 222 HZ1 LYS 29 3HZ LYS 29 17.509 -8.254 5.925 223 HZ2 LYS 29 1HZ LYS 29 17.132 -9.329 4.674 224 HZ3 LYS 29 2HZ LYS 29 16.718 -9.711 6.269 225 H SER 30 H SER 30 12.024 -7.555 10.484 226 HA SER 30 HA SER 30 13.718 -9.277 11.964 227 HB2 SER 30 1HB SER 30 13.040 -7.645 13.389 228 HB3 SER 30 2HB SER 30 11.508 -7.411 12.548 229 HG SER 30 HG SER 30 12.143 -9.095 14.663 230 H LYS 31 H LYS 31 10.282 -9.473 11.084 231 HA LYS 31 HA LYS 31 9.885 -12.007 12.336 232 HB2 LYS 31 1HB LYS 31 8.278 -10.369 10.388 233 HB3 LYS 31 2HB LYS 31 7.766 -11.981 10.873 234 HG2 LYS 31 1HG LYS 31 8.423 -10.008 12.998 235 HG3 LYS 31 2HG LYS 31 6.905 -9.830 12.115 236 HD2 LYS 31 1HD LYS 31 6.132 -11.942 12.813 237 HD3 LYS 31 2HD LYS 31 7.737 -12.441 13.353 238 HE2 LYS 31 1HE LYS 31 7.085 -11.824 15.395 239 HE3 LYS 31 2HE LYS 31 7.248 -10.164 14.826 240 HZ1 LYS 31 3HZ LYS 31 5.080 -9.887 15.068 241 HZ2 LYS 31 1HZ LYS 31 4.936 -11.459 15.676 242 HZ3 LYS 31 2HZ LYS 31 4.752 -11.173 14.019 243 H ASN 32 H ASN 32 11.353 -11.048 9.442 244 HA ASN 32 HA ASN 32 12.258 -12.204 7.705 245 HB2 ASN 32 1HB ASN 32 12.757 -13.795 9.730 246 HB3 ASN 32 2HB ASN 32 11.532 -14.817 8.983 247 HD21 ASN 32 2HD2 ASN 32 14.498 -13.040 8.233 248 HD22 ASN 32 1HD2 ASN 32 15.099 -14.183 7.085 249 H ILE 33 H ILE 33 9.941 -11.291 7.021 250 HA ILE 33 HA ILE 33 8.383 -13.538 5.925 251 HB ILE 33 HB ILE 33 7.528 -10.672 6.351 252 HG12 ILE 33 1HG1 ILE 33 6.391 -13.094 7.722 253 HG13 ILE 33 2HG1 ILE 33 7.817 -12.284 8.363 254 HG21 ILE 33 1HG2 ILE 33 6.355 -11.440 4.467 255 HG22 ILE 33 2HG2 ILE 33 6.127 -13.045 5.160 256 HG23 ILE 33 3HG2 ILE 33 5.247 -11.666 5.821 257 HD11 ILE 33 3HD1 ILE 33 5.007 -11.316 8.182 258 HD12 ILE 33 1HD1 ILE 33 6.124 -11.286 9.545 259 HD13 ILE 33 2HD1 ILE 33 6.334 -10.155 8.208 260 H ASN 34 H ASN 34 8.021 -13.697 3.760 261 HA ASN 34 HA ASN 34 9.780 -12.229 2.027 262 HB2 ASN 34 1HB ASN 34 7.627 -14.233 1.315 263 HB3 ASN 34 2HB ASN 34 8.922 -13.677 0.260 264 HD21 ASN 34 2HD2 ASN 34 11.163 -13.977 1.256 265 HD22 ASN 34 1HD2 ASN 34 11.456 -15.510 1.997 266 H ALA 35 H ALA 35 8.941 -10.089 2.335 267 HA ALA 35 HA ALA 35 6.834 -9.471 0.438 268 HB1 ALA 35 3HB ALA 35 6.591 -8.845 3.369 269 HB2 ALA 35 1HB ALA 35 5.678 -7.990 2.126 270 HB3 ALA 35 2HB ALA 35 5.459 -9.726 2.343 271 H THR 36 H THR 36 6.743 -7.205 -0.111 272 HA THR 36 HA THR 36 8.873 -5.497 0.891 273 HB THR 36 HB THR 36 9.899 -6.793 -0.980 274 HG1 THR 36 HG1 THR 36 9.522 -4.006 -1.462 275 HG21 THR 36 3HG2 THR 36 7.448 -6.288 -2.241 276 HG22 THR 36 1HG2 THR 36 8.864 -7.076 -2.935 277 HG23 THR 36 2HG2 THR 36 8.641 -5.336 -3.123 278 H ILE 37 H ILE 37 8.534 -3.302 0.512 279 HA ILE 37 HA ILE 37 6.068 -2.567 -0.904 280 HB ILE 37 HB ILE 37 5.613 -2.691 1.544 281 HG12 ILE 37 1HG1 ILE 37 5.519 0.155 0.540 282 HG13 ILE 37 2HG1 ILE 37 4.459 -1.108 -0.075 283 HG21 ILE 37 1HG2 ILE 37 6.709 -1.417 3.113 284 HG22 ILE 37 2HG2 ILE 37 8.029 -1.816 2.016 285 HG23 ILE 37 3HG2 ILE 37 7.258 -0.233 1.927 286 HD11 ILE 37 3HD1 ILE 37 3.572 0.431 1.758 287 HD12 ILE 37 1HD1 ILE 37 3.330 -1.306 1.949 288 HD13 ILE 37 2HD1 ILE 37 4.609 -0.489 2.848 289 H GLU 38 H GLU 38 6.013 -0.439 -1.723 290 HA GLU 38 HA GLU 38 8.451 1.154 -1.500 291 HB2 GLU 38 1HB GLU 38 8.500 -0.464 -3.524 292 HB3 GLU 38 2HB GLU 38 7.304 0.617 -4.224 293 HG2 GLU 38 1HG GLU 38 9.236 1.478 -5.087 294 HG3 GLU 38 2HG GLU 38 9.044 2.466 -3.640 295 H ALA 39 H ALA 39 8.124 3.327 -1.672 296 HA ALA 39 HA ALA 39 5.339 4.190 -2.097 297 HB1 ALA 39 3HB ALA 39 5.506 5.657 -0.379 298 HB2 ALA 39 1HB ALA 39 6.722 4.503 0.168 299 HB3 ALA 39 2HB ALA 39 7.216 5.975 -0.669 300 H ILE 40 H ILE 40 4.897 5.771 -3.546 301 HA ILE 40 HA ILE 40 7.021 7.395 -4.667 302 HB ILE 40 HB ILE 40 6.336 6.790 -7.021 303 HG12 ILE 40 1HG1 ILE 40 5.556 4.085 -6.348 304 HG13 ILE 40 2HG1 ILE 40 4.424 5.247 -5.666 305 HG21 ILE 40 1HG2 ILE 40 7.582 4.482 -5.553 306 HG22 ILE 40 2HG2 ILE 40 7.919 5.053 -7.187 307 HG23 ILE 40 3HG2 ILE 40 8.419 6.015 -5.797 308 HD11 ILE 40 3HD1 ILE 40 5.018 4.609 -8.497 309 HD12 ILE 40 1HD1 ILE 40 3.475 4.919 -7.702 310 HD13 ILE 40 2HD1 ILE 40 4.551 6.260 -8.096 311 H ALA 41 H ALA 41 5.921 8.661 -6.663 312 HA ALA 41 HA ALA 41 3.658 10.027 -5.464 313 HB1 ALA 41 3HB ALA 41 5.706 10.671 -7.462 314 HB2 ALA 41 1HB ALA 41 4.109 11.341 -7.796 315 HB3 ALA 41 2HB ALA 41 4.915 11.702 -6.269 316 H GLU 42 H GLU 42 2.010 10.883 -7.210 317 HA GLU 42 HA GLU 42 0.733 8.517 -8.277 318 HB2 GLU 42 1HB GLU 42 -1.177 9.940 -8.677 319 HB3 GLU 42 2HB GLU 42 -0.551 10.261 -7.066 320 HG2 GLU 42 1HG GLU 42 0.735 12.035 -8.856 321 HG3 GLU 42 2HG GLU 42 -0.993 12.076 -9.200 322 H THR 43 H THR 43 3.101 10.405 -9.424 323 HA THR 43 HA THR 43 2.193 10.972 -12.072 324 HB THR 43 HB THR 43 4.520 11.493 -12.582 325 HG1 THR 43 HG1 THR 43 6.104 11.163 -10.915 326 HG21 THR 43 3HG2 THR 43 3.759 12.477 -9.831 327 HG22 THR 43 1HG2 THR 43 3.179 13.153 -11.352 328 HG23 THR 43 2HG2 THR 43 4.891 13.251 -10.938 329 H ARG 44 H ARG 44 4.284 8.459 -10.671 330 HA ARG 44 HA ARG 44 4.032 6.949 -13.185 331 HB2 ARG 44 1HB ARG 44 6.084 6.592 -10.994 332 HB3 ARG 44 2HB ARG 44 6.057 5.770 -12.547 333 HG2 ARG 44 1HG ARG 44 7.218 7.405 -13.478 334 HG3 ARG 44 2HG ARG 44 6.011 8.592 -12.979 335 HD2 ARG 44 1HD ARG 44 7.088 8.769 -10.792 336 HD3 ARG 44 2HD ARG 44 8.285 7.571 -11.280 337 HE ARG 44 HE ARG 44 8.188 9.814 -13.051 338 HH11 ARG 44 1HH1 ARG 44 9.459 8.659 -10.023 339 HH12 ARG 44 2HH1 ARG 44 10.816 9.736 -10.033 340 HH21 ARG 44 1HH2 ARG 44 9.970 11.237 -13.076 341 HH22 ARG 44 2HH2 ARG 44 11.105 11.203 -11.769 342 H LEU 45 H LEU 45 2.249 7.137 -10.687 343 HA LEU 45 HA LEU 45 2.336 4.630 -9.384 344 HB2 LEU 45 1HB LEU 45 1.186 6.331 -8.266 345 HB3 LEU 45 2HB LEU 45 0.238 6.748 -9.692 346 HG LEU 45 HG LEU 45 -0.996 4.610 -9.437 347 HD11 LEU 45 1HD1 LEU 45 -0.767 3.661 -7.021 348 HD12 LEU 45 2HD1 LEU 45 0.854 4.351 -7.109 349 HD13 LEU 45 3HD1 LEU 45 0.347 3.138 -8.285 350 HD21 LEU 45 3HD2 LEU 45 -1.091 6.286 -6.936 351 HD22 LEU 45 1HD2 LEU 45 -2.403 5.363 -7.670 352 HD23 LEU 45 2HD2 LEU 45 -1.770 6.794 -8.484 353 H SER 46 H SER 46 0.632 5.797 -12.239 354 HA SER 46 HA SER 46 -0.889 3.389 -12.584 355 HB2 SER 46 1HB SER 46 -0.578 4.977 -14.999 356 HB3 SER 46 2HB SER 46 -2.036 4.615 -14.076 357 HG SER 46 HG SER 46 -1.199 6.913 -14.241 358 H GLU 47 H GLU 47 2.275 4.428 -13.403 359 HA GLU 47 HA GLU 47 2.599 2.500 -15.550 360 HB2 GLU 47 1HB GLU 47 3.993 4.851 -14.632 361 HB3 GLU 47 2HB GLU 47 5.115 3.508 -14.794 362 HG2 GLU 47 1HG GLU 47 3.852 3.231 -17.109 363 HG3 GLU 47 2HG GLU 47 3.567 4.953 -16.863 364 H VAL 48 H VAL 48 3.160 2.741 -12.149 365 HA VAL 48 HA VAL 48 4.918 0.410 -12.125 366 HB VAL 48 HB VAL 48 5.150 0.808 -9.732 367 HG11 VAL 48 1HG1 VAL 48 5.584 3.060 -11.641 368 HG12 VAL 48 2HG1 VAL 48 5.966 3.282 -9.932 369 HG13 VAL 48 3HG1 VAL 48 6.762 2.008 -10.858 370 HG21 VAL 48 3HG2 VAL 48 3.102 2.970 -10.191 371 HG22 VAL 48 1HG2 VAL 48 2.963 1.561 -9.141 372 HG23 VAL 48 2HG2 VAL 48 4.096 2.851 -8.740 373 H VAL 49 H VAL 49 1.652 1.361 -11.301 374 HA VAL 49 HA VAL 49 0.884 -0.799 -9.716 375 HB VAL 49 HB VAL 49 -0.485 1.249 -10.124 376 HG11 VAL 49 1HG1 VAL 49 -1.668 1.619 -12.078 377 HG12 VAL 49 2HG1 VAL 49 -0.131 0.998 -12.683 378 HG13 VAL 49 3HG1 VAL 49 -1.538 -0.061 -12.596 379 HG21 VAL 49 3HG2 VAL 49 -2.667 0.055 -10.133 380 HG22 VAL 49 1HG2 VAL 49 -1.808 -1.426 -10.554 381 HG23 VAL 49 2HG2 VAL 49 -1.491 -0.631 -9.012 382 H ASP 50 H ASP 50 1.470 -0.610 -13.120 383 HA ASP 50 HA ASP 50 -0.037 -2.855 -13.948 384 HB2 ASP 50 1HB ASP 50 1.128 -0.974 -15.345 385 HB3 ASP 50 2HB ASP 50 2.513 -2.061 -15.308 386 H ARG 51 H ARG 51 3.171 -2.486 -12.593 387 HA ARG 51 HA ARG 51 3.736 -5.328 -12.972 388 HB2 ARG 51 1HB ARG 51 5.480 -3.153 -11.802 389 HB3 ARG 51 2HB ARG 51 5.984 -4.796 -12.174 390 HG2 ARG 51 1HG ARG 51 5.154 -4.153 -14.585 391 HG3 ARG 51 2HG ARG 51 5.449 -2.514 -14.000 392 HD2 ARG 51 1HD ARG 51 7.733 -3.499 -13.227 393 HD3 ARG 51 2HD ARG 51 7.376 -4.764 -14.403 394 HE ARG 51 HE ARG 51 7.044 -2.208 -15.568 395 HH11 ARG 51 1HH1 ARG 51 9.497 -4.439 -14.508 396 HH12 ARG 51 2HH1 ARG 51 10.688 -3.865 -15.627 397 HH21 ARG 51 1HH2 ARG 51 8.604 -1.442 -17.046 398 HH22 ARG 51 2HH2 ARG 51 10.180 -2.159 -17.070 399 H PHE 52 H PHE 52 3.423 -2.935 -10.374 400 HA PHE 52 HA PHE 52 3.961 -4.562 -8.196 401 HB2 PHE 52 1HB PHE 52 2.356 -2.087 -8.611 402 HB3 PHE 52 2HB PHE 52 2.137 -2.957 -7.097 403 HD1 PHE 52 HD1 PHE 52 4.391 -3.631 -5.895 404 HD2 PHE 52 HD2 PHE 52 3.978 -0.470 -8.715 405 HE1 PHE 52 HE1 PHE 52 6.414 -2.563 -4.988 406 HE2 PHE 52 HE2 PHE 52 6.001 0.603 -7.813 407 HZ PHE 52 HZ PHE 52 7.222 -0.444 -5.948 408 H ASP 53 H ASP 53 2.185 -5.110 -6.500 409 HA ASP 53 HA ASP 53 0.071 -6.622 -7.891 410 HB2 ASP 53 1HB ASP 53 1.799 -7.296 -5.538 411 HB3 ASP 53 2HB ASP 53 0.193 -8.010 -5.665 412 H VAL 54 H VAL 54 0.822 -5.121 -4.745 413 HA VAL 54 HA VAL 54 -2.047 -4.524 -4.444 414 HB VAL 54 HB VAL 54 0.042 -4.663 -2.267 415 HG11 VAL 54 1HG1 VAL 54 -2.878 -4.050 -2.316 416 HG12 VAL 54 2HG1 VAL 54 -2.180 -4.850 -0.905 417 HG13 VAL 54 3HG1 VAL 54 -1.580 -3.270 -1.412 418 HG21 VAL 54 3HG2 VAL 54 -1.731 -6.685 -1.785 419 HG22 VAL 54 1HG2 VAL 54 -1.598 -6.723 -3.544 420 HG23 VAL 54 2HG2 VAL 54 -0.152 -6.880 -2.547 421 H VAL 55 H VAL 55 -2.698 -2.466 -3.798 422 HA VAL 55 HA VAL 55 -0.622 -0.376 -3.903 423 HB VAL 55 HB VAL 55 -3.411 -0.089 -5.021 424 HG11 VAL 55 1HG1 VAL 55 -2.397 1.934 -6.091 425 HG12 VAL 55 2HG1 VAL 55 -2.526 2.019 -4.334 426 HG13 VAL 55 3HG1 VAL 55 -0.970 1.675 -5.090 427 HG21 VAL 55 3HG2 VAL 55 -2.284 -0.126 -7.243 428 HG22 VAL 55 1HG2 VAL 55 -0.808 -0.652 -6.433 429 HG23 VAL 55 2HG2 VAL 55 -2.246 -1.673 -6.396 430 H LEU 56 H LEU 56 -0.975 1.476 -2.637 431 HA LEU 56 HA LEU 56 -3.206 1.347 -0.732 432 HB2 LEU 56 1HB LEU 56 -0.281 1.482 -0.144 433 HB3 LEU 56 2HB LEU 56 -1.425 2.263 0.946 434 HG LEU 56 HG LEU 56 -2.512 -0.218 0.746 435 HD11 LEU 56 1HD1 LEU 56 -0.986 -1.475 -0.352 436 HD12 LEU 56 2HD1 LEU 56 -0.268 -1.575 1.256 437 HD13 LEU 56 3HD1 LEU 56 0.361 -0.422 0.080 438 HD21 LEU 56 3HD2 LEU 56 -2.202 0.907 2.824 439 HD22 LEU 56 1HD2 LEU 56 -0.447 0.835 2.670 440 HD23 LEU 56 2HD2 LEU 56 -1.369 -0.645 2.937 441 H LEU 57 H LEU 57 -3.747 3.375 0.255 442 HA LEU 57 HA LEU 57 -2.650 5.733 -1.118 443 HB2 LEU 57 1HB LEU 57 -5.247 4.667 -1.418 444 HB3 LEU 57 2HB LEU 57 -5.404 6.142 -0.467 445 HG LEU 57 HG LEU 57 -3.988 6.025 -3.124 446 HD11 LEU 57 1HD1 LEU 57 -6.181 7.293 -3.786 447 HD12 LEU 57 2HD1 LEU 57 -6.870 6.372 -2.451 448 HD13 LEU 57 3HD1 LEU 57 -6.121 5.531 -3.808 449 HD21 LEU 57 3HD2 LEU 57 -4.814 8.198 -1.238 450 HD22 LEU 57 1HD2 LEU 57 -4.638 8.522 -2.962 451 HD23 LEU 57 2HD2 LEU 57 -3.260 7.936 -2.031 452 H ALA 58 H ALA 58 -3.013 7.762 0.031 453 HA ALA 58 HA ALA 58 -2.993 7.335 2.938 454 HB1 ALA 58 3HB ALA 58 -1.096 8.498 2.777 455 HB2 ALA 58 1HB ALA 58 -1.465 9.030 1.136 456 HB3 ALA 58 2HB ALA 58 -2.117 9.912 2.517 457 HA PRO 59 HA PRO 59 -6.675 9.624 3.613 458 HB2 PRO 59 1HB PRO 59 -6.078 11.045 5.848 459 HB3 PRO 59 2HB PRO 59 -6.352 9.299 5.865 460 HG2 PRO 59 1HG PRO 59 -3.768 10.812 5.846 461 HG3 PRO 59 2HG PRO 59 -4.222 9.385 6.795 462 HD2 PRO 59 1HD PRO 59 -2.707 9.224 4.557 463 HD3 PRO 59 2HD PRO 59 -3.831 7.939 5.043 464 H GLN 60 H GLN 60 -3.711 11.295 3.081 465 HA GLN 60 HA GLN 60 -4.937 13.920 2.973 466 HB2 GLN 60 1HB GLN 60 -2.523 13.358 3.723 467 HB3 GLN 60 2HB GLN 60 -2.170 13.266 2.003 468 HG2 GLN 60 1HG GLN 60 -2.950 15.571 1.729 469 HG3 GLN 60 2HG GLN 60 -3.271 15.660 3.459 470 HE21 GLN 60 2HE2 GLN 60 -1.819 17.059 4.198 471 HE22 GLN 60 1HE2 GLN 60 -0.111 16.949 3.961 472 H SER 61 H SER 61 -6.468 13.679 1.320 473 HA SER 61 HA SER 61 -5.490 14.215 -1.302 474 HB2 SER 61 1HB SER 61 -7.136 11.987 -1.850 475 HB3 SER 61 2HB SER 61 -5.404 12.143 -2.147 476 HG SER 61 HG SER 61 -6.702 10.657 -0.294 477 H ARG 62 H ARG 62 -6.933 15.444 -2.340 478 HA ARG 62 HA ARG 62 -9.561 15.792 -1.132 479 HB2 ARG 62 1HB ARG 62 -7.702 17.488 -2.481 480 HB3 ARG 62 2HB ARG 62 -9.208 17.487 -3.391 481 HG2 ARG 62 1HG ARG 62 -9.759 17.734 -0.588 482 HG3 ARG 62 2HG ARG 62 -8.593 18.959 -1.094 483 HD2 ARG 62 1HD ARG 62 -10.165 19.447 -3.025 484 HD3 ARG 62 2HD ARG 62 -11.351 18.454 -2.180 485 HE ARG 62 HE ARG 62 -10.371 20.380 -0.401 486 HH11 ARG 62 1HH1 ARG 62 -12.301 20.166 -3.290 487 HH12 ARG 62 2HH1 ARG 62 -13.235 21.579 -2.928 488 HH21 ARG 62 1HH2 ARG 62 -11.595 22.242 0.089 489 HH22 ARG 62 2HH2 ARG 62 -12.833 22.759 -1.006 490 H PHE 63 H PHE 63 -8.365 15.586 -4.491 491 HA PHE 63 HA PHE 63 -10.893 14.267 -5.212 492 HB2 PHE 63 1HB PHE 63 -9.067 16.127 -6.644 493 HB3 PHE 63 2HB PHE 63 -9.878 14.897 -7.608 494 HD1 PHE 63 HD1 PHE 63 -10.404 17.774 -5.366 495 HD2 PHE 63 HD2 PHE 63 -12.184 15.055 -8.115 496 HE1 PHE 63 HE1 PHE 63 -12.427 19.172 -5.433 497 HE2 PHE 63 HE2 PHE 63 -14.209 16.450 -8.188 498 HZ PHE 63 HZ PHE 63 -14.333 18.511 -6.846 499 H ASN 64 H ASN 64 -7.460 13.896 -5.090 500 HA ASN 64 HA ASN 64 -6.971 11.921 -6.952 501 HB2 ASN 64 1HB ASN 64 -5.779 12.050 -4.173 502 HB3 ASN 64 2HB ASN 64 -5.073 11.266 -5.582 503 HD21 ASN 64 2HD2 ASN 64 -3.859 13.277 -3.990 504 HD22 ASN 64 1HD2 ASN 64 -3.587 14.650 -5.003 505 H LYS 65 H LYS 65 -7.966 11.474 -3.562 506 HA LYS 65 HA LYS 65 -8.099 8.711 -3.516 507 HB2 LYS 65 1HB LYS 65 -9.830 9.022 -1.721 508 HB3 LYS 65 2HB LYS 65 -8.344 9.931 -1.478 509 HG2 LYS 65 1HG LYS 65 -9.499 11.924 -2.444 510 HG3 LYS 65 2HG LYS 65 -10.994 10.984 -2.437 511 HD2 LYS 65 1HD LYS 65 -9.300 11.572 -0.008 512 HD3 LYS 65 2HD LYS 65 -10.770 12.441 -0.455 513 HE2 LYS 65 1HE LYS 65 -11.768 10.942 0.896 514 HE3 LYS 65 2HE LYS 65 -11.662 9.890 -0.516 515 HZ1 LYS 65 3HZ LYS 65 -9.762 8.837 0.343 516 HZ2 LYS 65 1HZ LYS 65 -10.834 8.942 1.647 517 HZ3 LYS 65 2HZ LYS 65 -9.531 10.013 1.537 518 H LYS 66 H LYS 66 -10.630 11.023 -4.447 519 HA LYS 66 HA LYS 66 -12.673 9.187 -4.944 520 HB2 LYS 66 1HB LYS 66 -12.517 11.872 -5.015 521 HB3 LYS 66 2HB LYS 66 -12.476 11.540 -6.742 522 HG2 LYS 66 1HG LYS 66 -14.562 10.147 -5.183 523 HG3 LYS 66 2HG LYS 66 -14.737 11.895 -5.368 524 HD2 LYS 66 1HD LYS 66 -14.032 10.989 -7.901 525 HD3 LYS 66 2HD LYS 66 -15.164 9.776 -7.296 526 HE2 LYS 66 1HE LYS 66 -16.702 11.669 -6.686 527 HE3 LYS 66 2HE LYS 66 -15.609 12.745 -7.557 528 HZ1 LYS 66 3HZ LYS 66 -15.993 11.460 -9.563 529 HZ2 LYS 66 1HZ LYS 66 -17.458 12.039 -8.943 530 HZ3 LYS 66 2HZ LYS 66 -17.031 10.416 -8.729 531 H ARG 67 H ARG 67 -10.199 10.485 -7.138 532 HA ARG 67 HA ARG 67 -11.058 9.187 -9.464 533 HB2 ARG 67 1HB ARG 67 -8.781 10.723 -8.621 534 HB3 ARG 67 2HB ARG 67 -8.240 9.337 -9.559 535 HG2 ARG 67 1HG ARG 67 -9.188 10.088 -11.482 536 HG3 ARG 67 2HG ARG 67 -10.498 10.920 -10.641 537 HD2 ARG 67 1HD ARG 67 -8.928 12.654 -9.919 538 HD3 ARG 67 2HD ARG 67 -7.623 11.822 -10.763 539 HE ARG 67 HE ARG 67 -9.565 12.267 -12.659 540 HH11 ARG 67 1HH1 ARG 67 -7.642 14.220 -10.512 541 HH12 ARG 67 2HH1 ARG 67 -7.620 15.593 -11.570 542 HH21 ARG 67 1HH2 ARG 67 -9.544 14.068 -14.060 543 HH22 ARG 67 2HH2 ARG 67 -8.703 15.505 -13.587 544 H LEU 68 H LEU 68 -8.263 8.263 -7.447 545 HA LEU 68 HA LEU 68 -7.773 5.794 -8.562 546 HB2 LEU 68 1HB LEU 68 -7.101 7.167 -6.104 547 HB3 LEU 68 2HB LEU 68 -7.270 5.431 -5.852 548 HG LEU 68 HG LEU 68 -5.476 6.643 -7.948 549 HD11 LEU 68 1HD1 LEU 68 -3.676 6.555 -6.495 550 HD12 LEU 68 2HD1 LEU 68 -4.509 5.490 -5.362 551 HD13 LEU 68 3HD1 LEU 68 -4.966 7.190 -5.473 552 HD21 LEU 68 3HD2 LEU 68 -4.898 3.999 -6.842 553 HD22 LEU 68 1HD2 LEU 68 -4.926 4.550 -8.518 554 HD23 LEU 68 2HD2 LEU 68 -6.428 4.091 -7.714 555 H GLU 69 H GLU 69 -10.215 6.698 -6.220 556 HA GLU 69 HA GLU 69 -10.957 4.053 -5.487 557 HB2 GLU 69 1HB GLU 69 -12.131 6.772 -5.141 558 HB3 GLU 69 2HB GLU 69 -13.177 5.381 -4.891 559 HG2 GLU 69 1HG GLU 69 -11.493 4.510 -3.266 560 HG3 GLU 69 2HG GLU 69 -10.639 6.045 -3.422 561 H GLU 70 H GLU 70 -12.570 6.450 -7.582 562 HA GLU 70 HA GLU 70 -14.547 4.708 -8.548 563 HB2 GLU 70 1HB GLU 70 -14.990 6.371 -10.228 564 HB3 GLU 70 2HB GLU 70 -14.612 7.192 -8.720 565 HG2 GLU 70 1HG GLU 70 -12.439 7.770 -9.483 566 HG3 GLU 70 2HG GLU 70 -12.596 6.733 -10.900 567 H ILE 71 H ILE 71 -11.219 4.893 -9.235 568 HA ILE 71 HA ILE 71 -11.480 3.577 -11.829 569 HB ILE 71 HB ILE 71 -9.010 4.470 -10.334 570 HG12 ILE 71 1HG1 ILE 71 -10.011 5.671 -12.890 571 HG13 ILE 71 2HG1 ILE 71 -10.736 6.162 -11.363 572 HG21 ILE 71 1HG2 ILE 71 -8.093 4.183 -12.782 573 HG22 ILE 71 2HG2 ILE 71 -8.164 2.815 -11.671 574 HG23 ILE 71 3HG2 ILE 71 -9.411 3.017 -12.901 575 HD11 ILE 71 3HD1 ILE 71 -9.117 7.739 -11.549 576 HD12 ILE 71 1HD1 ILE 71 -8.210 6.499 -10.684 577 HD13 ILE 71 2HD1 ILE 71 -8.021 6.673 -12.429 578 H THR 72 H THR 72 -10.469 2.923 -8.535 579 HA THR 72 HA THR 72 -9.307 0.378 -9.050 580 HB THR 72 HB THR 72 -9.766 0.060 -6.518 581 HG1 THR 72 HG1 THR 72 -10.763 1.650 -5.542 582 HG21 THR 72 3HG2 THR 72 -7.790 1.505 -7.977 583 HG22 THR 72 1HG2 THR 72 -7.615 0.630 -6.456 584 HG23 THR 72 2HG2 THR 72 -8.070 2.334 -6.446 585 H LYS 73 H LYS 73 -12.534 1.460 -8.118 586 HA LYS 73 HA LYS 73 -13.731 -0.921 -7.434 587 HB2 LYS 73 1HB LYS 73 -15.188 0.814 -7.154 588 HB3 LYS 73 2HB LYS 73 -14.678 1.622 -8.631 589 HG2 LYS 73 1HG LYS 73 -16.039 0.246 -9.975 590 HG3 LYS 73 2HG LYS 73 -16.322 -0.890 -8.654 591 HD2 LYS 73 1HD LYS 73 -17.167 1.972 -8.406 592 HD3 LYS 73 2HD LYS 73 -18.175 0.812 -9.276 593 HE2 LYS 73 1HE LYS 73 -17.815 -0.630 -7.110 594 HE3 LYS 73 2HE LYS 73 -17.479 0.937 -6.378 595 HZ1 LYS 73 3HZ LYS 73 -19.644 1.706 -7.209 596 HZ2 LYS 73 1HZ LYS 73 -19.794 0.409 -6.134 597 HZ3 LYS 73 2HZ LYS 73 -19.966 0.154 -7.797 598 HA PRO 74 HA PRO 74 -14.786 -1.783 -12.069 599 HB2 PRO 74 1HB PRO 74 -13.569 -0.231 -13.934 600 HB3 PRO 74 2HB PRO 74 -15.126 0.185 -13.206 601 HG2 PRO 74 1HG PRO 74 -12.389 1.197 -12.535 602 HG3 PRO 74 2HG PRO 74 -13.910 2.097 -12.684 603 HD2 PRO 74 1HD PRO 74 -12.872 1.375 -10.289 604 HD3 PRO 74 2HD PRO 74 -14.620 1.492 -10.577 605 H LYS 75 H LYS 75 -11.507 -0.536 -11.537 606 HA LYS 75 HA LYS 75 -10.186 -2.314 -13.282 607 HB2 LYS 75 1HB LYS 75 -9.322 -0.636 -10.952 608 HB3 LYS 75 2HB LYS 75 -8.197 -1.777 -11.675 609 HG2 LYS 75 1HG LYS 75 -9.585 -0.028 -13.581 610 HG3 LYS 75 2HG LYS 75 -8.494 0.791 -12.460 611 HD2 LYS 75 1HD LYS 75 -6.895 -1.213 -13.155 612 HD3 LYS 75 2HD LYS 75 -7.899 -1.176 -14.607 613 HE2 LYS 75 1HE LYS 75 -6.892 0.668 -15.348 614 HE3 LYS 75 2HE LYS 75 -7.108 1.485 -13.802 615 HZ1 LYS 75 3HZ LYS 75 -5.050 -0.558 -13.865 616 HZ2 LYS 75 1HZ LYS 75 -5.036 0.973 -13.143 617 HZ3 LYS 75 2HZ LYS 75 -4.734 0.816 -14.800 618 H GLY 76 H GLY 76 -11.505 -2.718 -10.121 619 HA2 GLY 76 1HA GLY 76 -11.552 -4.501 -8.676 620 HA3 GLY 76 2HA GLY 76 -11.321 -5.489 -10.111 621 H ILE 77 H ILE 77 -9.309 -3.244 -8.201 622 HA ILE 77 HA ILE 77 -7.264 -5.363 -8.081 623 HB ILE 77 HB ILE 77 -5.563 -3.516 -8.011 624 HG12 ILE 77 1HG1 ILE 77 -7.099 -1.567 -9.440 625 HG13 ILE 77 2HG1 ILE 77 -7.908 -1.916 -7.917 626 HG21 ILE 77 1HG2 ILE 77 -5.978 -4.853 -10.022 627 HG22 ILE 77 2HG2 ILE 77 -7.214 -3.703 -10.526 628 HG23 ILE 77 3HG2 ILE 77 -5.529 -3.196 -10.423 629 HD11 ILE 77 3HD1 ILE 77 -6.063 -1.224 -6.655 630 HD12 ILE 77 1HD1 ILE 77 -4.984 -1.276 -8.048 631 HD13 ILE 77 2HD1 ILE 77 -6.220 -0.023 -7.938 632 HA PRO 78 HA PRO 78 -7.236 -4.923 -3.712 633 HB2 PRO 78 1HB PRO 78 -4.634 -5.454 -3.147 634 HB3 PRO 78 2HB PRO 78 -5.779 -6.699 -3.663 635 HG2 PRO 78 1HG PRO 78 -3.727 -5.228 -5.272 636 HG3 PRO 78 2HG PRO 78 -4.141 -6.952 -5.294 637 HD2 PRO 78 1HD PRO 78 -5.044 -5.212 -7.163 638 HD3 PRO 78 2HD PRO 78 -5.988 -6.620 -6.634 639 H ILE 79 H ILE 79 -7.663 -2.729 -3.390 640 HA ILE 79 HA ILE 79 -5.280 -1.032 -3.028 641 HB ILE 79 HB ILE 79 -6.671 -0.227 -4.882 642 HG12 ILE 79 1HG1 ILE 79 -7.104 2.093 -3.954 643 HG13 ILE 79 2HG1 ILE 79 -6.659 1.457 -2.374 644 HG21 ILE 79 1HG2 ILE 79 -8.852 0.176 -2.844 645 HG22 ILE 79 2HG2 ILE 79 -8.927 0.511 -4.573 646 HG23 ILE 79 3HG2 ILE 79 -8.810 -1.154 -4.002 647 HD11 ILE 79 3HD1 ILE 79 -4.953 1.884 -4.786 648 HD12 ILE 79 1HD1 ILE 79 -4.704 2.425 -3.126 649 HD13 ILE 79 2HD1 ILE 79 -4.481 0.726 -3.543 650 H GLU 80 H GLU 80 -4.959 -0.212 -1.057 651 HA GLU 80 HA GLU 80 -7.185 -0.330 0.872 652 HB2 GLU 80 1HB GLU 80 -4.274 -0.629 1.597 653 HB3 GLU 80 2HB GLU 80 -5.677 -0.950 2.606 654 HG2 GLU 80 1HG GLU 80 -5.022 -3.069 2.028 655 HG3 GLU 80 2HG GLU 80 -6.242 -2.728 0.803 656 H ILE 81 H ILE 81 -7.120 1.256 2.590 657 HA ILE 81 HA ILE 81 -5.550 3.657 1.936 658 HB ILE 81 HB ILE 81 -8.457 3.622 2.759 659 HG12 ILE 81 1HG1 ILE 81 -8.432 4.945 0.427 660 HG13 ILE 81 2HG1 ILE 81 -7.049 3.891 0.152 661 HG21 ILE 81 1HG2 ILE 81 -8.037 5.654 3.570 662 HG22 ILE 81 2HG2 ILE 81 -6.412 5.671 2.887 663 HG23 ILE 81 3HG2 ILE 81 -7.786 6.168 1.902 664 HD11 ILE 81 3HD1 ILE 81 -9.601 2.715 1.131 665 HD12 ILE 81 1HD1 ILE 81 -9.440 3.158 -0.568 666 HD13 ILE 81 2HD1 ILE 81 -8.329 1.991 0.149 667 H ILE 82 H ILE 82 -4.364 4.327 3.589 668 HA ILE 82 HA ILE 82 -4.636 3.168 6.189 669 HB ILE 82 HB ILE 82 -2.918 5.529 5.435 670 HG12 ILE 82 1HG1 ILE 82 -2.250 2.582 5.277 671 HG13 ILE 82 2HG1 ILE 82 -2.526 3.638 3.895 672 HG21 ILE 82 1HG2 ILE 82 -1.634 5.027 7.334 673 HG22 ILE 82 2HG2 ILE 82 -3.307 4.898 7.871 674 HG23 ILE 82 3HG2 ILE 82 -2.380 3.440 7.523 675 HD11 ILE 82 3HD1 ILE 82 -0.276 3.733 3.935 676 HD12 ILE 82 1HD1 ILE 82 -0.589 5.018 5.101 677 HD13 ILE 82 2HD1 ILE 82 -0.179 3.397 5.662 678 H ASN 83 H ASN 83 -6.226 3.757 7.513 679 HA ASN 83 HA ASN 83 -7.767 6.042 7.400 680 HB2 ASN 83 1HB ASN 83 -7.288 3.914 9.357 681 HB3 ASN 83 2HB ASN 83 -7.784 5.438 10.089 682 HD21 ASN 83 2HD2 ASN 83 -9.874 5.597 10.378 683 HD22 ASN 83 1HD2 ASN 83 -11.103 4.897 9.384 684 H THR 84 H THR 84 -7.914 7.738 9.172 685 HA THR 84 HA THR 84 -5.668 9.391 9.087 686 HB THR 84 HB THR 84 -7.320 9.908 11.427 687 HG1 THR 84 HG1 THR 84 -9.254 10.241 10.191 688 HG21 THR 84 3HG2 THR 84 -7.656 11.686 9.167 689 HG22 THR 84 1HG2 THR 84 -5.954 11.334 9.465 690 HG23 THR 84 2HG2 THR 84 -6.954 12.006 10.753 691 H ILE 85 H ILE 85 -6.682 7.023 11.475 692 HA ILE 85 HA ILE 85 -4.732 7.777 13.431 693 HB ILE 85 HB ILE 85 -6.162 5.129 13.226 694 HG12 ILE 85 1HG1 ILE 85 -7.498 6.616 15.122 695 HG13 ILE 85 2HG1 ILE 85 -7.164 7.807 13.869 696 HG21 ILE 85 1HG2 ILE 85 -5.769 4.959 15.588 697 HG22 ILE 85 2HG2 ILE 85 -4.235 5.293 14.785 698 HG23 ILE 85 3HG2 ILE 85 -5.085 6.583 15.635 699 HD11 ILE 85 3HD1 ILE 85 -8.082 5.615 12.468 700 HD12 ILE 85 1HD1 ILE 85 -9.089 5.653 13.914 701 HD13 ILE 85 2HD1 ILE 85 -8.996 7.069 12.867 702 H ASP 86 H ASP 86 -5.041 4.933 11.300 703 HA ASP 86 HA ASP 86 -2.631 3.716 11.873 704 HB2 ASP 86 1HB ASP 86 -4.248 3.815 9.331 705 HB3 ASP 86 2HB ASP 86 -2.781 2.850 9.465 706 H TYR 87 H TYR 87 -3.296 6.387 9.676 707 HA TYR 87 HA TYR 87 -0.581 6.469 8.694 708 HB2 TYR 87 1HB TYR 87 -2.673 7.135 7.382 709 HB3 TYR 87 2HB TYR 87 -2.671 8.612 8.337 710 HD1 TYR 87 HD1 TYR 87 0.070 6.663 6.705 711 HD2 TYR 87 HD2 TYR 87 -1.991 10.373 7.007 712 HE1 TYR 87 HE1 TYR 87 1.668 7.672 5.130 713 HE2 TYR 87 HE2 TYR 87 -0.401 11.391 5.432 714 HH TYR 87 HH TYR 87 1.149 10.484 3.535 715 H GLY 88 H GLY 88 -2.580 8.269 10.978 716 HA2 GLY 88 1HA GLY 88 -0.860 10.411 11.482 717 HA3 GLY 88 2HA GLY 88 -2.029 9.768 12.626 718 H THR 89 H THR 89 -0.864 7.145 12.797 719 HA THR 89 HA THR 89 1.393 7.813 14.537 720 HB THR 89 HB THR 89 -0.323 6.538 15.635 721 HG1 THR 89 HG1 THR 89 0.948 4.632 16.165 722 HG21 THR 89 3HG2 THR 89 -0.314 4.014 14.475 723 HG22 THR 89 1HG2 THR 89 -0.404 5.121 13.106 724 HG23 THR 89 2HG2 THR 89 -1.612 5.204 14.389 725 H MET 90 H MET 90 0.629 6.164 11.593 726 HA MET 90 HA MET 90 1.892 5.067 10.052 727 HB2 MET 90 1HB MET 90 3.794 6.919 11.377 728 HB3 MET 90 2HB MET 90 4.492 5.643 10.389 729 HG2 MET 90 1HG MET 90 3.546 6.450 8.441 730 HG3 MET 90 2HG MET 90 2.300 7.352 9.303 731 HE1 MET 90 3HE MET 90 6.731 8.577 9.397 732 HE2 MET 90 1HE MET 90 5.984 7.770 10.776 733 HE3 MET 90 2HE MET 90 6.109 6.935 9.227 734 H ASN 91 H ASN 91 1.212 3.145 11.374 735 HA ASN 91 HA ASN 91 3.486 1.870 12.729 736 HB2 ASN 91 1HB ASN 91 1.760 0.271 13.595 737 HB3 ASN 91 2HB ASN 91 1.520 1.937 14.113 738 HD21 ASN 91 2HD2 ASN 91 -0.583 0.412 14.380 739 HD22 ASN 91 1HD2 ASN 91 -1.764 0.701 13.152 740 H GLY 92 H GLY 92 4.685 0.789 11.279 741 HA2 GLY 92 1HA GLY 92 3.919 -0.226 8.830 742 HA3 GLY 92 2HA GLY 92 5.257 -0.855 9.780 743 H GLU 93 H GLU 93 3.651 -1.747 11.997 744 HA GLU 93 HA GLU 93 3.153 -4.362 11.294 745 HB2 GLU 93 1HB GLU 93 3.276 -3.260 13.628 746 HB3 GLU 93 2HB GLU 93 1.549 -2.993 13.437 747 HG2 GLU 93 1HG GLU 93 1.566 -5.567 12.870 748 HG3 GLU 93 2HG GLU 93 3.047 -5.523 13.825 749 H LYS 94 H LYS 94 0.660 -1.863 11.820 750 HA LYS 94 HA LYS 94 -1.459 -3.435 10.804 751 HB2 LYS 94 1HB LYS 94 -1.107 -0.519 11.410 752 HB3 LYS 94 2HB LYS 94 -2.549 -1.070 10.568 753 HG2 LYS 94 1HG LYS 94 -1.622 -2.058 13.257 754 HG3 LYS 94 2HG LYS 94 -2.896 -0.869 12.983 755 HD2 LYS 94 1HD LYS 94 -4.068 -2.623 11.595 756 HD3 LYS 94 2HD LYS 94 -2.880 -3.779 12.205 757 HE2 LYS 94 1HE LYS 94 -3.574 -3.253 14.503 758 HE3 LYS 94 2HE LYS 94 -4.779 -2.131 13.873 759 HZ1 LYS 94 3HZ LYS 94 -6.165 -3.842 13.798 760 HZ2 LYS 94 1HZ LYS 94 -4.941 -4.950 14.168 761 HZ3 LYS 94 2HZ LYS 94 -5.223 -4.508 12.560 762 H VAL 95 H VAL 95 0.752 -1.139 9.329 763 HA VAL 95 HA VAL 95 -0.555 -0.754 6.886 764 HB VAL 95 HB VAL 95 2.420 -0.808 7.414 765 HG11 VAL 95 1HG1 VAL 95 2.483 0.710 5.411 766 HG12 VAL 95 2HG1 VAL 95 2.081 -0.973 5.066 767 HG13 VAL 95 3HG1 VAL 95 0.809 0.249 5.101 768 HG21 VAL 95 3HG2 VAL 95 0.536 0.887 8.485 769 HG22 VAL 95 1HG2 VAL 95 2.258 1.231 8.315 770 HG23 VAL 95 2HG2 VAL 95 1.122 1.779 7.081 771 H LEU 96 H LEU 96 2.223 -2.917 7.484 772 HA LEU 96 HA LEU 96 2.032 -4.291 5.050 773 HB2 LEU 96 1HB LEU 96 3.460 -5.983 6.101 774 HB3 LEU 96 2HB LEU 96 4.043 -4.343 6.376 775 HG LEU 96 HG LEU 96 2.560 -4.783 8.623 776 HD11 LEU 96 1HD1 LEU 96 2.744 -6.938 9.403 777 HD12 LEU 96 2HD1 LEU 96 4.062 -7.341 8.304 778 HD13 LEU 96 3HD1 LEU 96 2.413 -7.213 7.692 779 HD21 LEU 96 3HD2 LEU 96 5.459 -5.547 8.353 780 HD22 LEU 96 1HD2 LEU 96 4.636 -4.878 9.762 781 HD23 LEU 96 2HD2 LEU 96 4.893 -3.876 8.335 782 H GLN 97 H GLN 97 0.662 -5.002 8.233 783 HA GLN 97 HA GLN 97 -0.362 -7.532 7.741 784 HB2 GLN 97 1HB GLN 97 -1.152 -5.295 9.556 785 HB3 GLN 97 2HB GLN 97 -2.220 -6.684 9.407 786 HG2 GLN 97 1HG GLN 97 0.684 -7.063 9.998 787 HG3 GLN 97 2HG GLN 97 -0.448 -6.637 11.281 788 HE21 GLN 97 2HE2 GLN 97 0.439 -9.049 8.923 789 HE22 GLN 97 1HE2 GLN 97 -0.439 -10.354 9.636 790 H LEU 98 H LEU 98 -1.870 -4.370 7.164 791 HA LEU 98 HA LEU 98 -4.309 -5.392 6.162 792 HB2 LEU 98 1HB LEU 98 -3.467 -2.952 6.899 793 HB3 LEU 98 2HB LEU 98 -3.334 -2.791 5.150 794 HG LEU 98 HG LEU 98 -5.825 -3.392 6.739 795 HD11 LEU 98 1HD1 LEU 98 -5.373 -1.091 6.864 796 HD12 LEU 98 2HD1 LEU 98 -6.551 -1.260 5.564 797 HD13 LEU 98 3HD1 LEU 98 -4.847 -1.018 5.182 798 HD21 LEU 98 3HD2 LEU 98 -6.695 -2.951 4.228 799 HD22 LEU 98 1HD2 LEU 98 -6.399 -4.557 4.895 800 HD23 LEU 98 2HD2 LEU 98 -5.175 -3.780 3.889 801 H ALA 99 H ALA 99 -1.437 -4.104 4.494 802 HA ALA 99 HA ALA 99 -2.265 -4.424 1.878 803 HB1 ALA 99 3HB ALA 99 -0.242 -3.256 2.339 804 HB2 ALA 99 1HB ALA 99 0.486 -4.686 3.071 805 HB3 ALA 99 2HB ALA 99 0.170 -4.648 1.336 806 H ILE 100 H ILE 100 -0.404 -6.765 3.824 807 HA ILE 100 HA ILE 100 -0.370 -8.820 1.930 808 HB ILE 100 HB ILE 100 -0.344 -9.074 4.940 809 HG12 ILE 100 1HG1 ILE 100 2.040 -9.142 3.102 810 HG13 ILE 100 2HG1 ILE 100 1.431 -7.624 3.753 811 HG21 ILE 100 1HG2 ILE 100 0.975 -11.194 4.312 812 HG22 ILE 100 2HG2 ILE 100 -0.782 -11.223 4.165 813 HG23 ILE 100 3HG2 ILE 100 0.221 -11.014 2.729 814 HD11 ILE 100 3HD1 ILE 100 1.641 -8.830 6.041 815 HD12 ILE 100 1HD1 ILE 100 2.733 -9.902 5.165 816 HD13 ILE 100 2HD1 ILE 100 3.077 -8.174 5.255 817 H ASN 101 H ASN 101 -2.622 -8.243 4.623 818 HA ASN 101 HA ASN 101 -4.230 -10.470 4.364 819 HB2 ASN 101 1HB ASN 101 -4.650 -7.701 5.372 820 HB3 ASN 101 2HB ASN 101 -6.084 -8.686 5.095 821 HD21 ASN 101 2HD2 ASN 101 -6.310 -8.404 7.432 822 HD22 ASN 101 1HD2 ASN 101 -5.495 -9.509 8.480 823 H ALA 102 H ALA 102 -4.397 -7.413 2.592 824 HA ALA 102 HA ALA 102 -6.749 -8.064 1.135 825 HB1 ALA 102 3HB ALA 102 -6.601 -5.889 0.730 826 HB2 ALA 102 1HB ALA 102 -4.943 -5.850 1.330 827 HB3 ALA 102 2HB ALA 102 -5.259 -6.217 -0.367 828 H PHE 103 H PHE 103 -3.289 -8.321 0.431 829 HA PHE 103 HA PHE 103 -3.426 -9.071 -2.239 830 HB2 PHE 103 1HB PHE 103 -1.313 -8.537 -1.159 831 HB3 PHE 103 2HB PHE 103 -1.455 -9.952 -0.120 832 HD1 PHE 103 HD2 PHE 103 -0.895 -8.817 -3.578 833 HD2 PHE 103 HD1 PHE 103 -0.834 -12.109 -0.880 834 HE1 PHE 103 HE2 PHE 103 0.308 -10.160 -5.251 835 HE2 PHE 103 HE1 PHE 103 0.370 -13.458 -2.549 836 HZ PHE 103 HZ PHE 103 0.941 -12.485 -4.739 837 H ASN 104 H ASN 104 -3.352 -11.177 0.634 838 HA ASN 104 HA ASN 104 -3.691 -13.585 -0.824 839 HB2 ASN 104 1HB ASN 104 -3.895 -12.812 2.064 840 HB3 ASN 104 2HB ASN 104 -4.475 -14.394 1.550 841 HD21 ASN 104 2HD2 ASN 104 -2.418 -14.152 3.337 842 HD22 ASN 104 1HD2 ASN 104 -0.946 -14.681 2.602 843 H ASN 105 H ASN 105 -5.956 -11.562 1.024 844 HA ASN 105 HA ASN 105 -8.249 -13.079 0.755 845 HB2 ASN 105 1HB ASN 105 -7.984 -10.969 2.106 846 HB3 ASN 105 2HB ASN 105 -8.166 -10.060 0.608 847 HD21 ASN 105 2HD2 ASN 105 -9.748 -11.506 3.190 848 HD22 ASN 105 1HD2 ASN 105 -11.365 -11.389 2.596 849 H LYS 106 H LYS 106 -6.995 -10.599 -1.460 