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NMR Restraints Grid |
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Result table
(Save to zip file containing files for each block)
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
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649086 |
6vfo ![]() ![]() |
30705 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 SER 303 H SER 303 20.032 5.591 15.559 2 HA SER 303 HA SER 303 21.658 6.570 17.703 3 HB2 SER 303 2HB SER 303 23.158 7.320 15.761 4 HB3 SER 303 1HB SER 303 22.744 5.606 15.774 5 HG SER 303 HG SER 303 22.395 7.257 13.804 6 H GLY 304 H GLY 304 20.095 8.223 14.930 7 HA2 GLY 304 2HA GLY 304 20.538 10.880 16.061 8 HA3 GLY 304 1HA GLY 304 19.784 10.493 14.522 9 HA PRO 305 HA PRO 305 16.417 11.714 17.616 10 HB2 PRO 305 2HB PRO 305 15.363 13.802 16.176 11 HB3 PRO 305 1HB PRO 305 16.686 14.010 17.333 12 HG2 PRO 305 2HG PRO 305 16.816 13.714 14.331 13 HG3 PRO 305 1HG PRO 305 17.660 14.881 15.373 14 HD2 PRO 305 2HD PRO 305 18.896 12.649 14.452 15 HD3 PRO 305 1HD PRO 305 19.254 13.307 16.066 16 H SER 306 H SER 306 15.729 9.606 16.913 17 HA SER 306 HA SER 306 14.325 9.185 14.441 18 HB2 SER 306 2HB SER 306 14.469 7.427 16.926 19 HB3 SER 306 1HB SER 306 13.930 6.922 15.320 20 HG SER 306 HG SER 306 16.219 7.894 14.807 21 H CYS 307 H CYS 307 12.684 10.637 14.367 22 HA CYS 307 HA CYS 307 10.814 11.136 16.472 23 HB2 CYS 307 2HB CYS 307 11.302 12.881 14.847 24 HB3 CYS 307 1HB CYS 307 10.784 11.849 13.517 25 H ARG 308 H ARG 308 9.443 9.631 17.124 26 HA ARG 308 HA ARG 308 8.699 7.286 15.753 27 HB2 ARG 308 2HB ARG 308 7.273 8.553 18.125 28 HB3 ARG 308 1HB ARG 308 7.247 6.848 17.672 29 HG2 ARG 308 2HG ARG 308 9.649 8.411 18.699 30 HG3 ARG 308 1HG ARG 308 8.699 7.226 19.605 31 HD2 ARG 308 2HD ARG 308 9.456 5.436 18.192 32 HD3 ARG 308 1HD ARG 308 10.226 6.567 17.068 33 HE ARG 308 HE ARG 308 11.181 6.611 19.828 34 HH11 ARG 308 1HH1 ARG 308 11.738 5.388 16.581 35 HH12 ARG 308 2HH1 ARG 308 13.422 5.098 16.854 36 HH21 ARG 308 1HH2 ARG 308 13.397 6.261 20.159 37 HH22 ARG 308 2HH2 ARG 308 14.364 5.594 18.891 38 H PHE 309 H PHE 309 7.196 10.429 15.987 39 HA PHE 309 HA PHE 309 4.598 9.870 15.030 40 HB2 PHE 309 2HB PHE 309 6.163 12.462 14.642 41 HB3 PHE 309 1HB PHE 309 4.411 12.277 14.593 42 HD1 PHE 309 HD1 PHE 309 3.131 11.898 16.702 43 HD2 PHE 309 HD2 PHE 309 7.354 12.584 16.759 44 HE1 PHE 309 HE1 PHE 309 3.030 12.369 19.115 45 HE2 PHE 309 HE2 PHE 309 7.236 13.053 19.171 46 HZ PHE 309 HZ PHE 309 5.078 12.944 20.347 47 H CYS 310 H CYS 310 7.615 10.737 13.355 48 HA CYS 310 HA CYS 310 6.553 10.738 10.683 49 HB2 CYS 310 2HB CYS 310 9.386 10.614 11.772 50 HB3 CYS 310 1HB CYS 310 9.063 10.497 10.049 51 H LYS 311 H LYS 311 7.405 8.261 12.906 52 HA LYS 311 HA LYS 311 7.994 6.091 12.860 53 HB2 LYS 311 2HB LYS 311 6.609 6.065 10.150 54 HB3 LYS 311 1HB LYS 311 7.040 4.633 11.085 55 HG2 LYS 311 2HG LYS 311 5.521 5.396 12.900 56 HG3 LYS 311 1HG LYS 311 5.048 6.781 11.909 57 HD2 LYS 311 2HD LYS 311 4.103 5.258 10.218 58 HD3 LYS 311 1HD LYS 311 4.636 3.856 11.155 59 HE2 LYS 311 2HE LYS 311 2.592 5.928 12.030 60 HE3 LYS 311 1HE LYS 311 2.250 4.270 11.532 61 HZ1 LYS 311 1HZ LYS 311 2.240 4.382 13.898 62 HZ2 LYS 311 2HZ LYS 311 3.749 5.138 13.947 63 HZ3 LYS 311 3HZ LYS 311 3.625 3.529 13.444 64 H ASP 312 H ASP 312 9.870 7.916 12.197 65 HA ASP 312 HA ASP 312 11.958 8.246 11.487 66 HB2 ASP 312 2HB ASP 312 12.377 5.840 11.820 67 HB3 ASP 312 1HB ASP 312 11.780 5.498 10.203 68 H ASP 313 H ASP 313 9.528 7.426 9.125 69 HA ASP 313 HA ASP 313 11.034 8.355 6.825 70 HB2 ASP 313 2HB ASP 313 9.457 6.428 6.650 71 HB3 ASP 313 1HB ASP 313 8.122 7.492 7.070 72 H GLU 314 H GLU 314 11.017 10.374 6.076 73 HA GLU 314 HA GLU 314 9.760 12.530 7.468 74 HB2 GLU 314 2HB GLU 314 10.867 13.975 5.769 75 HB3 GLU 314 1HB GLU 314 11.983 12.820 6.487 76 HG2 GLU 314 2HG GLU 314 11.916 11.425 4.501 77 HG3 GLU 314 1HG GLU 314 10.642 12.415 3.793 78 H ASN 315 H ASN 315 8.765 10.577 4.771 79 HA ASN 315 HA ASN 315 7.321 12.681 3.355 80 HB2 ASN 315 2HB ASN 315 7.527 9.688 2.803 81 HB3 ASN 315 1HB ASN 315 6.698 10.832 1.753 82 HD21 ASN 315 1HD2 ASN 315 7.921 12.273 0.502 83 HD22 ASN 315 2HD2 ASN 315 9.617 12.058 0.258 84 H LYS 316 H LYS 316 6.588 10.656 5.948 85 HA LYS 316 HA LYS 316 3.736 10.418 5.420 86 HB2 LYS 316 2HB LYS 316 5.384 9.754 7.906 87 HB3 LYS 316 1HB LYS 316 3.681 9.348 7.679 88 HG2 LYS 316 2HG LYS 316 4.306 7.946 5.714 89 HG3 LYS 316 1HG LYS 316 6.002 8.324 6.010 90 HD2 LYS 316 2HD LYS 316 5.827 7.210 8.236 91 HD3 LYS 316 1HD LYS 316 4.148 6.787 7.871 92 HE2 LYS 316 2HE LYS 316 6.621 5.842 6.364 93 HE3 LYS 316 1HE LYS 316 5.595 4.869 7.419 94 HZ1 LYS 316 1HZ LYS 316 5.072 4.475 5.095 95 HZ2 LYS 316 2HZ LYS 316 4.753 6.116 4.851 96 HZ3 LYS 316 3HZ LYS 316 3.757 5.206 5.868 97 HA PRO 317 HA PRO 317 2.614 14.391 7.088 98 HB2 PRO 317 2HB PRO 317 -0.054 13.373 7.877 99 HB3 PRO 317 1HB PRO 317 0.369 14.492 6.582 100 HG2 PRO 317 2HG PRO 317 -0.493 11.973 6.083 101 HG3 PRO 317 1HG PRO 317 0.674 12.795 5.028 102 HD2 PRO 317 2HD PRO 317 1.192 10.749 7.191 103 HD3 PRO 317 1HD PRO 317 1.866 10.844 5.548 104 H CYS 318 H CYS 318 4.123 14.158 8.860 105 HA CYS 318 HA CYS 318 3.008 13.540 11.516 106 HB2 CYS 318 2HB CYS 318 5.110 12.477 11.263 107 HB3 CYS 318 1HB CYS 318 5.820 13.851 10.430 108 H ARG 319 H ARG 319 2.154 15.151 12.585 109 HA ARG 319 HA ARG 319 2.003 17.803 11.793 110 HB2 ARG 319 2HB ARG 319 0.348 16.802 13.297 111 HB3 ARG 319 1HB ARG 319 1.559 16.596 14.559 112 HG2 ARG 319 2HG ARG 319 1.737 19.036 14.836 113 HG3 ARG 319 1HG ARG 319 0.603 19.287 13.506 114 HD2 ARG 319 2HD ARG 319 -0.058 17.891 16.126 115 HD3 ARG 319 1HD ARG 319 -0.458 19.568 15.736 116 HE ARG 319 HE ARG 319 -1.529 17.207 14.288 117 HH11 ARG 319 1HH1 ARG 319 -1.972 20.488 15.496 118 HH12 ARG 319 2HH1 ARG 319 -3.607 20.602 14.924 119 HH21 ARG 319 1HH2 ARG 319 -3.664 17.372 13.542 120 HH22 ARG 319 2HH2 ARG 319 -4.566 18.829 13.813 121 H LYS 320 H LYS 320 4.158 16.371 14.264 122 HA LYS 320 HA LYS 320 5.137 18.915 15.206 123 HB2 LYS 320 2HB LYS 320 5.951 16.063 15.875 124 HB3 LYS 320 1HB LYS 320 6.632 17.485 16.669 125 HG2 LYS 320 2HG LYS 320 4.289 18.115 17.374 126 HG3 LYS 320 1HG LYS 320 3.738 16.564 16.726 127 HD2 LYS 320 2HD LYS 320 5.170 15.365 18.310 128 HD3 LYS 320 1HD LYS 320 5.831 16.889 18.911 129 HE2 LYS 320 2HE LYS 320 3.564 17.514 19.729 130 HE3 LYS 320 1HE LYS 320 2.953 15.947 19.182 131 HZ1 LYS 320 1HZ LYS 320 4.407 14.848 20.719 132 HZ2 LYS 320 2HZ LYS 320 3.513 16.006 21.562 133 HZ3 LYS 320 3HZ LYS 320 5.129 16.308 21.169 134 H CYS 321 H CYS 321 5.878 17.574 12.361 135 HA CYS 321 HA CYS 321 8.524 18.930 12.342 136 HB2 CYS 321 2HB CYS 321 7.843 16.443 10.717 137 HB3 CYS 321 1HB CYS 321 9.372 17.328 10.690 138 H ALA 322 H ALA 322 5.475 19.186 11.486 139 HA ALA 322 HA ALA 322 5.861 20.279 8.772 140 HB1 ALA 322 1HB ALA 322 3.303 19.526 10.260 141 HB2 ALA 322 2HB ALA 322 4.094 18.561 9.014 142 HB3 ALA 322 3HB ALA 322 3.396 20.127 8.601 143 H CYS 323 H CYS 323 4.339 22.186 8.396 144 HA CYS 323 HA CYS 323 4.564 24.255 10.435 145 HB2 CYS 323 2HB CYS 323 4.977 25.072 8.249 146 HB3 CYS 323 1HB CYS 323 3.629 24.183 7.554 147 H HIS 324 H HIS 324 3.182 24.046 12.063 148 HA HIS 324 HA HIS 324 0.888 22.388 12.070 149 HB2 HIS 324 2HB HIS 324 1.814 24.460 14.115 150 HB3 HIS 324 1HB HIS 324 0.571 23.245 14.401 151 HD1 HIS 324 HD1 HIS 324 4.167 22.942 13.063 152 HD2 HIS 324 HD2 HIS 324 1.664 21.392 15.992 153 HE1 HIS 324 HE1 HIS 324 5.516 21.221 14.309 154 H VAL 325 H VAL 325 1.362 25.743 11.418 155 HA VAL 325 HA VAL 325 -1.106 26.847 12.143 156 HB VAL 325 HB VAL 325 0.658 27.876 9.881 157 HG11 VAL 325 1HG1 VAL 325 -1.498 29.053 10.096 158 HG12 VAL 325 2HG1 VAL 325 -0.165 30.113 10.552 159 HG13 VAL 325 3HG1 VAL 325 -1.173 29.375 11.802 160 HG21 VAL 325 1HG2 VAL 325 1.033 28.366 12.865 161 HG22 VAL 325 2HG2 VAL 325 1.930 29.172 11.575 162 HG23 VAL 325 3HG2 VAL 325 2.106 27.433 11.818 163 H CYS 326 H CYS 326 -0.124 25.150 9.200 164 HA CYS 326 HA CYS 326 -2.950 25.144 8.285 165 HB2 CYS 326 2HB CYS 326 -2.176 25.008 5.939 166 HB3 CYS 326 1HB CYS 326 -1.600 26.480 6.704 167 H GLY 327 H GLY 327 -0.605 23.314 9.645 168 HA2 GLY 327 2HA GLY 327 -0.258 21.089 9.997 169 HA3 GLY 327 1HA GLY 327 -1.892 20.849 9.400 170 H GLY 328 H GLY 328 1.209 21.848 7.865 171 HA2 GLY 328 2HA GLY 328 1.402 19.445 6.278 172 HA3 GLY 328 1HA GLY 328 0.826 20.822 5.348 173 H ARG 329 H ARG 329 3.073 19.619 4.558 174 HA ARG 329 HA ARG 329 5.410 21.174 5.527 175 HB2 ARG 329 2HB ARG 329 5.293 18.442 4.166 176 HB3 ARG 329 1HB ARG 329 6.770 19.258 4.681 177 HG2 ARG 329 2HG ARG 329 6.208 19.002 7.007 178 HG3 ARG 329 1HG ARG 329 4.562 18.491 6.617 179 HD2 ARG 329 2HD ARG 329 7.069 16.920 5.916 180 HD3 ARG 329 1HD ARG 329 6.039 16.615 7.316 181 HE ARG 329 HE ARG 329 4.203 16.149 5.712 182 HH11 ARG 329 1HH1 ARG 329 7.496 15.857 4.514 183 HH12 ARG 329 2HH1 ARG 329 7.075 14.685 3.311 184 HH21 ARG 329 1HH2 ARG 329 3.684 14.624 4.103 185 HH22 ARG 329 2HH2 ARG 329 4.935 13.997 3.083 186 H GLU 330 H GLU 330 3.243 21.524 3.243 187 HA GLU 330 HA GLU 330 4.769 21.229 0.772 188 HB2 GLU 330 2HB GLU 330 1.924 22.266 1.079 189 HB3 GLU 330 1HB GLU 330 2.667 21.542 -0.354 190 HG2 GLU 330 2HG GLU 330 2.896 19.405 1.000 191 HG3 GLU 330 1HG GLU 330 1.921 20.170 2.248 192 H ALA 331 H ALA 331 4.760 23.026 -0.840 193 HA ALA 331 HA ALA 331 5.681 24.979 -1.486 194 HB1 ALA 331 1HB ALA 331 4.873 27.103 -0.536 195 HB2 ALA 331 2HB ALA 331 4.142 26.232 0.817 196 HB3 ALA 331 3HB ALA 331 3.533 25.989 -0.821 197 HA PRO 332 HA PRO 332 8.923 24.286 1.882 198 HB2 PRO 332 2HB PRO 332 10.941 23.440 0.201 199 HB3 PRO 332 1HB PRO 332 9.736 22.349 0.897 200 HG2 PRO 332 2HG PRO 332 9.768 23.645 -1.829 201 HG3 PRO 332 1HG PRO 332 9.434 21.953 -1.404 202 HD2 PRO 332 2HD PRO 332 7.428 23.668 -1.911 203 HD3 PRO 332 1HD PRO 332 7.270 22.433 -0.642 204 H GLU 333 H GLU 333 9.002 25.943 -1.186 205 HA GLU 333 HA GLU 333 11.236 27.615 -0.914 206 HB2 GLU 333 2HB GLU 333 10.064 29.061 -2.594 207 HB3 GLU 333 1HB GLU 333 10.076 27.357 -3.042 208 HG2 GLU 333 2HG GLU 333 7.754 27.103 -2.378 209 HG3 GLU 333 1HG GLU 333 7.718 28.732 -1.714 210 H LYS 334 H LYS 334 8.010 27.867 0.456 211 HA LYS 334 HA LYS 334 8.457 30.625 1.411 212 HB2 LYS 334 2HB LYS 334 5.935 28.948 1.065 213 HB3 LYS 334 1HB LYS 334 5.935 30.513 1.880 214 HG2 LYS 334 2HG LYS 334 6.599 31.660 -0.124 215 HG3 LYS 334 1HG LYS 334 6.924 30.145 -0.966 216 HD2 LYS 334 2HD LYS 334 4.556 29.608 -1.027 217 HD3 LYS 334 1HD LYS 334 4.168 31.000 -0.015 218 HE2 LYS 334 2HE LYS 334 3.640 31.428 -2.384 219 HE3 LYS 334 1HE LYS 334 4.888 32.523 -1.795 220 HZ1 LYS 334 1HZ LYS 334 5.371 31.655 -4.008 221 HZ2 LYS 334 2HZ LYS 334 5.384 30.078 -3.401 222 HZ3 LYS 334 3HZ LYS 334 6.551 31.188 -2.890 223 H GLN 335 H GLN 335 9.113 27.639 2.566 224 HA GLN 335 HA GLN 335 7.986 27.779 5.205 225 HB2 GLN 335 2HB GLN 335 10.221 26.055 4.063 226 HB3 GLN 335 1HB GLN 335 9.737 25.976 5.757 227 HG2 GLN 335 2HG GLN 335 7.412 25.401 4.992 228 HG3 GLN 335 1HG GLN 335 8.030 25.315 3.343 229 HE21 GLN 335 1HE2 GLN 335 8.030 23.791 6.486 230 HE22 GLN 335 2HE2 GLN 335 8.712 22.286 5.988 231 H LEU 336 H LEU 336 8.704 28.762 6.965 232 HA LEU 336 HA LEU 336 11.503 29.698 7.172 233 HB2 LEU 336 2HB LEU 336 8.964 31.145 8.030 234 HB3 LEU 336 1HB LEU 336 10.551 31.573 8.656 235 HG LEU 336 HG LEU 336 9.722 31.719 5.734 236 HD11 LEU 336 1HD1 LEU 336 10.131 33.960 7.748 237 HD12 LEU 336 2HD1 LEU 336 8.594 33.447 7.043 238 HD13 LEU 336 3HD1 LEU 336 9.829 34.170 6.019 239 HD21 LEU 336 1HD2 LEU 336 12.113 31.226 5.957 240 HD22 LEU 336 2HD2 LEU 336 12.315 32.601 7.049 241 HD23 LEU 336 3HD2 LEU 336 11.868 32.866 5.361 242 H LEU 337 H LEU 337 12.434 28.492 8.658 243 HA LEU 337 HA LEU 337 10.869 27.118 10.717 244 HB2 LEU 337 2HB LEU 337 13.767 26.836 9.825 245 HB3 LEU 337 1HB LEU 337 13.139 26.028 11.250 246 HG LEU 337 HG LEU 337 11.443 24.871 9.758 247 HD11 LEU 337 1HD1 LEU 337 11.458 26.383 7.838 248 HD12 LEU 337 2HD1 LEU 337 11.839 24.733 7.350 249 HD13 LEU 337 3HD1 LEU 337 13.128 25.935 7.477 250 HD21 LEU 337 1HD2 LEU 337 13.443 23.715 10.576 251 HD22 LEU 337 2HD2 LEU 337 14.365 24.285 9.183 252 HD23 LEU 337 3HD2 LEU 337 13.017 23.167 8.954 253 H CYS 338 H CYS 338 11.111 27.422 12.889 254 HA CYS 338 HA CYS 338 12.304 29.990 13.740 255 HB2 CYS 338 2HB CYS 338 9.729 29.342 13.976 256 HB3 CYS 338 1HB CYS 338 10.293 28.464 15.399 257 H ASP 339 H ASP 339 14.161 29.812 14.895 258 HA ASP 339 HA ASP 339 15.568 27.437 15.175 259 HB2 ASP 339 2HB ASP 339 15.978 30.061 16.700 260 HB3 ASP 339 1HB ASP 339 17.177 28.770 16.581 261 H GLU 340 H GLU 340 13.787 29.175 17.618 262 HA GLU 340 HA GLU 340 14.560 27.408 19.793 263 HB2 GLU 340 2HB GLU 340 13.769 29.127 21.242 264 HB3 GLU 340 1HB GLU 340 14.566 29.943 19.913 265 HG2 GLU 340 2HG GLU 340 11.635 29.830 20.573 266 HG3 GLU 340 1HG GLU 340 12.671 31.239 20.405 267 H CYS 341 H CYS 341 11.748 27.990 17.796 268 HA CYS 341 HA CYS 341 9.901 26.356 19.365 269 HB2 CYS 341 2HB CYS 341 9.618 27.653 16.616 270 HB3 CYS 341 1HB CYS 341 8.380 26.619 17.314 271 H ASP 342 H ASP 342 12.323 25.819 17.009 272 HA ASP 342 HA ASP 342 13.038 24.092 15.748 273 HB2 ASP 342 2HB ASP 342 11.434 22.529 17.816 274 HB3 ASP 342 1HB ASP 342 12.425 21.737 16.609 275 H MET 343 H MET 343 10.805 25.423 14.676 276 HA MET 343 HA MET 343 9.004 23.302 13.675 277 HB2 MET 343 2HB MET 343 8.163 24.331 15.827 278 HB3 MET 343 1HB MET 343 8.057 25.874 15.000 279 HG2 MET 343 2HG MET 343 6.310 25.078 13.574 280 HG3 MET 343 1HG MET 343 6.548 23.411 14.111 281 HE1 MET 343 1HE MET 343 6.007 22.584 16.660 282 HE2 MET 343 2HE MET 343 5.427 23.686 17.910 283 HE3 MET 343 3HE MET 343 7.058 23.873 17.254 284 H ALA 344 H ALA 344 8.455 23.557 11.636 285 HA ALA 344 HA ALA 344 9.341 25.764 10.033 286 HB1 ALA 344 1HB ALA 344 8.323 24.521 8.158 287 HB2 ALA 344 2HB ALA 344 7.570 23.395 9.293 288 HB3 ALA 344 3HB ALA 344 9.328 23.461 9.149 289 H PHE 345 H PHE 345 8.145 27.394 9.180 290 HA PHE 345 HA PHE 345 5.202 27.477 9.548 291 HB2 PHE 345 2HB PHE 345 7.181 29.794 9.862 292 HB3 PHE 345 1HB PHE 345 5.439 30.009 9.740 293 HD1 PHE 345 HD1 PHE 345 4.061 29.836 11.663 294 HD2 PHE 345 HD2 PHE 345 8.107 28.477 11.867 295 HE1 PHE 345 HE1 PHE 345 3.856 29.574 14.100 296 HE2 PHE 345 HE2 PHE 345 7.889 28.212 14.301 297 HZ PHE 345 HZ PHE 345 5.768 28.758 15.418 298 H HIS 346 H HIS 346 4.530 29.541 7.968 299 HA HIS 346 HA HIS 346 6.065 29.426 5.450 300 HB2 HIS 346 2HB HIS 346 3.049 29.025 5.675 301 HB3 HIS 346 1HB HIS 346 3.834 29.486 4.174 302 HD2 HIS 346 HD2 HIS 346 6.141 27.455 3.797 303 HE1 HIS 346 HE1 HIS 346 3.277 24.456 4.606 304 HE2 HIS 346 HE2 HIS 346 5.435 25.008 3.422 305 H LEU 347 H LEU 347 5.895 31.316 4.193 306 HA LEU 347 HA LEU 347 5.754 33.816 5.358 307 HB2 LEU 347 2HB LEU 347 5.230 32.967 2.484 308 HB3 LEU 347 1HB LEU 347 5.374 34.649 2.959 309 HG LEU 347 HG LEU 347 7.595 32.576 3.194 310 HD11 LEU 347 1HD1 LEU 347 8.686 33.794 1.353 311 HD12 LEU 347 2HD1 LEU 347 7.280 34.852 1.203 312 HD13 LEU 347 3HD1 LEU 347 7.133 33.129 0.845 313 HD21 LEU 347 1HD2 LEU 347 7.650 35.565 3.718 314 HD22 LEU 347 2HD2 LEU 347 9.046 34.483 3.747 315 HD23 LEU 347 3HD2 LEU 347 7.761 34.292 4.936 316 H TYR 348 H TYR 348 3.217 32.130 3.554 317 HA TYR 348 HA TYR 348 1.180 34.127 4.004 318 HB2 TYR 348 2HB TYR 348 -0.290 32.513 2.747 319 HB3 TYR 348 1HB TYR 348 1.171 32.955 1.881 320 HD1 TYR 348 HD1 TYR 348 3.017 31.271 1.571 321 HD2 TYR 348 HD2 TYR 348 -0.658 30.185 3.466 322 HE1 TYR 348 HE1 TYR 348 3.557 28.890 1.263 323 HE2 TYR 348 HE2 TYR 348 -0.106 27.803 3.152 324 HH TYR 348 HH TYR 348 1.327 26.412 1.602 325 H CYS 349 H CYS 349 2.439 31.945 6.113 326 HA CYS 349 HA CYS 349 -0.132 31.425 7.516 327 HB2 CYS 349 2HB CYS 349 2.523 29.943 7.740 328 HB3 CYS 349 1HB CYS 349 1.089 29.600 8.709 329 H LEU 350 H LEU 350 2.211 33.650 7.511 330 HA LEU 350 HA LEU 350 2.746 33.821 10.382 331 HB2 LEU 350 2HB LEU 350 3.616 35.674 8.122 332 HB3 LEU 350 1HB LEU 350 4.168 35.756 9.791 333 HG LEU 350 HG LEU 350 4.743 33.529 7.808 334 HD11 LEU 350 1HD1 LEU 350 6.600 35.556 9.073 335 HD12 LEU 350 2HD1 LEU 350 6.055 35.532 7.393 336 HD13 LEU 350 3HD1 LEU 350 7.080 34.235 8.000 337 HD21 LEU 350 1HD2 LEU 350 4.426 32.549 10.025 338 HD22 LEU 350 2HD2 LEU 350 5.561 33.703 10.730 339 HD23 LEU 350 3HD2 LEU 350 6.129 32.494 9.575 340 H LYS 351 H LYS 351 2.482 36.068 11.400 341 HA LYS 351 HA LYS 351 0.275 37.666 10.373 342 HB2 LYS 351 2HB LYS 351 -0.819 35.836 11.731 343 HB3 LYS 351 1HB LYS 351 0.064 36.401 13.143 344 HG2 LYS 351 2HG LYS 351 -2.257 37.219 13.134 345 HG3 LYS 351 1HG LYS 351 -1.099 38.548 13.060 346 HD2 LYS 351 2HD LYS 351 -1.494 38.774 10.625 347 HD3 LYS 351 1HD LYS 351 -2.620 37.414 10.670 348 HE2 LYS 351 2HE LYS 351 -3.841 39.544 10.629 349 HE3 LYS 351 1HE LYS 351 -4.115 38.717 12.162 350 HZ1 LYS 351 1HZ LYS 351 -2.499 40.166 13.205 351 HZ2 LYS 351 2HZ LYS 351 -3.706 41.088 12.461 352 HZ3 LYS 351 3HZ LYS 351 -2.187 40.936 11.735 353 HA PRO 352 HA PRO 352 0.342 39.726 9.750 354 HB2 PRO 352 2HB PRO 352 2.583 41.460 8.908 355 HB3 PRO 352 1HB PRO 352 0.916 41.901 9.283 356 HG2 PRO 352 2HG PRO 352 2.991 42.599 10.896 357 HG3 PRO 352 1HG PRO 352 1.370 42.251 11.534 358 HD2 PRO 352 2HD PRO 352 3.789 40.443 11.436 359 HD3 PRO 352 1HD PRO 352 2.664 40.746 12.781 360 HA PRO 353 HA PRO 353 2.365 36.653 7.170 361 HB2 PRO 353 2HB PRO 353 0.841 36.896 4.886 362 HB3 PRO 353 1HB PRO 353 0.282 36.069 6.347 363 HG2 PRO 353 2HG PRO 353 -0.300 38.873 5.412 364 HG3 PRO 353 1HG PRO 353 -1.406 37.675 6.118 365 HD2 PRO 353 2HD PRO 353 -0.352 39.707 7.592 366 HD3 PRO 353 1HD PRO 353 -0.706 38.116 8.300 367 H LEU 354 H LEU 354 4.330 37.015 6.414 368 HA LEU 354 HA LEU 354 5.091 39.448 5.065 369 HB2 LEU 354 2HB LEU 354 6.685 36.925 5.675 370 HB3 LEU 354 1HB LEU 354 7.371 38.401 4.999 371 HG LEU 354 HG LEU 354 6.081 38.141 7.740 372 HD11 LEU 354 1HD1 LEU 354 8.345 38.454 8.649 373 HD12 LEU 354 2HD1 LEU 354 9.012 38.446 7.012 374 HD13 LEU 354 3HD1 LEU 354 8.233 36.999 7.660 375 HD21 LEU 354 1HD2 LEU 354 7.418 40.562 6.481 376 HD22 LEU 354 2HD2 LEU 354 6.890 40.442 8.163 377 HD23 LEU 354 3HD2 LEU 354 5.704 40.379 6.863 378 H THR 355 H THR 355 5.323 39.758 2.934 379 HA THR 355 HA THR 355 4.439 37.762 1.029 380 HB THR 355 HB THR 355 3.851 40.176 0.767 381 HG1 THR 355 HG1 THR 355 3.659 39.282 -1.156 382 HG21 THR 355 1HG2 THR 355 5.967 41.212 1.508 383 HG22 THR 355 2HG2 THR 355 5.495 41.789 -0.091 384 HG23 THR 355 3HG2 THR 355 6.781 40.590 0.067 385 H SER 356 H SER 356 7.424 38.726 2.380 386 HA SER 356 HA SER 356 8.972 36.959 0.635 387 HB2 SER 356 2HB SER 356 9.236 39.191 -0.397 388 HB3 SER 356 1HB SER 356 9.711 39.882 1.155 389 HG SER 356 HG SER 356 11.606 38.788 1.073 390 H VAL 357 H VAL 357 10.986 36.328 1.562 391 HA VAL 357 HA VAL 357 11.063 35.814 4.315 392 HB VAL 357 HB VAL 357 12.239 34.414 2.661 393 HG11 VAL 357 1HG1 VAL 357 14.336 35.123 1.555 394 HG12 VAL 357 2HG1 VAL 357 14.163 36.738 2.246 395 HG13 VAL 357 3HG1 VAL 357 12.980 36.148 1.076 396 HG21 VAL 357 1HG2 VAL 357 13.049 34.312 4.976 397 HG22 VAL 357 2HG2 VAL 357 14.189 35.619 4.658 398 HG23 VAL 357 3HG2 VAL 357 14.387 34.062 3.851 399 HA PRO 358 HA PRO 358 12.729 39.808 5.829 400 HB2 PRO 358 2HB PRO 358 13.452 39.023 8.366 401 HB3 PRO 358 1HB PRO 358 11.767 39.303 7.899 402 HG2 PRO 358 2HG PRO 358 13.288 36.700 8.036 403 HG3 PRO 358 1HG PRO 358 11.672 37.079 8.674 404 HD2 PRO 358 2HD PRO 358 11.979 35.778 6.332 405 HD3 PRO 358 1HD PRO 358 10.667 36.957 6.554 406 HA PRO 359 HA PRO 359 17.195 39.347 5.261 407 HB2 PRO 359 2HB PRO 359 18.162 41.655 6.275 408 HB3 PRO 359 1HB PRO 359 17.100 41.663 4.857 409 HG2 PRO 359 2HG PRO 359 16.400 42.178 7.751 410 HG3 PRO 359 1HG PRO 359 15.938 43.113 6.313 411 HD2 PRO 359 2HD PRO 359 14.283 41.256 7.481 412 HD3 PRO 359 1HD PRO 359 14.230 41.640 5.746 413 H GLU 360 H GLU 360 15.790 38.786 8.151 414 HA GLU 360 HA GLU 360 18.095 38.890 9.920 415 HB2 GLU 360 2HB GLU 360 15.295 37.806 10.390 416 HB3 GLU 360 1HB GLU 360 16.492 38.150 11.641 417 HG2 GLU 360 2HG GLU 360 16.384 40.538 11.131 418 HG3 GLU 360 1HG GLU 360 15.287 40.233 9.786 419 HA PRO 361 HA PRO 361 19.240 34.664 8.657 420 HB2 PRO 361 2HB PRO 361 21.314 34.337 10.454 421 HB3 PRO 361 1HB PRO 361 21.462 35.258 8.952 422 HG2 PRO 361 2HG PRO 361 21.027 36.242 11.756 423 HG3 PRO 361 1HG PRO 361 22.060 36.918 10.480 424 HD2 PRO 361 2HD PRO 361 19.601 37.949 11.113 425 HD3 PRO 361 1HD PRO 361 20.290 38.047 9.481 426 H GLU 362 H GLU 362 19.304 35.368 12.175 427 HA GLU 362 HA GLU 362 18.076 32.864 12.934 428 HB2 GLU 362 2HB GLU 362 18.080 33.893 15.240 429 HB3 GLU 362 1HB GLU 362 19.671 33.892 14.484 430 HG2 GLU 362 2HG GLU 362 19.242 36.298 13.826 431 HG3 GLU 362 1HG GLU 362 17.794 36.248 14.824 432 H TRP 363 H TRP 363 15.893 32.535 13.081 433 HA TRP 363 HA TRP 363 14.107 34.833 12.556 434 HB2 TRP 363 2HB TRP 363 14.433 33.318 10.553 435 HB3 TRP 363 1HB TRP 363 13.687 32.013 11.472 436 HD1 TRP 363 HD1 TRP 363 12.840 35.380 9.822 437 HE1 TRP 363 HE1 TRP 363 10.298 35.527 9.501 438 HE3 TRP 363 HE3 TRP 363 11.461 31.158 12.334 439 HZ2 TRP 363 HZ2 TRP 363 8.011 34.064 10.232 440 HZ3 TRP 363 HZ3 TRP 363 9.075 30.600 12.492 441 HH2 TRP 363 HH2 TRP 363 7.381 32.025 11.461 442 H TYR 364 H TYR 364 12.700 35.174 14.046 443 HA TYR 364 HA TYR 364 11.664 33.008 15.777 444 HB2 TYR 364 2HB TYR 364 11.959 35.972 16.498 445 HB3 TYR 364 1HB TYR 364 11.414 34.685 17.568 446 HD1 TYR 364 HD1 TYR 364 14.365 36.171 15.894 447 HD2 TYR 364 HD2 TYR 364 13.060 33.146 18.626 448 HE1 TYR 364 HE1 TYR 364 16.688 35.782 16.598 449 HE2 TYR 364 HE2 TYR 364 15.392 32.762 19.311 450 HH TYR 364 HH TYR 364 17.922 34.898 18.494 451 H CYS 365 H CYS 365 9.482 32.790 15.748 452 HA CYS 365 HA CYS 365 7.854 34.155 13.822 453 HB2 CYS 365 2HB CYS 365 6.034 32.691 14.655 454 HB3 CYS 365 1HB CYS 365 7.502 31.764 14.384 455 HA PRO 366 HA PRO 366 6.036 37.530 16.255 456 HB2 PRO 366 2HB PRO 366 3.266 37.105 15.932 457 HB3 PRO 366 1HB PRO 366 4.310 37.970 14.798 458 HG2 PRO 366 2HG PRO 366 3.424 35.083 14.738 459 HG3 PRO 366 1HG PRO 366 3.502 36.256 13.404 460 HD2 PRO 366 2HD PRO 366 5.409 34.422 13.660 461 HD3 PRO 366 1HD PRO 366 5.856 36.091 13.237 462 H SER 367 H SER 367 4.756 34.301 16.810 463 HA SER 367 HA SER 367 3.541 34.630 19.330 464 HB2 SER 367 2HB SER 367 3.134 32.656 17.890 465 HB3 SER 367 1HB SER 367 4.800 32.126 18.120 466 HG SER 367 HG SER 367 3.515 32.549 20.493 467 H CYS 368 H CYS 368 6.896 34.414 18.440 468 HA CYS 368 HA CYS 368 7.948 33.578 20.986 469 HB2 CYS 368 2HB CYS 368 9.122 34.379 18.351 470 HB3 CYS 368 1HB CYS 368 10.160 34.565 19.768 471 H ARG 369 H ARG 369 7.011 36.639 19.663 472 HA ARG 369 HA ARG 369 8.264 38.076 21.940 473 HB2 ARG 369 2HB ARG 369 8.145 40.114 20.587 474 HB3 ARG 369 1HB ARG 369 9.033 38.861 19.729 475 HG2 ARG 369 2HG ARG 369 6.962 38.389 18.396 476 HG3 ARG 369 1HG ARG 369 6.183 39.758 19.196 477 HD2 ARG 369 2HD ARG 369 8.658 39.875 17.433 478 HD3 ARG 369 1HD ARG 369 7.030 40.402 16.995 479 HE ARG 369 HE ARG 369 8.012 41.729 19.343 480 HH11 ARG 369 1HH1 ARG 369 8.120 41.850 15.823 481 HH12 ARG 369 2HH1 ARG 369 8.536 43.530 15.789 482 HH21 ARG 369 1HH2 ARG 369 8.554 43.914 19.261 483 HH22 ARG 369 2HH2 ARG 369 8.791 44.694 17.730 484 H THR 370 H THR 370 5.405 36.747 21.033 485 HA THR 370 HA THR 370 3.450 38.662 21.762 486 HB THR 370 HB THR 370 3.374 35.614 21.819 487 HG1 THR 370 HG1 THR 370 3.349 37.409 19.826 488 HG21 THR 370 1HG2 THR 370 1.543 36.484 23.230 489 HG22 THR 370 2HG2 THR 370 0.910 35.808 21.728 490 HG23 THR 370 3HG2 THR 370 1.037 37.556 21.920 491 H ASP 371 H ASP 371 2.973 39.497 23.695 492 HA ASP 371 HA ASP 371 4.193 38.624 26.155 493 HB2 ASP 371 2HB ASP 371 2.025 40.723 25.672 494 HB3 ASP 371 1HB ASP 371 2.870 40.476 27.198 495 H SER 372 H SER 372 1.151 38.016 24.583 496 HA SER 372 HA SER 372 -0.229 36.970 26.894 497 HB2 SER 372 2HB SER 372 -0.917 36.770 23.930 498 HB3 SER 372 1HB SER 372 -1.997 36.367 25.268 499 HG SER 372 HG SER 372 -2.413 38.458 24.497 500 H SER 373 H SER 373 1.731 35.653 27.332 501 HA SER 373 HA SER 373 2.419 33.319 25.845 502 HB2 SER 373 2HB SER 373 2.878 33.901 28.801 503 HB3 SER 373 1HB SER 373 3.773 32.741 27.817 504 HG SER 373 HG SER 373 4.905 34.703 28.072 505 H GLU 374 H GLU 374 2.246 31.106 26.724 506 HA GLU 374 HA GLU 374 -0.414 30.316 27.408 507 HB2 GLU 374 2HB GLU 374 1.233 28.929 26.083 508 HB3 GLU 374 1HB GLU 374 2.147 28.667 27.562 509 HG2 GLU 374 2HG GLU 374 0.147 27.545 28.546 510 HG3 GLU 374 1HG GLU 374 -0.691 27.754 27.008 511 H VAL 375 H VAL 375 -1.248 29.782 29.358 512 HA VAL 375 HA VAL 375 0.098 30.750 31.754 513 HB VAL 375 HB VAL 375 -2.698 29.556 31.463 514 HG11 VAL 375 1HG1 VAL 375 -1.503 31.125 33.784 515 HG12 VAL 375 2HG1 VAL 375 -1.898 29.406 33.790 516 HG13 VAL 375 3HG1 VAL 375 -3.185 30.604 33.653 517 HG21 VAL 375 1HG2 VAL 375 -2.467 31.604 30.113 518 HG22 VAL 375 2HG2 VAL 375 -1.865 32.483 31.522 519 HG23 VAL 375 3HG2 VAL 375 -3.525 31.883 31.499 520 H VAL 376 H VAL 376 1.453 29.431 32.790 521 HA VAL 376 HA VAL 376 1.485 26.585 32.629 522 HB VAL 376 HB VAL 376 2.822 28.353 34.738 523 HG11 VAL 376 1HG1 VAL 376 4.438 26.495 35.009 524 HG12 VAL 376 2HG1 VAL 376 3.531 25.526 33.846 525 HG13 VAL 376 3HG1 VAL 376 2.797 25.968 35.388 526 HG21 VAL 376 1HG2 VAL 376 3.460 29.084 32.467 527 HG22 VAL 376 2HG2 VAL 376 3.931 27.436 32.051 528 HG23 VAL 376 3HG2 VAL 376 4.830 28.323 33.283 529 H GLN 377 H GLN 377 -0.081 25.350 33.457 530 HA GLN 377 HA GLN 377 -2.133 26.340 35.135 531 HB2 GLN 377 2HB GLN 377 -1.513 23.524 34.170 532 HB3 GLN 377 1HB GLN 377 -3.017 23.988 34.968 533 HG2 GLN 377 2HG GLN 377 -3.588 25.483 33.139 534 HG3 GLN 377 1HG GLN 377 -2.030 25.209 32.361 535 HE21 GLN 377 1HE2 GLN 377 -1.680 23.262 31.255 536 HE22 GLN 377 2HE2 GLN 377 -2.974 22.208 30.814 537 H ALA 378 H ALA 378 -2.240 26.457 37.262 538 HA ALA 378 HA ALA 378 -0.236 25.212 38.997 539 HB1 ALA 378 1HB ALA 378 -2.339 27.326 39.596 540 HB2 ALA 378 2HB ALA 378 -0.657 27.648 39.171 541 HB3 ALA 378 3HB ALA 378 -1.042 26.824 40.684 542 H GLY 379 H GLY 379 -1.154 24.647 41.289 543 HA2 GLY 379 2HA GLY 379 -2.765 23.560 42.627 544 HA3 GLY 379 1HA GLY 379 -3.738 23.215 41.200 545 H GLU 380 H GLU 380 -0.282 22.637 41.735 546 HA GLU 380 HA GLU 380 -0.395 19.918 40.864 547 HB2 GLU 380 2HB GLU 380 1.608 21.358 40.520 548 HB3 GLU 380 1HB GLU 380 1.863 21.424 42.262 549 HG2 GLU 380 2HG GLU 380 2.205 18.934 42.249 550 HG3 GLU 380 1HG GLU 380 2.065 18.967 40.491 Start of MODEL 2 1 H1 SER 303 H SER 303 8.913 1.361 0.777 2 HA SER 303 HA SER 303 9.885 -0.457 2.864 3 HB2 SER 303 2HB SER 303 10.939 0.081 0.049 4 HB3 SER 303 1HB SER 303 11.499 -1.204 1.133 5 HG SER 303 HG SER 303 9.148 -1.817 1.134 6 H GLY 304 H GLY 304 10.472 2.707 1.606 7 HA2 GLY 304 2HA GLY 304 13.106 3.179 2.542 8 HA3 GLY 304 1HA GLY 304 11.893 4.399 2.182 9 HA PRO 305 HA PRO 305 12.810 3.742 6.864 10 HB2 PRO 305 2HB PRO 305 14.212 6.032 7.420 11 HB3 PRO 305 1HB PRO 305 14.987 4.544 6.857 12 HG2 PRO 305 2HG PRO 305 14.190 6.986 5.272 13 HG3 PRO 305 1HG PRO 305 15.714 6.073 5.220 14 HD2 PRO 305 2HD PRO 305 13.769 5.711 3.366 15 HD3 PRO 305 1HD PRO 305 14.798 4.366 3.914 16 H SER 306 H SER 306 11.445 4.474 8.411 17 HA SER 306 HA SER 306 9.462 6.508 7.737 18 HB2 SER 306 2HB SER 306 8.378 5.692 9.904 19 HB3 SER 306 1HB SER 306 8.580 4.448 8.672 20 HG SER 306 HG SER 306 10.345 3.655 9.785 21 H CYS 307 H CYS 307 9.002 8.322 9.060 22 HA CYS 307 HA CYS 307 11.326 9.577 10.307 23 HB2 CYS 307 2HB CYS 307 9.833 10.846 8.753 24 HB3 CYS 307 1HB CYS 307 8.493 10.655 9.880 25 H ARG 308 H ARG 308 11.730 8.994 12.379 26 HA ARG 308 HA ARG 308 10.112 7.339 13.903 27 HB2 ARG 308 2HB ARG 308 11.772 7.667 15.728 28 HB3 ARG 308 1HB ARG 308 12.507 7.346 14.162 29 HG2 ARG 308 2HG ARG 308 13.025 9.747 13.899 30 HG3 ARG 308 1HG ARG 308 12.262 10.090 15.453 31 HD2 ARG 308 2HD ARG 308 13.953 8.689 16.584 32 HD3 ARG 308 1HD ARG 308 14.726 8.361 15.027 33 HE ARG 308 HE ARG 308 14.836 10.995 15.010 34 HH11 ARG 308 1HH1 ARG 308 15.549 8.856 17.717 35 HH12 ARG 308 2HH1 ARG 308 16.677 9.964 18.427 36 HH21 ARG 308 1HH2 ARG 308 16.313 12.407 15.970 37 HH22 ARG 308 2HH2 ARG 308 17.090 11.965 17.453 38 H PHE 309 H PHE 309 10.484 10.892 14.331 39 HA PHE 309 HA PHE 309 9.113 11.158 16.811 40 HB2 PHE 309 2HB PHE 309 9.822 13.067 14.585 41 HB3 PHE 309 1HB PHE 309 8.667 13.612 15.790 42 HD1 PHE 309 HD1 PHE 309 12.177 12.329 15.400 43 HD2 PHE 309 HD2 PHE 309 9.387 14.442 17.859 44 HE1 PHE 309 HE1 PHE 309 14.009 13.050 16.873 45 HE2 PHE 309 HE2 PHE 309 11.214 15.158 19.325 46 HZ PHE 309 HZ PHE 309 13.535 14.462 18.837 47 H CYS 310 H CYS 310 7.943 10.797 13.577 48 HA CYS 310 HA CYS 310 5.209 11.712 14.293 49 HB2 CYS 310 2HB CYS 310 6.391 11.558 11.484 50 HB3 CYS 310 1HB CYS 310 5.010 12.505 12.036 51 H LYS 311 H LYS 311 7.108 9.025 13.495 52 HA LYS 311 HA LYS 311 6.931 7.014 12.506 53 HB2 LYS 311 2HB LYS 311 4.157 7.126 13.775 54 HB3 LYS 311 1HB LYS 311 4.859 5.672 13.091 55 HG2 LYS 311 2HG LYS 311 5.172 5.457 15.407 56 HG3 LYS 311 1HG LYS 311 6.752 5.924 14.781 57 HD2 LYS 311 2HD LYS 311 6.241 7.095 16.885 58 HD3 LYS 311 1HD LYS 311 6.384 8.241 15.549 59 HE2 LYS 311 2HE LYS 311 4.493 8.778 17.066 60 HE3 LYS 311 1HE LYS 311 3.945 8.442 15.425 61 HZ1 LYS 311 1HZ LYS 311 2.533 7.389 17.061 62 HZ2 LYS 311 2HZ LYS 311 3.849 6.541 17.708 63 HZ3 LYS 311 3HZ LYS 311 3.324 6.215 16.133 64 H ASP 312 H ASP 312 6.214 9.260 10.750 65 HA ASP 312 HA ASP 312 4.928 10.100 9.086 66 HB2 ASP 312 2HB ASP 312 4.815 7.158 8.303 67 HB3 ASP 312 1HB ASP 312 4.194 8.447 7.272 68 H ASP 313 H ASP 313 3.187 10.999 10.169 69 HA ASP 313 HA ASP 313 1.291 9.562 11.650 70 HB2 ASP 313 2HB ASP 313 0.773 12.324 10.471 71 HB3 ASP 313 1HB ASP 313 0.059 11.627 11.914 72 H GLU 314 H GLU 314 -0.806 8.886 11.238 73 HA GLU 314 HA GLU 314 -1.185 7.567 8.820 74 HB2 GLU 314 2HB GLU 314 -3.442 6.988 9.715 75 HB3 GLU 314 1HB GLU 314 -2.155 6.775 10.897 76 HG2 GLU 314 2HG GLU 314 -2.764 8.939 11.947 77 HG3 GLU 314 1HG GLU 314 -4.068 9.137 10.775 78 H ASN 315 H ASN 315 -2.345 10.729 9.773 79 HA ASN 315 HA ASN 315 -4.243 10.894 7.547 80 HB2 ASN 315 2HB ASN 315 -3.783 12.616 10.006 81 HB3 ASN 315 1HB ASN 315 -4.828 13.142 8.691 82 HD21 ASN 315 1HD2 ASN 315 -5.982 10.596 8.042 83 HD22 ASN 315 2HD2 ASN 315 -7.002 10.143 9.361 84 H LYS 316 H LYS 316 -1.186 12.364 8.612 85 HA LYS 316 HA LYS 316 -0.639 13.305 5.897 86 HB2 LYS 316 2HB LYS 316 -0.803 15.207 8.278 87 HB3 LYS 316 1HB LYS 316 0.187 15.585 6.869 88 HG2 LYS 316 2HG LYS 316 -1.829 15.489 5.438 89 HG3 LYS 316 1HG LYS 316 -2.809 15.116 6.859 90 HD2 LYS 316 2HD LYS 316 -2.240 17.323 7.831 91 HD3 LYS 316 1HD LYS 316 -1.242 17.688 6.418 92 HE2 LYS 316 2HE LYS 316 -3.446 18.766 6.244 93 HE3 LYS 316 1HE LYS 316 -3.234 17.569 4.966 94 HZ1 LYS 316 1HZ LYS 316 -4.772 17.187 7.477 95 HZ2 LYS 316 2HZ LYS 316 -4.557 16.015 6.277 96 HZ3 LYS 316 3HZ LYS 316 -5.428 17.421 5.934 97 HA PRO 317 HA PRO 317 3.243 11.327 6.630 98 HB2 PRO 317 2HB PRO 317 4.528 13.778 5.395 99 HB3 PRO 317 1HB PRO 317 4.805 12.065 5.031 100 HG2 PRO 317 2HG PRO 317 3.291 13.523 3.418 101 HG3 PRO 317 1HG PRO 317 2.787 11.870 3.832 102 HD2 PRO 317 2HD PRO 317 1.723 14.493 4.851 103 HD3 PRO 317 1HD PRO 317 0.852 12.985 4.497 104 H CYS 318 H CYS 318 3.320 14.778 7.478 105 HA CYS 318 HA CYS 318 4.492 14.142 10.065 106 HB2 CYS 318 2HB CYS 318 5.892 15.926 8.065 107 HB3 CYS 318 1HB CYS 318 6.182 16.049 9.799 108 H ARG 319 H ARG 319 3.754 15.426 11.648 109 HA ARG 319 HA ARG 319 2.250 17.888 11.054 110 HB2 ARG 319 2HB ARG 319 2.618 16.237 13.593 111 HB3 ARG 319 1HB ARG 319 1.700 17.738 13.533 112 HG2 ARG 319 2HG ARG 319 1.006 15.308 11.844 113 HG3 ARG 319 1HG ARG 319 0.345 15.591 13.461 114 HD2 ARG 319 2HD ARG 319 0.012 17.389 11.030 115 HD3 ARG 319 1HD ARG 319 -1.237 16.381 11.775 116 HE ARG 319 HE ARG 319 -0.245 18.098 13.752 117 HH11 ARG 319 1HH1 ARG 319 -2.140 18.363 10.809 118 HH12 ARG 319 2HH1 ARG 319 -2.885 19.852 11.281 119 HH21 ARG 319 1HH2 ARG 319 -1.227 20.043 14.354 120 HH22 ARG 319 2HH2 ARG 319 -2.374 20.803 13.300 121 H LYS 320 H LYS 320 4.911 16.704 13.121 122 HA LYS 320 HA LYS 320 5.634 19.336 14.082 123 HB2 LYS 320 2HB LYS 320 6.796 16.567 14.553 124 HB3 LYS 320 1HB LYS 320 7.470 18.019 15.293 125 HG2 LYS 320 2HG LYS 320 5.368 18.440 16.469 126 HG3 LYS 320 1HG LYS 320 4.610 17.057 15.674 127 HD2 LYS 320 2HD LYS 320 7.018 16.866 17.537 128 HD3 LYS 320 1HD LYS 320 5.351 16.617 18.048 129 HE2 LYS 320 2HE LYS 320 5.191 14.731 16.381 130 HE3 LYS 320 1HE LYS 320 6.912 14.943 16.050 131 HZ1 LYS 320 1HZ LYS 320 7.394 14.406 18.333 132 HZ2 LYS 320 2HZ LYS 320 6.461 13.173 17.643 133 HZ3 LYS 320 3HZ LYS 320 5.748 14.285 18.694 134 H CYS 321 H CYS 321 6.650 17.444 11.358 135 HA CYS 321 HA CYS 321 9.044 19.168 10.989 136 HB2 CYS 321 2HB CYS 321 8.266 16.815 9.224 137 HB3 CYS 321 1HB CYS 321 9.832 17.623 9.334 138 H ALA 322 H ALA 322 5.836 19.237 10.351 139 HA ALA 322 HA ALA 322 5.984 20.539 7.710 140 HB1 ALA 322 1HB ALA 322 3.504 20.434 7.782 141 HB2 ALA 322 2HB ALA 322 3.574 19.731 9.402 142 HB3 ALA 322 3HB ALA 322 4.211 18.834 8.024 143 H CYS 323 H CYS 323 4.508 22.544 7.578 144 HA CYS 323 HA CYS 323 4.876 24.409 9.750 145 HB2 CYS 323 2HB CYS 323 4.879 25.418 7.607 146 HB3 CYS 323 1HB CYS 323 3.448 24.541 7.083 147 H HIS 324 H HIS 324 3.827 23.909 11.571 148 HA HIS 324 HA HIS 324 1.670 22.062 11.672 149 HB2 HIS 324 2HB HIS 324 3.477 22.227 13.390 150 HB3 HIS 324 1HB HIS 324 2.841 23.785 13.901 151 HD1 HIS 324 HD1 HIS 324 1.052 23.719 15.695 152 HD2 HIS 324 HD2 HIS 324 1.635 20.017 13.894 153 HE1 HIS 324 HE1 HIS 324 -0.349 22.075 16.994 154 H VAL 325 H VAL 325 1.794 25.497 11.536 155 HA VAL 325 HA VAL 325 -0.538 26.404 12.699 156 HB VAL 325 HB VAL 325 0.602 27.392 10.042 157 HG11 VAL 325 1HG1 VAL 325 -1.613 28.364 10.533 158 HG12 VAL 325 2HG1 VAL 325 -0.351 29.591 10.652 159 HG13 VAL 325 3HG1 VAL 325 -1.044 28.897 12.121 160 HG21 VAL 325 1HG2 VAL 325 1.411 28.211 12.860 161 HG22 VAL 325 2HG2 VAL 325 1.975 28.968 11.367 162 HG23 VAL 325 3HG2 VAL 325 2.394 27.290 11.716 163 H CYS 326 H CYS 326 -0.063 25.109 9.442 164 HA CYS 326 HA CYS 326 -2.990 24.789 9.059 165 HB2 CYS 326 2HB CYS 326 -2.586 25.120 6.648 166 HB3 CYS 326 1HB CYS 326 -1.973 26.494 7.556 167 H GLY 327 H GLY 327 -0.306 23.104 9.820 168 HA2 GLY 327 2HA GLY 327 0.347 20.924 9.804 169 HA3 GLY 327 1HA GLY 327 -1.280 20.526 9.278 170 H GLY 328 H GLY 328 1.034 22.511 7.440 171 HA2 GLY 328 2HA GLY 328 0.910 20.489 5.255 172 HA3 GLY 328 1HA GLY 328 0.737 22.214 4.991 173 H ARG 329 H ARG 329 2.764 19.874 4.330 174 HA ARG 329 HA ARG 329 5.318 21.251 4.866 175 HB2 ARG 329 2HB ARG 329 4.769 18.690 3.297 176 HB3 ARG 329 1HB ARG 329 6.363 19.327 3.700 177 HG2 ARG 329 2HG ARG 329 5.863 18.976 6.112 178 HG3 ARG 329 1HG ARG 329 4.298 18.281 5.667 179 HD2 ARG 329 2HD ARG 329 7.047 17.200 4.946 180 HD3 ARG 329 1HD ARG 329 5.900 16.490 6.089 181 HE ARG 329 HE ARG 329 4.451 16.519 3.835 182 HH11 ARG 329 1HH1 ARG 329 7.730 15.360 4.352 183 HH12 ARG 329 2HH1 ARG 329 7.632 14.183 3.086 184 HH21 ARG 329 1HH2 ARG 329 4.358 15.018 2.166 185 HH22 ARG 329 2HH2 ARG 329 5.709 13.980 1.848 186 H GLU 330 H GLU 330 2.971 22.032 2.927 187 HA GLU 330 HA GLU 330 3.854 21.889 0.258 188 HB2 GLU 330 2HB GLU 330 1.934 23.877 1.554 189 HB3 GLU 330 1HB GLU 330 2.065 23.541 -0.175 190 HG2 GLU 330 2HG GLU 330 1.323 21.226 0.203 191 HG3 GLU 330 1HG GLU 330 1.241 21.521 1.937 192 H ALA 331 H ALA 331 5.157 23.188 -0.936 193 HA ALA 331 HA ALA 331 6.831 24.615 -1.467 194 HB1 ALA 331 1HB ALA 331 6.330 26.990 -1.225 195 HB2 ALA 331 2HB ALA 331 5.090 26.630 -0.021 196 HB3 ALA 331 3HB ALA 331 4.878 26.099 -1.692 197 HA PRO 332 HA PRO 332 8.909 23.877 2.647 198 HB2 PRO 332 2HB PRO 332 11.247 23.309 0.854 199 HB3 PRO 332 1HB PRO 332 10.568 22.340 2.169 200 HG2 PRO 332 2HG PRO 332 10.196 21.657 -0.395 201 HG3 PRO 332 1HG PRO 332 8.917 21.410 0.810 202 HD2 PRO 332 2HD PRO 332 9.180 23.566 -1.277 203 HD3 PRO 332 1HD PRO 332 7.735 22.673 -0.744 204 H GLU 333 H GLU 333 10.314 25.583 -0.113 205 HA GLU 333 HA GLU 333 12.158 27.160 1.402 206 HB2 GLU 333 2HB GLU 333 12.669 28.352 -0.648 207 HB3 GLU 333 1HB GLU 333 12.529 26.639 -1.006 208 HG2 GLU 333 2HG GLU 333 10.413 28.739 -1.605 209 HG3 GLU 333 1HG GLU 333 11.561 28.088 -2.774 210 H LYS 334 H LYS 334 8.789 27.643 0.496 211 HA LYS 334 HA LYS 334 8.759 30.427 1.434 212 HB2 LYS 334 2HB LYS 334 6.425 28.692 0.532 213 HB3 LYS 334 1HB LYS 334 6.385 30.426 0.815 214 HG2 LYS 334 2HG LYS 334 7.941 30.797 -1.046 215 HG3 LYS 334 1HG LYS 334 8.060 29.059 -1.318 216 HD2 LYS 334 2HD LYS 334 6.575 29.875 -2.986 217 HD3 LYS 334 1HD LYS 334 5.546 29.084 -1.796 218 HE2 LYS 334 2HE LYS 334 6.013 32.086 -1.961 219 HE3 LYS 334 1HE LYS 334 4.621 31.249 -2.643 220 HZ1 LYS 334 1HZ LYS 334 3.978 32.149 -0.582 221 HZ2 LYS 334 2HZ LYS 334 5.336 31.542 0.212 222 HZ3 LYS 334 3HZ LYS 334 4.133 30.482 -0.332 223 H GLN 335 H GLN 335 8.799 27.493 2.942 224 HA GLN 335 HA GLN 335 7.388 28.463 5.349 225 HB2 GLN 335 2HB GLN 335 8.662 25.765 4.723 226 HB3 GLN 335 1HB GLN 335 7.943 26.187 6.276 227 HG2 GLN 335 2HG GLN 335 5.741 26.346 5.294 228 HG3 GLN 335 1HG GLN 335 6.399 26.169 3.665 229 HE21 GLN 335 1HE2 GLN 335 7.114 24.160 2.985 230 HE22 GLN 335 2HE2 GLN 335 6.716 22.694 3.795 231 H LEU 336 H LEU 336 8.511 29.190 7.034 232 HA LEU 336 HA LEU 336 11.454 29.076 7.096 233 HB2 LEU 336 2HB LEU 336 9.496 31.166 8.138 234 HB3 LEU 336 1HB LEU 336 11.211 31.171 8.525 235 HG LEU 336 HG LEU 336 10.085 31.423 5.706 236 HD11 LEU 336 1HD1 LEU 336 10.733 33.785 5.807 237 HD12 LEU 336 2HD1 LEU 336 11.225 33.599 7.494 238 HD13 LEU 336 3HD1 LEU 336 9.529 33.409 7.040 239 HD21 LEU 336 1HD2 LEU 336 12.919 31.740 6.737 240 HD22 LEU 336 2HD2 LEU 336 12.384 32.032 5.080 241 HD23 LEU 336 3HD2 LEU 336 12.310 30.408 5.750 242 H LEU 337 H LEU 337 12.310 28.025 8.763 243 HA LEU 337 HA LEU 337 10.638 26.849 10.854 244 HB2 LEU 337 2HB LEU 337 13.506 26.455 9.918 245 HB3 LEU 337 1HB LEU 337 12.995 25.808 11.469 246 HG LEU 337 HG LEU 337 11.495 25.077 8.924 247 HD11 LEU 337 1HD1 LEU 337 12.843 23.043 8.730 248 HD12 LEU 337 2HD1 LEU 337 13.912 23.602 10.022 249 HD13 LEU 337 3HD1 LEU 337 13.830 24.486 8.494 250 HD21 LEU 337 1HD2 LEU 337 11.802 23.642 11.595 251 HD22 LEU 337 2HD2 LEU 337 10.839 23.087 10.222 252 HD23 LEU 337 3HD2 LEU 337 10.387 24.562 11.070 253 H CYS 338 H CYS 338 10.221 28.173 12.573 254 HA CYS 338 HA CYS 338 12.002 30.127 13.637 255 HB2 CYS 338 2HB CYS 338 9.582 30.098 14.215 256 HB3 CYS 338 1HB CYS 338 9.816 28.589 15.112 257 H ASP 339 H ASP 339 13.930 29.696 14.498 258 HA ASP 339 HA ASP 339 15.027 27.168 14.415 259 HB2 ASP 339 2HB ASP 339 16.295 29.309 14.298 260 HB3 ASP 339 1HB ASP 339 16.065 29.536 16.031 261 H GLU 340 H GLU 340 14.075 28.953 17.413 262 HA GLU 340 HA GLU 340 15.057 26.820 19.072 263 HB2 GLU 340 2HB GLU 340 14.959 28.288 20.821 264 HB3 GLU 340 1HB GLU 340 14.873 29.467 19.539 265 HG2 GLU 340 2HG GLU 340 12.344 28.389 20.782 266 HG3 GLU 340 1HG GLU 340 13.279 29.620 21.609 267 H CYS 341 H CYS 341 11.840 27.838 17.987 268 HA CYS 341 HA CYS 341 10.365 25.942 19.599 269 HB2 CYS 341 2HB CYS 341 9.536 27.455 17.090 270 HB3 CYS 341 1HB CYS 341 8.442 26.483 18.071 271 H ASP 342 H ASP 342 12.084 25.776 16.616 272 HA ASP 342 HA ASP 342 12.512 24.250 15.036 273 HB2 ASP 342 2HB ASP 342 12.936 22.794 17.038 274 HB3 ASP 342 1HB ASP 342 11.272 22.238 16.970 275 H MET 343 H MET 343 9.697 25.529 15.273 276 HA MET 343 HA MET 343 8.118 23.633 13.637 277 HB2 MET 343 2HB MET 343 7.253 26.079 15.234 278 HB3 MET 343 1HB MET 343 6.179 25.208 14.145 279 HG2 MET 343 2HG MET 343 7.497 24.055 16.611 280 HG3 MET 343 1HG MET 343 5.827 24.592 16.471 281 HE1 MET 343 1HE MET 343 8.455 21.932 15.112 282 HE2 MET 343 2HE MET 343 7.437 20.509 15.315 283 HE3 MET 343 3HE MET 343 7.840 21.508 16.711 284 H ALA 344 H ALA 344 7.557 24.092 11.619 285 HA ALA 344 HA ALA 344 8.712 26.395 10.255 286 HB1 ALA 344 1HB ALA 344 7.894 25.297 8.180 287 HB2 ALA 344 2HB ALA 344 7.118 24.043 9.153 288 HB3 ALA 344 3HB ALA 344 8.879 24.206 9.159 289 H PHE 345 H PHE 345 7.552 27.979 9.251 290 HA PHE 345 HA PHE 345 4.613 28.153 9.533 291 HB2 PHE 345 2HB PHE 345 6.695 30.200 10.413 292 HB3 PHE 345 1HB PHE 345 5.117 30.736 9.866 293 HD1 PHE 345 HD1 PHE 345 6.308 28.040 12.226 294 HD2 PHE 345 HD2 PHE 345 3.786 31.438 11.630 295 HE1 PHE 345 HE1 PHE 345 5.452 27.810 14.501 296 HE2 PHE 345 HE2 PHE 345 2.928 31.195 13.925 297 HZ PHE 345 HZ PHE 345 3.758 29.374 15.359 298 H HIS 346 H HIS 346 3.831 28.456 7.435 299 HA HIS 346 HA HIS 346 5.329 29.322 5.210 300 HB2 HIS 346 2HB HIS 346 2.351 29.438 5.786 301 HB3 HIS 346 1HB HIS 346 2.993 30.155 4.319 302 HD2 HIS 346 HD2 HIS 346 4.111 28.321 2.474 303 HE1 HIS 346 HE1 HIS 346 2.089 25.032 4.201 304 HE2 HIS 346 HE2 HIS 346 3.194 25.928 2.108 305 H LEU 347 H LEU 347 5.455 31.330 4.189 306 HA LEU 347 HA LEU 347 5.948 33.636 5.627 307 HB2 LEU 347 2HB LEU 347 5.159 33.179 2.726 308 HB3 LEU 347 1HB LEU 347 5.682 34.754 3.329 309 HG LEU 347 HG LEU 347 7.375 32.223 3.433 310 HD11 LEU 347 1HD1 LEU 347 7.058 32.868 1.115 311 HD12 LEU 347 2HD1 LEU 347 8.710 33.202 1.625 312 HD13 LEU 347 3HD1 LEU 347 7.552 34.526 1.475 313 HD21 LEU 347 1HD2 LEU 347 7.943 33.797 5.211 314 HD22 LEU 347 2HD2 LEU 347 8.103 35.107 4.038 315 HD23 LEU 347 3HD2 LEU 347 9.225 33.744 4.002 316 H TYR 348 H TYR 348 2.923 32.624 4.064 317 HA TYR 348 HA TYR 348 1.466 34.980 4.991 318 HB2 TYR 348 2HB TYR 348 -0.463 33.967 3.717 319 HB3 TYR 348 1HB TYR 348 0.955 34.336 2.748 320 HD1 TYR 348 HD1 TYR 348 2.416 32.480 1.891 321 HD2 TYR 348 HD2 TYR 348 -1.254 31.651 3.919 322 HE1 TYR 348 HE1 TYR 348 2.429 30.208 0.987 323 HE2 TYR 348 HE2 TYR 348 -1.237 29.369 3.002 324 HH TYR 348 HH TYR 348 -0.273 28.124 1.141 325 H CYS 349 H CYS 349 2.229 31.972 6.336 326 HA CYS 349 HA CYS 349 -0.148 31.849 8.070 327 HB2 CYS 349 2HB CYS 349 2.345 30.100 7.966 328 HB3 CYS 349 1HB CYS 349 1.095 29.921 9.190 329 H LEU 350 H LEU 350 2.253 33.941 7.967 330 HA LEU 350 HA LEU 350 3.041 34.014 10.782 331 HB2 LEU 350 2HB LEU 350 3.772 35.824 8.442 332 HB3 LEU 350 1HB LEU 350 4.442 35.959 10.066 333 HG LEU 350 HG LEU 350 4.788 33.567 8.212 334 HD11 LEU 350 1HD1 LEU 350 7.135 34.228 8.043 335 HD12 LEU 350 2HD1 LEU 350 6.813 35.679 8.997 336 HD13 LEU 350 3HD1 LEU 350 6.066 35.479 7.409 337 HD21 LEU 350 1HD2 LEU 350 4.750 32.878 10.549 338 HD22 LEU 350 2HD2 LEU 350 5.978 34.081 10.952 339 HD23 LEU 350 3HD2 LEU 350 6.377 32.730 9.887 340 H LYS 351 H LYS 351 3.153 36.517 11.524 341 HA LYS 351 HA LYS 351 0.728 38.006 11.099 342 HB2 LYS 351 2HB LYS 351 -0.026 36.149 12.645 343 HB3 LYS 351 1HB LYS 351 1.164 36.682 13.821 344 HG2 LYS 351 2HG LYS 351 -1.128 37.432 14.364 345 HG3 LYS 351 1HG LYS 351 -0.006 38.779 14.147 346 HD2 LYS 351 2HD LYS 351 -2.214 39.223 13.105 347 HD3 LYS 351 1HD LYS 351 -0.910 39.228 11.917 348 HE2 LYS 351 2HE LYS 351 -2.885 38.079 11.035 349 HE3 LYS 351 1HE LYS 351 -1.559 36.935 11.216 350 HZ1 LYS 351 1HZ LYS 351 -2.566 36.149 13.266 351 HZ2 LYS 351 2HZ LYS 351 -3.658 36.016 11.983 352 HZ3 LYS 351 3HZ LYS 351 -3.828 37.266 13.108 353 HA PRO 352 HA PRO 352 0.845 39.992 10.278 354 HB2 PRO 352 2HB PRO 352 2.425 41.697 8.830 355 HB3 PRO 352 1HB PRO 352 1.538 42.215 10.271 356 HG2 PRO 352 2HG PRO 352 4.439 41.389 10.032 357 HG3 PRO 352 1HG PRO 352 3.754 42.813 10.847 358 HD2 PRO 352 2HD PRO 352 4.446 40.584 12.227 359 HD3 PRO 352 1HD PRO 352 3.048 41.573 12.706 360 HA PRO 353 HA PRO 353 2.443 36.742 7.564 361 HB2 PRO 353 2HB PRO 353 0.688 37.064 5.448 362 HB3 PRO 353 1HB PRO 353 0.276 36.239 6.957 363 HG2 PRO 353 2HG PRO 353 -0.276 39.094 6.151 364 HG3 PRO 353 1HG PRO 353 -1.374 37.917 6.903 365 HD2 PRO 353 2HD PRO 353 -0.174 39.808 8.388 366 HD3 PRO 353 1HD PRO 353 -0.390 38.160 9.026 367 H LEU 354 H LEU 354 4.335 36.990 6.619 368 HA LEU 354 HA LEU 354 5.100 39.288 5.060 369 HB2 LEU 354 2HB LEU 354 6.550 36.673 5.638 370 HB3 LEU 354 1HB LEU 354 7.267 38.030 4.775 371 HG LEU 354 HG LEU 354 6.348 38.048 7.680 372 HD11 LEU 354 1HD1 LEU 354 8.400 36.761 7.369 373 HD12 LEU 354 2HD1 LEU 354 8.717 38.249 8.257 374 HD13 LEU 354 3HD1 LEU 354 9.161 38.129 6.550 375 HD21 LEU 354 1HD2 LEU 354 7.349 40.296 7.831 376 HD22 LEU 354 2HD2 LEU 354 6.005 40.252 6.697 377 HD23 LEU 354 3HD2 LEU 354 7.663 40.276 6.092 378 H THR 355 H THR 355 5.520 39.364 2.853 379 HA THR 355 HA THR 355 4.136 37.432 1.155 380 HB THR 355 HB THR 355 3.949 39.915 0.745 381 HG1 THR 355 HG1 THR 355 3.631 39.469 -1.298 382 HG21 THR 355 1HG2 THR 355 5.764 41.115 -0.404 383 HG22 THR 355 2HG2 THR 355 6.824 39.714 -0.233 384 HG23 THR 355 3HG2 THR 355 6.287 40.595 1.200 385 H SER 356 H SER 356 7.321 38.108 2.273 386 HA SER 356 HA SER 356 8.593 36.102 0.580 387 HB2 SER 356 2HB SER 356 10.422 37.738 -0.070 388 HB3 SER 356 1HB SER 356 8.850 38.139 -0.777 389 HG SER 356 HG SER 356 9.116 39.314 1.641 390 H VAL 357 H VAL 357 10.723 35.522 1.367 391 HA VAL 357 HA VAL 357 11.027 35.358 4.179 392 HB VAL 357 HB VAL 357 13.057 34.840 1.951 393 HG11 VAL 357 1HG1 VAL 357 14.303 33.445 3.594 394 HG12 VAL 357 2HG1 VAL 357 13.193 33.966 4.865 395 HG13 VAL 357 3HG1 VAL 357 14.246 35.143 4.079 396 HG21 VAL 357 1HG2 VAL 357 11.060 33.415 1.727 397 HG22 VAL 357 2HG2 VAL 357 11.222 32.886 3.403 398 HG23 VAL 357 3HG2 VAL 357 12.451 32.440 2.217 399 HA PRO 358 HA PRO 358 13.126 39.382 4.679 400 HB2 PRO 358 2HB PRO 358 13.485 39.338 7.370 401 HB3 PRO 358 1HB PRO 358 11.880 39.565 6.657 402 HG2 PRO 358 2HG PRO 358 13.119 37.051 7.773 403 HG3 PRO 358 1HG PRO 358 11.484 37.697 8.033 404 HD2 PRO 358 2HD PRO 358 12.032 35.711 6.215 405 HD3 PRO 358 1HD PRO 358 10.694 36.860 6.012 406 HA PRO 359 HA PRO 359 17.488 38.002 4.841 407 HB2 PRO 359 2HB PRO 359 18.775 40.377 4.845 408 HB3 PRO 359 1HB PRO 359 17.856 39.835 3.428 409 HG2 PRO 359 2HG PRO 359 17.002 41.735 5.622 410 HG3 PRO 359 1HG PRO 359 16.857 41.938 3.862 411 HD2 PRO 359 2HD PRO 359 14.774 41.069 5.422 412 HD3 PRO 359 1HD PRO 359 14.975 40.561 3.729 413 H GLU 360 H GLU 360 15.802 38.964 7.450 414 HA GLU 360 HA GLU 360 17.763 39.679 9.384 415 HB2 GLU 360 2HB GLU 360 14.957 38.531 9.677 416 HB3 GLU 360 1HB GLU 360 15.920 39.145 11.021 417 HG2 GLU 360 2HG GLU 360 15.944 41.388 10.009 418 HG3 GLU 360 1HG GLU 360 15.042 40.785 8.617 419 HA PRO 361 HA PRO 361 19.602 35.656 9.824 420 HB2 PRO 361 2HB PRO 361 21.239 36.099 11.951 421 HB3 PRO 361 1HB PRO 361 21.494 36.878 10.384 422 HG2 PRO 361 2HG PRO 361 20.228 37.998 12.876 423 HG3 PRO 361 1HG PRO 361 21.367 38.771 11.754 424 HD2 PRO 361 2HD PRO 361 18.631 39.181 11.711 425 HD3 PRO 361 1HD PRO 361 19.687 39.393 10.297 426 H GLU 362 H GLU 362 18.403 36.944 12.971 427 HA GLU 362 HA GLU 362 18.033 34.225 14.015 428 HB2 GLU 362 2HB GLU 362 17.548 35.408 16.189 429 HB3 GLU 362 1HB GLU 362 19.154 35.729 15.548 430 HG2 GLU 362 2HG GLU 362 18.428 37.920 14.737 431 HG3 GLU 362 1HG GLU 362 16.783 37.608 15.283 432 H TRP 363 H TRP 363 16.345 33.879 12.372 433 HA TRP 363 HA TRP 363 13.881 35.367 12.576 434 HB2 TRP 363 2HB TRP 363 14.728 34.340 10.389 435 HB3 TRP 363 1HB TRP 363 14.257 32.762 11.026 436 HD1 TRP 363 HD1 TRP 363 12.778 36.012 9.669 437 HE1 TRP 363 HE1 TRP 363 10.264 35.710 9.266 438 HE3 TRP 363 HE3 TRP 363 12.119 31.412 11.849 439 HZ2 TRP 363 HZ2 TRP 363 8.284 33.818 9.796 440 HZ3 TRP 363 HZ3 TRP 363 9.852 30.444 11.869 441 HH2 TRP 363 HH2 TRP 363 7.969 31.631 10.869 442 H TYR 364 H TYR 364 12.274 34.978 13.895 443 HA TYR 364 HA TYR 364 11.735 32.273 14.928 444 HB2 TYR 364 2HB TYR 364 11.494 34.809 16.601 445 HB3 TYR 364 1HB TYR 364 11.139 33.167 17.126 446 HD1 TYR 364 HD1 TYR 364 13.181 31.449 17.087 447 HD2 TYR 364 HD2 TYR 364 13.630 35.712 17.036 448 HE1 TYR 364 HE1 TYR 364 15.483 31.226 17.904 449 HE2 TYR 364 HE2 TYR 364 15.928 35.475 17.858 450 HH TYR 364 HH TYR 364 17.251 33.803 19.161 451 H CYS 365 H CYS 365 9.466 32.134 15.762 452 HA CYS 365 HA CYS 365 7.623 32.975 13.727 453 HB2 CYS 365 2HB CYS 365 6.008 31.581 14.950 454 HB3 CYS 365 1HB CYS 365 7.537 30.723 14.790 455 HA PRO 366 HA PRO 366 5.615 36.634 15.551 456 HB2 PRO 366 2HB PRO 366 3.053 35.025 15.452 457 HB3 PRO 366 1HB PRO 366 3.365 36.675 14.888 458 HG2 PRO 366 2HG PRO 366 3.214 34.656 13.159 459 HG3 PRO 366 1HG PRO 366 4.408 35.948 12.930 460 HD2 PRO 366 2HD PRO 366 4.807 33.138 13.890 461 HD3 PRO 366 1HD PRO 366 5.886 34.168 12.925 462 H SER 367 H SER 367 4.694 33.471 16.799 463 HA SER 367 HA SER 367 3.573 34.143 19.246 464 HB2 SER 367 2HB SER 367 5.113 31.618 18.541 465 HB3 SER 367 1HB SER 367 3.909 31.788 19.825 466 HG SER 367 HG SER 367 2.509 31.285 18.351 467 H CYS 368 H CYS 368 6.946 34.050 18.345 468 HA CYS 368 HA CYS 368 8.013 33.966 21.034 469 HB2 CYS 368 2HB CYS 368 9.185 34.152 18.266 470 HB3 CYS 368 1HB CYS 368 10.190 34.590 19.646 471 H ARG 369 H ARG 369 6.866 36.493 18.930 472 HA ARG 369 HA ARG 369 8.155 38.573 20.618 473 HB2 ARG 369 2HB ARG 369 8.189 40.038 18.581 474 HB3 ARG 369 1HB ARG 369 9.217 38.620 