850 HA LYS 106 HA LYS 106 -7.432 -10.139 -3.644 851 HB2 LYS 106 1HB LYS 106 -8.020 -13.093 -3.557 852 HB3 LYS 106 2HB LYS 106 -8.118 -12.168 -5.049 853 HG2 LYS 106 1HG LYS 106 -5.679 -11.428 -4.266 854 HG3 LYS 106 2HG LYS 106 -5.756 -13.009 -3.487 855 HD2 LYS 106 1HD LYS 106 -5.045 -13.777 -5.477 856 HD3 LYS 106 2HD LYS 106 -6.731 -13.584 -5.960 857 HE2 LYS 106 1HE LYS 106 -6.311 -11.577 -7.064 858 HE3 LYS 106 2HE LYS 106 -4.800 -11.306 -6.199 859 HZ1 LYS 106 3HZ LYS 106 -3.713 -12.292 -7.837 860 HZ2 LYS 106 1HZ LYS 106 -5.160 -12.513 -8.686 861 HZ3 LYS 106 2HZ LYS 106 -4.607 -13.713 -7.631 862 H SER 107 H SER 107 -9.516 -9.637 -1.738 863 HA SER 107 HA SER 107 -11.628 -8.981 -3.446 864 HB2 SER 107 1HB SER 107 -13.338 -10.577 -2.265 865 HB3 SER 107 2HB SER 107 -12.392 -11.170 -3.630 866 HG SER 107 HG SER 107 -12.066 -12.702 -2.154 867 H SER 108 H SER 108 -10.835 -7.160 -2.068 868 HA SER 108 HA SER 108 -11.429 -7.066 0.700 869 HB2 SER 108 1HB SER 108 -10.888 -4.927 -1.358 870 HB3 SER 108 2HB SER 108 -11.224 -4.541 0.329 871 HG SER 108 HG SER 108 -9.442 -6.133 0.742 872 H VAL 109 H VAL 109 -13.255 -6.609 1.762 873 HA VAL 109 HA VAL 109 -15.438 -6.128 2.190 874 HB VAL 109 HB VAL 109 -15.345 -4.430 -0.306 875 HG11 VAL 109 1HG1 VAL 109 -17.330 -4.914 1.768 876 HG12 VAL 109 2HG1 VAL 109 -16.954 -3.202 1.559 877 HG13 VAL 109 3HG1 VAL 109 -17.508 -4.160 0.184 878 HG21 VAL 109 3HG2 VAL 109 -13.613 -3.501 0.876 879 HG22 VAL 109 1HG2 VAL 109 -14.975 -2.619 1.566 880 HG23 VAL 109 2HG2 VAL 109 -14.274 -3.982 2.438 Start of MODEL 16 1 H1 GLY 1 H GLY 1 12.672 -17.231 -11.548 2 HA2 GLY 1 1HA GLY 1 9.775 -16.857 -11.952 3 HA3 GLY 1 2HA GLY 1 10.374 -18.188 -10.973 4 HA PRO 2 HA PRO 2 11.385 -14.082 -8.593 5 HB2 PRO 2 1HB PRO 2 10.092 -11.864 -9.474 6 HB3 PRO 2 2HB PRO 2 11.690 -12.339 -10.059 7 HG2 PRO 2 1HG PRO 2 9.009 -12.759 -11.322 8 HG3 PRO 2 2HG PRO 2 10.532 -12.250 -12.073 9 HD2 PRO 2 1HD PRO 2 9.615 -14.793 -12.221 10 HD3 PRO 2 2HD PRO 2 11.346 -14.403 -12.180 11 H GLY 3 H GLY 3 10.139 -15.124 -7.025 12 HA2 GLY 3 1HA GLY 3 7.259 -14.837 -7.017 13 HA3 GLY 3 2HA GLY 3 8.233 -15.652 -5.801 14 H SER 4 H SER 4 7.553 -14.743 -3.947 15 HA SER 4 HA SER 4 7.295 -13.197 -2.299 16 HB2 SER 4 1HB SER 4 8.933 -11.606 -2.103 17 HB3 SER 4 2HB SER 4 9.656 -12.565 -3.394 18 HG SER 4 HG SER 4 9.687 -10.641 -4.306 19 H MET 5 H MET 5 6.580 -10.791 -1.943 20 HA MET 5 HA MET 5 4.664 -10.053 -4.053 21 HB2 MET 5 1HB MET 5 3.506 -11.203 -2.199 22 HB3 MET 5 2HB MET 5 4.142 -10.010 -1.075 23 HG2 MET 5 1HG MET 5 2.883 -8.262 -2.132 24 HG3 MET 5 2HG MET 5 2.349 -9.362 -3.400 25 HE1 MET 5 3HE MET 5 1.354 -8.416 0.615 26 HE2 MET 5 1HE MET 5 1.491 -10.139 0.967 27 HE3 MET 5 2HE MET 5 2.857 -9.271 0.266 28 H ASN 6 H ASN 6 4.358 -7.882 -4.411 29 HA ASN 6 HA ASN 6 6.136 -6.076 -2.908 30 HB2 ASN 6 1HB ASN 6 5.172 -5.467 -5.684 31 HB3 ASN 6 2HB ASN 6 6.621 -4.896 -4.860 32 HD21 ASN 6 2HD2 ASN 6 5.583 -6.808 -7.264 33 HD22 ASN 6 1HD2 ASN 6 6.876 -7.953 -7.328 34 H ILE 7 H ILE 7 5.310 -4.248 -2.044 35 HA ILE 7 HA ILE 7 2.421 -3.805 -2.393 36 HB ILE 7 HB ILE 7 4.196 -3.007 -0.083 37 HG12 ILE 7 1HG1 ILE 7 2.162 -4.681 0.817 38 HG13 ILE 7 2HG1 ILE 7 2.679 -5.414 -0.698 39 HG21 ILE 7 1HG2 ILE 7 2.465 -1.380 -0.337 40 HG22 ILE 7 2HG2 ILE 7 1.245 -2.634 -0.553 41 HG23 ILE 7 3HG2 ILE 7 2.029 -2.427 1.013 42 HD11 ILE 7 3HD1 ILE 7 4.534 -6.196 0.226 43 HD12 ILE 7 1HD1 ILE 7 4.934 -4.627 0.925 44 HD13 ILE 7 2HD1 ILE 7 3.854 -5.725 1.783 45 H LEU 8 H LEU 8 1.629 -1.764 -2.805 46 HA LEU 8 HA LEU 8 3.643 0.259 -3.536 47 HB2 LEU 8 1HB LEU 8 2.161 -0.841 -5.337 48 HB3 LEU 8 2HB LEU 8 0.870 0.155 -4.668 49 HG LEU 8 HG LEU 8 1.933 1.115 -6.691 50 HD11 LEU 8 1HD1 LEU 8 2.692 3.049 -4.619 51 HD12 LEU 8 2HD1 LEU 8 1.068 2.381 -4.459 52 HD13 LEU 8 3HD1 LEU 8 1.543 3.196 -5.949 53 HD21 LEU 8 3HD2 LEU 8 4.291 2.127 -5.385 54 HD22 LEU 8 1HD2 LEU 8 4.136 1.274 -6.922 55 HD23 LEU 8 2HD2 LEU 8 4.303 0.363 -5.420 56 H LEU 9 H LEU 9 3.521 2.223 -2.627 57 HA LEU 9 HA LEU 9 1.105 2.876 -1.072 58 HB2 LEU 9 1HB LEU 9 3.284 2.225 0.182 59 HB3 LEU 9 2HB LEU 9 3.825 3.836 -0.281 60 HG LEU 9 HG LEU 9 1.224 3.976 0.937 61 HD11 LEU 9 1HD1 LEU 9 3.368 2.537 2.483 62 HD12 LEU 9 2HD1 LEU 9 1.738 1.971 2.119 63 HD13 LEU 9 3HD1 LEU 9 1.974 3.322 3.227 64 HD21 LEU 9 3HD2 LEU 9 3.921 5.002 1.814 65 HD22 LEU 9 1HD2 LEU 9 2.349 5.572 2.375 66 HD23 LEU 9 2HD2 LEU 9 2.829 5.821 0.696 67 H VAL 10 H VAL 10 0.177 4.757 -1.553 68 HA VAL 10 HA VAL 10 1.624 6.605 -3.318 69 HB VAL 10 HB VAL 10 -1.340 6.551 -2.749 70 HG11 VAL 10 1HG1 VAL 10 -0.157 8.655 -3.639 71 HG12 VAL 10 2HG1 VAL 10 0.017 7.746 -5.140 72 HG13 VAL 10 3HG1 VAL 10 -1.589 8.079 -4.490 73 HG21 VAL 10 3HG2 VAL 10 -1.615 5.389 -4.857 74 HG22 VAL 10 1HG2 VAL 10 0.132 5.372 -5.103 75 HG23 VAL 10 2HG2 VAL 10 -0.582 4.444 -3.783 76 H CYS 11 H CYS 11 2.562 8.252 -2.312 77 HA CYS 11 HA CYS 11 1.102 10.089 -0.736 78 HB2 CYS 11 1HB CYS 11 1.447 8.222 0.923 79 HB3 CYS 11 2HB CYS 11 3.176 8.523 0.806 80 HG CYS 11 HG CYS 11 2.372 11.405 1.467 81 H GLY 12 H GLY 12 2.384 10.732 -2.885 82 HA2 GLY 12 1HA GLY 12 4.053 12.011 -3.811 83 HA3 GLY 12 2HA GLY 12 4.191 12.712 -2.205 84 H ALA 13 H ALA 13 6.261 12.774 -1.647 85 HA ALA 13 HA ALA 13 8.395 12.130 -1.193 86 HB1 ALA 13 3HB ALA 13 8.384 10.243 -0.028 87 HB2 ALA 13 1HB ALA 13 6.793 9.864 -0.690 88 HB3 ALA 13 2HB ALA 13 8.249 9.297 -1.509 89 H GLY 14 H GLY 14 9.390 12.972 -3.003 90 HA2 GLY 14 1HA GLY 14 9.513 11.356 -5.431 91 HA3 GLY 14 2HA GLY 14 10.107 12.999 -5.244 92 H MET 15 H MET 15 10.971 10.755 -2.790 93 HA MET 15 HA MET 15 13.503 10.086 -4.072 94 HB2 MET 15 1HB MET 15 13.424 12.301 -2.498 95 HB3 MET 15 2HB MET 15 13.807 11.066 -1.305 96 HG2 MET 15 1HG MET 15 15.580 10.392 -3.174 97 HG3 MET 15 2HG MET 15 15.417 12.104 -3.555 98 HE1 MET 15 3HE MET 15 16.416 13.733 -2.757 99 HE2 MET 15 1HE MET 15 16.991 14.054 -1.121 100 HE3 MET 15 2HE MET 15 18.050 13.260 -2.288 101 H SER 16 H SER 16 14.858 8.957 -2.045 102 HA SER 16 HA SER 16 13.115 6.723 -1.305 103 HB2 SER 16 1HB SER 16 15.801 6.911 -2.239 104 HB3 SER 16 2HB SER 16 15.839 6.216 -0.619 105 HG SER 16 HG SER 16 14.132 5.297 -2.688 106 H THR 17 H THR 17 14.217 5.609 0.820 107 HA THR 17 HA THR 17 14.355 5.671 3.091 108 HB THR 17 HB THR 17 15.211 8.554 2.868 109 HG1 THR 17 HG1 THR 17 16.613 6.175 2.261 110 HG21 THR 17 3HG2 THR 17 15.250 8.230 5.099 111 HG22 THR 17 1HG2 THR 17 16.753 7.370 4.769 112 HG23 THR 17 2HG2 THR 17 15.244 6.473 4.946 113 H SER 18 H SER 18 12.110 5.474 3.369 114 HA SER 18 HA SER 18 10.782 7.964 4.211 115 HB2 SER 18 1HB SER 18 9.936 5.992 2.237 116 HB3 SER 18 2HB SER 18 8.724 6.239 3.493 117 HG SER 18 HG SER 18 9.975 8.363 2.094 118 H MET 19 H MET 19 9.460 7.853 6.022 119 HA MET 19 HA MET 19 10.202 6.142 8.071 120 HB2 MET 19 1HB MET 19 7.610 7.660 7.736 121 HB3 MET 19 2HB MET 19 8.161 6.936 9.240 122 HG2 MET 19 1HG MET 19 9.894 8.465 9.487 123 HG3 MET 19 2HG MET 19 9.846 8.935 7.789 124 HE1 MET 19 3HE MET 19 9.758 10.076 10.822 125 HE2 MET 19 1HE MET 19 9.627 11.645 10.027 126 HE3 MET 19 2HE MET 19 8.383 11.125 11.163 127 H LEU 20 H LEU 20 7.319 5.972 5.994 128 HA LEU 20 HA LEU 20 6.080 3.772 7.100 129 HB2 LEU 20 1HB LEU 20 6.064 5.135 4.527 130 HB3 LEU 20 2HB LEU 20 5.696 3.417 4.393 131 HG LEU 20 HG LEU 20 3.682 4.831 4.564 132 HD11 LEU 20 1HD1 LEU 20 4.333 2.744 6.586 133 HD12 LEU 20 2HD1 LEU 20 3.199 2.695 5.237 134 HD13 LEU 20 3HD1 LEU 20 2.793 3.595 6.698 135 HD21 LEU 20 3HD2 LEU 20 3.161 5.797 6.813 136 HD22 LEU 20 1HD2 LEU 20 4.450 6.624 5.937 137 HD23 LEU 20 2HD2 LEU 20 4.846 5.522 7.255 138 H VAL 21 H VAL 21 8.074 3.577 4.148 139 HA VAL 21 HA VAL 21 8.367 0.835 4.079 140 HB VAL 21 HB VAL 21 9.065 2.287 2.237 141 HG11 VAL 21 1HG1 VAL 21 11.368 3.030 4.038 142 HG12 VAL 21 2HG1 VAL 21 11.221 3.467 2.335 143 HG13 VAL 21 3HG1 VAL 21 10.066 4.094 3.511 144 HG21 VAL 21 3HG2 VAL 21 10.174 -0.066 2.934 145 HG22 VAL 21 1HG2 VAL 21 10.575 0.803 1.451 146 HG23 VAL 21 2HG2 VAL 21 11.617 0.947 2.867 147 H GLN 22 H GLN 22 10.082 3.183 6.022 148 HA GLN 22 HA GLN 22 12.265 1.617 6.813 149 HB2 GLN 22 1HB GLN 22 11.049 4.118 7.601 150 HB3 GLN 22 2HB GLN 22 11.588 3.220 9.013 151 HG2 GLN 22 1HG GLN 22 13.406 3.593 6.672 152 HG3 GLN 22 2HG GLN 22 13.202 4.873 7.867 153 HE21 GLN 22 2HE2 GLN 22 15.205 4.799 8.751 154 HE22 GLN 22 1HE2 GLN 22 15.826 3.443 9.623 155 H ARG 23 H ARG 23 9.398 2.350 8.808 156 HA ARG 23 HA ARG 23 9.843 0.420 10.749 157 HB2 ARG 23 1HB ARG 23 7.145 1.388 9.786 158 HB3 ARG 23 2HB ARG 23 7.506 0.683 11.356 159 HG2 ARG 23 1HG ARG 23 8.999 2.606 11.821 160 HG3 ARG 23 2HG ARG 23 8.477 3.325 10.296 161 HD2 ARG 23 1HD ARG 23 6.844 2.768 12.758 162 HD3 ARG 23 2HD ARG 23 7.146 4.318 11.974 163 HE ARG 23 HE ARG 23 5.087 2.464 11.339 164 HH11 ARG 23 1HH1 ARG 23 7.254 4.796 9.931 165 HH12 ARG 23 2HH1 ARG 23 6.217 5.141 8.586 166 HH21 ARG 23 1HH2 ARG 23 3.712 2.910 9.576 167 HH22 ARG 23 2HH2 ARG 23 4.202 4.070 8.386 168 H ILE 24 H ILE 24 7.839 0.185 7.819 169 HA ILE 24 HA ILE 24 6.892 -2.402 8.172 170 HB ILE 24 HB ILE 24 7.594 -1.035 5.571 171 HG12 ILE 24 1HG1 ILE 24 4.799 -1.306 6.550 172 HG13 ILE 24 2HG1 ILE 24 5.821 -0.127 7.366 173 HG21 ILE 24 1HG2 ILE 24 7.367 -3.306 5.048 174 HG22 ILE 24 2HG2 ILE 24 6.042 -3.527 6.188 175 HG23 ILE 24 3HG2 ILE 24 5.783 -2.613 4.702 176 HD11 ILE 24 3HD1 ILE 24 6.157 0.198 4.570 177 HD12 ILE 24 1HD1 ILE 24 4.431 0.134 4.922 178 HD13 ILE 24 2HD1 ILE 24 5.455 1.316 5.739 179 H GLU 25 H GLU 25 9.856 -1.316 6.536 180 HA GLU 25 HA GLU 25 10.758 -3.830 5.708 181 HB2 GLU 25 1HB GLU 25 12.091 -1.207 6.249 182 HB3 GLU 25 2HB GLU 25 13.083 -2.627 5.949 183 HG2 GLU 25 1HG GLU 25 10.884 -1.930 4.059 184 HG3 GLU 25 2HG GLU 25 12.417 -1.063 3.989 185 H LYS 26 H LYS 26 11.317 -2.053 8.718 186 HA LYS 26 HA LYS 26 13.165 -3.806 9.875 187 HB2 LYS 26 1HB LYS 26 11.422 -1.630 10.786 188 HB3 LYS 26 2HB LYS 26 11.754 -2.833 12.025 189 HG2 LYS 26 1HG LYS 26 13.918 -1.511 10.412 190 HG3 LYS 26 2HG LYS 26 13.320 -0.865 11.943 191 HD2 LYS 26 1HD LYS 26 13.793 -3.370 12.719 192 HD3 LYS 26 2HD LYS 26 14.962 -3.277 11.401 193 HE2 LYS 26 1HE LYS 26 15.874 -1.210 12.423 194 HE3 LYS 26 2HE LYS 26 14.767 -1.429 13.777 195 HZ1 LYS 26 3HZ LYS 26 16.952 -2.292 14.299 196 HZ2 LYS 26 1HZ LYS 26 16.903 -3.323 12.959 197 HZ3 LYS 26 2HZ LYS 26 15.829 -3.556 14.244 198 H TYR 27 H TYR 27 9.660 -3.596 10.524 199 HA TYR 27 HA TYR 27 9.416 -5.823 12.133 200 HB2 TYR 27 1HB TYR 27 7.559 -4.334 11.891 201 HB3 TYR 27 2HB TYR 27 7.467 -4.630 10.159 202 HD1 TYR 27 HD2 TYR 27 6.528 -6.729 9.304 203 HD2 TYR 27 HD1 TYR 27 6.606 -5.883 13.473 204 HE1 TYR 27 HE2 TYR 27 4.892 -8.523 9.694 205 HE2 TYR 27 HE1 TYR 27 4.972 -7.676 13.874 206 HH TYR 27 HH TYR 27 3.335 -9.286 11.269 207 H ALA 28 H ALA 28 8.855 -5.699 8.612 208 HA ALA 28 HA ALA 28 8.409 -8.405 8.195 209 HB1 ALA 28 3HB ALA 28 7.993 -7.477 6.213 210 HB2 ALA 28 1HB ALA 28 9.036 -6.095 6.557 211 HB3 ALA 28 2HB ALA 28 9.727 -7.584 5.908 212 H LYS 29 H LYS 29 11.489 -6.636 7.873 213 HA LYS 29 HA LYS 29 13.136 -8.751 7.216 214 HB2 LYS 29 1HB LYS 29 13.849 -6.392 7.232 215 HB3 LYS 29 2HB LYS 29 13.814 -6.398 8.990 216 HG2 LYS 29 1HG LYS 29 15.445 -8.528 8.408 217 HG3 LYS 29 2HG LYS 29 15.860 -7.353 7.158 218 HD2 LYS 29 1HD LYS 29 15.732 -5.795 9.406 219 HD3 LYS 29 2HD LYS 29 16.388 -7.308 10.036 220 HE2 LYS 29 1HE LYS 29 17.915 -7.095 7.873 221 HE3 LYS 29 2HE LYS 29 17.552 -5.384 8.093 222 HZ1 LYS 29 3HZ LYS 29 19.393 -5.576 9.390 223 HZ2 LYS 29 1HZ LYS 29 19.097 -7.191 9.798 224 HZ3 LYS 29 2HZ LYS 29 18.222 -5.955 10.551 225 H SER 30 H SER 30 11.942 -7.776 10.378 226 HA SER 30 HA SER 30 13.587 -9.553 11.874 227 HB2 SER 30 1HB SER 30 11.309 -7.752 12.425 228 HB3 SER 30 2HB SER 30 11.467 -9.128 13.517 229 HG SER 30 HG SER 30 12.903 -7.918 14.461 230 H LYS 31 H LYS 31 10.262 -9.723 10.664 231 HA LYS 31 HA LYS 31 9.740 -12.298 11.780 232 HB2 LYS 31 1HB LYS 31 8.351 -10.546 9.777 233 HB3 LYS 31 2HB LYS 31 7.819 -12.203 10.025 234 HG2 LYS 31 1HG LYS 31 8.077 -10.221 12.268 235 HG3 LYS 31 2HG LYS 31 6.596 -10.433 11.331 236 HD2 LYS 31 1HD LYS 31 7.698 -12.956 12.275 237 HD3 LYS 31 2HD LYS 31 7.313 -11.846 13.593 238 HE2 LYS 31 1HE LYS 31 5.120 -12.142 13.318 239 HE3 LYS 31 2HE LYS 31 5.233 -11.895 11.576 240 HZ1 LYS 31 3HZ LYS 31 6.336 -14.397 12.217 241 HZ2 LYS 31 1HZ LYS 31 4.973 -14.058 11.274 242 HZ3 LYS 31 2HZ LYS 31 4.811 -14.286 12.941 243 H ASN 32 H ASN 32 11.492 -11.230 9.081 244 HA ASN 32 HA ASN 32 12.582 -12.321 7.410 245 HB2 ASN 32 1HB ASN 32 12.962 -13.943 9.408 246 HB3 ASN 32 2HB ASN 32 11.775 -14.961 8.597 247 HD21 ASN 32 2HD2 ASN 32 14.911 -13.436 8.303 248 HD22 ASN 32 1HD2 ASN 32 15.518 -14.485 7.071 249 H ILE 33 H ILE 33 10.160 -11.458 6.700 250 HA ILE 33 HA ILE 33 8.817 -13.689 5.345 251 HB ILE 33 HB ILE 33 7.875 -10.850 5.757 252 HG12 ILE 33 1HG1 ILE 33 6.688 -13.329 6.979 253 HG13 ILE 33 2HG1 ILE 33 8.019 -12.481 7.758 254 HG21 ILE 33 1HG2 ILE 33 7.001 -11.806 3.697 255 HG22 ILE 33 2HG2 ILE 33 6.448 -13.229 4.578 256 HG23 ILE 33 3HG2 ILE 33 5.724 -11.654 4.904 257 HD11 ILE 33 3HD1 ILE 33 6.193 -11.564 8.796 258 HD12 ILE 33 1HD1 ILE 33 6.483 -10.402 7.501 259 HD13 ILE 33 2HD1 ILE 33 5.204 -11.606 7.336 260 H ASN 34 H ASN 34 8.516 -13.720 3.137 261 HA ASN 34 HA ASN 34 10.425 -12.181 1.601 262 HB2 ASN 34 1HB ASN 34 8.881 -14.644 1.235 263 HB3 ASN 34 2HB ASN 34 8.975 -13.656 -0.221 264 HD21 ASN 34 2HD2 ASN 34 11.403 -12.595 -0.193 265 HD22 ASN 34 1HD2 ASN 34 12.626 -13.816 -0.199 266 H ALA 35 H ALA 35 9.465 -10.087 1.876 267 HA ALA 35 HA ALA 35 7.502 -9.520 -0.184 268 HB1 ALA 35 3HB ALA 35 6.413 -7.988 1.762 269 HB2 ALA 35 1HB ALA 35 5.809 -9.578 1.295 270 HB3 ALA 35 2HB ALA 35 6.881 -9.414 2.688 271 H THR 36 H THR 36 7.195 -7.130 -0.449 272 HA THR 36 HA THR 36 9.334 -5.475 0.624 273 HB THR 36 HB THR 36 10.426 -6.394 -1.326 274 HG1 THR 36 HG1 THR 36 10.954 -4.273 -1.125 275 HG21 THR 36 3HG2 THR 36 8.087 -5.369 -2.938 276 HG22 THR 36 1HG2 THR 36 8.374 -7.063 -2.542 277 HG23 THR 36 2HG2 THR 36 9.516 -6.190 -3.563 278 H ILE 37 H ILE 37 9.039 -3.198 0.177 279 HA ILE 37 HA ILE 37 6.375 -2.464 -0.811 280 HB ILE 37 HB ILE 37 6.301 -2.613 1.676 281 HG12 ILE 37 1HG1 ILE 37 6.045 0.289 1.069 282 HG13 ILE 37 2HG1 ILE 37 5.119 -0.828 0.073 283 HG21 ILE 37 1HG2 ILE 37 7.817 -0.125 2.027 284 HG22 ILE 37 2HG2 ILE 37 7.751 -1.567 3.037 285 HG23 ILE 37 3HG2 ILE 37 8.791 -1.536 1.614 286 HD11 ILE 37 3HD1 ILE 37 3.571 -0.617 1.663 287 HD12 ILE 37 1HD1 ILE 37 4.575 -1.747 2.571 288 HD13 ILE 37 2HD1 ILE 37 4.728 -0.011 2.848 289 H GLU 38 H GLU 38 6.189 -0.328 -1.588 290 HA GLU 38 HA GLU 38 8.568 1.341 -1.661 291 HB2 GLU 38 1HB GLU 38 8.407 -0.401 -3.665 292 HB3 GLU 38 2HB GLU 38 7.314 0.812 -4.313 293 HG2 GLU 38 1HG GLU 38 8.966 2.282 -4.722 294 HG3 GLU 38 2HG GLU 38 9.877 1.825 -3.284 295 H ALA 39 H ALA 39 8.139 3.499 -2.068 296 HA ALA 39 HA ALA 39 5.287 4.204 -2.312 297 HB1 ALA 39 3HB ALA 39 5.753 6.172 -0.920 298 HB2 ALA 39 1HB ALA 39 6.092 4.664 -0.071 299 HB3 ALA 39 2HB ALA 39 7.418 5.626 -0.723 300 H ILE 40 H ILE 40 4.718 5.765 -3.749 301 HA ILE 40 HA ILE 40 6.740 7.433 -4.994 302 HB ILE 40 HB ILE 40 5.983 6.779 -7.300 303 HG12 ILE 40 1HG1 ILE 40 5.241 4.082 -6.648 304 HG13 ILE 40 2HG1 ILE 40 4.160 5.197 -5.820 305 HG21 ILE 40 1HG2 ILE 40 8.123 6.048 -6.242 306 HG22 ILE 40 2HG2 ILE 40 7.319 4.550 -5.776 307 HG23 ILE 40 3HG2 ILE 40 7.515 4.952 -7.482 308 HD11 ILE 40 3HD1 ILE 40 4.141 6.308 -8.245 309 HD12 ILE 40 1HD1 ILE 40 4.472 4.637 -8.697 310 HD13 ILE 40 2HD1 ILE 40 3.029 5.029 -7.760 311 H ALA 41 H ALA 41 5.505 8.637 -6.952 312 HA ALA 41 HA ALA 41 3.324 10.020 -5.654 313 HB1 ALA 41 3HB ALA 41 4.785 11.489 -6.707 314 HB2 ALA 41 1HB ALA 41 4.912 10.484 -8.151 315 HB3 ALA 41 2HB ALA 41 3.432 11.391 -7.835 316 H GLU 42 H GLU 42 1.587 10.793 -7.463 317 HA GLU 42 HA GLU 42 0.219 8.326 -8.186 318 HB2 GLU 42 1HB GLU 42 -1.746 9.724 -8.510 319 HB3 GLU 42 2HB GLU 42 -1.009 10.063 -6.949 320 HG2 GLU 42 1HG GLU 42 -0.842 12.204 -7.455 321 HG3 GLU 42 2HG GLU 42 0.110 11.820 -8.890 322 H THR 43 H THR 43 2.420 10.192 -9.656 323 HA THR 43 HA THR 43 1.173 10.380 -12.268 324 HB THR 43 HB THR 43 2.661 12.180 -11.635 325 HG1 THR 43 HG1 THR 43 4.236 11.888 -13.439 326 HG21 THR 43 3HG2 THR 43 4.756 10.023 -11.364 327 HG22 THR 43 1HG2 THR 43 4.118 11.050 -10.080 328 HG23 THR 43 2HG2 THR 43 5.099 11.754 -11.366 329 H ARG 44 H ARG 44 3.430 8.325 -10.569 330 HA ARG 44 HA ARG 44 3.744 6.700 -13.006 331 HB2 ARG 44 1HB ARG 44 5.570 7.081 -10.637 332 HB3 ARG 44 2HB ARG 44 5.769 5.758 -11.779 333 HG2 ARG 44 1HG ARG 44 6.335 7.191 -13.527 334 HG3 ARG 44 2HG ARG 44 5.668 8.604 -12.705 335 HD2 ARG 44 1HD ARG 44 7.467 8.200 -10.936 336 HD3 ARG 44 2HD ARG 44 8.208 7.115 -12.111 337 HE ARG 44 HE ARG 44 7.670 9.641 -13.276 338 HH11 ARG 44 1HH1 ARG 44 9.847 8.022 -11.095 339 HH12 ARG 44 2HH1 ARG 44 11.171 9.093 -11.414 340 HH21 ARG 44 1HH2 ARG 44 9.404 11.059 -13.704 341 HH22 ARG 44 2HH2 ARG 44 10.917 10.822 -12.897 342 H LEU 45 H LEU 45 1.677 6.753 -10.730 343 HA LEU 45 HA LEU 45 1.980 4.314 -9.303 344 HB2 LEU 45 1HB LEU 45 0.565 5.884 -8.313 345 HB3 LEU 45 2HB LEU 45 -0.311 6.175 -9.814 346 HG LEU 45 HG LEU 45 -0.514 3.468 -8.614 347 HD11 LEU 45 1HD1 LEU 45 -1.183 5.885 -7.174 348 HD12 LEU 45 2HD1 LEU 45 -1.200 4.207 -6.634 349 HD13 LEU 45 3HD1 LEU 45 -2.603 4.880 -7.463 350 HD21 LEU 45 3HD2 LEU 45 -2.972 4.089 -9.321 351 HD22 LEU 45 1HD2 LEU 45 -1.774 3.598 -10.520 352 HD23 LEU 45 2HD2 LEU 45 -2.145 5.308 -10.293 353 H SER 46 H SER 46 0.209 5.223 -12.232 354 HA SER 46 HA SER 46 -0.923 2.628 -12.622 355 HB2 SER 46 1HB SER 46 -2.121 4.427 -13.596 356 HB3 SER 46 2HB SER 46 -0.677 5.069 -14.378 357 HG SER 46 HG SER 46 -2.352 3.659 -15.581 358 H GLU 47 H GLU 47 2.120 4.042 -13.283 359 HA GLU 47 HA GLU 47 2.797 2.180 -15.403 360 HB2 GLU 47 1HB GLU 47 4.180 4.477 -14.075 361 HB3 GLU 47 2HB GLU 47 5.131 3.303 -14.974 362 HG2 GLU 47 1HG GLU 47 4.318 3.966 -16.981 363 HG3 GLU 47 2HG GLU 47 2.747 4.420 -16.321 364 H VAL 48 H VAL 48 3.113 2.451 -11.974 365 HA VAL 48 HA VAL 48 5.092 0.296 -11.873 366 HB VAL 48 HB VAL 48 5.276 0.762 -9.498 367 HG11 VAL 48 1HG1 VAL 48 6.779 2.248 -10.186 368 HG12 VAL 48 2HG1 VAL 48 5.785 2.701 -11.573 369 HG13 VAL 48 3HG1 VAL 48 5.537 3.487 -10.014 370 HG21 VAL 48 3HG2 VAL 48 3.026 2.706 -9.987 371 HG22 VAL 48 1HG2 VAL 48 3.020 1.299 -8.924 372 HG23 VAL 48 2HG2 VAL 48 4.019 2.698 -8.530 373 H VAL 49 H VAL 49 1.745 1.004 -11.145 374 HA VAL 49 HA VAL 49 1.085 -1.132 -9.501 375 HB VAL 49 HB VAL 49 -0.435 0.755 -10.110 376 HG11 VAL 49 1HG1 VAL 49 -1.079 -0.840 -12.578 377 HG12 VAL 49 2HG1 VAL 49 -1.657 0.767 -12.133 378 HG13 VAL 49 3HG1 VAL 49 0.031 0.530 -12.586 379 HG21 VAL 49 3HG2 VAL 49 -1.840 -0.614 -9.051 380 HG22 VAL 49 1HG2 VAL 49 -2.370 -1.163 -10.640 381 HG23 VAL 49 2HG2 VAL 49 -1.106 -2.042 -9.779 382 H ASP 50 H ASP 50 1.798 -1.080 -12.893 383 HA ASP 50 HA ASP 50 0.559 -3.507 -13.637 384 HB2 ASP 50 1HB ASP 50 1.679 -1.575 -15.065 385 HB3 ASP 50 2HB ASP 50 3.085 -2.630 -14.965 386 H ARG 51 H ARG 51 3.487 -2.785 -11.944 387 HA ARG 51 HA ARG 51 4.452 -5.534 -12.246 388 HB2 ARG 51 1HB ARG 51 5.752 -3.101 -11.011 389 HB3 ARG 51 2HB ARG 51 6.493 -4.692 -11.105 390 HG2 ARG 51 1HG ARG 51 5.677 -4.065 -13.713 391 HG3 ARG 51 2HG ARG 51 6.420 -2.604 -13.062 392 HD2 ARG 51 1HD ARG 51 8.178 -4.475 -12.218 393 HD3 ARG 51 2HD ARG 51 7.618 -5.212 -13.718 394 HE ARG 51 HE ARG 51 9.299 -2.912 -13.453 395 HH11 ARG 51 1HH1 ARG 51 6.941 -4.477 -15.480 396 HH12 ARG 51 2HH1 ARG 51 7.496 -3.717 -16.935 397 HH21 ARG 51 1HH2 ARG 51 10.038 -1.906 -15.361 398 HH22 ARG 51 2HH2 ARG 51 9.258 -2.256 -16.867 399 H PHE 52 H PHE 52 3.569 -3.187 -9.737 400 HA PHE 52 HA PHE 52 3.967 -4.936 -7.550 401 HB2 PHE 52 1HB PHE 52 2.415 -2.381 -7.902 402 HB3 PHE 52 2HB PHE 52 2.391 -3.266 -6.379 403 HD1 PHE 52 HD1 PHE 52 4.515 -3.600 -5.124 404 HD2 PHE 52 HD2 PHE 52 4.251 -1.038 -8.513 405 HE1 PHE 52 HE1 PHE 52 6.611 -2.499 -4.451 406 HE2 PHE 52 HE2 PHE 52 6.346 0.066 -7.847 407 HZ PHE 52 HZ PHE 52 7.530 -0.664 -5.813 408 H ASP 53 H ASP 53 1.984 -5.327 -6.011 409 HA ASP 53 HA ASP 53 -0.174 -6.531 -7.618 410 HB2 ASP 53 1HB ASP 53 1.387 -7.634 -5.309 411 HB3 ASP 53 2HB ASP 53 -0.274 -8.162 -5.569 412 H VAL 54 H VAL 54 0.705 -5.142 -4.481 413 HA VAL 54 HA VAL 54 -2.142 -4.574 -3.992 414 HB VAL 54 HB VAL 54 0.094 -4.502 -1.965 415 HG11 VAL 54 1HG1 VAL 54 -2.189 -4.937 -0.587 416 HG12 VAL 54 2HG1 VAL 54 -1.505 -3.337 -0.882 417 HG13 VAL 54 3HG1 VAL 54 -2.797 -3.950 -1.915 418 HG21 VAL 54 3HG2 VAL 54 -1.738 -6.728 -2.793 419 HG22 VAL 54 1HG2 VAL 54 0.011 -6.755 -2.571 420 HG23 VAL 54 2HG2 VAL 54 -1.055 -6.657 -1.169 421 H VAL 55 H VAL 55 -2.807 -2.507 -3.433 422 HA VAL 55 HA VAL 55 -0.799 -0.369 -3.707 423 HB VAL 55 HB VAL 55 -3.605 -0.212 -4.809 424 HG11 VAL 55 1HG1 VAL 55 -1.202 1.584 -5.129 425 HG12 VAL 55 2HG1 VAL 55 -2.755 1.796 -5.940 426 HG13 VAL 55 3HG1 VAL 55 -2.649 1.935 -4.185 427 HG21 VAL 55 3HG2 VAL 55 -1.028 -0.655 -6.315 428 HG22 VAL 55 1HG2 VAL 55 -2.269 -1.875 -6.032 429 HG23 VAL 55 2HG2 VAL 55 -2.633 -0.461 -7.019 430 H LEU 56 H LEU 56 -1.139 1.490 -2.484 431 HA LEU 56 HA LEU 56 -3.414 1.492 -0.638 432 HB2 LEU 56 1HB LEU 56 -0.506 1.629 0.110 433 HB3 LEU 56 2HB LEU 56 -1.783 2.220 1.171 434 HG LEU 56 HG LEU 56 -2.524 -0.394 0.486 435 HD11 LEU 56 1HD1 LEU 56 0.406 -0.063 0.664 436 HD12 LEU 56 2HD1 LEU 56 -0.552 -1.288 -0.165 437 HD13 LEU 56 3HD1 LEU 56 -0.298 -1.397 1.576 438 HD21 LEU 56 3HD2 LEU 56 -2.517 1.115 2.682 439 HD22 LEU 56 1HD2 LEU 56 -1.107 0.117 3.036 440 HD23 LEU 56 2HD2 LEU 56 -2.671 -0.642 2.737 441 H LEU 57 H LEU 57 -4.002 3.536 0.153 442 HA LEU 57 HA LEU 57 -2.670 5.813 -1.160 443 HB2 LEU 57 1HB LEU 57 -4.707 5.517 -2.315 444 HB3 LEU 57 2HB LEU 57 -5.600 5.241 -0.821 445 HG LEU 57 HG LEU 57 -5.257 7.622 -0.227 446 HD11 LEU 57 1HD1 LEU 57 -3.758 8.850 -1.297 447 HD12 LEU 57 2HD1 LEU 57 -4.668 8.664 -2.796 448 HD13 LEU 57 3HD1 LEU 57 -3.409 7.502 -2.379 449 HD21 LEU 57 3HD2 LEU 57 -7.321 6.913 -1.294 450 HD22 LEU 57 1HD2 LEU 57 -6.587 7.108 -2.886 451 HD23 LEU 57 2HD2 LEU 57 -6.856 8.518 -1.861 452 H ALA 58 H ALA 58 -2.179 7.520 0.096 453 HA ALA 58 HA ALA 58 -2.430 7.262 2.936 454 HB1 ALA 58 3HB ALA 58 -0.660 8.525 1.294 455 HB2 ALA 58 1HB ALA 58 -1.607 9.879 1.910 456 HB3 ALA 58 2HB ALA 58 -0.792 8.790 3.033 457 HA PRO 59 HA PRO 59 -6.061 9.576 3.775 458 HB2 PRO 59 1HB PRO 59 -5.355 10.990 5.983 459 HB3 PRO 59 2HB PRO 59 -5.640 9.245 6.010 460 HG2 PRO 59 1HG PRO 59 -3.050 10.740 5.877 461 HG3 PRO 59 2HG PRO 59 -3.470 9.315 6.846 462 HD2 PRO 59 1HD PRO 59 -2.057 9.146 4.541 463 HD3 PRO 59 2HD PRO 59 -3.168 7.868 5.076 464 H GLN 60 H GLN 60 -6.820 11.890 4.359 465 HA GLN 60 HA GLN 60 -7.041 14.067 3.742 466 HB2 GLN 60 1HB GLN 60 -4.044 14.082 3.380 467 HB3 GLN 60 2HB GLN 60 -5.089 15.459 3.701 468 HG2 GLN 60 1HG GLN 60 -5.667 14.076 5.868 469 HG3 GLN 60 2HG GLN 60 -4.084 13.367 5.547 470 HE21 GLN 60 2HE2 GLN 60 -3.321 14.295 7.485 471 HE22 GLN 60 1HE2 GLN 60 -2.917 15.972 7.574 472 H SER 61 H SER 61 -7.825 12.588 1.787 473 HA SER 61 HA SER 61 -6.574 13.728 -0.622 474 HB2 SER 61 1HB SER 61 -7.616 11.463 -1.632 475 HB3 SER 61 2HB SER 61 -5.965 11.564 -1.020 476 HG SER 61 HG SER 61 -6.510 10.414 0.689 477 H ARG 62 H ARG 62 -7.932 15.055 -1.608 478 HA ARG 62 HA ARG 62 -10.796 14.827 -1.130 479 HB2 ARG 62 1HB ARG 62 -9.057 16.941 -2.386 480 HB3 ARG 62 2HB ARG 62 -10.811 17.000 -2.496 481 HG2 ARG 62 1HG ARG 62 -11.075 17.522 -0.300 482 HG3 ARG 62 2HG ARG 62 -9.617 16.657 0.194 483 HD2 ARG 62 1HD ARG 62 -8.215 18.412 -0.487 484 HD3 ARG 62 2HD ARG 62 -9.486 19.166 -1.449 485 HE ARG 62 HE ARG 62 -10.219 19.083 1.285 486 HH11 ARG 62 1HH1 ARG 62 -8.138 20.749 -0.954 487 HH12 ARG 62 2HH1 ARG 62 -8.105 22.217 -0.033 488 HH21 ARG 62 1HH2 ARG 62 -10.184 21.009 2.506 489 HH22 ARG 62 2HH2 ARG 62 -9.269 22.363 1.935 490 H PHE 63 H PHE 63 -8.837 15.492 -4.038 491 HA PHE 63 HA PHE 63 -10.898 14.307 -5.703 492 HB2 PHE 63 1HB PHE 63 -8.794 16.234 -6.064 493 HB3 PHE 63 2HB PHE 63 -8.641 14.960 -7.270 494 HD1 PHE 63 HD1 PHE 63 -10.805 17.622 -5.969 495 HD2 PHE 63 HD2 PHE 63 -10.257 14.695 -9.010 496 HE1 PHE 63 HE1 PHE 63 -12.592 18.671 -7.297 497 HE2 PHE 63 HE2 PHE 63 -12.043 15.738 -10.342 498 HZ PHE 63 HZ PHE 63 -13.212 17.729 -9.486 499 H ASN 64 H ASN 64 -7.578 13.656 -4.718 500 HA ASN 64 HA ASN 64 -6.971 11.558 -6.434 501 HB2 ASN 64 1HB ASN 64 -5.951 12.597 -3.910 502 HB3 ASN 64 2HB ASN 64 -5.779 10.848 -4.023 503 HD21 ASN 64 2HD2 ASN 64 -5.440 13.627 -6.210 504 HD22 ASN 64 1HD2 ASN 64 -3.904 13.153 -6.843 505 H LYS 65 H LYS 65 -8.637 11.495 -3.306 506 HA LYS 65 HA LYS 65 -8.885 8.735 -3.017 507 HB2 LYS 65 1HB LYS 65 -9.428 10.162 -1.177 508 HB3 LYS 65 2HB LYS 65 -10.668 10.993 -2.107 509 HG2 LYS 65 1HG LYS 65 -12.177 9.271 -1.894 510 HG3 LYS 65 2HG LYS 65 -10.920 8.063 -1.622 511 HD2 LYS 65 1HD LYS 65 -10.590 8.753 0.602 512 HD3 LYS 65 2HD LYS 65 -11.454 10.270 0.346 513 HE2 LYS 65 1HE LYS 65 -13.425 9.332 0.812 514 HE3 LYS 65 2HE LYS 65 -13.102 7.954 -0.238 515 HZ1 LYS 65 3HZ LYS 65 -12.335 6.716 1.468 516 HZ2 LYS 65 1HZ LYS 65 -13.324 7.738 2.384 517 HZ3 LYS 65 2HZ LYS 65 -11.661 8.032 2.291 518 H LYS 66 H LYS 66 -11.299 11.007 -4.340 519 HA LYS 66 HA LYS 66 -13.153 9.105 -5.173 520 HB2 LYS 66 1HB LYS 66 -13.706 11.464 -5.077 521 HB3 LYS 66 2HB LYS 66 -12.531 11.825 -6.334 522 HG2 LYS 66 1HG LYS 66 -13.918 11.217 -7.987 523 HG3 LYS 66 2HG LYS 66 -14.562 9.845 -7.082 524 HD2 LYS 66 1HD LYS 66 -15.274 12.599 -6.197 525 HD3 LYS 66 2HD LYS 66 -16.059 11.944 -7.637 526 HE2 LYS 66 1HE LYS 66 -15.957 10.131 -5.322 527 HE3 LYS 66 2HE LYS 66 -16.943 11.574 -5.100 528 HZ1 LYS 66 3HZ LYS 66 -17.888 10.904 -7.401 529 HZ2 LYS 66 1HZ LYS 66 -18.434 10.108 -6.010 530 HZ3 LYS 66 2HZ LYS 66 -17.290 9.369 -7.013 531 H ARG 67 H ARG 67 -10.421 10.527 -6.931 532 HA ARG 67 HA ARG 67 -10.886 9.298 -9.404 533 HB2 ARG 67 1HB ARG 67 -8.629 10.649 -8.079 534 HB3 ARG 67 2HB ARG 67 -8.165 9.493 -9.321 535 HG2 ARG 67 1HG ARG 67 -10.194 10.902 -10.523 536 HG3 ARG 67 2HG ARG 67 -9.353 12.132 -9.576 537 HD2 ARG 67 1HD ARG 67 -7.246 11.528 -10.612 538 HD3 ARG 67 2HD ARG 67 -8.031 10.223 -11.499 539 HE ARG 67 HE ARG 67 -9.167 12.816 -12.000 540 HH11 ARG 67 1HH1 ARG 67 -6.696 10.543 -12.916 541 HH12 ARG 67 2HH1 ARG 67 -6.513 11.185 -14.514 542 HH21 ARG 67 1HH2 ARG 67 -8.937 13.672 -14.102 543 HH22 ARG 67 2HH2 ARG 67 -7.788 12.967 -15.187 544 H LEU 68 H LEU 68 -8.406 8.353 -7.015 545 HA LEU 68 HA LEU 68 -7.700 5.932 -8.118 546 HB2 LEU 68 1HB LEU 68 -7.560 7.148 -5.448 547 HB3 LEU 68 2HB LEU 68 -7.488 5.387 -5.465 548 HG LEU 68 HG LEU 68 -5.590 5.640 -7.147 549 HD11 LEU 68 1HD1 LEU 68 -5.819 7.879 -7.853 550 HD12 LEU 68 2HD1 LEU 68 -4.359 7.830 -6.864 551 HD13 LEU 68 3HD1 LEU 68 -5.857 8.479 -6.196 552 HD21 LEU 68 3HD2 LEU 68 -5.496 5.183 -4.594 553 HD22 LEU 68 1HD2 LEU 68 -4.884 6.834 -4.498 554 HD23 LEU 68 2HD2 LEU 68 -4.018 5.628 -5.449 555 H GLU 69 H GLU 69 -10.487 6.714 -6.146 556 HA GLU 69 HA GLU 69 -11.274 4.033 -5.617 557 HB2 GLU 69 1HB GLU 69 -12.541 6.719 -5.362 558 HB3 GLU 69 2HB GLU 69 -13.586 5.306 -5.326 559 HG2 GLU 69 1HG GLU 69 -11.365 4.847 -3.605 560 HG3 GLU 69 2HG GLU 69 -12.068 6.419 -3.228 561 H GLU 70 H GLU 70 -12.599 6.474 -7.858 562 HA GLU 70 HA GLU 70 -14.371 4.731 -9.165 563 HB2 GLU 70 1HB GLU 70 -14.602 6.445 -10.833 564 HB3 GLU 70 2HB GLU 70 -14.464 7.220 -9.261 565 HG2 GLU 70 1HG GLU 70 -12.214 7.858 -9.681 566 HG3 GLU 70 2HG GLU 70 -12.146 6.872 -11.140 567 H ILE 71 H ILE 71 -10.985 4.991 -9.328 568 HA ILE 71 HA ILE 71 -10.820 3.770 -11.976 569 HB ILE 71 HB ILE 71 -8.626 4.658 -10.099 570 HG12 ILE 71 1HG1 ILE 71 -9.261 5.926 -12.738 571 HG13 ILE 71 2HG1 ILE 71 -10.219 6.350 -11.324 572 HG21 ILE 71 1HG2 ILE 71 -7.423 4.483 -12.485 573 HG22 ILE 71 2HG2 ILE 71 -7.461 3.156 -11.325 574 HG23 ILE 71 3HG2 ILE 71 -8.610 3.190 -12.663 575 HD11 ILE 71 3HD1 ILE 71 -7.405 6.976 -11.973 576 HD12 ILE 71 1HD1 ILE 71 -8.636 7.958 -11.182 577 HD13 ILE 71 2HD1 ILE 71 -7.804 6.692 -10.279 578 H THR 72 H THR 72 -10.320 3.015 -8.591 579 HA THR 72 HA THR 72 -9.026 0.514 -9.007 580 HB THR 72 HB THR 72 -9.850 0.101 -6.583 581 HG1 THR 72 HG1 THR 72 -10.417 2.091 -5.532 582 HG21 THR 72 3HG2 THR 72 -7.839 2.012 -7.602 583 HG22 THR 72 1HG2 THR 72 -7.636 0.599 -6.568 584 HG23 THR 72 2HG2 THR 72 -8.214 2.118 -5.882 585 H LYS 73 H LYS 73 -12.380 1.502 -8.526 586 HA LYS 73 HA LYS 73 -13.605 -0.927 -8.111 587 HB2 LYS 73 1HB LYS 73 -15.096 0.811 -7.970 588 HB3 LYS 73 2HB LYS 73 -14.442 1.630 -9.383 589 HG2 LYS 73 1HG LYS 73 -16.706 0.807 -9.773 590 HG3 LYS 73 2HG LYS 73 -15.537 0.036 -10.847 591 HD2 LYS 73 1HD LYS 73 -15.825 -2.005 -9.910 592 HD3 LYS 73 2HD LYS 73 -16.058 -1.346 -8.290 593 HE2 LYS 73 1HE LYS 73 -18.172 -0.789 -10.286 594 HE3 LYS 73 2HE LYS 73 -18.035 -2.450 -9.713 595 HZ1 LYS 73 3HZ LYS 73 -19.577 -1.013 -8.410 596 HZ2 LYS 73 1HZ LYS 73 -18.240 -0.112 -7.900 597 HZ3 LYS 73 2HZ LYS 73 -18.364 -1.747 -7.488 598 HA PRO 74 HA PRO 74 -13.952 -1.606 -12.883 599 HB2 PRO 74 1HB PRO 74 -12.492 0.032 -14.481 600 HB3 PRO 74 2HB PRO 74 -14.146 0.404 -13.980 601 HG2 PRO 74 1HG PRO 74 -11.556 1.410 -12.866 602 HG3 PRO 74 2HG PRO 74 -13.050 2.303 -13.206 603 HD2 PRO 74 1HD PRO 74 -12.373 1.491 -10.713 604 HD3 PRO 74 2HD PRO 74 -14.059 1.605 -11.255 605 H LYS 75 H LYS 75 -10.804 -0.343 -11.836 606 HA LYS 75 HA LYS 75 -9.218 -2.049 -13.423 607 HB2 LYS 75 1HB LYS 75 -8.722 -0.441 -10.941 608 HB3 LYS 75 2HB LYS 75 -7.487 -1.542 -11.537 609 HG2 LYS 75 1HG LYS 75 -8.729 0.582 -13.260 610 HG3 LYS 75 2HG LYS 75 -7.302 0.870 -12.263 611 HD2 LYS 75 1HD LYS 75 -5.985 -0.582 -13.508 612 HD3 LYS 75 2HD LYS 75 -7.379 -1.445 -14.159 613 HE2 LYS 75 1HE LYS 75 -6.779 -0.211 -15.990 614 HE3 LYS 75 2HE LYS 75 -7.914 0.900 -15.225 615 HZ1 LYS 75 3HZ LYS 75 -6.289 2.345 -14.715 616 HZ2 LYS 75 1HZ LYS 75 -5.454 1.584 -15.975 617 HZ3 LYS 75 2HZ LYS 75 -5.152 1.142 -14.370 618 H GLY 76 H GLY 76 -10.975 -2.571 -10.505 619 HA2 GLY 76 1HA GLY 76 -11.170 -4.385 -9.108 620 HA3 GLY 76 2HA GLY 76 -10.790 -5.329 -10.541 621 H ILE 77 H ILE 77 -9.048 -3.224 -8.245 622 HA ILE 77 HA ILE 77 -7.060 -5.371 -7.944 623 HB ILE 77 HB ILE 77 -5.301 -3.587 -7.748 624 HG12 ILE 77 1HG1 ILE 77 -6.608 -1.639 -9.396 625 HG13 ILE 77 2HG1 ILE 77 -7.571 -1.898 -7.946 626 HG21 ILE 77 1HG2 ILE 77 -5.406 -4.928 -9.727 627 HG22 ILE 77 2HG2 ILE 77 -6.722 -3.952 -10.378 628 HG23 ILE 77 3HG2 ILE 77 -5.109 -3.258 -10.210 629 HD11 ILE 77 3HD1 ILE 77 -6.003 -0.081 -7.636 630 HD12 ILE 77 1HD1 ILE 77 -5.613 -1.428 -6.567 631 HD13 ILE 77 2HD1 ILE 77 -4.658 -1.153 -8.024 632 HA PRO 78 HA PRO 78 -7.463 -4.790 -3.611 633 HB2 PRO 78 1HB PRO 78 -4.957 -5.403 -2.764 634 HB3 PRO 78 2HB PRO 78 -6.094 -6.618 -3.360 635 HG2 PRO 78 1HG PRO 78 -3.828 -5.281 -4.788 636 HG3 PRO 78 2HG PRO 78 -4.310 -6.988 -4.805 637 HD2 PRO 78 1HD PRO 78 -4.942 -5.277 -6.805 638 HD3 PRO 78 2HD PRO 78 -5.993 -6.629 -6.337 639 H ILE 79 H ILE 79 -7.828 -2.593 -3.339 640 HA ILE 79 HA ILE 79 -5.431 -0.928 -2.925 641 HB ILE 79 HB ILE 79 -6.888 -0.138 -4.758 642 HG12 ILE 79 1HG1 ILE 79 -7.267 2.205 -3.765 643 HG13 ILE 79 2HG1 ILE 79 -6.617 1.541 -2.271 644 HG21 ILE 79 1HG2 ILE 79 -9.004 -0.997 -3.738 645 HG22 ILE 79 2HG2 ILE 79 -8.957 0.376 -2.632 646 HG23 ILE 79 3HG2 ILE 79 -9.106 0.647 -4.368 647 HD11 ILE 79 3HD1 ILE 79 -5.069 1.229 -4.792 648 HD12 ILE 79 1HD1 ILE 79 -5.072 2.783 -3.960 649 HD13 ILE 79 2HD1 ILE 79 -4.503 1.337 -3.126 650 H GLU 80 H GLU 80 -5.111 -0.019 -0.980 651 HA GLU 80 HA GLU 80 -7.272 -0.254 1.011 652 HB2 GLU 80 1HB GLU 80 -4.289 -0.530 1.415 653 HB3 GLU 80 2HB GLU 80 -5.468 -0.477 2.718 654 HG2 GLU 80 1HG GLU 80 -5.305 -2.714 2.542 655 HG3 GLU 80 2HG GLU 80 -6.522 -2.466 1.292 656 H ILE 81 H ILE 81 -7.520 1.422 2.506 657 HA ILE 81 HA ILE 81 -6.145 3.926 1.777 658 HB ILE 81 HB ILE 81 -8.886 3.715 3.019 659 HG12 ILE 81 1HG1 ILE 81 -8.948 2.714 0.795 660 HG13 ILE 81 2HG1 ILE 81 -9.764 4.274 0.778 661 HG21 ILE 81 1HG2 ILE 81 -8.965 6.092 2.015 662 HG22 ILE 81 2HG2 ILE 81 -8.065 5.829 3.508 663 HG23 ILE 81 3HG2 ILE 81 -7.207 5.960 1.972 664 HD11 ILE 81 3HD1 ILE 81 -7.566 5.225 -0.074 665 HD12 ILE 81 1HD1 ILE 81 -7.089 3.552 -0.360 666 HD13 ILE 81 2HD1 ILE 81 -8.500 4.220 -1.182 667 H ILE 82 H ILE 82 -4.659 4.385 3.262 668 HA ILE 82 HA ILE 82 -4.789 3.440 5.953 669 HB ILE 82 HB ILE 82 -2.973 5.598 4.880 670 HG12 ILE 82 1HG1 ILE 82 -2.543 2.602 4.900 671 HG13 ILE 82 2HG1 ILE 82 -2.866 3.573 3.468 672 HG21 ILE 82 1HG2 ILE 82 -2.358 3.625 7.050 673 HG22 ILE 82 2HG2 ILE 82 -1.591 5.175 6.709 674 HG23 ILE 82 3HG2 ILE 82 -3.215 5.127 7.394 675 HD11 ILE 82 3HD1 ILE 82 -0.498 3.020 3.706 676 HD12 ILE 82 1HD1 ILE 82 -0.782 4.760 3.772 677 HD13 ILE 82 2HD1 ILE 82 -0.464 3.861 5.256 678 H ASN 83 H ASN 83 -6.437 4.230 7.151 679 HA ASN 83 HA ASN 83 -7.611 6.724 7.029 680 HB2 ASN 83 1HB ASN 83 -7.410 4.606 9.101 681 HB3 ASN 83 2HB ASN 83 -7.939 6.196 9.644 682 HD21 ASN 83 2HD2 ASN 83 -9.973 6.823 9.262 683 HD22 ASN 83 1HD2 ASN 83 -11.133 5.910 8.364 684 H THR 84 H THR 84 -7.439 8.599 8.367 685 HA THR 84 HA THR 84 -4.923 9.715 8.543 686 HB THR 84 HB THR 84 -6.455 10.917 10.601 687 HG1 THR 84 HG1 THR 84 -8.379 11.295 9.156 688 HG21 THR 84 3HG2 THR 84 -6.375 12.803 9.224 689 HG22 THR 84 1HG2 THR 84 -6.414 11.842 7.745 690 HG23 THR 84 2HG2 THR 84 -4.954 11.879 8.735 691 H ILE 85 H ILE 85 -6.622 7.744 10.878 692 HA ILE 85 HA ILE 85 -4.955 8.307 13.104 693 HB ILE 85 HB ILE 85 -6.585 5.817 12.585 694 HG12 ILE 85 1HG1 ILE 85 -7.942 7.872 12.456 695 HG13 ILE 85 2HG1 ILE 85 -8.349 6.915 13.876 696 HG21 ILE 85 1HG2 ILE 85 -6.424 6.525 15.330 697 HG22 ILE 85 2HG2 ILE 85 -5.818 5.077 14.529 698 HG23 ILE 85 3HG2 ILE 85 -4.789 6.501 14.669 699 HD11 ILE 85 3HD1 ILE 85 -8.067 8.728 15.101 700 HD12 ILE 85 1HD1 ILE 85 -6.351 8.693 14.695 701 HD13 ILE 85 2HD1 ILE 85 -7.474 9.630 13.707 702 H ASP 86 H ASP 86 -5.119 5.397 11.040 703 HA ASP 86 HA ASP 86 -2.889 4.093 12.013 704 HB2 ASP 86 1HB ASP 86 -4.309 4.084 9.386 705 HB3 ASP 86 2HB ASP 86 -2.758 3.257 9.502 706 H TYR 87 H TYR 87 -3.048 6.410 9.320 707 HA TYR 87 HA TYR 87 -0.302 6.355 8.703 708 HB2 TYR 87 1HB TYR 87 -2.087 7.268 7.218 709 HB3 TYR 87 2HB TYR 87 -2.227 8.653 8.296 710 HD1 TYR 87 HD1 TYR 87 0.592 6.809 6.658 711 HD2 TYR 87 HD2 TYR 87 -1.248 10.559 7.466 712 HE1 TYR 87 HE1 TYR 87 2.383 7.948 5.416 713 HE2 TYR 87 HE2 TYR 87 0.537 11.709 6.225 714 HH TYR 87 HH TYR 87 3.260 9.909 4.833 715 H GLY 88 H GLY 88 -2.200 8.448 10.843 716 HA2 GLY 88 1HA GLY 88 -0.134 10.227 11.535 717 HA3 GLY 88 2HA GLY 88 -1.565 9.902 12.501 718 H THR 89 H THR 89 -1.227 7.242 13.121 719 HA THR 89 HA THR 89 0.690 7.413 15.225 720 HB THR 89 HB THR 89 -0.058 5.274 15.929 721 HG1 THR 89 HG1 THR 89 -1.277 3.921 14.523 722 HG21 THR 89 3HG2 THR 89 -2.105 5.975 16.486 723 HG22 THR 89 1HG2 THR 89 -2.661 5.893 14.816 724 HG23 THR 89 2HG2 THR 89 -1.841 7.340 15.402 725 H MET 90 H MET 90 0.756 6.226 11.989 726 HA MET 90 HA MET 90 2.364 5.232 10.727 727 HB2 MET 90 1HB MET 90 4.006 6.477 12.915 728 HB3 MET 90 2HB MET 90 4.764 5.534 11.639 729 HG2 MET 90 1HG MET 90 3.213 7.205 10.184 730 HG3 MET 90 2HG MET 90 3.599 8.224 11.569 731 HE1 MET 90 3HE MET 90 5.991 7.523 12.615 732 HE2 MET 90 1HE MET 90 7.040 6.474 11.660 733 HE3 MET 90 2HE MET 90 7.358 8.207 11.734 734 H ASN 91 H ASN 91 1.229 3.219 11.435 735 HA ASN 91 HA ASN 91 2.919 1.546 13.167 736 HB2 ASN 91 1HB ASN 91 0.015 1.697 12.674 737 HB3 ASN 91 2HB ASN 91 0.666 0.062 12.757 738 HD21 ASN 91 2HD2 ASN 91 1.610 -0.656 14.674 739 HD22 ASN 91 1HD2 ASN 91 1.325 0.139 16.182 740 H GLY 92 H GLY 92 4.456 0.742 11.811 741 HA2 GLY 92 1HA GLY 92 4.140 0.017 9.140 742 HA3 GLY 92 2HA GLY 92 5.370 -0.632 10.216 743 H GLU 93 H GLU 93 3.980 -2.083 12.015 744 HA GLU 93 HA GLU 93 3.528 -4.496 10.754 745 HB2 GLU 93 1HB GLU 93 3.914 -4.259 13.173 746 HB3 GLU 93 2HB GLU 93 2.317 -3.544 13.356 747 HG2 GLU 93 1HG GLU 93 1.272 -5.610 12.666 748 HG3 GLU 93 2HG GLU 93 2.852 -6.335 12.364 749 H LYS 94 H LYS 94 1.135 -2.071 11.753 750 HA LYS 94 HA LYS 94 -1.143 -3.495 10.912 751 HB2 LYS 94 1HB LYS 94 -0.660 -0.534 11.259 752 HB3 LYS 94 2HB LYS 94 -2.238 -1.224 10.901 753 HG2 LYS 94 1HG LYS 94 -0.623 -2.048 13.295 754 HG3 LYS 94 2HG LYS 94 -1.753 -0.692 13.323 755 HD2 LYS 94 1HD LYS 94 -3.427 -2.440 12.343 756 HD3 LYS 94 2HD LYS 94 -2.298 -3.616 13.019 757 HE2 LYS 94 1HE LYS 94 -2.718 -2.965 15.192 758 HE3 LYS 94 2HE LYS 94 -3.249 -1.353 14.716 759 HZ1 LYS 94 3HZ LYS 94 -4.800 -3.675 15.145 760 HZ2 LYS 94 1HZ LYS 94 -5.020 -3.135 13.557 761 HZ3 LYS 94 2HZ LYS 94 -5.317 -2.091 14.854 762 H VAL 95 H VAL 95 0.926 -1.152 9.255 763 HA VAL 95 HA VAL 95 -0.584 -0.848 6.921 764 HB VAL 95 HB VAL 95 2.422 -0.748 7.219 765 HG11 VAL 95 1HG1 VAL 95 0.569 0.019 4.998 766 HG12 VAL 95 2HG1 VAL 95 2.101 0.867 5.221 767 HG13 VAL 95 3HG1 VAL 95 2.089 -0.872 4.927 768 HG21 VAL 95 3HG2 VAL 95 1.036 1.782 6.967 769 HG22 VAL 95 1HG2 VAL 95 0.495 0.876 8.379 770 HG23 VAL 95 2HG2 VAL 95 2.205 1.254 8.177 771 H LEU 96 H LEU 96 2.366 -2.830 7.256 772 HA LEU 96 HA LEU 96 2.141 -4.212 4.872 773 HB2 LEU 96 1HB LEU 96 3.501 -5.990 6.017 774 HB3 LEU 96 2HB LEU 96 4.167 -4.360 6.065 775 HG LEU 96 HG LEU 96 2.800 -4.460 8.421 776 HD11 LEU 96 1HD1 LEU 96 2.462 -6.957 7.824 777 HD12 LEU 96 2HD1 LEU 96 2.969 -6.520 9.455 778 HD13 LEU 96 3HD1 LEU 96 4.154 -7.123 8.295 779 HD21 LEU 96 3HD2 LEU 96 5.049 -3.615 8.127 780 HD22 LEU 96 1HD2 LEU 96 5.659 -5.250 7.878 781 HD23 LEU 96 2HD2 LEU 96 5.015 -4.780 9.451 782 H GLN 97 H GLN 97 0.827 -5.061 8.055 783 HA GLN 97 HA GLN 97 -0.221 -7.560 7.419 784 HB2 GLN 97 1HB GLN 97 -0.940 -5.467 9.438 785 HB3 GLN 97 2HB GLN 97 -1.965 -6.885 9.251 786 HG2 GLN 97 1HG GLN 97 0.935 -7.366 9.543 787 HG3 GLN 97 2HG GLN 97 0.073 -6.773 10.962 788 HE21 GLN 97 2HE2 GLN 97 0.411 -9.384 8.692 789 HE22 GLN 97 1HE2 GLN 97 -0.478 -10.555 9.598 790 H LEU 98 H LEU 98 -1.627 -4.339 7.040 791 HA LEU 98 HA LEU 98 -4.183 -5.195 6.196 792 HB2 LEU 98 1HB LEU 98 -2.837 -2.743 6.612 793 HB3 LEU 98 2HB LEU 98 -3.491 -2.709 4.976 794 HG LEU 98 HG LEU 98 -5.152 -3.326 7.412 795 HD11 LEU 98 1HD1 LEU 98 -5.573 -0.741 6.156 796 HD12 LEU 98 2HD1 LEU 98 -3.973 -0.894 6.878 797 HD13 LEU 98 3HD1 LEU 98 -5.413 -1.160 7.861 798 HD21 LEU 98 3HD2 LEU 98 -5.686 -2.911 4.507 799 HD22 LEU 98 1HD2 LEU 98 -6.906 -2.436 5.689 800 HD23 LEU 98 2HD2 LEU 98 -6.353 -4.110 5.616 801 H ALA 99 H ALA 99 -1.334 -4.123 4.351 802 HA ALA 99 HA ALA 99 -2.366 -4.368 1.791 803 HB1 ALA 99 3HB ALA 99 -0.254 -4.002 1.075 804 HB2 ALA 99 1HB ALA 99 0.019 -3.629 2.777 805 HB3 ALA 99 2HB ALA 99 0.437 -5.222 2.144 806 H ILE 100 H ILE 100 -0.417 -6.809 3.522 807 HA ILE 100 HA ILE 100 -0.709 -8.854 1.648 808 HB ILE 100 HB ILE 100 -0.364 -9.126 4.637 809 HG12 ILE 100 1HG1 ILE 100 1.939 -9.567 2.871 810 HG13 ILE 100 2HG1 ILE 100 1.334 -7.914 2.844 811 HG21 ILE 100 1HG2 ILE 100 -0.987 -11.248 3.924 812 HG22 ILE 100 2HG2 ILE 100 -0.159 -11.079 2.377 813 HG23 ILE 100 3HG2 ILE 100 0.774 -11.305 3.856 814 HD11 ILE 100 3HD1 ILE 100 2.868 -9.292 4.864 815 HD12 ILE 100 1HD1 ILE 100 2.567 -7.567 4.651 816 HD13 ILE 100 2HD1 ILE 100 1.408 -8.562 5.532 817 H ASN 101 H ASN 101 -2.607 -8.210 4.590 818 HA ASN 101 HA ASN 101 -4.348 -10.348 4.486 819 HB2 ASN 101 1HB ASN 101 -4.299 -8.807 6.371 820 HB3 ASN 101 2HB ASN 101 -4.922 -7.507 5.358 821 HD21 ASN 101 2HD2 ASN 101 -6.486 -7.518 7.204 822 HD22 ASN 101 1HD2 ASN 101 -7.889 -8.514 7.040 823 H ALA 102 H ALA 102 -4.662 -7.193 2.887 824 HA ALA 102 HA ALA 102 -7.165 -7.682 1.691 825 HB1 ALA 102 3HB ALA 102 -5.249 -5.591 1.715 826 HB2 ALA 102 1HB ALA 102 -5.652 -5.943 0.035 827 HB3 ALA 102 2HB ALA 102 -6.930 -5.536 1.183 828 H PHE 103 H PHE 103 -3.854 -8.123 0.494 829 HA PHE 103 HA PHE 103 -4.419 -8.867 -2.115 830 HB2 PHE 103 1HB PHE 103 -2.142 -8.450 -1.270 831 HB3 PHE 103 2HB PHE 103 -2.219 -9.941 -0.337 832 HD1 PHE 103 HD1 PHE 103 -2.310 -8.607 -3.794 833 HD2 PHE 103 HD2 PHE 103 -1.608 -11.979 -1.292 834 HE1 PHE 103 HE1 PHE 103 -1.432 -9.854 -5.725 835 HE2 PHE 103 HE2 PHE 103 -0.727 -13.229 -3.219 836 HZ PHE 103 HZ PHE 103 -0.638 -12.167 -5.438 837 H ASN 104 H ASN 104 -4.008 -11.001 0.709 838 HA ASN 104 HA ASN 104 -4.631 -13.394 -0.622 839 HB2 ASN 104 1HB ASN 104 -4.394 -12.511 2.191 840 HB3 ASN 104 2HB ASN 104 -5.389 -13.939 1.923 841 HD21 ASN 104 2HD2 ASN 104 -2.232 -12.557 1.135 842 HD22 ASN 104 1HD2 ASN 104 -1.379 -14.059 1.136 843 H ASN 105 H ASN 105 -6.669 -11.175 1.255 844 HA ASN 105 HA ASN 105 -9.045 -12.607 1.197 845 HB2 ASN 105 1HB ASN 105 -8.296 -9.765 1.532 846 HB3 ASN 105 2HB ASN 105 -9.963 -10.061 1.046 847 HD21 ASN 105 2HD2 ASN 105 -10.838 -9.403 2.973 848 HD22 ASN 105 1HD2 ASN 105 -10.668 -10.302 4.439 849 H LYS 106 H LYS 106 -7.716 -10.366 -1.199 850 HA LYS 106 HA LYS 106 -9.875 -11.134 -3.044 851 HB2 LYS 106 1HB LYS 106 -8.059 -8.721 -3.014 852 HB3 LYS 106 2HB LYS 106 -9.148 -9.102 -4.341 853 HG2 LYS 106 1HG LYS 106 -11.043 -8.997 -2.740 854 HG3 LYS 106 2HG LYS 106 -9.908 -8.453 -1.502 855 HD2 LYS 106 1HD LYS 106 -9.279 -6.628 -3.230 856 HD3 LYS 106 2HD LYS 106 -10.818 -7.047 -3.988 857 HE2 LYS 106 1HE LYS 106 -12.055 -6.228 -2.248 858 HE3 LYS 106 2HE LYS 106 -10.793 -6.547 -1.058 859 HZ1 LYS 106 3HZ LYS 106 -11.074 -4.260 -2.890 860 HZ2 LYS 106 1HZ LYS 106 -9.541 -4.696 -2.321 861 HZ3 LYS 106 2HZ LYS 106 -10.758 -4.266 -1.228 862 H SER 107 H SER 107 -8.727 -13.159 -3.433 863 HA SER 107 HA SER 107 -6.149 -13.105 -4.692 864 HB2 SER 107 1HB SER 107 -7.377 -15.571 -5.262 865 HB3 SER 107 2HB SER 107 -6.222 -15.227 -3.973 866 HG SER 107 HG SER 107 -7.958 -14.754 -2.610 867 H SER 108 H SER 108 -9.493 -13.462 -5.777 868 HA SER 108 HA SER 108 -8.573 -12.950 -8.524 869 HB2 SER 108 1HB SER 108 -9.100 -15.251 -8.601 870 HB3 SER 108 2HB SER 108 -10.519 -15.047 -7.574 871 HG SER 108 HG SER 108 -10.181 -14.445 -10.296 872 H VAL 109 H VAL 109 -10.069 -11.851 -9.877 873 HA VAL 109 HA VAL 109 -12.303 -10.559 -8.459 874 HB VAL 109 HB VAL 109 -10.446 -8.968 -8.601 875 HG11 VAL 109 1HG1 VAL 109 -9.684 -10.125 -10.848 876 HG12 VAL 109 2HG1 VAL 109 -10.656 -8.838 -11.564 877 HG13 VAL 109 3HG1 VAL 109 -9.302 -8.438 -10.506 878 HG21 VAL 109 3HG2 VAL 109 -12.767 -8.355 -10.427 879 HG22 VAL 109 1HG2 VAL 109 -12.680 -8.073 -8.689 880 HG23 VAL 109 2HG2 VAL 109 -11.651 -7.151 -9.783 Start of MODEL 17 1 H1 GLY 1 H GLY 1 11.523 -21.536 -2.292 2 HA2 GLY 1 1HA GLY 1 10.472 -21.248 -5.032 3 HA3 GLY 1 2HA GLY 1 9.507 -21.133 -3.567 4 HA PRO 2 HA PRO 2 12.088 -17.038 -3.922 5 HB2 PRO 2 1HB PRO 2 13.216 -16.568 -6.346 6 HB3 PRO 2 2HB PRO 2 14.061 -17.407 -5.040 7 HG2 PRO 2 1HG PRO 2 12.650 -18.547 -7.423 8 HG3 PRO 2 2HG PRO 2 14.208 -19.014 -6.715 9 HD2 PRO 2 1HD PRO 2 11.927 -20.401 -6.260 10 HD3 PRO 2 2HD PRO 2 13.220 -20.266 -5.051 11 H GLY 3 H GLY 3 10.850 -15.280 -4.207 12 HA2 GLY 3 1HA GLY 3 9.704 -14.453 -6.629 13 HA3 GLY 3 2HA GLY 3 8.487 -15.349 -5.731 14 H SER 4 H SER 4 8.457 -14.641 -3.291 15 HA SER 4 HA SER 4 7.882 -13.028 -1.794 16 HB2 SER 4 1HB SER 4 10.186 -11.870 -3.248 17 HB3 SER 4 2HB SER 4 9.185 -10.720 -2.361 18 HG SER 4 HG SER 4 11.054 -12.189 -1.357 19 H MET 5 H MET 5 6.897 -10.781 -1.607 20 HA MET 5 HA MET 5 5.276 -10.250 -4.011 21 HB2 MET 5 1HB MET 5 4.127 -11.165 -1.916 22 HB3 MET 5 2HB MET 5 4.453 -9.599 -1.186 23 HG2 MET 5 1HG MET 5 3.173 -9.473 -3.817 24 HG3 MET 5 2HG MET 5 2.206 -10.241 -2.560 25 HE1 MET 5 3HE MET 5 1.145 -8.957 -0.500 26 HE2 MET 5 1HE MET 5 2.822 -8.937 0.043 27 HE3 MET 5 2HE MET 5 1.856 -7.465 0.116 28 H ASN 6 H ASN 6 4.745 -8.078 -4.499 29 HA ASN 6 HA ASN 6 6.523 -6.094 -3.240 30 HB2 ASN 6 1HB ASN 6 6.056 -6.768 -6.068 31 HB3 ASN 6 2HB ASN 6 6.012 -5.044 -5.712 32 HD21 ASN 6 2HD2 ASN 6 7.865 -4.434 -4.094 33 HD22 ASN 6 1HD2 ASN 6 9.430 -4.995 -4.567 34 H ILE 7 H ILE 7 5.366 -4.743 -2.042 35 HA ILE 7 HA ILE 7 2.586 -4.191 -2.717 36 HB ILE 7 HB ILE 7 4.199 -3.274 -0.333 37 HG12 ILE 7 1HG1 ILE 7 2.157 -5.499 -0.541 38 HG13 ILE 7 2HG1 ILE 7 3.900 -5.741 -0.478 39 HG21 ILE 7 1HG2 ILE 7 1.553 -2.606 -1.312 40 HG22 ILE 7 2HG2 ILE 7 1.511 -3.267 0.321 41 HG23 ILE 7 3HG2 ILE 7 2.507 -1.855 -0.033 42 HD11 ILE 7 3HD1 ILE 7 2.943 -4.100 1.708 43 HD12 ILE 7 1HD1 ILE 7 2.171 -5.684 1.663 44 HD13 ILE 7 2HD1 ILE 7 3.929 -5.562 1.733 45 H LEU 8 H LEU 8 1.791 -2.227 -3.322 46 HA LEU 8 HA LEU 8 3.785 -0.199 -4.055 47 HB2 LEU 8 1HB LEU 8 2.391 -1.139 -5.861 48 HB3 LEU 8 2HB LEU 8 0.953 -0.541 -5.033 49 HG LEU 8 HG LEU 8 1.855 0.796 -7.027 50 HD11 LEU 8 1HD1 LEU 8 0.586 1.549 -4.611 51 HD12 LEU 8 2HD1 LEU 8 0.454 2.297 -6.202 52 HD13 LEU 8 3HD1 LEU 8 1.688 2.847 -5.069 53 HD21 LEU 8 3HD2 LEU 8 4.221 0.670 -5.791 54 HD22 LEU 8 1HD2 LEU 8 3.631 2.189 -5.116 55 HD23 LEU 8 2HD2 LEU 8 3.770 1.996 -6.864 56 H LEU 9 H LEU 9 3.738 1.804 -3.210 57 HA LEU 9 HA LEU 9 1.504 2.462 -1.404 58 HB2 LEU 9 1HB LEU 9 3.690 2.003 -0.292 59 HB3 LEU 9 2HB LEU 9 4.362 3.383 -1.158 60 HG LEU 9 HG LEU 9 3.690 3.738 1.271 61 HD11 LEU 9 1HD1 LEU 9 3.734 5.890 0.732 62 HD12 LEU 9 2HD1 LEU 9 2.162 5.784 -0.059 63 HD13 LEU 9 3HD1 LEU 9 3.630 5.409 -0.962 64 HD21 LEU 9 3HD2 LEU 9 0.926 4.245 0.375 65 HD22 LEU 9 1HD2 LEU 9 1.533 3.684 1.932 66 HD23 LEU 9 2HD2 LEU 9 1.375 2.553 0.590 67 H VAL 10 H VAL 10 0.594 4.465 -1.533 68 HA VAL 10 HA VAL 10 1.670 6.285 -3.589 69 HB VAL 10 HB VAL 10 -1.259 5.888 -2.973 70 HG11 VAL 10 1HG1 VAL 10 -1.713 7.535 -4.439 71 HG12 VAL 10 2HG1 VAL 10 -0.071 8.058 -4.061 72 HG13 VAL 10 3HG1 VAL 10 -0.379 7.097 -5.507 73 HG21 VAL 10 3HG2 VAL 10 -1.336 4.792 -5.216 74 HG22 VAL 10 1HG2 VAL 10 0.428 4.778 -5.210 75 HG23 VAL 10 2HG2 VAL 10 -0.466 3.870 -3.990 76 H CYS 11 H CYS 11 2.057 8.302 -2.939 77 HA CYS 11 HA CYS 11 0.484 9.746 -1.104 78 HB2 CYS 11 1HB CYS 11 1.536 8.179 0.511 79 HB3 CYS 11 2HB CYS 11 3.118 8.769 0.017 80 HG CYS 11 HG CYS 11 3.146 10.963 1.414 81 H GLY 12 H GLY 12 0.911 11.891 -1.260 82 HA2 GLY 12 1HA GLY 12 2.584 12.830 -3.303 83 HA3 GLY 12 2HA GLY 12 1.850 13.827 -2.055 84 H ALA 13 H ALA 13 2.976 13.946 0.031 85 HA ALA 13 HA ALA 13 5.832 14.211 -0.408 86 HB1 ALA 13 3HB ALA 13 5.857 15.673 1.348 87 HB2 ALA 13 1HB ALA 13 4.173 15.836 0.846 88 HB3 ALA 13 2HB ALA 13 4.589 14.816 2.225 89 H GLY 14 H GLY 14 7.233 12.661 0.076 90 HA2 GLY 14 1HA GLY 14 7.838 11.387 2.295 91 HA3 GLY 14 2HA GLY 14 6.397 10.486 1.848 92 H MET 15 H MET 15 9.312 11.695 0.177 93 HA MET 15 HA MET 15 9.403 9.253 -1.399 94 HB2 MET 15 1HB MET 15 9.880 11.741 -2.160 95 HB3 MET 15 2HB MET 15 11.502 11.367 -1.589 96 HG2 MET 15 1HG MET 15 11.667 9.522 -3.123 97 HG3 MET 15 2HG MET 15 9.994 9.750 -3.629 98 HE1 MET 15 3HE MET 15 9.120 11.895 -4.304 99 HE2 MET 15 1HE MET 15 10.098 13.361 -4.368 100 HE3 MET 15 2HE MET 15 9.741 12.474 -5.850 101 H SER 16 H SER 16 9.994 7.700 0.128 102 HA SER 16 HA SER 16 11.438 6.378 1.288 103 HB2 SER 16 1HB SER 16 13.764 8.044 0.380 104 HB3 SER 16 2HB SER 16 13.661 6.296 0.598 105 HG SER 16 HG SER 16 12.842 7.880 -1.550 106 H THR 17 H THR 17 13.002 6.376 3.109 107 HA THR 17 HA THR 17 13.656 7.083 5.172 108 HB THR 17 HB THR 17 13.520 9.966 4.477 109 HG1 THR 17 HG1 THR 17 14.860 9.834 2.828 110 HG21 THR 17 3HG2 THR 17 14.582 8.795 6.544 111 HG22 THR 17 1HG2 THR 17 15.447 10.117 5.761 112 HG23 THR 17 2HG2 THR 17 15.913 8.446 5.441 113 H SER 18 H SER 18 10.943 6.632 4.840 114 HA SER 18 HA SER 18 9.696 8.779 6.425 115 HB2 SER 18 1HB SER 18 8.762 7.198 4.171 116 HB3 SER 18 2HB SER 18 7.655 7.097 5.540 117 HG SER 18 HG SER 18 7.095 8.878 4.323 118 H MET 19 H MET 19 8.354 8.207 8.193 119 HA MET 19 HA MET 19 9.376 6.199 9.855 120 HB2 MET 19 1HB MET 19 6.711 7.623 9.997 121 HB3 MET 19 2HB MET 19 7.415 6.667 11.295 122 HG2 MET 19 1HG MET 19 8.762 9.072 10.102 123 HG3 MET 19 2HG MET 19 7.684 9.151 11.494 124 HE1 MET 19 3HE MET 19 10.257 9.668 13.767 125 HE2 MET 19 1HE MET 19 11.111 10.053 12.272 126 HE3 MET 19 2HE MET 19 9.396 10.430 12.429 127 H LEU 20 H LEU 20 6.380 6.293 7.943 128 HA LEU 20 HA LEU 20 5.327 3.836 8.701 129 HB2 LEU 20 1HB LEU 20 5.015 5.672 6.428 130 HB3 LEU 20 2HB LEU 20 4.573 3.997 6.097 131 HG LEU 20 HG LEU 20 3.402 5.736 8.268 132 HD11 LEU 20 1HD1 LEU 20 2.691 6.428 6.050 133 HD12 LEU 20 2HD1 LEU 20 1.366 5.648 6.912 134 HD13 LEU 20 3HD1 LEU 20 2.241 4.767 5.660 135 HD21 LEU 20 3HD2 LEU 20 2.982 3.737 9.205 136 HD22 LEU 20 1HD2 LEU 20 3.294 2.854 7.711 137 HD23 LEU 20 2HD2 LEU 20 1.728 3.625 7.969 138 H VAL 21 H VAL 21 7.075 4.457 5.652 139 HA VAL 21 HA VAL 21 7.426 1.837 4.866 140 HB VAL 21 HB VAL 21 7.967 3.667 3.381 141 HG11 VAL 21 1HG1 VAL 21 10.416 4.203 5.048 142 HG12 VAL 21 2HG1 VAL 21 9.813 5.134 3.675 143 HG13 VAL 21 3HG1 VAL 21 8.921 5.125 5.196 144 HG21 VAL 21 3HG2 VAL 21 10.050 2.837 2.440 145 HG22 VAL 21 1HG2 VAL 21 10.430 2.022 3.958 146 HG23 VAL 21 2HG2 VAL 21 9.050 1.494 2.995 147 H GLN 22 H GLN 22 9.374 3.751 7.096 148 HA GLN 22 HA GLN 22 11.504 1.923 7.369 149 HB2 GLN 22 1HB GLN 22 10.482 4.244 8.938 150 HB3 GLN 22 2HB GLN 22 11.629 3.160 9.715 151 HG2 GLN 22 1HG GLN 22 12.725 3.668 7.214 152 HG3 GLN 22 2HG GLN 22 12.076 5.218 7.749 153 HE21 GLN 22 2HE2 GLN 22 14.493 2.828 8.200 154 HE22 GLN 22 1HE2 GLN 22 15.388 3.644 9.432 155 H ARG 23 H ARG 23 8.544 2.403 9.272 156 HA ARG 23 HA ARG 23 9.061 0.430 11.204 157 HB2 ARG 23 1HB ARG 23 6.425 1.490 10.173 158 HB3 ARG 23 2HB ARG 23 6.607 0.492 11.610 159 HG2 ARG 23 1HG ARG 23 8.309 2.873 11.578 160 HG3 ARG 23 2HG ARG 23 6.577 3.210 11.582 161 HD2 ARG 23 1HD ARG 23 7.325 3.100 13.854 162 HD3 ARG 23 2HD ARG 23 6.347 1.671 13.524 163 HE ARG 23 HE ARG 23 9.123 1.183 13.101 164 HH11 ARG 23 1HH1 ARG 23 6.670 1.452 15.555 165 HH12 ARG 23 2HH1 ARG 23 7.497 0.426 16.679 166 HH21 ARG 23 1HH2 ARG 23 10.223 -0.169 14.571 167 HH22 ARG 23 2HH2 ARG 23 9.519 -0.495 16.119 168 H ILE 24 H ILE 24 7.541 0.276 8.031 169 HA ILE 24 HA ILE 24 6.611 -2.399 8.263 170 HB ILE 24 HB ILE 24 7.226 -0.799 5.776 171 HG12 ILE 24 1HG1 ILE 24 4.436 -1.304 6.569 172 HG13 ILE 24 2HG1 ILE 24 5.329 -0.258 7.667 173 HG21 ILE 24 1HG2 ILE 24 5.967 -3.469 6.218 174 HG22 ILE 24 2HG2 ILE 24 5.444 -2.466 4.867 175 HG23 ILE 24 3HG2 ILE 24 7.131 -2.966 4.992 176 HD11 ILE 24 3HD1 ILE 24 5.004 1.442 6.300 177 HD12 ILE 24 1HD1 ILE 24 5.869 0.591 5.020 178 HD13 ILE 24 2HD1 ILE 24 4.125 0.389 5.192 179 H GLU 25 H GLU 25 9.353 -1.039 6.423 180 HA GLU 25 HA GLU 25 10.475 -3.447 5.614 181 HB2 GLU 25 1HB GLU 25 12.497 -2.221 5.181 182 HB3 GLU 25 2HB GLU 25 11.129 -1.187 4.788 183 HG2 GLU 25 1HG GLU 25 11.392 -0.018 6.910 184 HG3 GLU 25 2HG GLU 25 12.751 -1.063 7.321 185 H LYS 26 H LYS 26 10.819 -1.697 8.641 186 HA LYS 26 HA LYS 26 12.957 -3.244 9.680 187 HB2 LYS 26 1HB LYS 26 10.948 -1.354 10.841 188 HB3 LYS 26 2HB LYS 26 11.922 -2.341 11.923 189 HG2 LYS 26 1HG LYS 26 13.934 -1.367 11.155 190 HG3 LYS 26 2HG LYS 26 13.120 -0.593 9.793 191 HD2 LYS 26 1HD LYS 26 12.092 0.996 11.156 192 HD3 LYS 26 2HD LYS 26 12.329 0.035 12.616 193 HE2 LYS 26 1HE LYS 26 14.604 1.211 11.035 194 HE3 LYS 26 2HE LYS 26 13.817 2.064 12.361 195 HZ1 LYS 26 3HZ LYS 26 15.532 1.042 13.445 196 HZ2 LYS 26 1HZ LYS 26 15.525 -0.319 12.441 197 HZ3 LYS 26 2HZ LYS 26 14.333 -0.138 13.627 198 H TYR 27 H TYR 27 9.490 -3.255 10.534 199 HA TYR 27 HA TYR 27 9.493 -5.465 12.185 200 HB2 TYR 27 1HB TYR 27 7.528 -4.107 12.038 201 HB3 TYR 27 2HB TYR 27 7.354 -4.437 10.317 202 HD1 TYR 27 HD1 TYR 27 6.929 -5.806 13.700 203 HD2 TYR 27 HD2 TYR 27 6.359 -6.491 9.539 204 HE1 TYR 27 HE1 TYR 27 5.444 -7.697 14.221 205 HE2 TYR 27 HE2 TYR 27 4.873 -8.384 10.049 206 HH TYR 27 HH TYR 27 3.833 -9.078 13.314 207 H ALA 28 H ALA 28 9.001 -5.375 8.667 208 HA ALA 28 HA ALA 28 8.620 -8.139 8.315 209 HB1 ALA 28 3HB ALA 28 8.301 -7.565 6.188 210 HB2 ALA 28 1HB ALA 28 8.593 -5.900 6.687 211 HB3 ALA 28 2HB ALA 28 9.919 -6.877 6.053 212 H LYS 29 H LYS 29 11.544 -6.143 7.936 213 HA LYS 29 HA LYS 29 13.304 -8.177 7.211 214 HB2 LYS 29 1HB LYS 29 13.646 -5.515 8.541 215 HB3 LYS 29 2HB LYS 29 15.026 -6.597 8.404 216 HG2 LYS 29 1HG LYS 29 14.917 -6.573 6.033 217 HG3 LYS 29 2HG LYS 29 13.356 -5.749 6.051 218 HD2 LYS 29 1HD LYS 29 14.345 -3.756 6.141 219 HD3 LYS 29 2HD LYS 29 15.307 -4.243 7.539 220 HE2 LYS 29 1HE LYS 29 17.056 -5.035 6.204 221 HE3 LYS 29 2HE LYS 29 16.042 -5.113 4.764 222 HZ1 LYS 29 3HZ LYS 29 15.980 -2.484 5.498 223 HZ2 LYS 29 1HZ LYS 29 16.901 -3.147 4.244 224 HZ3 LYS 29 2HZ LYS 29 17.587 -2.935 5.775 225 H SER 30 H SER 30 12.038 -7.276 10.331 226 HA SER 30 HA SER 30 13.934 -8.887 11.800 227 HB2 SER 30 1HB SER 30 13.244 -7.092 13.095 228 HB3 SER 30 2HB SER 30 11.580 -7.180 12.518 229 HG SER 30 HG SER 30 11.158 -8.356 14.192 230 H LYS 31 H LYS 31 10.546 -9.104 10.818 231 HA LYS 31 HA LYS 31 10.062 -11.584 12.148 232 HB2 LYS 31 1HB LYS 31 8.587 -9.792 10.323 233 HB3 LYS 31 2HB LYS 31 8.145 -11.491 10.224 234 HG2 LYS 31 1HG LYS 31 8.204 -9.915 12.787 235 HG3 LYS 31 2HG LYS 31 6.762 -10.153 11.798 236 HD2 LYS 31 1HD LYS 31 7.119 -12.624 12.035 237 HD3 LYS 31 2HD LYS 31 8.395 -12.263 13.202 238 HE2 LYS 31 1HE LYS 31 6.081 -10.772 13.916 239 HE3 LYS 31 2HE LYS 31 5.594 -12.443 13.633 240 HZ1 LYS 31 3HZ LYS 31 6.201 -12.313 15.882 241 HZ2 LYS 31 1HZ LYS 31 7.610 -11.437 15.553 242 HZ3 LYS 31 2HZ LYS 31 7.509 -13.068 15.122 243 H ASN 32 H ASN 32 11.655 -10.731 9.270 244 HA ASN 32 HA ASN 32 12.646 -11.950 7.625 245 HB2 ASN 32 1HB ASN 32 13.269 -13.373 9.652 246 HB3 ASN 32 2HB ASN 32 11.940 -14.432 9.189 247 HD21 ASN 32 2HD2 ASN 32 13.722 -15.994 9.058 248 HD22 ASN 32 1HD2 ASN 32 14.600 -16.114 7.573 249 H ILE 33 H ILE 33 10.318 -11.152 6.826 250 HA ILE 33 HA ILE 33 8.879 -13.506 5.796 251 HB ILE 33 HB ILE 33 7.897 -10.662 6.062 252 HG12 ILE 33 1HG1 ILE 33 6.859 -13.078 7.530 253 HG13 ILE 33 2HG1 ILE 33 8.193 -12.122 8.166 254 HG21 ILE 33 1HG2 ILE 33 6.474 -13.152 5.129 255 HG22 ILE 33 2HG2 ILE 33 5.714 -11.587 5.412 256 HG23 ILE 33 3HG2 ILE 33 6.918 -11.764 4.135 257 HD11 ILE 33 3HD1 ILE 33 5.333 -11.358 7.793 258 HD12 ILE 33 1HD1 ILE 33 6.351 -11.228 9.228 259 HD13 ILE 33 2HD1 ILE 33 6.590 -10.124 7.874 260 H ASN 34 H ASN 34 8.482 -13.716 3.620 261 HA ASN 34 HA ASN 34 10.279 -12.305 1.868 262 HB2 ASN 34 1HB ASN 34 9.189 -13.784 0.106 263 HB3 ASN 34 2HB ASN 34 10.030 -14.620 1.408 264 HD21 ASN 34 2HD2 ASN 34 7.217 -14.437 -0.347 265 HD22 ASN 34 1HD2 ASN 34 6.190 -15.362 0.690 266 H ALA 35 H ALA 35 9.414 -10.164 2.081 267 HA ALA 35 HA ALA 35 7.334 -9.640 0.128 268 HB1 ALA 35 3HB ALA 35 5.694 -9.034 1.503 269 HB2 ALA 35 1HB ALA 35 6.624 -9.773 2.807 270 HB3 ALA 35 2HB ALA 35 6.783 -8.047 2.477 271 H THR 36 H THR 36 7.093 -7.258 -0.261 272 HA THR 36 HA THR 36 9.366 -5.636 0.561 273 HB THR 36 HB THR 36 9.114 -5.219 -2.243 274 HG1 THR 36 HG1 THR 36 8.536 -7.254 -2.709 275 HG21 THR 36 3HG2 THR 36 11.178 -5.864 -0.257 276 HG22 THR 36 1HG2 THR 36 11.204 -4.700 -1.581 277 HG23 THR 36 2HG2 THR 36 11.545 -6.402 -1.895 278 H ILE 37 H ILE 37 9.147 -3.368 -0.136 279 HA ILE 37 HA ILE 37 6.471 -2.560 -0.971 280 HB ILE 37 HB ILE 37 6.373 -2.668 1.498 281 HG12 ILE 37 1HG1 ILE 37 6.345 0.249 0.990 282 HG13 ILE 37 2HG1 ILE 37 5.406 -0.733 -0.129 283 HG21 ILE 37 1HG2 ILE 37 7.680 -1.129 2.849 284 HG22 ILE 37 2HG2 ILE 37 8.740 -2.202 1.938 285 HG23 ILE 37 3HG2 ILE 37 8.505 -0.536 1.408 286 HD11 ILE 37 3HD1 ILE 37 4.493 -1.789 2.101 287 HD12 ILE 37 1HD1 ILE 37 4.999 -0.236 2.766 288 HD13 ILE 37 2HD1 ILE 37 3.829 -0.292 1.447 289 H GLU 38 H GLU 38 6.363 -0.477 -1.843 290 HA GLU 38 HA GLU 38 8.705 1.214 -1.862 291 HB2 GLU 38 1HB GLU 38 9.170 -0.458 -3.646 292 HB3 GLU 38 2HB GLU 38 7.697 0.047 -4.462 293 HG2 GLU 38 1HG GLU 38 8.575 2.207 -4.895 294 HG3 GLU 38 2HG GLU 38 9.957 1.925 -3.839 295 H ALA 39 H ALA 39 8.256 3.326 -2.437 296 HA ALA 39 HA ALA 39 5.405 3.922 -2.878 297 HB1 ALA 39 3HB ALA 39 6.398 6.268 -2.000 298 HB2 ALA 39 1HB ALA 39 5.724 5.028 -0.942 299 HB3 ALA 39 2HB ALA 39 7.470 5.141 -1.170 300 H ILE 40 H ILE 40 4.826 5.577 -4.328 301 HA ILE 40 HA ILE 40 6.884 6.778 -5.986 302 HB ILE 40 HB ILE 40 5.751 6.035 -8.093 303 HG12 ILE 40 1HG1 ILE 40 4.559 3.704 -7.646 304 HG13 ILE 40 2HG1 ILE 40 4.203 4.449 -6.092 305 HG21 ILE 40 1HG2 ILE 40 7.121 4.211 -8.311 306 HG22 ILE 40 2HG2 ILE 40 7.815 4.961 -6.874 307 HG23 ILE 40 3HG2 ILE 40 6.725 3.584 -6.711 308 HD11 ILE 40 3HD1 ILE 40 2.427 4.694 -7.826 309 HD12 ILE 40 1HD1 ILE 40 2.995 6.209 -7.124 310 HD13 ILE 40 2HD1 ILE 40 3.539 5.723 -8.730 311 H ALA 41 H ALA 41 5.570 7.957 -7.918 312 HA ALA 41 HA ALA 41 3.638 9.650 -6.516 313 HB1 ALA 41 3HB ALA 41 5.029 11.163 -7.433 314 HB2 ALA 41 1HB ALA 41 5.577 10.054 -8.690 315 HB3 ALA 41 2HB ALA 41 4.044 10.909 -8.874 316 H GLU 42 H GLU 42 1.647 10.259 -7.482 317 HA GLU 42 HA GLU 42 0.151 8.185 -8.564 318 HB2 GLU 42 1HB GLU 42 -1.535 9.940 -9.112 319 HB3 GLU 42 2HB GLU 42 -0.943 10.013 -7.458 320 HG2 GLU 42 1HG GLU 42 0.067 12.010 -7.757 321 HG3 GLU 42 2HG GLU 42 0.478 11.676 -9.439 322 H THR 43 H THR 43 2.223 10.469 -10.117 323 HA THR 43 HA THR 43 1.158 10.412 -12.719 324 HB THR 43 HB THR 43 2.817 12.075 -12.075 325 HG1 THR 43 HG1 THR 43 3.729 12.093 -14.031 326 HG21 THR 43 3HG2 THR 43 4.144 10.061 -10.835 327 HG22 THR 43 1HG2 THR 43 4.861 11.622 -11.228 328 HG23 THR 43 2HG2 THR 43 5.112 10.243 -12.298 329 H ARG 44 H ARG 44 3.395 8.273 -11.042 330 HA ARG 44 HA ARG 44 3.584 6.594 -13.443 331 HB2 ARG 44 1HB ARG 44 5.259 6.783 -10.947 332 HB3 ARG 44 2HB ARG 44 5.387 5.418 -12.048 333 HG2 ARG 44 1HG ARG 44 6.455 6.619 -13.635 334 HG3 ARG 44 2HG ARG 44 5.584 8.106 -13.254 335 HD2 ARG 44 1HD ARG 44 7.044 8.695 -11.584 336 HD3 ARG 44 2HD ARG 44 7.508 7.026 -11.256 337 HE ARG 44 HE ARG 44 8.791 8.826 -13.037 338 HH11 ARG 44 1HH1 ARG 44 7.958 5.472 -12.616 339 HH12 ARG 44 2HH1 ARG 44 9.276 4.889 -13.577 340 HH21 ARG 44 1HH2 ARG 44 10.531 8.071 -14.304 341 HH22 ARG 44 2HH2 ARG 44 10.739 6.369 -14.536 342 H LEU 45 H LEU 45 1.717 6.877 -10.767 343 HA LEU 45 HA LEU 45 1.564 4.375 -9.599 344 HB2 LEU 45 1HB LEU 45 0.342 6.207 -8.685 345 HB3 LEU 45 2HB LEU 45 -0.588 6.401 -10.169 346 HG LEU 45 HG LEU 45 -1.528 4.071 -9.662 347 HD11 LEU 45 1HD1 LEU 45 -0.239 3.150 -8.004 348 HD12 LEU 45 2HD1 LEU 45 -1.572 3.812 -7.060 349 HD13 LEU 45 3HD1 LEU 45 -0.041 4.682 -7.152 350 HD21 LEU 45 3HD2 LEU 45 -2.510 5.780 -7.510 351 HD22 LEU 45 1HD2 LEU 45 -3.348 5.135 -8.921 352 HD23 LEU 45 2HD2 LEU 45 -2.382 6.604 -9.065 353 H SER 46 H SER 46 -0.299 5.570 -12.392 354 HA SER 46 HA SER 46 -1.513 3.041 -12.904 355 HB2 SER 46 1HB SER 46 -2.300 5.431 -13.595 356 HB3 SER 46 2HB SER 46 -1.246 5.188 -14.988 357 HG SER 46 HG SER 46 -3.676 4.051 -14.396 358 H GLU 47 H GLU 47 1.586 4.188 -13.409 359 HA GLU 47 HA GLU 47 2.041 2.460 -15.737 360 HB2 GLU 47 1HB GLU 47 3.087 4.994 -14.936 361 HB3 GLU 47 2HB GLU 47 4.412 3.840 -14.993 362 HG2 GLU 47 1HG GLU 47 2.772 