18.464 475 HG2 ARG 369 2HG ARG 369 8.282 38.536 16.366 476 HG3 ARG 369 1HG ARG 369 7.083 37.581 17.230 477 HD2 ARG 369 2HD ARG 369 6.001 39.204 15.737 478 HD3 ARG 369 1HD ARG 369 5.629 39.568 17.425 479 HE ARG 369 HE ARG 369 7.899 41.047 16.590 480 HH11 ARG 369 1HH1 ARG 369 4.411 41.030 16.194 481 HH12 ARG 369 2HH1 ARG 369 4.321 42.727 15.860 482 HH21 ARG 369 1HH2 ARG 369 7.784 43.254 16.154 483 HH22 ARG 369 2HH2 ARG 369 6.252 43.999 15.835 484 H THR 370 H THR 370 5.234 37.215 20.069 485 HA THR 370 HA THR 370 3.594 39.636 19.954 486 HB THR 370 HB THR 370 2.884 37.582 18.701 487 HG1 THR 370 HG1 THR 370 0.791 37.970 19.115 488 HG21 THR 370 1HG2 THR 370 3.627 35.880 20.367 489 HG22 THR 370 2HG2 THR 370 1.947 35.660 19.874 490 HG23 THR 370 3HG2 THR 370 2.319 36.391 21.437 491 H ASP 371 H ASP 371 1.830 39.928 21.523 492 HA ASP 371 HA ASP 371 2.738 39.733 24.281 493 HB2 ASP 371 2HB ASP 371 0.185 40.948 23.124 494 HB3 ASP 371 1HB ASP 371 0.729 41.111 24.792 495 H SER 372 H SER 372 0.491 38.098 22.167 496 HA SER 372 HA SER 372 -1.302 37.084 24.149 497 HB2 SER 372 2HB SER 372 -2.124 35.614 22.253 498 HB3 SER 372 1HB SER 372 -2.090 37.336 21.870 499 HG SER 372 HG SER 372 -0.816 36.870 20.285 500 H SER 373 H SER 373 1.017 35.281 22.098 501 HA SER 373 HA SER 373 0.974 32.942 23.750 502 HB2 SER 373 2HB SER 373 3.006 33.644 21.588 503 HB3 SER 373 1HB SER 373 2.619 32.036 22.211 504 HG SER 373 HG SER 373 0.704 33.702 20.958 505 H GLU 374 H GLU 374 2.585 32.140 25.071 506 HA GLU 374 HA GLU 374 4.083 34.112 26.571 507 HB2 GLU 374 2HB GLU 374 4.457 32.279 28.158 508 HB3 GLU 374 1HB GLU 374 2.762 32.331 27.684 509 HG2 GLU 374 2HG GLU 374 3.200 30.458 26.078 510 HG3 GLU 374 1HG GLU 374 4.856 30.380 26.674 511 H VAL 375 H VAL 375 6.340 33.397 27.358 512 HA VAL 375 HA VAL 375 8.135 32.981 25.133 513 HB VAL 375 HB VAL 375 8.784 33.043 28.123 514 HG11 VAL 375 1HG1 VAL 375 11.087 33.648 27.390 515 HG12 VAL 375 2HG1 VAL 375 10.595 33.440 25.708 516 HG13 VAL 375 3HG1 VAL 375 10.603 32.053 26.799 517 HG21 VAL 375 1HG2 VAL 375 8.783 35.347 26.132 518 HG22 VAL 375 2HG2 VAL 375 9.361 35.439 27.797 519 HG23 VAL 375 3HG2 VAL 375 7.653 35.131 27.473 520 H VAL 376 H VAL 376 9.180 31.097 24.587 521 HA VAL 376 HA VAL 376 8.167 28.577 25.418 522 HB VAL 376 HB VAL 376 9.950 27.574 23.999 523 HG11 VAL 376 1HG1 VAL 376 8.611 29.974 22.687 524 HG12 VAL 376 2HG1 VAL 376 7.888 28.377 22.903 525 HG13 VAL 376 3HG1 VAL 376 9.280 28.576 21.836 526 HG21 VAL 376 1HG2 VAL 376 11.808 29.112 24.548 527 HG22 VAL 376 2HG2 VAL 376 10.992 30.422 23.693 528 HG23 VAL 376 3HG2 VAL 376 11.574 29.017 22.800 529 H GLN 377 H GLN 377 9.286 26.844 26.456 530 HA GLN 377 HA GLN 377 10.859 27.736 28.771 531 HB2 GLN 377 2HB GLN 377 10.223 25.548 29.760 532 HB3 GLN 377 1HB GLN 377 8.817 26.479 29.250 533 HG2 GLN 377 2HG GLN 377 8.636 25.085 27.212 534 HG3 GLN 377 1HG GLN 377 10.045 24.156 27.727 535 HE21 GLN 377 1HE2 GLN 377 6.695 24.910 28.431 536 HE22 GLN 377 2HE2 GLN 377 6.392 23.532 29.426 537 H ALA 378 H ALA 378 12.598 26.356 29.591 538 HA ALA 378 HA ALA 378 14.516 25.512 27.610 539 HB1 ALA 378 1HB ALA 378 15.210 26.683 29.669 540 HB2 ALA 378 2HB ALA 378 15.988 25.103 29.549 541 HB3 ALA 378 3HB ALA 378 14.620 25.336 30.643 542 H GLY 379 H GLY 379 15.748 23.322 28.203 543 HA2 GLY 379 2HA GLY 379 15.709 21.019 28.129 544 HA3 GLY 379 1HA GLY 379 14.100 21.041 28.850 545 H GLU 380 H GLU 380 14.652 22.953 26.092 546 HA GLU 380 HA GLU 380 12.681 21.700 24.492 547 HB2 GLU 380 2HB GLU 380 14.016 23.442 22.725 548 HB3 GLU 380 1HB GLU 380 12.601 23.817 23.687 549 HG2 GLU 380 2HG GLU 380 14.299 25.565 23.857 550 HG3 GLU 380 1HG GLU 380 13.986 24.822 25.419 Start of MODEL 3 1 H1 SER 303 H SER 303 13.798 -0.129 16.063 2 HA SER 303 HA SER 303 14.757 2.482 16.801 3 HB2 SER 303 2HB SER 303 15.762 0.440 17.748 4 HB3 SER 303 1HB SER 303 16.270 -0.086 16.143 5 HG SER 303 HG SER 303 17.113 2.451 16.918 6 H GLY 304 H GLY 304 14.058 1.087 13.789 7 HA2 GLY 304 2HA GLY 304 16.061 2.149 12.089 8 HA3 GLY 304 1HA GLY 304 14.430 1.701 11.611 9 HA PRO 305 HA PRO 305 15.295 6.462 11.736 10 HB2 PRO 305 2HB PRO 305 15.624 7.047 9.104 11 HB3 PRO 305 1HB PRO 305 16.945 6.399 10.088 12 HG2 PRO 305 2HG PRO 305 15.081 4.926 8.218 13 HG3 PRO 305 1HG PRO 305 16.856 4.846 8.313 14 HD2 PRO 305 2HD PRO 305 15.270 2.982 9.491 15 HD3 PRO 305 1HD PRO 305 16.824 3.476 10.202 16 H SER 306 H SER 306 12.847 4.498 10.638 17 HA SER 306 HA SER 306 11.063 6.288 9.366 18 HB2 SER 306 2HB SER 306 9.339 4.511 10.142 19 HB3 SER 306 1HB SER 306 10.644 3.971 9.086 20 HG SER 306 HG SER 306 10.682 2.514 10.678 21 H CYS 307 H CYS 307 9.254 7.416 10.201 22 HA CYS 307 HA CYS 307 9.668 8.759 12.678 23 HB2 CYS 307 2HB CYS 307 7.649 8.940 10.474 24 HB3 CYS 307 1HB CYS 307 7.203 9.632 12.024 25 H ARG 308 H ARG 308 9.160 8.003 14.616 26 HA ARG 308 HA ARG 308 7.073 6.062 15.149 27 HB2 ARG 308 2HB ARG 308 8.786 7.721 17.061 28 HB3 ARG 308 1HB ARG 308 7.756 6.372 17.526 29 HG2 ARG 308 2HG ARG 308 10.131 6.091 15.654 30 HG3 ARG 308 1HG ARG 308 10.239 5.884 17.401 31 HD2 ARG 308 2HD ARG 308 10.045 3.684 16.485 32 HD3 ARG 308 1HD ARG 308 8.471 4.060 17.179 33 HE ARG 308 HE ARG 308 7.536 4.031 15.088 34 HH11 ARG 308 1HH1 ARG 308 11.036 3.913 14.702 35 HH12 ARG 308 2HH1 ARG 308 10.943 3.560 13.007 36 HH21 ARG 308 1HH2 ARG 308 7.452 3.548 12.878 37 HH22 ARG 308 2HH2 ARG 308 8.921 3.309 11.989 38 H PHE 309 H PHE 309 7.658 9.517 15.672 39 HA PHE 309 HA PHE 309 5.375 9.994 17.342 40 HB2 PHE 309 2HB PHE 309 7.244 11.951 15.931 41 HB3 PHE 309 1HB PHE 309 6.076 12.390 17.171 42 HD1 PHE 309 HD1 PHE 309 6.685 12.274 19.485 43 HD2 PHE 309 HD2 PHE 309 9.151 10.338 16.579 44 HE1 PHE 309 HE1 PHE 309 8.388 11.840 21.208 45 HE2 PHE 309 HE2 PHE 309 10.846 9.908 18.310 46 HZ PHE 309 HZ PHE 309 10.464 10.658 20.624 47 H CYS 310 H CYS 310 5.600 9.645 13.970 48 HA CYS 310 HA CYS 310 3.115 11.220 13.521 49 HB2 CYS 310 2HB CYS 310 5.129 10.607 11.327 50 HB3 CYS 310 1HB CYS 310 3.849 11.818 11.331 51 H LYS 311 H LYS 311 4.575 8.119 13.478 52 HA LYS 311 HA LYS 311 4.212 6.074 12.608 53 HB2 LYS 311 2HB LYS 311 1.415 7.145 12.018 54 HB3 LYS 311 1HB LYS 311 1.886 5.464 11.776 55 HG2 LYS 311 2HG LYS 311 2.313 5.208 14.171 56 HG3 LYS 311 1HG LYS 311 1.942 6.911 14.448 57 HD2 LYS 311 2HD LYS 311 -0.385 6.539 13.753 58 HD3 LYS 311 1HD LYS 311 -0.032 4.849 13.385 59 HE2 LYS 311 2HE LYS 311 -1.182 5.118 15.566 60 HE3 LYS 311 1HE LYS 311 0.413 4.394 15.758 61 HZ1 LYS 311 1HZ LYS 311 -0.060 6.096 17.419 62 HZ2 LYS 311 2HZ LYS 311 -0.227 7.264 16.208 63 HZ3 LYS 311 3HZ LYS 311 1.270 6.521 16.465 64 H ASP 312 H ASP 312 2.401 8.127 10.401 65 HA ASP 312 HA ASP 312 3.421 8.996 8.325 66 HB2 ASP 312 2HB ASP 312 5.087 7.098 7.990 67 HB3 ASP 312 1HB ASP 312 3.747 6.022 7.603 68 H ASP 313 H ASP 313 1.269 9.607 8.723 69 HA ASP 313 HA ASP 313 -0.892 7.706 8.285 70 HB2 ASP 313 2HB ASP 313 -0.869 9.293 10.250 71 HB3 ASP 313 1HB ASP 313 -1.068 10.631 9.124 72 H GLU 314 H GLU 314 -2.660 8.115 6.860 73 HA GLU 314 HA GLU 314 -1.791 8.908 4.251 74 HB2 GLU 314 2HB GLU 314 -3.998 8.167 3.444 75 HB3 GLU 314 1HB GLU 314 -3.265 6.970 4.501 76 HG2 GLU 314 2HG GLU 314 -5.410 8.914 5.416 77 HG3 GLU 314 1HG GLU 314 -5.759 7.314 4.771 78 H ASN 315 H ASN 315 -3.838 10.422 6.700 79 HA ASN 315 HA ASN 315 -4.903 12.505 5.013 80 HB2 ASN 315 2HB ASN 315 -4.681 12.366 8.061 81 HB3 ASN 315 1HB ASN 315 -5.549 13.618 7.181 82 HD21 ASN 315 1HD2 ASN 315 -5.562 10.257 8.137 83 HD22 ASN 315 2HD2 ASN 315 -7.212 9.957 7.739 84 H LYS 316 H LYS 316 -2.494 12.535 7.656 85 HA LYS 316 HA LYS 316 -0.863 14.508 6.181 86 HB2 LYS 316 2HB LYS 316 -1.465 14.607 9.165 87 HB3 LYS 316 1HB LYS 316 -0.260 15.605 8.357 88 HG2 LYS 316 2HG LYS 316 -2.070 16.626 6.985 89 HG3 LYS 316 1HG LYS 316 -3.258 15.671 7.879 90 HD2 LYS 316 2HD LYS 316 -2.578 16.798 9.976 91 HD3 LYS 316 1HD LYS 316 -1.387 17.748 9.078 92 HE2 LYS 316 2HE LYS 316 -4.408 17.852 8.716 93 HE3 LYS 316 1HE LYS 316 -3.408 19.072 9.504 94 HZ1 LYS 316 1HZ LYS 316 -2.233 19.316 7.323 95 HZ2 LYS 316 2HZ LYS 316 -3.843 19.823 7.324 96 HZ3 LYS 316 3HZ LYS 316 -3.429 18.340 6.629 97 HA PRO 317 HA PRO 317 1.816 10.933 6.941 98 HB2 PRO 317 2HB PRO 317 4.000 11.845 5.503 99 HB3 PRO 317 1HB PRO 317 2.581 11.089 4.772 100 HG2 PRO 317 2HG PRO 317 3.288 14.000 4.987 101 HG3 PRO 317 1HG PRO 317 2.537 13.120 3.639 102 HD2 PRO 317 2HD PRO 317 1.117 14.673 5.393 103 HD3 PRO 317 1HD PRO 317 0.411 13.273 4.573 104 H CYS 318 H CYS 318 2.915 14.269 7.376 105 HA CYS 318 HA CYS 318 3.995 13.576 10.010 106 HB2 CYS 318 2HB CYS 318 5.554 14.961 7.815 107 HB3 CYS 318 1HB CYS 318 5.893 15.288 9.510 108 H ARG 319 H ARG 319 2.809 14.787 11.379 109 HA ARG 319 HA ARG 319 2.105 17.564 10.717 110 HB2 ARG 319 2HB ARG 319 0.266 16.378 11.682 111 HB3 ARG 319 1HB ARG 319 1.266 15.670 12.944 112 HG2 ARG 319 2HG ARG 319 1.431 17.765 14.110 113 HG3 ARG 319 1HG ARG 319 0.673 18.643 12.780 114 HD2 ARG 319 2HD ARG 319 -0.821 18.180 14.781 115 HD3 ARG 319 1HD ARG 319 -1.466 17.661 13.222 116 HE ARG 319 HE ARG 319 -0.191 15.804 15.167 117 HH11 ARG 319 1HH1 ARG 319 -2.760 16.515 12.869 118 HH12 ARG 319 2HH1 ARG 319 -3.529 14.972 13.060 119 HH21 ARG 319 1HH2 ARG 319 -1.208 13.766 15.391 120 HH22 ARG 319 2HH2 ARG 319 -2.652 13.421 14.492 121 H LYS 320 H LYS 320 3.831 15.723 13.263 122 HA LYS 320 HA LYS 320 4.760 18.000 14.702 123 HB2 LYS 320 2HB LYS 320 5.700 15.108 14.747 124 HB3 LYS 320 1HB LYS 320 6.239 16.339 15.891 125 HG2 LYS 320 2HG LYS 320 3.949 16.619 16.717 126 HG3 LYS 320 1HG LYS 320 3.355 15.459 15.524 127 HD2 LYS 320 2HD LYS 320 4.732 13.684 16.593 128 HD3 LYS 320 1HD LYS 320 5.281 14.852 17.802 129 HE2 LYS 320 2HE LYS 320 2.392 14.005 17.370 130 HE3 LYS 320 1HE LYS 320 3.452 13.402 18.645 131 HZ1 LYS 320 1HZ LYS 320 2.595 16.226 18.299 132 HZ2 LYS 320 2HZ LYS 320 3.622 15.652 19.511 133 HZ3 LYS 320 3HZ LYS 320 2.016 15.144 19.464 134 H CYS 321 H CYS 321 5.993 16.480 11.850 135 HA CYS 321 HA CYS 321 8.612 17.842 12.052 136 HB2 CYS 321 2HB CYS 321 7.616 15.965 9.860 137 HB3 CYS 321 1HB CYS 321 9.266 16.547 10.080 138 H ALA 322 H ALA 322 5.739 18.969 11.453 139 HA ALA 322 HA ALA 322 6.252 20.316 8.855 140 HB1 ALA 322 1HB ALA 322 3.845 20.168 8.390 141 HB2 ALA 322 2HB ALA 322 3.569 19.339 9.925 142 HB3 ALA 322 3HB ALA 322 4.514 18.557 8.657 143 H CYS 323 H CYS 323 4.637 22.162 8.574 144 HA CYS 323 HA CYS 323 4.754 24.072 10.757 145 HB2 CYS 323 2HB CYS 323 5.161 25.028 8.632 146 HB3 CYS 323 1HB CYS 323 3.860 24.138 7.864 147 H HIS 324 H HIS 324 3.337 23.721 12.396 148 HA HIS 324 HA HIS 324 1.004 22.128 12.200 149 HB2 HIS 324 2HB HIS 324 2.164 23.847 14.413 150 HB3 HIS 324 1HB HIS 324 0.591 23.087 14.615 151 HD1 HIS 324 HD1 HIS 324 1.453 21.600 16.546 152 HD2 HIS 324 HD2 HIS 324 3.454 21.039 12.950 153 HE1 HIS 324 HE1 HIS 324 2.840 19.509 16.829 154 H VAL 325 H VAL 325 1.455 25.463 11.561 155 HA VAL 325 HA VAL 325 -1.004 26.541 12.382 156 HB VAL 325 HB VAL 325 0.639 27.504 9.999 157 HG11 VAL 325 1HG1 VAL 325 -1.574 28.589 10.173 158 HG12 VAL 325 2HG1 VAL 325 -0.286 29.738 10.534 159 HG13 VAL 325 3HG1 VAL 325 -1.238 29.041 11.848 160 HG21 VAL 325 1HG2 VAL 325 1.028 28.215 12.937 161 HG22 VAL 325 2HG2 VAL 325 1.870 28.965 11.579 162 HG23 VAL 325 3HG2 VAL 325 2.130 27.259 11.940 163 H CYS 326 H CYS 326 -0.027 24.855 9.467 164 HA CYS 326 HA CYS 326 -2.840 24.678 8.531 165 HB2 CYS 326 2HB CYS 326 -1.926 24.507 6.218 166 HB3 CYS 326 1HB CYS 326 -1.503 26.035 6.978 167 H GLY 327 H GLY 327 -0.359 23.000 9.938 168 HA2 GLY 327 2HA GLY 327 0.174 20.815 10.291 169 HA3 GLY 327 1HA GLY 327 -1.414 20.417 9.656 170 H GLY 328 H GLY 328 1.336 21.972 7.970 171 HA2 GLY 328 2HA GLY 328 1.813 19.605 6.322 172 HA3 GLY 328 1HA GLY 328 1.040 20.953 5.506 173 H ARG 329 H ARG 329 3.594 19.672 5.011 174 HA ARG 329 HA ARG 329 5.552 21.862 5.368 175 HB2 ARG 329 2HB ARG 329 5.947 19.084 4.153 176 HB3 ARG 329 1HB ARG 329 7.220 20.238 4.552 177 HG2 ARG 329 2HG ARG 329 6.742 19.985 6.934 178 HG3 ARG 329 1HG ARG 329 5.374 18.933 6.575 179 HD2 ARG 329 2HD ARG 329 7.220 17.568 7.296 180 HD3 ARG 329 1HD ARG 329 6.967 17.283 5.572 181 HE ARG 329 HE ARG 329 9.017 19.220 6.419 182 HH11 ARG 329 1HH1 ARG 329 8.265 16.168 4.858 183 HH12 ARG 329 2HH1 ARG 329 9.912 15.849 4.414 184 HH21 ARG 329 1HH2 ARG 329 11.173 18.798 5.805 185 HH22 ARG 329 2HH2 ARG 329 11.551 17.337 4.946 186 H GLU 330 H GLU 330 3.079 21.623 3.510 187 HA GLU 330 HA GLU 330 3.957 21.397 0.811 188 HB2 GLU 330 2HB GLU 330 1.423 22.737 1.856 189 HB3 GLU 330 1HB GLU 330 1.691 22.108 0.229 190 HG2 GLU 330 2HG GLU 330 1.904 19.813 1.219 191 HG3 GLU 330 1HG GLU 330 1.500 20.489 2.792 192 H ALA 331 H ALA 331 4.753 22.924 -0.537 193 HA ALA 331 HA ALA 331 5.666 24.806 -1.358 194 HB1 ALA 331 1HB ALA 331 3.593 26.039 -0.831 195 HB2 ALA 331 2HB ALA 331 5.023 27.052 -0.634 196 HB3 ALA 331 3HB ALA 331 4.204 26.390 0.786 197 HA PRO 332 HA PRO 332 8.920 24.151 1.860 198 HB2 PRO 332 2HB PRO 332 10.935 23.419 0.181 199 HB3 PRO 332 1HB PRO 332 9.627 22.309 0.613 200 HG2 PRO 332 2HG PRO 332 9.926 24.006 -1.868 201 HG3 PRO 332 1HG PRO 332 9.484 22.288 -1.742 202 HD2 PRO 332 2HD PRO 332 7.627 24.265 -2.060 203 HD3 PRO 332 1HD PRO 332 7.277 22.768 -1.167 204 H GLU 333 H GLU 333 9.076 26.151 -1.034 205 HA GLU 333 HA GLU 333 11.431 27.632 -0.257 206 HB2 GLU 333 2HB GLU 333 10.473 29.197 -2.244 207 HB3 GLU 333 1HB GLU 333 11.373 27.727 -2.549 208 HG2 GLU 333 2HG GLU 333 9.492 27.855 -4.032 209 HG3 GLU 333 1HG GLU 333 9.279 26.508 -2.930 210 H LYS 334 H LYS 334 7.998 27.989 0.210 211 HA LYS 334 HA LYS 334 8.326 30.689 1.273 212 HB2 LYS 334 2HB LYS 334 5.859 29.005 0.724 213 HB3 LYS 334 1HB LYS 334 5.769 30.526 1.614 214 HG2 LYS 334 2HG LYS 334 6.778 31.699 -0.333 215 HG3 LYS 334 1HG LYS 334 6.775 30.179 -1.229 216 HD2 LYS 334 2HD LYS 334 4.300 31.619 -0.173 217 HD3 LYS 334 1HD LYS 334 4.866 31.650 -1.846 218 HE2 LYS 334 2HE LYS 334 3.883 29.216 -0.318 219 HE3 LYS 334 1HE LYS 334 3.023 30.063 -1.604 220 HZ1 LYS 334 1HZ LYS 334 4.924 29.462 -3.075 221 HZ2 LYS 334 2HZ LYS 334 4.015 28.149 -2.532 222 HZ3 LYS 334 3HZ LYS 334 5.517 28.483 -1.838 223 H GLN 335 H GLN 335 9.043 27.801 2.536 224 HA GLN 335 HA GLN 335 7.763 27.975 5.119 225 HB2 GLN 335 2HB GLN 335 10.057 26.244 4.131 226 HB3 GLN 335 1HB GLN 335 9.495 26.212 5.801 227 HG2 GLN 335 2HG GLN 335 7.222 25.570 4.953 228 HG3 GLN 335 1HG GLN 335 7.918 25.445 3.335 229 HE21 GLN 335 1HE2 GLN 335 7.532 23.249 3.135 230 HE22 GLN 335 2HE2 GLN 335 8.361 22.053 4.065 231 H LEU 336 H LEU 336 8.530 28.717 6.966 232 HA LEU 336 HA LEU 336 11.245 29.845 7.178 233 HB2 LEU 336 2HB LEU 336 8.641 31.100 8.138 234 HB3 LEU 336 1HB LEU 336 10.232 31.638 8.659 235 HG LEU 336 HG LEU 336 9.213 31.714 5.799 236 HD11 LEU 336 1HD1 LEU 336 9.163 34.165 6.069 237 HD12 LEU 336 2HD1 LEU 336 9.603 33.993 7.769 238 HD13 LEU 336 3HD1 LEU 336 8.057 33.369 7.185 239 HD21 LEU 336 1HD2 LEU 336 11.247 33.024 5.300 240 HD22 LEU 336 2HD2 LEU 336 11.636 31.397 5.845 241 HD23 LEU 336 3HD2 LEU 336 11.822 32.761 6.951 242 H LEU 337 H LEU 337 12.181 28.451 8.487 243 HA LEU 337 HA LEU 337 10.669 26.946 10.490 244 HB2 LEU 337 2HB LEU 337 13.535 26.637 9.470 245 HB3 LEU 337 1HB LEU 337 12.861 25.673 10.773 246 HG LEU 337 HG LEU 337 11.126 24.803 9.142 247 HD11 LEU 337 1HD1 LEU 337 11.203 26.559 7.434 248 HD12 LEU 337 2HD1 LEU 337 11.541 24.980 6.729 249 HD13 LEU 337 3HD1 LEU 337 12.863 26.112 7.028 250 HD21 LEU 337 1HD2 LEU 337 12.644 23.181 8.073 251 HD22 LEU 337 2HD2 LEU 337 13.092 23.457 9.755 252 HD23 LEU 337 3HD2 LEU 337 14.028 24.207 8.460 253 H CYS 338 H CYS 338 10.333 28.112 12.301 254 HA CYS 338 HA CYS 338 12.171 29.943 13.495 255 HB2 CYS 338 2HB CYS 338 9.656 29.920 13.899 256 HB3 CYS 338 1HB CYS 338 9.895 28.486 14.908 257 H ASP 339 H ASP 339 14.126 29.215 14.146 258 HA ASP 339 HA ASP 339 14.895 26.654 14.903 259 HB2 ASP 339 2HB ASP 339 16.092 29.333 15.732 260 HB3 ASP 339 1HB ASP 339 16.892 27.783 15.986 261 H GLU 340 H GLU 340 13.956 29.367 16.981 262 HA GLU 340 HA GLU 340 14.219 28.398 19.533 263 HB2 GLU 340 2HB GLU 340 13.518 30.688 19.042 264 HB3 GLU 340 1HB GLU 340 12.011 30.120 18.339 265 HG2 GLU 340 2HG GLU 340 11.564 31.070 20.495 266 HG3 GLU 340 1HG GLU 340 11.269 29.337 20.564 267 H CYS 341 H CYS 341 11.379 27.958 17.422 268 HA CYS 341 HA CYS 341 9.963 26.360 19.415 269 HB2 CYS 341 2HB CYS 341 9.135 27.429 16.684 270 HB3 CYS 341 1HB CYS 341 8.075 26.493 17.744 271 H ASP 342 H ASP 342 12.183 25.724 16.990 272 HA ASP 342 HA ASP 342 12.667 24.108 15.483 273 HB2 ASP 342 2HB ASP 342 11.506 22.416 17.745 274 HB3 ASP 342 1HB ASP 342 12.342 21.709 16.363 275 H MET 343 H MET 343 10.352 25.396 14.848 276 HA MET 343 HA MET 343 8.573 23.327 13.717 277 HB2 MET 343 2HB MET 343 7.597 24.436 15.806 278 HB3 MET 343 1HB MET 343 7.628 25.963 14.943 279 HG2 MET 343 2HG MET 343 5.489 25.441 14.406 280 HG3 MET 343 1HG MET 343 6.201 24.378 13.197 281 HE1 MET 343 1HE MET 343 7.427 22.017 15.203 282 HE2 MET 343 2HE MET 343 6.595 21.667 13.687 283 HE3 MET 343 3HE MET 343 6.067 20.894 15.180 284 H ALA 344 H ALA 344 8.321 23.578 11.609 285 HA ALA 344 HA ALA 344 9.202 25.825 10.101 286 HB1 ALA 344 1HB ALA 344 8.116 24.720 8.184 287 HB2 ALA 344 2HB ALA 344 7.326 23.574 9.273 288 HB3 ALA 344 3HB ALA 344 9.084 23.570 9.112 289 H PHE 345 H PHE 345 7.984 27.416 9.113 290 HA PHE 345 HA PHE 345 5.071 27.574 9.604 291 HB2 PHE 345 2HB PHE 345 7.079 29.863 9.933 292 HB3 PHE 345 1HB PHE 345 5.339 30.108 9.797 293 HD1 PHE 345 HD1 PHE 345 8.010 28.681 11.977 294 HD2 PHE 345 HD2 PHE 345 3.881 29.754 11.680 295 HE1 PHE 345 HE1 PHE 345 7.742 28.355 14.400 296 HE2 PHE 345 HE2 PHE 345 3.628 29.424 14.104 297 HZ PHE 345 HZ PHE 345 5.555 28.721 15.467 298 H HIS 346 H HIS 346 4.314 29.550 8.048 299 HA HIS 346 HA HIS 346 5.819 29.486 5.503 300 HB2 HIS 346 2HB HIS 346 2.828 28.972 5.821 301 HB3 HIS 346 1HB HIS 346 3.534 29.484 4.298 302 HD2 HIS 346 HD2 HIS 346 5.667 27.625 3.445 303 HE1 HIS 346 HE1 HIS 346 3.490 24.357 5.015 304 HE2 HIS 346 HE2 HIS 346 5.172 25.100 3.282 305 H LEU 347 H LEU 347 5.535 31.349 4.217 306 HA LEU 347 HA LEU 347 5.493 33.842 5.421 307 HB2 LEU 347 2HB LEU 347 4.947 32.974 2.562 308 HB3 LEU 347 1HB LEU 347 5.048 34.670 3.006 309 HG LEU 347 HG LEU 347 7.319 32.666 3.372 310 HD11 LEU 347 1HD1 LEU 347 6.929 33.047 0.987 311 HD12 LEU 347 2HD1 LEU 347 8.427 33.820 1.498 312 HD13 LEU 347 3HD1 LEU 347 6.980 34.796 1.233 313 HD21 LEU 347 1HD2 LEU 347 8.699 34.648 3.833 314 HD22 LEU 347 2HD2 LEU 347 7.392 34.500 5.002 315 HD23 LEU 347 3HD2 LEU 347 7.277 35.687 3.700 316 H TYR 348 H TYR 348 2.825 32.051 4.054 317 HA TYR 348 HA TYR 348 0.884 34.215 4.443 318 HB2 TYR 348 2HB TYR 348 -0.645 32.726 3.076 319 HB3 TYR 348 1HB TYR 348 0.794 33.271 2.234 320 HD1 TYR 348 HD1 TYR 348 -1.211 30.410 2.944 321 HD2 TYR 348 HD2 TYR 348 2.849 31.556 2.235 322 HE1 TYR 348 HE1 TYR 348 -0.656 28.096 2.300 323 HE2 TYR 348 HE2 TYR 348 3.390 29.251 1.596 324 HH TYR 348 HH TYR 348 1.089 26.915 0.908 325 H CYS 349 H CYS 349 2.100 31.712 6.230 326 HA CYS 349 HA CYS 349 -0.382 31.158 7.731 327 HB2 CYS 349 2HB CYS 349 2.401 29.922 7.895 328 HB3 CYS 349 1HB CYS 349 1.083 29.514 8.994 329 H LEU 350 H LEU 350 1.593 33.672 7.678 330 HA LEU 350 HA LEU 350 2.167 33.899 10.569 331 HB2 LEU 350 2HB LEU 350 3.080 35.673 8.261 332 HB3 LEU 350 1HB LEU 350 3.575 35.839 9.941 333 HG LEU 350 HG LEU 350 4.242 33.505 8.112 334 HD11 LEU 350 1HD1 LEU 350 6.034 35.696 9.190 335 HD12 LEU 350 2HD1 LEU 350 5.499 35.501 7.518 336 HD13 LEU 350 3HD1 LEU 350 6.559 34.297 8.247 337 HD21 LEU 350 1HD2 LEU 350 5.056 33.957 11.004 338 HD22 LEU 350 2HD2 LEU 350 5.689 32.688 9.953 339 HD23 LEU 350 3HD2 LEU 350 3.985 32.690 10.397 340 H LYS 351 H LYS 351 1.717 35.966 11.629 341 HA LYS 351 HA LYS 351 -0.309 37.724 10.419 342 HB2 LYS 351 2HB LYS 351 -1.259 35.914 12.141 343 HB3 LYS 351 1HB LYS 351 -0.577 36.980 13.361 344 HG2 LYS 351 2HG LYS 351 -2.661 37.786 11.288 345 HG3 LYS 351 1HG LYS 351 -3.016 37.334 12.956 346 HD2 LYS 351 2HD LYS 351 -1.719 39.297 13.753 347 HD3 LYS 351 1HD LYS 351 -1.360 39.741 12.082 348 HE2 LYS 351 2HE LYS 351 -3.782 40.077 11.654 349 HE3 LYS 351 1HE LYS 351 -4.137 39.635 13.325 350 HZ1 LYS 351 1HZ LYS 351 -2.838 41.546 14.051 351 HZ2 LYS 351 2HZ LYS 351 -4.113 42.021 13.043 352 HZ3 LYS 351 3HZ LYS 351 -2.531 41.973 12.446 353 HA PRO 352 HA PRO 352 -0.137 39.552 9.661 354 HB2 PRO 352 2HB PRO 352 1.287 41.553 8.525 355 HB3 PRO 352 1HB PRO 352 0.244 41.841 9.927 356 HG2 PRO 352 2HG PRO 352 3.238 41.454 9.831 357 HG3 PRO 352 1HG PRO 352 2.293 42.660 10.733 358 HD2 PRO 352 2HD PRO 352 3.256 40.328 11.851 359 HD3 PRO 352 1HD PRO 352 1.826 41.182 12.456 360 HA PRO 353 HA PRO 353 2.177 36.736 7.044 361 HB2 PRO 353 2HB PRO 353 0.818 37.003 4.664 362 HB3 PRO 353 1HB PRO 353 0.160 36.148 6.066 363 HG2 PRO 353 2HG PRO 353 -0.355 38.978 5.157 364 HG3 PRO 353 1HG PRO 353 -1.521 37.748 5.695 365 HD2 PRO 353 2HD PRO 353 -0.661 39.717 7.352 366 HD3 PRO 353 1HD PRO 353 -1.027 38.085 7.960 367 H LEU 354 H LEU 354 4.095 36.909 6.055 368 HA LEU 354 HA LEU 354 4.983 39.459 4.880 369 HB2 LEU 354 2HB LEU 354 6.532 36.938 5.624 370 HB3 LEU 354 1HB LEU 354 7.260 38.415 5.002 371 HG LEU 354 HG LEU 354 5.773 38.198 7.656 372 HD11 LEU 354 1HD1 LEU 354 7.982 38.392 8.727 373 HD12 LEU 354 2HD1 LEU 354 8.767 38.341 7.145 374 HD13 LEU 354 3HD1 LEU 354 7.874 36.936 7.737 375 HD21 LEU 354 1HD2 LEU 354 7.383 40.513 6.512 376 HD22 LEU 354 2HD2 LEU 354 6.666 40.449 8.125 377 HD23 LEU 354 3HD2 LEU 354 5.629 40.462 6.702 378 H THR 355 H THR 355 6.051 39.518 2.808 379 HA THR 355 HA THR 355 5.172 37.473 0.879 380 HB THR 355 HB THR 355 4.772 39.864 0.305 381 HG1 THR 355 HG1 THR 355 5.424 38.082 -1.300 382 HG21 THR 355 1HG2 THR 355 6.767 40.912 1.332 383 HG22 THR 355 2HG2 THR 355 6.625 41.343 -0.370 384 HG23 THR 355 3HG2 THR 355 7.801 40.127 0.125 385 H SER 356 H SER 356 7.934 38.301 2.704 386 HA SER 356 HA SER 356 9.599 36.285 1.455 387 HB2 SER 356 2HB SER 356 10.047 38.283 0.023 388 HB3 SER 356 1HB SER 356 10.519 39.203 1.451 389 HG SER 356 HG SER 356 12.364 38.415 0.497 390 H VAL 357 H VAL 357 11.732 36.102 2.673 391 HA VAL 357 HA VAL 357 11.340 36.233 5.521 392 HB VAL 357 HB VAL 357 12.555 34.333 4.516 393 HG11 VAL 357 1HG1 VAL 357 14.833 34.559 3.573 394 HG12 VAL 357 2HG1 VAL 357 14.719 36.315 3.714 395 HG13 VAL 357 3HG1 VAL 357 13.641 35.447 2.620 396 HG21 VAL 357 1HG2 VAL 357 13.090 34.886 6.862 397 HG22 VAL 357 2HG2 VAL 357 14.392 35.951 6.331 398 HG23 VAL 357 3HG2 VAL 357 14.504 34.213 6.045 399 HA PRO 358 HA PRO 358 13.298 40.363 6.194 400 HB2 PRO 358 2HB PRO 358 14.081 39.898 8.847 401 HB3 PRO 358 1HB PRO 358 12.474 40.450 8.361 402 HG2 PRO 358 2HG PRO 358 13.422 37.649 8.956 403 HG3 PRO 358 1HG PRO 358 11.936 38.464 9.493 404 HD2 PRO 358 2HD PRO 358 11.843 36.737 7.464 405 HD3 PRO 358 1HD PRO 358 10.906 38.249 7.372 406 HA PRO 359 HA PRO 359 17.712 39.548 5.599 407 HB2 PRO 359 2HB PRO 359 18.921 41.776 6.622 408 HB3 PRO 359 1HB PRO 359 17.951 41.828 5.142 409 HG2 PRO 359 2HG PRO 359 17.125 42.511 7.972 410 HG3 PRO 359 1HG PRO 359 16.886 43.458 6.487 411 HD2 PRO 359 2HD PRO 359 14.902 41.928 7.499 412 HD3 PRO 359 1HD PRO 359 15.129 42.086 5.740 413 H GLU 360 H GLU 360 16.334 39.412 8.633 414 HA GLU 360 HA GLU 360 18.507 39.122 10.396 415 HB2 GLU 360 2HB GLU 360 15.710 37.924 10.485 416 HB3 GLU 360 1HB GLU 360 16.841 37.896 11.838 417 HG2 GLU 360 2HG GLU 360 16.807 40.341 11.958 418 HG3 GLU 360 1HG GLU 360 15.768 40.424 10.536 419 HA PRO 361 HA PRO 361 19.989 35.110 8.852 420 HB2 PRO 361 2HB PRO 361 22.018 34.724 10.601 421 HB3 PRO 361 1HB PRO 361 22.097 35.996 9.372 422 HG2 PRO 361 2HG PRO 361 21.341 36.222 12.288 423 HG3 PRO 361 1HG PRO 361 22.456 37.237 11.345 424 HD2 PRO 361 2HD PRO 361 19.862 37.946 11.854 425 HD3 PRO 361 1HD PRO 361 20.723 38.458 10.387 426 H GLU 362 H GLU 362 18.562 35.743 11.892 427 HA GLU 362 HA GLU 362 17.987 32.891 12.402 428 HB2 GLU 362 2HB GLU 362 17.995 33.517 14.885 429 HB3 GLU 362 1HB GLU 362 19.574 33.499 14.105 430 HG2 GLU 362 2HG GLU 362 19.369 36.003 13.840 431 HG3 GLU 362 1HG GLU 362 17.918 35.931 14.838 432 H TRP 363 H TRP 363 15.950 32.772 11.700 433 HA TRP 363 HA TRP 363 14.091 35.010 12.001 434 HB2 TRP 363 2HB TRP 363 14.182 33.801 9.806 435 HB3 TRP 363 1HB TRP 363 13.618 32.332 10.600 436 HD1 TRP 363 HD1 TRP 363 12.391 35.802 9.494 437 HE1 TRP 363 HE1 TRP 363 9.826 35.849 9.534 438 HE3 TRP 363 HE3 TRP 363 11.509 31.243 11.657 439 HZ2 TRP 363 HZ2 TRP 363 7.711 34.201 10.359 440 HZ3 TRP 