3.504 -17.306 363 HG3 GLU 47 2HG GLU 47 3.201 5.205 -17.130 364 H VAL 48 H VAL 48 2.102 2.261 -12.468 365 HA VAL 48 HA VAL 48 4.286 0.279 -12.497 366 HB VAL 48 HB VAL 48 4.726 0.746 -10.164 367 HG11 VAL 48 1HG1 VAL 48 5.175 2.556 -12.287 368 HG12 VAL 48 2HG1 VAL 48 4.851 3.512 -10.840 369 HG13 VAL 48 3HG1 VAL 48 6.145 2.313 -10.836 370 HG21 VAL 48 3HG2 VAL 48 3.600 2.570 -8.980 371 HG22 VAL 48 1HG2 VAL 48 2.551 2.827 -10.375 372 HG23 VAL 48 2HG2 VAL 48 2.458 1.317 -9.466 373 H VAL 49 H VAL 49 1.044 1.077 -11.463 374 HA VAL 49 HA VAL 49 0.585 -1.201 -9.847 375 HB VAL 49 HB VAL 49 -1.821 -0.699 -10.158 376 HG11 VAL 49 1HG1 VAL 49 -1.070 0.493 -8.371 377 HG12 VAL 49 2HG1 VAL 49 0.166 1.334 -9.308 378 HG13 VAL 49 3HG1 VAL 49 -1.522 1.834 -9.424 379 HG21 VAL 49 3HG2 VAL 49 -1.871 1.743 -11.430 380 HG22 VAL 49 1HG2 VAL 49 -0.768 0.793 -12.425 381 HG23 VAL 49 2HG2 VAL 49 -2.403 0.208 -12.117 382 H ASP 50 H ASP 50 0.958 -0.863 -13.186 383 HA ASP 50 HA ASP 50 -0.823 -2.903 -14.071 384 HB2 ASP 50 1HB ASP 50 0.625 -0.976 -15.333 385 HB3 ASP 50 2HB ASP 50 1.596 -2.403 -15.684 386 H ARG 51 H ARG 51 2.292 -2.906 -12.612 387 HA ARG 51 HA ARG 51 2.559 -5.785 -13.185 388 HB2 ARG 51 1HB ARG 51 5.025 -5.402 -12.697 389 HB3 ARG 51 2HB ARG 51 4.413 -4.732 -14.204 390 HG2 ARG 51 1HG ARG 51 4.437 -2.986 -11.802 391 HG3 ARG 51 2HG ARG 51 5.970 -3.342 -12.600 392 HD2 ARG 51 1HD ARG 51 4.080 -2.721 -14.614 393 HD3 ARG 51 2HD ARG 51 3.939 -1.491 -13.359 394 HE ARG 51 HE ARG 51 6.598 -1.631 -13.734 395 HH11 ARG 51 1HH1 ARG 51 3.928 -1.304 -15.944 396 HH12 ARG 51 2HH1 ARG 51 4.835 -0.398 -17.110 397 HH21 ARG 51 1HH2 ARG 51 7.802 -0.440 -15.262 398 HH22 ARG 51 2HH2 ARG 51 7.038 0.092 -16.721 399 H PHE 52 H PHE 52 2.761 -3.245 -10.773 400 HA PHE 52 HA PHE 52 3.762 -4.621 -8.601 401 HB2 PHE 52 1HB PHE 52 2.041 -2.264 -8.989 402 HB3 PHE 52 2HB PHE 52 1.863 -3.049 -7.424 403 HD1 PHE 52 HD1 PHE 52 4.216 -3.704 -6.319 404 HD2 PHE 52 HD2 PHE 52 3.580 -0.579 -9.138 405 HE1 PHE 52 HE1 PHE 52 6.250 -2.573 -5.518 406 HE2 PHE 52 HE2 PHE 52 5.613 0.557 -8.343 407 HZ PHE 52 HZ PHE 52 6.951 -0.441 -6.532 408 H ASP 53 H ASP 53 2.420 -5.226 -6.606 409 HA ASP 53 HA ASP 53 0.430 -7.186 -7.470 410 HB2 ASP 53 1HB ASP 53 1.860 -6.862 -4.824 411 HB3 ASP 53 2HB ASP 53 0.732 -8.157 -5.213 412 H VAL 54 H VAL 54 0.725 -5.313 -4.460 413 HA VAL 54 HA VAL 54 -2.158 -4.748 -4.638 414 HB VAL 54 HB VAL 54 -1.322 -6.076 -2.661 415 HG11 VAL 54 1HG1 VAL 54 0.307 -5.328 -1.339 416 HG12 VAL 54 2HG1 VAL 54 0.602 -4.078 -2.549 417 HG13 VAL 54 3HG1 VAL 54 -0.456 -3.747 -1.178 418 HG21 VAL 54 3HG2 VAL 54 -2.501 -3.505 -1.694 419 HG22 VAL 54 1HG2 VAL 54 -3.406 -4.523 -2.815 420 HG23 VAL 54 2HG2 VAL 54 -2.906 -5.163 -1.250 421 H VAL 55 H VAL 55 -2.900 -2.675 -3.812 422 HA VAL 55 HA VAL 55 -0.881 -0.545 -4.097 423 HB VAL 55 HB VAL 55 -3.766 -0.322 -4.961 424 HG11 VAL 55 1HG1 VAL 55 -2.607 1.771 -4.306 425 HG12 VAL 55 2HG1 VAL 55 -1.401 1.453 -5.554 426 HG13 VAL 55 3HG1 VAL 55 -3.083 1.737 -6.002 427 HG21 VAL 55 3HG2 VAL 55 -2.636 -1.945 -6.373 428 HG22 VAL 55 1HG2 VAL 55 -2.921 -0.450 -7.265 429 HG23 VAL 55 2HG2 VAL 55 -1.310 -0.815 -6.645 430 H LEU 56 H LEU 56 -0.996 1.173 -2.701 431 HA LEU 56 HA LEU 56 -3.153 1.168 -0.709 432 HB2 LEU 56 1HB LEU 56 -0.313 0.685 -0.279 433 HB3 LEU 56 2HB LEU 56 -0.941 2.004 0.708 434 HG LEU 56 HG LEU 56 -2.648 -0.349 0.792 435 HD11 LEU 56 1HD1 LEU 56 -1.050 -1.909 0.852 436 HD12 LEU 56 2HD1 LEU 56 -0.674 -1.262 2.449 437 HD13 LEU 56 3HD1 LEU 56 0.237 -0.718 1.040 438 HD21 LEU 56 3HD2 LEU 56 -1.462 1.660 2.606 439 HD22 LEU 56 1HD2 LEU 56 -1.868 0.096 3.314 440 HD23 LEU 56 2HD2 LEU 56 -3.115 1.049 2.508 441 H LEU 57 H LEU 57 -3.970 3.127 -0.278 442 HA LEU 57 HA LEU 57 -2.649 5.445 -1.501 443 HB2 LEU 57 1HB LEU 57 -5.435 4.639 -1.054 444 HB3 LEU 57 2HB LEU 57 -5.100 6.338 -0.724 445 HG LEU 57 HG LEU 57 -5.953 5.821 -3.031 446 HD11 LEU 57 1HD1 LEU 57 -4.737 7.534 -3.978 447 HD12 LEU 57 2HD1 LEU 57 -3.224 7.017 -3.234 448 HD13 LEU 57 3HD1 LEU 57 -4.462 7.808 -2.258 449 HD21 LEU 57 3HD2 LEU 57 -4.223 3.769 -3.030 450 HD22 LEU 57 1HD2 LEU 57 -3.245 4.982 -3.856 451 HD23 LEU 57 2HD2 LEU 57 -4.823 4.532 -4.503 452 H ALA 58 H ALA 58 -2.171 7.278 -0.347 453 HA ALA 58 HA ALA 58 -1.987 6.940 2.534 454 HB1 ALA 58 3HB ALA 58 -0.842 9.302 2.188 455 HB2 ALA 58 1HB ALA 58 0.004 7.796 1.834 456 HB3 ALA 58 2HB ALA 58 -0.727 8.725 0.525 457 HA PRO 59 HA PRO 59 -5.297 9.566 3.712 458 HB2 PRO 59 1HB PRO 59 -4.247 10.925 5.814 459 HB3 PRO 59 2HB PRO 59 -4.677 9.212 5.895 460 HG2 PRO 59 1HG PRO 59 -1.995 10.475 5.475 461 HG3 PRO 59 2HG PRO 59 -2.434 9.097 6.502 462 HD2 PRO 59 1HD PRO 59 -1.288 8.793 4.067 463 HD3 PRO 59 2HD PRO 59 -2.443 7.621 4.732 464 H GLN 60 H GLN 60 -5.818 11.928 4.297 465 HA GLN 60 HA GLN 60 -5.908 14.116 3.682 466 HB2 GLN 60 1HB GLN 60 -3.434 13.855 4.559 467 HB3 GLN 60 2HB GLN 60 -3.034 14.096 2.863 468 HG2 GLN 60 1HG GLN 60 -4.244 16.218 2.880 469 HG3 GLN 60 2HG GLN 60 -4.638 15.977 4.582 470 HE21 GLN 60 2HE2 GLN 60 -3.402 17.069 5.911 471 HE22 GLN 60 1HE2 GLN 60 -1.749 17.501 5.655 472 H SER 61 H SER 61 -6.187 11.885 1.717 473 HA SER 61 HA SER 61 -5.440 13.268 -0.763 474 HB2 SER 61 1HB SER 61 -6.182 11.019 -1.793 475 HB3 SER 61 2HB SER 61 -4.677 11.045 -0.876 476 HG SER 61 HG SER 61 -5.705 9.363 -0.011 477 H ARG 62 H ARG 62 -6.960 14.625 -1.449 478 HA ARG 62 HA ARG 62 -9.774 14.058 -0.951 479 HB2 ARG 62 1HB ARG 62 -8.627 16.351 -0.652 480 HB3 ARG 62 2HB ARG 62 -8.705 16.463 -2.406 481 HG2 ARG 62 1HG ARG 62 -10.785 17.196 -2.271 482 HG3 ARG 62 2HG ARG 62 -11.268 15.699 -1.469 483 HD2 ARG 62 1HD ARG 62 -10.429 16.728 0.680 484 HD3 ARG 62 2HD ARG 62 -10.293 18.249 -0.202 485 HE ARG 62 HE ARG 62 -12.886 17.109 -0.476 486 HH11 ARG 62 1HH1 ARG 62 -10.846 18.897 1.705 487 HH12 ARG 62 2HH1 ARG 62 -12.168 19.659 2.526 488 HH21 ARG 62 1HH2 ARG 62 -14.636 18.104 0.596 489 HH22 ARG 62 2HH2 ARG 62 -14.324 19.206 1.895 490 H PHE 63 H PHE 63 -7.974 15.240 -3.797 491 HA PHE 63 HA PHE 63 -9.962 14.184 -5.585 492 HB2 PHE 63 1HB PHE 63 -7.252 15.342 -6.257 493 HB3 PHE 63 2HB PHE 63 -8.610 15.132 -7.358 494 HD1 PHE 63 HD2 PHE 63 -10.832 16.336 -6.577 495 HD2 PHE 63 HD1 PHE 63 -6.905 17.414 -5.341 496 HE1 PHE 63 HE2 PHE 63 -11.631 18.594 -6.020 497 HE2 PHE 63 HE1 PHE 63 -7.698 19.676 -4.781 498 HZ PHE 63 HZ PHE 63 -10.064 20.268 -5.122 499 H ASN 64 H ASN 64 -6.687 13.329 -4.607 500 HA ASN 64 HA ASN 64 -6.190 11.331 -6.505 501 HB2 ASN 64 1HB ASN 64 -4.862 12.394 -4.281 502 HB3 ASN 64 2HB ASN 64 -5.048 10.680 -3.922 503 HD21 ASN 64 2HD2 ASN 64 -4.277 9.158 -5.525 504 HD22 ASN 64 1HD2 ASN 64 -2.924 9.585 -6.512 505 H LYS 65 H LYS 65 -7.516 11.062 -3.213 506 HA LYS 65 HA LYS 65 -7.900 8.305 -3.173 507 HB2 LYS 65 1HB LYS 65 -8.125 9.479 -1.130 508 HB3 LYS 65 2HB LYS 65 -9.342 10.562 -1.793 509 HG2 LYS 65 1HG LYS 65 -11.015 8.954 -1.681 510 HG3 LYS 65 2HG LYS 65 -9.861 7.622 -1.578 511 HD2 LYS 65 1HD LYS 65 -9.152 8.661 0.655 512 HD3 LYS 65 2HD LYS 65 -10.639 9.604 0.544 513 HE2 LYS 65 1HE LYS 65 -11.751 7.285 0.126 514 HE3 LYS 65 2HE LYS 65 -10.280 6.652 0.864 515 HZ1 LYS 65 3HZ LYS 65 -10.746 7.701 2.871 516 HZ2 LYS 65 1HZ LYS 65 -12.258 7.127 2.373 517 HZ3 LYS 65 2HZ LYS 65 -11.870 8.762 2.184 518 H LYS 66 H LYS 66 -10.292 10.830 -3.964 519 HA LYS 66 HA LYS 66 -12.411 9.204 -4.659 520 HB2 LYS 66 1HB LYS 66 -12.570 11.648 -4.472 521 HB3 LYS 66 2HB LYS 66 -11.615 11.827 -5.938 522 HG2 LYS 66 1HG LYS 66 -13.729 12.098 -6.762 523 HG3 LYS 66 2HG LYS 66 -13.509 10.362 -6.991 524 HD2 LYS 66 1HD LYS 66 -14.547 10.219 -4.593 525 HD3 LYS 66 2HD LYS 66 -15.177 11.820 -4.988 526 HE2 LYS 66 1HE LYS 66 -16.838 10.224 -5.598 527 HE3 LYS 66 2HE LYS 66 -16.119 10.836 -7.087 528 HZ1 LYS 66 3HZ LYS 66 -15.015 8.864 -7.467 529 HZ2 LYS 66 1HZ LYS 66 -16.476 8.317 -6.811 530 HZ3 LYS 66 2HZ LYS 66 -15.085 8.372 -5.850 531 H ARG 67 H ARG 67 -9.882 10.479 -6.820 532 HA ARG 67 HA ARG 67 -10.764 9.239 -9.163 533 HB2 ARG 67 1HB ARG 67 -8.057 10.181 -8.246 534 HB3 ARG 67 2HB ARG 67 -8.276 9.419 -9.817 535 HG2 ARG 67 1HG ARG 67 -10.224 11.505 -9.386 536 HG3 ARG 67 2HG ARG 67 -8.575 12.108 -9.203 537 HD2 ARG 67 1HD ARG 67 -8.766 12.346 -11.451 538 HD3 ARG 67 2HD ARG 67 -8.234 10.666 -11.415 539 HE ARG 67 HE ARG 67 -10.996 10.618 -11.275 540 HH11 ARG 67 1HH1 ARG 67 -8.560 11.719 -13.506 541 HH12 ARG 67 2HH1 ARG 67 -9.544 11.468 -14.909 542 HH21 ARG 67 1HH2 ARG 67 -12.302 10.283 -13.115 543 HH22 ARG 67 2HH2 ARG 67 -11.673 10.651 -14.685 544 H LEU 68 H LEU 68 -8.180 8.174 -6.944 545 HA LEU 68 HA LEU 68 -7.558 5.769 -8.137 546 HB2 LEU 68 1HB LEU 68 -7.357 6.879 -5.416 547 HB3 LEU 68 2HB LEU 68 -7.283 5.122 -5.527 548 HG LEU 68 HG LEU 68 -5.064 6.266 -5.492 549 HD11 LEU 68 1HD1 LEU 68 -4.122 4.675 -6.820 550 HD12 LEU 68 2HD1 LEU 68 -5.270 4.930 -8.134 551 HD13 LEU 68 3HD1 LEU 68 -5.755 4.019 -6.704 552 HD21 LEU 68 3HD2 LEU 68 -4.315 7.340 -7.582 553 HD22 LEU 68 1HD2 LEU 68 -5.603 8.238 -6.781 554 HD23 LEU 68 2HD2 LEU 68 -5.966 7.251 -8.196 555 H GLU 69 H GLU 69 -10.285 6.571 -6.093 556 HA GLU 69 HA GLU 69 -11.136 3.899 -5.621 557 HB2 GLU 69 1HB GLU 69 -12.618 6.527 -5.482 558 HB3 GLU 69 2HB GLU 69 -13.308 4.988 -4.985 559 HG2 GLU 69 1HG GLU 69 -10.749 5.406 -3.738 560 HG3 GLU 69 2HG GLU 69 -11.830 6.765 -3.432 561 H GLU 70 H GLU 70 -12.458 6.435 -7.757 562 HA GLU 70 HA GLU 70 -14.299 4.791 -9.078 563 HB2 GLU 70 1HB GLU 70 -14.296 6.547 -10.838 564 HB3 GLU 70 2HB GLU 70 -14.487 7.190 -9.212 565 HG2 GLU 70 1HG GLU 70 -12.123 7.805 -9.176 566 HG3 GLU 70 2HG GLU 70 -11.936 7.170 -10.809 567 H ILE 71 H ILE 71 -10.900 4.973 -9.330 568 HA ILE 71 HA ILE 71 -10.831 3.788 -11.993 569 HB ILE 71 HB ILE 71 -8.573 4.538 -10.132 570 HG12 ILE 71 1HG1 ILE 71 -9.193 5.896 -12.729 571 HG13 ILE 71 2HG1 ILE 71 -10.114 6.323 -11.290 572 HG21 ILE 71 1HG2 ILE 71 -7.595 2.923 -11.436 573 HG22 ILE 71 2HG2 ILE 71 -8.643 3.248 -12.815 574 HG23 ILE 71 3HG2 ILE 71 -7.325 4.353 -12.430 575 HD11 ILE 71 3HD1 ILE 71 -7.208 6.710 -11.855 576 HD12 ILE 71 1HD1 ILE 71 -8.411 7.883 -11.317 577 HD13 ILE 71 2HD1 ILE 71 -7.805 6.661 -10.197 578 H THR 72 H THR 72 -10.207 2.942 -8.637 579 HA THR 72 HA THR 72 -9.058 0.399 -9.139 580 HB THR 72 HB THR 72 -9.843 -0.047 -6.711 581 HG1 THR 72 HG1 THR 72 -10.522 1.759 -5.591 582 HG21 THR 72 3HG2 THR 72 -7.678 0.435 -6.467 583 HG22 THR 72 1HG2 THR 72 -8.154 2.106 -6.172 584 HG23 THR 72 2HG2 THR 72 -7.720 1.587 -7.801 585 H LYS 73 H LYS 73 -12.361 1.514 -8.639 586 HA LYS 73 HA LYS 73 -13.693 -0.856 -8.216 587 HB2 LYS 73 1HB LYS 73 -14.372 1.789 -9.231 588 HB3 LYS 73 2HB LYS 73 -15.365 0.528 -9.951 589 HG2 LYS 73 1HG LYS 73 -15.520 -0.216 -7.387 590 HG3 LYS 73 2HG LYS 73 -15.274 1.519 -7.174 591 HD2 LYS 73 1HD LYS 73 -17.137 1.715 -8.993 592 HD3 LYS 73 2HD LYS 73 -17.528 0.067 -8.495 593 HE2 LYS 73 1HE LYS 73 -17.899 0.770 -6.237 594 HE3 LYS 73 2HE LYS 73 -17.292 2.387 -6.586 595 HZ1 LYS 73 3HZ LYS 73 -19.234 2.294 -8.343 596 HZ2 LYS 73 1HZ LYS 73 -19.509 2.769 -6.742 597 HZ3 LYS 73 2HZ LYS 73 -19.879 1.193 -7.232 598 HA PRO 74 HA PRO 74 -14.089 -1.588 -12.968 599 HB2 PRO 74 1HB PRO 74 -12.662 0.031 -14.615 600 HB3 PRO 74 2HB PRO 74 -14.304 0.410 -14.082 601 HG2 PRO 74 1HG PRO 74 -11.690 1.426 -13.034 602 HG3 PRO 74 2HG PRO 74 -13.190 2.317 -13.352 603 HD2 PRO 74 1HD PRO 74 -12.462 1.532 -10.865 604 HD3 PRO 74 2HD PRO 74 -14.159 1.640 -11.373 605 H LYS 75 H LYS 75 -10.932 -0.355 -11.934 606 HA LYS 75 HA LYS 75 -9.358 -2.038 -13.560 607 HB2 LYS 75 1HB LYS 75 -8.850 -0.480 -11.047 608 HB3 LYS 75 2HB LYS 75 -7.622 -1.576 -11.667 609 HG2 LYS 75 1HG LYS 75 -8.742 0.253 -13.664 610 HG3 LYS 75 2HG LYS 75 -7.859 1.036 -12.351 611 HD2 LYS 75 1HD LYS 75 -6.083 0.620 -13.692 612 HD3 LYS 75 2HD LYS 75 -6.155 -0.964 -12.916 613 HE2 LYS 75 1HE LYS 75 -7.887 -0.649 -15.269 614 HE3 LYS 75 2HE LYS 75 -6.159 -0.553 -15.602 615 HZ1 LYS 75 3HZ LYS 75 -7.039 -2.824 -15.762 616 HZ2 LYS 75 1HZ LYS 75 -7.474 -2.770 -14.128 617 HZ3 LYS 75 2HZ LYS 75 -5.844 -2.687 -14.571 618 H GLY 76 H GLY 76 -11.092 -2.596 -10.627 619 HA2 GLY 76 1HA GLY 76 -11.305 -4.440 -9.274 620 HA3 GLY 76 2HA GLY 76 -10.925 -5.358 -10.725 621 H ILE 77 H ILE 77 -9.219 -3.338 -8.329 622 HA ILE 77 HA ILE 77 -7.239 -5.490 -8.061 623 HB ILE 77 HB ILE 77 -5.450 -3.735 -7.878 624 HG12 ILE 77 1HG1 ILE 77 -6.725 -1.774 -9.537 625 HG13 ILE 77 2HG1 ILE 77 -7.691 -2.009 -8.083 626 HG21 ILE 77 1HG2 ILE 77 -6.813 -3.877 -10.563 627 HG22 ILE 77 2HG2 ILE 77 -5.105 -3.573 -10.255 628 HG23 ILE 77 3HG2 ILE 77 -5.800 -5.150 -9.882 629 HD11 ILE 77 3HD1 ILE 77 -6.104 -0.221 -7.767 630 HD12 ILE 77 1HD1 ILE 77 -5.703 -1.579 -6.716 631 HD13 ILE 77 2HD1 ILE 77 -4.770 -1.295 -8.186 632 HA PRO 78 HA PRO 78 -7.628 -4.875 -3.731 633 HB2 PRO 78 1HB PRO 78 -5.133 -5.526 -2.882 634 HB3 PRO 78 2HB PRO 78 -6.291 -6.724 -3.469 635 HG2 PRO 78 1HG PRO 78 -4.003 -5.438 -4.909 636 HG3 PRO 78 2HG PRO 78 -4.515 -7.135 -4.914 637 HD2 PRO 78 1HD PRO 78 -5.119 -5.426 -6.925 638 HD3 PRO 78 2HD PRO 78 -6.193 -6.756 -6.447 639 H ILE 79 H ILE 79 -7.927 -2.766 -3.199 640 HA ILE 79 HA ILE 79 -5.513 -1.095 -2.927 641 HB ILE 79 HB ILE 79 -7.085 -0.298 -4.694 642 HG12 ILE 79 1HG1 ILE 79 -7.366 2.060 -3.505 643 HG13 ILE 79 2HG1 ILE 79 -6.346 1.305 -2.287 644 HG21 ILE 79 1HG2 ILE 79 -8.967 0.551 -2.537 645 HG22 ILE 79 2HG2 ILE 79 -9.253 0.363 -4.267 646 HG23 ILE 79 3HG2 ILE 79 -9.103 -1.061 -3.238 647 HD11 ILE 79 3HD1 ILE 79 -5.495 2.613 -4.547 648 HD12 ILE 79 1HD1 ILE 79 -4.528 1.540 -3.537 649 HD13 ILE 79 2HD1 ILE 79 -5.334 0.909 -4.973 650 H GLU 80 H GLU 80 -5.136 -0.167 -0.993 651 HA GLU 80 HA GLU 80 -7.260 -0.268 1.038 652 HB2 GLU 80 1HB GLU 80 -4.373 -0.893 1.643 653 HB3 GLU 80 2HB GLU 80 -5.762 -1.086 2.703 654 HG2 GLU 80 1HG GLU 80 -5.393 -3.246 2.058 655 HG3 GLU 80 2HG GLU 80 -6.583 -2.736 0.862 656 H ILE 81 H ILE 81 -7.598 1.632 1.976 657 HA ILE 81 HA ILE 81 -5.567 3.729 1.661 658 HB ILE 81 HB ILE 81 -8.500 3.976 2.341 659 HG12 ILE 81 1HG1 ILE 81 -7.639 5.257 -0.101 660 HG13 ILE 81 2HG1 ILE 81 -7.233 3.545 -0.131 661 HG21 ILE 81 1HG2 ILE 81 -7.451 5.807 3.361 662 HG22 ILE 81 2HG2 ILE 81 -6.316 6.011 2.027 663 HG23 ILE 81 3HG2 ILE 81 -8.017 6.427 1.810 664 HD11 ILE 81 3HD1 ILE 81 -9.653 4.657 -0.794 665 HD12 ILE 81 1HD1 ILE 81 -9.349 2.956 -0.443 666 HD13 ILE 81 2HD1 ILE 81 -9.924 4.032 0.833 667 H ILE 82 H ILE 82 -4.413 4.357 3.355 668 HA ILE 82 HA ILE 82 -4.844 3.260 5.950 669 HB ILE 82 HB ILE 82 -3.014 5.553 5.250 670 HG12 ILE 82 1HG1 ILE 82 -2.442 2.583 5.138 671 HG13 ILE 82 2HG1 ILE 82 -2.635 3.633 3.739 672 HG21 ILE 82 1HG2 ILE 82 -1.691 4.643 7.149 673 HG22 ILE 82 2HG2 ILE 82 -3.274 5.262 7.615 674 HG23 ILE 82 3HG2 ILE 82 -3.012 3.523 7.477 675 HD11 ILE 82 3HD1 ILE 82 -0.688 4.961 4.608 676 HD12 ILE 82 1HD1 ILE 82 -0.438 3.669 5.782 677 HD13 ILE 82 2HD1 ILE 82 -0.320 3.327 4.056 678 H ASN 83 H ASN 83 -5.348 4.352 7.882 679 HA ASN 83 HA ASN 83 -7.156 6.612 7.495 680 HB2 ASN 83 1HB ASN 83 -6.924 4.412 9.423 681 HB3 ASN 83 2HB ASN 83 -7.300 5.965 10.163 682 HD21 ASN 83 2HD2 ASN 83 -8.768 3.333 9.396 683 HD22 ASN 83 1HD2 ASN 83 -10.262 3.912 8.751 684 H THR 84 H THR 84 -7.098 8.440 8.955 685 HA THR 84 HA THR 84 -4.662 9.731 9.075 686 HB THR 84 HB THR 84 -6.604 10.421 11.212 687 HG1 THR 84 HG1 THR 84 -8.227 10.846 9.870 688 HG21 THR 84 3HG2 THR 84 -5.560 12.183 9.020 689 HG22 THR 84 1HG2 THR 84 -4.547 11.752 10.396 690 HG23 THR 84 2HG2 THR 84 -6.060 12.622 10.652 691 H ILE 85 H ILE 85 -6.301 7.900 11.637 692 HA ILE 85 HA ILE 85 -4.383 8.382 13.648 693 HB ILE 85 HB ILE 85 -6.178 5.967 13.400 694 HG12 ILE 85 1HG1 ILE 85 -7.178 7.904 15.236 695 HG13 ILE 85 2HG1 ILE 85 -6.852 8.723 13.712 696 HG21 ILE 85 1HG2 ILE 85 -6.034 6.103 15.932 697 HG22 ILE 85 2HG2 ILE 85 -4.589 5.555 15.085 698 HG23 ILE 85 3HG2 ILE 85 -4.682 7.208 15.690 699 HD11 ILE 85 3HD1 ILE 85 -8.566 7.733 12.680 700 HD12 ILE 85 1HD1 ILE 85 -8.246 6.169 13.429 701 HD13 ILE 85 2HD1 ILE 85 -9.141 7.404 14.315 702 H ASP 86 H ASP 86 -4.904 5.461 11.665 703 HA ASP 86 HA ASP 86 -2.714 4.003 12.500 704 HB2 ASP 86 1HB ASP 86 -4.153 4.109 9.858 705 HB3 ASP 86 2HB ASP 86 -2.805 3.007 10.127 706 H TYR 87 H TYR 87 -2.851 6.710 10.310 707 HA TYR 87 HA TYR 87 -0.160 6.338 9.336 708 HB2 TYR 87 1HB TYR 87 -1.934 7.372 7.940 709 HB3 TYR 87 2HB TYR 87 -1.988 8.732 9.055 710 HD1 TYR 87 HD1 TYR 87 -0.007 7.042 6.464 711 HD2 TYR 87 HD2 TYR 87 -0.255 10.410 9.053 712 HE1 TYR 87 HE1 TYR 87 1.782 8.148 5.188 713 HE2 TYR 87 HE2 TYR 87 1.532 11.525 7.783 714 HH TYR 87 HH TYR 87 2.632 11.476 5.720 715 H GLY 88 H GLY 88 -1.819 8.458 11.633 716 HA2 GLY 88 1HA GLY 88 0.392 10.109 12.233 717 HA3 GLY 88 2HA GLY 88 -1.016 9.872 13.255 718 H THR 89 H THR 89 -0.870 7.227 13.894 719 HA THR 89 HA THR 89 1.162 7.229 15.888 720 HB THR 89 HB THR 89 -0.915 6.140 16.396 721 HG1 THR 89 HG1 THR 89 0.062 4.558 17.430 722 HG21 THR 89 3HG2 THR 89 -2.034 5.129 14.749 723 HG22 THR 89 1HG2 THR 89 -0.933 3.764 14.934 724 HG23 THR 89 2HG2 THR 89 -0.586 5.023 13.749 725 H MET 90 H MET 90 0.955 6.014 12.659 726 HA MET 90 HA MET 90 2.447 4.952 11.312 727 HB2 MET 90 1HB MET 90 4.477 5.530 13.473 728 HB3 MET 90 2HB MET 90 4.804 5.189 11.778 729 HG2 MET 90 1HG MET 90 4.626 7.328 11.261 730 HG3 MET 90 2HG MET 90 3.021 7.414 11.981 731 HE1 MET 90 3HE MET 90 6.457 6.602 13.050 732 HE2 MET 90 1HE MET 90 7.064 8.253 13.182 733 HE3 MET 90 2HE MET 90 6.633 7.353 14.636 734 H ASN 91 H ASN 91 1.204 3.009 11.840 735 HA ASN 91 HA ASN 91 2.631 1.136 13.597 736 HB2 ASN 91 1HB ASN 91 -0.188 1.567 12.934 737 HB3 ASN 91 2HB ASN 91 0.293 -0.125 12.840 738 HD21 ASN 91 2HD2 ASN 91 1.856 -0.677 14.780 739 HD22 ASN 91 1HD2 ASN 91 1.225 -0.241 16.328 740 H GLY 92 H GLY 92 4.275 0.493 12.207 741 HA2 GLY 92 1HA GLY 92 4.092 -0.167 9.529 742 HA3 GLY 92 2HA GLY 92 5.235 -0.895 10.648 743 H GLU 93 H GLU 93 3.650 -2.349 12.309 744 HA GLU 93 HA GLU 93 3.216 -4.701 10.906 745 HB2 GLU 93 1HB GLU 93 3.464 -4.424 13.407 746 HB3 GLU 93 2HB GLU 93 1.777 -3.934 13.446 747 HG2 GLU 93 1HG GLU 93 1.135 -6.103 12.503 748 HG3 GLU 93 2HG GLU 93 2.828 -6.593 12.507 749 H LYS 94 H LYS 94 0.810 -2.318 12.000 750 HA LYS 94 HA LYS 94 -1.448 -3.606 10.956 751 HB2 LYS 94 1HB LYS 94 -0.966 -0.649 11.378 752 HB3 LYS 94 2HB LYS 94 -2.539 -1.389 11.102 753 HG2 LYS 94 1HG LYS 94 -0.737 -1.997 13.438 754 HG3 LYS 94 2HG LYS 94 -2.106 -0.883 13.473 755 HD2 LYS 94 1HD LYS 94 -3.441 -2.938 12.580 756 HD3 LYS 94 2HD LYS 94 -2.087 -3.864 13.231 757 HE2 LYS 94 1HE LYS 94 -3.042 -3.752 15.234 758 HE3 LYS 94 2HE LYS 94 -2.783 -2.008 15.216 759 HZ1 LYS 94 3HZ LYS 94 -5.154 -3.276 13.975 760 HZ2 LYS 94 1HZ LYS 94 -4.924 -1.644 14.354 761 HZ3 LYS 94 2HZ LYS 94 -5.133 -2.776 15.591 762 H VAL 95 H VAL 95 0.851 -1.386 9.490 763 HA VAL 95 HA VAL 95 -0.584 -0.874 7.115 764 HB VAL 95 HB VAL 95 2.409 -0.866 7.523 765 HG11 VAL 95 1HG1 VAL 95 2.197 -0.770 5.236 766 HG12 VAL 95 2HG1 VAL 95 0.632 0.042 5.307 767 HG13 VAL 95 3HG1 VAL 95 2.110 0.941 5.651 768 HG21 VAL 95 3HG2 VAL 95 2.158 0.976 8.737 769 HG22 VAL 95 1HG2 VAL 95 1.251 1.736 7.429 770 HG23 VAL 95 2HG2 VAL 95 0.407 0.782 8.649 771 H LEU 96 H LEU 96 2.345 -2.884 7.439 772 HA LEU 96 HA LEU 96 2.178 -4.168 5.003 773 HB2 LEU 96 1HB LEU 96 3.479 -6.013 6.119 774 HB3 LEU 96 2HB LEU 96 4.164 -4.394 6.239 775 HG LEU 96 HG LEU 96 2.670 -4.631 8.550 776 HD11 LEU 96 1HD1 LEU 96 4.167 -7.213 8.163 777 HD12 LEU 96 2HD1 LEU 96 2.418 -7.060 8.000 778 HD13 LEU 96 3HD1 LEU 96 3.191 -6.725 9.549 779 HD21 LEU 96 3HD2 LEU 96 4.817 -4.702 9.661 780 HD22 LEU 96 1HD2 LEU 96 4.901 -3.623 8.268 781 HD23 LEU 96 2HD2 LEU 96 5.600 -5.241 8.174 782 H GLN 97 H GLN 97 0.555 -4.935 8.024 783 HA GLN 97 HA GLN 97 -0.428 -7.473 7.297 784 HB2 GLN 97 1HB GLN 97 -1.205 -5.419 9.330 785 HB3 GLN 97 2HB GLN 97 -2.269 -6.790 9.042 786 HG2 GLN 97 1HG GLN 97 0.641 -7.036 9.764 787 HG3 GLN 97 2HG GLN 97 -0.682 -7.090 10.929 788 HE21 GLN 97 2HE2 GLN 97 1.128 -8.812 8.603 789 HE22 GLN 97 1HE2 GLN 97 0.301 -10.323 8.740 790 H LEU 98 H LEU 98 -2.032 -4.289 7.245 791 HA LEU 98 HA LEU 98 -4.437 -5.104 6.110 792 HB2 LEU 98 1HB LEU 98 -3.394 -2.739 6.958 793 HB3 LEU 98 2HB LEU 98 -3.448 -2.487 5.215 794 HG LEU 98 HG LEU 98 -5.791 -3.168 6.992 795 HD11 LEU 98 1HD1 LEU 98 -6.135 -0.751 5.583 796 HD12 LEU 98 2HD1 LEU 98 -4.537 -0.693 6.323 797 HD13 LEU 98 3HD1 LEU 98 -5.961 -0.985 7.322 798 HD21 LEU 98 3HD2 LEU 98 -7.128 -2.765 4.950 799 HD22 LEU 98 1HD2 LEU 98 -6.082 -4.180 4.823 800 HD23 LEU 98 2HD2 LEU 98 -5.631 -2.675 4.020 801 H ALA 99 H ALA 99 -1.435 -4.060 4.543 802 HA ALA 99 HA ALA 99 -2.356 -4.082 1.898 803 HB1 ALA 99 3HB ALA 99 -0.172 -3.776 1.273 804 HB2 ALA 99 1HB ALA 99 -0.098 -3.266 2.959 805 HB3 ALA 99 2HB ALA 99 0.450 -4.879 2.500 806 H ILE 100 H ILE 100 -0.359 -6.573 3.501 807 HA ILE 100 HA ILE 100 -0.548 -8.507 1.524 808 HB ILE 100 HB ILE 100 -0.343 -8.964 4.503 809 HG12 ILE 100 1HG1 ILE 100 1.897 -8.896 2.484 810 HG13 ILE 100 2HG1 ILE 100 1.392 -7.468 3.379 811 HG21 ILE 100 1HG2 ILE 100 0.918 -11.050 3.599 812 HG22 ILE 100 2HG2 ILE 100 -0.844 -11.057 3.668 813 HG23 ILE 100 3HG2 ILE 100 -0.023 -10.758 2.136 814 HD11 ILE 100 3HD1 ILE 100 2.147 -9.984 4.804 815 HD12 ILE 100 1HD1 ILE 100 3.371 -8.840 4.257 816 HD13 ILE 100 2HD1 ILE 100 2.132 -8.325 5.401 817 H ASN 101 H ASN 101 -2.664 -7.960 4.319 818 HA ASN 101 HA ASN 101 -4.327 -10.163 4.063 819 HB2 ASN 101 1HB ASN 101 -4.305 -8.415 5.915 820 HB3 ASN 101 2HB ASN 101 -5.301 -7.419 4.858 821 HD21 ASN 101 2HD2 ASN 101 -7.236 -7.437 5.781 822 HD22 ASN 101 1HD2 ASN 101 -8.131 -8.853 6.204 823 H ALA 102 H ALA 102 -4.853 -6.903 2.713 824 HA ALA 102 HA ALA 102 -7.172 -7.465 1.283 825 HB1 ALA 102 3HB ALA 102 -5.119 -5.544 0.250 826 HB2 ALA 102 1HB ALA 102 -6.879 -5.422 0.214 827 HB3 ALA 102 2HB ALA 102 -6.010 -5.211 1.734 828 H PHE 103 H PHE 103 -3.784 -7.650 0.227 829 HA PHE 103 HA PHE 103 -4.282 -8.401 -2.425 830 HB2 PHE 103 1HB PHE 103 -2.085 -7.629 -1.631 831 HB3 PHE 103 2HB PHE 103 -1.910 -9.103 -0.684 832 HD1 PHE 103 HD1 PHE 103 -2.850 -8.281 -4.205 833 HD2 PHE 103 HD2 PHE 103 -0.422 -10.590 -1.580 834 HE1 PHE 103 HE1 PHE 103 -1.820 -9.395 -6.142 835 HE2 PHE 103 HE2 PHE 103 0.612 -11.707 -3.512 836 HZ PHE 103 HZ PHE 103 -0.086 -11.110 -5.797 837 H ASN 104 H ASN 104 -4.021 -10.298 0.526 838 HA ASN 104 HA ASN 104 -4.051 -12.835 -0.785 839 HB2 ASN 104 1HB ASN 104 -4.282 -11.885 2.039 840 HB3 ASN 104 2HB ASN 104 -4.791 -13.529 1.661 841 HD21 ASN 104 2HD2 ASN 104 -2.865 -13.516 3.347 842 HD22 ASN 104 1HD2 ASN 104 -1.324 -13.847 2.638 843 H ASN 105 H ASN 105 -6.495 -10.771 0.710 844 HA ASN 105 HA ASN 105 -8.626 -12.644 0.435 845 HB2 ASN 105 1HB ASN 105 -8.273 -10.226 1.749 846 HB3 ASN 105 2HB ASN 105 -9.443 -9.844 0.490 847 HD21 ASN 105 2HD2 ASN 105 -9.533 -10.235 3.506 848 HD22 ASN 105 1HD2 ASN 105 -10.884 -11.285 3.742 849 H LYS 106 H LYS 106 -7.204 -10.227 -1.622 850 HA LYS 106 HA LYS 106 -7.555 -9.650 -3.794 851 HB2 LYS 106 1HB LYS 106 -9.245 -12.141 -4.004 852 HB3 LYS 106 2HB LYS 106 -8.389 -11.312 -5.298 853 HG2 LYS 106 1HG LYS 106 -6.290 -11.865 -3.807 854 HG3 LYS 106 2HG LYS 106 -7.351 -13.136 -3.195 855 HD2 LYS 106 1HD LYS 106 -7.739 -13.858 -5.544 856 HD3 LYS 106 2HD LYS 106 -6.542 -12.669 -6.064 857 HE2 LYS 106 1HE LYS 106 -4.875 -13.794 -4.611 858 HE3 LYS 106 2HE LYS 106 -6.079 -15.027 -4.240 859 HZ1 LYS 106 3HZ LYS 106 -4.660 -15.813 -5.980 860 HZ2 LYS 106 1HZ LYS 106 -4.925 -14.422 -6.908 861 HZ3 LYS 106 2HZ LYS 106 -6.189 -15.514 -6.642 862 H SER 107 H SER 107 -9.398 -8.746 -1.726 863 HA SER 107 HA SER 107 -11.440 -7.686 -3.455 864 HB2 SER 107 1HB SER 107 -12.323 -9.939 -2.635 865 HB3 SER 107 2HB SER 107 -12.389 -9.211 -1.029 866 HG SER 107 HG SER 107 -13.975 -7.899 -1.665 867 H SER 108 H SER 108 -12.081 -5.706 -2.803 868 HA SER 108 HA SER 108 -12.025 -4.860 -0.074 869 HB2 SER 108 1HB SER 108 -9.557 -4.806 -1.053 870 HB3 SER 108 2HB SER 108 -10.117 -3.284 -1.747 871 HG SER 108 HG SER 108 -10.882 -2.930 0.566 872 H VAL 109 H VAL 109 -14.127 -4.839 -1.690 873 HA VAL 109 HA VAL 109 -14.370 -2.122 -2.782 874 HB VAL 109 HB VAL 109 -14.992 -3.950 -4.300 875 HG11 VAL 109 1HG1 VAL 109 -17.018 -5.280 -3.845 876 HG12 VAL 109 2HG1 VAL 109 -15.728 -5.597 -2.683 877 HG13 VAL 109 3HG1 VAL 109 -17.093 -4.576 -2.229 878 HG21 VAL 109 3HG2 VAL 109 -17.635 -3.054 -4.198 879 HG22 VAL 109 1HG2 VAL 109 -16.668 -1.736 -3.535 880 HG23 VAL 109 2HG2 VAL 109 -16.312 -2.369 -5.143 Start of MODEL 18 1 H1 GLY 1 H GLY 1 8.200 -21.804 -5.635 2 HA2 GLY 1 1HA GLY 1 10.295 -21.186 -7.261 3 HA3 GLY 1 2HA GLY 1 8.927 -20.413 -8.048 4 HA PRO 2 HA PRO 2 10.775 -17.786 -4.541 5 HB2 PRO 2 1HB PRO 2 12.026 -15.928 -6.075 6 HB3 PRO 2 2HB PRO 2 12.824 -17.399 -5.505 7 HG2 PRO 2 1HG PRO 2 11.605 -16.819 -8.177 8 HG3 PRO 2 2HG PRO 2 13.135 -17.632 -7.797 9 HD2 PRO 2 1HD PRO 2 10.888 -18.991 -8.457 10 HD3 PRO 2 2HD PRO 2 12.100 -19.638 -7.332 11 H GLY 3 H GLY 3 8.756 -17.012 -4.016 12 HA2 GLY 3 1HA GLY 3 7.543 -15.049 -5.847 13 HA3 GLY 3 2HA GLY 3 6.685 -15.924 -4.589 14 H SER 4 H SER 4 6.449 -13.184 -4.849 15 HA SER 4 HA SER 4 7.196 -12.329 -2.230 16 HB2 SER 4 1HB SER 4 8.454 -10.267 -3.160 17 HB3 SER 4 2HB SER 4 9.326 -11.798 -3.063 18 HG SER 4 HG SER 4 9.151 -12.047 -5.229 19 H MET 5 H MET 5 5.919 -10.677 -1.524 20 HA MET 5 HA MET 5 3.927 -9.686 -3.439 21 HB2 MET 5 1HB MET 5 3.539 -10.880 -1.029 22 HB3 MET 5 2HB MET 5 3.521 -9.185 -0.559 23 HG2 MET 5 1HG MET 5 1.810 -8.824 -2.373 24 HG3 MET 5 2HG MET 5 1.718 -10.579 -2.511 25 HE1 MET 5 3HE MET 5 0.091 -7.778 0.580 26 HE2 MET 5 1HE MET 5 1.687 -8.300 1.118 27 HE3 MET 5 2HE MET 5 1.495 -7.541 -0.462 28 H ASN 6 H ASN 6 4.428 -7.766 -4.266 29 HA ASN 6 HA ASN 6 5.886 -5.824 -2.631 30 HB2 ASN 6 1HB ASN 6 5.230 -5.768 -5.587 31 HB3 ASN 6 2HB ASN 6 6.255 -4.615 -4.736 32 HD21 ASN 6 2HD2 ASN 6 8.298 -4.941 -5.187 33 HD22 ASN 6 1HD2 ASN 6 9.075 -6.474 -5.364 34 H ILE 7 H ILE 7 4.959 -4.052 -1.818 35 HA ILE 7 HA ILE 7 2.163 -3.508 -2.552 36 HB ILE 7 HB ILE 7 3.628 -2.592 -0.077 37 HG12 ILE 7 1HG1 ILE 7 1.586 -4.465 0.530 38 HG13 ILE 7 2HG1 ILE 7 2.571 -5.170 -0.747 39 HG21 ILE 7 1HG2 ILE 7 0.827 -2.327 -1.075 40 HG22 ILE 7 2HG2 ILE 7 1.134 -2.394 0.659 41 HG23 ILE 7 3HG2 ILE 7 1.868 -1.122 -0.317 42 HD11 ILE 7 3HD1 ILE 7 3.121 -4.955 2.034 43 HD12 ILE 7 1HD1 ILE 7 4.057 -5.758 0.775 44 HD13 ILE 7 2HD1 ILE 7 4.343 -4.056 1.135 45 H LEU 8 H LEU 8 1.475 -1.412 -2.995 46 HA LEU 8 HA LEU 8 3.629 0.522 -3.545 47 HB2 LEU 8 1HB LEU 8 2.575 -0.432 -5.570 48 HB3 LEU 8 2HB LEU 8 1.022 0.199 -5.025 49 HG LEU 8 HG LEU 8 2.290 1.497 -6.832 50 HD11 LEU 8 1HD1 LEU 8 1.822 3.568 -4.938 51 HD12 LEU 8 2HD1 LEU 8 0.621 2.300 -4.697 52 HD13 LEU 8 3HD1 LEU 8 0.808 3.048 -6.283 53 HD21 LEU 8 3HD2 LEU 8 4.398 1.338 -5.199 54 HD22 LEU 8 1HD2 LEU 8 3.731 2.874 -4.645 55 HD23 LEU 8 2HD2 LEU 8 4.170 2.665 -6.341 56 H LEU 9 H LEU 9 3.513 2.388 -2.490 57 HA LEU 9 HA LEU 9 0.991 3.077 -1.146 58 HB2 LEU 9 1HB LEU 9 3.083 2.716 0.206 59 HB3 LEU 9 2HB LEU 9 3.736 4.163 -0.557 60 HG LEU 9 HG LEU 9 2.009 5.520 0.470 61 HD11 LEU 9 1HD1 LEU 9 0.715 4.137 2.354 62 HD12 LEU 9 2HD1 LEU 9 0.872 2.874 1.133 63 HD13 LEU 9 3HD1 LEU 9 0.067 4.391 0.732 64 HD21 LEU 9 3HD2 LEU 9 3.408 3.686 2.411 65 HD22 LEU 9 1HD2 LEU 9 2.648 5.219 2.838 66 HD23 LEU 9 2HD2 LEU 9 4.032 5.196 1.743 67 H VAL 10 H VAL 10 -0.063 4.915 -1.616 68 HA VAL 10 HA VAL 10 1.104 6.649 -3.678 69 HB VAL 10 HB VAL 10 -1.777 6.563 -2.784 70 HG11 VAL 10 1HG1 VAL 10 -0.271 7.947 -4.952 71 HG12 VAL 10 2HG1 VAL 10 -1.945 7.472 -5.238 72 HG13 VAL 10 3HG1 VAL 10 -1.551 8.555 -3.904 73 HG21 VAL 10 3HG2 VAL 10 -1.084 4.373 -3.654 74 HG22 VAL 10 1HG2 VAL 10 -2.226 5.177 -4.731 75 HG23 VAL 10 2HG2 VAL 10 -0.508 5.149 -5.129 76 H CYS 11 H CYS 11 2.379 7.988 -2.401 77 HA CYS 11 HA CYS 11 1.100 10.245 -1.290 78 HB2 CYS 11 1HB CYS 11 1.615 10.022 1.040 79 HB3 CYS 11 2HB CYS 11 0.728 8.581 0.556 80 HG CYS 11 HG CYS 11 3.488 8.698 2.167 81 H GLY 12 H GLY 12 2.570 11.914 -0.731 82 HA2 GLY 12 1HA GLY 12 4.586 13.034 -0.730 83 HA3 GLY 12 2HA GLY 12 5.397 11.477 -0.714 84 H ALA 13 H ALA 13 6.916 12.511 -2.183 85 HA ALA 13 HA ALA 13 6.142 12.041 -4.940 86 HB1 ALA 13 3HB ALA 13 6.844 14.746 -3.883 87 HB2 ALA 13 1HB ALA 13 7.259 14.307 -5.540 88 HB3 ALA 13 2HB ALA 13 5.574 14.279 -5.015 89 H GLY 14 H GLY 14 8.015 10.964 -2.870 90 HA2 GLY 14 1HA GLY 14 10.349 10.840 -4.611 91 HA3 GLY 14 2HA GLY 14 10.621 11.474 -2.996 92 H MET 15 H MET 15 11.971 9.793 -2.376 93 HA MET 15 HA MET 15 10.710 7.549 -1.222 94 HB2 MET 15 1HB MET 15 11.686 5.758 -2.570 95 HB3 MET 15 2HB MET 15 10.617 6.760 -3.543 96 HG2 MET 15 1HG MET 15 12.860 8.017 -4.103 97 HG3 MET 15 2HG MET 15 13.568 6.468 -3.652 98 HE1 MET 15 3HE MET 15 13.504 6.778 -7.636 99 HE2 MET 15 1HE MET 15 13.972 7.843 -6.311 100 HE3 MET 15 2HE MET 15 14.554 6.179 -6.350 101 H SER 16 H SER 16 12.339 9.445 -0.169 102 HA SER 16 HA SER 16 15.014 8.283 0.042 103 HB2 SER 16 1HB SER 16 15.343 10.403 1.519 104 HB3 SER 16 2HB SER 16 15.207 10.595 -0.228 105 HG SER 16 HG SER 16 13.488 11.742 0.092 106 H THR 17 H THR 17 13.930 6.407 1.154 107 HA THR 17 HA THR 17 13.348 5.222 3.021 108 HB THR 17 HB THR 17 14.701 6.065 5.119 109 HG1 THR 17 HG1 THR 17 15.375 8.049 4.420 110 HG21 THR 17 3HG2 THR 17 16.344 4.582 4.533 111 HG22 THR 17 1HG2 THR 17 16.472 5.204 2.889 112 HG23 THR 17 2HG2 THR 17 15.127 4.151 3.331 113 H SER 18 H SER 18 11.158 5.926 3.093 114 HA SER 18 HA SER 18 10.454 8.202 4.731 115 HB2 SER 18 1HB SER 18 8.321 6.309 3.979 116 HB3 SER 18 2HB SER 18 8.407 8.058 3.767 117 HG SER 18 HG SER 18 8.508 7.175 1.748 118 H MET 19 H MET 19 8.994 8.029 6.569 119 HA MET 19 HA MET 19 9.929 6.374 8.581 120 HB2 MET 19 1HB MET 19 7.183 7.623 8.385 121 HB3 MET 19 2HB MET 19 7.951 7.049 9.860 122 HG2 MET 19 1HG MET 19 9.027 9.263 8.131 123 HG3 MET 19 2HG MET 19 8.034 9.504 9.566 124 HE1 MET 19 3HE MET 19 11.291 9.821 8.256 125 HE2 MET 19 1HE MET 19 12.469 9.138 9.377 126 HE3 MET 19 2HE MET 19 11.572 8.080 8.289 127 H LEU 20 H LEU 20 6.899 6.025 6.734 128 HA LEU 20 HA LEU 20 5.975 3.682 7.860 129 HB2 LEU 20 1HB LEU 20 5.668 4.990 5.216 130 HB3 LEU 20 2HB LEU 20 5.153 3.310 5.353 131 HG LEU 20 HG LEU 20 3.314 4.942 5.644 132 HD11 LEU 20 1HD1 LEU 20 3.889 3.398 8.165 133 HD12 LEU 20 2HD1 LEU 20 3.298 2.671 6.670 134 HD13 LEU 20 3HD1 LEU 20 2.313 3.859 7.523 135 HD21 LEU 20 3HD2 LEU 20 5.019 6.482 6.984 136 HD22 LEU 20 1HD2 LEU 20 4.298 5.636 8.353 137 HD23 LEU 20 2HD2 LEU 20 3.275 6.554 7.247 138 H VAL 21 H VAL 21 7.975 3.965 4.918 139 HA VAL 21 HA VAL 21 8.358 1.278 4.409 140 HB VAL 21 HB VAL 21 10.401 3.469 4.014 141 HG11 VAL 21 1HG1 VAL 21 10.601 0.701 3.606 142 HG12 VAL 21 2HG1 VAL 21 10.387 1.417 2.007 143 HG13 VAL 21 3HG1 VAL 21 11.707 1.955 3.046 144 HG21 VAL 21 3HG2 VAL 21 8.355 4.130 2.967 145 HG22 VAL 21 1HG2 VAL 21 9.444 3.554 1.706 146 HG23 VAL 21 2HG2 VAL 21 8.129 2.525 2.272 147 H GLN 22 H GLN 22 10.225 3.401 6.548 148 HA GLN 22 HA GLN 22 12.234 1.604 7.257 149 HB2 GLN 22 1HB GLN 22 11.042 4.029 8.509 150 HB3 GLN 22 2HB GLN 22 12.069 3.012 9.511 151 HG2 GLN 22 1HG GLN 22 13.080 3.802 6.837 152 HG3 GLN 22 2HG GLN 22 13.032 5.025 8.106 153 HE21 GLN 22 2HE2 GLN 22 15.351 3.930 6.833 154 HE22 GLN 22 1HE2 GLN 22 16.293 3.166 8.063 155 H ARG 23 H ARG 23 9.183 2.302 8.964 156 HA ARG 23 HA ARG 23 9.462 0.433 11.006 157 HB2 ARG 23 1HB ARG 23 6.938 1.408 9.658 158 HB3 ARG 23 2HB ARG 23 6.986 0.531 11.181 159 HG2 ARG 23 1HG ARG 23 8.728 2.846 11.207 160 HG3 ARG 23 2HG ARG 23 7.052 3.270 10.852 161 HD2 ARG 23 1HD ARG 23 7.225 3.361 13.193 162 HD3 ARG 23 2HD ARG 23 6.426 1.827 12.849 163 HE ARG 23 HE ARG 23 9.111 1.250 12.987 164 HH11 ARG 23 1HH1 ARG 23 6.715 2.624 15.106 165 HH12 ARG 23 2HH1 ARG 23 7.475 2.048 16.553 166 HH21 ARG 23 1HH2 ARG 23 10.122 0.486 14.885 167 HH22 ARG 23 2HH2 ARG 23 9.413 0.832 16.425 168 H ILE 24 H ILE 24 7.498 0.045 8.049 169 HA ILE 24 HA ILE 24 6.858 -2.623 8.347 170 HB ILE 24 HB ILE 24 7.417 -1.185 5.750 171 HG12 ILE 24 1HG1 ILE 24 4.638 -1.644 6.555 172 HG13 ILE 24 2HG1 ILE 24 5.515 -0.582 7.651 173 HG21 ILE 24 1HG2 ILE 24 5.452 -3.043 5.280 174 HG22 ILE 24 2HG2 ILE 24 7.155 -3.214 4.857 175 HG23 ILE 24 3HG2 ILE 24 6.549 -3.897 6.365 176 HD11 ILE 24 3HD1 ILE 24 6.217 0.427 5.226 177 HD12 ILE 24 1HD1 ILE 24 4.565 -0.113 4.931 178 HD13 ILE 24 2HD1 ILE 24 4.902 1.027 6.235 179 H GLU 25 H GLU 25 9.748 -1.202 6.873 180 HA GLU 25 HA GLU 25 10.896 -3.542 5.875 181 HB2 GLU 25 1HB GLU 25 11.945 -0.878 6.711 182 HB3 GLU 25 2HB GLU 25 13.101 -2.174 6.434 183 HG2 GLU 25 1HG GLU 25 11.040 -1.301 4.425 184 HG3 GLU 25 2HG GLU 25 12.697 -0.702 4.471 185 H LYS 26 H LYS 26 11.269 -2.001 9.053 186 HA LYS 26 HA LYS 26 13.109 -3.857 10.101 187 HB2 LYS 26 1HB LYS 26 11.352 -1.739 11.181 188 HB3 LYS 26 2HB LYS 26 11.828 -2.988 12.323 189 HG2 LYS 26 1HG LYS 26 14.029 -1.933 10.707 190 HG3 LYS 26 2HG LYS 26 13.261 -0.749 11.768 191 HD2 LYS 26 1HD LYS 26 13.873 -1.867 13.682 192 HD3 LYS 26 2HD LYS 26 13.958 -3.431 12.869 193 HE2 LYS 26 1HE LYS 26 15.917 -2.101 11.574 194 HE3 LYS 26 2HE LYS 26 15.998 -1.320 13.151 195 HZ1 LYS 26 3HZ LYS 26 17.207 -3.054 13.785 196 HZ2 LYS 26 1HZ LYS 26 16.851 -3.929 12.382 197 HZ3 LYS 26 2HZ LYS 26 15.801 -3.992 13.707 198 H TYR 27 H TYR 27 9.618 -3.568 10.791 199 HA TYR 27 HA TYR 27 9.310 -5.887 12.252 200 HB2 TYR 27 1HB TYR 27 7.541 -4.216 12.038 201 HB3 TYR 27 2HB TYR 27 7.336 -4.625 10.338 202 HD1 TYR 27 HD2 TYR 27 6.391 -6.842 9.712 203 HD2 TYR 27 HD1 TYR 27 6.526 -5.517 13.754 204 HE1 TYR 27 HE2 TYR 27 4.725 -8.546 10.321 205 HE2 TYR 27 HE1 TYR 27 4.862 -7.218 14.373 206 HH TYR 27 HH TYR 27 3.348 -9.282 11.932 207 H ALA 28 H ALA 28 8.917 -5.480 8.738 208 HA ALA 28 HA ALA 28 8.301 -8.147 8.145 209 HB1 ALA 28 3HB ALA 28 9.821 -6.368 6.268 210 HB2 ALA 28 1HB ALA 28 8.610 -7.596 5.896 211 HB3 ALA 28 2HB ALA 28 8.125 -6.076 6.650 212 H LYS 29 H LYS 29 11.435 -6.470 7.827 213 HA LYS 29 HA LYS 29 12.983 -8.638 7.088 214 HB2 LYS 29 1HB LYS 29 13.911 -6.433 7.006 215 HB3 LYS 29 2HB LYS 29 13.686 -6.209 8.736 216 HG2 LYS 29 1HG LYS 29 15.519 -7.453 9.279 217 HG3 LYS 29 2HG LYS 29 15.415 -8.446 7.825 218 HD2 LYS 29 1HD LYS 29 15.890 -5.950 6.800 219 HD3 LYS 29 2HD LYS 29 16.838 -5.934 8.289 220 HE2 LYS 29 1HE LYS 29 17.849 -8.102 7.581 221 HE3 LYS 29 2HE LYS 29 17.005 -7.936 6.041 222 HZ1 LYS 29 3HZ LYS 29 19.380 -7.148 6.100 223 HZ2 LYS 29 1HZ LYS 29 18.855 -5.865 7.070 224 HZ3 LYS 29 2HZ LYS 29 18.255 -6.037 5.499 225 H SER 30 H SER 30 11.736 -7.778 10.226 226 HA SER 30 HA SER 30 13.435 -9.533 11.716 227 HB2 SER 30 1HB SER 30 11.031 -7.867 12.308 228 HB3 SER 30 2HB SER 30 11.434 -9.167 13.429 229 HG SER 30 HG SER 30 13.081 -8.051 14.111 230 H LYS 31 H LYS 31 10.059 -9.694 10.619 231 HA LYS 31 HA LYS 31 9.638 -12.332 11.624 232 HB2 LYS 31 1HB LYS 31 8.114 -10.396 9.963 233 HB3 LYS 31 2HB LYS 31 7.670 -12.091 9.820 234 HG2 LYS 31 1HG LYS 31 6.274 -11.041 11.463 235 HG3 LYS 31 2HG LYS 31 7.355 -12.182 12.267 236 HD2 LYS 31 1HD LYS 31 8.542 -9.551 12.096 237 HD3 LYS 31 2HD LYS 31 6.972 -9.494 12.903 238 HE2 LYS 31 1HE LYS 31 7.926 -11.591 14.176 239 HE3 LYS 31 2HE LYS 31 9.477 -10.899 13.702 240 HZ1 LYS 31 3HZ LYS 31 8.723 -8.789 14.737 241 HZ2 LYS 31 1HZ LYS 31 8.907 -10.061 15.838 242 HZ3 LYS 31 2HZ LYS 31 7.361 -9.601 15.326 243 H ASN 32 H ASN 32 11.248 -11.111 8.914 244 HA ASN 32 HA ASN 32 12.256 -12.097 7.129 245 HB2 ASN 32 1HB ASN 32 12.827 -13.799 8.951 246 HB3 ASN 32 2HB ASN 32 11.506 -14.771 8.307 247 HD21 ASN 32 2HD2 ASN 32 12.758 -16.438 7.595 248 HD22 ASN 32 1HD2 ASN 32 13.876 -16.296 6.285 249 H ILE 33 H ILE 33 9.816 -11.202 6.568 250 HA ILE 33 HA ILE 33 8.369 -13.357 5.202 251 HB ILE 33 HB ILE 33 7.547 -10.496 5.711 252 HG12 ILE 33 1HG1 ILE 33 6.113 -12.827 6.876 253 HG13 ILE 33 2HG1 ILE 33 7.675 -12.412 7.575 254 HG21 ILE 33 1HG2 ILE 33 6.428 -12.626 4.028 255 HG22 ILE 33 2HG2 ILE 33 5.270 -11.824 5.088 256 HG23 ILE 33 3HG2 ILE 33 6.216 -10.877 3.940 257 HD11 ILE 33 3HD1 ILE 33 6.776 -10.057 7.812 258 HD12 ILE 33 1HD1 ILE 33 5.192 -10.738 7.443 259 HD13 ILE 33 2HD1 ILE 33 6.078 -11.287 8.866 260 H ASN 34 H ASN 34 7.998 -13.350 3.008 261 HA ASN 34 HA ASN 34 9.892 -11.840 1.427 262 HB2 ASN 34 1HB ASN 34 7.808 -13.804 0.457 263 HB3 ASN 34 2HB ASN 34 9.248 -13.264 -0.403 264 HD21 ASN 34 2HD2 ASN 34 11.227 -13.486 1.356 265 HD22 ASN 34 1HD2 ASN 34 11.411 -15.117 1.892 266 H ALA 35 H ALA 35 8.994 -9.727 1.759 267 HA ALA 35 HA ALA 35 6.970 -9.088 -0.219 268 HB1 ALA 35 3HB ALA 35 5.464 -9.367 1.539 269 HB2 ALA 35 1HB ALA 35 6.566 -8.659 2.720 270 HB3 ALA 35 2HB ALA 35 5.775 -7.631 1.525 271 H THR 36 H THR 36 6.717 -6.688 -0.453 272 HA THR 36 HA THR 36 9.008 -5.145 0.499 273 HB THR 36 HB THR 36 8.864 -4.297 -2.113 274 HG1 THR 36 HG1 THR 36 8.885 -7.139 -2.197 275 HG21 THR 36 3HG2 THR 36 11.057 -5.152 -2.330 276 HG22 THR 36 1HG2 THR 36 10.742 -6.464 -1.195 277 HG23 THR 36 2HG2 THR 36 10.857 -4.803 -0.613 278 H ILE 37 H ILE 37 8.779 -2.816 0.046 279 HA ILE 37 HA ILE 37 6.084 -1.912 -0.599 280 HB ILE 37 HB ILE 37 6.107 -2.302 1.861 281 HG12 ILE 37 1HG1 ILE 37 5.935 0.629 1.738 282 HG13 ILE 37 2HG1 ILE 37 5.071 -0.192 0.442 283 HG21 ILE 37 1HG2 ILE 37 7.501 -1.142 3.322 284 HG22 ILE 37 2HG2 ILE 37 8.580 -1.617 2.011 285 HG23 ILE 37 3HG2 ILE 37 7.967 0.035 2.094 286 HD11 ILE 37 3HD1 ILE 37 4.656 -1.206 3.187 287 HD12 ILE 37 1HD1 ILE 37 3.960 0.363 2.785 288 HD13 ILE 37 2HD1 ILE 37 3.525 -1.063 1.842 289 H GLU 38 H GLU 38 6.003 0.132 -1.440 290 HA GLU 38 HA GLU 38 8.241 1.937 -1.218 291 HB2 GLU 38 1HB GLU 38 8.800 0.249 -3.068 292 HB3 GLU 38 2HB GLU 38 7.516 1.017 -3.991 293 HG2 GLU 38 1HG GLU 38 8.711 2.901 -4.361 294 HG3 GLU 38 2HG GLU 38 9.564 2.796 -2.822 295 H ALA 39 H ALA 39 7.706 4.040 -1.704 296 HA ALA 39 HA ALA 39 4.889 4.494 -2.441 297 HB1 ALA 39 3HB ALA 39 4.949 6.514 -1.122 298 HB2 ALA 39 1HB ALA 39 5.478 5.151 -0.136 299 HB3 ALA 39 2HB ALA 39 6.665 6.282 -0.787 300 H ILE 40 H ILE 40 4.385 6.255 -3.803 301 HA ILE 40 HA ILE 40 6.502 7.776 -5.041 302 HB ILE 40 HB ILE 40 5.550 6.999 -7.370 303 HG12 ILE 40 1HG1 ILE 40 5.052 4.593 -7.407 304 HG13 ILE 40 2HG1 ILE 40 5.167 4.537 -5.651 305 HG21 ILE 40 1HG2 ILE 40 7.603 6.169 -7.656 306 HG22 ILE 40 2HG2 ILE 40 7.862 6.561 -5.956 307 HG23 ILE 40 3HG2 ILE 40 7.369 4.933 -6.420 308 HD11 ILE 40 3HD1 ILE 40 3.139 6.102 -7.228 309 HD12 ILE 40 1HD1 ILE 40 2.855 4.569 -6.405 310 HD13 ILE 40 2HD1 ILE 40 3.245 6.014 -5.470 311 H ALA 41 H ALA 41 5.476 9.058 -6.989 312 HA ALA 41 HA ALA 41 3.322 10.567 -5.891 313 HB1 ALA 41 3HB ALA 41 4.683 11.927 -7.114 314 HB2 ALA 41 1HB ALA 41 4.981 10.706 -8.352 315 HB3 ALA 41 2HB ALA 41 3.451 11.583 -8.328 316 H GLU 42 H GLU 42 1.542 11.228 -7.667 317 HA GLU 42 HA GLU 42 -0.020 8.827 -8.025 318 HB2 GLU 42 1HB GLU 42 -1.778 10.419 -8.820 319 HB3 GLU 42 2HB GLU 42 -1.179 10.756 -7.203 320 HG2 GLU 42 1HG GLU 42 -0.496 12.784 -7.780 321 HG3 GLU 42 2HG GLU 42 0.331 12.180 -9.213 322 H THR 43 H THR 43 1.768 11.070 -10.015 323 HA THR 43 HA THR 43 0.685 10.246 -12.515 324 HB THR 43 HB THR 43 1.826 12.413 -12.235 325 HG1 THR 43 HG1 THR 43 2.746 12.338 -14.235 326 HG21 THR 43 3HG2 THR 43 4.522 11.274 -12.446 327 HG22 THR 43 1HG2 THR 43 3.743 11.021 -10.885 328 HG23 THR 43 2HG2 THR 43 3.946 12.656 -11.515 329 H ARG 44 H ARG 44 3.217 9.055 -10.450 330 HA ARG 44 HA ARG 44 4.235 7.278 -12.531 331 HB2 ARG 44 1HB ARG 44 5.463 8.582 -10.431 332 HB3 ARG 44 2HB ARG 44 5.318 6.934 -9.835 333 HG2 ARG 44 1HG ARG 44 6.325 6.272 -12.123 334 HG3 ARG 44 2HG ARG 44 6.830 7.961 -12.198 335 HD2 ARG 44 1HD ARG 44 7.821 7.582 -9.875 336 HD3 ARG 44 2HD ARG 44 7.598 5.862 -10.190 337 HE ARG 44 HE ARG 44 9.027 7.245 -12.266 338 HH11 ARG 44 1HH1 ARG 44 9.294 5.595 -9.213 339 HH12 ARG 44 2HH1 ARG 44 10.958 5.168 -9.440 340 HH21 ARG 44 1HH2 ARG 44 11.218 6.690 -12.577 341 HH22 ARG 44 2HH2 ARG 44 12.051 5.793 -11.353 342 H LEU 45 H LEU 45 1.902 7.279 -10.101 343 HA LEU 45 HA LEU 45 2.009 4.719 -9.033 344 HB2 LEU 45 1HB LEU 45 0.467 6.182 -8.074 345 HB3 LEU 45 2HB LEU 45 -0.251 6.592 -9.630 346 HG LEU 45 HG LEU 45 -0.532 3.791 -8.687 347 HD11 LEU 45 1HD1 LEU 45 -1.350 6.048 -7.104 348 HD12 LEU 45 2HD1 LEU 45 -1.485 4.325 -6.756 349 HD13 LEU 45 3HD1 LEU 45 -2.754 5.142 -7.668 350 HD21 LEU 45 3HD2 LEU 45 -2.915 4.467 -9.598 351 HD22 LEU 45 1HD2 LEU 45 -1.594 4.054 -10.692 352 HD23 LEU 45 2HD2 LEU 45 -1.991 5.746 -10.388 353 H SER 46 H SER 46 0.564 5.835 -12.064 354 HA SER 46 HA SER 46 -0.490 3.272 -12.766 355 HB2 SER 46 1HB SER 46 -0.058 4.989 -15.052 356 HB3 SER 46 2HB SER 46 -1.576 4.456 -14.330 357 HG SER 46 HG SER 46 -0.616 6.867 -14.296 358 H GLU 47 H GLU 47 2.613 4.537 -12.743 359 HA GLU 47 HA GLU 47 3.524 2.804 -14.930 360 HB2 GLU 47 1HB GLU 47 4.342 5.380 -13.964 361 HB3 GLU 47 2HB GLU 47 5.694 4.262 -13.855 362 HG2 GLU 47 1HG GLU 47 4.065 4.639 -16.350 363 HG3 GLU 47 2HG GLU 47 5.523 5.562 -15.991 364 H VAL 48 H VAL 48 2.931 2.491 -11.779 365 HA VAL 48 HA VAL 48 5.199 0.655 -11.371 366 HB VAL 48 HB VAL 48 5.033 1.114 -8.934 367 HG11 VAL 48 1HG1 VAL 48 6.220 2.686 -10.951 368 HG12 VAL 48 2HG1 VAL 48 5.619 3.799 -9.720 369 HG13 VAL 48 3HG1 VAL 48 6.730 2.505 -9.272 370 HG21 VAL 48 3HG2 VAL 48 3.879 3.209 -8.241 371 HG22 VAL 48 1HG2 VAL 48 3.154 3.287 -9.847 372 HG23 VAL 48 2HG2 VAL 48 2.783 1.935 -8.777 373 H VAL 49 H VAL 49 1.810 1.377 -10.731 374 HA VAL 49 HA VAL 49 1.164 -0.935 -9.278 375 HB VAL 49 HB VAL 49 -1.171 -0.521 -9.980 376 HG11 VAL 49 1HG1 VAL 49 -1.170 1.970 -9.198 377 HG12 VAL 49 2HG1 VAL 49 -0.649 0.696 -8.092 378 HG13 VAL 49 3HG1 VAL 49 0.550 1.683 -8.932 379 HG21 VAL 49 3HG2 VAL 49 -1.578 0.443 -11.940 380 HG22 VAL 49 1HG2 VAL 49 -0.937 1.954 -11.297 381 HG23 VAL 49 2HG2 VAL 49 0.130 0.833 -12.143 382 H ASP 50 H ASP 50 1.746 -0.437 -12.647 383 HA ASP 50 HA ASP 50 0.323 -2.614 -13.717 384 HB2 ASP 50 1HB ASP 50 1.885 -0.594 -14.746 385 HB3 ASP 50 2HB ASP 50 2.864 -2.026 -15.053 386 H ARG 51 H ARG 51 3.286 -2.434 -11.946 387 HA ARG 51 HA ARG 51 3.847 -5.260 -12.545 388 HB2 ARG 51 1HB ARG 51 5.742 -3.317 -11.234 389 HB3 ARG 51 2HB ARG 51 6.119 -4.876 -11.954 390 HG2 ARG 51 1HG ARG 51 5.215 -3.752 -14.135 391 HG3 ARG 51 2HG ARG 51 5.582 -2.260 -13.268 392 HD2 ARG 51 1HD ARG 51 7.754 -4.120 -13.006 393 HD3 ARG 51 2HD ARG 51 7.353 -3.891 -14.708 394 HE ARG 51 HE ARG 51 7.442 -1.364 -13.733 395 HH11 ARG 51 1HH1 ARG 51 9.648 -4.056 -13.653 396 HH12 ARG 51 2HH1 ARG 51 11.067 -3.061 -13.623 397 HH21 ARG 51 1HH2 ARG 51 9.301 -0.043 -13.694 398 HH22 ARG 51 2HH2 ARG 51 10.867 -0.778 -13.646 399 H PHE 52 H PHE 52 3.435 -2.908 -9.954 400 HA PHE 52 HA PHE 52 4.023 -4.530 -7.767 401 HB2 PHE 52 1HB PHE 52 2.397 -2.077 -8.197 402 HB3 PHE 52 2HB PHE 52 2.133 -2.964 -6.699 403 HD1 PHE 52 HD2 PHE 52 4.386 -3.662 -5.467 404 HD2 PHE 52 HD1 PHE 52 3.973 -0.417 -8.189 405 HE1 PHE 52 HE2 PHE 52 6.368 -2.588 -4.481 406 HE2 PHE 52 HE1 PHE 52 5.955 0.663 -7.208 407 HZ PHE 52 HZ PHE 52 7.153 -0.422 -5.351 408 H ASP 53 H ASP 53 2.106 -4.957 -6.081 409 HA ASP 53 HA ASP 53 0.118 -6.602 -7.506 410 HB2 ASP 53 1HB ASP 53 1.727 -7.141 -5.032 411 HB3 ASP 53 2HB ASP 53 0.161 -7.918 -5.248 412 H VAL 54 H VAL 54 0.715 -4.848 -4.467 413 HA VAL 54 HA VAL 54 -2.189 -4.427 -4.224 414 HB VAL 54 HB VAL 54 -0.124 -4.076 -2.051 415 HG11 VAL 54 1HG1 VAL 54 -2.222 -2.825 -1.767 416 HG12 VAL 54 2HG1 VAL 54 -3.128 -4.333 -1.917 417 HG13 VAL 54 3HG1 VAL 54 -2.033 -4.091 -0.554 418 HG21 VAL 54 3HG2 VAL 54 0.033 -6.328 -2.201 419 HG22 VAL 54 1HG2 VAL 54 -1.481 -6.271 -1.298 420 HG23 VAL 54 2HG2 VAL 54 -1.505 -6.488 -3.048 421 H VAL 55 H VAL 55 -3.018 -2.379 -3.913 422 HA VAL 55 HA VAL 55 -1.118 -0.147 -4.229 423 HB VAL 55 HB VAL 55 -3.900 -0.234 -5.400 424 HG11 VAL 55 1HG1 VAL 55 -2.936 1.706 -6.736 425 HG12 VAL 55 2HG1 VAL 55 -3.291 2.008 -5.034 426 HG13 VAL 55 3HG1 VAL 55 -1.628 1.728 -5.554 427 HG21 VAL 55 3HG2 VAL 55 -2.664 -0.392 -7.594 428 HG22 VAL 55 1HG2 VAL 55 -1.227 -0.808 -6.660 429 HG23 VAL 55 2HG2 VAL 55 -2.648 -1.851 -6.604 430 H LEU 56 H LEU 56 -1.063 0.593 -2.163 431 HA LEU 56 HA LEU 56 -3.612 1.125 -0.808 432 HB2 LEU 56 1HB LEU 56 -0.811 1.177 0.306 433 HB3 LEU 56 2HB LEU 56 -2.304 1.352 1.225 434 HG LEU 56 HG LEU 56 -1.118 -1.107 -0.004 435 HD11 LEU 56 1HD1 LEU 56 -0.981 -1.869 2.117 436 HD12 LEU 56 2HD1 LEU 56 -2.472 -1.072 2.619 437 HD13 LEU 56 3HD1 LEU 56 -0.976 -0.146 2.492 438 HD21 LEU 56 3HD2 LEU 56 -3.381 -2.147 0.745 439 HD22 LEU 56 1HD2 LEU 56 -3.250 -1.388 -0.841 440 HD23 LEU 56 2HD2 LEU 56 -4.004 -0.516 0.494 441 H LEU 57 H LEU 57 -4.322 3.142 -0.483 442 HA LEU 57 HA LEU 57 -2.694 5.345 -1.495 443 HB2 LEU 57 1HB LEU 57 -5.393 4.712 -1.689 444 HB3 LEU 57 2HB LEU 57 -5.338 6.061 -0.556 445 HG LEU 57 HG LEU 57 -3.762 6.461 -2.998 446 HD11 LEU 57 1HD1 LEU 57 -6.739 6.067 -3.106 447 HD12 LEU 57 2HD1 LEU 57 -5.498 5.311 -4.105 448 HD13 LEU 57 3HD1 LEU 57 -5.856 7.028 -4.292 449 HD21 LEU 57 3HD2 LEU 57 -4.039 8.559 -2.335 450 HD22 LEU 57 1HD2 LEU 57 -4.997 7.981 -0.971 451 HD23 LEU 57 2HD2 LEU 57 -5.790 8.407 -2.487 452 H ALA 58 H ALA 58 -3.093 7.496 -0.263 453 HA ALA 58 HA ALA 58 -2.449 6.981 2.553 454 HB1 ALA 58 3HB ALA 58 -1.867 9.600 2.205 455 HB2 ALA 58 1HB ALA 58 -0.722 8.286 1.940 456 HB3 ALA 58 2HB ALA 58 -1.597 8.982 0.576 457 HA PRO 59 HA PRO 59 -6.096 8.859 4.112 458 HB2 PRO 59 1HB PRO 59 -5.167 10.266 6.240 459 HB3 PRO 59 2HB PRO 59 -5.264 8.501 6.224 460 HG2 PRO 59 1HG PRO 59 -2.901 10.273 5.736 461 HG3 PRO 59 2HG PRO 59 -3.002 8.778 6.685 462 HD2 PRO 59 1HD PRO 59 -1.997 8.842 4.171 463 HD3 PRO 59 2HD PRO 59 -2.864 7.434 4.818 464 H GLN 60 H GLN 60 -3.550 10.790 2.915 465 HA GLN 60 HA GLN 60 -5.199 13.220 3.059 466 HB2 GLN 60 1HB GLN 60 -2.514 12.846 3.631 467 HB3 GLN 60 2HB GLN 60 -2.493 13.561 2.024 468 HG2 GLN 60 1HG GLN 60 -2.357 15.358 3.518 469 HG3 GLN 60 2HG GLN 60 -4.023 15.349 2.940 470 HE21 GLN 60 2HE2 GLN 60 -4.988 16.306 4.648 471 HE22 GLN 60 1HE2 GLN 60 -5.031 15.637 6.240 472 H SER 61 H SER 61 -6.557 13.007 1.334 473 HA SER 61 HA SER 61 -5.429 13.483 -1.268 474 HB2 SER 61 1HB SER 61 -7.118 11.381 -1.921 475 HB3 SER 61 2HB SER 61 -5.355 11.330 -1.919 476 HG SER 61 HG SER 61 -5.388 10.164 -0.157 477 H ARG 62 H ARG 62 -6.759 14.740 -2.420 478 HA ARG 62 HA ARG 62 -9.400 15.300 -1.328 479 HB2 ARG 62 1HB ARG 62 -7.407 16.774 -2.831 480 HB3 ARG 62 2HB ARG 62 -8.997 16.915 -3.571 481 HG2 ARG 62 1HG ARG 62 -9.147 18.652 -2.138 482 HG3 ARG 62 2HG ARG 62 -9.686 17.378 -1.041 483 HD2 ARG 62 1HD ARG 62 -8.070 18.648 0.137 484 HD3 ARG 62 2HD ARG 62 -7.287 17.136 -0.322 485 HE ARG 62 HE ARG 62 -6.850 19.206 -2.239 486 HH11 ARG 62 1HH1 ARG 62 -5.800 17.955 0.837 487 HH12 ARG 62 2HH1 ARG 62 -4.205 18.618 0.709 488 HH21 ARG 62 1HH2 ARG 62 -4.752 20.083 -2.419 489 HH22 ARG 62 2HH2 ARG 62 -3.609 19.829 -1.143 490 H PHE 63 H PHE 63 -8.142 14.942 -4.648 491 HA PHE 63 HA PHE 63 -10.651 13.558 -5.337 492 HB2 PHE 63 1HB PHE 63 -8.861 15.150 -7.184 493 HB3 PHE 63 2HB PHE 63 -10.406 14.417 -7.600 494 HD1 PHE 63 HD1 PHE 63 -12.332 15.154 -5.805 495 HD2 PHE 63 HD2 PHE 63 -8.909 17.418 -6.933 496 HE1 PHE 63 HE1 PHE 63 -13.491 17.224 -5.154 497 HE2 PHE 63 HE2 PHE 63 -10.062 19.492 -6.283 498 HZ PHE 63 HZ PHE 63 -12.356 19.397 -5.391 499 H ASN 64 H ASN 64 -7.201 13.433 -5.348 500 HA ASN 64 HA ASN 64 -6.634 11.580 -7.311 501 HB2 ASN 64 1HB ASN 64 -5.366 11.665 -4.565 502 HB3 ASN 64 2HB ASN 64 -4.650 11.011 -6.036 503 HD21 ASN 64 2HD2 ASN 64 -5.143 12.881 -7.889 504 HD22 ASN 64 1HD2 ASN 64 -4.385 14.376 -7.471 505 H LYS 65 H LYS 65 -7.540 10.935 -3.930 506 HA LYS 65 HA LYS 65 -7.515 8.129 -4.130 507 HB2 LYS 65 1HB LYS 65 -8.791 8.143 -2.051 508 HB3 LYS 65 2HB LYS 65 -7.492 9.326 -1.984 509 HG2 LYS 65 1HG LYS 65 -9.028 10.774 -1.296 510 HG3 LYS 65 2HG LYS 65 -9.626 10.775 -2.957 511 HD2 LYS 65 1HD LYS 65 -11.419 9.465 -2.457 512 HD3 LYS 65 2HD LYS 65 -10.564 8.595 -1.180 513 HE2 LYS 65 1HE LYS 65 -10.820 10.442 0.329 514 HE3 LYS 65 2HE LYS 65 -11.482 11.458 -0.951 515 HZ1 LYS 65 3HZ LYS 65 -13.313 9.745 -1.105 516 HZ2 LYS 65 1HZ LYS 65 -13.312 10.716 0.280 517 HZ3 LYS 65 2HZ LYS 65 -12.743 9.125 0.361 518 H LYS 66 H LYS 66 -9.968 10.522 -4.860 519 HA LYS 66 HA LYS 66 -12.185 8.801 -5.053 520 HB2 LYS 66 1HB LYS 66 -11.990 11.427 -5.110 521 HB3 LYS 66 2HB LYS 66 -11.918 11.177 -6.850 522 HG2 LYS 66 1HG LYS 66 -14.069 9.643 -5.761 523 HG3 LYS 66 2HG LYS 66 -14.194 11.316 -5.212 524 HD2 LYS 66 1HD LYS 66 -13.762 11.921 -7.685 525 HD3 LYS 66 2HD LYS 66 -14.193 10.242 -8.013 526 HE2 LYS 66 1HE LYS 66 -16.370 10.528 -7.162 527 HE3 LYS 66 2HE LYS 66 -15.951 12.054 -6.383 528 HZ1 LYS 66 3HZ LYS 66 -16.706 11.528 -9.128 529 HZ2 LYS 66 1HZ LYS 66 -15.420 12.611 -8.938 530 HZ3 LYS 66 2HZ LYS 66 -16.908 12.925 -8.198 531 H ARG 67 H ARG 67 -10.169 10.150 -7.673 532 HA ARG 67 HA ARG 67 -11.278 8.613 -9.732 533 HB2 ARG 67 1HB ARG 67 -8.577 9.921 -9.432 534 HB3 ARG 67 2HB ARG 67 -9.069 9.096 -10.905 535 HG2 ARG 67 1HG ARG 67 -10.465 10.751 -11.529 536 HG3 ARG 67 2HG ARG 67 -10.950 11.114 -9.870 537 HD2 ARG 67 1HD ARG 67 -9.346 12.670 -9.610 538 HD3 ARG 67 2HD ARG 67 -8.149 11.725 -10.495 539 HE ARG 67 HE ARG 67 -10.182 12.862 -12.174 540 HH11 ARG 67 1HH1 ARG 67 -7.128 13.429 -10.604 541 HH12 ARG 67 2HH1 ARG 67 -6.636 14.662 -11.717 542 HH21 ARG 67 1HH2 ARG 67 -9.546 14.484 -13.647 543 HH22 ARG 67 2HH2 ARG 67 -8.013 15.262 -13.447 544 H LEU 68 H LEU 68 -8.266 8.079 -7.901 545 HA LEU 68 HA LEU 68 -7.435 5.728 -9.061 546 HB2 LEU 68 1HB LEU 68 -7.075 7.024 -6.447 547 HB3 LEU 68 2HB LEU 68 -6.785 5.285 -6.461 548 HG LEU 68 HG LEU 68 -5.046 5.536 -8.105 549 HD11 LEU 68 1HD1 LEU 68 -4.423 8.069 -8.557 550 HD12 LEU 68 2HD1 LEU 68 -6.159 8.277 -8.334 551 HD13 LEU 68 3HD1 LEU 68 -5.556 7.188 -9.583 552 HD21 LEU 68 3HD2 LEU 68 -4.779 7.565 -5.889 553 HD22 LEU 68 1HD2 LEU 68 -3.447 6.901 -6.836 554 HD23 LEU 68 2HD2 LEU 68 -4.396 5.846 -5.788 555 H GLU 69 H GLU 69 -9.349 5.922 -6.051 556 HA GLU 69 HA GLU 69 -9.926 3.205 -5.857 557 HB2 GLU 69 1HB GLU 69 -11.366 5.650 -4.853 558 HB3 GLU 69 2HB GLU 69 -11.960 4.030 -4.522 559 HG2 GLU 69 1HG GLU 69 -9.893 3.476 -3.385 560 HG3 GLU 69 2HG GLU 69 -9.238 5.068 -3.766 561 H GLU 70 H GLU 70 -11.779 5.806 -7.407 562 HA GLU 70 HA GLU 70 -14.010 4.316 -8.162 563 HB2 GLU 70 1HB GLU 70 -12.704 6.783 -9.251 564 HB3 GLU 70 2HB GLU 70 -14.046 6.052 -10.121 565 HG2 GLU 70 1HG GLU 70 -14.269 6.717 -7.212 566 HG3 GLU 70 2HG GLU 70 -14.542 7.936 -8.456 567 H ILE 71 H ILE 71 -10.808 4.424 -9.496 568 HA ILE 71 HA ILE 71 -11.602 3.025 -11.922 569 HB ILE 71 HB ILE 71 -8.867 3.878 -10.967 570 HG12 ILE 71 1HG1 ILE 71 -10.240 5.068 -13.331 571 HG13 ILE 71 2HG1 ILE 71 -10.782 5.560 -11.731 572 HG21 ILE 71 1HG2 ILE 71 -8.626 3.527 -13.636 573 HG22 ILE 71 2HG2 ILE 71 -8.202 2.309 -12.435 574 HG23 ILE 71 3HG2 ILE 71 -9.771 2.246 -13.237 575 HD11 ILE 71 3HD1 ILE 71 -7.967 5.682 -11.726 576 HD12 ILE 71 1HD1 ILE 71 -8.526 6.450 -13.211 577 HD13 ILE 71 2HD1 ILE 71 -9.123 7.012 -11.649 578 H THR 72 H THR 72 -10.067 2.395 -8.848 579 HA THR 72 HA THR 72 -8.974 -0.139 -9.471 580 HB THR 72 HB THR 72 -8.803 -0.492 -7.063 581 HG1 THR 72 HG1 THR 72 -10.657 0.309 -6.208 582 HG21 THR 72 3HG2 THR 72 -7.637 1.593 -8.495 583 HG22 THR 72 1HG2 THR 72 -7.071 0.915 -6.969 584 HG23 THR 72 2HG2 THR 72 -8.134 2.323 -6.969 585 H LYS 73 H LYS 73 -12.111 0.892 -8.230 586 HA LYS 73 HA LYS 73 -13.198 -1.506 -7.433 587 HB2 LYS 73 1HB LYS 73 -14.195 1.085 -8.239 588 HB3 LYS 73 2HB LYS 73 -15.271 -0.191 -8.789 589 HG2 LYS 73 1HG LYS 73 -15.512 -1.022 -6.541 590 HG3 LYS 73 2HG LYS 73 -14.324 0.143 -5.950 591 HD2 LYS 73 1HD LYS 73 -15.873 1.735 -5.770 592 HD3 LYS 73 2HD LYS 73 -16.429 1.462 -7.423 593 HE2 LYS 73 1HE LYS 73 -18.328 0.800 -6.414 594 HE3 LYS 73 2HE LYS 73 -17.454 -0.712 -6.180 595 HZ1 LYS 73 3HZ LYS 73 -17.216 1.419 -4.170 596 HZ2 LYS 73 1HZ LYS 73 -17.069 -0.256 -3.980 597 HZ3 LYS 73 2HZ LYS 73 -18.597 0.443 -4.180 598 HA PRO 74 HA PRO 74 -14.714 -2.411 -11.922 599 HB2 PRO 74 1HB PRO 74 -13.795 -0.804 -13.908 600 HB3 PRO 74 2HB PRO 74 -15.272 -0.461 -13.000 601 HG2 PRO 74 1HG PRO 74 -12.523 0.674 -12.648 602 HG3 PRO 74 2HG PRO 74 -14.090 1.504 -12.612 603 HD2 PRO 74 1HD PRO 74 -12.748 0.828 -10.360 604 HD3 PRO 74 2HD PRO 74 -14.521 0.866 -10.439 605 H LYS 75 H LYS 75 -11.448 -1.115 -11.599 606 HA LYS 75 HA LYS 75 -10.220 -2.716 -13.571 607 HB2 LYS 75 1HB LYS 75 -9.264 -1.143 -11.219 608 HB3 LYS 75 2HB LYS 75 -8.152 -2.273 -11.980 609 HG2 LYS 75 1HG LYS 75 -9.622 -0.344 -13.703 610 HG3 LYS 75 2HG LYS 75 -8.271 0.239 -12.728 611 HD2 LYS 75 1HD LYS 75 -7.227 -2.032 -13.815 612 HD3 LYS 75 2HD LYS 75 -8.282 -1.468 -15.114 613 HE2 LYS 75 1HE LYS 75 -6.441 -0.266 -15.661 614 HE3 LYS 75 2HE LYS 75 -7.116 0.851 -14.475 615 HZ1 LYS 75 3HZ LYS 75 -4.729 0.403 -14.153 616 HZ2 LYS 75 1HZ LYS 75 -5.085 -1.224 -13.854 617 HZ3 LYS 75 2HZ LYS 75 -5.660 -0.026 -12.808 618 H GLY 76 H GLY 76 -11.141 -3.328 -10.266 619 HA2 GLY 76 1HA GLY 76 -11.242 -5.307 -9.096 620 HA3 GLY 76 2HA GLY 76 -10.805 -6.138 -10.582 621 H ILE 77 H ILE 77 -9.310 -4.005 -8.147 622 HA ILE 77 HA ILE 77 -7.060 -5.879 -8.004 623 HB ILE 77 HB ILE 77 -5.479 -3.934 -7.894 624 HG12 ILE 77 1HG1 ILE 77 -7.019 -2.107 -9.462 625 HG13 ILE 77 2HG1 ILE 77 -7.919 -2.475 -7.995 626 HG21 ILE 77 1HG2 ILE 77 -6.170 -5.399 -9.978 627 HG22 ILE 77 2HG2 ILE 77 -6.754 -3.848 -10.577 628 HG23 ILE 77 3HG2 ILE 77 -5.057 -4.041 -10.136 629 HD11 ILE 77 3HD1 ILE 77 -6.204 -0.504 -8.074 630 HD12 ILE 77 1HD1 ILE 77 -6.356 -1.514 -6.636 631 HD13 ILE 77 2HD1 ILE 77 -5.035 -1.790 -7.772 632 HA PRO 78 HA PRO 78 -7.343 -5.310 -3.660 633 HB2 PRO 78 1HB PRO 78 -4.756 -5.656 -2.915 634 HB3 PRO 78 2HB PRO 78 -5.785 -6.986 -3.459 635 HG2 PRO 78 1HG PRO 78 -3.728 -5.436 -4.984 636 HG3 PRO 78 2HG PRO 78 -4.033 -7.183 -4.975 637 HD2 PRO 78 1HD PRO 78 -4.918 -5.560 -6.953 638 HD3 PRO 78 2HD PRO 78 -5.806 -7.008 -6.438 639 H ILE 79 H ILE 79 -7.927 -3.129 -3.469 640 HA ILE 79 HA ILE 79 -5.682 -1.272 -3.016 641 HB ILE 79 HB ILE 79 -7.109 -0.688 -4.979 642 HG12 ILE 79 1HG1 ILE 79 -7.770 1.653 -3.615 643 HG13 ILE 79 2HG1 ILE 79 -6.409 0.995 -2.715 644 HG21 ILE 79 1HG2 ILE 79 -9.203 -1.470 -3.487 645 HG22 ILE 79 2HG2 ILE 79 -9.280 0.272 -3.231 646 HG23 ILE 79 3HG2 ILE 79 -9.343 -0.382 -4.867 647 HD11 ILE 79 3HD1 ILE 79 -6.472 2.297 -5.295 648 HD12 ILE 79 1HD1 ILE 79 -5.115 1.990 -4.213 649 HD13 ILE 79 2HD1 ILE 79 -5.633 0.747 -5.350 650 H GLU 80 H GLU 80 -5.578 -0.241 -1.103 651 HA GLU 80 HA GLU 80 -7.917 -0.250 0.656 652 HB2 GLU 80 1HB GLU 80 -5.605 -1.911 1.002 653 HB3 GLU 80 2HB GLU 80 -5.671 -0.737 2.309 654 HG2 GLU 80 1HG GLU 80 -7.964 -2.517 1.519 655 HG3 GLU 80 2HG GLU 80 -6.811 -2.885 2.800 656 H ILE 81 H ILE 81 -7.763 1.278 2.422 657 HA ILE 81 HA ILE 81 -5.876 3.467 1.847 658 HB ILE 81 HB ILE 81 -8.699 3.649 2.902 659 HG12 ILE 81 1HG1 ILE 81 -8.775 5.176 0.757 660 HG13 ILE 81 2HG1 ILE 81 -7.396 4.200 0.263 661 HG21 ILE 81 1HG2 ILE 81 -6.452 5.561 2.908 662 HG22 ILE 81 2HG2 ILE 81 -8.018 6.196 2.408 663 HG23 ILE 81 3HG2 ILE 81 -7.840 5.434 3.989 664 HD11 ILE 81 3HD1 ILE 81 -10.217 3.555 0.292 665 HD12 ILE 81 1HD1 ILE 81 -8.885 2.779 -0.563 666 HD13 ILE 81 2HD1 ILE 81 -9.240 2.334 1.107 667 H ILE 82 H ILE 82 -4.473 3.905 3.406 668 HA ILE 82 HA ILE 82 -4.586 2.602 5.938 669 HB ILE 82 HB ILE 82 -2.783 4.901 5.190 670 HG12 ILE 82 1HG1 ILE 82 -2.360 1.942 4.713 671 HG13 ILE 82 2HG1 ILE 82 -2.682 3.140 3.465 672 HG21 ILE 82 1HG2 ILE 82 -2.799 4.314 7.554 673 HG22 ILE 82 2HG2 ILE 82 -2.459 2.633 7.150 674 HG23 ILE 82 3HG2 ILE 82 -1.260 3.880 6.812 675 HD11 ILE 82 3HD1 ILE 82 -0.257 2.997 5.238 676 HD12 ILE 82 1HD1 ILE 82 -0.338 2.625 3.516 677 HD13 ILE 82 2HD1 ILE 82 -0.584 4.280 4.073 678 H ASN 83 H ASN 83 -5.559 3.242 7.741 679 HA ASN 83 HA ASN 83 -7.226 5.439 7.942 680 HB2 ASN 83 1HB ASN 83 -6.070 3.486 9.822 681 HB3 ASN 83 2HB ASN 83 -6.563 5.010 10.554 682 HD21 ASN 83 2HD2 ASN 83 -8.031 3.409 11.630 683 HD22 ASN 83 1HD2 ASN 83 -9.558 3.116 10.877 684 H THR 84 H THR 84 -7.070 7.451 8.971 685 HA THR 84 HA THR 84 -4.770 8.932 8.490 686 HB THR 84 HB THR 84 -6.236 10.100 10.678 687 HG1 THR 84 HG1 THR 84 -8.264 9.767 10.085 688 HG21 THR 84 3HG2 THR 84 -4.980 11.013 8.506 689 HG22 THR 84 1HG2 THR 84 -6.247 11.930 9.319 690 HG23 THR 84 2HG2 THR 84 -6.626 10.992 7.875 691 H ILE 85 H ILE 85 -5.989 7.734 11.618 692 HA ILE 85 HA ILE 85 -3.858 8.642 13.184 693 HB ILE 85 HB ILE 85 -5.560 6.191 13.650 694 HG12 ILE 85 1HG1 ILE 85 -5.948 8.992 14.717 695 HG13 ILE 85 2HG1 ILE 85 -6.803 8.356 13.316 696 HG21 ILE 85 1HG2 ILE 85 -4.943 7.173 16.101 697 HG22 ILE 85 2HG2 ILE 85 -4.068 5.870 15.298 698 HG23 ILE 85 3HG2 ILE 85 -3.462 7.524 15.210 699 HD11 ILE 85 3HD1 ILE 85 -8.244 8.170 15.184 700 HD12 ILE 85 1HD1 ILE 85 -7.685 6.544 14.792 701 HD13 ILE 85 2HD1 ILE 85 -6.986 7.411 16.160 702 H ASP 86 H ASP 86 -4.381 5.441 11.715 703 HA ASP 86 HA ASP 86 -2.089 4.175 12.602 704 HB2 ASP 86 1HB ASP 86 -3.606 3.877 10.009 705 HB3 ASP 86 2HB ASP 86 -2.286 2.809 10.474 706 H TYR 87 H TYR 87 -2.519 6.148 9.681 707 HA TYR 87 HA TYR 87 0.080 5.852 8.671 708 HB2 TYR 87 1HB TYR 87 -1.783 6.759 7.347 709 HB3 TYR 87 2HB TYR 87 -1.809 8.196 8.364 710 HD1 TYR 87 HD1 TYR 87 0.241 6.314 5.918 711 HD2 TYR 87 HD2 TYR 87 -0.349 10.007 7.947 712 HE1 TYR 87 HE1 TYR 87 1.883 7.385 4.433 713 HE2 TYR 87 HE2 TYR 87 1.290 11.090 6.467 714 HH TYR 87 HH TYR 87 2.168 10.584 4.010 715 H GLY 88 H GLY 88 -1.284 8.620 10.472 716 HA2 GLY 88 1HA GLY 88 1.041 10.079 10.794 717 HA3 GLY 88 2HA GLY 88 -0.298 10.093 11.932 718 H THR 89 H THR 89 -0.143 7.392 12.762 719 HA THR 89 HA THR 89 1.931 7.627 14.719 720 HB THR 89 HB THR 89 1.135 5.461 15.558 721 HG1 THR 89 HG1 THR 89 -0.876 4.724 14.329 722 HG21 THR 89 3HG2 THR 89 -0.476 7.825 15.228 723 HG22 THR 89 1HG2 THR 89 -0.367 6.732 16.607 724 HG23 THR 89 2HG2 THR 89 -1.497 6.389 15.296 725 H MET 90 H MET 90 1.643 6.111 11.635 726 HA MET 90 HA MET 90 3.105 4.932 10.355 727 HB2 MET 90 1HB MET 90 5.190 5.616 12.428 728 HB3 MET 90 2HB MET 90 5.461 5.187 10.744 729 HG2 MET 90 1HG MET 90 5.362 7.315 10.170 730 HG3 MET 90 2HG MET 90 3.724 7.426 10.810 731 HE1 MET 90 3HE MET 90 7.243 6.912 11.858 732 HE2 MET 90 1HE MET 90 7.665 8.309 12.848 733 HE3 MET 90 2HE MET 90 6.881 6.911 13.585 734 H ASN 91 H ASN 91 1.633 3.219 11.484 735 HA ASN 91 HA ASN 91 3.173 1.408 13.179 736 HB2 ASN 91 1HB ASN 91 0.776 1.998 13.702 737 HB3 ASN 91 2HB ASN 91 0.311 1.101 12.260 738 HD21 ASN 91 2HD2 ASN 91 -0.555 0.495 14.853 739 HD22 ASN 91 1HD2 ASN 91 0.070 -1.056 15.285 740 H GLY 92 H GLY 92 4.656 0.481 11.795 741 HA2 GLY 92 1HA GLY 92 4.270 -0.399 9.204 742 HA3 GLY 92 2HA GLY 92 5.416 -1.114 10.327 743 H GLU 93 H GLU 93 3.737 -2.224 12.206 744 HA GLU 93 HA GLU 93 3.117 -4.690 11.132 745 HB2 GLU 93 1HB GLU 93 3.316 -4.019 13.589 746 HB3 GLU 93 2HB GLU 