363 HZ3 TRP 363 9.174 30.558 12.035 441 HH2 TRP 363 HH2 TRP 363 7.313 32.010 11.400 442 H TYR 364 H TYR 364 12.765 35.154 13.635 443 HA TYR 364 HA TYR 364 11.807 32.735 15.051 444 HB2 TYR 364 2HB TYR 364 11.967 35.615 16.056 445 HB3 TYR 364 1HB TYR 364 11.351 34.242 16.977 446 HD1 TYR 364 HD1 TYR 364 14.331 36.109 16.077 447 HD2 TYR 364 HD2 TYR 364 12.972 32.310 17.491 448 HE1 TYR 364 HE1 TYR 364 16.605 35.576 16.853 449 HE2 TYR 364 HE2 TYR 364 15.241 31.785 18.268 450 HH TYR 364 HH TYR 364 17.786 34.155 18.292 451 H CYS 365 H CYS 365 9.568 32.661 15.550 452 HA CYS 365 HA CYS 365 7.847 33.770 13.512 453 HB2 CYS 365 2HB CYS 365 6.115 32.342 14.506 454 HB3 CYS 365 1HB CYS 365 7.607 31.430 14.306 455 HA PRO 366 HA PRO 366 6.097 37.326 15.749 456 HB2 PRO 366 2HB PRO 366 3.332 36.822 15.440 457 HB3 PRO 366 1HB PRO 366 4.352 37.672 14.274 458 HG2 PRO 366 2HG PRO 366 3.538 34.764 14.326 459 HG3 PRO 366 1HG PRO 366 3.599 35.887 12.945 460 HD2 PRO 366 2HD PRO 366 5.548 34.114 13.281 461 HD3 PRO 366 1HD PRO 366 5.962 35.777 12.810 462 H SER 367 H SER 367 4.802 34.110 16.391 463 HA SER 367 HA SER 367 3.590 34.404 18.874 464 HB2 SER 367 2HB SER 367 5.154 31.954 17.995 465 HB3 SER 367 1HB SER 367 3.695 32.014 18.987 466 HG SER 367 HG SER 367 2.503 32.539 17.178 467 H CYS 368 H CYS 368 7.006 34.351 18.111 468 HA CYS 368 HA CYS 368 7.931 33.711 20.784 469 HB2 CYS 368 2HB CYS 368 9.254 34.249 18.141 470 HB3 CYS 368 1HB CYS 368 10.210 34.534 19.594 471 H ARG 369 H ARG 369 7.638 36.686 18.789 472 HA ARG 369 HA ARG 369 8.971 38.292 20.845 473 HB2 ARG 369 2HB ARG 369 8.762 40.182 19.270 474 HB3 ARG 369 1HB ARG 369 9.545 38.790 18.535 475 HG2 ARG 369 2HG ARG 369 7.559 38.269 17.240 476 HG3 ARG 369 1HG ARG 369 6.618 39.500 18.091 477 HD2 ARG 369 2HD ARG 369 7.380 40.224 15.811 478 HD3 ARG 369 1HD ARG 369 7.942 41.285 17.108 479 HE ARG 369 HE ARG 369 9.768 39.174 16.268 480 HH11 ARG 369 1HH1 ARG 369 8.947 42.577 15.989 481 HH12 ARG 369 2HH1 ARG 369 10.491 43.014 15.333 482 HH21 ARG 369 1HH2 ARG 369 11.785 39.754 15.417 483 HH22 ARG 369 2HH2 ARG 369 12.100 41.408 15.008 484 H THR 370 H THR 370 5.755 37.582 19.826 485 HA THR 370 HA THR 370 4.624 39.158 22.009 486 HB THR 370 HB THR 370 4.482 40.650 19.991 487 HG1 THR 370 HG1 THR 370 2.792 40.532 21.685 488 HG21 THR 370 1HG2 THR 370 2.949 40.115 18.140 489 HG22 THR 370 2HG2 THR 370 2.681 38.504 18.808 490 HG23 THR 370 3HG2 THR 370 4.278 38.956 18.204 491 H ASP 371 H ASP 371 2.122 38.536 22.065 492 HA ASP 371 HA ASP 371 2.058 35.607 22.147 493 HB2 ASP 371 2HB ASP 371 0.194 37.723 23.314 494 HB3 ASP 371 1HB ASP 371 -0.062 35.988 23.486 495 H SER 372 H SER 372 2.101 36.179 19.620 496 HA SER 372 HA SER 372 -0.579 36.251 18.428 497 HB2 SER 372 2HB SER 372 1.295 37.548 17.388 498 HB3 SER 372 1HB SER 372 2.194 36.055 17.139 499 HG SER 372 HG SER 372 -0.281 36.787 15.966 500 H SER 373 H SER 373 -0.654 34.191 19.978 501 HA SER 373 HA SER 373 -0.754 31.816 18.402 502 HB2 SER 373 2HB SER 373 1.713 31.870 18.818 503 HB3 SER 373 1HB SER 373 1.422 31.912 20.555 504 HG SER 373 HG SER 373 1.249 29.826 20.489 505 H GLU 374 H GLU 374 -1.249 29.884 19.860 506 HA GLU 374 HA GLU 374 -3.310 30.556 21.785 507 HB2 GLU 374 2HB GLU 374 -2.217 27.855 20.873 508 HB3 GLU 374 1HB GLU 374 -3.698 28.097 21.803 509 HG2 GLU 374 2HG GLU 374 -4.679 29.323 19.888 510 HG3 GLU 374 1HG GLU 374 -3.201 29.074 18.963 511 H VAL 375 H VAL 375 -3.328 29.017 23.832 512 HA VAL 375 HA VAL 375 -1.122 29.592 25.529 513 HB VAL 375 HB VAL 375 -2.268 28.106 27.200 514 HG11 VAL 375 1HG1 VAL 375 -2.916 30.469 27.062 515 HG12 VAL 375 2HG1 VAL 375 -4.320 29.476 27.455 516 HG13 VAL 375 3HG1 VAL 375 -4.111 30.096 25.815 517 HG21 VAL 375 1HG2 VAL 375 -4.476 27.104 26.651 518 HG22 VAL 375 2HG2 VAL 375 -3.183 26.386 25.691 519 HG23 VAL 375 3HG2 VAL 375 -4.268 27.571 24.959 520 H VAL 376 H VAL 376 0.198 27.979 26.710 521 HA VAL 376 HA VAL 376 1.775 26.462 24.980 522 HB VAL 376 HB VAL 376 2.888 25.530 27.055 523 HG11 VAL 376 1HG1 VAL 376 3.810 27.696 27.817 524 HG12 VAL 376 2HG1 VAL 376 2.478 28.551 27.036 525 HG13 VAL 376 3HG1 VAL 376 3.645 27.658 26.059 526 HG21 VAL 376 1HG2 VAL 376 0.802 27.180 28.558 527 HG22 VAL 376 2HG2 VAL 376 2.220 26.415 29.283 528 HG23 VAL 376 3HG2 VAL 376 0.946 25.420 28.577 529 H GLN 377 H GLN 377 1.465 24.567 24.046 530 HA GLN 377 HA GLN 377 -0.799 22.931 24.556 531 HB2 GLN 377 2HB GLN 377 0.023 21.474 22.716 532 HB3 GLN 377 1HB GLN 377 -0.029 23.167 22.268 533 HG2 GLN 377 2HG GLN 377 2.522 21.716 23.047 534 HG3 GLN 377 1HG GLN 377 1.959 21.877 21.390 535 HE21 GLN 377 1HE2 GLN 377 1.042 24.645 21.737 536 HE22 GLN 377 2HE2 GLN 377 2.466 25.616 21.816 537 H ALA 378 H ALA 378 -0.938 21.749 26.350 538 HA ALA 378 HA ALA 378 1.239 20.344 27.604 539 HB1 ALA 378 1HB ALA 378 -1.760 20.147 28.087 540 HB2 ALA 378 2HB ALA 378 -0.642 21.220 28.930 541 HB3 ALA 378 3HB ALA 378 -0.499 19.473 29.128 542 H GLY 379 H GLY 379 1.183 17.954 27.961 543 HA2 GLY 379 2HA GLY 379 1.315 15.818 27.086 544 HA3 GLY 379 1HA GLY 379 0.067 16.246 25.917 545 H GLU 380 H GLU 380 3.311 17.503 26.626 546 HA GLU 380 HA GLU 380 3.938 18.167 23.973 547 HB2 GLU 380 2HB GLU 380 6.299 18.513 24.875 548 HB3 GLU 380 1HB GLU 380 5.019 19.425 25.659 549 HG2 GLU 380 2HG GLU 380 5.055 17.922 27.580 550 HG3 GLU 380 1HG GLU 380 6.225 16.870 26.782 Start of MODEL 4 1 H1 SER 303 H SER 303 16.108 9.401 0.619 2 HA SER 303 HA SER 303 17.255 11.924 -0.371 3 HB2 SER 303 2HB SER 303 15.280 10.217 -1.955 4 HB3 SER 303 1HB SER 303 15.814 11.836 -2.396 5 HG SER 303 HG SER 303 18.025 10.614 -2.095 6 H GLY 304 H GLY 304 15.537 10.761 1.942 7 HA2 GLY 304 2HA GLY 304 13.028 12.172 1.842 8 HA3 GLY 304 1HA GLY 304 13.779 11.452 3.261 9 HA PRO 305 HA PRO 305 14.181 16.288 3.109 10 HB2 PRO 305 2HB PRO 305 12.074 16.359 5.225 11 HB3 PRO 305 1HB PRO 305 12.202 17.311 3.741 12 HG2 PRO 305 2HG PRO 305 10.351 15.376 3.991 13 HG3 PRO 305 1HG PRO 305 11.168 15.680 2.440 14 HD2 PRO 305 2HD PRO 305 11.748 13.533 4.492 15 HD3 PRO 305 1HD PRO 305 11.604 13.391 2.722 16 H SER 306 H SER 306 14.749 17.715 5.061 17 HA SER 306 HA SER 306 16.790 16.571 6.609 18 HB2 SER 306 2HB SER 306 15.268 19.175 7.103 19 HB3 SER 306 1HB SER 306 16.814 18.745 7.841 20 HG SER 306 HG SER 306 17.784 18.835 5.862 21 H CYS 307 H CYS 307 16.458 15.009 8.080 22 HA CYS 307 HA CYS 307 14.117 15.080 9.867 23 HB2 CYS 307 2HB CYS 307 14.847 12.913 7.884 24 HB3 CYS 307 1HB CYS 307 13.888 12.550 9.320 25 H ARG 308 H ARG 308 15.171 15.384 11.743 26 HA ARG 308 HA ARG 308 16.986 13.232 12.720 27 HB2 ARG 308 2HB ARG 308 17.008 16.162 13.624 28 HB3 ARG 308 1HB ARG 308 18.127 14.896 14.118 29 HG2 ARG 308 2HG ARG 308 17.910 16.072 11.327 30 HG3 ARG 308 1HG ARG 308 19.142 16.481 12.523 31 HD2 ARG 308 2HD ARG 308 20.035 14.214 12.431 32 HD3 ARG 308 1HD ARG 308 18.739 13.703 11.341 33 HE ARG 308 HE ARG 308 20.956 15.554 10.682 34 HH11 ARG 308 1HH1 ARG 308 18.405 13.402 9.566 35 HH12 ARG 308 2HH1 ARG 308 18.798 13.607 7.890 36 HH21 ARG 308 1HH2 ARG 308 21.467 15.801 8.475 37 HH22 ARG 308 2HH2 ARG 308 20.535 14.965 7.276 38 H PHE 309 H PHE 309 14.492 15.621 13.470 39 HA PHE 309 HA PHE 309 14.072 14.957 16.222 40 HB2 PHE 309 2HB PHE 309 12.363 16.550 14.262 41 HB3 PHE 309 1HB PHE 309 12.058 16.460 15.988 42 HD1 PHE 309 HD1 PHE 309 13.236 17.879 17.522 43 HD2 PHE 309 HD2 PHE 309 14.441 17.735 13.423 44 HE1 PHE 309 HE1 PHE 309 14.632 19.872 17.858 45 HE2 PHE 309 HE2 PHE 309 15.847 19.728 13.773 46 HZ PHE 309 HZ PHE 309 15.944 20.796 15.989 47 H CYS 310 H CYS 310 13.251 13.074 13.612 48 HA CYS 310 HA CYS 310 10.554 12.312 14.581 49 HB2 CYS 310 2HB CYS 310 9.960 12.391 11.999 50 HB3 CYS 310 1HB CYS 310 9.957 13.878 12.941 51 H LYS 311 H LYS 311 13.468 11.433 12.819 52 HA LYS 311 HA LYS 311 14.426 9.513 12.164 53 HB2 LYS 311 2HB LYS 311 12.174 8.113 13.658 54 HB3 LYS 311 1HB LYS 311 13.517 7.259 12.906 55 HG2 LYS 311 2HG LYS 311 15.094 8.405 14.426 56 HG3 LYS 311 1HG LYS 311 13.751 9.280 15.166 57 HD2 LYS 311 2HD LYS 311 14.434 7.361 16.561 58 HD3 LYS 311 1HD LYS 311 12.784 7.156 15.972 59 HE2 LYS 311 2HE LYS 311 13.623 5.612 14.206 60 HE3 LYS 311 1HE LYS 311 15.265 5.807 14.823 61 HZ1 LYS 311 1HZ LYS 311 14.145 3.774 15.604 62 HZ2 LYS 311 2HZ LYS 311 12.995 4.725 16.402 63 HZ3 LYS 311 3HZ LYS 311 14.617 4.787 16.876 64 H ASP 312 H ASP 312 11.019 9.843 11.444 65 HA ASP 312 HA ASP 312 9.688 9.429 9.713 66 HB2 ASP 312 2HB ASP 312 12.341 9.514 8.247 67 HB3 ASP 312 1HB ASP 312 10.816 9.255 7.397 68 H ASP 313 H ASP 313 9.218 7.508 10.888 69 HA ASP 313 HA ASP 313 9.932 4.927 9.934 70 HB2 ASP 313 2HB ASP 313 8.999 5.135 12.143 71 HB3 ASP 313 1HB ASP 313 7.588 6.004 11.546 72 H GLU 314 H GLU 314 8.769 3.563 8.572 73 HA GLU 314 HA GLU 314 7.818 4.710 6.168 74 HB2 GLU 314 2HB GLU 314 7.449 2.330 5.490 75 HB3 GLU 314 1HB GLU 314 9.051 2.622 6.162 76 HG2 GLU 314 2HG GLU 314 8.314 1.671 8.328 77 HG3 GLU 314 1HG GLU 314 6.715 1.373 7.648 78 H ASN 315 H ASN 315 6.135 3.746 9.033 79 HA ASN 315 HA ASN 315 3.516 3.539 7.711 80 HB2 ASN 315 2HB ASN 315 4.067 1.780 9.340 81 HB3 ASN 315 1HB ASN 315 4.416 2.983 10.573 82 HD21 ASN 315 1HD2 ASN 315 2.943 2.074 12.004 83 HD22 ASN 315 2HD2 ASN 315 1.231 2.202 11.804 84 H LYS 316 H LYS 316 5.356 5.647 9.901 85 HA LYS 316 HA LYS 316 3.020 7.472 10.142 86 HB2 LYS 316 2HB LYS 316 5.290 7.087 12.135 87 HB3 LYS 316 1HB LYS 316 3.948 8.217 12.314 88 HG2 LYS 316 2HG LYS 316 2.387 6.218 12.271 89 HG3 LYS 316 1HG LYS 316 3.817 5.185 12.315 90 HD2 LYS 316 2HD LYS 316 2.977 5.375 14.573 91 HD3 LYS 316 1HD LYS 316 4.479 6.297 14.482 92 HE2 LYS 316 2HE LYS 316 2.817 7.557 15.758 93 HE3 LYS 316 1HE LYS 316 3.144 8.392 14.239 94 HZ1 LYS 316 1HZ LYS 316 0.798 8.341 14.691 95 HZ2 LYS 316 2HZ LYS 316 0.803 6.658 14.814 96 HZ3 LYS 316 3HZ LYS 316 1.125 7.393 13.327 97 HA PRO 317 HA PRO 317 5.695 10.366 7.897 98 HB2 PRO 317 2HB PRO 317 3.942 12.395 7.596 99 HB3 PRO 317 1HB PRO 317 3.678 10.838 6.797 100 HG2 PRO 317 2HG PRO 317 2.450 11.892 9.340 101 HG3 PRO 317 1HG PRO 317 1.660 11.084 7.969 102 HD2 PRO 317 2HD PRO 317 2.396 9.782 10.290 103 HD3 PRO 317 1HD PRO 317 2.250 8.970 8.719 104 H CYS 318 H CYS 318 5.471 13.212 8.269 105 HA CYS 318 HA CYS 318 6.798 13.538 10.897 106 HB2 CYS 318 2HB CYS 318 7.156 15.080 8.303 107 HB3 CYS 318 1HB CYS 318 7.928 15.511 9.828 108 H ARG 319 H ARG 319 5.930 14.893 12.335 109 HA ARG 319 HA ARG 319 3.908 16.894 11.645 110 HB2 ARG 319 2HB ARG 319 3.604 15.455 13.666 111 HB3 ARG 319 1HB ARG 319 5.101 16.082 14.340 112 HG2 ARG 319 2HG ARG 319 3.210 17.160 15.411 113 HG3 ARG 319 1HG ARG 319 4.095 18.349 14.456 114 HD2 ARG 319 2HD ARG 319 1.675 18.648 14.201 115 HD3 ARG 319 1HD ARG 319 2.402 18.181 12.666 116 HE ARG 319 HE ARG 319 1.558 15.913 13.067 117 HH11 ARG 319 1HH1 ARG 319 0.030 18.463 14.951 118 HH12 ARG 319 2HH1 ARG 319 -1.458 17.593 15.129 119 HH21 ARG 319 1HH2 ARG 319 -0.380 14.800 13.319 120 HH22 ARG 319 2HH2 ARG 319 -1.691 15.521 14.197 121 H LYS 320 H LYS 320 7.166 16.654 13.070 122 HA LYS 320 HA LYS 320 7.542 19.528 13.290 123 HB2 LYS 320 2HB LYS 320 9.277 17.140 14.018 124 HB3 LYS 320 1HB LYS 320 9.802 18.806 14.248 125 HG2 LYS 320 2HG LYS 320 7.930 19.211 15.791 126 HG3 LYS 320 1HG LYS 320 7.345 17.562 15.544 127 HD2 LYS 320 2HD LYS 320 10.093 18.233 16.677 128 HD3 LYS 320 1HD LYS 320 8.674 17.941 17.682 129 HE2 LYS 320 2HE LYS 320 8.484 15.655 16.695 130 HE3 LYS 320 1HE LYS 320 9.947 15.956 15.756 131 HZ1 LYS 320 1HZ LYS 320 9.737 15.871 18.715 132 HZ2 LYS 320 2HZ LYS 320 11.144 16.245 17.857 133 HZ3 LYS 320 3HZ LYS 320 10.456 14.704 17.721 134 H CYS 321 H CYS 321 7.574 17.879 10.584 135 HA CYS 321 HA CYS 321 9.729 19.554 9.421 136 HB2 CYS 321 2HB CYS 321 8.733 16.866 8.413 137 HB3 CYS 321 1HB CYS 321 9.844 17.913 7.532 138 H ALA 322 H ALA 322 6.404 18.960 9.665 139 HA ALA 322 HA ALA 322 5.729 20.467 7.237 140 HB1 ALA 322 1HB ALA 322 3.386 20.036 7.904 141 HB2 ALA 322 2HB ALA 322 3.935 19.285 9.406 142 HB3 ALA 322 3HB ALA 322 4.303 18.527 7.857 143 H CYS 323 H CYS 323 4.142 22.277 7.627 144 HA CYS 323 HA CYS 323 4.924 24.018 9.860 145 HB2 CYS 323 2HB CYS 323 4.955 25.318 7.923 146 HB3 CYS 323 1HB CYS 323 3.617 24.456 7.181 147 H HIS 324 H HIS 324 3.850 23.573 11.670 148 HA HIS 324 HA HIS 324 1.477 22.023 11.796 149 HB2 HIS 324 2HB HIS 324 3.225 21.924 13.547 150 HB3 HIS 324 1HB HIS 324 2.923 23.605 13.973 151 HD1 HIS 324 HD1 HIS 324 1.028 24.041 15.645 152 HD2 HIS 324 HD2 HIS 324 1.125 20.122 14.293 153 HE1 HIS 324 HE1 HIS 324 -0.652 22.773 17.033 154 H VAL 325 H VAL 325 2.009 25.370 11.484 155 HA VAL 325 HA VAL 325 -0.145 26.569 12.782 156 HB VAL 325 HB VAL 325 1.042 27.577 10.160 157 HG11 VAL 325 1HG1 VAL 325 0.600 29.826 11.088 158 HG12 VAL 325 2HG1 VAL 325 -0.090 29.100 12.541 159 HG13 VAL 325 3HG1 VAL 325 -0.883 28.875 10.981 160 HG21 VAL 325 1HG2 VAL 325 2.823 28.699 11.461 161 HG22 VAL 325 2HG2 VAL 325 2.919 26.946 11.625 162 HG23 VAL 325 3HG2 VAL 325 2.249 27.918 12.937 163 H CYS 326 H CYS 326 0.020 24.877 9.726 164 HA CYS 326 HA CYS 326 -2.920 25.046 9.415 165 HB2 CYS 326 2HB CYS 326 -2.646 25.109 6.962 166 HB3 CYS 326 1HB CYS 326 -1.894 26.505 7.720 167 H GLY 327 H GLY 327 -0.253 23.079 9.890 168 HA2 GLY 327 2HA GLY 327 0.264 20.871 9.594 169 HA3 GLY 327 1HA GLY 327 -1.459 20.587 9.384 170 H GLY 328 H GLY 328 1.316 21.974 7.603 171 HA2 GLY 328 2HA GLY 328 0.782 20.344 5.256 172 HA3 GLY 328 1HA GLY 328 0.424 22.053 5.045 173 H ARG 329 H ARG 329 2.485 20.165 3.895 174 HA ARG 329 HA ARG 329 5.028 21.530 4.551 175 HB2 ARG 329 2HB ARG 329 4.359 19.037 2.939 176 HB3 ARG 329 1HB ARG 329 5.991 19.698 3.052 177 HG2 ARG 329 2HG ARG 329 6.003 19.316 5.478 178 HG3 ARG 329 1HG ARG 329 4.345 18.711 5.407 179 HD2 ARG 329 2HD ARG 329 6.057 16.901 5.536 180 HD3 ARG 329 1HD ARG 329 5.035 16.796 4.099 181 HE ARG 329 HE ARG 329 7.601 18.168 3.808 182 HH11 ARG 329 1HH1 ARG 329 5.807 15.186 3.310 183 HH12 ARG 329 2HH1 ARG 329 6.932 14.561 2.154 184 HH21 ARG 329 1HH2 ARG 329 9.036 17.346 2.269 185 HH22 ARG 329 2HH2 ARG 329 8.761 15.789 1.562 186 H GLU 330 H GLU 330 3.087 23.054 3.249 187 HA GLU 330 HA GLU 330 3.104 22.805 0.388 188 HB2 GLU 330 2HB GLU 330 2.064 25.221 1.878 189 HB3 GLU 330 1HB GLU 330 1.433 24.476 0.413 190 HG2 GLU 330 2HG GLU 330 0.469 22.668 1.680 191 HG3 GLU 330 1HG GLU 330 1.302 23.168 3.148 192 H ALA 331 H ALA 331 4.966 23.333 -0.606 193 HA ALA 331 HA ALA 331 6.784 24.416 -1.402 194 HB1 ALA 331 1HB ALA 331 6.892 26.859 -1.374 195 HB2 ALA 331 2HB ALA 331 5.614 26.920 -0.153 196 HB3 ALA 331 3HB ALA 331 5.262 26.317 -1.774 197 HA PRO 332 HA PRO 332 9.113 23.870 2.578 198 HB2 PRO 332 2HB PRO 332 11.323 22.730 1.349 199 HB3 PRO 332 1HB PRO 332 9.901 21.812 1.860 200 HG2 PRO 332 2HG PRO 332 10.580 22.901 -0.868 201 HG3 PRO 332 1HG PRO 332 9.969 21.290 -0.429 202 HD2 PRO 332 2HD PRO 332 8.321 23.174 -1.405 203 HD3 PRO 332 1HD PRO 332 7.771 22.069 -0.124 204 H GLU 333 H GLU 333 10.007 25.401 -0.467 205 HA GLU 333 HA GLU 333 12.204 26.964 0.328 206 HB2 GLU 333 2HB GLU 333 11.486 28.523 -1.533 207 HB3 GLU 333 1HB GLU 333 11.659 26.838 -2.008 208 HG2 GLU 333 2HG GLU 333 9.291 26.513 -2.105 209 HG3 GLU 333 1HG GLU 333 8.977 28.048 -1.296 210 H LYS 334 H LYS 334 8.747 27.432 0.843 211 HA LYS 334 HA LYS 334 9.192 30.070 2.103 212 HB2 LYS 334 2HB LYS 334 6.644 28.775 1.034 213 HB3 LYS 334 1HB LYS 334 6.677 30.312 1.903 214 HG2 LYS 334 2HG LYS 334 8.236 31.200 0.133 215 HG3 LYS 334 1HG LYS 334 7.984 29.703 -0.771 216 HD2 LYS 334 2HD LYS 334 5.698 31.531 0.060 217 HD3 LYS 334 1HD LYS 334 6.569 31.731 -1.459 218 HE2 LYS 334 2HE LYS 334 5.129 29.178 -0.669 219 HE3 LYS 334 1HE LYS 334 4.418 30.457 -1.656 220 HZ1 LYS 334 1HZ LYS 334 6.864 28.915 -2.345 221 HZ2 LYS 334 2HZ LYS 334 6.170 30.136 -3.283 222 HZ3 LYS 334 3HZ LYS 334 5.329 28.694 -3.022 223 H GLN 335 H GLN 335 9.204 26.974 3.120 224 HA GLN 335 HA GLN 335 7.699 27.321 5.565 225 HB2 GLN 335 2HB GLN 335 9.625 25.149 4.683 226 HB3 GLN 335 1HB GLN 335 8.983 25.216 6.323 227 HG2 GLN 335 2HG GLN 335 6.642 25.311 5.072 228 HG3 GLN 335 1HG GLN 335 7.559 24.607 3.746 229 HE21 GLN 335 1HE2 GLN 335 9.321 22.972 5.322 230 HE22 GLN 335 2HE2 GLN 335 8.368 21.703 5.999 231 H LEU 336 H LEU 336 8.314 28.716 7.007 232 HA LEU 336 HA LEU 336 11.138 29.395 7.466 233 HB2 LEU 336 2HB LEU 336 8.539 30.706 8.343 234 HB3 LEU 336 1HB LEU 336 10.125 31.260 8.866 235 HG LEU 336 HG LEU 336 9.247 31.159 5.956 236 HD11 LEU 336 1HD1 LEU 336 9.004 33.605 6.093 237 HD12 LEU 336 2HD1 LEU 336 9.318 33.548 7.828 238 HD13 LEU 336 3HD1 LEU 336 7.872 32.782 7.162 239 HD21 LEU 336 1HD2 LEU 336 11.683 32.458 7.244 240 HD22 LEU 336 2HD2 LEU 336 11.222 32.601 5.547 241 HD23 LEU 336 3HD2 LEU 336 11.687 31.034 6.198 242 H LEU 337 H LEU 337 12.000 27.886 8.763 243 HA LEU 337 HA LEU 337 10.532 26.724 11.005 244 HB2 LEU 337 2HB LEU 337 13.340 26.160 9.933 245 HB3 LEU 337 1HB LEU 337 12.674 25.388 11.361 246 HG LEU 337 HG LEU 337 10.835 24.436 9.867 247 HD11 LEU 337 1HD1 LEU 337 11.234 24.271 7.459 248 HD12 LEU 337 2HD1 LEU 337 12.643 25.324 7.604 249 HD13 LEU 337 3HD1 LEU 337 11.031 25.953 7.947 250 HD21 LEU 337 1HD2 LEU 337 12.234 22.591 9.031 251 HD22 LEU 337 2HD2 LEU 337 12.707 23.060 10.662 252 HD23 LEU 337 3HD2 LEU 337 13.686 23.565 9.283 253 H CYS 338 H CYS 338 10.343 28.120 12.683 254 HA CYS 338 HA CYS 338 12.373 29.904 13.616 255 HB2 CYS 338 2HB CYS 338 9.956 30.202 14.181 256 HB3 CYS 338 1HB CYS 338 10.027 28.743 15.181 257 H ASP 339 H ASP 339 14.298 29.133 14.286 258 HA ASP 339 HA ASP 339 14.918 26.493 14.871 259 HB2 ASP 339 2HB ASP 339 16.584 28.158 14.150 260 HB3 ASP 339 1HB ASP 339 16.415 29.023 15.674 261 H GLU 340 H GLU 340 14.179 29.127 17.121 262 HA GLU 340 HA GLU 340 14.892 27.886 19.541 263 HB2 GLU 340 2HB GLU 340 14.523 30.341 19.173 264 HB3 GLU 340 1HB GLU 340 12.792 30.041 19.097 265 HG2 GLU 340 2HG GLU 340 12.837 29.232 21.435 266 HG3 GLU 340 1HG GLU 340 14.573 29.534 21.503 267 H CYS 341 H CYS 341 11.890 27.800 17.695 268 HA CYS 341 HA CYS 341 10.484 26.295 19.818 269 HB2 CYS 341 2HB CYS 341 9.380 27.619 17.309 270 HB3 CYS 341 1HB CYS 341 8.427 26.861 18.587 271 H ASP 342 H ASP 342 12.159 25.812 16.952 272 HA ASP 342 HA ASP 342 12.446 24.227 15.400 273 HB2 ASP 342 2HB ASP 342 11.387 22.392 17.590 274 HB3 ASP 342 1HB ASP 342 12.334 21.871 16.196 275 H MET 343 H MET 343 9.746 25.494 15.493 276 HA MET 343 HA MET 343 8.169 23.483 14.001 277 HB2 MET 343 2HB MET 343 7.299 25.989 15.483 278 HB3 MET 343 1HB MET 343 6.245 25.165 14.342 279 HG2 MET 343 2HG MET 343 7.399 23.680 16.696 280 HG3 MET 343 1HG MET 343 5.985 24.704 16.857 281 HE1 MET 343 1HE MET 343 7.141 21.972 14.064 282 HE2 MET 343 2HE MET 343 6.096 20.665 14.617 283 HE3 MET 343 3HE MET 343 7.367 21.279 15.672 284 H ALA 344 H ALA 344 7.600 23.847 11.977 285 HA ALA 344 HA ALA 344 8.833 26.017 10.472 286 HB1 ALA 344 1HB ALA 344 8.920 23.723 9.555 287 HB2 ALA 344 2HB ALA 344 8.062 24.818 8.470 288 HB3 ALA 344 3HB ALA 344 7.157 23.680 9.474 289 H PHE 345 H PHE 345 7.734 27.567 9.379 290 HA PHE 345 HA PHE 345 4.799 27.830 9.721 291 HB2 PHE 345 2HB PHE 345 7.000 29.941 9.877 292 HB3 PHE 345 1HB PHE 345 5.347 30.389 9.476 293 HD1 PHE 345 HD1 PHE 345 4.097 31.237 11.263 294 HD2 PHE 345 HD2 PHE 345 7.076 28.285 12.089 295 HE1 PHE 345 HE1 PHE 345 3.553 31.352 13.663 296 HE2 PHE 345 HE2 PHE 345 6.516 28.398 14.471 297 HZ PHE 345 HZ PHE 345 4.758 29.929 15.269 298 H HIS 346 H HIS 346 4.140 29.643 7.975 299 HA HIS 346 HA HIS 346 5.656 29.370 5.457 300 HB2 HIS 346 2HB HIS 346 2.619 29.155 5.759 301 HB3 HIS 346 1HB HIS 346 3.402 29.507 4.226 302 HD2 HIS 346 HD2 HIS 346 5.622 27.299 4.002 303 HE1 HIS 346 HE1 HIS 346 2.489 24.563 4.696 304 HE2 HIS 346 HE2 HIS 346 4.713 24.925 3.575 305 H LEU 347 H LEU 347 5.429 31.300 4.104 306 HA LEU 347 HA LEU 347 5.501 33.774 5.379 307 HB2 LEU 347 2HB LEU 347 4.846 33.073 2.497 308 HB3 LEU 347 1HB LEU 347 5.071 34.729 3.040 309 HG LEU 347 HG LEU 347 7.206 32.553 3.132 310 HD11 LEU 347 1HD1 LEU 347 6.729 33.260 0.826 311 HD12 LEU 347 2HD1 LEU 347 8.318 33.817 1.341 312 HD13 LEU 347 3HD1 LEU 347 6.965 34.950 1.278 313 HD21 LEU 347 1HD2 LEU 347 7.490 34.162 4.959 314 HD22 LEU 347 2HD2 LEU 347 7.400 35.508 3.820 315 HD23 LEU 347 3HD2 LEU 347 8.752 34.373 3.748 316 H TYR 348 H TYR 348 2.789 32.173 3.818 317 HA TYR 348 HA TYR 348 0.867 34.280 4.437 318 HB2 TYR 348 2HB TYR 348 -0.714 32.781 3.132 319 HB3 TYR 348 1HB TYR 348 0.700 33.312 2.227 320 HD1 TYR 348 HD1 TYR 348 -0.920 30.387 3.831 321 HD2 TYR 348 HD2 TYR 348 2.429 31.700 1.526 322 HE1 TYR 348 HE1 TYR 348 -0.316 28.055 3.353 323 HE2 TYR 348 HE2 TYR 348 3.014 29.360 1.046 324 HH TYR 348 HH TYR 348 0.895 26.746 1.862 325 H CYS 349 H CYS 349 2.184 32.096 6.388 326 HA CYS 349 HA CYS 349 -0.316 31.536 7.904 327 HB2 CYS 349 2HB CYS 349 2.326 30.015 7.897 328 HB3 CYS 349 1HB CYS 349 1.025 29.724 9.052 329 H LEU 350 H LEU 350 1.658 33.891 7.753 330 HA LEU 350 HA LEU 350 2.496 34.110 10.572 331 HB2 LEU 350 2HB LEU 350 3.145 35.895 8.179 332 HB3 LEU 350 1HB LEU 350 3.827 36.052 9.795 333 HG LEU 350 HG LEU 350 4.293 33.751 7.855 334 HD11 LEU 350 1HD1 LEU 350 6.215 35.852 8.887 335 HD12 LEU 350 2HD1 LEU 350 5.543 35.755 7.257 336 HD13 LEU 350 3HD1 LEU 350 6.626 34.492 7.835 337 HD21 LEU 350 1HD2 LEU 350 5.850 32.831 9.534 338 HD22 LEU 350 2HD2 LEU 350 4.192 32.858 10.125 339 HD23 LEU 350 3HD2 LEU 350 5.346 34.072 10.685 340 H LYS 351 H LYS 351 2.353 36.755 11.086 341 HA LYS 351 HA LYS 351 -0.200 37.882 10.301 342 HB2 LYS 351 2HB LYS 351 -0.611 36.230 12.287 343 HB3 LYS 351 1HB LYS 351 0.234 37.403 13.284 344 HG2 LYS 351 2HG LYS 351 -2.168 37.716 13.498 345 HG3 LYS 351 1HG LYS 351 -1.454 39.116 12.692 346 HD2 LYS 351 2HD LYS 351 -2.206 38.250 10.497 347 HD3 LYS 351 1HD LYS 351 -2.892 36.825 11.284 348 HE2 LYS 351 2HE LYS 351 -3.796 39.690 11.775 349 HE3 LYS 351 1HE LYS 351 -4.608 38.537 10.714 350 HZ1 LYS 351 1HZ LYS 351 -5.094 37.148 12.576 351 HZ2 LYS 351 2HZ LYS 351 -5.613 38.715 12.943 352 HZ3 LYS 351 3HZ LYS 351 -4.184 38.113 13.620 353 HA PRO 352 HA PRO 352 -0.201 39.421 9.049 354 HB2 PRO 352 2HB PRO 352 0.802 41.339 7.445 355 HB3 PRO 352 1HB PRO 352 -0.124 41.773 8.890 356 HG2 PRO 352 2HG PRO 352 2.869 41.717 8.507 357 HG3 PRO 352 1HG PRO 352 1.865 42.971 9.268 358 HD2 PRO 352 2HD PRO 352 3.224 41.009 10.680 359 HD3 PRO 352 1HD PRO 352 1.783 41.843 11.291 360 HA PRO 353 HA PRO 353 2.309 36.693 6.460 361 HB2 PRO 353 2HB PRO 353 1.243 37.144 3.922 362 HB3 PRO 353 1HB PRO 353 0.476 36.136 5.156 363 HG2 PRO 353 2HG PRO 353 -0.066 39.015 4.457 364 HG3 PRO 353 1HG PRO 353 -1.224 37.699 4.757 365 HD2 PRO 353 2HD PRO 353 -0.685 39.511 6.664 366 HD3 PRO 353 1HD PRO 353 -0.933 37.801 7.089 367 H LEU 354 H LEU 354 4.342 36.919 5.699 368 HA LEU 354 HA LEU 354 5.300 39.526 4.757 369 HB2 LEU 354 2HB LEU 354 6.814 36.970 5.432 370 HB3 LEU 354 1HB LEU 354 7.575 38.468 4.912 371 HG LEU 354 HG LEU 354 6.031 38.033 7.498 372 HD11 LEU 354 1HD1 LEU 354 8.984 38.572 7.039 373 HD12 LEU 354 2HD1 LEU 354 8.264 37.041 7.543 374 HD13 LEU 354 3HD1 LEU 354 8.186 38.438 8.611 375 HD21 LEU 354 1HD2 LEU 354 5.588 40.304 6.716 376 HD22 LEU 354 2HD2 LEU 354 7.314 40.601 6.495 377 HD23 LEU 354 3HD2 LEU 354 6.658 40.348 8.114 378 H THR 355 H THR 355 6.340 39.835 2.758 379 HA THR 355 HA THR 355 5.233 38.367 0.551 380 HB THR 355 HB THR 355 5.571 40.789 0.335 381 HG1 THR 355 HG1 THR 355 6.856 40.733 -1.682 382 HG21 THR 355 1HG2 THR 355 8.563 40.256 0.509 383 HG22 THR 355 2HG2 THR 355 7.592 41.111 1.710 384 HG23 THR 355 3HG2 THR 355 7.820 41.803 0.102 385 H SER 356 H SER 356 8.360 38.497 2.130 386 HA SER 356 HA SER 356 9.296 36.052 0.838 387 HB2 SER 356 2HB SER 356 10.858 38.681 0.656 388 HB3 SER 356 1HB SER 356 11.454 37.101 0.152 389 HG SER 356 HG SER 356 9.477 38.723 -1.038 390 H VAL 357 H VAL 357 11.780 35.803 1.816 391 HA VAL 357 HA VAL 357 11.529 35.627 4.642 392 HB VAL 357 HB VAL 357 12.897 34.028 3.387 393 HG11 VAL 357 1HG1 VAL 357 14.835 36.299 2.787 394 HG12 VAL 357 2HG1 VAL 357 13.808 35.476 1.612 395 HG13 VAL 357 3HG1 VAL 357 15.099 34.590 2.422 396 HG21 VAL 357 1HG2 VAL 357 14.875 33.944 4.855 397 HG22 VAL 357 2HG2 VAL 357 13.424 34.373 5.762 398 HG23 VAL 357 3HG2 VAL 357 14.594 35.622 5.336 399 HA PRO 358 HA PRO 358 12.470 39.960 5.591 400 HB2 PRO 358 2HB PRO 358 13.028 39.684 8.292 401 HB3 PRO 358 1HB PRO 358 11.389 39.640 7.632 402 HG2 PRO 358 2HG PRO 358 13.220 37.330 8.301 403 HG3 PRO 358 1HG PRO 358 11.515 37.565 8.751 404 HD2 PRO 358 2HD PRO 358 12.148 35.993 6.686 405 HD3 PRO 358 1HD PRO 358 10.742 37.078 6.570 406 HA PRO 359 HA PRO 359 16.923 40.486 5.343 407 HB2 PRO 359 2HB PRO 359 17.443 42.769 6.789 408 HB3 PRO 359 1HB PRO 359 16.609 42.797 5.229 409 HG2 PRO 359 2HG PRO 359 15.428 42.833 8.011 410 HG3 PRO 359 1HG PRO 359 15.040 43.875 6.624 411 HD2 PRO 359 2HD PRO 359 13.490 41.767 7.260 412 HD3 PRO 359 1HD PRO 359 13.782 42.202 5.558 413 H GLU 360 H GLU 360 15.491 39.791 8.339 414 HA GLU 360 HA GLU 360 17.969 39.353 9.828 415 HB2 GLU 360 2HB GLU 360 15.092 38.733 10.566 416 HB3 GLU 360 1HB GLU 360 16.467 38.710 11.669 417 HG2 GLU 360 2HG GLU 360 16.739 41.111 11.465 418 HG3 GLU 360 1HG GLU 360 15.518 41.185 10.198 419 HA PRO 361 HA PRO 361 17.952 35.187 7.921 420 HB2 PRO 361 2HB PRO 361 20.425 34.406 8.793 421 HB3 PRO 361 1HB PRO 361 20.201 35.536 7.450 422 HG2 PRO 361 2HG PRO 361 20.835 36.126 10.338 423 HG3 PRO 361 1HG PRO 361 21.554 36.822 8.869 424 HD2 PRO 361 2HD PRO 361 19.615 38.107 10.310 425 HD3 PRO 361 1HD PRO 361 19.777 38.299 8.553 426 H GLU 362 H GLU 362 18.652 35.876 11.308 427 HA GLU 362 HA GLU 362 18.019 33.242 12.323 428 HB2 GLU 362 2HB GLU 362 18.147 34.442 14.578 429 HB3 GLU 362 1HB GLU 362 19.608 34.538 13.597 430 HG2 GLU 362 2HG GLU 362 18.910 36.814 12.849 431 HG3 GLU 362 1HG GLU 362 17.522 36.717 13.927 432 H TRP 363 H TRP 363 15.942 32.917 11.363 433 HA TRP 363 HA TRP 363 13.837 34.835 11.722 434 HB2 TRP 363 2HB TRP 363 13.979 33.275 9.694 435 HB3 TRP 363 1HB TRP 363 13.403 31.975 10.743 436 HD1 TRP 363 HD1 TRP 363 12.269 35.283 9.163 437 HE1 TRP 363 HE1 TRP 363 9.720 35.486 9.326 438 HE3 TRP 363 HE3 TRP 363 11.285 31.132 11.999 439 HZ2 TRP 363 HZ2 TRP 363 7.586 34.107 10.497 440 HZ3 TRP 363 HZ3 TRP 363 8.943 30.651 12.597 441 HH2 TRP 363 HH2 TRP 363 7.131 32.112 11.857 442 H TYR 364 H TYR 364 12.930 35.144 13.587 443 HA TYR 364 HA TYR 364 12.055 32.848 15.231 444 HB2 TYR 364 2HB TYR 364 12.543 35.745 16.065 445 HB3 TYR 364 1HB TYR 364 11.868 34.497 17.115 446 HD1 TYR 364 HD1 TYR 364 14.889 36.113 16.221 447 HD2 TYR 364 HD2 TYR 364 13.352 32.250 17.233 448 HE1 TYR 364 HE1 TYR 364 17.146 35.367 16.851 449 HE2 TYR 364 HE2 TYR 364 15.611 31.514 17.863 450 HH TYR 364 HH TYR 364 18.210 33.666 18.276 451 H CYS 365 H CYS 365 9.935 32.725 15.789 452 HA CYS 365 HA CYS 365 7.990 33.900 14.036 453 HB2 CYS 365 2HB CYS 365 6.403 32.449 15.221 454 HB3 CYS 365 1HB CYS 365 7.876 31.546 14.873 455 HA PRO 366 HA PRO 366 6.483 37.315 16.708 456 HB2 PRO 366 2HB PRO 366 3.721 36.970 16.327 457 HB3 PRO 366 1HB PRO 366 4.778 37.870 15.237 458 HG2 PRO 366 2HG PRO 366 3.833 35.010 15.030 459 HG3 PRO 366 1HG PRO 366 3.919 36.255 13.760 460 HD2 PRO 366 2HD PRO 366 5.799 34.371 13.920 461 HD3 PRO 366 1HD PRO 366 6.263 36.046 13.547 462 H SER 367 H SER 367 5.307 34.023 16.902 463 HA SER 367 HA SER 367 4.044 34.073 19.421 464 HB2 SER 367 2HB SER 367 5.325 31.676 18.067 465 HB3 SER 367 1HB SER 367 3.967 31.677 19.198 466 HG SER 367 HG SER 367 2.715 31.967 17.546 467 H CYS 368 H CYS 368 7.381 34.315 18.704 468 HA CYS 368 HA CYS 368 8.430 33.078 21.105 469 HB2 CYS 368 2HB CYS 368 9.576 34.568 18.785 470 HB3 CYS 368 1HB CYS 368 10.465 34.751 20.288 471 H ARG 369 H ARG 369 7.055 36.196 20.303 472 HA ARG 369 HA ARG 369 8.128 37.400 22.803 473 HB2 ARG 369 2HB ARG 369 8.340 39.547 21.615 474 HB3 ARG 369 1HB ARG 369 9.312 38.294 20.852 475 HG2 ARG 369 2HG ARG 369 7.493 38.020 19.125 476 HG3 ARG 369 1HG ARG 369 6.665 39.403 19.847 477 HD2 ARG 369 2HD ARG 369 7.966 40.108 17.882 478 HD3 ARG 369 1HD ARG 369 8.627 40.834 19.350 479 HE ARG 369 HE ARG 369 10.250 38.833 19.246 480 HH11 ARG 369 1HH1 ARG 369 9.100 40.556 16.409 481 HH12 ARG 369 2HH1 ARG 369 10.482 40.129 15.460 482 HH21 ARG 369 1HH2 ARG 369 12.016 38.272 17.989 483 HH22 ARG 369 2HH2 ARG 369 12.140 38.850 16.360 484 H THR 370 H THR 370 5.280 36.629 21.069 485 HA THR 370 HA THR 370 3.667 38.839 22.017 486 HB THR 370 HB THR 370 3.130 37.700 19.853 487 HG1 THR 370 HG1 THR 370 1.402 38.780 20.641 488 HG21 THR 370 1HG2 THR 370 2.131 35.400 21.580 489 HG22 THR 370 2HG2 THR 370 3.565 35.340 20.554 490 HG23 THR 370 3HG2 THR 370 1.972 35.546 19.827 491 H ASP 371 H ASP 371 1.873 38.662 23.454 492 HA ASP 371 HA ASP 371 2.236 36.979 25.782 493 HB2 ASP 371 2HB ASP 371 -0.069 38.861 25.095 494 HB3 ASP 371 1HB ASP 371 0.273 38.183 26.685 495 H SER 372 H SER 372 0.502 36.773 22.820 496 HA SER 372 HA SER 372 -1.785 35.273 23.503 497 HB2 SER 372 2HB SER 372 -1.459 36.499 21.343 498 HB3 SER 372 1HB SER 372 -0.235 35.319 20.870 499 HG SER 372 HG SER 372 -1.752 33.863 20.501 500 H SER 373 H SER 373 1.542 34.315 23.275 501 HA SER 373 HA SER 373 1.032 31.449 23.090 502 HB2 SER 373 2HB SER 373 3.598 32.984 23.704 503 HB3 SER 373 1HB SER 373 3.490 31.257 23.339 504 HG SER 373 HG SER 373 3.817 33.158 21.629 505 H GLU 374 H GLU 374 1.562 29.960 24.777 506 HA GLU 374 HA GLU 374 0.678 30.755 27.415 507 HB2 GLU 374 2HB GLU 374 1.629 28.051 26.369 508 HB3 GLU 374 1HB GLU 374 0.747 28.325 27.872 509 HG2 GLU 374 2HG GLU 374 -1.254 28.963 26.653 510 HG3 GLU 374 1HG GLU 374 -0.383 28.956 25.123 511 H VAL 375 H VAL 375 1.917 30.483 29.374 512 HA VAL 375 HA VAL 375 4.666 31.220 29.114 513 HB VAL 375 HB VAL 375 4.761 31.324 31.556 514 HG11 VAL 375 1HG1 VAL 375 2.155 32.508 30.513 515 HG12 VAL 375 2HG1 VAL 375 3.756 33.235 30.361 516 HG13 VAL 375 3HG1 VAL 375 3.031 33.034 31.955 517 HG21 VAL 375 1HG2 VAL 375 1.971 30.105 31.618 518 HG22 VAL 375 2HG2 VAL 375 2.836 30.766 33.007 519 HG23 VAL 375 3HG2 VAL 375 3.455 29.334 32.187 520 H VAL 376 H VAL 376 6.413 29.972 29.019 521 HA VAL 376 HA VAL 376 6.534 27.276 30.074 522 HB VAL 376 HB VAL 376 5.346 26.937 27.907 523 HG11 VAL 376 1HG1 VAL 376 7.815 28.098 26.566 524 HG12 VAL 376 2HG1 VAL 376 6.220 28.848 26.630 525 HG13 VAL 376 3HG1 VAL 376 6.451 27.345 25.735 526 HG21 VAL 376 1HG2 VAL 376 6.798 25.164 26.960 527 HG22 VAL 376 2HG2 VAL 376 6.780 25.112 28.724 528 HG23 VAL 376 3HG2 VAL 376 8.168 25.799 27.878 529 H GLN 377 H GLN 377 8.662 26.490 30.206 530 HA GLN 377 HA GLN 377 10.805 28.438 30.102 531 HB2 GLN 377 2HB GLN 377 10.788 25.484 30.862 532 HB3 GLN 377 1HB GLN 377 12.188 26.541 31.015 533 HG2 GLN 377 2HG GLN 377 9.555 26.871 32.488 534 HG3 GLN 377 1HG GLN 377 11.030 26.181 33.160 535 HE21 GLN 377 1HE2 GLN 377 12.821 27.561 33.557 536 HE22 GLN 377 2HE2 GLN 377 12.621 29.270 33.722 537 H ALA 378 H ALA 378 11.387 28.927 28.015 538 HA ALA 378 HA ALA 378 11.865 27.026 25.925 539 HB1 ALA 378 1HB ALA 378 11.437 29.408 25.427 540 HB2 ALA 378 2HB ALA 378 12.995 28.907 24.769 541 HB3 ALA 378 3HB ALA 378 12.930 29.863 26.252 542 H GLY 379 H GLY 379 13.381 25.476 26.179 543 HA2 GLY 379 2HA GLY 379 15.434 24.471 26.602 544 HA3 GLY 379 1HA GLY 379 16.061 25.996 27.217 545 H GLU 380 H GLU 380 13.429 23.751 27.986 546 HA GLU 380 HA GLU 380 13.556 24.244 30.817 547 HB2 GLU 380 2HB GLU 380 11.432 23.815 29.582 548 HB3 GLU 380 1HB GLU 380 11.952 22.165 29.261 549 HG2 GLU 380 2HG GLU 380 11.877 21.641 31.650 550 HG3 GLU 380 1HG GLU 380 11.490 23.320 32.028 Start of MODEL 5 1 H1 SER 303 H SER 303 13.128 10.256 -0.930 2 HA SER 303 HA SER 303 13.556 12.658 -2.437 3 HB2 SER 303 2HB SER 303 12.258 10.691 -3.293 4 HB3 SER 303 1HB SER 303 11.011 11.002 -2.088 5 HG SER 303 HG SER 303 10.859 11.900 -4.379 6 H GLY 304 H GLY 304 11.632 11.757 0.424 7 HA2 GLY 304 2HA GLY 304 10.709 14.510 0.884 8 HA3 GLY 304 1HA GLY 304 10.295 13.091 1.838 9 HA PRO 305 HA PRO 305 14.104 15.611 3.630 10 HB2 PRO 305 2HB PRO 305 12.813 17.208 5.495 11 HB3 PRO 305 1HB PRO 305 13.246 17.743 3.867 12 HG2 PRO 305 2HG PRO 305 10.601 16.717 4.885 13 HG3 PRO 305 1HG PRO 305 10.922 18.114 3.833 14 HD2 PRO 305 2HD PRO 305 10.059 15.762 2.829 15 HD3 PRO 305 1HD PRO 305 11.221 16.768 1.931 16 H SER 306 H SER 306 15.133 14.644 5.280 17 HA SER 306 HA SER 306 13.968 12.449 6.641 18 HB2 SER 306 2HB SER 306 16.655 13.802 7.139 19 HB3 SER 306 1HB SER 306 16.192 12.185 7.688 20 HG SER 306 HG SER 306 15.882 11.684 5.414 21 H CYS 307 H CYS 307 14.187 12.125 9.049 22 HA CYS 307 HA CYS 307 13.349 14.476 10.604 23 HB2 CYS 307 2HB CYS 307 11.599 12.134 9.851 24 HB3 CYS 307 1HB CYS 307 11.345 12.941 11.391 25 H ARG 308 H ARG 308 14.956 14.344 12.133 26 HA ARG 308 HA ARG 308 15.491 11.970 13.674 27 HB2 ARG 308 2HB ARG 308 15.915 14.733 14.867 28 HB3 ARG 308 1HB ARG 308 16.849 13.269 15.102 29 HG2 ARG 308 2HG ARG 308 18.345 14.505 13.869 30 HG3 ARG 308 1HG ARG 308 17.513 13.671 12.554 31 HD2 ARG 308 2HD ARG 308 16.136 15.619 12.118 32 HD3 ARG 308 1HD ARG 308 16.765 16.445 13.547 33 HE ARG 308 HE ARG 308 18.566 15.709 11.321 34 HH11 ARG 308 1HH1 ARG 308 17.185 18.218 13.356 35 HH12 ARG 308 2HH1 ARG 308 18.196 19.464 12.697 36 HH21 ARG 308 1HH2 ARG 308 19.902 17.356 10.495 37 HH22 ARG 308 2HH2 ARG 308 19.727 18.978 11.094 38 H PHE 309 H PHE 309 13.417 14.797 13.942 39 HA PHE 309 HA PHE 309 12.331 14.339 16.528 40 HB2 PHE 309 2HB PHE 309 11.313 16.060 14.221 41 HB3 PHE 309 1HB PHE 309 10.673 16.113 15.860 42 HD1 PHE 309 HD1 PHE 309 12.110 16.968 17.740 43 HD2 PHE 309 HD2 PHE 309 13.360 17.257 13.654 44 HE1 PHE 309 HE1 PHE 309 13.754 18.693 18.361 45 HE2 PHE 309 HE2 PHE 309 15.001 18.984 14.292 46 HZ PHE 309 HZ PHE 309 15.195 19.705 16.641 47 H CYS 310 H CYS 310 11.753 12.535 13.752 48 HA CYS 310 HA CYS 310 9.124 11.629 14.757 49 HB2 CYS 310 2HB CYS 310 9.650 12.088 11.791 50 HB3 CYS 310 1HB CYS 310 8.129 11.618 12.545 51 H LYS 311 H LYS 311 12.242 10.820 13.989 52 HA LYS 311 HA LYS 311 13.447 8.964 13.522 53 HB2 LYS 311 2HB LYS 311 10.914 7.500 14.360 54 HB3 LYS 311 1HB LYS 311 12.501 6.753 14.198 55 HG2 LYS 311 2HG LYS 311 13.368 8.112 16.039 56 HG3 LYS 311 1HG LYS 311 11.827 8.965 16.173 57 HD2 LYS 311 2HD LYS 311 12.281 5.995 16.680 58 HD3 LYS 311 1HD LYS 311 12.044 7.232 17.918 59 HE2 LYS 311 2HE LYS 311 9.757 7.640 17.102 60 HE3 LYS 311 1HE LYS 311 9.987 6.466 15.805 61 HZ1 LYS 311 1HZ LYS 311 10.199 4.732 17.428 62 HZ2 LYS 311 2HZ LYS 311 8.752 5.572 17.668 63 HZ3 LYS 311 3HZ LYS 311 10.065 5.841 18.702 64 H ASP 312 H ASP 312 11.514 10.095 11.419 65 HA ASP 312 HA ASP 312 10.649 9.758 9.355 66 HB2 ASP 312 2HB ASP 312 12.886 7.694 9.240 67 HB3 ASP 312 1HB ASP 312 11.981 8.245 7.831 68 H ASP 313 H ASP 313 9.403 8.294 11.532 69 HA ASP 313 HA ASP 313 8.666 5.657 10.745 70 HB2 ASP 313 2HB ASP 313 8.495 6.720 13.103 71 HB3 ASP 313 1HB ASP 313 7.002 7.465 12.548 72 H GLU 314 H GLU 314 6.938 4.958 9.569 73 HA GLU 314 HA GLU 314 5.891 6.776 7.570 74 HB2 GLU 314 2HB GLU 314 5.333 3.807 7.962 75 HB3 GLU 314 1HB GLU 314 5.104 4.735 6.480 76 HG2 GLU 314 2HG GLU 314 7.478 4.964 6.158 77 HG3 GLU 314 1HG GLU 314 7.825 4.317 7.764 78 H ASN 315 H ASN 315 4.726 5.223 10.467 79 HA ASN 315 HA ASN 315 1.887 5.456 9.747 80 HB2 ASN 315 2HB ASN 315 3.261 4.200 12.167 81 HB3 ASN 315 1HB ASN 315 1.514 4.250 11.947 82 HD21 ASN 315 1HD2 ASN 315 4.499 2.831 10.839 83 HD22 ASN 315 2HD2 ASN 315 3.783 1.542 9.938 84 H LYS 316 H LYS 316 4.241 6.823 12.029 85 HA LYS 316 HA LYS 316 2.239 8.417 13.405 86 HB2 LYS 316 2HB LYS 316 5.249 8.807 13.621 87 HB3 LYS 316 1HB LYS 316 4.016 9.291 14.774 88 HG2 LYS 316 2HG LYS 316 5.053 6.497 14.217 89 HG3 LYS 316 1HG LYS 316 5.196 7.427 15.701 90 HD2 LYS 316 2HD LYS 316 2.581 6.324 14.591 91 HD3 LYS 316 1HD LYS 316 3.562 5.533 15.821 92 HE2 LYS 316 2HE LYS 316 1.854 6.598 17.045 93 HE3 LYS 316 1HE LYS 316 3.225 7.689 17.219 94 HZ1 LYS 316 1HZ LYS 316 1.074 8.039 15.211 95 HZ2 LYS 316 2HZ LYS 316 2.286 9.152 15.623 96 HZ3 LYS 316 3HZ LYS 316 1.072 8.770 16.734 97 HA PRO 317 HA PRO 317 2.376 11.780 10.368 98 HB2 PRO 317 2HB PRO 317 1.116 13.735 11.841 99 HB3 PRO 317 1HB PRO 317 0.252 12.380 11.099 100 HG2 PRO 317 2HG PRO 317 1.221 12.677 13.946 101 HG3 PRO 317 1HG PRO 317 -0.369 12.134 13.361 102 HD2 PRO 317 2HD PRO 317 1.510 10.361 14.146 103 HD3 PRO 317 1HD PRO 317 0.432 10.003 12.779 104 H CYS 318 H CYS 318 3.054 14.113 10.267 105 HA CYS 318 HA CYS 318 5.376 14.751 11.988 106 HB2 CYS 318 2HB CYS 318 6.243 13.673 9.967 107 HB3 CYS 318 1HB CYS 318 5.258 14.704 8.937 108 H ARG 319 H ARG 319 4.717 16.596 12.962 109 HA ARG 319 HA ARG 319 3.227 18.672 11.447 110 HB2 ARG 319 2HB ARG 319 1.974 17.522 13.293 111 HB3 ARG 319 1HB ARG 319 3.179 18.103 14.444 112 HG2 ARG 319 2HG ARG 319 2.504 20.411 14.062 113 HG3 ARG 319 1HG ARG 319 1.419 19.926 12.755 114 HD2 ARG 319 2HD ARG 319 0.220 20.400 14.889 115 HD3 ARG 319 1HD ARG 319 -0.024 18.743 14.321 116 HE ARG 319 HE ARG 319 1.869 19.491 16.487 117 HH11 ARG 319 1HH1 ARG 319 -0.454 17.209 15.179 118 HH12 ARG 319 2HH1 ARG 319 -0.388 16.174 16.566 119 HH21 ARG 319 1HH2 ARG 319 1.969 18.100 18.275 120 HH22 ARG 319 2HH2 ARG 319 0.979 16.678 18.313 121 H LYS 320 H LYS 320 5.831 18.043 13.719 122 HA LYS 320 HA LYS 320 6.420 20.692 14.483 123 HB2 LYS 320 2HB LYS 320 7.091 18.714 15.796 124 HB3 LYS 320 1HB LYS 320 8.204 18.232 14.521 125 HG2 LYS 320 2HG LYS 320 9.597 20.194 14.919 126 HG3 LYS 320 1HG LYS 320 8.440 20.823 16.094 127 HD2 LYS 320 2HD LYS 320 10.069 18.268 16.381 128 HD3 LYS 320 1HD LYS 320 10.395 19.798 17.201 129 HE2 LYS 320 2HE LYS 320 8.183 19.613 18.355 130 HE3 LYS 320 1HE LYS 320 7.932 18.040 17.583 131 HZ1 LYS 320 1HZ LYS 320 8.798 17.868 19.847 132 HZ2 LYS 320 2HZ LYS 320 10.183 18.719 19.395 133 HZ3 LYS 320 3HZ LYS 320 9.867 17.200 18.721 134 H CYS 321 H CYS 321 7.811 18.620 11.962 135 HA CYS 321 HA CYS 321 9.622 20.755 11.063 136 HB2 CYS 321 2HB CYS 321 9.790 18.237 9.547 137 HB3 CYS 321 1HB CYS 321 11.046 19.080 10.446 138 H ALA 322 H ALA 322 6.529 19.900 10.557 139 HA ALA 322 HA ALA 322 6.421 20.910 7.786 140 HB1 ALA 322 1HB ALA 322 4.027 20.253 7.885 141 HB2 ALA 322 2HB ALA 322 4.239 19.708 9.551 142 HB3 ALA 322 3HB ALA 322 5.078 18.880 8.239 143 H CYS 323 H CYS 323 4.475 22.504 7.572 144 HA CYS 323 HA CYS 323 4.780 24.685 9.433 145 HB2 CYS 323 2HB CYS 323 4.477 25.307 7.157 146 HB3 CYS 323 1HB CYS 323 3.026 24.324 6.995 147 H HIS 324 H HIS 324 3.892 24.563 11.354 148 HA HIS 324 HA HIS 324 2.130 22.554 12.176 149 HB2 HIS 324 2HB HIS 324 3.917 23.727 13.536 150 HB3 HIS 324 1HB HIS 324 2.859 25.124 13.644 151 HD1 HIS 324 HD1 HIS 324 3.832 22.247 15.521 152 HD2 HIS 324 HD2 HIS 324 0.263 24.312 15.004 153 HE1 HIS 324 HE1 HIS 324 2.370 21.666 17.500 154 H VAL 325 H VAL 325 1.615 25.905 11.292 155 HA VAL 325 HA VAL 325 -0.813 26.414 12.565 156 HB VAL 325 HB VAL 325 0.305 27.716 10.050 157 HG11 VAL 325 1HG1 VAL 325 -2.081 28.263 10.283 158 HG12 VAL 325 2HG1 VAL 325 -1.094 29.685 10.628 159 HG13 VAL 325 3HG1 VAL 325 -1.821 28.771 11.954 160 HG21 VAL 325 1HG2 VAL 325 1.856 27.839 11.971 161 HG22 VAL 325 2HG2 VAL 325 0.585 28.562 12.960 162 HG23 VAL 325 3HG2 VAL 325 1.222 29.435 11.564 163 H CYS 326 H CYS 326 -0.229 25.338 9.190 164 HA CYS 326 HA CYS 326 -3.133 24.761 8.894 165 HB2 CYS 326 2HB CYS 326 -2.824 24.950 6.478 166 HB3 CYS 326 1HB CYS 326 -2.175 26.392 7.256 167 H GLY 327 H GLY 327 -0.473 23.177 9.810 168 HA2 GLY 327 2HA GLY 327 0.165 20.982 9.968 169 HA3 GLY 327 1HA GLY 327 -1.502 20.603 9.575 170 H GLY 328 H GLY 328 1.051 22.120 7.583 171 HA2 GLY 328 2HA GLY 328 1.010 19.843 5.689 172 HA3 GLY 328 1HA GLY 328 0.544 21.439 5.116 173 H ARG 329 H ARG 329 2.873 19.609 4.453 174 HA ARG 329 HA ARG 329 5.163 21.330 5.246 175 HB2 ARG 329 2HB ARG 329 5.094 18.836 5.891 176 HB3 ARG 329 1HB ARG 329 5.334 18.492 4.182 177 HG2 ARG 329 2HG ARG 329 7.484 19.806 4.288 178 HG3 ARG 329 1HG ARG 329 7.239 19.979 6.029 179 HD2 ARG 329 2HD ARG 329 8.788 18.121 5.472 180 HD3 ARG 329 1HD ARG 329 7.340 17.558 6.319 181 HE ARG 329 HE ARG 329 7.077 17.472 3.457 182 HH11 ARG 329 1HH1 ARG 329 8.270 15.636 6.190 183 HH12 ARG 329 2HH1 ARG 329 8.197 14.123 5.353 184 HH21 ARG 329 1HH2 ARG 329 6.956 15.486 2.396 185 HH22 ARG 329 2HH2 ARG 329 7.446 14.038 3.215 186 H GLU 330 H GLU 330 3.234 21.778 3.025 187 HA GLU 330 HA GLU 330 4.670 21.346 0.536 188 HB2 GLU 330 2HB GLU 330 2.162 22.998 1.040 189 HB3 GLU 330 1HB GLU 330 2.747 22.416 -0.520 190 HG2 GLU 330 2HG GLU 330 2.375 20.081 0.248 191 HG3 GLU 330 1HG GLU 330 1.736 20.696 1.768 192 H ALA 331 H ALA 331 5.117 23.173 -0.941 193 HA ALA 331 HA ALA 331 6.336 24.980 -1.514 194 HB1 ALA 331 1HB ALA 331 4.592 26.386 0.526 195 HB2 ALA 331 2HB ALA 331 4.170 26.060 -1.155 196 HB3 ALA 331 3HB ALA 331 5.495 27.163 -0.782 197 HA PRO 332 HA PRO 332 9.201 24.316 2.101 198 HB2 PRO 332 2HB PRO 332 11.464 23.742 0.639 199 HB3 PRO 332 1HB PRO 332 10.218 22.537 0.997 200 HG2 PRO 332 2HG PRO 332 10.595 24.182 -1.507 201 HG3 PRO 332 1HG PRO 332 10.268 22.441 -1.360 202 HD2 PRO 332 2HD PRO 332 8.307 24.220 -1.929 203 HD3 PRO 332 1HD PRO 332 7.988 22.779 -0.937 204 H GLU 333 H GLU 333 9.647 26.312 -0.770 205 HA GLU 333 HA GLU 333 11.700 28.030 0.270 206 HB2 GLU 333 2HB GLU 333 11.240 29.411 -1.739 207 HB3 GLU 333 1HB GLU 333 11.434 27.709 -2.144 208 HG2 GLU 333 2HG GLU 333 9.001 27.442 -2.357 209 HG3 GLU 333 1HG GLU 333 8.753 29.118 -1.867 210 H LYS 334 H LYS 334 8.218 27.973 0.518 211 HA LYS 334 HA LYS 334 8.048 30.742 1.474 212 HB2 LYS 334 2HB LYS 334 5.866 28.656 1.053 213 HB3 LYS 334 1HB LYS 334 5.581 30.304 1.599 214 HG2 LYS 334 2HG LYS 334 6.728 29.489 -1.093 215 HG3 LYS 334 1HG LYS 334 5.089 30.073 -0.783 216 HD2 LYS 334 2HD LYS 334 6.099 32.235 0.045 217 HD3 LYS 334 1HD LYS 334 7.679 31.641 -0.471 218 HE2 LYS 334 2HE LYS 334 5.280 32.155 -2.259 219 HE3 LYS 334 1HE LYS 334 6.724 33.158 -2.133 220 HZ1 LYS 334 1HZ LYS 334 6.852 31.776 -4.061 221 HZ2 LYS 334 2HZ LYS 334 6.583 30.383 -3.145 222 HZ3 LYS 334 3HZ LYS 334 8.018 31.253 -2.951 223 H GLN 335 H GLN 335 8.510 27.598 2.789 224 HA GLN 335 HA GLN 335 7.431 28.298 5.410 225 HB2 GLN 335 2HB GLN 335 8.845 25.785 4.446 226 HB3 GLN 335 1HB GLN 335 8.334 26.043 6.116 227 HG2 GLN 335 2HG GLN 335 5.979 26.498 5.010 228 HG3 GLN 335 1HG GLN 335 6.655 25.593 3.660 229 HE21 GLN 335 1HE2 GLN 335 5.003 24.049 4.027 230 HE22 GLN 335 2HE2 GLN 335 5.141 22.902 5.304 231 H LEU 336 H LEU 336 8.574 28.664 7.202 232 HA LEU 336 HA LEU 336 11.482 29.046 7.110 233 HB2 LEU 336 2HB LEU 336 9.387 31.051 8.040 234 HB3 LEU 336 1HB LEU 336 11.078 31.162 8.503 235 HG LEU 336 HG LEU 336 10.043 31.325 5.645 236 HD11 LEU 336 1HD1 LEU 336 10.656 33.703 5.734 237 HD12 LEU 336 2HD1 LEU 336 11.118 33.534 7.430 238 HD13 LEU 336 3HD1 LEU 336 9.435 33.322 6.949 239 HD21 LEU 336 1HD2 LEU 336 12.289 30.354 5.717 240 HD22 LEU 336 2HD2 LEU 336 12.855 31.684 6.732 241 HD23 LEU 336 3HD2 LEU 336 12.354 31.992 5.068 242 H LEU 337 H LEU 337 12.365 28.022 8.742 243 HA LEU 337 HA LEU 337 10.732 26.840 10.849 244 HB2 LEU 337 2HB LEU 337 13.631 26.385 10.004 245 HB3 LEU 337 1HB LEU 337 12.918 25.630 11.419 246 HG LEU 337 HG LEU 337 11.198 24.554 9.876 247 HD11 LEU 337 1HD1 LEU 337 11.381 26.017 7.920 248 HD12 LEU 337 2HD1 LEU 337 11.717 24.344 7.477 249 HD13 LEU 337 3HD1 LEU 337 13.046 25.490 7.659 250 HD21 LEU 337 1HD2 LEU 337 13.084 23.277 10.778 251 HD22 LEU 337 2HD2 LEU 337 14.099 23.791 9.429 252 HD23 LEU 337 3HD2 LEU 337 12.703 22.751 9.138 253 H CYS 338 H CYS 338 10.407 28.033 12.610 254 HA CYS 338 HA CYS 338 12.141 30.113 13.558 255 HB2 CYS 338 2HB CYS 338 9.712 30.128 14.016 256 HB3 CYS 338 1HB CYS 338 9.882 28.668 14.997 257 H ASP 339 H ASP 339 14.061 29.722 14.458 258 HA ASP 339 HA ASP 339 15.085 27.283 15.316 259 HB2 ASP 339 2HB ASP 339 16.445 29.265 14.668 260 HB3 ASP 339 1HB ASP 339 15.963 30.085 16.148 261 H GLU 340 H GLU 340 13.554 29.843 17.219 262 HA GLU 340 HA GLU 340 14.012 28.892 19.830 263 HB2 GLU 340 2HB GLU 340 13.289 31.197 19.228 264 HB3 GLU 340 1HB GLU 340 11.712 30.578 18.768 265 HG2 GLU 340 2HG GLU 340 11.472 31.571 20.914 266 HG3 GLU 340 1HG GLU 340 11.388 29.828 21.148 267 H CYS 341 H CYS 341 11.534 28.012 17.460 268 HA CYS 341 HA CYS 341 9.931 26.600 19.510 269 HB2 CYS 341 2HB CYS 341 9.151 27.643 16.755 270 HB3 CYS 341 1HB CYS 341 8.089 26.670 17.772 271 H ASP 342 H ASP 342 12.077 25.993 16.925 272 HA ASP 342 HA ASP 342 12.558 24.339 15.476 273 HB2 ASP 342 2HB ASP 342 11.348 22.638 17.700 274 HB3 ASP 342 1HB ASP 342 12.173 21.934 16.313 275 H MET 343 H MET 343 9.819 25.597 15.416 276 HA MET 343 HA MET 343 8.243 23.581 13.941 277 HB2 MET 343 2HB MET 343 7.422 26.173 15.316 278 HB3 MET 343 1HB MET 343 6.337 25.254 14.276 279 HG2 MET 343 2HG MET 343 7.601 24.214 16.819 280 HG3 MET 343 1HG MET 343 5.958 24.844 16.663 281 HE1 MET 343 1HE MET 343 5.325 22.396 17.853 282 HE2 MET 343 2HE MET 343 7.013 21.896 17.718 283 HE3 MET 343 3HE MET 343 5.735 20.864 17.080 284 H ALA 344 H ALA 344 7.613 23.987 11.897 285 HA ALA 344 HA ALA 344 8.877 26.253 10.472 286 HB1 ALA 344 1HB ALA 344 9.246 24.014 9.532 287 HB2 ALA 344 2HB ALA 344 8.357 25.035 8.405 288 HB3 ALA 344 3HB ALA 344 7.507 23.794 9.328 289 H PHE 345 H PHE 345 7.650 27.660 9.097 290 HA PHE 345 HA PHE 345 4.715 27.694 9.356 291 HB2 PHE 345 2HB PHE 345 6.412 30.138 10.072 292 HB3 PHE 345 1HB PHE 345 4.655 30.037 10.108 293 HD1 PHE 345 HD1 PHE 345 3.545 28.607 11.862 294 HD2 PHE 345 HD2 PHE 345 7.729 29.473 11.972 295 HE1 PHE 345 HE1 PHE 345 3.613 27.983 14.242 296 HE2 PHE 345 HE2 PHE 345 7.782 28.850 14.353 297 HZ PHE 345 HZ PHE 345 5.731 28.106 15.485 298 H HIS 346 H HIS 346 3.827 28.291 7.384 299 HA HIS 346 HA HIS 346 5.332 29.319 5.193 300 HB2 HIS 346 2HB HIS 346 2.336 29.230 5.717 301 HB3 HIS 346 1HB HIS 346 2.988 29.980 4.268 302 HD2 HIS 346 HD2 HIS 346 4.792 27.971 2.863 303 HE1 HIS 346 HE1 HIS 346 1.928 25.009 3.764 304 HE2 HIS 346 HE2 HIS 346 3.699 25.749 2.133 305 H LEU 347 H LEU 347 5.485 31.376 4.373 306 HA LEU 347 HA LEU 347 5.563 33.690 5.871 307 HB2 LEU 347 2HB LEU 347 5.001 33.296 2.912 308 HB3 LEU 347 1HB LEU 347 5.384 34.862 3.626 309 HG LEU 347 HG LEU 347 7.252 32.453 3.672 310 HD11 LEU 347 1HD1 LEU 347 6.947 33.237 1.381 311 HD12 LEU 347 2HD1 LEU 347 8.567 33.608 1.960 312 HD13 LEU 347 3HD1 LEU 347 7.350 34.883 1.869 313 HD21 LEU 347 1HD2 LEU 347 8.968 34.060 4.398 314 HD22 LEU 347 2HD2 LEU 347 7.638 33.982 5.552 315 HD23 LEU 347 3HD2 LEU 347 7.761 35.348 4.438 316 H TYR 348 H TYR 348 2.870 32.274 4.135 317 HA TYR 348 HA TYR 348 1.024 34.463 4.424 318 HB2 TYR 348 2HB TYR 348 0.402 31.574 3.685 319 HB3 TYR 348 1HB TYR 348 -0.555 33.000 3.300 320 HD1 TYR 348 HD1 TYR 348 2.439 31.026 2.379 321 HD2 TYR 348 HD2 TYR 348 0.117 34.493 1.432 322 HE1 TYR 348 HE1 TYR 348 3.601 31.218 0.217 323 HE2 TYR 348 HE2 TYR 348 1.276 34.664 -0.728 324 HH TYR 348 HH TYR 348 3.137 32.200 -2.034 325 H CYS 349 H CYS 349 1.881 31.627 6.277 326 HA CYS 349 HA CYS 349 -0.573 31.590 7.880 327 HB2 CYS 349 2HB CYS 349 1.904 29.830 7.976 328 HB3 CYS 349 1HB CYS 349 0.448 29.589 8.947 329 H LEU 350 H LEU 350 2.155 33.417 7.964 330 HA LEU 350 HA LEU 350 2.574 33.570 10.830 331 HB2 LEU 350 2HB LEU 350 3.518 35.348 8.546 332 HB3 LEU 350 1HB LEU 350 4.025 35.529 10.222 333 HG LEU 350 HG LEU 350 4.564 33.057 8.521 334 HD11 LEU 350 1HD1 LEU 350 5.822 34.971 7.665 335 HD12 LEU 350 2HD1 LEU 350 6.896 33.801 8.429 336 HD13 LEU 350 3HD1 LEU 350 6.466 35.289 9.277 337 HD21 LEU 350 1HD2 LEU 350 5.574 33.804 11.288 338 HD22 LEU 350 2HD2 LEU 350 6.076 32.389 10.361 339 HD23 LEU 350 3HD2 LEU 350 4.409 32.533 10.914 340 H LYS 351 H LYS 351 2.241 35.656 12.006 341 HA LYS 351 HA LYS 351 0.108 37.407 11.004 342 HB2 LYS 351 2HB LYS 351 -0.879 35.411 12.363 343 HB3 LYS 351 1HB LYS 351 -0.141 36.153 13.774 344 HG2 LYS 351 2HG LYS 351 -2.457 36.802 13.696 345 HG3 LYS 351 1HG LYS 351 -1.484 38.230 13.321 346 HD2 LYS 351 2HD LYS 351 -1.957 37.950 10.913 347 HD3 LYS 351 1HD LYS 351 -2.829 36.450 11.236 348 HE2 LYS 351 2HE LYS 351 -4.427 38.248 10.862 349 HE3 LYS 351 1HE LYS 351 -4.508 37.743 12.549 350 HZ1 LYS 351 1HZ LYS 351 -3.110 40.143 11.501 351 HZ2 LYS 351 2HZ LYS 351 -3.097 39.644 13.115 352 HZ3 LYS 351 3HZ LYS 351 -4.547 40.124 12.391 353 HA PRO 352 HA PRO 352 0.357 39.473 10.423 354 HB2 PRO 352 2HB PRO 352 2.710 41.185 9.839 355 HB3 PRO 352 1HB PRO 352 1.024 41.652 10.086 356 HG2 PRO 352 2HG PRO 352 2.940 42.239 11.906 357 HG3 PRO 352 1HG PRO 352 1.271 41.859 12.388 358 HD2 PRO 352 2HD PRO 352 3.691 40.038 12.374 359 HD3 PRO 352 1HD PRO 352 2.481 40.284 13.655 360 HA PRO 353 HA PRO 353 2.554 36.661 7.669 361 HB2 PRO 353 2HB PRO 353 1.227 37.111 5.322 362 HB3 PRO 353 1HB PRO 353 0.482 36.261 6.684 363 HG2 PRO 353 2HG PRO 353 0.202 39.161 5.887 364 HG3 PRO 353 1HG PRO 353 -1.069 38.003 6.341 365 HD2 PRO 353 2HD PRO 353 -0.074 39.815 8.115 366 HD3 PRO 353 1HD PRO 353 -0.617 38.202 8.626 367 H LEU 354 H LEU 354 4.283 36.695 6.302 368 HA LEU 354 HA LEU 354 5.356 39.290 5.420 369 HB2 LEU 354 2HB LEU 354 6.673 36.546 5.589 370 HB3 LEU 354 1HB LEU 