93 1.637 -3.511 13.479 747 HG2 GLU 93 1HG GLU 93 1.002 -5.789 12.829 748 HG3 GLU 93 2HG GLU 93 2.685 -6.289 12.988 749 H LYS 94 H LYS 94 0.823 -2.076 11.918 750 HA LYS 94 HA LYS 94 -1.461 -3.334 10.892 751 HB2 LYS 94 1HB LYS 94 -0.717 -0.500 11.494 752 HB3 LYS 94 2HB LYS 94 -2.202 -0.820 10.608 753 HG2 LYS 94 1HG LYS 94 -1.582 -2.149 13.227 754 HG3 LYS 94 2HG LYS 94 -2.387 -0.581 13.124 755 HD2 LYS 94 1HD LYS 94 -4.252 -1.496 12.019 756 HD3 LYS 94 2HD LYS 94 -3.397 -2.992 11.638 757 HE2 LYS 94 1HE LYS 94 -3.321 -2.741 14.431 758 HE3 LYS 94 2HE LYS 94 -4.966 -2.321 13.952 759 HZ1 LYS 94 3HZ LYS 94 -3.978 -4.634 12.586 760 HZ2 LYS 94 1HZ LYS 94 -5.414 -4.427 13.457 761 HZ3 LYS 94 2HZ LYS 94 -3.986 -4.841 14.264 762 H VAL 95 H VAL 95 0.951 -1.270 9.356 763 HA VAL 95 HA VAL 95 -0.347 -0.837 6.915 764 HB VAL 95 HB VAL 95 2.621 -1.093 7.428 765 HG11 VAL 95 1HG1 VAL 95 1.079 -0.593 5.014 766 HG12 VAL 95 2HG1 VAL 95 2.245 0.686 5.356 767 HG13 VAL 95 3HG1 VAL 95 2.788 -0.985 5.205 768 HG21 VAL 95 3HG2 VAL 95 2.581 0.941 8.338 769 HG22 VAL 95 1HG2 VAL 95 1.577 1.578 7.036 770 HG23 VAL 95 2HG2 VAL 95 0.826 0.781 8.419 771 H LEU 96 H LEU 96 2.389 -3.076 7.370 772 HA LEU 96 HA LEU 96 2.076 -4.499 5.027 773 HB2 LEU 96 1HB LEU 96 3.242 -6.367 6.250 774 HB3 LEU 96 2HB LEU 96 4.059 -4.805 6.255 775 HG LEU 96 HG LEU 96 2.584 -4.772 8.593 776 HD11 LEU 96 1HD1 LEU 96 2.215 -7.254 8.109 777 HD12 LEU 96 2HD1 LEU 96 2.833 -6.815 9.701 778 HD13 LEU 96 3HD1 LEU 96 3.930 -7.451 8.475 779 HD21 LEU 96 3HD2 LEU 96 5.452 -5.629 8.228 780 HD22 LEU 96 1HD2 LEU 96 4.736 -4.936 9.683 781 HD23 LEU 96 2HD2 LEU 96 4.882 -3.959 8.221 782 H GLN 97 H GLN 97 0.532 -5.026 8.158 783 HA GLN 97 HA GLN 97 -0.686 -7.483 7.611 784 HB2 GLN 97 1HB GLN 97 -1.290 -5.228 9.485 785 HB3 GLN 97 2HB GLN 97 -2.447 -6.541 9.313 786 HG2 GLN 97 1HG GLN 97 0.419 -7.160 9.856 787 HG3 GLN 97 2HG GLN 97 -0.632 -6.628 11.168 788 HE21 GLN 97 2HE2 GLN 97 -0.145 -9.083 8.715 789 HE22 GLN 97 1HE2 GLN 97 -1.082 -10.312 9.488 790 H LEU 98 H LEU 98 -1.978 -4.186 7.243 791 HA LEU 98 HA LEU 98 -4.478 -4.899 6.219 792 HB2 LEU 98 1HB LEU 98 -3.646 -2.623 7.016 793 HB3 LEU 98 2HB LEU 98 -2.969 -2.434 5.400 794 HG LEU 98 HG LEU 98 -5.236 -2.636 4.453 795 HD11 LEU 98 1HD1 LEU 98 -7.146 -2.374 6.078 796 HD12 LEU 98 2HD1 LEU 98 -6.015 -2.832 7.351 797 HD13 LEU 98 3HD1 LEU 98 -6.376 -3.961 6.045 798 HD21 LEU 98 3HD2 LEU 98 -6.031 -0.486 5.972 799 HD22 LEU 98 1HD2 LEU 98 -4.982 -0.421 4.555 800 HD23 LEU 98 2HD2 LEU 98 -4.278 -0.489 6.171 801 H ALA 99 H ALA 99 -1.513 -3.975 4.475 802 HA ALA 99 HA ALA 99 -2.426 -4.210 1.882 803 HB1 ALA 99 3HB ALA 99 0.214 -5.257 1.960 804 HB2 ALA 99 1HB ALA 99 -0.321 -3.645 1.481 805 HB3 ALA 99 2HB ALA 99 0.089 -3.976 3.165 806 H ILE 100 H ILE 100 -0.759 -6.761 3.744 807 HA ILE 100 HA ILE 100 -1.043 -8.811 1.893 808 HB ILE 100 HB ILE 100 -1.030 -9.053 4.904 809 HG12 ILE 100 1HG1 ILE 100 1.313 -9.436 3.052 810 HG13 ILE 100 2HG1 ILE 100 0.907 -7.849 3.696 811 HG21 ILE 100 1HG2 ILE 100 -0.159 -11.333 4.459 812 HG22 ILE 100 2HG2 ILE 100 -1.819 -11.096 3.914 813 HG23 ILE 100 3HG2 ILE 100 -0.500 -11.090 2.745 814 HD11 ILE 100 3HD1 ILE 100 2.180 -10.137 4.986 815 HD12 ILE 100 1HD1 ILE 100 2.280 -8.417 5.359 816 HD13 ILE 100 2HD1 ILE 100 0.918 -9.370 5.949 817 H ASN 101 H ASN 101 -3.244 -7.777 4.466 818 HA ASN 101 HA ASN 101 -5.117 -9.844 4.238 819 HB2 ASN 101 1HB ASN 101 -4.876 -7.823 5.942 820 HB3 ASN 101 2HB ASN 101 -6.052 -7.079 4.865 821 HD21 ASN 101 2HD2 ASN 101 -7.984 -7.224 5.730 822 HD22 ASN 101 1HD2 ASN 101 -8.653 -8.617 6.502 823 H ALA 102 H ALA 102 -4.897 -6.731 2.564 824 HA ALA 102 HA ALA 102 -7.319 -6.964 1.129 825 HB1 ALA 102 3HB ALA 102 -6.732 -5.012 0.094 826 HB2 ALA 102 1HB ALA 102 -5.689 -4.930 1.514 827 HB3 ALA 102 2HB ALA 102 -5.031 -5.460 -0.034 828 H PHE 103 H PHE 103 -3.975 -7.812 0.312 829 HA PHE 103 HA PHE 103 -4.436 -8.596 -2.341 830 HB2 PHE 103 1HB PHE 103 -2.189 -8.201 -1.359 831 HB3 PHE 103 2HB PHE 103 -2.358 -9.689 -0.434 832 HD1 PHE 103 HD2 PHE 103 -2.183 -8.336 -3.875 833 HD2 PHE 103 HD1 PHE 103 -1.815 -11.760 -1.374 834 HE1 PHE 103 HE2 PHE 103 -1.249 -9.609 -5.761 835 HE2 PHE 103 HE1 PHE 103 -0.878 -13.038 -3.256 836 HZ PHE 103 HZ PHE 103 -0.595 -11.963 -5.454 837 H ASN 104 H ASN 104 -4.411 -10.495 0.660 838 HA ASN 104 HA ASN 104 -4.928 -12.992 -0.527 839 HB2 ASN 104 1HB ASN 104 -4.803 -11.892 2.158 840 HB3 ASN 104 2HB ASN 104 -6.088 -13.085 2.010 841 HD21 ASN 104 2HD2 ASN 104 -2.666 -12.516 1.827 842 HD22 ASN 104 1HD2 ASN 104 -2.183 -14.175 1.869 843 H ASN 105 H ASN 105 -7.136 -10.651 0.995 844 HA ASN 105 HA ASN 105 -9.508 -12.060 0.618 845 HB2 ASN 105 1HB ASN 105 -8.791 -9.208 1.050 846 HB3 ASN 105 2HB ASN 105 -10.410 -9.539 0.443 847 HD21 ASN 105 2HD2 ASN 105 -8.154 -10.189 3.047 848 HD22 ASN 105 1HD2 ASN 105 -9.347 -10.585 4.233 849 H LYS 106 H LYS 106 -7.850 -9.787 -1.530 850 HA LYS 106 HA LYS 106 -8.115 -9.287 -3.734 851 HB2 LYS 106 1HB LYS 106 -8.154 -12.087 -3.474 852 HB3 LYS 106 2HB LYS 106 -9.440 -11.697 -4.608 853 HG2 LYS 106 1HG LYS 106 -7.531 -10.169 -5.645 854 HG3 LYS 106 2HG LYS 106 -6.510 -11.387 -4.877 855 HD2 LYS 106 1HD LYS 106 -7.436 -13.126 -6.151 856 HD3 LYS 106 2HD LYS 106 -8.826 -12.149 -6.631 857 HE2 LYS 106 1HE LYS 106 -6.163 -11.125 -7.406 858 HE3 LYS 106 2HE LYS 106 -6.704 -12.594 -8.218 859 HZ1 LYS 106 3HZ LYS 106 -7.361 -10.628 -9.445 860 HZ2 LYS 106 1HZ LYS 106 -8.195 -10.028 -8.100 861 HZ3 LYS 106 2HZ LYS 106 -8.730 -11.438 -8.867 862 H SER 107 H SER 107 -10.344 -8.756 -1.864 863 HA SER 107 HA SER 107 -12.760 -9.155 -3.386 864 HB2 SER 107 1HB SER 107 -12.051 -8.157 -0.716 865 HB3 SER 107 2HB SER 107 -13.398 -7.300 -1.463 866 HG SER 107 HG SER 107 -13.599 -9.508 -0.207 867 H SER 108 H SER 108 -13.902 -7.647 -4.540 868 HA SER 108 HA SER 108 -13.279 -4.881 -4.605 869 HB2 SER 108 1HB SER 108 -12.502 -4.916 -7.050 870 HB3 SER 108 2HB SER 108 -11.323 -5.400 -5.831 871 HG SER 108 HG SER 108 -11.368 -6.853 -7.593 872 H VAL 109 H VAL 109 -15.649 -5.978 -4.198 873 HA VAL 109 HA VAL 109 -17.227 -4.978 -6.359 874 HB VAL 109 HB VAL 109 -16.724 -7.213 -7.258 875 HG11 VAL 109 1HG1 VAL 109 -17.049 -8.019 -4.590 876 HG12 VAL 109 2HG1 VAL 109 -18.356 -8.782 -5.497 877 HG13 VAL 109 3HG1 VAL 109 -16.680 -9.032 -5.985 878 HG21 VAL 109 3HG2 VAL 109 -18.916 -7.739 -7.914 879 HG22 VAL 109 1HG2 VAL 109 -19.598 -7.181 -6.386 880 HG23 VAL 109 2HG2 VAL 109 -18.963 -6.014 -7.546 Start of MODEL 19 1 H1 GLY 1 H GLY 1 10.575 -10.865 -7.116 2 HA2 GLY 1 1HA GLY 1 11.473 -12.984 -8.723 3 HA3 GLY 1 2HA GLY 1 11.687 -12.867 -6.983 4 HA PRO 2 HA PRO 2 8.804 -16.411 -8.108 5 HB2 PRO 2 1HB PRO 2 10.343 -18.394 -7.072 6 HB3 PRO 2 2HB PRO 2 10.488 -17.839 -8.745 7 HG2 PRO 2 1HG PRO 2 12.161 -17.137 -6.364 8 HG3 PRO 2 2HG PRO 2 12.673 -17.516 -8.020 9 HD2 PRO 2 1HD PRO 2 12.506 -14.978 -7.091 10 HD3 PRO 2 2HD PRO 2 12.192 -15.396 -8.788 11 H GLY 3 H GLY 3 10.571 -15.373 -5.286 12 HA2 GLY 3 1HA GLY 3 8.310 -16.258 -3.620 13 HA3 GLY 3 2HA GLY 3 9.955 -16.623 -3.120 14 H SER 4 H SER 4 7.959 -13.847 -4.122 15 HA SER 4 HA SER 4 8.726 -12.382 -1.767 16 HB2 SER 4 1HB SER 4 9.332 -10.696 -4.062 17 HB3 SER 4 2HB SER 4 10.286 -10.999 -2.610 18 HG SER 4 HG SER 4 11.445 -12.376 -3.689 19 H MET 5 H MET 5 7.853 -9.995 -2.049 20 HA MET 5 HA MET 5 5.410 -9.952 -3.649 21 HB2 MET 5 1HB MET 5 5.040 -10.838 -1.226 22 HB3 MET 5 2HB MET 5 5.247 -9.155 -0.760 23 HG2 MET 5 1HG MET 5 3.408 -8.551 -2.303 24 HG3 MET 5 2HG MET 5 3.164 -10.267 -2.622 25 HE1 MET 5 3HE MET 5 3.416 -8.589 1.438 26 HE2 MET 5 1HE MET 5 3.730 -7.708 -0.058 27 HE3 MET 5 2HE MET 5 2.148 -7.598 0.714 28 H ASN 6 H ASN 6 4.971 -7.987 -4.469 29 HA ASN 6 HA ASN 6 6.588 -5.727 -3.489 30 HB2 ASN 6 1HB ASN 6 5.420 -6.072 -6.257 31 HB3 ASN 6 2HB ASN 6 6.536 -4.817 -5.728 32 HD21 ASN 6 2HD2 ASN 6 6.431 -7.380 -7.585 33 HD22 ASN 6 1HD2 ASN 6 8.015 -8.034 -7.362 34 H ILE 7 H ILE 7 5.399 -4.414 -2.273 35 HA ILE 7 HA ILE 7 2.549 -4.090 -2.848 36 HB ILE 7 HB ILE 7 4.149 -3.087 -0.491 37 HG12 ILE 7 1HG1 ILE 7 2.248 -5.434 -0.676 38 HG13 ILE 7 2HG1 ILE 7 4.003 -5.565 -0.638 39 HG21 ILE 7 1HG2 ILE 7 1.470 -3.256 0.204 40 HG22 ILE 7 2HG2 ILE 7 2.381 -1.785 -0.131 41 HG23 ILE 7 3HG2 ILE 7 1.458 -2.562 -1.417 42 HD11 ILE 7 3HD1 ILE 7 2.205 -5.473 1.527 43 HD12 ILE 7 1HD1 ILE 7 3.966 -5.559 1.568 44 HD13 ILE 7 2HD1 ILE 7 3.160 -3.991 1.574 45 H LEU 8 H LEU 8 1.629 -2.184 -3.449 46 HA LEU 8 HA LEU 8 3.483 -0.004 -4.128 47 HB2 LEU 8 1HB LEU 8 2.156 -1.162 -5.946 48 HB3 LEU 8 2HB LEU 8 0.719 -0.428 -5.237 49 HG LEU 8 HG LEU 8 1.670 0.741 -7.251 50 HD11 LEU 8 1HD1 LEU 8 1.856 2.824 -5.248 51 HD12 LEU 8 2HD1 LEU 8 0.498 1.740 -4.953 52 HD13 LEU 8 3HD1 LEU 8 0.645 2.567 -6.503 53 HD21 LEU 8 3HD2 LEU 8 4.068 0.439 -5.985 54 HD22 LEU 8 1HD2 LEU 8 3.676 2.121 -5.629 55 HD23 LEU 8 2HD2 LEU 8 3.751 1.569 -7.303 56 H LEU 9 H LEU 9 3.190 2.001 -3.321 57 HA LEU 9 HA LEU 9 0.770 2.493 -1.716 58 HB2 LEU 9 1HB LEU 9 2.984 2.034 -0.466 59 HB3 LEU 9 2HB LEU 9 3.441 3.649 -1.006 60 HG LEU 9 HG LEU 9 1.198 4.356 0.127 61 HD11 LEU 9 1HD1 LEU 9 0.102 2.843 1.320 62 HD12 LEU 9 2HD1 LEU 9 1.566 2.408 2.200 63 HD13 LEU 9 3HD1 LEU 9 1.183 1.607 0.676 64 HD21 LEU 9 3HD2 LEU 9 3.714 3.607 1.606 65 HD22 LEU 9 1HD2 LEU 9 2.420 4.587 2.296 66 HD23 LEU 9 2HD2 LEU 9 3.309 5.167 0.888 67 H VAL 10 H VAL 10 -0.166 4.479 -1.899 68 HA VAL 10 HA VAL 10 1.090 6.353 -3.798 69 HB VAL 10 HB VAL 10 -1.873 6.037 -3.315 70 HG11 VAL 10 1HG1 VAL 10 -1.692 7.192 -5.708 71 HG12 VAL 10 2HG1 VAL 10 -1.729 8.121 -4.208 72 HG13 VAL 10 3HG1 VAL 10 -0.190 7.792 -5.007 73 HG21 VAL 10 3HG2 VAL 10 -1.989 4.840 -5.413 74 HG22 VAL 10 1HG2 VAL 10 -0.245 4.992 -5.629 75 HG23 VAL 10 2HG2 VAL 10 -0.888 4.002 -4.319 76 H CYS 11 H CYS 11 2.002 7.870 -2.528 77 HA CYS 11 HA CYS 11 0.317 9.686 -1.118 78 HB2 CYS 11 1HB CYS 11 0.437 8.018 0.634 79 HB3 CYS 11 2HB CYS 11 2.189 7.943 0.494 80 HG CYS 11 HG CYS 11 1.774 9.274 2.833 81 H GLY 12 H GLY 12 3.716 8.611 -0.859 82 HA2 GLY 12 1HA GLY 12 5.584 9.720 -1.776 83 HA3 GLY 12 2HA GLY 12 4.571 11.123 -2.087 84 H ALA 13 H ALA 13 4.620 9.502 1.009 85 HA ALA 13 HA ALA 13 5.489 11.961 2.275 86 HB1 ALA 13 3HB ALA 13 3.846 11.135 3.592 87 HB2 ALA 13 1HB ALA 13 4.183 9.461 3.153 88 HB3 ALA 13 2HB ALA 13 5.196 10.282 4.341 89 H GLY 14 H GLY 14 7.671 12.119 1.694 90 HA2 GLY 14 1HA GLY 14 9.884 11.937 2.425 91 HA3 GLY 14 2HA GLY 14 9.440 10.506 3.341 92 H MET 15 H MET 15 11.475 11.370 1.091 93 HA MET 15 HA MET 15 10.972 9.431 -0.969 94 HB2 MET 15 1HB MET 15 12.336 11.687 -1.039 95 HB3 MET 15 2HB MET 15 13.666 10.651 -0.544 96 HG2 MET 15 1HG MET 15 12.413 9.316 -2.657 97 HG3 MET 15 2HG MET 15 12.498 11.010 -3.136 98 HE1 MET 15 3HE MET 15 14.297 8.855 -4.933 99 HE2 MET 15 1HE MET 15 13.822 10.548 -5.075 100 HE3 MET 15 2HE MET 15 15.529 10.105 -5.123 101 H SER 16 H SER 16 11.054 7.342 -0.400 102 HA SER 16 HA SER 16 11.944 5.330 0.193 103 HB2 SER 16 1HB SER 16 14.237 6.966 -0.362 104 HB3 SER 16 2HB SER 16 14.590 5.920 1.013 105 HG SER 16 HG SER 16 13.537 5.043 -1.474 106 H THR 17 H THR 17 13.910 7.430 2.275 107 HA THR 17 HA THR 17 13.378 5.897 4.598 108 HB THR 17 HB THR 17 14.207 8.427 5.469 109 HG1 THR 17 HG1 THR 17 15.814 8.998 4.012 110 HG21 THR 17 3HG2 THR 17 15.207 6.591 6.464 111 HG22 THR 17 1HG2 THR 17 16.507 7.193 5.436 112 HG23 THR 17 2HG2 THR 17 15.545 5.808 4.922 113 H SER 18 H SER 18 11.829 6.056 6.103 114 HA SER 18 HA SER 18 10.406 8.429 6.706 115 HB2 SER 18 1HB SER 18 9.462 7.439 4.404 116 HB3 SER 18 2HB SER 18 8.523 6.451 5.522 117 HG SER 18 HG SER 18 7.731 8.346 6.459 118 H MET 19 H MET 19 8.896 8.151 8.430 119 HA MET 19 HA MET 19 9.636 6.306 10.361 120 HB2 MET 19 1HB MET 19 6.998 7.752 10.066 121 HB3 MET 19 2HB MET 19 7.545 6.944 11.528 122 HG2 MET 19 1HG MET 19 8.992 9.229 10.215 123 HG3 MET 19 2HG MET 19 7.848 9.404 11.543 124 HE1 MET 19 3HE MET 19 11.018 9.314 10.361 125 HE2 MET 19 1HE MET 19 11.969 9.519 11.832 126 HE3 MET 19 2HE MET 19 11.883 7.940 11.052 127 H LEU 20 H LEU 20 6.595 6.274 8.489 128 HA LEU 20 HA LEU 20 5.639 3.825 9.324 129 HB2 LEU 20 1HB LEU 20 5.265 5.520 6.935 130 HB3 LEU 20 2HB LEU 20 4.771 3.835 6.779 131 HG LEU 20 HG LEU 20 2.910 5.329 7.383 132 HD11 LEU 20 1HD1 LEU 20 1.927 3.758 8.670 133 HD12 LEU 20 2HD1 LEU 20 3.254 3.719 9.831 134 HD13 LEU 20 3HD1 LEU 20 3.396 2.855 8.300 135 HD21 LEU 20 3HD2 LEU 20 2.861 6.203 9.728 136 HD22 LEU 20 1HD2 LEU 20 4.014 7.010 8.664 137 HD23 LEU 20 2HD2 LEU 20 4.580 5.824 9.841 138 H VAL 21 H VAL 21 7.684 4.487 6.486 139 HA VAL 21 HA VAL 21 7.936 1.875 5.562 140 HB VAL 21 HB VAL 21 9.999 4.078 5.430 141 HG11 VAL 21 1HG1 VAL 21 10.874 2.870 3.491 142 HG12 VAL 21 2HG1 VAL 21 10.965 1.889 4.955 143 HG13 VAL 21 3HG1 VAL 21 9.701 1.581 3.764 144 HG21 VAL 21 3HG2 VAL 21 7.882 3.292 3.430 145 HG22 VAL 21 1HG2 VAL 21 7.798 4.691 4.500 146 HG23 VAL 21 2HG2 VAL 21 9.053 4.600 3.263 147 H GLN 22 H GLN 22 9.923 3.635 7.916 148 HA GLN 22 HA GLN 22 11.867 1.678 8.334 149 HB2 GLN 22 1HB GLN 22 11.358 4.187 9.337 150 HB3 GLN 22 2HB GLN 22 11.109 3.162 10.744 151 HG2 GLN 22 1HG GLN 22 13.421 2.143 9.824 152 HG3 GLN 22 2HG GLN 22 13.578 3.813 9.283 153 HE21 GLN 22 2HE2 GLN 22 13.780 5.445 10.786 154 HE22 GLN 22 1HE2 GLN 22 14.097 5.142 12.457 155 H ARG 23 H ARG 23 8.768 2.203 9.979 156 HA ARG 23 HA ARG 23 9.041 0.120 11.855 157 HB2 ARG 23 1HB ARG 23 6.477 1.222 10.695 158 HB3 ARG 23 2HB ARG 23 6.653 0.354 12.215 159 HG2 ARG 23 1HG ARG 23 8.387 2.666 12.098 160 HG3 ARG 23 2HG ARG 23 6.692 3.096 11.853 161 HD2 ARG 23 1HD ARG 23 7.134 3.202 14.194 162 HD3 ARG 23 2HD ARG 23 6.144 1.772 13.900 163 HE ARG 23 HE ARG 23 8.966 1.234 13.919 164 HH11 ARG 23 1HH1 ARG 23 6.110 1.583 15.877 165 HH12 ARG 23 2HH1 ARG 23 6.718 0.606 17.172 166 HH21 ARG 23 1HH2 ARG 23 9.780 -0.054 15.616 167 HH22 ARG 23 2HH2 ARG 23 8.808 -0.325 17.022 168 H ILE 24 H ILE 24 7.704 0.213 8.591 169 HA ILE 24 HA ILE 24 6.651 -2.419 8.609 170 HB ILE 24 HB ILE 24 7.514 -0.725 6.261 171 HG12 ILE 24 1HG1 ILE 24 4.680 -1.185 7.131 172 HG13 ILE 24 2HG1 ILE 24 5.649 0.052 7.924 173 HG21 ILE 24 1HG2 ILE 24 6.477 -3.437 6.453 174 HG22 ILE 24 2HG2 ILE 24 5.505 -2.399 5.412 175 HG23 ILE 24 3HG2 ILE 24 7.226 -2.604 5.092 176 HD11 ILE 24 3HD1 ILE 24 4.498 -0.012 5.215 177 HD12 ILE 24 1HD1 ILE 24 4.752 1.342 6.315 178 HD13 ILE 24 2HD1 ILE 24 6.101 0.708 5.371 179 H GLU 25 H GLU 25 9.608 -1.096 7.111 180 HA GLU 25 HA GLU 25 10.657 -3.525 6.226 181 HB2 GLU 25 1HB GLU 25 12.759 -2.383 5.993 182 HB3 GLU 25 2HB GLU 25 11.472 -1.267 5.558 183 HG2 GLU 25 1HG GLU 25 11.634 -0.224 7.763 184 HG3 GLU 25 2HG GLU 25 12.934 -1.337 8.189 185 H LYS 26 H LYS 26 10.867 -1.935 9.351 186 HA LYS 26 HA LYS 26 12.860 -3.608 10.465 187 HB2 LYS 26 1HB LYS 26 10.838 -1.696 11.546 188 HB3 LYS 26 2HB LYS 26 11.621 -2.805 12.666 189 HG2 LYS 26 1HG LYS 26 13.409 -1.351 10.829 190 HG3 LYS 26 2HG LYS 26 12.583 -0.379 12.048 191 HD2 LYS 26 1HD LYS 26 13.544 -2.738 13.306 192 HD3 LYS 26 2HD LYS 26 14.863 -2.051 12.354 193 HE2 LYS 26 1HE LYS 26 13.968 0.191 13.478 194 HE3 LYS 26 2HE LYS 26 13.433 -0.950 14.711 195 HZ1 LYS 26 3HZ LYS 26 16.213 -0.631 13.714 196 HZ2 LYS 26 1HZ LYS 26 15.714 -1.777 14.854 197 HZ3 LYS 26 2HZ LYS 26 15.628 -0.128 15.220 198 H TYR 27 H TYR 27 9.331 -3.580 11.002 199 HA TYR 27 HA TYR 27 9.134 -5.860 12.541 200 HB2 TYR 27 1HB TYR 27 7.222 -4.437 12.247 201 HB3 TYR 27 2HB TYR 27 7.202 -4.731 10.511 202 HD1 TYR 27 HD2 TYR 27 6.412 -6.884 9.626 203 HD2 TYR 27 HD1 TYR 27 6.277 -6.021 13.789 204 HE1 TYR 27 HE2 TYR 27 4.853 -8.758 9.958 205 HE2 TYR 27 HE1 TYR 27 4.719 -7.892 14.134 206 HH TYR 27 HH TYR 27 3.316 -9.341 13.058 207 H ALA 28 H ALA 28 9.007 -5.603 9.000 208 HA ALA 28 HA ALA 28 8.640 -8.360 8.511 209 HB1 ALA 28 3HB ALA 28 10.063 -7.087 6.367 210 HB2 ALA 28 1HB ALA 28 8.393 -7.651 6.423 211 HB3 ALA 28 2HB ALA 28 8.793 -6.024 6.973 212 H LYS 29 H LYS 29 11.557 -6.326 8.506 213 HA LYS 29 HA LYS 29 13.407 -8.273 7.772 214 HB2 LYS 29 1HB LYS 29 13.949 -5.889 7.880 215 HB3 LYS 29 2HB LYS 29 13.788 -5.918 9.631 216 HG2 LYS 29 1HG LYS 29 15.711 -7.305 9.859 217 HG3 LYS 29 2HG LYS 29 15.800 -7.564 8.116 218 HD2 LYS 29 1HD LYS 29 17.238 -5.856 8.076 219 HD3 LYS 29 2HD LYS 29 15.844 -4.813 8.366 220 HE2 LYS 29 1HE LYS 29 17.098 -4.145 10.127 221 HE3 LYS 29 2HE LYS 29 16.360 -5.555 10.884 222 HZ1 LYS 29 3HZ LYS 29 19.051 -5.065 10.567 223 HZ2 LYS 29 1HZ LYS 29 18.697 -6.284 9.447 224 HZ3 LYS 29 2HZ LYS 29 18.336 -6.509 11.084 225 H SER 30 H SER 30 11.887 -7.636 10.853 226 HA SER 30 HA SER 30 13.656 -9.391 12.315 227 HB2 SER 30 1HB SER 30 11.582 -7.460 12.958 228 HB3 SER 30 2HB SER 30 11.398 -8.944 13.893 229 HG SER 30 HG SER 30 12.841 -7.927 15.087 230 H LYS 31 H LYS 31 10.371 -9.490 11.026 231 HA LYS 31 HA LYS 31 9.750 -12.057 12.111 232 HB2 LYS 31 1HB LYS 31 8.481 -10.189 10.164 233 HB3 LYS 31 2HB LYS 31 7.965 -11.870 10.148 234 HG2 LYS 31 1HG LYS 31 7.989 -10.185 12.637 235 HG3 LYS 31 2HG LYS 31 6.593 -10.314 11.565 236 HD2 LYS 31 1HD LYS 31 6.585 -12.753 11.905 237 HD3 LYS 31 2HD LYS 31 7.948 -12.588 13.016 238 HE2 LYS 31 1HE LYS 31 5.844 -10.785 13.763 239 HE3 LYS 31 2HE LYS 31 5.204 -12.419 13.607 240 HZ1 LYS 31 3HZ LYS 31 6.098 -11.806 15.852 241 HZ2 LYS 31 1HZ LYS 31 7.644 -11.797 15.167 242 HZ3 LYS 31 2HZ LYS 31 6.736 -13.223 15.186 243 H ASN 32 H ASN 32 11.619 -11.011 9.474 244 HA ASN 32 HA ASN 32 12.756 -12.119 7.845 245 HB2 ASN 32 1HB ASN 32 13.132 -13.711 9.823 246 HB3 ASN 32 2HB ASN 32 11.879 -14.715 9.098 247 HD21 ASN 32 2HD2 ASN 32 13.673 -16.268 9.046 248 HD22 ASN 32 1HD2 ASN 32 14.732 -16.252 7.680 249 H ILE 33 H ILE 33 10.495 -11.222 6.919 250 HA ILE 33 HA ILE 33 9.194 -13.468 5.522 251 HB ILE 33 HB ILE 33 8.112 -10.694 6.035 252 HG12 ILE 33 1HG1 ILE 33 7.001 -13.277 7.104 253 HG13 ILE 33 2HG1 ILE 33 8.275 -12.416 7.961 254 HG21 ILE 33 1HG2 ILE 33 6.826 -13.077 4.708 255 HG22 ILE 33 2HG2 ILE 33 6.026 -11.551 5.081 256 HG23 ILE 33 3HG2 ILE 33 7.342 -11.593 3.908 257 HD11 ILE 33 3HD1 ILE 33 6.688 -10.389 7.798 258 HD12 ILE 33 1HD1 ILE 33 5.448 -11.598 7.466 259 HD13 ILE 33 2HD1 ILE 33 6.353 -11.655 8.980 260 H ASN 34 H ASN 34 8.958 -13.408 3.307 261 HA ASN 34 HA ASN 34 10.816 -11.676 1.908 262 HB2 ASN 34 1HB ASN 34 9.047 -13.682 0.548 263 HB3 ASN 34 2HB ASN 34 10.677 -13.170 0.121 264 HD21 ASN 34 2HD2 ASN 34 12.024 -13.468 2.454 265 HD22 ASN 34 1HD2 ASN 34 12.050 -15.133 2.917 266 H ALA 35 H ALA 35 9.670 -9.683 2.212 267 HA ALA 35 HA ALA 35 7.746 -9.210 0.092 268 HB1 ALA 35 3HB ALA 35 6.973 -8.254 2.821 269 HB2 ALA 35 1HB ALA 35 5.975 -8.450 1.379 270 HB3 ALA 35 2HB ALA 35 6.524 -9.869 2.272 271 H THR 36 H THR 36 7.466 -6.964 -0.398 272 HA THR 36 HA THR 36 9.170 -5.051 0.977 273 HB THR 36 HB THR 36 10.692 -6.020 -0.681 274 HG1 THR 36 HG1 THR 36 11.223 -3.943 -0.484 275 HG21 THR 36 3HG2 THR 36 8.572 -5.182 -2.655 276 HG22 THR 36 1HG2 THR 36 9.164 -6.814 -2.349 277 HG23 THR 36 2HG2 THR 36 10.219 -5.620 -3.106 278 H ILE 37 H ILE 37 8.482 -2.958 0.780 279 HA ILE 37 HA ILE 37 6.124 -2.509 -0.932 280 HB ILE 37 HB ILE 37 5.552 -2.573 1.477 281 HG12 ILE 37 1HG1 ILE 37 5.295 0.237 0.405 282 HG13 ILE 37 2HG1 ILE 37 4.374 -1.114 -0.244 283 HG21 ILE 37 1HG2 ILE 37 6.803 0.030 2.021 284 HG22 ILE 37 2HG2 ILE 37 6.601 -1.375 3.066 285 HG23 ILE 37 3HG2 ILE 37 7.917 -1.330 1.893 286 HD11 ILE 37 3HD1 ILE 37 2.922 -0.130 1.264 287 HD12 ILE 37 1HD1 ILE 37 3.603 -1.475 2.178 288 HD13 ILE 37 2HD1 ILE 37 4.194 0.165 2.450 289 H GLU 38 H GLU 38 5.896 -0.471 -1.897 290 HA GLU 38 HA GLU 38 8.035 1.473 -1.590 291 HB2 GLU 38 1HB GLU 38 8.720 -0.229 -3.361 292 HB3 GLU 38 2HB GLU 38 7.406 0.408 -4.338 293 HG2 GLU 38 1HG GLU 38 9.334 1.511 -5.075 294 HG3 GLU 38 2HG GLU 38 8.477 2.679 -4.071 295 H ALA 39 H ALA 39 7.495 3.544 -2.310 296 HA ALA 39 HA ALA 39 4.669 3.885 -3.081 297 HB1 ALA 39 3HB ALA 39 4.619 5.943 -1.827 298 HB2 ALA 39 1HB ALA 39 5.174 4.636 -0.779 299 HB3 ALA 39 2HB ALA 39 6.333 5.790 -1.441 300 H ILE 40 H ILE 40 4.156 5.522 -4.561 301 HA ILE 40 HA ILE 40 6.297 7.044 -5.793 302 HB ILE 40 HB ILE 40 5.370 6.231 -8.102 303 HG12 ILE 40 1HG1 ILE 40 4.794 3.826 -8.078 304 HG13 ILE 40 2HG1 ILE 40 4.817 3.849 -6.318 305 HG21 ILE 40 1HG2 ILE 40 7.063 4.088 -7.165 306 HG22 ILE 40 2HG2 ILE 40 7.419 5.389 -8.299 307 HG23 ILE 40 3HG2 ILE 40 7.614 5.653 -6.566 308 HD11 ILE 40 3HD1 ILE 40 2.943 5.363 -6.278 309 HD12 ILE 40 1HD1 ILE 40 2.957 5.471 -8.039 310 HD13 ILE 40 2HD1 ILE 40 2.549 3.946 -7.251 311 H ALA 41 H ALA 41 5.283 8.279 -7.783 312 HA ALA 41 HA ALA 41 3.072 9.774 -6.714 313 HB1 ALA 41 3HB ALA 41 4.999 10.083 -8.917 314 HB2 ALA 41 1HB ALA 41 3.413 10.807 -9.186 315 HB3 ALA 41 2HB ALA 41 4.369 11.274 -7.780 316 H GLU 42 H GLU 42 1.257 10.415 -8.274 317 HA GLU 42 HA GLU 42 -0.136 8.020 -9.004 318 HB2 GLU 42 1HB GLU 42 -1.941 9.598 -9.703 319 HB3 GLU 42 2HB GLU 42 -1.405 9.813 -8.042 320 HG2 GLU 42 1HG GLU 42 -1.181 11.965 -8.501 321 HG3 GLU 42 2HG GLU 42 0.206 11.531 -9.500 322 H THR 43 H THR 43 1.737 10.413 -10.671 323 HA THR 43 HA THR 43 0.755 10.068 -13.280 324 HB THR 43 HB THR 43 2.214 11.935 -12.722 325 HG1 THR 43 HG1 THR 43 3.719 10.398 -14.550 326 HG21 THR 43 3HG2 THR 43 3.719 10.132 -11.342 327 HG22 THR 43 1HG2 THR 43 4.250 11.756 -11.776 328 HG23 THR 43 2HG2 THR 43 4.704 10.380 -12.783 329 H ARG 44 H ARG 44 3.128 8.273 -11.407 330 HA ARG 44 HA ARG 44 3.605 6.496 -13.693 331 HB2 ARG 44 1HB ARG 44 5.061 6.451 -11.054 332 HB3 ARG 44 2HB ARG 44 5.569 5.746 -12.583 333 HG2 ARG 44 1HG ARG 44 6.748 7.578 -12.967 334 HG3 ARG 44 2HG ARG 44 5.232 8.475 -13.090 335 HD2 ARG 44 1HD ARG 44 5.290 8.823 -10.639 336 HD3 ARG 44 2HD ARG 44 6.857 8.015 -10.590 337 HE ARG 44 HE ARG 44 6.747 10.251 -12.400 338 HH11 ARG 44 1HH1 ARG 44 7.328 9.232 -9.122 339 HH12 ARG 44 2HH1 ARG 44 8.310 10.606 -8.732 340 HH21 ARG 44 1HH2 ARG 44 8.037 12.063 -11.898 341 HH22 ARG 44 2HH2 ARG 44 8.711 12.216 -10.311 342 H LEU 45 H LEU 45 1.662 6.733 -11.008 343 HA LEU 45 HA LEU 45 1.653 4.231 -9.832 344 HB2 LEU 45 1HB LEU 45 0.305 5.818 -8.812 345 HB3 LEU 45 2HB LEU 45 -0.477 6.269 -10.326 346 HG LEU 45 HG LEU 45 -0.976 3.517 -9.373 347 HD11 LEU 45 1HD1 LEU 45 -2.906 4.997 -8.046 348 HD12 LEU 45 2HD1 LEU 45 -1.392 5.815 -7.663 349 HD13 LEU 45 3HD1 LEU 45 -1.579 4.097 -7.313 350 HD21 LEU 45 3HD2 LEU 45 -2.711 3.708 -10.755 351 HD22 LEU 45 1HD2 LEU 45 -2.019 5.244 -11.276 352 HD23 LEU 45 2HD2 LEU 45 -3.238 5.214 -10.002 353 H SER 46 H SER 46 -0.212 5.312 -12.664 354 HA SER 46 HA SER 46 -1.346 2.742 -13.153 355 HB2 SER 46 1HB SER 46 -1.257 5.344 -14.628 356 HB3 SER 46 2HB SER 46 -1.761 3.891 -15.491 357 HG SER 46 HG SER 46 -3.606 4.019 -14.513 358 H GLU 47 H GLU 47 1.734 3.956 -13.606 359 HA GLU 47 HA GLU 47 2.291 2.197 -15.891 360 HB2 GLU 47 1HB GLU 47 3.157 4.782 -15.275 361 HB3 GLU 47 2HB GLU 47 4.550 3.759 -14.956 362 HG2 GLU 47 1HG GLU 47 3.537 2.859 -17.390 363 HG3 GLU 47 2HG GLU 47 3.436 4.617 -17.466 364 H VAL 48 H VAL 48 2.256 2.039 -12.623 365 HA VAL 48 HA VAL 48 4.483 0.108 -12.561 366 HB VAL 48 HB VAL 48 4.807 0.619 -10.192 367 HG11 VAL 48 1HG1 VAL 48 6.310 1.838 -11.422 368 HG12 VAL 48 2HG1 VAL 48 5.053 2.768 -12.241 369 HG13 VAL 48 3HG1 VAL 48 5.469 3.130 -10.565 370 HG21 VAL 48 3HG2 VAL 48 2.558 1.303 -9.606 371 HG22 VAL 48 1HG2 VAL 48 3.699 2.582 -9.191 372 HG23 VAL 48 2HG2 VAL 48 2.697 2.730 -10.635 373 H VAL 49 H VAL 49 1.227 0.897 -11.523 374 HA VAL 49 HA VAL 49 0.755 -1.340 -9.885 375 HB VAL 49 HB VAL 49 -1.650 -0.916 -10.304 376 HG11 VAL 49 1HG1 VAL 49 -0.911 0.345 -8.532 377 HG12 VAL 49 2HG1 VAL 49 0.229 1.262 -9.519 378 HG13 VAL 49 3HG1 VAL 49 -1.498 1.608 -9.614 379 HG21 VAL 49 3HG2 VAL 49 -0.516 0.844 -12.432 380 HG22 VAL 49 1HG2 VAL 49 -1.898 -0.251 -12.495 381 HG23 VAL 49 2HG2 VAL 49 -2.033 1.292 -11.651 382 H ASP 50 H ASP 50 0.967 -1.011 -13.303 383 HA ASP 50 HA ASP 50 -0.624 -3.228 -14.063 384 HB2 ASP 50 1HB ASP 50 0.820 -1.235 -15.382 385 HB3 ASP 50 2HB ASP 50 1.602 -2.739 -15.859 386 H ARG 51 H ARG 51 2.448 -2.985 -12.601 387 HA ARG 51 HA ARG 51 3.001 -5.812 -13.221 388 HB2 ARG 51 1HB ARG 51 5.054 -3.765 -12.383 389 HB3 ARG 51 2HB ARG 51 5.341 -5.381 -13.015 390 HG2 ARG 51 1HG ARG 51 3.837 -4.083 -14.974 391 HG3 ARG 51 2HG ARG 51 5.021 -2.897 -14.421 392 HD2 ARG 51 1HD ARG 51 6.816 -4.513 -14.803 393 HD3 ARG 51 2HD ARG 51 5.633 -5.703 -15.344 394 HE ARG 51 HE ARG 51 5.507 -3.269 -16.839 395 HH11 ARG 51 1HH1 ARG 51 7.194 -6.296 -16.507 396 HH12 ARG 51 2HH1 ARG 51 7.710 -6.340 -18.160 397 HH21 ARG 51 1HH2 ARG 51 6.180 -3.315 -19.018 398 HH22 ARG 51 2HH2 ARG 51 7.133 -4.643 -19.588 399 H PHE 52 H PHE 52 2.867 -3.331 -10.747 400 HA PHE 52 HA PHE 52 3.901 -4.749 -8.584 401 HB2 PHE 52 1HB PHE 52 2.166 -2.397 -8.949 402 HB3 PHE 52 2HB PHE 52 1.967 -3.225 -7.408 403 HD1 PHE 52 HD1 PHE 52 4.101 -3.692 -6.054 404 HD2 PHE 52 HD2 PHE 52 3.894 -0.885 -9.246 405 HE1 PHE 52 HE1 PHE 52 6.106 -2.560 -5.184 406 HE2 PHE 52 HE2 PHE 52 5.899 0.250 -8.383 407 HZ PHE 52 HZ PHE 52 7.008 -0.588 -6.350 408 H ASP 53 H ASP 53 2.283 -5.165 -6.596 409 HA ASP 53 HA ASP 53 0.390 -7.188 -7.581 410 HB2 ASP 53 1HB ASP 53 1.941 -6.966 -5.002 411 HB3 ASP 53 2HB ASP 53 0.611 -8.102 -5.211 412 H VAL 54 H VAL 54 0.681 -5.333 -4.554 413 HA VAL 54 HA VAL 54 -2.209 -4.791 -4.719 414 HB VAL 54 HB VAL 54 -1.353 -6.098 -2.738 415 HG11 VAL 54 1HG1 VAL 54 -0.491 -3.751 -1.279 416 HG12 VAL 54 2HG1 VAL 54 0.280 -5.331 -1.431 417 HG13 VAL 54 3HG1 VAL 54 0.561 -4.090 -2.653 418 HG21 VAL 54 3HG2 VAL 54 -2.506 -3.582 -1.666 419 HG22 VAL 54 1HG2 VAL 54 -3.413 -4.432 -2.916 420 HG23 VAL 54 2HG2 VAL 54 -3.003 -5.254 -1.411 421 H VAL 55 H VAL 55 -2.961 -2.717 -3.896 422 HA VAL 55 HA VAL 55 -0.955 -0.574 -4.159 423 HB VAL 55 HB VAL 55 -3.799 -0.383 -5.154 424 HG11 VAL 55 1HG1 VAL 55 -2.845 1.750 -4.535 425 HG12 VAL 55 2HG1 VAL 55 -1.398 1.412 -5.488 426 HG13 VAL 55 3HG1 VAL 55 -2.953 1.638 -6.292 427 HG21 VAL 55 3HG2 VAL 55 -2.756 -0.458 -7.428 428 HG22 VAL 55 1HG2 VAL 55 -1.256 -0.974 -6.658 429 HG23 VAL 55 2HG2 VAL 55 -2.697 -1.983 -6.546 430 H LEU 56 H LEU 56 -1.288 1.285 -2.910 431 HA LEU 56 HA LEU 56 -3.463 1.192 -0.946 432 HB2 LEU 56 1HB LEU 56 -0.524 1.327 -0.399 433 HB3 LEU 56 2HB LEU 56 -1.674 2.055 0.719 434 HG LEU 56 HG LEU 56 -2.727 -0.416 0.509 435 HD11 LEU 56 1HD1 LEU 56 0.104 -0.606 -0.319 436 HD12 LEU 56 2HD1 LEU 56 -1.269 -1.641 -0.712 437 HD13 LEU 56 3HD1 LEU 56 -0.467 -1.797 0.851 438 HD21 LEU 56 3HD2 LEU 56 -1.693 -0.883 2.648 439 HD22 LEU 56 1HD2 LEU 56 -2.164 0.814 2.564 440 HD23 LEU 56 2HD2 LEU 56 -0.473 0.358 2.358 441 H LEU 57 H LEU 57 -3.867 3.253 0.108 442 HA LEU 57 HA LEU 57 -2.829 5.562 -1.393 443 HB2 LEU 57 1HB LEU 57 -5.500 4.577 -1.327 444 HB3 LEU 57 2HB LEU 57 -5.458 6.133 -0.501 445 HG LEU 57 HG LEU 57 -4.251 5.822 -3.226 446 HD11 LEU 57 1HD1 LEU 57 -6.857 6.943 -3.402 447 HD12 LEU 57 2HD1 LEU 57 -6.978 5.367 -2.621 448 HD13 LEU 57 3HD1 LEU 57 -6.213 5.510 -4.204 449 HD21 LEU 57 3HD2 LEU 57 -3.711 7.916 -2.584 450 HD22 LEU 57 1HD2 LEU 57 -5.012 8.006 -1.397 451 HD23 LEU 57 2HD2 LEU 57 -5.358 8.269 -3.106 452 H ALA 58 H ALA 58 -3.176 7.646 -0.234 453 HA ALA 58 HA ALA 58 -2.740 7.252 2.645 454 HB1 ALA 58 3HB ALA 58 -1.509 8.952 0.646 455 HB2 ALA 58 1HB ALA 58 -2.037 9.863 2.061 456 HB3 ALA 58 2HB ALA 58 -0.937 8.497 2.251 457 HA PRO 59 HA PRO 59 -6.379 9.418 3.795 458 HB2 PRO 59 1HB PRO 59 -5.540 10.885 5.919 459 HB3 PRO 59 2HB PRO 59 -5.744 9.130 5.984 460 HG2 PRO 59 1HG PRO 59 -3.244 10.733 5.607 461 HG3 PRO 59 2HG PRO 59 -3.513 9.302 6.619 462 HD2 PRO 59 1HD PRO 59 -2.308 9.168 4.198 463 HD3 PRO 59 2HD PRO 59 -3.309 7.850 4.840 464 H GLN 60 H GLN 60 -3.543 11.231 2.969 465 HA GLN 60 HA GLN 60 -5.008 13.749 2.853 466 HB2 GLN 60 1HB GLN 60 -2.112 13.021 2.458 467 HB3 GLN 60 2HB GLN 60 -2.734 14.618 2.067 468 HG2 GLN 60 1HG GLN 60 -2.805 15.244 4.206 469 HG3 GLN 60 2HG GLN 60 -3.472 13.700 4.734 470 HE21 GLN 60 2HE2 GLN 60 -1.027 15.655 5.290 471 HE22 GLN 60 1HE2 GLN 60 0.236 14.530 5.643 472 H SER 61 H SER 61 -6.448 13.364 1.160 473 HA SER 61 HA SER 61 -5.396 13.863 -1.455 474 HB2 SER 61 1HB SER 61 -6.560 11.151 -0.815 475 HB3 SER 61 2HB SER 61 -6.504 11.795 -2.456 476 HG SER 61 HG SER 61 -4.605 10.509 -1.227 477 H ARG 62 H ARG 62 -6.790 15.189 -2.397 478 HA ARG 62 HA ARG 62 -9.516 15.352 -1.385 479 HB2 ARG 62 1HB ARG 62 -7.764 17.132 -3.034 480 HB3 ARG 62 2HB ARG 62 -9.508 17.353 -3.081 481 HG2 ARG 62 1HG ARG 62 -7.853 17.387 -0.566 482 HG3 ARG 62 2HG ARG 62 -8.354 18.823 -1.460 483 HD2 ARG 62 1HD ARG 62 -10.737 17.651 -1.187 484 HD3 ARG 62 2HD ARG 62 -9.940 16.985 0.239 485 HE ARG 62 HE ARG 62 -10.030 19.054 1.214 486 HH11 ARG 62 1HH1 ARG 62 -10.634 19.372 -2.200 487 HH12 ARG 62 2HH1 ARG 62 -11.074 21.045 -2.099 488 HH21 ARG 62 1HH2 ARG 62 -10.610 21.255 1.360 489 HH22 ARG 62 2HH2 ARG 62 -11.059 22.115 -0.074 490 H PHE 63 H PHE 63 -8.097 15.524 -4.655 491 HA PHE 63 HA PHE 63 -10.529 14.298 -5.718 492 HB2 PHE 63 1HB PHE 63 -9.601 14.970 -7.935 493 HB3 PHE 63 2HB PHE 63 -9.842 16.325 -6.836 494 HD1 PHE 63 HD1 PHE 63 -7.344 14.160 -8.437 495 HD2 PHE 63 HD2 PHE 63 -8.000 17.608 -6.026 496 HE1 PHE 63 HE1 PHE 63 -4.995 14.824 -8.752 497 HE2 PHE 63 HE2 PHE 63 -5.654 18.277 -6.339 498 HZ PHE 63 HZ PHE 63 -4.148 16.886 -7.704 499 H ASN 64 H ASN 64 -7.171 13.649 -5.173 500 HA ASN 64 HA ASN 64 -6.622 11.649 -6.993 501 HB2 ASN 64 1HB ASN 64 -5.570 12.498 -4.415 502 HB3 ASN 64 2HB ASN 