354 7.486 38.029 5.103 371 HG LEU 354 HG LEU 354 6.317 37.484 7.863 372 HD11 LEU 354 1HD1 LEU 354 8.638 37.395 8.656 373 HD12 LEU 354 2HD1 LEU 354 9.223 37.591 7.001 374 HD13 LEU 354 3HD1 LEU 354 8.324 36.141 7.455 375 HD21 LEU 354 1HD2 LEU 354 7.891 39.896 6.890 376 HD22 LEU 354 2HD2 LEU 354 7.425 39.583 8.565 377 HD23 LEU 354 3HD2 LEU 354 6.187 39.872 7.346 378 H THR 355 H THR 355 6.006 39.615 3.276 379 HA THR 355 HA THR 355 4.558 38.225 1.202 380 HB THR 355 HB THR 355 5.770 39.862 -0.327 381 HG1 THR 355 HG1 THR 355 7.378 40.982 0.445 382 HG21 THR 355 1HG2 THR 355 4.593 41.880 0.477 383 HG22 THR 355 2HG2 THR 355 4.354 41.126 2.052 384 HG23 THR 355 3HG2 THR 355 3.555 40.461 0.624 385 H SER 356 H SER 356 7.925 38.566 2.210 386 HA SER 356 HA SER 356 8.685 36.078 0.846 387 HB2 SER 356 2HB SER 356 10.768 37.198 -0.019 388 HB3 SER 356 1HB SER 356 9.296 37.834 -0.753 389 HG SER 356 HG SER 356 9.452 39.651 0.523 390 H VAL 357 H VAL 357 11.066 35.553 1.560 391 HA VAL 357 HA VAL 357 11.248 35.420 4.377 392 HB VAL 357 HB VAL 357 12.330 33.709 2.991 393 HG11 VAL 357 1HG1 VAL 357 14.255 35.857 2.007 394 HG12 VAL 357 2HG1 VAL 357 13.001 35.072 1.046 395 HG13 VAL 357 3HG1 VAL 357 14.365 34.130 1.648 396 HG21 VAL 357 1HG2 VAL 357 13.279 34.075 5.247 397 HG22 VAL 357 2HG2 VAL 357 14.424 35.241 4.587 398 HG23 VAL 357 3HG2 VAL 357 14.534 33.542 4.123 399 HA PRO 358 HA PRO 358 13.184 39.518 4.979 400 HB2 PRO 358 2HB PRO 358 13.550 39.409 7.676 401 HB3 PRO 358 1HB PRO 358 11.950 39.634 6.957 402 HG2 PRO 358 2HG PRO 358 13.209 37.119 8.031 403 HG3 PRO 358 1HG PRO 358 11.557 37.728 8.261 404 HD2 PRO 358 2HD PRO 358 12.198 35.789 6.423 405 HD3 PRO 358 1HD PRO 358 10.833 36.907 6.216 406 HA PRO 359 HA PRO 359 17.537 38.494 4.867 407 HB2 PRO 359 2HB PRO 359 18.732 40.851 5.307 408 HB3 PRO 359 1HB PRO 359 17.619 40.654 3.942 409 HG2 PRO 359 2HG PRO 359 17.045 41.810 6.686 410 HG3 PRO 359 1HG PRO 359 16.698 42.526 5.093 411 HD2 PRO 359 2HD PRO 359 14.822 41.145 6.526 412 HD3 PRO 359 1HD PRO 359 14.842 41.149 4.746 413 H GLU 360 H GLU 360 16.133 38.504 7.738 414 HA GLU 360 HA GLU 360 18.059 39.225 9.661 415 HB2 GLU 360 2HB GLU 360 15.879 37.127 10.050 416 HB3 GLU 360 1HB GLU 360 16.638 38.123 11.289 417 HG2 GLU 360 2HG GLU 360 14.726 39.025 9.126 418 HG3 GLU 360 1HG GLU 360 14.416 38.963 10.858 419 HA PRO 361 HA PRO 361 20.980 35.780 9.319 420 HB2 PRO 361 2HB PRO 361 22.314 36.110 11.707 421 HB3 PRO 361 1HB PRO 361 22.547 37.182 10.319 422 HG2 PRO 361 2HG PRO 361 20.798 37.583 12.746 423 HG3 PRO 361 1HG PRO 361 21.919 38.733 11.979 424 HD2 PRO 361 2HD PRO 361 19.246 38.833 11.508 425 HD3 PRO 361 1HD PRO 361 20.425 39.220 10.234 426 H GLU 362 H GLU 362 18.979 36.181 12.203 427 HA GLU 362 HA GLU 362 18.577 33.260 12.379 428 HB2 GLU 362 2HB GLU 362 18.402 33.534 14.898 429 HB3 GLU 362 1HB GLU 362 20.023 33.750 14.246 430 HG2 GLU 362 2HG GLU 362 19.671 36.227 14.342 431 HG3 GLU 362 1HG GLU 362 18.128 35.943 15.136 432 H TRP 363 H TRP 363 16.512 32.821 12.060 433 HA TRP 363 HA TRP 363 14.540 35.003 12.099 434 HB2 TRP 363 2HB TRP 363 14.874 33.712 9.965 435 HB3 TRP 363 1HB TRP 363 14.275 32.270 10.778 436 HD1 TRP 363 HD1 TRP 363 13.095 35.655 9.410 437 HE1 TRP 363 HE1 TRP 363 10.540 35.624 9.172 438 HE3 TRP 363 HE3 TRP 363 12.085 31.182 11.701 439 HZ2 TRP 363 HZ2 TRP 363 8.404 33.962 9.844 440 HZ3 TRP 363 HZ3 TRP 363 9.737 30.452 11.869 441 HH2 TRP 363 HH2 TRP 363 7.925 31.821 10.963 442 H TYR 364 H TYR 364 12.793 34.997 13.330 443 HA TYR 364 HA TYR 364 11.968 32.610 14.847 444 HB2 TYR 364 2HB TYR 364 12.128 35.450 15.963 445 HB3 TYR 364 1HB TYR 364 11.495 34.046 16.823 446 HD1 TYR 364 HD1 TYR 364 13.129 32.069 17.211 447 HD2 TYR 364 HD2 TYR 364 14.454 35.987 16.129 448 HE1 TYR 364 HE1 TYR 364 15.384 31.536 18.028 449 HE2 TYR 364 HE2 TYR 364 16.708 35.448 16.959 450 HH TYR 364 HH TYR 364 17.838 33.935 18.398 451 H CYS 365 H CYS 365 9.751 32.481 15.226 452 HA CYS 365 HA CYS 365 7.992 33.754 13.357 453 HB2 CYS 365 2HB CYS 365 6.254 32.382 14.334 454 HB3 CYS 365 1HB CYS 365 7.711 31.395 14.266 455 HA PRO 366 HA PRO 366 6.733 37.332 15.876 456 HB2 PRO 366 2HB PRO 366 4.023 37.430 15.151 457 HB3 PRO 366 1HB PRO 366 5.341 38.143 14.214 458 HG2 PRO 366 2HG PRO 366 4.003 35.454 13.853 459 HG3 PRO 366 1HG PRO 366 4.429 36.662 12.618 460 HD2 PRO 366 2HD PRO 366 5.970 34.521 12.978 461 HD3 PRO 366 1HD PRO 366 6.727 36.110 12.702 462 H SER 367 H SER 367 4.984 34.287 15.886 463 HA SER 367 HA SER 367 3.395 34.485 18.172 464 HB2 SER 367 2HB SER 367 4.715 31.915 17.238 465 HB3 SER 367 1HB SER 367 3.102 32.124 17.927 466 HG SER 367 HG SER 367 2.432 33.066 16.013 467 H CYS 368 H CYS 368 6.829 34.345 18.041 468 HA CYS 368 HA CYS 368 7.325 33.140 20.607 469 HB2 CYS 368 2HB CYS 368 8.969 34.448 18.501 470 HB3 CYS 368 1HB CYS 368 9.608 34.592 20.133 471 H ARG 369 H ARG 369 6.420 36.332 19.555 472 HA ARG 369 HA ARG 369 6.877 37.426 22.266 473 HB2 ARG 369 2HB ARG 369 7.539 39.570 21.273 474 HB3 ARG 369 1HB ARG 369 8.591 38.279 20.705 475 HG2 ARG 369 2HG ARG 369 7.212 38.208 18.580 476 HG3 ARG 369 1HG ARG 369 6.373 39.654 19.149 477 HD2 ARG 369 2HD ARG 369 9.321 39.375 18.460 478 HD3 ARG 369 1HD ARG 369 8.113 40.352 17.620 479 HE ARG 369 HE ARG 369 9.370 40.930 20.219 480 HH11 ARG 369 1HH1 ARG 369 7.241 42.052 17.653 481 HH12 ARG 369 2HH1 ARG 369 7.255 43.696 18.201 482 HH21 ARG 369 1HH2 ARG 369 9.393 43.084 20.911 483 HH22 ARG 369 2HH2 ARG 369 8.486 44.283 20.043 484 H THR 370 H THR 370 4.583 36.718 19.910 485 HA THR 370 HA THR 370 2.722 38.860 20.364 486 HB THR 370 HB THR 370 2.295 36.079 19.177 487 HG1 THR 370 HG1 THR 370 3.497 38.258 18.213 488 HG21 THR 370 1HG2 THR 370 0.236 36.989 18.163 489 HG22 THR 370 2HG2 THR 370 0.468 38.504 19.035 490 HG23 THR 370 3HG2 THR 370 0.132 37.018 19.927 491 H ASP 371 H ASP 371 1.067 38.977 21.832 492 HA ASP 371 HA ASP 371 1.244 37.386 24.230 493 HB2 ASP 371 2HB ASP 371 -0.752 39.569 23.477 494 HB3 ASP 371 1HB ASP 371 -0.543 38.890 25.091 495 H SER 372 H SER 372 -0.772 37.364 21.377 496 HA SER 372 HA SER 372 -2.932 35.767 22.388 497 HB2 SER 372 2HB SER 372 -1.989 36.143 19.503 498 HB3 SER 372 1HB SER 372 -3.552 35.496 20.008 499 HG SER 372 HG SER 372 -3.129 37.935 19.495 500 H SER 373 H SER 373 0.287 35.035 21.587 501 HA SER 373 HA SER 373 -0.213 32.116 21.589 502 HB2 SER 373 2HB SER 373 2.217 32.089 20.663 503 HB3 SER 373 1HB SER 373 0.954 32.672 19.579 504 HG SER 373 HG SER 373 2.807 34.206 21.073 505 H GLU 374 H GLU 374 1.775 30.958 22.623 506 HA GLU 374 HA GLU 374 1.725 31.642 25.399 507 HB2 GLU 374 2HB GLU 374 3.017 29.547 25.718 508 HB3 GLU 374 1HB GLU 374 1.639 29.297 24.655 509 HG2 GLU 374 2HG GLU 374 3.301 29.554 22.698 510 HG3 GLU 374 1HG GLU 374 4.578 29.418 23.906 511 H VAL 375 H VAL 375 3.144 32.755 26.576 512 HA VAL 375 HA VAL 375 5.721 33.613 25.461 513 HB VAL 375 HB VAL 375 4.354 35.375 26.501 514 HG11 VAL 375 1HG1 VAL 375 3.088 34.069 28.160 515 HG12 VAL 375 2HG1 VAL 375 3.868 35.452 28.932 516 HG13 VAL 375 3HG1 VAL 375 4.549 33.834 29.119 517 HG21 VAL 375 1HG2 VAL 375 6.808 35.638 26.598 518 HG22 VAL 375 2HG2 VAL 375 6.851 34.799 28.150 519 HG23 VAL 375 3HG2 VAL 375 6.054 36.368 28.022 520 H VAL 376 H VAL 376 7.653 32.872 26.194 521 HA VAL 376 HA VAL 376 7.797 30.525 27.849 522 HB VAL 376 HB VAL 376 9.341 30.767 25.965 523 HG11 VAL 376 1HG1 VAL 376 11.156 32.457 25.909 524 HG12 VAL 376 2HG1 VAL 376 10.520 33.190 27.380 525 HG13 VAL 376 3HG1 VAL 376 9.563 33.223 25.899 526 HG21 VAL 376 1HG2 VAL 376 10.878 30.848 28.596 527 HG22 VAL 376 2HG2 VAL 376 11.499 30.217 27.070 528 HG23 VAL 376 3HG2 VAL 376 10.148 29.414 27.869 529 H GLN 377 H GLN 377 8.338 30.369 30.003 530 HA GLN 377 HA GLN 377 8.385 32.698 31.685 531 HB2 GLN 377 2HB GLN 377 7.390 30.574 32.470 532 HB3 GLN 377 1HB GLN 377 8.955 29.777 32.366 533 HG2 GLN 377 2HG GLN 377 8.388 30.347 34.689 534 HG3 GLN 377 1HG GLN 377 9.834 31.202 34.157 535 HE21 GLN 377 1HE2 GLN 377 9.642 32.835 35.677 536 HE22 GLN 377 2HE2 GLN 377 8.386 34.020 35.648 537 H ALA 378 H ALA 378 10.106 33.900 30.915 538 HA ALA 378 HA ALA 378 12.861 32.903 31.179 539 HB1 ALA 378 1HB ALA 378 11.792 35.499 30.003 540 HB2 ALA 378 2HB ALA 378 12.260 34.068 29.084 541 HB3 ALA 378 3HB ALA 378 13.479 34.979 29.977 542 H GLY 379 H GLY 379 14.431 34.572 32.117 543 HA2 GLY 379 2HA GLY 379 15.176 35.946 33.816 544 HA3 GLY 379 1HA GLY 379 13.513 36.370 34.185 545 H GLU 380 H GLU 380 13.974 33.004 34.088 546 HA GLU 380 HA GLU 380 14.781 32.701 36.876 547 HB2 GLU 380 2HB GLU 380 12.294 33.008 36.975 548 HB3 GLU 380 1HB GLU 380 12.092 31.661 35.863 549 HG2 GLU 380 2HG GLU 380 11.637 30.927 38.134 550 HG3 GLU 380 1HG GLU 380 13.087 30.127 37.530 Start of MODEL 6 1 H1 SER 303 H SER 303 10.653 13.742 1.471 2 HA SER 303 HA SER 303 12.003 16.071 0.239 3 HB2 SER 303 2HB SER 303 9.808 17.226 0.683 4 HB3 SER 303 1HB SER 303 9.649 15.832 -0.385 5 HG SER 303 HG SER 303 8.126 15.364 0.999 6 H GLY 304 H GLY 304 12.595 14.494 2.843 7 HA2 GLY 304 2HA GLY 304 13.334 16.718 4.483 8 HA3 GLY 304 1HA GLY 304 11.953 15.854 5.157 9 HA PRO 305 HA PRO 305 15.959 13.572 6.299 10 HB2 PRO 305 2HB PRO 305 16.524 14.515 8.756 11 HB3 PRO 305 1HB PRO 305 16.975 15.432 7.309 12 HG2 PRO 305 2HG PRO 305 14.605 15.823 9.138 13 HG3 PRO 305 1HG PRO 305 15.713 17.042 8.473 14 HD2 PRO 305 2HD PRO 305 13.233 16.454 7.384 15 HD3 PRO 305 1HD PRO 305 14.583 17.140 6.453 16 H SER 306 H SER 306 16.221 11.925 7.963 17 HA SER 306 HA SER 306 13.825 10.550 8.631 18 HB2 SER 306 2HB SER 306 15.924 9.350 8.098 19 HB3 SER 306 1HB SER 306 16.684 9.998 9.551 20 HG SER 306 HG SER 306 14.294 8.474 9.664 21 H CYS 307 H CYS 307 12.806 10.298 10.575 22 HA CYS 307 HA CYS 307 13.672 11.544 13.006 23 HB2 CYS 307 2HB CYS 307 11.596 13.025 13.106 24 HB3 CYS 307 1HB CYS 307 12.848 13.526 11.995 25 H ARG 308 H ARG 308 13.320 9.966 14.328 26 HA ARG 308 HA ARG 308 11.606 7.751 13.989 27 HB2 ARG 308 2HB ARG 308 12.486 7.015 16.158 28 HB3 ARG 308 1HB ARG 308 13.788 7.684 15.179 29 HG2 ARG 308 2HG ARG 308 13.418 9.882 16.485 30 HG3 ARG 308 1HG ARG 308 12.425 8.927 17.584 31 HD2 ARG 308 2HD ARG 308 14.651 9.107 18.512 32 HD3 ARG 308 1HD ARG 308 14.405 7.435 17.989 33 HE ARG 308 HE ARG 308 15.663 9.181 16.040 34 HH11 ARG 308 1HH1 ARG 308 16.271 6.886 18.639 35 HH12 ARG 308 2HH1 ARG 308 17.884 6.546 18.097 36 HH21 ARG 308 1HH2 ARG 308 17.762 8.734 15.373 37 HH22 ARG 308 2HH2 ARG 308 18.732 7.606 16.263 38 H PHE 309 H PHE 309 11.137 10.803 15.534 39 HA PHE 309 HA PHE 309 9.168 10.249 17.461 40 HB2 PHE 309 2HB PHE 309 9.554 12.791 15.808 41 HB3 PHE 309 1HB PHE 309 8.626 12.681 17.302 42 HD1 PHE 309 HD1 PHE 309 12.012 12.782 15.849 43 HD2 PHE 309 HD2 PHE 309 9.769 12.443 19.470 44 HE1 PHE 309 HE1 PHE 309 14.041 13.246 17.158 45 HE2 PHE 309 HE2 PHE 309 11.800 12.915 20.767 46 HZ PHE 309 HZ PHE 309 13.940 13.310 19.619 47 H CYS 310 H CYS 310 8.989 10.377 14.008 48 HA CYS 310 HA CYS 310 6.018 10.509 14.012 49 HB2 CYS 310 2HB CYS 310 7.687 11.180 11.579 50 HB3 CYS 310 1HB CYS 310 6.125 11.835 12.070 51 H LYS 311 H LYS 311 8.498 8.349 13.791 52 HA LYS 311 HA LYS 311 8.817 6.243 13.048 53 HB2 LYS 311 2HB LYS 311 6.341 5.946 13.598 54 HB3 LYS 311 1HB LYS 311 5.972 6.318 11.923 55 HG2 LYS 311 2HG LYS 311 7.454 4.285 11.331 56 HG3 LYS 311 1HG LYS 311 7.368 3.876 13.043 57 HD2 LYS 311 2HD LYS 311 4.995 4.147 11.147 58 HD3 LYS 311 1HD LYS 311 5.695 2.626 11.703 59 HE2 LYS 311 2HE LYS 311 4.326 4.701 13.450 60 HE3 LYS 311 1HE LYS 311 3.635 3.168 12.924 61 HZ1 LYS 311 1HZ LYS 311 4.454 2.994 15.155 62 HZ2 LYS 311 2HZ LYS 311 5.995 3.504 14.695 63 HZ3 LYS 311 3HZ LYS 311 5.397 2.021 14.148 64 H ASP 312 H ASP 312 8.917 8.819 11.183 65 HA ASP 312 HA ASP 312 8.850 9.489 9.002 66 HB2 ASP 312 2HB ASP 312 10.514 6.948 8.796 67 HB3 ASP 312 1HB ASP 312 10.412 8.159 7.515 68 H ASP 313 H ASP 313 6.435 8.634 9.384 69 HA ASP 313 HA ASP 313 5.583 6.698 7.436 70 HB2 ASP 313 2HB ASP 313 4.238 7.417 9.523 71 HB3 ASP 313 1HB ASP 313 3.812 8.871 8.629 72 H GLU 314 H GLU 314 6.200 7.154 5.424 73 HA GLU 314 HA GLU 314 6.425 9.769 4.290 74 HB2 GLU 314 2HB GLU 314 7.071 8.650 2.223 75 HB3 GLU 314 1HB GLU 314 7.890 7.907 3.589 76 HG2 GLU 314 2HG GLU 314 5.383 6.714 2.356 77 HG3 GLU 314 1HG GLU 314 6.995 6.356 1.746 78 H ASN 315 H ASN 315 3.665 8.025 4.919 79 HA ASN 315 HA ASN 315 2.208 8.833 2.487 80 HB2 ASN 315 2HB ASN 315 1.329 7.168 4.882 81 HB3 ASN 315 1HB ASN 315 0.324 7.518 3.479 82 HD21 ASN 315 1HD2 ASN 315 3.070 5.715 4.664 83 HD22 ASN 315 2HD2 ASN 315 3.206 4.644 3.316 84 H LYS 316 H LYS 316 2.607 9.690 5.861 85 HA LYS 316 HA LYS 316 0.520 11.784 5.626 86 HB2 LYS 316 2HB LYS 316 1.505 10.392 8.161 87 HB3 LYS 316 1HB LYS 316 0.307 11.684 8.104 88 HG2 LYS 316 2HG LYS 316 0.016 8.888 6.957 89 HG3 LYS 316 1HG LYS 316 -0.792 9.533 8.392 90 HD2 LYS 316 2HD LYS 316 -2.064 11.100 7.018 91 HD3 LYS 316 1HD LYS 316 -1.180 10.608 5.569 92 HE2 LYS 316 2HE LYS 316 -2.126 8.301 5.844 93 HE3 LYS 316 1HE LYS 316 -3.083 8.897 7.201 94 HZ1 LYS 316 1HZ LYS 316 -3.248 9.940 4.428 95 HZ2 LYS 316 2HZ LYS 316 -4.236 10.373 5.732 96 HZ3 LYS 316 3HZ LYS 316 -4.303 8.810 5.101 97 HA PRO 317 HA PRO 317 3.829 14.906 6.118 98 HB2 PRO 317 2HB PRO 317 1.476 16.435 7.234 99 HB3 PRO 317 1HB PRO 317 2.681 16.943 6.040 100 HG2 PRO 317 2HG PRO 317 0.210 16.263 5.278 101 HG3 PRO 317 1HG PRO 317 1.618 15.804 4.293 102 HD2 PRO 317 2HD PRO 317 -0.045 14.112 6.136 103 HD3 PRO 317 1HD PRO 317 0.719 13.683 4.591 104 H CYS 318 H CYS 318 4.968 15.800 7.901 105 HA CYS 318 HA CYS 318 4.579 14.555 10.467 106 HB2 CYS 318 2HB CYS 318 6.533 16.694 9.542 107 HB3 CYS 318 1HB CYS 318 6.482 16.075 11.185 108 H ARG 319 H ARG 319 3.938 15.540 12.410 109 HA ARG 319 HA ARG 319 2.643 18.174 12.373 110 HB2 ARG 319 2HB ARG 319 3.043 16.337 14.779 111 HB3 ARG 319 1HB ARG 319 1.864 17.632 14.599 112 HG2 ARG 319 2HG ARG 319 1.821 15.007 13.064 113 HG3 ARG 319 1HG ARG 319 0.888 15.348 14.517 114 HD2 ARG 319 2HD ARG 319 -0.656 15.677 12.787 115 HD3 ARG 319 1HD ARG 319 -0.128 17.316 13.169 116 HE ARG 319 HE ARG 319 1.443 16.230 11.072 117 HH11 ARG 319 1HH1 ARG 319 -1.737 17.582 11.663 118 HH12 ARG 319 2HH1 ARG 319 -1.990 18.030 10.007 119 HH21 ARG 319 1HH2 ARG 319 1.113 16.835 8.914 120 HH22 ARG 319 2HH2 ARG 319 -0.359 17.624 8.450 121 H LYS 320 H LYS 320 5.169 16.442 14.186 122 HA LYS 320 HA LYS 320 6.157 18.718 15.622 123 HB2 LYS 320 2HB LYS 320 7.211 15.864 15.421 124 HB3 LYS 320 1HB LYS 320 7.814 17.072 16.550 125 HG2 LYS 320 2HG LYS 320 5.591 17.143 17.651 126 HG3 LYS 320 1HG LYS 320 5.003 15.915 16.522 127 HD2 LYS 320 2HD LYS 320 6.685 14.307 17.382 128 HD3 LYS 320 1HD LYS 320 7.308 15.533 18.491 129 HE2 LYS 320 2HE LYS 320 4.479 14.415 18.555 130 HE3 LYS 320 1HE LYS 320 5.802 13.885 19.594 131 HZ1 LYS 320 1HZ LYS 320 4.393 15.481 20.712 132 HZ2 LYS 320 2HZ LYS 320 4.679 16.626 19.501 133 HZ3 LYS 320 3HZ LYS 320 5.945 16.114 20.494 134 H CYS 321 H CYS 321 6.677 18.241 12.444 135 HA CYS 321 HA CYS 321 9.398 19.420 12.559 136 HB2 CYS 321 2HB CYS 321 8.697 17.338 10.447 137 HB3 CYS 321 1HB CYS 321 10.275 18.019 10.818 138 H ALA 322 H ALA 322 6.249 19.694 11.488 139 HA ALA 322 HA ALA 322 6.908 21.111 8.966 140 HB1 ALA 322 1HB ALA 322 4.641 20.527 8.227 141 HB2 ALA 322 2HB ALA 322 4.319 19.729 9.771 142 HB3 ALA 322 3HB ALA 322 5.538 19.076 8.677 143 H CYS 323 H CYS 323 4.870 22.596 8.405 144 HA CYS 323 HA CYS 323 4.535 24.584 10.476 145 HB2 CYS 323 2HB CYS 323 4.664 25.405 8.215 146 HB3 CYS 323 1HB CYS 323 3.398 24.312 7.676 147 H HIS 324 H HIS 324 3.467 23.711 12.174 148 HA HIS 324 HA HIS 324 1.240 21.900 11.859 149 HB2 HIS 324 2HB HIS 324 3.091 21.775 13.644 150 HB3 HIS 324 1HB HIS 324 2.279 23.104 14.458 151 HD1 HIS 324 HD1 HIS 324 1.443 21.863 16.529 152 HD2 HIS 324 HD2 HIS 324 0.470 19.914 12.985 153 HE1 HIS 324 HE1 HIS 324 -0.051 19.930 17.164 154 H VAL 325 H VAL 325 1.517 25.225 11.845 155 HA VAL 325 HA VAL 325 -0.816 26.211 13.043 156 HB VAL 325 HB VAL 325 0.518 27.190 10.468 157 HG11 VAL 325 1HG1 VAL 325 -0.333 29.431 11.061 158 HG12 VAL 325 2HG1 VAL 325 -1.177 28.751 12.457 159 HG13 VAL 325 3HG1 VAL 325 -1.655 28.284 10.823 160 HG21 VAL 325 1HG2 VAL 325 1.883 28.672 11.908 161 HG22 VAL 325 2HG2 VAL 325 2.188 26.969 12.246 162 HG23 VAL 325 3HG2 VAL 325 1.186 27.918 13.346 163 H CYS 326 H CYS 326 -0.265 24.672 9.913 164 HA CYS 326 HA CYS 326 -3.185 24.348 9.492 165 HB2 CYS 326 2HB CYS 326 -2.867 24.651 7.083 166 HB3 CYS 326 1HB CYS 326 -2.214 26.054 7.923 167 H GLY 327 H GLY 327 -0.381 22.786 10.204 168 HA2 GLY 327 2HA GLY 327 0.403 20.640 10.101 169 HA3 GLY 327 1HA GLY 327 -1.163 20.157 9.474 170 H GLY 328 H GLY 328 0.552 22.571 7.703 171 HA2 GLY 328 2HA GLY 328 0.632 20.758 5.393 172 HA3 GLY 328 1HA GLY 328 0.636 22.513 5.354 173 H ARG 329 H ARG 329 2.387 20.485 4.076 174 HA ARG 329 HA ARG 329 5.016 21.639 4.851 175 HB2 ARG 329 2HB ARG 329 4.433 18.887 3.644 176 HB3 ARG 329 1HB ARG 329 6.048 19.549 3.910 177 HG2 ARG 329 2HG ARG 329 5.536 19.653 6.364 178 HG3 ARG 329 1HG ARG 329 4.005 18.837 6.041 179 HD2 ARG 329 2HD ARG 329 5.722 17.278 6.851 180 HD3 ARG 329 1HD ARG 329 5.215 16.870 5.205 181 HE ARG 329 HE ARG 329 7.700 18.379 5.793 182 HH11 ARG 329 1HH1 ARG 329 6.115 15.737 4.102 183 HH12 ARG 329 2HH1 ARG 329 7.548 15.292 3.231 184 HH21 ARG 329 1HH2 ARG 329 9.563 17.774 4.637 185 HH22 ARG 329 2HH2 ARG 329 9.477 16.449 3.524 186 H GLU 330 H GLU 330 3.165 22.899 3.208 187 HA GLU 330 HA GLU 330 3.598 22.282 0.403 188 HB2 GLU 330 2HB GLU 330 2.008 24.555 1.677 189 HB3 GLU 330 1HB GLU 330 1.855 23.961 0.022 190 HG2 GLU 330 2HG GLU 330 0.964 21.826 0.844 191 HG3 GLU 330 1HG GLU 330 1.192 22.346 2.514 192 H ALA 331 H ALA 331 4.979 23.321 -0.933 193 HA ALA 331 HA ALA 331 6.456 24.757 -1.858 194 HB1 ALA 331 1HB ALA 331 5.015 26.870 -0.222 195 HB2 ALA 331 2HB ALA 331 4.530 26.287 -1.815 196 HB3 ALA 331 3HB ALA 331 6.047 27.164 -1.629 197 HA PRO 332 HA PRO 332 9.447 24.484 1.684 198 HB2 PRO 332 2HB PRO 332 11.666 23.898 0.131 199 HB3 PRO 332 1HB PRO 332 10.512 22.679 0.691 200 HG2 PRO 332 2HG PRO 332 10.677 24.055 -1.982 201 HG3 PRO 332 1HG PRO 332 10.378 22.341 -1.623 202 HD2 PRO 332 2HD PRO 332 8.372 24.053 -2.269 203 HD3 PRO 332 1HD PRO 332 8.124 22.708 -1.137 204 H GLU 333 H GLU 333 9.621 26.323 -1.282 205 HA GLU 333 HA GLU 333 11.487 28.314 -0.691 206 HB2 GLU 333 2HB GLU 333 10.132 29.717 -2.310 207 HB3 GLU 333 1HB GLU 333 10.576 28.124 -2.918 208 HG2 GLU 333 2HG GLU 333 8.318 27.279 -2.452 209 HG3 GLU 333 1HG GLU 333 7.864 28.829 -1.747 210 H LYS 334 H LYS 334 8.118 27.986 0.321 211 HA LYS 334 HA LYS 334 8.197 30.554 1.777 212 HB2 LYS 334 2HB LYS 334 5.851 28.877 0.784 213 HB3 LYS 334 1HB LYS 334 5.659 30.271 1.850 214 HG2 LYS 334 2HG LYS 334 6.829 31.672 0.087 215 HG3 LYS 334 1HG LYS 334 6.762 30.271 -0.984 216 HD2 LYS 334 2HD LYS 334 4.231 31.378 0.283 217 HD3 LYS 334 1HD LYS 334 4.905 32.117 -1.170 218 HE2 LYS 334 2HE LYS 334 4.145 29.184 -0.943 219 HE3 LYS 334 1HE LYS 334 3.114 30.437 -1.634 220 HZ1 LYS 334 1HZ LYS 334 4.314 29.250 -3.343 221 HZ2 LYS 334 2HZ LYS 334 5.798 29.661 -2.648 222 HZ3 LYS 334 3HZ LYS 334 4.807 30.863 -3.305 223 H GLN 335 H GLN 335 8.775 27.367 2.416 224 HA GLN 335 HA GLN 335 7.652 27.331 5.114 225 HB2 GLN 335 2HB GLN 335 9.416 25.355 3.613 226 HB3 GLN 335 1HB GLN 335 9.008 25.163 5.318 227 HG2 GLN 335 2HG GLN 335 6.584 25.147 4.689 228 HG3 GLN 335 1HG GLN 335 7.058 25.213 2.996 229 HE21 GLN 335 1HE2 GLN 335 7.855 23.352 2.007 230 HE22 GLN 335 2HE2 GLN 335 7.815 21.800 2.756 231 H LEU 336 H LEU 336 8.564 28.569 6.576 232 HA LEU 336 HA LEU 336 11.511 28.891 6.722 233 HB2 LEU 336 2HB LEU 336 9.297 30.907 7.261 234 HB3 LEU 336 1HB LEU 336 10.962 31.160 7.765 235 HG LEU 336 HG LEU 336 10.101 30.800 4.864 236 HD11 LEU 336 1HD1 LEU 336 10.452 33.206 4.597 237 HD12 LEU 336 2HD1 LEU 336 10.794 33.373 6.322 238 HD13 LEU 336 3HD1 LEU 336 9.185 32.889 5.779 239 HD21 LEU 336 1HD2 LEU 336 12.365 31.611 4.328 240 HD22 LEU 336 2HD2 LEU 336 12.428 30.118 5.261 241 HD23 LEU 336 3HD2 LEU 336 12.765 31.665 6.047 242 H LEU 337 H LEU 337 12.404 28.300 8.571 243 HA LEU 337 HA LEU 337 10.675 26.982 10.536 244 HB2 LEU 337 2HB LEU 337 12.721 25.982 9.125 245 HB3 LEU 337 1HB LEU 337 13.675 26.631 10.441 246 HG LEU 337 HG LEU 337 11.439 24.583 10.781 247 HD11 LEU 337 1HD1 LEU 337 13.224 22.912 11.099 248 HD12 LEU 337 2HD1 LEU 337 14.437 24.127 10.685 249 HD13 LEU 337 3HD1 LEU 337 13.255 23.611 9.481 250 HD21 LEU 337 1HD2 LEU 337 13.533 25.544 12.757 251 HD22 LEU 337 2HD2 LEU 337 12.389 24.223 13.033 252 HD23 LEU 337 3HD2 LEU 337 11.799 25.870 12.819 253 H CYS 338 H CYS 338 10.306 27.915 12.479 254 HA CYS 338 HA CYS 338 11.861 30.097 13.532 255 HB2 CYS 338 2HB CYS 338 9.434 29.912 14.048 256 HB3 CYS 338 1HB CYS 338 9.746 28.440 14.974 257 H ASP 339 H ASP 339 13.841 29.740 14.188 258 HA ASP 339 HA ASP 339 15.151 27.429 14.910 259 HB2 ASP 339 2HB ASP 339 16.276 29.520 14.327 260 HB3 ASP 339 1HB ASP 339 15.649 30.308 15.760 261 H GLU 340 H GLU 340 13.532 29.729 17.089 262 HA GLU 340 HA GLU 340 14.253 28.601 19.564 263 HB2 GLU 340 2HB GLU 340 13.396 30.885 19.381 264 HB3 GLU 340 1HB GLU 340 11.853 30.299 18.781 265 HG2 GLU 340 2HG GLU 340 11.687 31.026 21.102 266 HG3 GLU 340 1HG GLU 340 11.338 29.305 20.948 267 H CYS 341 H CYS 341 11.148 28.265 17.777 268 HA CYS 341 HA CYS 341 10.019 26.451 19.705 269 HB2 CYS 341 2HB CYS 341 9.048 27.294 16.951 270 HB3 CYS 341 1HB CYS 341 8.105 26.319 18.080 271 H ASP 342 H ASP 342 12.012 26.035 16.954 272 HA ASP 342 HA ASP 342 12.695 24.379 15.608 273 HB2 ASP 342 2HB ASP 342 12.918 23.133 17.849 274 HB3 ASP 342 1HB ASP 342 11.396 22.366 17.494 275 H MET 343 H MET 343 9.801 25.468 15.577 276 HA MET 343 HA MET 343 8.582 23.368 13.877 277 HB2 MET 343 2HB MET 343 6.985 25.744 14.888 278 HB3 MET 343 1HB MET 343 6.416 24.179 14.321 279 HG2 MET 343 2HG MET 343 7.440 24.980 16.997 280 HG3 MET 343 1HG MET 343 6.015 24.049 16.587 281 HE1 MET 343 1HE MET 343 6.235 21.351 15.865 282 HE2 MET 343 2HE MET 343 7.802 20.533 15.846 283 HE3 MET 343 3HE MET 343 7.452 21.786 14.660 284 H ALA 344 H ALA 344 8.007 23.835 11.885 285 HA ALA 344 HA ALA 344 9.122 26.193 10.573 286 HB1 ALA 344 1HB ALA 344 7.763 23.741 9.384 287 HB2 ALA 344 2HB ALA 344 9.503 23.979 9.568 288 HB3 ALA 344 3HB ALA 344 8.584 25.015 8.472 289 H PHE 345 H PHE 345 7.825 27.505 9.141 290 HA PHE 345 HA PHE 345 4.898 27.500 9.576 291 HB2 PHE 345 2HB PHE 345 6.788 29.846 10.003 292 HB3 PHE 345 1HB PHE 345 5.158 30.146 9.418 293 HD1 PHE 345 HD1 PHE 345 6.606 27.973 12.143 294 HD2 PHE 345 HD2 PHE 345 3.790 31.002 11.077 295 HE1 PHE 345 HE1 PHE 345 5.756 28.000 14.439 296 HE2 PHE 345 HE2 PHE 345 2.948 31.026 13.391 297 HZ PHE 345 HZ PHE 345 3.925 29.518 15.072 298 H HIS 346 H HIS 346 3.890 29.106 7.976 299 HA HIS 346 HA HIS 346 5.298 29.156 5.367 300 HB2 HIS 346 2HB HIS 346 2.310 28.888 5.933 301 HB3 HIS 346 1HB HIS 346 2.965 29.253 4.342 302 HD2 HIS 346 HD2 HIS 346 5.221 27.053 3.987 303 HE1 HIS 346 HE1 HIS 346 2.135 24.309 4.865 304 HE2 HIS 346 HE2 HIS 346 4.302 24.668 3.624 305 H LEU 347 H LEU 347 5.109 31.116 4.193 306 HA LEU 347 HA LEU 347 5.087 33.547 5.551 307 HB2 LEU 347 2HB LEU 347 4.577 32.917 2.623 308 HB3 LEU 347 1HB LEU 347 4.754 34.560 3.223 309 HG LEU 347 HG LEU 347 6.908 32.404 3.361 310 HD11 LEU 347 1HD1 LEU 347 6.531 33.198 1.058 311 HD12 LEU 347 2HD1 LEU 347 8.100 33.709 1.673 312 HD13 LEU 347 3HD1 LEU 347 6.769 34.865 1.589 313 HD21 LEU 347 1HD2 LEU 347 8.400 34.223 4.108 314 HD22 LEU 347 2HD2 LEU 347 7.092 33.943 5.251 315 HD23 LEU 347 3HD2 LEU 347 7.027 35.333 4.164 316 H TYR 348 H TYR 348 2.453 31.970 3.794 317 HA TYR 348 HA TYR 348 0.510 34.044 4.306 318 HB2 TYR 348 2HB TYR 348 -1.089 32.452 3.170 319 HB3 TYR 348 1HB TYR 348 0.319 32.878 2.214 320 HD1 TYR 348 HD1 TYR 348 -1.502 30.121 3.792 321 HD2 TYR 348 HD2 TYR 348 2.166 31.171 1.855 322 HE1 TYR 348 HE1 TYR 348 -1.018 27.737 3.395 323 HE2 TYR 348 HE2 TYR 348 2.637 28.787 1.458 324 HH TYR 348 HH TYR 348 0.324 26.344 1.808 325 H CYS 349 H CYS 349 1.737 31.587 6.240 326 HA CYS 349 HA CYS 349 -0.690 31.414 7.932 327 HB2 CYS 349 2HB CYS 349 1.884 29.778 8.036 328 HB3 CYS 349 1HB CYS 349 0.512 29.579 9.128 329 H LEU 350 H LEU 350 1.778 33.497 7.594 330 HA LEU 350 HA LEU 350 2.460 33.872 10.426 331 HB2 LEU 350 2HB LEU 350 3.350 35.339 7.906 332 HB3 LEU 350 1HB LEU 350 3.885 35.770 9.526 333 HG LEU 350 HG LEU 350 4.413 33.082 8.197 334 HD11 LEU 350 1HD1 LEU 350 5.647 34.875 7.064 335 HD12 LEU 350 2HD1 LEU 350 6.733 33.811 7.954 336 HD13 LEU 350 3HD1 LEU 350 6.322 35.399 8.609 337 HD21 LEU 350 1HD2 LEU 350 4.298 32.911 10.642 338 HD22 LEU 350 2HD2 LEU 350 5.470 34.222 10.806 339 HD23 LEU 350 3HD2 LEU 350 5.951 32.690 10.075 340 H LYS 351 H LYS 351 2.188 36.004 11.413 341 HA LYS 351 HA LYS 351 0.003 37.684 10.373 342 HB2 LYS 351 2HB LYS 351 -0.674 35.805 12.177 343 HB3 LYS 351 1HB LYS 351 -0.000 36.953 13.322 344 HG2 LYS 351 2HG LYS 351 -2.294 37.506 11.401 345 HG3 LYS 351 1HG LYS 351 -2.468 37.110 13.113 346 HD2 LYS 351 2HD LYS 351 -1.212 39.199 13.679 347 HD3 LYS 351 1HD LYS 351 -1.136 39.594 11.960 348 HE2 LYS 351 2HE LYS 351 -3.597 39.731 11.868 349 HE3 LYS 351 1HE LYS 351 -3.698 39.276 13.571 350 HZ1 LYS 351 1HZ LYS 351 -2.437 41.740 12.498 351 HZ2 LYS 351 2HZ LYS 351 -2.486 41.302 14.130 352 HZ3 LYS 351 3HZ LYS 351 -3.921 41.649 13.302 353 HA PRO 352 HA PRO 352 0.180 39.468 9.480 354 HB2 PRO 352 2HB PRO 352 1.553 41.400 8.191 355 HB3 PRO 352 1HB PRO 352 0.595 41.772 9.632 356 HG2 PRO 352 2HG PRO 352 3.574 41.330 9.397 357 HG3 PRO 352 1HG PRO 352 2.698 42.603 10.279 358 HD2 PRO 352 2HD PRO 352 3.679 40.311 11.474 359 HD3 PRO 352 1HD PRO 352 2.299 41.229 12.106 360 HA PRO 353 HA PRO 353 2.310 36.607 6.743 361 HB2 PRO 353 2HB PRO 353 0.906 37.976 4.463 362 HB3 PRO 353 1HB PRO 353 0.910 36.266 4.925 363 HG2 PRO 353 2HG PRO 353 -1.233 37.783 5.415 364 HG3 PRO 353 1HG PRO 353 -0.688 36.583 6.611 365 HD2 PRO 353 2HD PRO 353 -0.258 39.580 6.606 366 HD3 PRO 353 1HD PRO 353 -0.723 38.509 7.950 367 H LEU 354 H LEU 354 4.423 36.917 6.458 368 HA LEU 354 HA LEU 354 5.609 39.278 5.315 369 HB2 LEU 354 2HB LEU 354 6.850 36.563 5.929 370 HB3 LEU 354 1HB LEU 354 7.753 37.990 5.439 371 HG LEU 354 HG LEU 354 6.215 37.631 8.038 372 HD11 LEU 354 1HD1 LEU 354 9.199 37.864 7.522 373 HD12 LEU 354 2HD1 LEU 354 8.329 36.414 8.029 374 HD13 LEU 354 3HD1 LEU 354 8.435 37.797 9.113 375 HD21 LEU 354 1HD2 LEU 354 5.973 39.952 7.366 376 HD22 LEU 354 2HD2 LEU 354 7.705 40.088 7.053 377 HD23 LEU 354 3HD2 LEU 354 7.118 39.854 8.702 378 H THR 355 H THR 355 6.691 39.427 3.317 379 HA THR 355 HA THR 355 5.434 37.943 1.149 380 HB THR 355 HB THR 355 5.635 40.372 0.938 381 HG1 THR 355 HG1 THR 355 5.696 39.235 -1.001 382 HG21 THR 355 1HG2 THR 355 7.805 41.493 0.612 383 HG22 THR 355 2HG2 THR 355 8.649 39.979 0.940 384 HG23 THR 355 3HG2 THR 355 7.711 40.760 2.215 385 H SER 356 H SER 356 8.513 38.014 2.779 386 HA SER 356 HA SER 356 9.477 35.646 1.433 387 HB2 SER 356 2HB SER 356 10.165 37.475 -0.165 388 HB3 SER 356 1HB SER 356 11.086 38.238 1.130 389 HG SER 356 HG SER 356 11.819 36.250 -0.503 390 H VAL 357 H VAL 357 11.959 35.367 2.307 391 HA VAL 357 HA VAL 357 11.842 35.259 5.145 392 HB VAL 357 HB VAL 357 13.107 33.571 3.935 393 HG11 VAL 357 1HG1 VAL 357 15.025 35.753 3.028 394 HG12 VAL 357 2HG1 VAL 357 13.893 34.872 2.003 395 HG13 VAL 357 3HG1 VAL 357 15.235 34.018 2.763 396 HG21 VAL 357 1HG2 VAL 357 14.993 35.247 5.634 397 HG22 VAL 357 2HG2 VAL 357 15.192 33.533 5.259 398 HG23 VAL 357 3HG2 VAL 357 13.827 34.068 6.241 399 HA PRO 358 HA PRO 358 13.034 39.553 6.017 400 HB2 PRO 358 2HB PRO 358 13.884 39.100 8.662 401 HB3 PRO 358 1HB PRO 358 12.215 39.400 8.173 402 HG2 PRO 358 2HG PRO 358 13.602 36.778 8.682 403 HG3 PRO 358 1HG PRO 358 11.971 37.296 9.162 404 HD2 PRO 358 2HD PRO 358 12.310 35.669 7.067 405 HD3 PRO 358 1HD PRO 358 11.093 36.962 7.000 406 HA PRO 359 HA PRO 359 17.458 39.572 5.128 407 HB2 PRO 359 2HB PRO 359 18.093 42.152 5.943 408 HB3 PRO 359 1HB PRO 359 17.276 41.766 4.424 409 HG2 PRO 359 2HG PRO 359 16.084 42.648 7.049 410 HG3 PRO 359 1HG PRO 359 15.714 43.211 5.403 411 HD2 PRO 359 2HD PRO 359 14.123 41.441 6.660 412 HD3 PRO 359 1HD PRO 359 14.421 41.316 4.912 413 H GLU 360 H GLU 360 16.236 39.855 8.333 414 HA GLU 360 HA GLU 360 18.601 39.911 9.860 415 HB2 GLU 360 2HB GLU 360 15.925 38.564 10.456 416 HB3 GLU 360 1HB GLU 360 17.232 38.688 11.623 417 HG2 GLU 360 2HG GLU 360 15.802 40.423 12.228 418 HG3 GLU 360 1HG GLU 360 17.070 41.230 11.318 419 HA PRO 361 HA PRO 361 20.303 35.820 8.879 420 HB2 PRO 361 2HB PRO 361 22.268 35.655 10.717 421 HB3 PRO 361 1HB PRO 361 22.319 36.883 9.441 422 HG2 PRO 361 2HG PRO 361 21.428 37.165 12.314 423 HG3 PRO 361 1HG PRO 361 22.510 38.218 11.376 424 HD2 PRO 361 2HD PRO 361 19.835 38.745 11.760 425 HD3 PRO 361 1HD PRO 361 20.745 39.308 10.340 426 H GLU 362 H GLU 362 18.164 36.293 11.224 427 HA GLU 362 HA GLU 362 18.179 33.544 12.281 428 HB2 GLU 362 2HB GLU 362 17.531 34.496 14.533 429 HB3 GLU 362 1HB GLU 362 19.168 34.927 14.042 430 HG2 GLU 362 2HG GLU 362 18.241 37.144 13.231 431 HG3 GLU 362 1HG GLU 362 16.712 36.704 13.988 432 H TRP 363 H TRP 363 16.042 32.710 12.546 433 HA TRP 363 HA TRP 363 13.837 34.486 11.675 434 HB2 TRP 363 2HB TRP 363 14.649 32.686 9.943 435 HB3 TRP 363 1HB TRP 363 13.827 31.522 10.981 436 HD1 TRP 363 HD1 TRP 363 13.164 34.198 8.387 437 HE1 TRP 363 HE1 TRP 363 10.651 34.349 7.891 438 HE3 TRP 363 HE3 TRP 363 11.376 31.191 12.125 439 HZ2 TRP 363 HZ2 TRP 363 8.243 33.345 8.916 440 HZ3 TRP 363 HZ3 TRP 363 8.949 30.840 12.300 441 HH2 TRP 363 HH2 TRP 363 7.416 31.897 10.727 442 H TYR 364 H TYR 364 12.375 34.711 13.157 443 HA TYR 364 HA TYR 364 11.581 32.475 14.913 444 HB2 TYR 364 2HB TYR 364 12.069 35.355 15.809 445 HB3 TYR 364 1HB TYR 364 11.358 34.095 16.815 446 HD1 TYR 364 HD1 TYR 364 12.802 31.941 17.168 447 HD2 TYR 364 HD2 TYR 364 14.447 35.661 15.862 448 HE1 TYR 364 HE1 TYR 364 15.030 31.207 17.884 449 HE2 TYR 364 HE2 TYR 364 16.679 34.917 16.586 450 HH TYR 364 HH TYR 364 17.331 31.653 17.508 451 H CYS 365 H CYS 365 9.409 32.586 15.635 452 HA CYS 365 HA CYS 365 7.564 33.784 13.728 453 HB2 CYS 365 2HB CYS 365 5.887 32.327 14.737 454 HB3 CYS 365 1HB CYS 365 7.357 31.382 14.528 455 HA PRO 366 HA PRO 366 6.364 37.360 16.217 456 HB2 PRO 366 2HB PRO 366 3.553 37.269 15.910 457 HB3 PRO 366 1HB PRO 366 4.681 38.030 14.784 458 HG2 PRO 366 2HG PRO 366 3.457 35.274 14.678 459 HG3 PRO 366 1HG PRO 366 3.690 36.447 13.361 460 HD2 PRO 366 2HD PRO 366 5.346 34.376 13.606 461 HD3 PRO 366 1HD PRO 366 6.001 35.980 13.194 462 H SER 367 H SER 367 4.576 34.348 16.717 463 HA SER 367 HA SER 367 3.374 34.747 19.178 464 HB2 SER 367 2HB SER 367 4.599 32.149 18.162 465 HB3 SER 367 1HB SER 367 3.297 32.303 19.347 466 HG SER 367 HG SER 367 1.995 32.310 17.709 467 H CYS 368 H CYS 368 6.775 34.097 18.495 468 HA CYS 368 HA CYS 368 7.610 33.210 21.058 469 HB2 CYS 368 2HB CYS 368 8.981 34.118 18.571 470 HB3 CYS 368 1HB CYS 368 9.918 34.313 20.046 471 H ARG 369 H ARG 369 7.448 36.467 19.615 472 HA ARG 369 HA ARG 369 8.828 37.658 21.906 473 HB2 ARG 369 2HB ARG 369 8.778 39.759 20.549 474 HB3 ARG 369 1HB ARG 369 9.565 38.409 19.743 475 HG2 ARG 369 2HG ARG 369 7.538 38.041 18.369 476 HG3 ARG 369 1HG ARG 369 6.749 39.402 19.174 477 HD2 ARG 369 2HD ARG 369 9.266 39.557 17.474 478 HD3 ARG 369 1HD ARG 369 7.644 40.043 16.968 479 HE ARG 369 HE ARG 369 8.325 41.438 19.319 480 HH11 ARG 369 1HH1 ARG 369 9.220 41.367 15.929 481 HH12 ARG 369 2HH1 ARG 369 9.683 43.036 15.893 482 HH21 ARG 369 1HH2 ARG 369 8.952 43.616 19.277 483 HH22 ARG 369 2HH2 ARG 369 9.534 44.312 17.798 484 H THR 370 H THR 370 5.559 37.648 20.519 485 HA THR 370 HA THR 370 4.623 39.413 22.716 486 HB THR 370 HB THR 370 4.121 40.303 20.463 487 HG1 THR 370 HG1 THR 370 1.978 40.758 20.880 488 HG21 THR 370 1HG2 THR 370 2.471 37.783 20.045 489 HG22 THR 370 2HG2 THR 370 3.922 38.245 19.151 490 HG23 THR 370 3HG2 THR 370 2.451 39.203 18.998 491 H ASP 371 H ASP 371 2.276 38.915 23.341 492 HA ASP 371 HA ASP 371 2.217 36.343 24.585 493 HB2 ASP 371 2HB ASP 371 0.172 38.603 24.493 494 HB3 ASP 371 1HB ASP 371 -0.012 37.162 25.490 495 H SER 372 H SER 372 1.484 37.021 21.450 496 HA SER 372 HA SER 372 -0.937 35.561 21.041 497 HB2 SER 372 2HB SER 372 1.232 36.397 19.077 498 HB3 SER 372 1HB SER 372 -0.360 35.779 18.628 499 HG SER 372 HG SER 372 -0.438 37.889 20.398 500 H SER 373 H SER 373 1.664 34.220 22.298 501 HA SER 373 HA SER 373 2.066 31.818 20.871 502 HB2 SER 373 2HB SER 373 2.010 32.164 23.907 503 HB3 SER 373 1HB SER 373 2.832 30.892 23.007 504 HG SER 373 HG SER 373 3.561 33.446 22.287 505 H GLU 374 H GLU 374 0.056 31.125 20.025 506 HA GLU 374 HA GLU 374 -2.315 30.696 21.499 507 HB2 GLU 374 2HB GLU 374 -2.295 30.752 19.040 508 HB3 GLU 374 1HB GLU 374 -1.316 29.293 18.981 509 HG2 GLU 374 2HG GLU 374 -3.173 27.988 19.927 510 HG3 GLU 374 1HG GLU 374 -4.146 29.454 20.057 511 H VAL 375 H VAL 375 -3.174 28.797 22.437 512 HA VAL 375 HA VAL 375 -1.384 27.478 24.156 513 HB VAL 375 HB VAL 375 -4.261 26.651 23.539 514 HG11 VAL 375 1HG1 VAL 375 -4.248 25.610 25.797 515 HG12 VAL 375 2HG1 VAL 375 -2.538 26.009 25.976 516 HG13 VAL 375 3HG1 VAL 375 -3.053 24.864 24.736 517 HG21 VAL 375 1HG2 VAL 375 -3.217 28.558 25.671 518 HG22 VAL 375 2HG2 VAL 375 -4.890 28.020 25.505 519 HG23 VAL 375 3HG2 VAL 375 -4.152 29.003 24.242 520 H VAL 376 H VAL 376 0.186 26.360 23.126 521 HA VAL 376 HA VAL 376 -0.115 24.302 21.194 522 HB VAL 376 HB VAL 376 2.108 24.687 23.272 523 HG11 VAL 376 1HG1 VAL 376 3.548 23.400 21.723 524 HG12 VAL 376 2HG1 VAL 376 2.163 23.117 20.666 525 HG13 VAL 376 3HG1 VAL 376 2.185 22.433 22.293 526 HG21 VAL 376 1HG2 VAL 376 1.822 26.708 21.886 527 HG22 VAL 376 2HG2 VAL 376 1.949 25.742 20.416 528 HG23 VAL 376 3HG2 VAL 376 3.340 25.899 21.490 529 H GLN 377 H GLN 377 -1.104 22.395 21.512 530 HA GLN 377 HA GLN 377 -2.451 21.787 23.874 531 HB2 GLN 377 2HB GLN 377 -3.117 19.655 22.774 532 HB3 GLN 377 1HB GLN 377 -3.335 21.060 21.737 533 HG2 GLN 377 2HG GLN 377 -1.395 20.485 20.428 534 HG3 GLN 377 1HG GLN 377 -0.941 19.201 21.548 535 HE21 GLN 377 1HE2 GLN 377 -2.074 17.233 21.499 536 HE22 GLN 377 2HE2 GLN 377 -3.138 16.810 20.205 537 H ALA 378 H ALA 378 -2.227 20.304 25.480 538 HA ALA 378 HA ALA 378 0.328 19.218 26.174 539 HB1 ALA 378 1HB ALA 378 -0.867 18.295 28.129 540 HB2 ALA 378 2HB ALA 378 -2.415 18.737 27.402 541 HB3 ALA 378 3HB ALA 378 -1.271 19.993 27.877 542 H GLY 379 H GLY 379 0.274 16.802 26.965 543 HA2 GLY 379 2HA GLY 379 -0.182 14.524 26.414 544 HA3 GLY 379 1HA GLY 379 -0.758 15.027 24.829 545 H GLU 380 H GLU 380 1.911 16.841 25.420 546 HA GLU 380 HA GLU 380 4.065 16.930 24.842 547 HB2 GLU 380 2HB GLU 380 4.032 13.920 25.361 548 HB3 GLU 380 1HB GLU 380 5.488 14.901 25.204 549 HG2 GLU 380 2HG GLU 380 4.973 16.120 27.228 550 HG3 GLU 380 1HG GLU 380 3.379 15.374 27.342 Start of MODEL 7 1 H1 SER 303 H SER 303 15.471 8.912 3.296 2 HA SER 303 HA SER 303 17.442 9.855 1.376 3 HB2 SER 303 2HB SER 303 15.135 9.242 0.662 4 HB3 SER 303 1HB SER 303 14.487 10.547 1.655 5 HG SER 303 HG SER 303 15.110 11.969 0.212 6 H GLY 304 H GLY 304 16.251 10.898 4.408 7 HA2 GLY 304 2HA GLY 304 17.690 13.482 4.136 8 HA3 GLY 304 1HA GLY 304 16.090 13.422 4.875 9 HA PRO 305 HA PRO 305 19.091 12.737 8.416 10 HB2 PRO 305 2HB PRO 305 17.914 14.493 10.156 11 HB3 PRO 305 1HB PRO 305 19.097 15.013 8.945 12 HG2 PRO 305 2HG PRO 305 16.083 15.136 8.821 13 HG3 PRO 305 1HG PRO 305 17.267 16.399 8.414 14 HD2 PRO 305 2HD PRO 305 16.090 14.851 6.511 15 HD3 PRO 305 1HD PRO 305 17.756 15.445 6.330 16 H SER 306 H SER 306 18.596 11.750 10.480 17 HA SER 306 HA SER 306 16.471 9.873 10.394 18 HB2 SER 306 2HB SER 306 17.262 9.261 12.741 19 HB3 SER 306 1HB SER 306 18.514 9.212 11.503 20 HG SER 306 HG SER 306 19.557 10.738 12.498 21 H CYS 307 H CYS 307 14.433 10.532 10.596 22 HA CYS 307 HA CYS 307 13.576 12.666 12.341 23 HB2 CYS 307 2HB CYS 307 12.232 10.748 10.443 24 HB3 CYS 307 1HB CYS 307 11.249 11.607 11.621 25 H ARG 308 H ARG 308 14.191 12.012 14.441 26 HA ARG 308 HA ARG 308 13.169 9.522 15.569 27 HB2 ARG 308 2HB ARG 308 14.165 10.454 17.768 28 HB3 ARG 308 1HB ARG 308 15.274 9.983 16.499 29 HG2 ARG 308 2HG ARG 308 14.485 12.890 16.747 30 HG3 ARG 308 1HG ARG 308 15.657 12.208 17.877 31 HD2 ARG 308 2HD ARG 308 17.071 11.497 15.973 32 HD3 ARG 308 1HD ARG 308 15.908 12.203 14.850 33 HE ARG 308 HE ARG 308 16.811 14.148 16.716 34 HH11 ARG 308 1HH1 ARG 308 17.863 12.456 13.805 35 HH12 ARG 308 2HH1 ARG 308 18.989 13.695 13.360 36 HH21 ARG 308 1HH2 ARG 308 18.305 15.759 16.085 37 HH22 ARG 308 2HH2 ARG 308 19.235 15.552 14.635 38 H PHE 309 H PHE 309 12.367 12.933 15.587 39 HA PHE 309 HA PHE 309 10.293 12.806 17.552 40 HB2 PHE 309 2HB PHE 309 10.941 14.814 15.363 41 HB3 PHE 309 1HB PHE 309 9.557 15.015 16.435 42 HD1 PHE 309 HD1 PHE 309 9.835 15.877 18.653 43 HD2 PHE 309 HD2 PHE 309 13.284 14.769 16.378 44 HE1 PHE 309 HE1 PHE 309 11.291 16.909 20.347 45 HE2 PHE 309 HE2 PHE 309 14.726 15.806 18.075 46 HZ PHE 309 HZ PHE 309 13.737 16.869 20.060 47 H CYS 310 H CYS 310 10.430 11.979 14.170 48 HA CYS 310 HA CYS 310 7.491 11.607 14.035 49 HB2 CYS 310 2HB CYS 310 9.287 11.443 11.608 50 HB3 CYS 310 1HB CYS 310 7.600 11.949 11.710 51 H LYS 311 H LYS 311 10.195 9.914 14.788 52 HA LYS 311 HA LYS 311 10.858 7.780 14.955 53 HB2 LYS 311 2HB LYS 311 7.894 7.183 14.615 54 HB3 LYS 311 1HB LYS 311 9.090 6.049 15.242 55 HG2 LYS 311 2HG LYS 311 8.330 8.695 16.538 56 HG3 LYS 311 1HG LYS 311 7.749 7.105 17.037 57 HD2 LYS 311 2HD LYS 311 10.011 6.428 17.665 58 HD3 LYS 311 1HD LYS 311 10.673 7.944 17.043 59 HE2 LYS 311 2HE LYS 311 10.494 7.977 19.500 60 HE3 LYS 311 1HE LYS 311 9.460 9.205 18.770 61 HZ1 LYS 311 1HZ LYS 311 8.346 8.038 20.561 62 HZ2 LYS 311 2HZ LYS 311 8.551 6.559 19.772 63 HZ3 LYS 311 3HZ LYS 311 7.564 7.750 19.092 64 H ASP 312 H ASP 312 10.690 8.968 12.227 65 HA ASP 312 HA ASP 312 11.126 8.539 10.077 66 HB2 ASP 312 2HB ASP 312 12.402 6.129 11.394 67 HB3 ASP 312 1HB ASP 312 12.524 6.376 9.655 68 H ASP 313 H ASP 313 8.492 7.559 11.094 69 HA ASP 313 HA ASP 313 7.752 5.353 9.426 70 HB2 ASP 313 2HB ASP 313 6.028 7.491 10.741 71 HB3 ASP 313 1HB ASP 313 5.407 6.041 9.959 72 H GLU 314 H GLU 314 8.291 5.665 7.343 73 HA GLU 314 HA GLU 314 8.083 8.077 5.845 74 HB2 GLU 314 2HB GLU 314 8.388 5.191 4.940 75 HB3 GLU 314 1HB GLU 314 8.636 6.600 3.908 76 HG2 GLU 314 2HG GLU 314 10.548 7.299 5.255 77 HG3 GLU 314 1HG GLU 314 10.265 5.985 6.399 78 H ASN 315 H ASN 315 5.910 5.382 6.405 79 HA ASN 315 HA ASN 315 4.053 5.906 4.282 80 HB2 ASN 315 2HB ASN 315 3.714 4.333 6.873 81 HB3 ASN 315 1HB ASN 315 2.526 4.366 5.575 82 HD21 ASN 315 1HD2 ASN 315 3.087 3.403 3.556 83 HD22 ASN 315 2HD2 ASN 315 4.293 2.174 3.470 84 H LYS 316 H LYS 316 4.553 7.204 7.447 85 HA LYS 316 HA LYS 316 1.958 8.611 7.466 86 HB2 LYS 316 2HB LYS 316 4.116 8.335 9.603 87 HB3 LYS 316 1HB LYS 316 2.601 9.213 9.813 88 HG2 LYS 316 2HG LYS 316 1.329 7.127 9.552 89 HG3 LYS 316 1HG LYS 316 2.822 6.240 9.236 90 HD2 LYS 316 2HD LYS 316 2.096 5.872 11.542 91 HD3 LYS 316 1HD LYS 316 3.620 6.760 11.514 92 HE2 LYS 316 2HE LYS 316 2.401 8.869 11.957 93 HE3 LYS 316 1HE LYS 316 0.871 7.985 11.954 94 HZ1 LYS 316 1HZ LYS 316 3.110 7.559 13.850 95 HZ2 LYS 316 2HZ LYS 316 1.641 6.722 13.853 96 HZ3 LYS 316 3HZ LYS 316 1.670 8.378 14.188 97 HA PRO 317 HA PRO 317 4.029 12.440 6.128 98 HB2 PRO 317 2HB PRO 317 1.819 13.851 7.579 99 HB3 PRO 317 1HB PRO 317 2.296 13.974 5.880 100 HG2 PRO 317 2HG PRO 317 0.056 12.681 6.591 101 HG3 PRO 317 1HG PRO 317 1.079 12.073 5.270 102 HD2 PRO 317 2HD PRO 317 0.925 11.119 8.137 103 HD3 PRO 317 1HD PRO 317 0.981 10.165 6.636 104 H CYS 318 H CYS 318 5.386 13.956 7.047 105 HA CYS 318 HA CYS 318 6.050 13.755 9.846 106 HB2 CYS 318 2HB CYS 318 7.096 15.388 7.531 107 HB3 CYS 318 1HB CYS 318 7.521 15.846 9.171 108 H ARG 319 H ARG 319 4.494 14.560 11.187 109 HA ARG 319 HA ARG 319 3.332 17.205 10.779 110 HB2 ARG 319 2HB ARG 319 3.067 15.375 13.205 111 HB3 ARG 319 1HB ARG 319 2.074 16.783 12.826 112 HG2 ARG 319 2HG ARG 319 1.299 15.559 10.746 113 HG3 ARG 319 1HG ARG 319 2.150 14.133 11.347 114 HD2 ARG 319 2HD ARG 319 -0.197 13.951 11.929 115 HD3 ARG 319 1HD ARG 319 0.724 14.225 13.417 116 HE ARG 319 HE ARG 319 -0.408 16.574 12.088 117 HH11 ARG 319 1HH1 ARG 319 -0.834 14.236 14.691 118 HH12 ARG 319 2HH1 ARG 319 -1.912 15.263 15.577 119 HH21 ARG 319 1HH2 ARG 319 -1.824 17.878 13.249 120 HH22 ARG 319 2HH2 ARG 319 -2.479 17.325 14.756 121 H LYS 320 H LYS 320 5.880 15.643 12.557 122 HA LYS 320 HA LYS 320 6.548 17.874 14.269 123 HB2 LYS 320 2HB LYS 320 7.851 15.190 13.734 124 HB3 LYS 320 1HB LYS 320 8.547 16.364 14.840 125 HG2 LYS 320 2HG LYS 320 5.692 15.469 15.266 126 HG3 LYS 320 1HG LYS 320 7.009 14.392 15.717 127 HD2 LYS 320 2HD LYS 320 6.374 15.614 17.690 128 HD3 LYS 320 1HD LYS 320 7.946 16.217 17.174 129 HE2 LYS 320 2HE LYS 320 6.799 18.179 16.132 130 HE3 LYS 320 1HE LYS 320 5.261 17.588 16.760 131 HZ1 LYS 320 1HZ LYS 320 6.110 17.840 18.988 132 HZ2 LYS 320 2HZ LYS 320 6.255 19.300 18.148 133 HZ3 LYS 320 3HZ LYS 320 7.615 18.332 18.399 134 H CYS 321 H CYS 321 7.164 17.233 11.019 135 HA CYS 321 HA CYS 321 9.313 19.281 10.993 136 HB2 CYS 321 2HB CYS 321 8.782 17.154 8.881 137 HB3 CYS 321 1HB CYS 321 10.021 18.402 8.787 138 H ALA 322 H ALA 322 6.158 19.092 10.854 139 HA ALA 322 HA ALA 322 5.619 20.507 8.343 140 HB1 ALA 322 1HB ALA 322 3.238 20.155 8.897 141 HB2 ALA 322 2HB ALA 322 3.698 19.418 10.437 142 HB3 ALA 322 3HB ALA 322 4.133 18.636 8.918 143 H CYS 323 H CYS 323 3.797 22.108 8.631 144 HA CYS 323 HA CYS 323 4.394 24.123 10.703 145 HB2 CYS 323 2HB CYS 323 4.842 25.150 8.644 146 HB3 CYS 323 1HB CYS 323 3.577 24.269 7.803 147 H HIS 324 H HIS 324 3.021 23.702 12.314 148 HA HIS 324 HA HIS 324 0.639 22.192 12.092 149 HB2 HIS 324 2HB HIS 324 2.153 22.222 14.094 150 HB3 HIS 324 1HB HIS 324 1.632 23.863 14.450 151 HD1 HIS 324 HD1 HIS 324 -0.863 24.128 15.345 152 HD2 HIS 324 HD2 HIS 324 0.451 20.205 14.924 153 HE1 HIS 324 HE1 HIS 324 -2.487 22.695 16.644 154 H VAL 325 H VAL 325 1.251 25.585 11.908 155 HA VAL 325 HA VAL 325 -1.093 26.789 12.737 156 HB VAL 325 HB VAL 325 0.650 27.661 10.388 157 HG11 VAL 325 1HG1 VAL 325 -1.218 29.336 12.118 158 HG12 VAL 325 2HG1 VAL 325 -1.476 28.906 10.426 159 HG13 VAL 325 3HG1 VAL 325 -0.134 29.963 10.868 160 HG21 VAL 325 1HG2 VAL 325 0.905 28.367 13.335 161 HG22 VAL 325 2HG2 VAL 325 1.872 29.059 12.029 162 HG23 VAL 325 3HG2 VAL 325 2.003 27.340 12.407 163 H CYS 326 H CYS 326 -0.328 25.415 9.534 164 HA CYS 326 HA CYS 326 -3.204 25.508 8.788 165 HB2 CYS 326 2HB CYS 326 -2.515 25.478 6.438 166 HB3 CYS 326 1HB CYS 326 -1.733 26.823 7.261 167 H GLY 327 H GLY 327 -0.857 23.451 9.921 168 HA2 GLY 327 2HA GLY 327 -0.513 21.187 9.964 169 HA3 GLY 327 1HA GLY 327 -2.140 21.013 9.320 170 H GLY 328 H GLY 328 0.773 22.515 7.898 171 HA2 GLY 328 2HA GLY 328 0.662 20.635 5.619 172 HA3 GLY 328 1HA GLY 328 0.483 22.358 5.332 173 H ARG 329 H ARG 329 2.462 20.665 4.244 174 HA ARG 329 HA ARG 329 5.009 21.722 5.371 175 HB2 ARG 329 2HB ARG 329 4.402 19.151 3.835 176 HB3 ARG 329 1HB ARG 329 6.039 19.708 4.193 177 HG2 ARG 329 2HG ARG 329 5.681 19.445 6.580 178 HG3 ARG 329 1HG ARG 329 3.971 19.078 6.327 179 HD2 ARG 329 2HD ARG 329 6.268 17.380 5.293 180 HD3 ARG 329 1HD ARG 329 5.375 17.065 6.783 181 HE ARG 329 HE ARG 329 3.337 17.001 5.223 182 HH11 ARG 329 1HH1 ARG 329 6.521 15.907 4.211 183 HH12 ARG 329 2HH1 ARG 329 5.884 14.718 3.125 184 HH21 ARG 329 1HH2 ARG 329 2.547 15.435 3.790 185 HH22 ARG 329 2HH2 ARG 329 3.656 14.450 2.889 186 H GLU 330 H GLU 330 2.910 22.537 3.093 187 HA GLU 330 HA GLU 330 4.362 21.961 0.651 188 HB2 GLU 330 2HB GLU 330 1.688 23.369 0.980 189 HB3 GLU 330 1HB GLU 330 2.351 22.678 -0.501 190 HG2 GLU 330 2HG GLU 330 0.901 20.989 0.143 191 HG3 GLU 330 1HG GLU 330 2.401 20.470 0.882 192 H ALA 331 H ALA 331 4.759 23.520 -0.999 193 HA ALA 331 HA ALA 331 5.803 25.301 -1.858 194 HB1 ALA 331 1HB ALA 331 3.818 26.605 -1.190 195 HB2 ALA 331 2HB ALA 331 5.291 27.571 -1.118 196 HB3 ALA 331 3HB ALA 331 4.567 26.952 0.370 197 HA PRO 332 HA PRO 332 9.239 24.254 1.104 198 HB2 PRO 332 2HB PRO 332 11.192 23.952 -0.844 199 HB3 PRO 332 1HB PRO 332 10.049 22.681 -0.393 200 HG2 PRO 332 2HG PRO 332 9.899 24.632 -2.690 201 HG3 PRO 332 1HG PRO 332 9.615 22.875 -2.693 202 HD2 PRO 332 2HD PRO 332 7.556 24.590 -2.643 203 HD3 PRO 332 1HD PRO 332 7.499 23.084 -1.704 204 H GLU 333 H GLU 333 9.395 26.586 -1.529 205 HA GLU 333 HA GLU 333 11.639 28.089 -0.606 206 HB2 GLU 333 2HB GLU 333 10.929 29.731 -2.333 207 HB3 GLU 333 1HB GLU 333 10.982 28.088 -2.965 208 HG2 GLU 333 2HG GLU 333 8.540 27.908 -2.781 209 HG3 GLU 333 1HG GLU 333 8.458 29.518 -2.079 210 H LYS 334 H LYS 334 8.371 27.962 0.417 211 HA LYS 334 HA LYS 334 8.449 30.652 1.649 212 HB2 LYS 334 2HB LYS 334 5.985 28.876 1.487 213 HB3 LYS 334 1HB LYS 334 6.067 30.618 1.708 214 HG2 LYS 334 2HG LYS 334 6.814 29.151 -0.844 215 HG3 LYS 334 1HG LYS 334 5.249 29.901 -0.545 216 HD2 LYS 334 2HD LYS 334 7.884 31.429 -0.570 217 HD3 LYS 334 1HD LYS 334 6.844 31.242 -1.984 218 HE2 LYS 334 2HE LYS 334 4.997 32.319 -0.666 219 HE3 LYS 334 1HE LYS 334 6.169 32.651 0.609 220 HZ1 LYS 334 1HZ LYS 334 5.883 34.556 -0.812 221 HZ2 LYS 334 2HZ LYS 334 6.280 33.644 -2.180 222 HZ3 LYS 334 3HZ LYS 334 7.450 33.942 -0.998 223 H GLN 335 H GLN 335 9.211 27.516 2.438 224 HA GLN 335 HA GLN 335 8.086 27.367 5.099 225 HB2 GLN 335 2HB GLN 335 10.282 25.707 3.788 226 HB3 GLN 335 1HB GLN 335 9.639 25.403 5.402 227 HG2 GLN 335 2HG GLN 335 7.372 25.083 4.341 228 HG3 GLN 335 1HG GLN 335 8.166 25.178 2.767 229 HE21 GLN 335 1HE2 GLN 335 7.724 23.251 5.653 230 HE22 GLN 335 2HE2 GLN 335 8.412 21.795 5.033 231 H LEU 336 H LEU 336 8.858 28.297 6.854 232 HA LEU 336 HA LEU 336 11.722 28.947 7.117 233 HB2 LEU 336 2HB LEU 336 9.308 30.647 7.787 234 HB3 LEU 336 1HB LEU 336 10.804 30.860 8.681 235 HG LEU 336 HG LEU 336 10.474 31.226 5.679 236 HD11 LEU 336 1HD1 LEU 336 10.883 33.600 6.114 237 HD12 LEU 336 2HD1 LEU 336 10.957 33.288 7.851 238 HD13 LEU 336 3HD1 LEU 336 9.446 33.045 6.972 239 HD21 LEU 336 1HD2 LEU 336 12.699 30.353 6.216 240 HD22 LEU 336 2HD2 LEU 336 12.919 31.626 7.423 241 HD23 LEU 336 3HD2 LEU 336 12.794 32.038 5.711 242 H LEU 337 H LEU 337 12.541 27.680 8.609 243 HA LEU 337 HA LEU 337 10.870 26.421 10.647 244 HB2 LEU 337 2HB LEU 337 13.753 25.971 9.782 245 HB3 LEU 337 1HB LEU 337 13.058 25.178 11.183 246 HG LEU 337 HG LEU 337 11.335 24.134 9.670 247 HD11 LEU 337 1HD1 LEU 337 13.026 25.211 7.401 248 HD12 LEU 337 2HD1 LEU 337 11.368 25.681 7.787 249 HD13 LEU 337 3HD1 LEU 337 11.712 24.039 7.250 250 HD21 LEU 337 1HD2 LEU 337 13.275 22.853 10.411 251 HD22 LEU 337 2HD2 LEU 337 14.221 23.451 9.047 252 HD23 LEU 337 3HD2 LEU 337 12.832 22.400 8.765 253 H CYS 338 H CYS 338 10.590 27.408 12.509 254 HA CYS 338 HA CYS 338 12.230 29.578 13.467 255 HB2 CYS 338 2HB CYS 338 9.597 29.005 13.744 256 HB3 CYS 338 1HB CYS 338 10.187 28.319 15.258 257 H ASP 339 H ASP 339 14.040 29.291 14.620 258 HA ASP 339 HA ASP 339 15.197 26.822 15.171 259 HB2 ASP 339 2HB ASP 339 16.443 28.970 14.849 260 HB3 ASP 339 1HB ASP 339 15.894 29.522 16.423 261 H GLU 340 H GLU 340 14.124 29.202 17.499 262 HA GLU 340 HA GLU 340 14.519 27.684 19.835 263 HB2 GLU 340 2HB GLU 340 13.779 29.651 20.974 264 HB3 GLU 340 1HB GLU 340 14.589 30.217 19.523 265 HG2 GLU 340 2HG GLU 340 11.652 30.242 20.172 266 HG3 GLU 340 1HG GLU 340 12.707 31.603 19.812 267 H CYS 341 H CYS 341 11.722 28.057 17.757 268 HA CYS 341 HA CYS 341 9.832 26.773 19.574 269 HB2 CYS 341 2HB CYS 341 9.601 27.660 16.672 270 HB3 CYS 341 1HB CYS 341 8.321 26.776 17.494 271 H ASP 342 H ASP 342 12.109 25.843 17.168 272 HA ASP 342 HA ASP 342 12.762 23.949 16.172 273 HB2 ASP 342 2HB ASP 342 11.256 22.558 18.428 274 HB3 ASP 342 1HB ASP 342 12.421 21.777 17.365 275 H MET 343 H MET 343 10.095 25.131 15.531 276 HA MET 343 HA MET 343 8.796 22.840 14.180 277 HB2 MET 343 2HB MET 343 7.546 25.328 15.406 278 HB3 MET 343 1HB MET 343 6.673 24.289 14.291 279 HG2 MET 343 2HG MET 343 7.827 23.202 16.858 280 HG3 MET 343 1HG MET 343 6.269 24.010 16.806 281 HE1 MET 343 1HE MET 343 8.240 20.731 16.102 282 HE2 MET 343 2HE MET 343 8.045 21.213 14.416 283 HE3 MET 343 3HE MET 343 7.160 19.825 15.043 284 H ALA 344 H ALA 344 8.143 23.137 12.111 285 HA ALA 344 HA ALA 344 9.378 25.253 10.543 286 HB1 ALA 344 1HB ALA 344 8.524 23.999 8.592 287 HB2 ALA 344 2HB ALA 344 7.652 22.900 9.665 288 HB3 ALA 344 3HB ALA 344 9.416 22.936 9.683 289 H PHE 345 H PHE 345 8.214 26.778 9.345 290 HA PHE 345 HA PHE 345 5.287 26.948 9.657 291 HB2 PHE 345 2HB PHE 345 7.216 29.258 10.211 292 HB3 PHE 345 1HB PHE 345 5.465 29.431 10.073 293 HD1 PHE 345 HD1 PHE 345 8.177 28.744 12.341 294 HD2 PHE 345 HD2 PHE 345 4.005 28.093 11.703 295 HE1 PHE 345 HE1 PHE 345 7.886 28.182 14.721 296 HE2 PHE 345 HE2 PHE 345 3.729 27.542 14.081 297 HZ PHE 345 HZ PHE 345 5.670 27.582 15.590 298 H HIS 346 H HIS 346 4.570 28.919 8.195 299 HA HIS 346 HA HIS 346 6.147 28.980 5.695 300 HB2 HIS 346 2HB HIS 346 3.114 28.795 5.937 