64 -5.419 10.759 -4.649 503 HD21 ASN 64 2HD2 ASN 64 -3.834 13.554 -4.996 504 HD22 ASN 64 1HD2 ASN 64 -2.786 13.159 -6.312 505 H LYS 65 H LYS 65 -7.974 11.232 -3.720 506 HA LYS 65 HA LYS 65 -8.382 8.476 -3.857 507 HB2 LYS 65 1HB LYS 65 -10.073 8.847 -2.057 508 HB3 LYS 65 2HB LYS 65 -8.519 9.607 -1.744 509 HG2 LYS 65 1HG LYS 65 -9.406 11.762 -2.419 510 HG3 LYS 65 2HG LYS 65 -10.956 11.016 -2.814 511 HD2 LYS 65 1HD LYS 65 -11.050 10.249 -0.403 512 HD3 LYS 65 2HD LYS 65 -9.679 11.319 -0.106 513 HE2 LYS 65 1HE LYS 65 -10.957 13.234 -0.792 514 HE3 LYS 65 2HE LYS 65 -12.298 12.211 -1.301 515 HZ1 LYS 65 3HZ LYS 65 -11.391 12.065 1.485 516 HZ2 LYS 65 1HZ LYS 65 -12.937 11.821 0.843 517 HZ3 LYS 65 2HZ LYS 65 -12.327 13.390 1.008 518 H LYS 66 H LYS 66 -10.389 11.151 -4.946 519 HA LYS 66 HA LYS 66 -12.749 9.731 -5.462 520 HB2 LYS 66 1HB LYS 66 -11.945 12.344 -5.700 521 HB3 LYS 66 2HB LYS 66 -12.134 11.866 -7.382 522 HG2 LYS 66 1HG LYS 66 -14.371 11.754 -7.235 523 HG3 LYS 66 2HG LYS 66 -14.336 11.075 -5.607 524 HD2 LYS 66 1HD LYS 66 -13.409 13.598 -5.167 525 HD3 LYS 66 2HD LYS 66 -14.549 13.868 -6.487 526 HE2 LYS 66 1HE LYS 66 -15.408 12.152 -4.216 527 HE3 LYS 66 2HE LYS 66 -15.308 13.892 -3.949 528 HZ1 LYS 66 3HZ LYS 66 -17.499 13.408 -4.657 529 HZ2 LYS 66 1HZ LYS 66 -16.961 12.470 -5.958 530 HZ3 LYS 66 2HZ LYS 66 -16.728 14.146 -5.970 531 H ARG 67 H ARG 67 -10.251 10.729 -7.810 532 HA ARG 67 HA ARG 67 -11.255 9.189 -9.935 533 HB2 ARG 67 1HB ARG 67 -8.383 10.031 -9.523 534 HB3 ARG 67 2HB ARG 67 -9.163 9.640 -11.050 535 HG2 ARG 67 1HG ARG 67 -10.723 11.595 -10.567 536 HG3 ARG 67 2HG ARG 67 -9.567 12.048 -9.312 537 HD2 ARG 67 1HD ARG 67 -7.791 12.171 -10.978 538 HD3 ARG 67 2HD ARG 67 -8.924 11.675 -12.235 539 HE ARG 67 HE ARG 67 -10.013 13.926 -11.074 540 HH11 ARG 67 1HH1 ARG 67 -7.080 13.104 -12.758 541 HH12 ARG 67 2HH1 ARG 67 -6.865 14.688 -13.425 542 HH21 ARG 67 1HH2 ARG 67 -9.741 16.015 -11.946 543 HH22 ARG 67 2HH2 ARG 67 -8.378 16.344 -12.961 544 H LEU 68 H LEU 68 -8.637 8.531 -7.622 545 HA LEU 68 HA LEU 68 -7.741 6.113 -8.592 546 HB2 LEU 68 1HB LEU 68 -7.894 7.323 -5.880 547 HB3 LEU 68 2HB LEU 68 -7.447 5.623 -6.013 548 HG LEU 68 HG LEU 68 -5.948 7.527 -7.715 549 HD11 LEU 68 1HD1 LEU 68 -4.866 8.658 -6.101 550 HD12 LEU 68 2HD1 LEU 68 -4.922 7.310 -4.967 551 HD13 LEU 68 3HD1 LEU 68 -6.333 8.347 -5.172 552 HD21 LEU 68 3HD2 LEU 68 -5.271 5.292 -7.877 553 HD22 LEU 68 1HD2 LEU 68 -5.379 5.039 -6.135 554 HD23 LEU 68 2HD2 LEU 68 -4.084 6.032 -6.802 555 H GLU 69 H GLU 69 -10.468 6.714 -6.402 556 HA GLU 69 HA GLU 69 -11.145 3.977 -6.068 557 HB2 GLU 69 1HB GLU 69 -12.671 6.536 -5.612 558 HB3 GLU 69 2HB GLU 69 -13.368 4.954 -5.290 559 HG2 GLU 69 1HG GLU 69 -10.733 5.571 -4.082 560 HG3 GLU 69 2HG GLU 69 -12.156 6.371 -3.418 561 H GLU 70 H GLU 70 -12.344 6.536 -8.204 562 HA GLU 70 HA GLU 70 -14.390 5.006 -9.408 563 HB2 GLU 70 1HB GLU 70 -12.881 7.446 -10.339 564 HB3 GLU 70 2HB GLU 70 -14.206 6.738 -11.252 565 HG2 GLU 70 1HG GLU 70 -14.602 7.487 -8.392 566 HG3 GLU 70 2HG GLU 70 -14.652 8.723 -9.647 567 H ILE 71 H ILE 71 -10.990 4.998 -9.780 568 HA ILE 71 HA ILE 71 -11.110 3.708 -12.399 569 HB ILE 71 HB ILE 71 -8.722 4.503 -10.729 570 HG12 ILE 71 1HG1 ILE 71 -9.425 5.752 -13.349 571 HG13 ILE 71 2HG1 ILE 71 -10.334 6.238 -11.921 572 HG21 ILE 71 1HG2 ILE 71 -7.699 4.191 -13.164 573 HG22 ILE 71 2HG2 ILE 71 -7.786 2.871 -12.000 574 HG23 ILE 71 3HG2 ILE 71 -9.001 3.008 -13.270 575 HD11 ILE 71 3HD1 ILE 71 -7.652 6.945 -12.753 576 HD12 ILE 71 1HD1 ILE 71 -8.721 7.723 -11.586 577 HD13 ILE 71 2HD1 ILE 71 -7.712 6.364 -11.089 578 H THR 72 H THR 72 -10.189 3.037 -9.059 579 HA THR 72 HA THR 72 -9.179 0.430 -9.520 580 HB THR 72 HB THR 72 -9.529 0.106 -7.056 581 HG1 THR 72 HG1 THR 72 -10.864 1.417 -6.086 582 HG21 THR 72 3HG2 THR 72 -7.497 1.002 -6.907 583 HG22 THR 72 1HG2 THR 72 -8.202 2.617 -6.861 584 HG23 THR 72 2HG2 THR 72 -7.774 1.885 -8.408 585 H LYS 73 H LYS 73 -12.381 1.687 -8.773 586 HA LYS 73 HA LYS 73 -13.725 -0.618 -8.080 587 HB2 LYS 73 1HB LYS 73 -14.428 2.006 -9.091 588 HB3 LYS 73 2HB LYS 73 -15.506 0.773 -9.731 589 HG2 LYS 73 1HG LYS 73 -16.565 0.562 -7.790 590 HG3 LYS 73 2HG LYS 73 -15.051 0.439 -6.891 591 HD2 LYS 73 1HD LYS 73 -14.847 2.816 -6.767 592 HD3 LYS 73 2HD LYS 73 -16.192 3.044 -7.889 593 HE2 LYS 73 1HE LYS 73 -17.236 1.477 -5.842 594 HE3 LYS 73 2HE LYS 73 -16.218 2.660 -5.021 595 HZ1 LYS 73 3HZ LYS 73 -18.089 3.557 -7.104 596 HZ2 LYS 73 1HZ LYS 73 -17.481 4.405 -5.772 597 HZ3 LYS 73 2HZ LYS 73 -18.672 3.224 -5.552 598 HA PRO 74 HA PRO 74 -14.647 -1.551 -12.723 599 HB2 PRO 74 1HB PRO 74 -13.352 -0.062 -14.587 600 HB3 PRO 74 2HB PRO 74 -14.916 0.400 -13.906 601 HG2 PRO 74 1HG PRO 74 -12.176 1.369 -13.186 602 HG3 PRO 74 2HG PRO 74 -13.674 2.297 -13.390 603 HD2 PRO 74 1HD PRO 74 -12.712 1.600 -10.956 604 HD3 PRO 74 2HD PRO 74 -14.449 1.748 -11.290 605 H LYS 75 H LYS 75 -11.364 -0.394 -12.069 606 HA LYS 75 HA LYS 75 -10.019 -2.198 -13.772 607 HB2 LYS 75 1HB LYS 75 -9.206 -0.555 -11.398 608 HB3 LYS 75 2HB LYS 75 -8.083 -1.720 -12.087 609 HG2 LYS 75 1HG LYS 75 -9.322 0.024 -14.073 610 HG3 LYS 75 2HG LYS 75 -8.355 0.881 -12.871 611 HD2 LYS 75 1HD LYS 75 -7.191 -1.575 -14.061 612 HD3 LYS 75 2HD LYS 75 -7.301 -0.148 -15.093 613 HE2 LYS 75 1HE LYS 75 -5.737 0.984 -13.916 614 HE3 LYS 75 2HE LYS 75 -6.252 0.303 -12.374 615 HZ1 LYS 75 3HZ LYS 75 -5.214 -1.833 -13.663 616 HZ2 LYS 75 1HZ LYS 75 -4.391 -0.893 -12.522 617 HZ3 LYS 75 2HZ LYS 75 -4.192 -0.585 -14.173 618 H GLY 76 H GLY 76 -11.421 -2.549 -10.626 619 HA2 GLY 76 1HA GLY 76 -11.597 -4.346 -9.207 620 HA3 GLY 76 2HA GLY 76 -11.328 -5.337 -10.634 621 H ILE 77 H ILE 77 -9.444 -3.232 -8.455 622 HA ILE 77 HA ILE 77 -7.428 -5.371 -8.307 623 HB ILE 77 HB ILE 77 -5.679 -3.574 -8.155 624 HG12 ILE 77 1HG1 ILE 77 -7.086 -1.588 -9.667 625 HG13 ILE 77 2HG1 ILE 77 -7.975 -1.905 -8.182 626 HG21 ILE 77 1HG2 ILE 77 -6.616 -4.892 -10.297 627 HG22 ILE 77 2HG2 ILE 77 -6.873 -3.232 -10.832 628 HG23 ILE 77 3HG2 ILE 77 -5.258 -3.769 -10.367 629 HD11 ILE 77 3HD1 ILE 77 -6.129 -1.306 -6.841 630 HD12 ILE 77 1HD1 ILE 77 -5.035 -1.306 -8.225 631 HD13 ILE 77 2HD1 ILE 77 -6.276 -0.061 -8.081 632 HA PRO 78 HA PRO 78 -7.608 -4.916 -3.944 633 HB2 PRO 78 1HB PRO 78 -5.056 -5.523 -3.248 634 HB3 PRO 78 2HB PRO 78 -6.210 -6.734 -3.818 635 HG2 PRO 78 1HG PRO 78 -4.036 -5.332 -5.324 636 HG3 PRO 78 2HG PRO 78 -4.501 -7.044 -5.364 637 HD2 PRO 78 1HD PRO 78 -5.254 -5.283 -7.279 638 HD3 PRO 78 2HD PRO 78 -6.266 -6.660 -6.796 639 H ILE 79 H ILE 79 -7.971 -2.767 -3.494 640 HA ILE 79 HA ILE 79 -5.571 -1.087 -3.160 641 HB ILE 79 HB ILE 79 -7.083 -0.263 -4.942 642 HG12 ILE 79 1HG1 ILE 79 -7.446 2.062 -3.824 643 HG13 ILE 79 2HG1 ILE 79 -6.630 1.339 -2.441 644 HG21 ILE 79 1HG2 ILE 79 -9.181 -1.103 -3.939 645 HG22 ILE 79 2HG2 ILE 79 -9.066 0.157 -2.711 646 HG23 ILE 79 3HG2 ILE 79 -9.274 0.595 -4.407 647 HD11 ILE 79 3HD1 ILE 79 -5.388 2.644 -4.453 648 HD12 ILE 79 1HD1 ILE 79 -4.624 1.431 -3.425 649 HD13 ILE 79 2HD1 ILE 79 -5.261 0.973 -5.006 650 H GLU 80 H GLU 80 -5.213 -0.207 -1.206 651 HA GLU 80 HA GLU 80 -7.361 -0.369 0.800 652 HB2 GLU 80 1HB GLU 80 -5.105 -1.949 0.816 653 HB3 GLU 80 2HB GLU 80 -4.650 -0.622 1.874 654 HG2 GLU 80 1HG GLU 80 -5.636 -2.527 3.077 655 HG3 GLU 80 2HG GLU 80 -6.538 -1.029 3.295 656 H ILE 81 H ILE 81 -6.968 1.071 2.693 657 HA ILE 81 HA ILE 81 -5.388 3.450 2.000 658 HB ILE 81 HB ILE 81 -8.225 3.507 3.035 659 HG12 ILE 81 1HG1 ILE 81 -8.219 4.967 0.743 660 HG13 ILE 81 2HG1 ILE 81 -7.018 3.742 0.348 661 HG21 ILE 81 1HG2 ILE 81 -6.247 5.712 2.492 662 HG22 ILE 81 2HG2 ILE 81 -7.974 5.978 2.722 663 HG23 ILE 81 3HG2 ILE 81 -7.005 5.298 4.030 664 HD11 ILE 81 3HD1 ILE 81 -8.550 2.118 0.183 665 HD12 ILE 81 1HD1 ILE 81 -9.488 2.716 1.551 666 HD13 ILE 81 2HD1 ILE 81 -9.670 3.462 -0.036 667 H ILE 82 H ILE 82 -4.219 4.250 3.638 668 HA ILE 82 HA ILE 82 -4.205 2.868 6.154 669 HB ILE 82 HB ILE 82 -2.665 5.331 5.325 670 HG12 ILE 82 1HG1 ILE 82 -1.875 2.410 5.276 671 HG13 ILE 82 2HG1 ILE 82 -2.205 3.409 3.865 672 HG21 ILE 82 1HG2 ILE 82 -2.821 5.021 7.755 673 HG22 ILE 82 2HG2 ILE 82 -2.168 3.392 7.580 674 HG23 ILE 82 3HG2 ILE 82 -1.176 4.790 7.164 675 HD11 ILE 82 3HD1 ILE 82 0.237 3.042 5.259 676 HD12 ILE 82 1HD1 ILE 82 -0.079 3.992 3.806 677 HD13 ILE 82 2HD1 ILE 82 -0.240 4.734 5.398 678 H ASN 83 H ASN 83 -4.811 3.610 8.152 679 HA ASN 83 HA ASN 83 -6.794 5.717 8.171 680 HB2 ASN 83 1HB ASN 83 -6.231 3.388 9.738 681 HB3 ASN 83 2HB ASN 83 -6.279 4.789 10.806 682 HD21 ASN 83 2HD2 ASN 83 -8.189 5.676 11.313 683 HD22 ASN 83 1HD2 ASN 83 -9.713 5.148 10.691 684 H THR 84 H THR 84 -6.678 7.647 9.263 685 HA THR 84 HA THR 84 -4.285 9.008 9.387 686 HB THR 84 HB THR 84 -5.652 10.405 11.226 687 HG1 THR 84 HG1 THR 84 -7.348 8.934 11.435 688 HG21 THR 84 3HG2 THR 84 -6.999 10.893 8.768 689 HG22 THR 84 1HG2 THR 84 -5.329 10.458 8.405 690 HG23 THR 84 2HG2 THR 84 -5.673 11.802 9.494 691 H ILE 85 H ILE 85 -5.758 6.946 11.786 692 HA ILE 85 HA ILE 85 -4.161 7.778 13.987 693 HB ILE 85 HB ILE 85 -5.511 5.104 13.612 694 HG12 ILE 85 1HG1 ILE 85 -7.133 6.895 13.294 695 HG13 ILE 85 2HG1 ILE 85 -7.405 6.108 14.845 696 HG21 ILE 85 1HG2 ILE 85 -5.646 5.429 16.197 697 HG22 ILE 85 2HG2 ILE 85 -4.160 4.837 15.456 698 HG23 ILE 85 3HG2 ILE 85 -4.293 6.529 15.934 699 HD11 ILE 85 3HD1 ILE 85 -7.642 8.412 15.224 700 HD12 ILE 85 1HD1 ILE 85 -6.063 7.978 15.878 701 HD13 ILE 85 2HD1 ILE 85 -6.178 8.792 14.318 702 H ASP 86 H ASP 86 -4.072 4.727 12.134 703 HA ASP 86 HA ASP 86 -1.661 3.785 13.137 704 HB2 ASP 86 1HB ASP 86 -2.910 3.343 10.420 705 HB3 ASP 86 2HB ASP 86 -1.549 2.417 11.046 706 H TYR 87 H TYR 87 -2.289 6.107 10.597 707 HA TYR 87 HA TYR 87 0.347 6.136 9.526 708 HB2 TYR 87 1HB TYR 87 -2.102 7.243 8.820 709 HB3 TYR 87 2HB TYR 87 -1.111 8.640 9.224 710 HD1 TYR 87 HD2 TYR 87 1.555 7.720 8.327 711 HD2 TYR 87 HD1 TYR 87 -2.262 7.310 6.492 712 HE1 TYR 87 HE2 TYR 87 2.636 7.594 6.120 713 HE2 TYR 87 HE1 TYR 87 -1.193 7.184 4.281 714 HH TYR 87 HH TYR 87 0.748 7.010 3.181 715 H GLY 88 H GLY 88 -1.386 8.332 11.736 716 HA2 GLY 88 1HA GLY 88 0.729 10.106 12.201 717 HA3 GLY 88 2HA GLY 88 -0.613 9.823 13.299 718 H THR 89 H THR 89 -0.227 7.204 14.019 719 HA THR 89 HA THR 89 1.956 7.472 15.869 720 HB THR 89 HB THR 89 -0.097 6.426 16.630 721 HG1 THR 89 HG1 THR 89 0.905 4.831 17.729 722 HG21 THR 89 3HG2 THR 89 -1.248 5.096 15.262 723 HG22 THR 89 1HG2 THR 89 -0.009 3.861 15.477 724 HG23 THR 89 2HG2 THR 89 0.110 5.006 14.142 725 H MET 90 H MET 90 1.526 6.079 12.769 726 HA MET 90 HA MET 90 2.919 4.939 11.380 727 HB2 MET 90 1HB MET 90 5.117 5.398 13.389 728 HB3 MET 90 2HB MET 90 5.269 5.172 11.653 729 HG2 MET 90 1HG MET 90 5.300 7.369 11.432 730 HG3 MET 90 2HG MET 90 3.620 7.398 11.961 731 HE1 MET 90 3HE MET 90 7.485 8.141 13.673 732 HE2 MET 90 1HE MET 90 6.905 7.150 15.012 733 HE3 MET 90 2HE MET 90 6.911 6.501 13.371 734 H ASN 91 H ASN 91 1.752 3.004 11.837 735 HA ASN 91 HA ASN 91 3.150 1.140 13.639 736 HB2 ASN 91 1HB ASN 91 0.562 1.791 13.805 737 HB3 ASN 91 2HB ASN 91 0.431 0.502 12.612 738 HD21 ASN 91 2HD2 ASN 91 2.155 -1.349 13.345 739 HD22 ASN 91 1HD2 ASN 91 1.830 -1.935 14.938 740 H GLY 92 H GLY 92 4.704 0.406 12.195 741 HA2 GLY 92 1HA GLY 92 4.383 -0.288 9.540 742 HA3 GLY 92 2HA GLY 92 5.544 -1.042 10.623 743 H GLU 93 H GLU 93 3.935 -2.383 12.380 744 HA GLU 93 HA GLU 93 3.394 -4.762 11.084 745 HB2 GLU 93 1HB GLU 93 3.657 -4.490 13.540 746 HB3 GLU 93 2HB GLU 93 2.057 -3.766 13.604 747 HG2 GLU 93 1HG GLU 93 1.095 -5.856 12.746 748 HG3 GLU 93 2HG GLU 93 2.703 -6.577 12.745 749 H LYS 94 H LYS 94 1.079 -2.240 12.051 750 HA LYS 94 HA LYS 94 -1.215 -3.495 11.023 751 HB2 LYS 94 1HB LYS 94 -0.700 -0.531 11.326 752 HB3 LYS 94 2HB LYS 94 -2.275 -1.300 11.179 753 HG2 LYS 94 1HG LYS 94 -0.589 -2.289 13.376 754 HG3 LYS 94 2HG LYS 94 -1.136 -0.617 13.521 755 HD2 LYS 94 1HD LYS 94 -3.420 -1.266 13.384 756 HD3 LYS 94 2HD LYS 94 -2.991 -2.910 12.905 757 HE2 LYS 94 1HE LYS 94 -1.951 -3.256 15.107 758 HE3 LYS 94 2HE LYS 94 -2.429 -1.625 15.579 759 HZ1 LYS 94 3HZ LYS 94 -3.998 -4.036 15.464 760 HZ2 LYS 94 1HZ LYS 94 -4.754 -2.707 14.740 761 HZ3 LYS 94 2HZ LYS 94 -4.254 -2.621 16.353 762 H VAL 95 H VAL 95 1.117 -1.292 9.556 763 HA VAL 95 HA VAL 95 -0.252 -0.784 7.162 764 HB VAL 95 HB VAL 95 2.741 -0.944 7.545 765 HG11 VAL 95 1HG1 VAL 95 2.617 0.841 5.702 766 HG12 VAL 95 2HG1 VAL 95 2.373 -0.845 5.243 767 HG13 VAL 95 3HG1 VAL 95 0.988 0.232 5.415 768 HG21 VAL 95 3HG2 VAL 95 0.847 0.812 8.719 769 HG22 VAL 95 1HG2 VAL 95 2.606 0.872 8.814 770 HG23 VAL 95 2HG2 VAL 95 1.763 1.725 7.522 771 H LEU 96 H LEU 96 2.568 -2.940 7.517 772 HA LEU 96 HA LEU 96 2.339 -4.241 5.095 773 HB2 LEU 96 1HB LEU 96 3.539 -6.140 6.238 774 HB3 LEU 96 2HB LEU 96 4.309 -4.557 6.337 775 HG LEU 96 HG LEU 96 2.803 -4.682 8.648 776 HD11 LEU 96 1HD1 LEU 96 2.430 -7.106 8.122 777 HD12 LEU 96 2HD1 LEU 96 3.200 -6.786 9.676 778 HD13 LEU 96 3HD1 LEU 96 4.168 -7.343 8.311 779 HD21 LEU 96 3HD2 LEU 96 5.075 -3.791 8.375 780 HD22 LEU 96 1HD2 LEU 96 5.698 -5.438 8.267 781 HD23 LEU 96 2HD2 LEU 96 4.951 -4.875 9.763 782 H GLN 97 H GLN 97 0.824 -5.063 8.187 783 HA GLN 97 HA GLN 97 -0.327 -7.493 7.466 784 HB2 GLN 97 1HB GLN 97 -1.028 -5.382 9.468 785 HB3 GLN 97 2HB GLN 97 -2.133 -6.724 9.204 786 HG2 GLN 97 1HG GLN 97 0.761 -7.203 9.788 787 HG3 GLN 97 2HG GLN 97 -0.397 -6.905 11.084 788 HE21 GLN 97 2HE2 GLN 97 0.612 -9.090 8.581 789 HE22 GLN 97 1HE2 GLN 97 -0.318 -10.447 9.109 790 H LEU 98 H LEU 98 -1.630 -4.203 7.176 791 HA LEU 98 HA LEU 98 -4.135 -4.927 6.124 792 HB2 LEU 98 1HB LEU 98 -2.727 -2.545 6.706 793 HB3 LEU 98 2HB LEU 98 -3.279 -2.429 5.037 794 HG LEU 98 HG LEU 98 -4.982 -2.828 7.493 795 HD11 LEU 98 1HD1 LEU 98 -5.961 -0.675 6.760 796 HD12 LEU 98 2HD1 LEU 98 -4.716 -0.569 5.517 797 HD13 LEU 98 3HD1 LEU 98 -4.264 -0.550 7.221 798 HD21 LEU 98 3HD2 LEU 98 -6.582 -2.304 5.254 799 HD22 LEU 98 1HD2 LEU 98 -6.491 -3.799 6.187 800 HD23 LEU 98 2HD2 LEU 98 -5.470 -3.584 4.766 801 H ALA 99 H ALA 99 -1.155 -3.885 4.477 802 HA ALA 99 HA ALA 99 -2.020 -3.981 1.861 803 HB1 ALA 99 3HB ALA 99 0.397 -4.573 1.328 804 HB2 ALA 99 1HB ALA 99 0.119 -3.098 2.255 805 HB3 ALA 99 2HB ALA 99 0.666 -4.563 3.071 806 H ILE 100 H ILE 100 -0.420 -6.628 3.641 807 HA ILE 100 HA ILE 100 -0.696 -8.571 1.649 808 HB ILE 100 HB ILE 100 -0.629 -9.016 4.636 809 HG12 ILE 100 1HG1 ILE 100 1.679 -9.062 2.689 810 HG13 ILE 100 2HG1 ILE 100 1.261 -7.650 3.652 811 HG21 ILE 100 1HG2 ILE 100 0.213 -11.231 4.092 812 HG22 ILE 100 2HG2 ILE 100 -1.371 -10.973 3.362 813 HG23 ILE 100 3HG2 ILE 100 0.083 -10.873 2.370 814 HD11 ILE 100 3HD1 ILE 100 2.760 -9.997 4.378 815 HD12 ILE 100 1HD1 ILE 100 2.602 -8.453 5.216 816 HD13 ILE 100 2HD1 ILE 100 1.412 -9.728 5.484 817 H ASN 101 H ASN 101 -2.853 -7.645 4.288 818 HA ASN 101 HA ASN 101 -4.706 -9.703 4.131 819 HB2 ASN 101 1HB ASN 101 -4.691 -6.939 5.142 820 HB3 ASN 101 2HB ASN 101 -6.286 -7.552 4.720 821 HD21 ASN 101 2HD2 ASN 101 -4.878 -6.939 7.312 822 HD22 ASN 101 1HD2 ASN 101 -5.109 -8.359 8.267 823 H ALA 102 H ALA 102 -4.834 -6.546 2.479 824 HA ALA 102 HA ALA 102 -7.127 -7.118 0.947 825 HB1 ALA 102 3HB ALA 102 -5.571 -5.284 -0.504 826 HB2 ALA 102 1HB ALA 102 -6.907 -4.939 0.595 827 HB3 ALA 102 2HB ALA 102 -5.251 -4.968 1.202 828 H PHE 103 H PHE 103 -3.678 -7.521 0.285 829 HA PHE 103 HA PHE 103 -3.769 -8.154 -2.407 830 HB2 PHE 103 1HB PHE 103 -1.672 -7.843 -1.179 831 HB3 PHE 103 2HB PHE 103 -1.963 -9.331 -0.285 832 HD1 PHE 103 HD1 PHE 103 -2.351 -8.590 -3.910 833 HD2 PHE 103 HD2 PHE 103 -0.285 -10.791 -0.910 834 HE1 PHE 103 HE1 PHE 103 -1.176 -9.863 -5.657 835 HE2 PHE 103 HE2 PHE 103 0.893 -12.067 -2.652 836 HZ PHE 103 HZ PHE 103 0.449 -11.604 -5.030 837 H ASN 104 H ASN 104 -3.688 -10.520 0.265 838 HA ASN 104 HA ASN 104 -4.351 -12.723 -1.379 839 HB2 ASN 104 1HB ASN 104 -4.348 -14.005 0.573 840 HB3 ASN 104 2HB ASN 104 -3.257 -12.682 0.974 841 HD21 ASN 104 2HD2 ASN 104 -3.686 -11.465 2.697 842 HD22 ASN 104 1HD2 ASN 104 -5.129 -11.555 3.642 843 H ASN 105 H ASN 105 -6.266 -10.451 0.480 844 HA ASN 105 HA ASN 105 -8.698 -11.774 0.590 845 HB2 ASN 105 1HB ASN 105 -8.421 -9.707 1.773 846 HB3 ASN 105 2HB ASN 105 -8.087 -8.830 0.283 847 HD21 ASN 105 2HD2 ASN 105 -10.611 -11.104 1.312 848 HD22 ASN 105 1HD2 ASN 105 -11.940 -10.085 0.883 849 H LYS 106 H LYS 106 -7.524 -9.575 -1.956 850 HA LYS 106 HA LYS 106 -9.765 -10.231 -3.664 851 HB2 LYS 106 1HB LYS 106 -9.181 -8.020 -3.969 852 HB3 LYS 106 2HB LYS 106 -7.460 -8.339 -3.794 853 HG2 LYS 106 1HG LYS 106 -8.050 -7.688 -6.075 854 HG3 LYS 106 2HG LYS 106 -7.384 -9.322 -6.006 855 HD2 LYS 106 1HD LYS 106 -9.214 -10.127 -6.976 856 HD3 LYS 106 2HD LYS 106 -10.213 -9.471 -5.677 857 HE2 LYS 106 1HE LYS 106 -10.707 -7.551 -6.847 858 HE3 LYS 106 2HE LYS 106 -9.247 -7.648 -7.830 859 HZ1 LYS 106 3HZ LYS 106 -11.381 -9.665 -8.104 860 HZ2 LYS 106 1HZ LYS 106 -10.189 -9.220 -9.220 861 HZ3 LYS 106 2HZ LYS 106 -11.490 -8.183 -8.913 862 H SER 107 H SER 107 -9.809 -11.800 -5.132 863 HA SER 107 HA SER 107 -7.623 -13.593 -5.437 864 HB2 SER 107 1HB SER 107 -10.390 -13.381 -6.491 865 HB3 SER 107 2HB SER 107 -9.253 -14.330 -7.450 866 HG SER 107 HG SER 107 -9.827 -15.826 -6.064 867 H SER 108 H SER 108 -5.839 -12.685 -6.343 868 HA SER 108 HA SER 108 -5.849 -10.880 -8.506 869 HB2 SER 108 1HB SER 108 -3.631 -12.738 -7.613 870 HB3 SER 108 2HB SER 108 -3.440 -11.322 -8.647 871 HG SER 108 HG SER 108 -4.334 -11.338 -5.952 872 H VAL 109 H VAL 109 -5.466 -11.161 -10.694 873 HA VAL 109 HA VAL 109 -6.562 -13.478 -11.883 874 HB VAL 109 HB VAL 109 -5.719 -12.498 -14.033 875 HG11 VAL 109 1HG1 VAL 109 -7.363 -10.877 -12.116 876 HG12 VAL 109 2HG1 VAL 109 -7.110 -10.366 -13.786 877 HG13 VAL 109 3HG1 VAL 109 -7.906 -11.903 -13.443 878 HG21 VAL 109 3HG2 VAL 109 -5.060 -9.907 -13.022 879 HG22 VAL 109 1HG2 VAL 109 -3.997 -11.107 -12.287 880 HG23 VAL 109 2HG2 VAL 109 -4.100 -10.977 -14.044 Start of MODEL 20 1 H1 GLY 1 H GLY 1 14.796 -15.436 -6.040 2 HA2 GLY 1 1HA GLY 1 14.031 -15.744 -8.859 3 HA3 GLY 1 2HA GLY 1 13.615 -17.025 -7.729 4 HA PRO 2 HA PRO 2 10.316 -13.631 -7.900 5 HB2 PRO 2 1HB PRO 2 8.374 -15.092 -9.110 6 HB3 PRO 2 2HB PRO 2 9.546 -14.122 -10.007 7 HG2 PRO 2 1HG PRO 2 9.544 -17.065 -9.465 8 HG3 PRO 2 2HG PRO 2 9.925 -16.205 -10.968 9 HD2 PRO 2 1HD PRO 2 11.841 -17.163 -9.312 10 HD3 PRO 2 2HD PRO 2 12.064 -15.691 -10.280 11 H GLY 3 H GLY 3 8.064 -13.846 -6.960 12 HA2 GLY 3 1HA GLY 3 6.632 -15.527 -5.715 13 HA3 GLY 3 2HA GLY 3 8.111 -15.909 -4.847 14 H SER 4 H SER 4 9.082 -13.242 -4.599 15 HA SER 4 HA SER 4 7.923 -12.477 -2.192 16 HB2 SER 4 1HB SER 4 9.306 -10.549 -2.274 17 HB3 SER 4 2HB SER 4 10.196 -11.801 -3.140 18 HG SER 4 HG SER 4 9.063 -9.460 -4.074 19 H MET 5 H MET 5 6.675 -10.602 -1.630 20 HA MET 5 HA MET 5 4.739 -9.884 -3.726 21 HB2 MET 5 1HB MET 5 3.768 -11.073 -1.817 22 HB3 MET 5 2HB MET 5 4.422 -9.865 -0.719 23 HG2 MET 5 1HG MET 5 3.045 -8.181 -2.086 24 HG3 MET 5 2HG MET 5 2.193 -9.598 -2.695 25 HE1 MET 5 3HE MET 5 3.249 -9.219 1.448 26 HE2 MET 5 1HE MET 5 3.646 -7.961 0.276 27 HE3 MET 5 2HE MET 5 2.295 -7.736 1.388 28 H ASN 6 H ASN 6 5.317 -7.997 -4.609 29 HA ASN 6 HA ASN 6 6.619 -5.937 -3.060 30 HB2 ASN 6 1HB ASN 6 5.712 -6.038 -5.943 31 HB3 ASN 6 2HB ASN 6 6.553 -4.667 -5.225 32 HD21 ASN 6 2HD2 ASN 6 6.849 -7.757 -6.616 33 HD22 ASN 6 1HD2 ASN 6 8.563 -7.918 -6.467 34 H ILE 7 H ILE 7 5.540 -4.540 -1.850 35 HA ILE 7 HA ILE 7 2.705 -4.078 -2.328 36 HB ILE 7 HB ILE 7 4.455 -3.050 -0.091 37 HG12 ILE 7 1HG1 ILE 7 2.537 -5.392 -0.144 38 HG13 ILE 7 2HG1 ILE 7 4.293 -5.513 -0.121 39 HG21 ILE 7 1HG2 ILE 7 1.457 -3.100 -0.409 40 HG22 ILE 7 2HG2 ILE 7 2.319 -2.610 1.048 41 HG23 ILE 7 3HG2 ILE 7 2.491 -1.671 -0.435 42 HD11 ILE 7 3HD1 ILE 7 3.355 -5.907 2.079 43 HD12 ILE 7 1HD1 ILE 7 4.337 -4.442 2.070 44 HD13 ILE 7 2HD1 ILE 7 2.577 -4.325 2.046 45 H LEU 8 H LEU 8 1.790 -2.072 -2.726 46 HA LEU 8 HA LEU 8 3.673 0.004 -3.631 47 HB2 LEU 8 1HB LEU 8 2.064 -1.228 -5.269 48 HB3 LEU 8 2HB LEU 8 0.842 -0.162 -4.575 49 HG LEU 8 HG LEU 8 1.735 0.689 -6.697 50 HD11 LEU 8 1HD1 LEU 8 1.215 2.092 -4.439 51 HD12 LEU 8 2HD1 LEU 8 1.561 2.818 -6.008 52 HD13 LEU 8 3HD1 LEU 8 2.846 2.647 -4.813 53 HD21 LEU 8 3HD2 LEU 8 3.900 0.649 -7.181 54 HD22 LEU 8 1HD2 LEU 8 4.197 -0.141 -5.632 55 HD23 LEU 8 2HD2 LEU 8 4.279 1.617 -5.755 56 H LEU 9 H LEU 9 3.570 1.959 -2.716 57 HA LEU 9 HA LEU 9 1.219 2.591 -1.057 58 HB2 LEU 9 1HB LEU 9 3.324 2.001 0.205 59 HB3 LEU 9 2HB LEU 9 4.039 3.463 -0.472 60 HG LEU 9 HG LEU 9 2.411 4.833 0.697 61 HD11 LEU 9 1HD1 LEU 9 1.235 3.062 2.518 62 HD12 LEU 9 2HD1 LEU 9 1.010 2.338 0.926 63 HD13 LEU 9 3HD1 LEU 9 0.438 3.977 1.237 64 HD21 LEU 9 3HD2 LEU 9 4.474 4.260 1.857 65 HD22 LEU 9 1HD2 LEU 9 3.719 2.802 2.504 66 HD23 LEU 9 2HD2 LEU 9 3.130 4.390 2.994 67 H VAL 10 H VAL 10 0.467 4.690 -1.087 68 HA VAL 10 HA VAL 10 1.758 6.506 -3.018 69 HB VAL 10 HB VAL 10 -1.220 6.305 -2.577 70 HG11 VAL 10 1HG1 VAL 10 -0.219 7.432 -5.071 71 HG12 VAL 10 2HG1 VAL 10 -1.429 8.057 -3.949 72 HG13 VAL 10 3HG1 VAL 10 0.285 8.340 -3.646 73 HG21 VAL 10 3HG2 VAL 10 -0.357 4.231 -3.572 74 HG22 VAL 10 1HG2 VAL 10 -1.348 5.145 -4.709 75 HG23 VAL 10 2HG2 VAL 10 0.410 5.172 -4.850 76 H CYS 11 H CYS 11 2.794 7.740 -1.470 77 HA CYS 11 HA CYS 11 1.079 9.593 -0.031 78 HB2 CYS 11 1HB CYS 11 2.321 9.294 2.091 79 HB3 CYS 11 2HB CYS 11 1.419 7.855 1.630 80 HG CYS 11 HG CYS 11 4.603 7.898 0.578 81 H GLY 12 H GLY 12 1.873 11.608 -0.088 82 HA2 GLY 12 1HA GLY 12 4.593 11.947 -1.157 83 HA3 GLY 12 2HA GLY 12 3.303 13.136 -1.248 84 H ALA 13 H ALA 13 5.483 14.246 -0.472 85 HA ALA 13 HA ALA 13 6.578 15.382 1.172 86 HB1 ALA 13 3HB ALA 13 4.556 16.489 1.594 87 HB2 ALA 13 1HB ALA 13 3.838 15.072 2.360 88 HB3 ALA 13 2HB ALA 13 5.119 15.966 3.181 89 H GLY 14 H GLY 14 7.982 13.471 1.396 90 HA2 GLY 14 1HA GLY 14 8.448 12.819 4.077 91 HA3 GLY 14 2HA GLY 14 7.562 11.487 3.351 92 H MET 15 H MET 15 8.720 11.717 0.738 93 HA MET 15 HA MET 15 10.456 10.853 -0.450 94 HB2 MET 15 1HB MET 15 11.465 12.968 0.979 95 HB3 MET 15 2HB MET 15 12.565 11.668 1.418 96 HG2 MET 15 1HG MET 15 12.440 11.327 -1.256 97 HG3 MET 15 2HG MET 15 12.212 13.070 -1.137 98 HE1 MET 15 3HE MET 15 15.413 13.086 -2.439 99 HE2 MET 15 1HE MET 15 13.843 13.859 -2.216 100 HE3 MET 15 2HE MET 15 15.245 14.434 -1.312 101 H SER 16 H SER 16 12.734 9.604 -0.003 102 HA SER 16 HA SER 16 11.969 7.128 1.102 103 HB2 SER 16 1HB SER 16 14.336 8.251 -0.200 104 HB3 SER 16 2HB SER 16 14.731 7.039 1.018 105 HG SER 16 HG SER 16 13.852 6.634 -1.434 106 H THR 17 H THR 17 13.296 5.975 2.798 107 HA THR 17 HA THR 17 13.974 5.747 4.961 108 HB THR 17 HB THR 17 14.790 8.635 5.045 109 HG1 THR 17 HG1 THR 17 16.032 8.275 3.376 110 HG21 THR 17 3HG2 THR 17 15.793 6.069 6.258 111 HG22 THR 17 1HG2 THR 17 15.173 7.498 7.084 112 HG23 THR 17 2HG2 THR 17 16.738 7.557 6.273 113 H SER 18 H SER 18 11.290 6.832 4.218 114 HA SER 18 HA SER 18 10.502 8.697 6.216 115 HB2 SER 18 1HB SER 18 8.897 8.780 4.619 116 HB3 SER 18 2HB SER 18 9.187 7.117 4.107 117 HG SER 18 HG SER 18 7.151 7.938 5.445 118 H MET 19 H MET 19 8.968 8.263 7.955 119 HA MET 19 HA MET 19 9.870 6.272 9.706 120 HB2 MET 19 1HB MET 19 7.202 7.688 9.795 121 HB3 MET 19 2HB MET 19 8.026 6.916 11.144 122 HG2 MET 19 1HG MET 19 9.146 9.255 9.625 123 HG3 MET 19 2HG MET 19 8.174 9.406 11.086 124 HE1 MET 19 3HE MET 19 11.755 10.380 12.090 125 HE2 MET 19 1HE MET 19 11.941 9.882 10.408 126 HE3 MET 19 2HE MET 19 10.531 10.822 10.898 127 H LEU 20 H LEU 20 6.784 6.459 7.926 128 HA LEU 20 HA LEU 20 5.707 4.036 8.685 129 HB2 LEU 20 1HB LEU 20 5.431 5.798 6.321 130 HB3 LEU 20 2HB LEU 20 4.805 4.157 6.173 131 HG LEU 20 HG LEU 20 3.973 6.143 8.287 132 HD11 LEU 20 1HD1 LEU 20 1.798 5.587 6.694 133 HD12 LEU 20 2HD1 LEU 20 3.119 5.747 5.537 134 HD13 LEU 20 3HD1 LEU 20 2.765 7.063 6.658 135 HD21 LEU 20 3HD2 LEU 20 3.608 4.033 9.201 136 HD22 LEU 20 1HD2 LEU 20 3.175 3.327 7.644 137 HD23 LEU 20 2HD2 LEU 20 2.060 4.428 8.451 138 H VAL 21 H VAL 21 7.430 4.596 5.607 139 HA VAL 21 HA VAL 21 7.660 1.968 4.803 140 HB VAL 21 HB VAL 21 8.263 3.783 3.322 141 HG11 VAL 21 1HG1 VAL 21 9.300 5.185 5.139 142 HG12 VAL 21 2HG1 VAL 21 10.754 4.202 4.961 143 HG13 VAL 21 3HG1 VAL 21 10.170 5.168 3.606 144 HG21 VAL 21 3HG2 VAL 21 10.348 2.885 2.390 145 HG22 VAL 21 1HG2 VAL 21 10.620 1.983 3.881 146 HG23 VAL 21 2HG2 VAL 21 9.235 1.599 2.858 147 H GLN 22 H GLN 22 9.708 3.783 7.026 148 HA GLN 22 HA GLN 22 11.763 1.867 7.266 149 HB2 GLN 22 1HB GLN 22 10.857 4.222 8.847 150 HB3 GLN 22 2HB GLN 22 11.945 3.082 9.626 151 HG2 GLN 22 1HG GLN 22 12.969 3.635 7.043 152 HG3 GLN 22 2HG GLN 22 12.559 5.168 7.811 153 HE21 GLN 22 2HE2 GLN 22 14.310 6.022 8.659 154 HE22 GLN 22 1HE2 GLN 22 15.518 5.184 9.566 155 H ARG 23 H ARG 23 8.800 2.415 9.132 156 HA ARG 23 HA ARG 23 9.265 0.420 11.069 157 HB2 ARG 23 1HB ARG 23 6.633 1.520 10.065 158 HB3 ARG 23 2HB ARG 23 6.859 0.601 11.547 159 HG2 ARG 23 1HG ARG 23 8.619 2.900 11.408 160 HG3 ARG 23 2HG ARG 23 6.916 3.346 11.289 161 HD2 ARG 23 1HD ARG 23 7.499 3.365 13.598 162 HD3 ARG 23 2HD ARG 23 6.497 1.941 13.317 163 HE ARG 23 HE ARG 23 9.331 1.448 13.155 164 HH11 ARG 23 1HH1 ARG 23 6.546 1.599 15.237 165 HH12 ARG 23 2HH1 ARG 23 7.225 0.553 16.440 166 HH21 ARG 23 1HH2 ARG 23 10.237 0.070 14.730 167 HH22 ARG 23 2HH2 ARG 23 9.326 -0.316 16.150 168 H ILE 24 H ILE 24 7.687 0.358 7.916 169 HA ILE 24 HA ILE 24 6.668 -2.280 8.125 170 HB ILE 24 HB ILE 24 7.335 -0.678 5.652 171 HG12 ILE 24 1HG1 ILE 24 4.550 -1.133 6.597 172 HG13 ILE 24 2HG1 ILE 24 5.526 0.029 7.488 173 HG21 ILE 24 1HG2 ILE 24 5.415 -2.317 4.822 174 HG22 ILE 24 2HG2 ILE 24 7.122 -2.749 4.740 175 HG23 ILE 24 3HG2 ILE 24 6.123 -3.351 6.063 176 HD11 ILE 24 3HD1 ILE 24 4.144 0.360 5.027 177 HD12 ILE 24 1HD1 ILE 24 5.032 1.554 5.972 178 HD13 ILE 24 2HD1 ILE 24 5.870 0.595 4.752 179 H GLU 25 H GLU 25 9.505 -0.993 6.387 180 HA GLU 25 HA GLU 25 10.511 -3.457 5.530 181 HB2 GLU 25 1HB GLU 25 12.574 -2.306 5.084 182 HB3 GLU 25 2HB GLU 25 11.243 -1.228 4.690 183 HG2 GLU 25 1HG GLU 25 11.551 -0.071 6.821 184 HG3 GLU 25 2HG GLU 25 12.895 -1.146 7.204 185 H LYS 26 H LYS 26 10.932 -1.707 8.547 186 HA LYS 26 HA LYS 26 13.027 -3.301 9.589 187 HB2 LYS 26 1HB LYS 26 11.042 -1.388 10.750 188 HB3 LYS 26 2HB LYS 26 11.985 -2.401 11.834 189 HG2 LYS 26 1HG LYS 26 13.404 -0.857 9.723 190 HG3 LYS 26 2HG LYS 26 12.810 -0.011 11.154 191 HD2 LYS 26 1HD LYS 26 14.146 -1.302 12.600 192 HD3 LYS 26 2HD LYS 26 14.470 -2.510 11.354 193 HE2 LYS 26 1HE LYS 26 15.862 -0.988 10.145 194 HE3 LYS 26 2HE LYS 26 15.391 0.354 11.187 195 HZ1 LYS 26 3HZ LYS 26 17.540 -1.367 11.516 196 HZ2 LYS 26 1HZ LYS 26 16.446 -1.745 12.750 197 HZ3 LYS 26 2HZ LYS 26 17.014 -0.161 12.580 198 H TYR 27 H TYR 27 9.557 -3.273 10.429 199 HA TYR 27 HA TYR 27 9.524 -5.494 12.066 200 HB2 TYR 27 1HB TYR 27 7.582 -4.085 11.893 201 HB3 TYR 27 2HB TYR 27 7.397 -4.460 10.183 202 HD1 TYR 27 HD1 TYR 27 6.978 -5.736 13.604 203 HD2 TYR 27 HD2 TYR 27 6.370 -6.518 9.466 204 HE1 TYR 27 HE1 TYR 27 5.477 -7.596 14.183 205 HE2 TYR 27 HE2 TYR 27 4.866 -8.379 10.033 206 HH TYR 27 HH TYR 27 4.225 -9.260 13.415 207 H ALA 28 H ALA 28 9.094 -5.368 8.543 208 HA ALA 28 HA ALA 28 8.680 -8.137 8.184 209 HB1 ALA 28 3HB ALA 28 9.197 -5.814 6.460 210 HB2 ALA 28 1HB ALA 28 9.709 -7.369 5.802 211 HB3 ALA 28 2HB ALA 28 8.029 -7.124 6.284 212 H LYS 29 H LYS 29 11.598 -6.130 7.843 213 HA LYS 29 HA LYS 29 13.360 -8.150 7.071 214 HB2 LYS 29 1HB LYS 29 13.921 -5.770 6.945 215 HB3 LYS 29 2HB LYS 29 13.927 -5.667 8.700 216 HG2 LYS 29 1HG LYS 29 16.184 -5.779 7.986 217 HG3 LYS 29 2HG LYS 29 15.786 -7.339 8.708 218 HD2 LYS 29 1HD LYS 29 16.676 -8.196 6.832 219 HD3 LYS 29 2HD LYS 29 15.131 -7.762 6.097 220 HE2 LYS 29 1HE LYS 29 16.032 -6.087 4.896 221 HE3 LYS 29 2HE LYS 29 17.093 -5.582 6.212 222 HZ1 LYS 29 3HZ LYS 29 17.971 -8.070 5.285 223 HZ2 LYS 29 1HZ LYS 29 18.766 -6.580 5.194 224 HZ3 LYS 29 2HZ LYS 29 17.748 -7.071 3.937 225 H SER 30 H SER 30 12.074 -7.323 10.196 226 HA SER 30 HA SER 30 13.985 -8.947 11.638 227 HB2 SER 30 1HB SER 30 11.744 -7.137 12.349 228 HB3 SER 30 2HB SER 30 12.087 -8.443 13.483 229 HG SER 30 HG SER 30 13.897 -6.465 12.551 230 H LYS 31 H LYS 31 10.588 -9.135 10.678 231 HA LYS 31 HA LYS 31 10.106 -11.635 11.969 232 HB2 LYS 31 1HB LYS 31 8.621 -9.995 9.937 233 HB3 LYS 31 2HB LYS 31 8.081 -11.618 10.344 234 HG2 LYS 31 1HG LYS 31 8.430 -9.364 12.308 235 HG3 LYS 31 2HG LYS 31 6.895 -9.887 11.610 236 HD2 LYS 31 1HD LYS 31 7.390 -12.175 12.568 237 HD3 LYS 31 2HD LYS 31 8.713 -11.420 13.458 238 HE2 LYS 31 1HE LYS 31 7.307 -10.273 14.844 239 HE3 LYS 31 2HE LYS 31 6.028 -10.165 13.636 240 HZ1 LYS 31 3HZ LYS 31 5.149 -12.125 14.262 241 HZ2 LYS 31 1HZ LYS 31 5.930 -11.796 15.726 242 HZ3 LYS 31 2HZ LYS 31 6.646 -12.834 14.600 243 H ASN 32 H ASN 32 11.678 -10.739 9.092 244 HA ASN 32 HA ASN 32 12.648 -11.935 7.419 245 HB2 ASN 32 1HB ASN 32 11.952 -14.501 8.811 246 HB3 ASN 32 2HB ASN 32 13.387 -14.103 7.871 247 HD21 ASN 32 2HD2 ASN 32 12.297 -14.671 10.890 248 HD22 ASN 32 1HD2 ASN 32 13.485 -13.811 11.804 249 H ILE 33 H ILE 33 10.374 -11.111 6.588 250 HA ILE 33 HA ILE 33 8.894 -13.439 5.552 251 HB ILE 33 HB ILE 33 7.933 -10.593 5.866 252 HG12 ILE 33 1HG1 ILE 33 6.879 -13.023 7.298 253 HG13 ILE 33 2HG1 ILE 33 8.226 -12.093 7.946 254 HG21 ILE 33 1HG2 ILE 33 6.950 -11.680 3.921 255 HG22 ILE 33 2HG2 ILE 33 6.474 -13.055 4.916 256 HG23 ILE 33 3HG2 ILE 33 5.748 -11.472 5.193 257 HD11 ILE 33 3HD1 ILE 33 6.413 -11.183 9.031 258 HD12 ILE 33 1HD1 ILE 33 6.634 -10.073 7.680 259 HD13 ILE 33 2HD1 ILE 33 5.370 -11.303 7.615 260 H ASN 34 H ASN 34 8.459 -13.594 3.372 261 HA ASN 34 HA ASN 34 10.266 -12.167 1.637 262 HB2 ASN 34 1HB ASN 34 8.129 -14.151 0.845 263 HB3 ASN 34 2HB ASN 34 9.554 -13.686 -0.082 264 HD21 ASN 34 2HD2 ASN 34 11.663 -14.145 0.992 265 HD22 ASN 34 1HD2 ASN 34 11.802 -15.631 1.863 266 H ALA 35 H ALA 35 9.438 -10.029 1.823 267 HA ALA 35 HA ALA 35 7.309 -9.492 -0.076 268 HB1 ALA 35 3HB ALA 35 5.719 -9.139 1.432 269 HB2 ALA 35 1HB ALA 35 6.854 -9.393 2.758 270 HB3 ALA 35 2HB ALA 35 6.668 -7.788 2.051 271 H THR 36 H THR 36 7.088 -7.111 -0.476 272 HA THR 36 HA THR 36 9.529 -5.611 0.156 273 HB THR 36 HB THR 36 8.805 -4.936 -2.504 274 HG1 THR 36 HG1 THR 36 9.255 -7.048 -3.456 275 HG21 THR 36 3HG2 THR 36 11.134 -6.115 -2.862 276 HG22 THR 36 1HG2 THR 36 11.155 -6.118 -1.098 277 HG23 THR 36 2HG2 THR 36 11.016 -4.594 -1.977 278 H ILE 37 H ILE 37 9.327 -3.285 -0.320 279 HA ILE 37 HA ILE 37 6.566 -2.317 -0.463 280 HB ILE 37 HB ILE 37 7.158 -2.475 1.934 281 HG12 ILE 37 1HG1 ILE 37 6.570 -0.140 2.514 282 HG13 ILE 37 2HG1 ILE 37 6.911 0.342 0.856 283 HG21 ILE 37 1HG2 ILE 37 8.943 -1.354 2.905 284 HG22 ILE 37 2HG2 ILE 37 9.634 -1.974 1.407 285 HG23 ILE 37 3HG2 ILE 37 9.152 -0.282 1.521 286 HD11 ILE 37 3HD1 ILE 37 4.879 -1.765 1.472 287 HD12 ILE 37 1HD1 ILE 37 4.479 -0.049 1.538 288 HD13 ILE 37 2HD1 ILE 37 5.043 -0.767 0.028 289 H GLU 38 H GLU 38 6.320 -0.301 -1.380 290 HA GLU 38 HA GLU 38 8.603 1.370 -1.942 291 HB2 GLU 38 1HB GLU 38 8.786 -0.281 -3.742 292 HB3 GLU 38 2HB GLU 38 7.120 0.029 -4.210 293 HG2 GLU 38 1HG GLU 38 7.724 1.737 -5.479 294 HG3 GLU 38 2HG GLU 38 8.611 2.482 -4.151 295 H ALA 39 H ALA 39 8.029 3.464 -2.238 296 HA ALA 39 HA ALA 39 5.141 4.038 -2.389 297 HB1 ALA 39 3HB ALA 39 6.517 6.281 -1.355 298 HB2 ALA 39 1HB ALA 39 5.369 5.225 -0.531 299 HB3 ALA 39 2HB ALA 39 7.094 4.859 -0.487 300 H ILE 40 H ILE 40 4.416 5.414 -3.919 301 HA ILE 40 HA ILE 40 6.240 7.173 -5.328 302 HB ILE 40 HB ILE 40 5.439 6.296 -7.568 303 HG12 ILE 40 1HG1 ILE 40 5.110 3.582 -6.596 304 HG13 ILE 40 2HG1 ILE 40 3.871 4.648 -5.943 305 HG21 ILE 40 1HG2 ILE 40 7.069 4.189 -6.234 306 HG22 ILE 40 2HG2 ILE 40 7.310 4.988 -7.787 307 HG23 ILE 40 3HG2 ILE 40 7.685 5.840 -6.290 308 HD11 ILE 40 3HD1 ILE 40 3.162 5.270 -8.135 309 HD12 ILE 40 1HD1 ILE 40 4.518 4.415 -8.869 310 HD13 ILE 40 2HD1 ILE 40 3.241 3.511 -8.055 311 H ALA 41 H ALA 41 4.853 8.138 -7.312 312 HA ALA 41 HA ALA 41 2.514 9.300 -6.033 313 HB1 ALA 41 3HB ALA 41 4.330 10.062 -8.221 314 HB2 ALA 41 1HB ALA 41 2.647 10.551 -8.420 315 HB3 ALA 41 2HB ALA 41 3.550 11.055 -6.992 316 H GLU 42 H GLU 42 0.455 9.432 -7.057 317 HA GLU 42 HA GLU 42 -0.512 7.027 -8.075 318 HB2 GLU 42 1HB GLU 42 -2.562 8.300 -8.641 319 HB3 GLU 42 2HB GLU 42 -1.989 8.613 -7.009 320 HG2 GLU 42 1HG GLU 42 -1.029 10.447 -9.111 321 HG3 GLU 42 2HG GLU 42 -2.742 10.537 -8.702 322 H THR 43 H THR 43 1.004 9.680 -9.674 323 HA THR 43 HA THR 43 0.012 9.430 -12.265 324 HB THR 43 HB THR 43 2.104 10.461 -13.029 325 HG1 THR 43 HG1 THR 43 3.669 10.935 -11.278 326 HG21 THR 43 3HG2 THR 43 1.632 11.888 -10.477 327 HG22 THR 43 1HG2 THR 43 0.228 11.627 -11.511 328 HG23 THR 43 2HG2 THR 43 1.631 12.497 -12.132 329 H ARG 44 H ARG 44 2.714 7.747 -10.699 330 HA ARG 44 HA ARG 44 2.913 5.978 -13.037 331 HB2 ARG 44 1HB ARG 44 4.848 6.397 -10.752 332 HB3 ARG 44 2HB ARG 44 5.101 5.311 -12.112 333 HG2 ARG 44 1HG ARG 44 5.623 6.986 -13.535 334 HG3 ARG 44 2HG ARG 44 4.519 8.130 -12.768 335 HD2 ARG 44 1HD ARG 44 6.287 7.845 -10.783 336 HD3 ARG 44 2HD ARG 44 7.345 7.501 -12.151 337 HE ARG 44 HE ARG 44 5.768 9.889 -12.456 338 HH11 ARG 44 1HH1 ARG 44 8.732 8.537 -11.230 339 HH12 ARG 44 2HH1 ARG 44 9.590 10.041 -11.276 340 HH21 ARG 44 1HH2 ARG 44 6.887 11.876 -12.522 341 HH22 ARG 44 2HH2 ARG 44 8.539 11.940 -12.010 342 H LEU 45 H LEU 45 0.986 5.955 -10.643 343 HA LEU 45 HA LEU 45 1.585 3.590 -9.173 344 HB2 LEU 45 1HB LEU 45 0.157 5.091 -8.098 345 HB3 LEU 45 2HB LEU 45 -0.859 5.284 -9.524 346 HG LEU 45 HG LEU 45 -0.778 2.602 -8.253 347 HD11 LEU 45 1HD1 LEU 45 -1.089 3.636 -6.237 348 HD12 LEU 45 2HD1 LEU 45 -2.754 3.565 -6.813 349 HD13 LEU 45 3HD1 LEU 45 -1.835 5.063 -6.956 350 HD21 LEU 45 3HD2 LEU 45 -2.425 2.354 -9.720 351 HD22 LEU 45 1HD2 LEU 45 -2.384 4.071 -10.124 352 HD23 LEU 45 2HD2 LEU 45 -3.380 3.505 -8.783 353 H SER 46 H SER 46 -0.712 4.290 -11.802 354 HA SER 46 HA SER 46 -1.494 1.555 -12.086 355 HB2 SER 46 1HB SER 46 -2.664 2.353 -14.127 356 HB3 SER 46 2HB SER 46 -3.035 3.334 -12.710 357 HG SER 46 HG SER 46 -1.637 3.988 -15.013 358 H GLU 47 H GLU 47 1.189 3.349 -13.112 359 HA GLU 47 HA GLU 47 1.711 1.758 -15.480 360 HB2 GLU 47 1HB GLU 47 2.594 4.271 -14.462 361 HB3 GLU 47 2HB GLU 47 4.005 3.249 -14.690 362 HG2 GLU 47 1HG GLU 47 2.702 2.799 -17.007 363 HG3 GLU 47 2HG GLU 47 2.201 4.455 -16.670 364 H VAL 48 H VAL 48 2.472 1.717 -12.123 365 HA VAL 48 HA VAL 48 4.578 -0.291 -12.560 366 HB VAL 48 HB VAL 48 5.287 0.100 -10.277 367 HG11 VAL 48 1HG1 VAL 48 4.922 2.535 -11.993 368 HG12 VAL 48 2HG1 VAL 48 5.811 2.597 -10.470 369 HG13 VAL 48 3HG1 VAL 48 6.364 1.544 -11.773 370 HG21 VAL 48 3HG2 VAL 48 4.189 2.045 -9.033 371 HG22 VAL 48 1HG2 VAL 48 2.842 1.840 -10.154 372 HG23 VAL 48 2HG2 VAL 48 3.310 0.517 -9.085 373 H VAL 49 H VAL 49 1.396 0.209 -11.301 374 HA VAL 49 HA VAL 49 1.088 -1.856 -9.499 375 HB VAL 49 HB VAL 49 -0.650 -0.155 -10.082 376 HG11 VAL 49 1HG1 VAL 49 -1.444 -1.996 -12.318 377 HG12 VAL 49 2HG1 VAL 49 -2.030 -0.369 -11.966 378 HG13 VAL 49 3HG1 VAL 49 -0.395 -0.603 -12.583 379 HG21 VAL 49 3HG2 VAL 49 -1.390 -3.070 -9.987 380 HG22 VAL 49 1HG2 VAL 49 -1.310 -1.921 -8.651 381 HG23 VAL 49 2HG2 VAL 49 -2.580 -1.774 -9.865 382 H ASP 50 H ASP 50 1.341 -1.994 -12.973 383 HA ASP 50 HA ASP 50 0.269 -4.501 -13.498 384 HB2 ASP 50 1HB ASP 50 1.343 -2.654 -15.064 385 HB3 ASP 50 2HB ASP 50 2.769 -3.677 -14.910 386 H ARG 51 H ARG 51 3.231 -3.632 -11.925 387 HA ARG 51 HA ARG 51 4.143 -6.422 -11.982 388 HB2 ARG 51 1HB ARG 51 5.657 -3.983 -11.042 389 HB3 ARG 51 2HB ARG 51 6.309 -5.596 -11.297 390 HG2 ARG 51 1HG ARG 51 5.172 -4.927 -13.735 391 HG3 ARG 51 2HG ARG 51 5.930 -3.435 -13.175 392 HD2 ARG 51 1HD ARG 51 7.262 -6.130 -13.420 393 HD3 ARG 51 2HD ARG 51 7.485 -4.759 -14.505 394 HE ARG 51 HE ARG 51 8.093 -4.025 -11.840 395 HH11 ARG 51 1HH1 ARG 51 9.338 -5.838 -14.538 396 HH12 ARG 51 2HH1 ARG 51 10.997 -5.624 -14.085 397 HH21 ARG 51 1HH2 ARG 51 10.273 -3.738 -11.232 398 HH22 ARG 51 2HH2 ARG 51 11.527 -4.431 -12.203 399 H PHE 52 H PHE 52 3.526 -3.730 -9.758 400 HA PHE 52 HA PHE 52 4.098 -5.099 -7.376 401 HB2 PHE 52 1HB PHE 52 2.430 -2.692 -8.040 402 HB3 PHE 52 2HB PHE 52 2.442 -3.341 -6.403 403 HD1 PHE 52 HD2 PHE 52 4.490 -3.298 -5.065 404 HD2 PHE 52 HD1 PHE 52 4.319 -1.538 -8.935 405 HE1 PHE 52 HE2 PHE 52 6.559 -2.055 -4.586 406 HE2 PHE 52 HE1 PHE 52 6.389 -0.293 -8.465 407 HZ PHE 52 HZ PHE 52 7.510 -0.550 -6.288 408 H ASP 53 H ASP 53 2.441 -5.614 -5.676 409 HA ASP 53 HA ASP 53 0.376 -7.301 -6.875 410 HB2 ASP 53 1HB ASP 53 1.791 -7.269 -4.236 411 HB3 ASP 53 2HB ASP 53 0.222 -8.059 -4.364 412 H VAL 54 H VAL 54 0.457 -5.553 -3.779 413 HA VAL 54 HA VAL 54 -2.281 -4.626 -4.337 414 HB VAL 54 HB VAL 54 -2.523 -4.357 -1.896 415 HG11 VAL 54 1HG1 VAL 54 -2.540 -6.780 -1.337 416 HG12 VAL 54 2HG1 VAL 54 -3.307 -6.402 -2.880 417 HG13 VAL 54 3HG1 VAL 54 -1.683 -7.091 -2.848 418 HG21 VAL 54 3HG2 VAL 54 -0.848 -4.599 -0.416 419 HG22 VAL 54 1HG2 VAL 54 -0.165 -5.984 -1.266 420 HG23 VAL 54 2HG2 VAL 54 0.195 -4.347 -1.816 421 H VAL 55 H VAL 55 -2.871 -2.506 -3.410 422 HA VAL 55 HA VAL 55 -0.600 -0.641 -3.278 423 HB VAL 55 HB VAL 55 -3.176 -0.033 -4.726 424 HG11 VAL 55 1HG1 VAL 55 -2.341 2.020 -4.151 425 HG12 VAL 55 2HG1 VAL 55 -0.667 1.463 -4.153 426 HG13 VAL 55 3HG1 VAL 55 -1.501 1.760 -5.679 427 HG21 VAL 55 3HG2 VAL 55 -2.370 -1.345 -6.354 428 HG22 VAL 55 1HG2 VAL 55 -1.208 -0.046 -6.629 429 HG23 VAL 55 2HG2 VAL 55 -0.767 -1.425 -5.622 430 H LEU 56 H LEU 56 -0.933 1.239 -2.037 431 HA LEU 56 HA LEU 56 -3.393 1.329 -0.440 432 HB2 LEU 56 1HB LEU 56 -0.574 1.168 0.554 433 HB3 LEU 56 2HB LEU 56 -1.814 1.979 1.508 434 HG LEU 56 HG LEU 56 -2.782 -0.595 0.740 435 HD11 LEU 56 1HD1 LEU 56 -0.837 -1.720 0.597 436 HD12 LEU 56 2HD1 LEU 56 -0.912 -1.660 2.358 437 HD13 LEU 56 3HD1 LEU 56 0.066 -0.486 1.477 438 HD21 LEU 56 3HD2 LEU 56 -1.878 0.075 3.499 439 HD22 LEU 56 1HD2 LEU 56 -3.348 -0.734 2.957 440 HD23 LEU 56 2HD2 LEU 56 -3.185 1.012 2.775 441 H LEU 57 H LEU 57 -4.153 3.338 -0.045 442 HA LEU 57 HA LEU 57 -2.512 5.591 -0.996 443 HB2 LEU 57 1HB LEU 57 -4.425 5.364 -2.377 444 HB3 LEU 57 2HB LEU 57 -5.487 5.159 -0.986 445 HG LEU 57 HG LEU 57 -5.003 7.542 -0.378 446 HD11 LEU 57 1HD1 LEU 57 -3.615 8.844 -1.552 447 HD12 LEU 57 2HD1 LEU 57 -4.171 8.207 -3.099 448 HD13 LEU 57 3HD1 LEU 57 -2.955 7.328 -2.171 449 HD21 LEU 57 3HD2 LEU 57 -6.158 8.107 -2.886 450 HD22 LEU 57 1HD2 LEU 57 -6.976 7.833 -1.347 451 HD23 LEU 57 2HD2 LEU 57 -6.675 6.480 -2.438 452 H ALA 58 H ALA 58 -2.143 7.293 0.320 453 HA ALA 58 HA ALA 58 -2.554 7.010 3.107 454 HB1 ALA 58 3HB ALA 58 -1.913 9.648 2.781 455 HB2 ALA 58 1HB ALA 58 -0.754 8.324 2.913 456 HB3 ALA 58 2HB ALA 58 -1.242 8.916 1.324 457 HA PRO 59 HA PRO 59 -6.427 8.932 3.857 458 HB2 PRO 59 1HB PRO 59 -5.944 10.358 6.116 459 HB3 PRO 59 2HB PRO 59 -6.054 8.593 6.098 460 HG2 PRO 59 1HG PRO 59 -3.623 10.341 6.091 461 HG3 PRO 59 2HG PRO 59 -3.933 8.859 7.015 462 HD2 PRO 59 1HD PRO 59 -2.430 8.884 4.762 463 HD3 PRO 59 2HD PRO 59 -3.426 7.491 5.230 464 H GLN 60 H GLN 60 -3.609 11.006 3.681 465 HA GLN 60 HA GLN 60 -5.120 13.445 3.492 466 HB2 GLN 60 1HB GLN 60 -2.211 12.852 2.924 467 HB3 GLN 60 2HB GLN 60 -2.921 14.460 2.918 468 HG2 GLN 60 1HG GLN 60 -3.623 13.276 5.371 469 HG3 GLN 60 2HG GLN 60 -1.912 12.940 5.110 470 HE21 GLN 60 2HE2 GLN 60 -4.276 15.313 5.833 471 HE22 GLN 60 1HE2 GLN 60 -3.198 16.644 6.053 472 H SER 61 H SER 61 -6.436 13.595 1.769 473 HA SER 61 HA SER 61 -5.425 14.135 -0.779 474 HB2 SER 61 1HB SER 61 -6.801 11.920 -1.664 475 HB3 SER 61 2HB SER 61 -5.045 12.048 -1.551 476 HG SER 61 HG SER 61 -6.697 11.141 0.569 477 H ARG 62 H ARG 62 -6.872 15.451 -1.659 478 HA ARG 62 HA ARG 62 -9.608 15.426 -0.662 479 HB2 ARG 62 1HB ARG 62 -8.395 17.388 -2.605 480 HB3 ARG 62 2HB ARG 62 -9.826 17.604 -1.608 481 HG2 ARG 62 1HG ARG 62 -8.445 17.617 0.398 482 HG3 ARG 62 2HG ARG 62 -7.004 17.366 -0.588 483 HD2 ARG 62 1HD ARG 62 -7.320 19.492 -1.676 484 HD3 ARG 62 2HD ARG 62 -8.860 19.726 -0.851 485 HE ARG 62 HE ARG 62 -7.714 20.471 0.979 486 HH11 ARG 62 1HH1 ARG 62 -5.525 18.717 -1.082 487 HH12 ARG 62 2HH1 ARG 62 -4.119 19.124 -0.155 488 HH21 ARG 62 1HH2 ARG 62 -5.871 21.015 2.207 489 HH22 ARG 62 2HH2 ARG 62 -4.317 20.431 1.716 490 H PHE 63 H PHE 63 -8.182 15.879 -3.902 491 HA PHE 63 HA PHE 63 -10.557 14.646 -5.071 492 HB2 PHE 63 1HB PHE 63 -8.862 16.768 -5.849 493 HB3 PHE 63 2HB PHE 63 -8.626 15.483 -7.030 494 HD1 PHE 63 HD1 PHE 63 -10.575 14.610 -8.300 495 HD2 PHE 63 HD2 PHE 63 -10.846 18.043 -5.797 496 HE1 PHE 63 HE1 PHE 63 -12.660 15.266 -9.431 497 HE2 PHE 63 HE2 PHE 63 -12.931 18.704 -6.924 498 HZ PHE 63 HZ PHE 63 -13.841 17.314 -8.742 499 H ASN 64 H ASN 64 -7.168 14.068 -4.567 500 HA ASN 64 HA ASN 64 -6.590 12.163 -6.478 501 HB2 ASN 64 1HB ASN 64 -5.573 12.826 -3.790 502 HB3 ASN 64 2HB ASN 64 -5.246 11.178 -4.321 503 HD21 ASN 64 2HD2 ASN 64 -3.749 13.903 -4.035 504 HD22 ASN 64 1HD2 ASN 64 -2.788 13.948 -5.469 505 H LYS 65 H LYS 65 -7.927 11.602 -3.224 506 HA LYS 65 HA LYS 65 -8.224 8.839 -3.409 507 HB2 LYS 65 1HB LYS 65 -9.952 9.098 -1.640 508 HB3 LYS 65 2HB LYS 65 -8.462 9.964 -1.291 509 HG2 LYS 65 1HG LYS 65 -9.821 11.670 -0.810 510 HG3 LYS 65 2HG LYS 65 -9.903 11.884 -2.560 511 HD2 LYS 65 1HD LYS 65 -12.131 11.775 -2.161 512 HD3 LYS 65 2HD LYS 65 -11.824 10.039 -2.254 513 HE2 LYS 65 1HE LYS 65 -11.404 10.185 0.275 514 HE3 LYS 65 2HE LYS 65 -12.190 11.759 0.178 515 HZ1 LYS 65 3HZ LYS 65 -13.472 9.319 -0.891 516 HZ2 LYS 65 1HZ LYS 65 -14.192 10.796 -0.488 517 HZ3 LYS 65 2HZ LYS 65 -13.635 9.766 0.732 518 H LYS 66 H LYS 66 -10.418 11.433 -4.386 519 HA LYS 66 HA LYS 66 -12.645 9.880 -5.035 520 HB2 LYS 66 1HB LYS 66 -12.359 12.457 -4.947 521 HB3 LYS 66 2HB LYS 66 -11.867 12.306 -6.629 522 HG2 LYS 66 1HG LYS 66 -14.085 12.696 -6.914 523 HG3 LYS 66 2HG LYS 66 -14.114 10.935 -6.802 524 HD2 LYS 66 1HD LYS 66 -14.348 11.518 -4.208 525 HD3 LYS 66 2HD LYS 66 -15.067 12.983 -4.881 526 HE2 LYS 66 1HE LYS 66 -15.908 10.154 -5.510 527 HE3 LYS 66 2HE LYS 66 -16.754 11.262 -4.431 528 HZ1 LYS 66 3HZ LYS 66 -16.713 12.767 -6.561 529 HZ2 LYS 66 1HZ LYS 66 -17.911 11.591 -6.346 530 HZ3 LYS 66 2HZ LYS 66 -16.589 11.277 -7.354 531 H ARG 67 H ARG 67 -10.041 11.038 -7.179 532 HA ARG 67 HA ARG 67 -10.931 9.663 -9.470 533 HB2 ARG 67 1HB ARG 67 -9.026 11.531 -9.004 534 HB3 ARG 67 2HB ARG 67 -8.021 10.099 -9.189 535 HG2 ARG 67 1HG ARG 67 -8.088 10.683 -11.359 536 HG3 ARG 67 2HG ARG 67 -9.617 9.803 -11.323 537 HD2 ARG 67 1HD ARG 67 -10.881 11.746 -11.284 538 HD3 ARG 67 2HD ARG 67 -9.548 12.719 -10.664 539 HE ARG 67 HE ARG 67 -10.184 12.256 -13.389 540 HH11 ARG 67 1HH1 ARG 67 -7.501 12.673 -11.211 541 HH12 ARG 67 2HH1 ARG 67 -6.440 13.298 -12.429 542 HH21 ARG 67 1HH2 ARG 67 -8.796 13.077 -15.003 543 HH22 ARG 67 2HH2 ARG 67 -7.177 13.528 -14.585 544 H LEU 68 H LEU 68 -8.398 8.844 -7.105 545 HA LEU 68 HA LEU 68 -7.518 6.464 -8.184 546 HB2 LEU 68 1HB LEU 68 -6.970 7.846 -5.936 547 HB3 LEU 68 2HB LEU 68 -7.867 6.491 -5.253 548 HG LEU 68 HG LEU 68 -6.262 4.932 -6.258 549 HD11 LEU 68 1HD1 LEU 68 -4.126 5.910 -7.152 550 HD12 LEU 68 2HD1 LEU 68 -4.963 7.459 -7.246 551 HD13 LEU 68 3HD1 LEU 68 -5.537 6.088 -8.196 552 HD21 LEU 68 3HD2 LEU 68 -5.262 7.105 -4.450 553 HD22 LEU 68 1HD2 LEU 68 -4.234 5.748 -4.910 554 HD23 LEU 68 2HD2 LEU 68 -5.744 5.457 -4.046 555 H GLU 69 H GLU 69 -10.342 7.045 -6.141 556 HA GLU 69 HA GLU 69 -11.047 4.291 -5.900 557 HB2 GLU 69 1HB GLU 69 -12.638 6.820 -5.450 558 HB3 GLU 69 2HB GLU 69 -13.243 5.208 -5.096 559 HG2 GLU 69 1HG GLU 69 -10.656 5.673 -3.889 560 HG3 GLU 69 2HG GLU 69 -11.846 6.870 -3.384 561 H GLU 70 H GLU 70 -12.082 6.939 -8.007 562 HA GLU 70 HA GLU 70 -14.109 5.464 -9.340 563 HB2 GLU 70 1HB GLU 70 -12.614 7.993 -9.998 564 HB3 GLU 70 2HB GLU 70 -13.789 7.303 -11.109 565 HG2 GLU 70 1HG GLU 70 -14.550 7.822 -8.271 566 HG3 GLU 70 2HG GLU 70 -14.510 9.146 -9.434 567 H ILE 71 H ILE 71 -10.708 5.450 -9.551 568 HA ILE 71 HA ILE 71 -10.721 4.305 -12.245 569 HB ILE 71 HB ILE 71 -8.396 5.065 -10.473 570 HG12 ILE 71 1HG1 ILE 71 -9.132 6.412 -13.048 571 HG13 ILE 71 2HG1 ILE 71 -9.965 6.856 -11.562 572 HG21 ILE 71 1HG2 ILE 71 -8.535 3.915 -13.242 573 HG22 ILE 71 2HG2 ILE 71 -7.133 4.823 -12.676 574 HG23 ILE 71 3HG2 ILE 71 -7.613 3.338 -11.854 575 HD11 ILE 71 3HD1 ILE 71 -8.136 8.367 -11.986 576 HD12 ILE 71 1HD1 ILE 71 -7.803 7.409 -10.543 577 HD13 ILE 71 2HD1 ILE 71 -7.004 7.017 -12.065 578 H THR 72 H THR 72 -9.922 3.504 -8.907 579 HA THR 72 HA THR 72 -8.865 0.922 -9.471 580 HB THR 72 HB THR 72 -9.265 0.516 -7.004 581 HG1 THR 72 HG1 THR 72 -10.797 1.838 -6.295 582 HG21 THR 72 3HG2 THR 72 -7.803 2.933 -6.734 583 HG22 THR 72 1HG2 THR 72 -7.422 2.248 -8.313 584 HG23 THR 72 2HG2 THR 72 -7.182 1.287 -6.854 585 H LYS 73 H LYS 73 -12.062 2.136 -8.610 586 HA LYS 73 HA LYS 73 -13.385 -0.219 -8.042 587 HB2 LYS 73 1HB LYS 73 -14.727 1.612 -7.701 588 HB3 LYS 73 2HB LYS 73 -14.202 2.407 -9.180 589 HG2 LYS 73 1HG LYS 73 -16.548 1.742 -9.285 590 HG3 LYS 73 2HG LYS 73 -15.578 0.911 -10.504 591 HD2 LYS 73 1HD LYS 73 -15.978 -1.109 -9.611 592 HD3 LYS 73 2HD LYS 73 -15.775 -0.522 -7.959 593 HE2 LYS 73 1HE LYS 73 -18.218 0.187 -9.536 594 HE3 LYS 73 2HE LYS 73 -18.099 -1.378 -8.736 595 HZ1 LYS 73 3HZ LYS 73 -18.533 -0.448 -6.784 596 HZ2 LYS 73 1HZ LYS 73 -18.908 0.985 -7.601 597 HZ3 LYS 73 2HZ LYS 73 -17.349 0.743 -6.992 598 HA PRO 74 HA PRO 74 -14.371 -0.796 -12.737 599 HB2 PRO 74 1HB PRO 74 -13.011 0.762 -14.495 600 HB3 PRO 74 2HB PRO 74 -14.559 1.238 -13.788 601 HG2 PRO 74 1HG PRO 74 -11.787 2.049 -12.999 602 HG3 PRO 74 2HG PRO 74 -13.246 3.047 -13.143 603 HD2 PRO 74 1HD PRO 74 -12.323 2.151 -10.760 604 HD3 PRO 74 2HD PRO 74 -14.052 2.388 -11.087 605 H LYS 75 H LYS 75 -11.038 0.228 -12.076 606 HA LYS 75 HA LYS 75 -9.784 -1.556 -13.863 607 HB2 LYS 75 1HB LYS 75 -8.872 -0.029 -11.449 608 HB3 LYS 75 2HB LYS 75 -7.800 -1.197 -12.209 609 HG2 LYS 75 1HG LYS 75 -9.109 0.974 -13.805 610 HG3 LYS 75 2HG LYS 75 -7.616 1.261 -12.905 611 HD2 LYS 75 1HD LYS 75 -6.387 -0.179 -14.231 612 HD3 LYS 75 2HD LYS 75 -7.809 -1.092 -14.738 613 HE2 LYS 75 1HE LYS 75 -8.506 1.140 -15.875 614 HE3 LYS 75 2HE LYS 75 -6.796 1.545 -15.723 615 HZ1 LYS 75 3HZ LYS 75 -7.130 -1.072 -16.770 616 HZ2 LYS 75 1HZ LYS 75 -6.313 0.251 -17.437 617 HZ3 LYS 75 2HZ LYS 75 -7.970 0.053 -17.714 618 H GLY 76 H GLY 76 -11.166 -1.987 -10.727 619 HA2 GLY 76 1HA GLY 76 -11.387 -3.833 -9.380 620 HA3 GLY 76 2HA GLY 76 -11.118 -4.778 -10.836 621 H ILE 77 H ILE 77 -9.133 -2.684 -8.735 622 HA ILE 77 HA ILE 77 -7.176 -4.883 -8.589 623 HB ILE 77 HB ILE 77 -5.411 -3.110 -8.376 624 HG12 ILE 77 1HG1 ILE 77 -6.797 -1.059 -9.817 625 HG13 ILE 77 2HG1 ILE 77 -7.692 -1.418 -8.344 626 HG21 ILE 77 1HG2 ILE 77 -6.255 -4.375 -10.535 627 HG22 ILE 77 2HG2 ILE 77 -6.685 -2.740 -11.035 628 HG23 ILE 77 3HG2 ILE 77 -5.014 -3.125 -10.624 629 HD11 ILE 77 3HD1 ILE 77 -4.745 -0.852 -8.361 630 HD12 ILE 77 1HD1 ILE 77 -5.968 0.405 -8.186 631 HD13 ILE 77 2HD1 ILE 77 -5.845 -0.879 -6.983 632 HA PRO 78 HA PRO 78 -7.355 -4.575 -4.213 633 HB2 PRO 78 1HB PRO 78 -4.809 -5.228 -3.535 634 HB3 PRO 78 2HB PRO 78 -5.973 -6.410 -4.147 635 HG2 PRO 78 1HG PRO 78 -3.785 -4.976 -5.604 636 HG3 PRO 78 2HG PRO 78 -4.266 -6.680 -5.703 637 HD2 PRO 78 1HD PRO 78 -5.003 -4.850 -7.558 638 HD3 PRO 78 2HD PRO 78 -6.026 -6.233 -7.121 639 H ILE 79 H ILE 79 -7.695 -2.453 -3.661 640 HA ILE 79 HA ILE 79 -5.275 -0.854 -3.151 641 HB ILE 79 HB ILE 79 -6.438 0.092 -5.081 642 HG12 ILE 79 1HG1 ILE 79 -6.827 2.389 -4.151 643 HG13 ILE 79 2HG1 ILE 79 -6.687 1.706 -2.535 644 HG21 ILE 79 1HG2 ILE 79 -8.687 -0.780 -4.472 645 HG22 ILE 79 2HG2 ILE 79 -8.802 0.493 -3.257 646 HG23 ILE 79 3HG2 ILE 79 -8.687 0.913 -4.967 647 HD11 ILE 79 3HD1 ILE 79 -4.634 2.829 -3.487 648 HD12 ILE 79 1HD1 ILE 79 -4.414 1.205 -2.835 649 HD13 ILE 79 2HD1 ILE 79 -4.508 1.450 -4.579 650 H GLU 80 H GLU 80 -5.070 -0.156 -1.124 651 HA GLU 80 HA GLU 80 -7.434 -0.293 0.630 652 HB2 GLU 80 1HB GLU 80 -4.712 -1.278 0.933 653 HB3 GLU 80 2HB GLU 80 -5.200 -0.261 2.281 654 HG2 GLU 80 1HG GLU 80 -5.652 -2.633 2.682 655 HG3 GLU 80 2HG GLU 80 -7.119 -1.657 2.698 656 H ILE 81 H ILE 81 -7.445 1.243 2.448 657 HA ILE 81 HA ILE 81 -6.100 3.774 1.767 658 HB ILE 81 HB ILE 81 -8.855 3.568 2.977 659 HG12 ILE 81 1HG1 ILE 81 -8.836 2.670 0.674 660 HG13 ILE 81 2HG1 ILE 81 -9.739 4.177 0.787 661 HG21 ILE 81 1HG2 ILE 81 -8.015 5.640 3.571 662 HG22 ILE 81 2HG2 ILE 81 -7.104 5.815 2.072 663 HG23 ILE 81 3HG2 ILE 81 -8.857 5.995 2.063 664 HD11 ILE 81 3HD1 ILE 81 -7.969 5.397 -0.230 665 HD12 ILE 81 1HD1 ILE 81 -6.888 4.006 -0.145 666 HD13 ILE 81 2HD1 ILE 81 -8.285 3.973 -1.221 667 H ILE 82 H ILE 82 -4.725 4.352 3.301 668 HA ILE 82 HA ILE 82 -4.733 3.179 5.900 669 HB ILE 82 HB ILE 82 -3.153 5.540 4.873 670 HG12 ILE 82 1HG1 ILE 82 -2.306 2.652 5.164 671 HG13 ILE 82 2HG1 ILE 82 -2.830 3.373 3.646 672 HG21 ILE 82 1HG2 ILE 82 -2.726 3.814 7.309 673 HG22 ILE 82 2HG2 ILE 82 -1.645 5.087 6.744 674 HG23 ILE 82 3HG2 ILE 82 -3.266 5.494 7.308 675 HD11 ILE 82 3HD1 ILE 82 -0.859 4.350 3.303 676 HD12 ILE 82 1HD1 ILE 82 -0.715 4.869 4.982 677 HD13 ILE 82 2HD1 ILE 82 -0.258 3.228 4.524 678 H ASN 83 H ASN 83 -5.699 3.844 7.705 679 HA ASN 83 HA ASN 83 -7.487 6.056 7.676 680 HB2 ASN 83 1HB ASN 83 -6.707 3.944 9.599 681 HB3 ASN 83 2HB ASN 83 -7.334 5.432 10.305 682 HD21 ASN 83 2HD2 ASN 83 -9.160 4.325 11.049 683 HD22 ASN 83 1HD2 ASN 83 -10.444 3.879 9.983 684 H THR 84 H THR 84 -7.430 7.935 8.996 685 HA THR 84 HA THR 84 -5.104 9.415 8.908 686 HB THR 84 HB THR 84 -6.904 10.064 11.164 687 HG1 THR 84 HG1 THR 84 -8.648 10.509 9.851 688 HG21 THR 84 3HG2 THR 84 -6.197 11.713 8.749 689 HG22 THR 84 1HG2 THR 84 -5.103 11.538 10.120 690 HG23 THR 84 2HG2 THR 84 -6.693 12.268 10.347 691 H ILE 85 H ILE 85 -6.286 7.311 11.465 692 HA ILE 85 HA ILE 85 -4.382 8.094 13.425 693 HB ILE 85 HB ILE 85 -5.892 5.487 13.205 694 HG12 ILE 85 1HG1 ILE 85 -7.134 6.884 15.163 695 HG13 ILE 85 2HG1 ILE 85 -6.644 8.204 14.106 696 HG21 ILE 85 1HG2 ILE 85 -3.966 5.357 14.699 697 HG22 ILE 85 2HG2 ILE 85 -4.540 6.778 15.571 698 HG23 ILE 85 3HG2 ILE 85 -5.478 5.285 15.603 699 HD11 ILE 85 3HD1 ILE 85 -8.950 6.870 13.853 700 HD12 ILE 85 1HD1 ILE 85 -8.114 7.637 12.504 701 HD13 ILE 85 2HD1 ILE 85 -7.926 5.907 12.789 702 H ASP 86 H ASP 86 -4.591 5.160 11.402 703 HA ASP 86 HA ASP 86 -2.160 4.034 12.115 704 HB2 ASP 86 1HB ASP 86 -3.971 2.963 10.731 705 HB3 ASP 86 2HB ASP 86 -3.384 3.894 9.357 706 H TYR 87 H TYR 87 -2.853 6.654 9.922 707 HA TYR 87 HA TYR 87 -0.233 6.668 8.728 708 HB2 TYR 87 1HB TYR 87 -2.302 7.477 7.563 709 HB3 TYR 87 2HB TYR 87 -2.329 8.847 8.668 710 HD1 TYR 87 HD1 TYR 87 0.533 7.231 6.902 711 HD2 TYR 87 HD2 TYR 87 -1.852 10.722 7.383 712 HE1 TYR 87 HE1 TYR 87 2.044 8.463 5.403 713 HE2 TYR 87 HE2 TYR 87 -0.348 11.962 5.884 714 HH TYR 87 HH TYR 87 1.310 11.221 3.914 715 H GLY 88 H GLY 88 -1.930 8.512 11.224 716 HA2 GLY 88 1HA GLY 88 0.136 10.412 11.652 717 HA3 GLY 88 2HA GLY 88 -1.180 10.051 12.759 718 H THR 89 H THR 89 -0.694 7.376 13.293 719 HA THR 89 HA THR 89 1.533 7.620 15.114 720 HB THR 89 HB THR 89 -0.518 6.545 15.889 721 HG1 THR 89 HG1 THR 89 0.500 4.792 16.852 722 HG21 THR 89 3HG2 THR 89 -1.655 5.114 14.617 723 HG22 THR 89 1HG2 THR 89 -0.293 3.996 14.625 724 HG23 THR 89 2HG2 THR 89 -0.406 5.238 13.379 725 H MET 90 H MET 90 0.912 6.178 12.034 726 HA MET 90 HA MET 90 2.236 5.055 10.566 727 HB2 MET 90 1HB MET 90 4.568 5.672 12.372 728 HB3 MET 90 2HB MET 90 4.587 5.399 10.634 729 HG2 MET 90 1HG MET 90 4.498 7.586 10.351 730 HG3 MET 90 2HG MET 90 2.868 7.560 11.020 731 HE1 MET 90 3HE MET 90 6.827 8.522 12.414 732 HE2 MET 90 1HE MET 90 6.386 7.514 13.792 733 HE3 MET 90 2HE MET 90 6.303 6.857 12.158 734 H ASN 91 H ASN 91 1.056 3.166 11.442 735 HA ASN 91 HA ASN 91 2.661 1.422 13.155 736 HB2 ASN 91 1HB ASN 91 0.026 1.903 13.251 737 HB3 ASN 91 2HB ASN 91 0.010 0.546 12.129 738 HD21 ASN 91 2HD2 ASN 91 1.922 -1.086 13.017 739 HD22 ASN 91 1HD2 ASN 91 1.584 -1.626 14.622 740 H GLY 92 H GLY 92 4.279 0.735 11.761 741 HA2 GLY 92 1HA GLY 92 4.043 -0.088 9.134 742 HA3 GLY 92 2HA GLY 92 5.238 -0.715 10.259 743 H GLU 93 H GLU 93 3.680 -2.080 12.056 744 HA GLU 93 HA GLU 93 3.322 -4.545 10.849 745 HB2 GLU 93 1HB GLU 93 3.403 -3.810 13.379 746 HB3 GLU 93 2HB GLU 93 1.653 -3.825 13.222 747 HG2 GLU 93 1HG GLU 93 1.565 -6.102 12.887 748 HG3 GLU 93 2HG GLU 93 3.235 -6.190 12.332 749 H LYS 94 H LYS 94 0.836 -2.146 11.704 750 HA LYS 94 HA LYS 94 -1.363 -3.588 10.717 751 HB2 LYS 94 1HB LYS 94 -1.057 -0.585 10.871 752 HB3 LYS 94 2HB LYS 94 -2.570 -1.477 10.790 753 HG2 LYS 94 1HG LYS 94 -0.626 -1.899 13.031 754 HG3 LYS 94 2HG LYS 94 -1.813 -0.593 13.064 755 HD2 LYS 94 1HD LYS 94 -3.397 -2.672 12.384 756 HD3 LYS 94 2HD LYS 94 -2.182 -3.504 13.359 757 HE2 LYS 94 1HE LYS 94 -2.828 -2.480 15.276 758 HE3 LYS 94 2HE LYS 94 -3.250 -0.976 14.458 759 HZ1 LYS 94 3HZ LYS 94 -5.326 -1.675 14.907 760 HZ2 LYS 94 1HZ LYS 94 -4.891 -3.306 15.016 761 HZ3 LYS 94 2HZ LYS 94 -5.126 -2.594 13.501 762 H VAL 95 H VAL 95 0.832 -1.303 9.166 763 HA VAL 95 HA VAL 95 -0.549 -0.996 6.744 764 HB VAL 95 HB VAL 95 2.446 -0.936 7.138 765 HG11 VAL 95 1HG1 VAL 95 1.997 0.882 5.247 766 HG12 VAL 95 2HG1 VAL 95 2.268 -0.822 4.873 767 HG13 VAL 95 3HG1 VAL 95 0.625 -0.180 4.922 768 HG21 VAL 95 3HG2 VAL 95 1.297 1.661 7.028 769 HG22 VAL 95 1HG2 VAL 95 0.436 0.729 8.253 770 HG23 VAL 95 2HG2 VAL 95 2.187 0.907 8.351 771 H LEU 96 H LEU 96 2.409 -2.933 7.211 772 HA LEU 96 HA LEU 96 2.293 -4.353 4.849 773 HB2 LEU 96 1HB LEU 96 3.614 -6.109 6.076 774 HB3 LEU 96 2HB LEU 96 4.268 -4.472 6.122 775 HG LEU 96 HG LEU 96 2.760 -4.599 8.423 776 HD11 LEU 96 1HD1 LEU 96 3.253 -6.640 9.536 777 HD12 LEU 96 2HD1 LEU 96 4.252 -7.204 8.197 778 HD13 LEU 96 3HD1 LEU 96 2.507 -7.056 7.992 779 HD21 LEU 96 3HD2 LEU 96 5.693 -5.214 8.076 780 HD22 LEU 96 1HD2 LEU 96 4.913 -4.664 9.560 781 HD23 LEU 96 2HD2 LEU 96 4.979 -3.602 8.154 782 H GLN 97 H GLN 97 0.777 -5.108 7.953 783 HA GLN 97 HA GLN 97 -0.187 -7.653 7.346 784 HB2 GLN 97 1HB GLN 97 -1.046 -5.500 9.236 785 HB3 GLN 97 2HB GLN 97 -2.072 -6.912 9.019 786 HG2 GLN 97 1HG GLN 97 0.838 -7.173 9.683 787 HG3 GLN 97 2HG GLN 97 -0.384 -6.933 10.931 788 HE21 GLN 97 2HE2 GLN 97 0.848 -9.089 8.497 789 HE22 GLN 97 1HE2 GLN 97 0.019 -10.503 9.042 790 H LEU 98 H LEU 98 -1.814 -4.505 7.004 791 HA LEU 98 HA LEU 98 -4.204 -5.453 5.915 792 HB2 LEU 98 1HB LEU 98 -3.035 -2.960 6.461 793 HB3 LEU 98 2HB LEU 98 -3.477 -2.927 4.756 794 HG LEU 98 HG LEU 98 -5.330 -3.439 7.082 795 HD11 LEU 98 1HD1 LEU 98 -4.991 -1.158 7.080 796 HD12 LEU 98 2HD1 LEU 98 -6.378 -1.319 6.004 797 HD13 LEU 98 3HD1 LEU 98 -4.765 -1.084 5.333 798 HD21 LEU 98 3HD2 LEU 98 -5.559 -4.064 4.261 799 HD22 LEU 98 1HD2 LEU 98 -6.830 -2.968 4.803 800 HD23 LEU 98 2HD2 LEU 98 -6.602 -4.520 5.609 801 H ALA 99 H ALA 99 -1.252 -4.331 4.284 802 HA ALA 99 HA ALA 99 -2.084 -4.555 1.652 803 HB1 ALA 99 3HB ALA 99 0.483 -4.479 3.051 804 HB2 ALA 99 1HB ALA 99 0.534 -5.318 1.500 805 HB3 ALA 99 2HB ALA 99 -0.037 -3.651 1.583 806 H ILE 100 H ILE 100 -0.377 -7.027 3.580 807 HA ILE 100 HA ILE 100 -0.420 -9.063 1.685 808 HB ILE 100 HB ILE 100 -0.566 -9.351 4.689 809 HG12 ILE 100 1HG1 ILE 100 1.896 -9.542 2.964 810 HG13 ILE 100 2HG1 ILE 100 1.357 -8.006 3.634 811 HG21 ILE 100 1HG2 ILE 100 -1.166 -11.423 3.626 812 HG22 ILE 100 2HG2 ILE 100 0.218 -11.313 2.540 813 HG23 ILE 100 3HG2 ILE 100 0.471 -11.565 4.267 814 HD11 ILE 100 3HD1 ILE 100 3.012 -8.863 5.085 815 HD12 ILE 100 1HD1 ILE 100 1.461 -9.076 5.898 816 HD13 ILE 100 2HD1 ILE 100 2.248 -10.453 5.127 817 H ASN 101 H ASN 101 -2.790 -8.289 4.212 818 HA ASN 101 HA ASN 101 -4.523 -10.423 3.866 819 HB2 ASN 101 1HB ASN 101 -4.681 -8.731 5.683 820 HB3 ASN 101 2HB ASN 101 -5.302 -7.570 4.512 821 HD21 ASN 101 2HD2 ASN 101 -7.325 -7.282 5.216 822 HD22 ASN 101 1HD2 ASN 101 -8.504 -8.535 5.370 823 H ALA 102 H ALA 102 -4.582 -7.256 2.244 824 HA ALA 102 HA ALA 102 -6.818 -7.775 0.618 825 HB1 ALA 102 3HB ALA 102 -5.351 -5.579 1.129 826 HB2 ALA 102 1HB ALA 102 -4.743 -5.988 -0.476 827 HB3 ALA 102 2HB ALA 102 -6.468 -5.713 -0.229 828 H PHE 103 H PHE 103 -3.363 -8.311 0.123 829 HA PHE 103 HA PHE 103 -3.408 -8.981 -2.583 830 HB2 PHE 103 1HB PHE 103 -1.322 -8.605 -1.388 831 HB3 PHE 103 2HB PHE 103 -1.612 -10.023 -0.385 832 HD1 PHE 103 HD2 PHE 103 -1.739 -9.361 -4.058 833 HD2 PHE 103 HD1 PHE 103 -0.158 -11.717 -0.886 834 HE1 PHE 103 HE2 PHE 103 -0.544 -10.755 -5.695 835 HE2 PHE 103 HE1 PHE 103 1.040 -13.115 -2.518 836 HZ PHE 103 HZ PHE 103 0.848 -12.636 -4.925 837 H ASN 104 H ASN 104 -3.549 -11.159 0.235 838 HA ASN 104 HA ASN 104 -4.013 -13.496 -1.295 839 HB2 ASN 104 1HB ASN 104 -4.164 -12.775 1.597 840 HB3 ASN 104 2HB ASN 104 -4.955 -14.260 1.073 841 HD21 ASN 104 2HD2 ASN 104 -1.916 -12.602 0.277 842 HD22 ASN 104 1HD2 ASN 104 -0.904 -13.981 0.523 843 H ASN 105 H ASN 105 -6.168 -11.266 0.415 844 HA ASN 105 HA ASN 105 -8.560 -12.659 0.092 845 HB2 ASN 105 1HB ASN 105 -7.879 -9.758 0.431 846 HB3 ASN 105 2HB ASN 105 -9.544 -10.231 0.103 847 HD21 ASN 105 2HD2 ASN 105 -9.722 -9.151 2.264 848 HD22 ASN 105 1HD2 ASN 105 -9.562 -10.158 3.659 849 H LYS 106 H LYS 106 -7.010 -10.280 -2.034 850 HA LYS 106 HA LYS 106 -7.575 -9.558 -4.145 851 HB2 LYS 106 1HB LYS 106 -7.500 -11.360 -5.782 852 HB3 LYS 106 2HB LYS 106 -6.300 -11.630 -4.525 853 HG2 LYS 106 1HG LYS 106 -7.506 -13.386 -3.581 854 HG3 LYS 106 2HG LYS 106 -9.002 -12.915 -4.393 855 HD2 LYS 106 1HD LYS 106 -7.379 -13.359 -6.520 856 HD3 LYS 106 2HD LYS 106 -6.745 -14.534 -5.365 857 HE2 LYS 106 1HE LYS 106 -8.953 -15.488 -5.080 858 HE3 LYS 106 2HE LYS 106 -9.648 -14.262 -6.139 859 HZ1 LYS 106 3HZ LYS 106 -7.792 -15.281 -7.737 860 HZ2 LYS 106 1HZ LYS 106 -9.375 -15.875 -7.665 861 HZ3 LYS 106 2HZ LYS 106 -8.141 -16.653 -6.811 862 H SER 107 H SER 107 -9.810 -9.402 -2.494 863 HA SER 107 HA SER 107 -11.906 -9.477 -4.453 864 HB2 SER 107 1HB SER 107 -11.714 -11.583 -2.403 865 HB3 SER 107 2HB SER 107 -13.288 -10.793 -2.495 866 HG SER 107 HG SER 107 -13.083 -12.607 -3.915 867 H SER 108 H SER 108 -11.403 -9.356 -0.925 868 HA SER 108 HA SER 108 -12.027 -7.839 0.651 869 HB2 SER 108 1HB SER 108 -12.338 -5.893 -1.644 870 HB3 SER 108 2HB SER 108 -12.058 -5.504 0.053 871 HG SER 108 HG SER 108 -10.231 -5.734 -1.718 872 H VAL 109 H VAL 109 -13.927 -8.632 1.398 873 HA VAL 109 HA VAL 109 -16.357 -7.342 0.420 874 HB VAL 109 HB VAL 109 -16.338 -9.439 -0.804 875 HG11 VAL 109 1HG1 VAL 109 -16.056 -10.733 1.906 876 HG12 VAL 109 2HG1 VAL 109 -16.408 -11.596 0.407 877 HG13 VAL 109 3HG1 VAL 109 -14.874 -10.747 0.597 878 HG21 VAL 109 3HG2 VAL 109 -18.411 -8.480 0.645 879 HG22 VAL 109 1HG2 VAL 109 -18.530 -9.842 -0.469 880 HG23 VAL 109 2HG2 VAL 109 -18.322 -10.132 1.258
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