301 HB3 HIS 346 1HB HIS 346 3.961 29.143 4.437 302 HD2 HIS 346 HD2 HIS 346 6.101 26.826 4.251 303 HE1 HIS 346 HE1 HIS 346 2.802 24.237 4.795 304 HE2 HIS 346 HE2 HIS 346 5.073 24.516 3.753 305 H LEU 347 H LEU 347 5.757 30.905 4.438 306 HA LEU 347 HA LEU 347 6.155 33.233 5.924 307 HB2 LEU 347 2HB LEU 347 5.690 32.662 2.994 308 HB3 LEU 347 1HB LEU 347 5.822 34.323 3.545 309 HG LEU 347 HG LEU 347 7.978 32.229 4.040 310 HD11 LEU 347 1HD1 LEU 347 9.300 33.329 2.283 311 HD12 LEU 347 2HD1 LEU 347 7.912 34.339 1.869 312 HD13 LEU 347 3HD1 LEU 347 7.836 32.592 1.638 313 HD21 LEU 347 1HD2 LEU 347 8.001 35.244 4.369 314 HD22 LEU 347 2HD2 LEU 347 9.381 34.170 4.605 315 HD23 LEU 347 3HD2 LEU 347 7.984 34.047 5.670 316 H TYR 348 H TYR 348 3.175 32.134 4.268 317 HA TYR 348 HA TYR 348 1.766 34.562 5.151 318 HB2 TYR 348 2HB TYR 348 0.726 32.309 3.398 319 HB3 TYR 348 1HB TYR 348 -0.054 33.863 3.675 320 HD1 TYR 348 HD1 TYR 348 2.182 32.060 1.564 321 HD2 TYR 348 HD2 TYR 348 1.297 36.004 2.946 322 HE1 TYR 348 HE1 TYR 348 3.410 32.993 -0.329 323 HE2 TYR 348 HE2 TYR 348 2.528 36.947 1.035 324 HH TYR 348 HH TYR 348 3.445 35.131 -1.645 325 H CYS 349 H CYS 349 2.552 31.868 6.674 326 HA CYS 349 HA CYS 349 -0.026 31.399 8.048 327 HB2 CYS 349 2HB CYS 349 2.630 29.904 8.143 328 HB3 CYS 349 1HB CYS 349 1.202 29.466 9.085 329 H LEU 350 H LEU 350 1.577 33.852 8.302 330 HA LEU 350 HA LEU 350 2.321 33.820 11.166 331 HB2 LEU 350 2HB LEU 350 3.442 35.632 8.981 332 HB3 LEU 350 1HB LEU 350 3.968 35.564 10.657 333 HG LEU 350 HG LEU 350 4.339 33.347 8.592 334 HD11 LEU 350 1HD1 LEU 350 5.787 35.265 8.147 335 HD12 LEU 350 2HD1 LEU 350 6.726 33.881 8.695 336 HD13 LEU 350 3HD1 LEU 350 6.399 35.217 9.804 337 HD21 LEU 350 1HD2 LEU 350 5.720 32.205 10.286 338 HD22 LEU 350 2HD2 LEU 350 4.058 32.391 10.835 339 HD23 LEU 350 3HD2 LEU 350 5.317 33.451 11.471 340 H LYS 351 H LYS 351 2.192 36.188 12.045 341 HA LYS 351 HA LYS 351 0.018 37.776 10.902 342 HB2 LYS 351 2HB LYS 351 -1.000 36.122 12.553 343 HB3 LYS 351 1HB LYS 351 -0.038 36.873 13.818 344 HG2 LYS 351 2HG LYS 351 -2.336 37.712 13.863 345 HG3 LYS 351 1HG LYS 351 -1.202 39.005 13.473 346 HD2 LYS 351 2HD LYS 351 -3.231 39.153 12.076 347 HD3 LYS 351 1HD LYS 351 -1.804 38.847 11.084 348 HE2 LYS 351 2HE LYS 351 -2.415 36.457 10.957 349 HE3 LYS 351 1HE LYS 351 -3.832 36.757 11.962 350 HZ1 LYS 351 1HZ LYS 351 -4.408 36.646 9.641 351 HZ2 LYS 351 2HZ LYS 351 -3.334 37.896 9.266 352 HZ3 LYS 351 3HZ LYS 351 -4.691 38.207 10.224 353 HA PRO 352 HA PRO 352 0.241 39.546 9.942 354 HB2 PRO 352 2HB PRO 352 1.739 41.383 8.638 355 HB3 PRO 352 1HB PRO 352 0.690 41.842 9.988 356 HG2 PRO 352 2HG PRO 352 3.668 41.375 9.970 357 HG3 PRO 352 1HG PRO 352 2.742 42.675 10.751 358 HD2 PRO 352 2HD PRO 352 3.643 40.418 12.078 359 HD3 PRO 352 1HD PRO 352 2.244 41.377 12.599 360 HA PRO 353 HA PRO 353 2.464 36.532 7.401 361 HB2 PRO 353 2HB PRO 353 0.983 37.810 5.106 362 HB3 PRO 353 1HB PRO 353 1.055 36.112 5.595 363 HG2 PRO 353 2HG PRO 353 -1.129 37.528 6.101 364 HG3 PRO 353 1HG PRO 353 -0.499 36.402 7.323 365 HD2 PRO 353 2HD PRO 353 -0.208 39.408 7.192 366 HD3 PRO 353 1HD PRO 353 -0.606 38.373 8.585 367 H LEU 354 H LEU 354 4.346 36.501 6.320 368 HA LEU 354 HA LEU 354 5.441 38.971 5.145 369 HB2 LEU 354 2HB LEU 354 6.800 36.340 5.854 370 HB3 LEU 354 1HB LEU 354 7.616 37.760 5.205 371 HG LEU 354 HG LEU 354 6.191 37.631 7.889 372 HD11 LEU 354 1HD1 LEU 354 8.419 37.723 8.911 373 HD12 LEU 354 2HD1 LEU 354 9.167 37.631 7.315 374 HD13 LEU 354 3HD1 LEU 354 8.216 36.276 7.927 375 HD21 LEU 354 1HD2 LEU 354 6.106 39.896 6.964 376 HD22 LEU 354 2HD2 LEU 354 7.851 39.884 6.701 377 HD23 LEU 354 3HD2 LEU 354 7.203 39.836 8.342 378 H THR 355 H THR 355 6.044 39.055 3.018 379 HA THR 355 HA THR 355 4.836 37.177 1.160 380 HB THR 355 HB THR 355 5.744 38.764 -0.584 381 HG1 THR 355 HG1 THR 355 7.524 39.663 0.326 382 HG21 THR 355 1HG2 THR 355 4.190 40.131 1.656 383 HG22 THR 355 2HG2 THR 355 3.486 39.150 0.366 384 HG23 THR 355 3HG2 THR 355 4.288 40.670 -0.025 385 H SER 356 H SER 356 8.082 38.190 2.126 386 HA SER 356 HA SER 356 9.224 35.671 1.118 387 HB2 SER 356 2HB SER 356 9.757 37.346 -0.601 388 HB3 SER 356 1HB SER 356 10.399 38.448 0.617 389 HG SER 356 HG SER 356 12.164 37.449 -0.133 390 H VAL 357 H VAL 357 11.413 35.305 2.089 391 HA VAL 357 HA VAL 357 11.395 35.456 4.900 392 HB VAL 357 HB VAL 357 12.559 33.624 3.800 393 HG11 VAL 357 1HG1 VAL 357 14.653 33.914 2.498 394 HG12 VAL 357 2HG1 VAL 357 14.486 35.666 2.625 395 HG13 VAL 357 3HG1 VAL 357 13.289 34.730 1.731 396 HG21 VAL 357 1HG2 VAL 357 13.433 34.252 6.019 397 HG22 VAL 357 2HG2 VAL 357 14.591 35.352 5.266 398 HG23 VAL 357 3HG2 VAL 357 14.724 33.611 5.001 399 HA PRO 358 HA PRO 358 13.058 39.661 5.632 400 HB2 PRO 358 2HB PRO 358 14.072 38.301 8.138 401 HB3 PRO 358 1HB PRO 358 13.219 39.845 7.966 402 HG2 PRO 358 2HG PRO 358 11.901 37.711 8.829 403 HG3 PRO 358 1HG PRO 358 11.135 38.800 7.650 404 HD2 PRO 358 2HD PRO 358 12.425 36.108 7.190 405 HD3 PRO 358 1HD PRO 358 10.932 36.776 6.492 406 HA PRO 359 HA PRO 359 17.431 39.124 4.519 407 HB2 PRO 359 2HB PRO 359 18.262 41.698 4.607 408 HB3 PRO 359 1HB PRO 359 17.100 41.158 3.384 409 HG2 PRO 359 2HG PRO 359 16.577 42.575 6.002 410 HG3 PRO 359 1HG PRO 359 15.929 42.945 4.387 411 HD2 PRO 359 2HD PRO 359 14.527 41.496 6.247 412 HD3 PRO 359 1HD PRO 359 14.337 41.249 4.498 413 H GLU 360 H GLU 360 16.317 39.528 7.558 414 HA GLU 360 HA GLU 360 18.638 40.379 9.014 415 HB2 GLU 360 2HB GLU 360 16.121 38.969 10.006 416 HB3 GLU 360 1HB GLU 360 17.273 39.864 10.996 417 HG2 GLU 360 2HG GLU 360 15.384 40.990 8.901 418 HG3 GLU 360 1HG GLU 360 15.298 41.217 10.646 419 HA PRO 361 HA PRO 361 20.980 36.633 9.193 420 HB2 PRO 361 2HB PRO 361 21.951 36.596 11.790 421 HB3 PRO 361 1HB PRO 361 22.567 37.663 10.522 422 HG2 PRO 361 2HG PRO 361 20.543 38.253 12.679 423 HG3 PRO 361 1HG PRO 361 21.928 39.233 12.150 424 HD2 PRO 361 2HD PRO 361 19.444 39.810 11.314 425 HD3 PRO 361 1HD PRO 361 20.830 39.975 10.210 426 H GLU 362 H GLU 362 18.868 36.922 12.095 427 HA GLU 362 HA GLU 362 18.141 34.071 11.755 428 HB2 GLU 362 2HB GLU 362 19.580 34.359 13.771 429 HB3 GLU 362 1HB GLU 362 18.417 35.501 14.430 430 HG2 GLU 362 2HG GLU 362 16.748 33.796 14.679 431 HG3 GLU 362 1HG GLU 362 17.690 32.645 13.731 432 H TRP 363 H TRP 363 16.047 33.534 11.976 433 HA TRP 363 HA TRP 363 14.068 35.724 11.952 434 HB2 TRP 363 2HB TRP 363 14.234 34.505 9.829 435 HB3 TRP 363 1HB TRP 363 14.045 32.966 10.655 436 HD1 TRP 363 HD1 TRP 363 11.984 36.080 9.643 437 HE1 TRP 363 HE1 TRP 363 9.504 35.416 9.555 438 HE3 TRP 363 HE3 TRP 363 12.320 31.333 11.545 439 HZ2 TRP 363 HZ2 TRP 363 7.919 33.204 10.192 440 HZ3 TRP 363 HZ3 TRP 363 10.249 30.021 11.790 441 HH2 TRP 363 HH2 TRP 363 8.084 30.946 11.136 442 H TYR 364 H TYR 364 12.319 35.632 13.251 443 HA TYR 364 HA TYR 364 11.703 33.220 14.835 444 HB2 TYR 364 2HB TYR 364 11.568 36.094 15.867 445 HB3 TYR 364 1HB TYR 364 11.072 34.661 16.761 446 HD1 TYR 364 HD1 TYR 364 12.926 32.913 17.322 447 HD2 TYR 364 HD2 TYR 364 13.825 36.893 16.057 448 HE1 TYR 364 HE1 TYR 364 15.180 32.682 18.243 449 HE2 TYR 364 HE2 TYR 364 16.084 36.666 17.011 450 HH TYR 364 HH TYR 364 17.417 33.723 17.942 451 H CYS 365 H CYS 365 9.494 32.803 14.988 452 HA CYS 365 HA CYS 365 7.668 34.069 13.164 453 HB2 CYS 365 2HB CYS 365 5.998 32.492 13.994 454 HB3 CYS 365 1HB CYS 365 7.528 31.628 13.824 455 HA PRO 366 HA PRO 366 5.797 37.329 15.788 456 HB2 PRO 366 2HB PRO 366 3.182 36.093 14.918 457 HB3 PRO 366 1HB PRO 366 3.675 37.792 14.913 458 HG2 PRO 366 2HG PRO 366 3.617 36.371 12.649 459 HG3 PRO 366 1HG PRO 366 4.906 37.565 12.941 460 HD2 PRO 366 2HD PRO 366 5.016 34.575 13.048 461 HD3 PRO 366 1HD PRO 366 6.274 35.734 12.573 462 H SER 367 H SER 367 4.514 34.052 15.891 463 HA SER 367 HA SER 367 3.082 34.046 18.282 464 HB2 SER 367 2HB SER 367 4.573 31.688 17.068 465 HB3 SER 367 1HB SER 367 3.096 31.634 18.035 466 HG SER 367 HG SER 367 1.977 32.040 16.289 467 H CYS 368 H CYS 368 6.532 33.955 17.785 468 HA CYS 368 HA CYS 368 7.477 32.865 20.203 469 HB2 CYS 368 2HB CYS 368 8.576 34.651 18.083 470 HB3 CYS 368 1HB CYS 368 9.399 34.731 19.627 471 H ARG 369 H ARG 369 6.307 36.103 19.409 472 HA ARG 369 HA ARG 369 6.958 37.097 22.127 473 HB2 ARG 369 2HB ARG 369 7.197 39.317 21.159 474 HB3 ARG 369 1HB ARG 369 8.218 38.191 20.267 475 HG2 ARG 369 2HG ARG 369 6.490 38.079 18.472 476 HG3 ARG 369 1HG ARG 369 5.514 39.252 19.360 477 HD2 ARG 369 2HD ARG 369 6.726 40.382 17.580 478 HD3 ARG 369 1HD ARG 369 7.361 40.911 19.140 479 HE ARG 369 HE ARG 369 9.076 38.969 18.588 480 HH11 ARG 369 1HH1 ARG 369 7.942 41.541 16.487 481 HH12 ARG 369 2HH1 ARG 369 9.355 41.498 15.487 482 HH21 ARG 369 1HH2 ARG 369 10.931 38.959 17.287 483 HH22 ARG 369 2HH2 ARG 369 11.051 40.054 15.947 484 H THR 370 H THR 370 4.339 36.121 20.258 485 HA THR 370 HA THR 370 2.468 38.185 20.574 486 HB THR 370 HB THR 370 1.861 35.203 20.425 487 HG1 THR 370 HG1 THR 370 2.708 37.063 18.558 488 HG21 THR 370 1HG2 THR 370 -0.307 35.905 19.456 489 HG22 THR 370 2HG2 THR 370 0.109 37.597 19.738 490 HG23 THR 370 3HG2 THR 370 -0.134 36.507 21.108 491 H ASP 371 H ASP 371 1.235 38.863 22.172 492 HA ASP 371 HA ASP 371 1.968 38.323 24.855 493 HB2 ASP 371 2HB ASP 371 0.406 40.123 25.419 494 HB3 ASP 371 1HB ASP 371 1.394 40.574 24.037 495 H SER 372 H SER 372 -0.333 36.775 22.920 496 HA SER 372 HA SER 372 -2.246 36.038 24.900 497 HB2 SER 372 2HB SER 372 -2.842 34.232 23.268 498 HB3 SER 372 1HB SER 372 -2.762 35.829 22.528 499 HG SER 372 HG SER 372 -0.818 33.766 22.388 500 H SER 373 H SER 373 0.901 34.850 23.983 501 HA SER 373 HA SER 373 0.723 32.320 25.409 502 HB2 SER 373 2HB SER 373 1.887 32.413 23.233 503 HB3 SER 373 1HB SER 373 3.005 33.631 23.853 504 HG SER 373 HG SER 373 3.014 31.468 25.469 505 H GLU 374 H GLU 374 1.402 32.032 27.469 506 HA GLU 374 HA GLU 374 2.760 34.039 29.031 507 HB2 GLU 374 2HB GLU 374 2.329 31.077 29.687 508 HB3 GLU 374 1HB GLU 374 2.797 32.336 30.826 509 HG2 GLU 374 2HG GLU 374 0.133 32.137 29.385 510 HG3 GLU 374 1HG GLU 374 0.439 31.689 31.060 511 H VAL 375 H VAL 375 4.830 34.482 28.515 512 HA VAL 375 HA VAL 375 6.657 32.641 27.310 513 HB VAL 375 HB VAL 375 7.183 35.359 28.606 514 HG11 VAL 375 1HG1 VAL 375 9.045 33.709 26.850 515 HG12 VAL 375 2HG1 VAL 375 9.263 34.036 28.571 516 HG13 VAL 375 3HG1 VAL 375 9.353 35.357 27.406 517 HG21 VAL 375 1HG2 VAL 375 5.695 35.518 26.642 518 HG22 VAL 375 2HG2 VAL 375 6.870 34.633 25.667 519 HG23 VAL 375 3HG2 VAL 375 7.271 36.234 26.292 520 H VAL 376 H VAL 376 7.294 30.919 28.459 521 HA VAL 376 HA VAL 376 7.683 30.698 31.228 522 HB VAL 376 HB VAL 376 7.499 28.732 29.724 523 HG11 VAL 376 1HG1 VAL 376 10.297 29.415 28.747 524 HG12 VAL 376 2HG1 VAL 376 8.814 29.510 27.798 525 HG13 VAL 376 3HG1 VAL 376 9.403 27.943 28.352 526 HG21 VAL 376 1HG2 VAL 376 9.204 27.284 30.784 527 HG22 VAL 376 2HG2 VAL 376 8.480 28.387 31.956 528 HG23 VAL 376 3HG2 VAL 376 10.091 28.715 31.315 529 H GLN 377 H GLN 377 9.578 30.819 32.509 530 HA GLN 377 HA GLN 377 11.327 32.989 31.872 531 HB2 GLN 377 2HB GLN 377 10.458 32.523 34.160 532 HB3 GLN 377 1HB GLN 377 11.408 31.042 34.208 533 HG2 GLN 377 2HG GLN 377 13.488 32.432 34.008 534 HG3 GLN 377 1HG GLN 377 12.476 33.879 34.105 535 HE21 GLN 377 1HE2 GLN 377 13.724 31.126 35.866 536 HE22 GLN 377 2HE2 GLN 377 13.317 31.699 37.442 537 H ALA 378 H ALA 378 12.251 32.088 29.922 538 HA ALA 378 HA ALA 378 14.285 30.019 30.107 539 HB1 ALA 378 1HB ALA 378 14.650 30.482 27.702 540 HB2 ALA 378 2HB ALA 378 13.549 31.859 27.793 541 HB3 ALA 378 3HB ALA 378 12.935 30.224 28.037 542 H GLY 379 H GLY 379 16.539 30.527 29.448 543 HA2 GLY 379 2HA GLY 379 18.519 31.616 29.843 544 HA3 GLY 379 1HA GLY 379 17.642 33.141 29.913 545 H GLU 380 H GLU 380 16.981 30.292 31.875 546 HA GLU 380 HA GLU 380 17.321 31.740 34.359 547 HB2 GLU 380 2HB GLU 380 15.486 29.983 33.816 548 HB3 GLU 380 1HB GLU 380 16.722 28.760 34.062 549 HG2 GLU 380 2HG GLU 380 15.801 30.769 36.148 550 HG3 GLU 380 1HG GLU 380 15.228 29.113 36.025 Start of MODEL 8 1 H1 SER 303 H SER 303 11.516 11.327 0.918 2 HA SER 303 HA SER 303 12.944 12.656 -1.329 3 HB2 SER 303 2HB SER 303 9.937 12.164 -1.177 4 HB3 SER 303 1HB SER 303 10.803 12.947 -2.502 5 HG SER 303 HG SER 303 11.556 10.356 -1.714 6 H GLY 304 H GLY 304 11.359 12.960 1.688 7 HA2 GLY 304 2HA GLY 304 10.734 15.795 1.514 8 HA3 GLY 304 1HA GLY 304 10.658 14.782 2.950 9 HA PRO 305 HA PRO 305 14.514 17.615 3.162 10 HB2 PRO 305 2HB PRO 305 13.174 18.549 5.688 11 HB3 PRO 305 1HB PRO 305 13.970 19.490 4.419 12 HG2 PRO 305 2HG PRO 305 11.300 19.487 4.649 13 HG3 PRO 305 1HG PRO 305 12.078 19.510 3.052 14 HD2 PRO 305 2HD PRO 305 10.835 17.172 4.521 15 HD3 PRO 305 1HD PRO 305 10.696 17.631 2.806 16 H SER 306 H SER 306 16.038 17.704 5.126 17 HA SER 306 HA SER 306 16.741 15.098 5.870 18 HB2 SER 306 2HB SER 306 18.400 16.323 7.408 19 HB3 SER 306 1HB SER 306 18.470 16.716 5.696 20 HG SER 306 HG SER 306 17.913 18.317 7.805 21 H CYS 307 H CYS 307 15.718 13.823 7.237 22 HA CYS 307 HA CYS 307 13.984 14.887 9.339 23 HB2 CYS 307 2HB CYS 307 14.293 12.151 8.085 24 HB3 CYS 307 1HB CYS 307 13.204 12.476 9.430 25 H ARG 308 H ARG 308 15.291 15.471 10.965 26 HA ARG 308 HA ARG 308 16.638 13.373 12.537 27 HB2 ARG 308 2HB ARG 308 18.344 15.158 13.228 28 HB3 ARG 308 1HB ARG 308 18.501 14.571 11.578 29 HG2 ARG 308 2HG ARG 308 17.530 16.591 10.676 30 HG3 ARG 308 1HG ARG 308 17.077 17.159 12.285 31 HD2 ARG 308 2HD ARG 308 19.055 18.351 11.452 32 HD3 ARG 308 1HD ARG 308 19.454 17.400 12.883 33 HE ARG 308 HE ARG 308 20.060 15.817 10.682 34 HH11 ARG 308 1HH1 ARG 308 21.164 18.885 11.972 35 HH12 ARG 308 2HH1 ARG 308 22.774 18.691 11.359 36 HH21 ARG 308 1HH2 ARG 308 22.180 15.591 9.902 37 HH22 ARG 308 2HH2 ARG 308 23.335 16.844 10.189 38 H PHE 309 H PHE 309 15.103 16.540 12.391 39 HA PHE 309 HA PHE 309 14.307 16.909 15.076 40 HB2 PHE 309 2HB PHE 309 12.741 17.649 12.554 41 HB3 PHE 309 1HB PHE 309 12.526 18.352 14.141 42 HD1 PHE 309 HD1 PHE 309 14.868 18.146 11.249 43 HD2 PHE 309 HD2 PHE 309 13.812 20.266 14.814 44 HE1 PHE 309 HE1 PHE 309 16.383 19.975 10.617 45 HE2 PHE 309 HE2 PHE 309 15.335 22.077 14.177 46 HZ PHE 309 HZ PHE 309 16.622 21.941 12.082 47 H CYS 310 H CYS 310 12.839 15.415 12.300 48 HA CYS 310 HA CYS 310 10.961 13.774 13.875 49 HB2 CYS 310 2HB CYS 310 9.937 13.568 11.437 50 HB3 CYS 310 1HB CYS 310 9.692 15.080 12.322 51 H LYS 311 H LYS 311 12.831 12.500 14.364 52 HA LYS 311 HA LYS 311 14.856 11.399 13.080 53 HB2 LYS 311 2HB LYS 311 13.000 9.734 14.840 54 HB3 LYS 311 1HB LYS 311 14.714 9.429 14.543 55 HG2 LYS 311 2HG LYS 311 15.284 11.553 15.686 56 HG3 LYS 311 1HG LYS 311 13.565 11.842 15.978 57 HD2 LYS 311 2HD LYS 311 14.568 10.934 17.997 58 HD3 LYS 311 1HD LYS 311 13.461 9.741 17.311 59 HE2 LYS 311 2HE LYS 311 15.529 8.671 18.081 60 HE3 LYS 311 1HE LYS 311 15.384 8.533 16.329 61 HZ1 LYS 311 1HZ LYS 311 17.027 10.529 17.779 62 HZ2 LYS 311 2HZ LYS 311 16.918 10.383 16.101 63 HZ3 LYS 311 3HZ LYS 311 17.621 9.143 17.014 64 H ASP 312 H ASP 312 14.680 11.013 10.918 65 HA ASP 312 HA ASP 312 13.997 10.190 8.913 66 HB2 ASP 312 2HB ASP 312 14.793 7.864 8.585 67 HB3 ASP 312 1HB ASP 312 15.921 8.876 9.469 68 H ASP 313 H ASP 313 11.654 10.593 10.280 69 HA ASP 313 HA ASP 313 9.934 8.299 10.168 70 HB2 ASP 313 2HB ASP 313 9.248 11.250 10.493 71 HB3 ASP 313 1HB ASP 313 8.069 9.937 10.550 72 H GLU 314 H GLU 314 10.483 7.692 7.992 73 HA GLU 314 HA GLU 314 9.062 8.954 5.825 74 HB2 GLU 314 2HB GLU 314 10.268 6.166 6.069 75 HB3 GLU 314 1HB GLU 314 9.682 6.900 4.576 76 HG2 GLU 314 2HG GLU 314 11.436 8.613 4.713 77 HG3 GLU 314 1HG GLU 314 12.024 7.909 6.223 78 H ASN 315 H ASN 315 8.359 6.846 8.423 79 HA ASN 315 HA ASN 315 6.016 5.573 7.197 80 HB2 ASN 315 2HB ASN 315 7.690 4.194 8.471 81 HB3 ASN 315 1HB ASN 315 7.316 5.107 9.922 82 HD21 ASN 315 1HD2 ASN 315 7.100 2.252 9.395 83 HD22 ASN 315 2HD2 ASN 315 5.464 1.808 9.720 84 H LYS 316 H LYS 316 6.909 7.398 10.156 85 HA LYS 316 HA LYS 316 4.125 7.906 10.847 86 HB2 LYS 316 2HB LYS 316 6.698 8.882 12.176 87 HB3 LYS 316 1HB LYS 316 5.065 9.068 12.827 88 HG2 LYS 316 2HG LYS 316 4.867 6.551 12.865 89 HG3 LYS 316 1HG LYS 316 6.568 6.461 12.392 90 HD2 LYS 316 2HD LYS 316 7.155 7.736 14.471 91 HD3 LYS 316 1HD LYS 316 5.449 7.698 14.933 92 HE2 LYS 316 2HE LYS 316 7.308 5.310 14.633 93 HE3 LYS 316 1HE LYS 316 6.610 5.945 16.123 94 HZ1 LYS 316 1HZ LYS 316 5.078 4.730 13.885 95 HZ2 LYS 316 2HZ LYS 316 4.415 5.336 15.312 96 HZ3 LYS 316 3HZ LYS 316 5.423 3.985 15.363 97 HA PRO 317 HA PRO 317 3.592 11.794 8.623 98 HB2 PRO 317 2HB PRO 317 2.139 12.607 11.156 99 HB3 PRO 317 1HB PRO 317 1.633 12.765 9.465 100 HG2 PRO 317 2HG PRO 317 0.612 10.820 10.944 101 HG3 PRO 317 1HG PRO 317 1.103 10.481 9.270 102 HD2 PRO 317 2HD PRO 317 2.522 9.785 11.842 103 HD3 PRO 317 1HD PRO 317 2.342 8.827 10.351 104 H CYS 318 H CYS 318 5.084 13.302 8.399 105 HA CYS 318 HA CYS 318 6.852 14.144 10.518 106 HB2 CYS 318 2HB CYS 318 6.661 14.654 7.559 107 HB3 CYS 318 1HB CYS 318 7.619 15.746 8.545 108 H ARG 319 H ARG 319 5.925 15.464 11.996 109 HA ARG 319 HA ARG 319 4.243 17.706 11.295 110 HB2 ARG 319 2HB ARG 319 4.461 18.355 13.743 111 HB3 ARG 319 1HB ARG 319 3.709 16.804 13.428 112 HG2 ARG 319 2HG ARG 319 6.650 16.927 14.105 113 HG3 ARG 319 1HG ARG 319 5.442 17.051 15.383 114 HD2 ARG 319 2HD ARG 319 4.535 14.866 14.802 115 HD3 ARG 319 1HD ARG 319 5.607 14.754 13.399 116 HE ARG 319 HE ARG 319 7.050 15.103 15.844 117 HH11 ARG 319 1HH1 ARG 319 5.436 12.620 13.931 118 HH12 ARG 319 2HH1 ARG 319 6.440 11.355 14.561 119 HH21 ARG 319 1HH2 ARG 319 8.323 13.397 16.629 120 HH22 ARG 319 2HH2 ARG 319 8.042 11.791 16.055 121 H LYS 320 H LYS 320 7.670 17.241 12.179 122 HA LYS 320 HA LYS 320 8.215 20.116 11.942 123 HB2 LYS 320 2HB LYS 320 9.966 17.803 12.845 124 HB3 LYS 320 1HB LYS 320 10.555 19.458 12.687 125 HG2 LYS 320 2HG LYS 320 8.789 20.177 14.330 126 HG3 LYS 320 1HG LYS 320 8.377 18.472 14.558 127 HD2 LYS 320 2HD LYS 320 10.654 18.015 15.382 128 HD3 LYS 320 1HD LYS 320 11.118 19.696 15.103 129 HE2 LYS 320 2HE LYS 320 9.519 20.440 16.814 130 HE3 LYS 320 1HE LYS 320 8.970 18.777 17.049 131 HZ1 LYS 320 1HZ LYS 320 11.724 19.750 17.551 132 HZ2 LYS 320 2HZ LYS 320 11.148 18.186 17.836 133 HZ3 LYS 320 3HZ LYS 320 10.552 19.488 18.737 134 H CYS 321 H CYS 321 7.782 17.939 9.635 135 HA CYS 321 HA CYS 321 9.530 19.539 7.831 136 HB2 CYS 321 2HB CYS 321 8.150 16.877 7.334 137 HB3 CYS 321 1HB CYS 321 8.711 17.884 6.011 138 H ALA 322 H ALA 322 6.705 19.750 9.324 139 HA ALA 322 HA ALA 322 5.180 20.867 7.055 140 HB1 ALA 322 1HB ALA 322 4.212 18.705 7.799 141 HB2 ALA 322 2HB ALA 322 3.123 20.051 8.132 142 HB3 ALA 322 3HB ALA 322 4.064 19.333 9.445 143 H CYS 323 H CYS 323 3.255 22.149 8.126 144 HA CYS 323 HA CYS 323 4.327 24.042 10.147 145 HB2 CYS 323 2HB CYS 323 4.534 25.244 8.168 146 HB3 CYS 323 1HB CYS 323 3.149 24.482 7.415 147 H HIS 324 H HIS 324 3.118 23.829 11.908 148 HA HIS 324 HA HIS 324 0.818 22.204 12.018 149 HB2 HIS 324 2HB HIS 324 2.428 22.353 13.856 150 HB3 HIS 324 1HB HIS 324 2.062 24.052 14.099 151 HD1 HIS 324 HD1 HIS 324 0.318 20.658 14.425 152 HD2 HIS 324 HD2 HIS 324 0.154 24.508 15.982 153 HE1 HIS 324 HE1 HIS 324 -1.423 20.612 16.248 154 H VAL 325 H VAL 325 1.205 25.637 11.717 155 HA VAL 325 HA VAL 325 -1.148 26.671 12.752 156 HB VAL 325 HB VAL 325 0.450 27.669 10.358 157 HG11 VAL 325 1HG1 VAL 325 -0.423 29.926 10.886 158 HG12 VAL 325 2HG1 VAL 325 -1.448 29.232 12.146 159 HG13 VAL 325 3HG1 VAL 325 -1.729 28.812 10.456 160 HG21 VAL 325 1HG2 VAL 325 1.632 29.114 11.986 161 HG22 VAL 325 2HG2 VAL 325 1.869 27.402 12.344 162 HG23 VAL 325 3HG2 VAL 325 0.735 28.355 13.306 163 H CYS 326 H CYS 326 -0.590 25.129 9.628 164 HA CYS 326 HA CYS 326 -3.484 25.341 8.973 165 HB2 CYS 326 2HB CYS 326 -2.860 25.471 6.586 166 HB3 CYS 326 1HB CYS 326 -2.154 26.797 7.504 167 H GLY 327 H GLY 327 -0.792 23.303 9.450 168 HA2 GLY 327 2HA GLY 327 -0.477 21.052 9.369 169 HA3 GLY 327 1HA GLY 327 -2.176 20.872 8.989 170 H GLY 328 H GLY 328 0.814 22.061 7.403 171 HA2 GLY 328 2HA GLY 328 0.466 20.219 5.172 172 HA3 GLY 328 1HA GLY 328 0.283 21.923 4.760 173 H ARG 329 H ARG 329 2.267 19.968 3.872 174 HA ARG 329 HA ARG 329 4.842 20.969 4.952 175 HB2 ARG 329 2HB ARG 329 4.328 18.646 3.024 176 HB3 ARG 329 1HB ARG 329 5.889 19.104 3.678 177 HG2 ARG 329 2HG ARG 329 5.208 17.161 4.851 178 HG3 ARG 329 1HG ARG 329 5.001 18.502 5.976 179 HD2 ARG 329 2HD ARG 329 3.125 16.859 6.058 180 HD3 ARG 329 1HD ARG 329 2.582 18.481 5.613 181 HE ARG 329 HE ARG 329 3.128 17.007 3.273 182 HH11 ARG 329 1HH1 ARG 329 0.755 17.053 5.840 183 HH12 ARG 329 2HH1 ARG 329 -0.510 16.434 4.829 184 HH21 ARG 329 1HH2 ARG 329 1.446 16.237 1.959 185 HH22 ARG 329 2HH2 ARG 329 -0.125 15.979 2.649 186 H GLU 330 H GLU 330 2.889 22.324 3.013 187 HA GLU 330 HA GLU 330 3.773 21.931 0.338 188 HB2 GLU 330 2HB GLU 330 2.066 24.260 1.305 189 HB3 GLU 330 1HB GLU 330 2.064 23.493 -0.279 190 HG2 GLU 330 2HG GLU 330 1.064 22.274 2.300 191 HG3 GLU 330 1HG GLU 330 0.063 22.913 1.005 192 H ALA 331 H ALA 331 4.957 23.269 -0.997 193 HA ALA 331 HA ALA 331 6.708 24.617 -1.598 194 HB1 ALA 331 1HB ALA 331 5.137 26.668 -0.003 195 HB2 ALA 331 2HB ALA 331 4.813 26.195 -1.672 196 HB3 ALA 331 3HB ALA 331 6.322 27.017 -1.270 197 HA PRO 332 HA PRO 332 9.179 23.902 2.372 198 HB2 PRO 332 2HB PRO 332 11.176 23.061 0.291 199 HB3 PRO 332 1HB PRO 332 10.714 22.264 1.801 200 HG2 PRO 332 2HG PRO 332 9.894 21.338 -0.572 201 HG3 PRO 332 1HG PRO 332 8.841 21.254 0.851 202 HD2 PRO 332 2HD PRO 332 8.744 23.137 -1.489 203 HD3 PRO 332 1HD PRO 332 7.409 22.405 -0.566 204 H GLU 333 H GLU 333 10.006 25.382 -0.679 205 HA GLU 333 HA GLU 333 12.040 27.146 -0.096 206 HB2 GLU 333 2HB GLU 333 10.980 28.668 -1.835 207 HB3 GLU 333 1HB GLU 333 11.196 26.995 -2.338 208 HG2 GLU 333 2HG GLU 333 8.822 26.530 -1.927 209 HG3 GLU 333 1HG GLU 333 8.589 28.170 -1.330 210 H LYS 334 H LYS 334 8.625 27.533 0.781 211 HA LYS 334 HA LYS 334 9.189 30.051 2.227 212 HB2 LYS 334 2HB LYS 334 6.617 28.862 1.107 213 HB3 LYS 334 1HB LYS 334 6.600 30.194 2.266 214 HG2 LYS 334 2HG LYS 334 7.971 31.552 0.680 215 HG3 LYS 334 1HG LYS 334 7.881 30.237 -0.498 216 HD2 LYS 334 2HD LYS 334 5.413 31.581 0.663 217 HD3 LYS 334 1HD LYS 334 6.221 32.172 -0.792 218 HE2 LYS 334 2HE LYS 334 5.179 29.333 -0.508 219 HE3 LYS 334 1HE LYS 334 4.225 30.652 -1.190 220 HZ1 LYS 334 1HZ LYS 334 6.834 29.709 -2.250 221 HZ2 LYS 334 2HZ LYS 334 5.872 30.932 -2.910 222 HZ3 LYS 334 3HZ LYS 334 5.322 29.336 -2.897 223 H GLN 335 H GLN 335 9.229 26.861 2.898 224 HA GLN 335 HA GLN 335 7.967 27.028 5.547 225 HB2 GLN 335 2HB GLN 335 9.194 24.765 3.945 226 HB3 GLN 335 1HB GLN 335 8.923 24.576 5.671 227 HG2 GLN 335 2HG GLN 335 6.638 25.434 3.897 228 HG3 GLN 335 1HG GLN 335 7.124 23.738 3.954 229 HE21 GLN 335 1HE2 GLN 335 7.172 25.983 6.723 230 HE22 GLN 335 2HE2 GLN 335 5.990 25.132 7.625 231 H LEU 336 H LEU 336 9.321 28.595 6.511 232 HA LEU 336 HA LEU 336 12.117 27.837 7.047 233 HB2 LEU 336 2HB LEU 336 10.590 30.397 7.704 234 HB3 LEU 336 1HB LEU 336 12.254 30.092 8.171 235 HG LEU 336 HG LEU 336 12.727 29.844 5.617 236 HD11 LEU 336 1HD1 LEU 336 11.240 31.083 4.117 237 HD12 LEU 336 2HD1 LEU 336 10.090 31.328 5.432 238 HD13 LEU 336 3HD1 LEU 336 10.410 29.699 4.831 239 HD21 LEU 336 1HD2 LEU 336 12.014 32.560 6.753 240 HD22 LEU 336 2HD2 LEU 336 13.068 32.259 5.368 241 HD23 LEU 336 3HD2 LEU 336 13.545 31.712 6.975 242 H LEU 337 H LEU 337 12.754 27.069 9.005 243 HA LEU 337 HA LEU 337 10.691 26.407 10.967 244 HB2 LEU 337 2HB LEU 337 13.616 25.572 10.758 245 HB3 LEU 337 1HB LEU 337 12.547 25.079 12.060 246 HG LEU 337 HG LEU 337 11.073 23.973 10.283 247 HD11 LEU 337 1HD1 LEU 337 11.883 25.106 8.276 248 HD12 LEU 337 2HD1 LEU 337 12.094 23.362 8.133 249 HD13 LEU 337 3HD1 LEU 337 13.484 24.390 8.492 250 HD21 LEU 337 1HD2 LEU 337 12.510 22.671 11.773 251 HD22 LEU 337 2HD2 LEU 337 13.871 22.872 10.666 252 HD23 LEU 337 3HD2 LEU 337 12.454 21.945 10.165 253 H CYS 338 H CYS 338 10.328 27.689 12.693 254 HA CYS 338 HA CYS 338 12.083 29.701 13.672 255 HB2 CYS 338 2HB CYS 338 9.631 29.701 14.143 256 HB3 CYS 338 1HB CYS 338 9.836 28.286 15.178 257 H ASP 339 H ASP 339 14.045 29.211 14.446 258 HA ASP 339 HA ASP 339 15.121 26.843 15.261 259 HB2 ASP 339 2HB ASP 339 16.548 28.697 14.836 260 HB3 ASP 339 1HB ASP 339 15.747 29.695 16.037 261 H GLU 340 H GLU 340 13.678 29.235 17.456 262 HA GLU 340 HA GLU 340 14.111 28.026 19.932 263 HB2 GLU 340 2HB GLU 340 13.392 30.360 19.656 264 HB3 GLU 340 1HB GLU 340 11.847 29.839 19.006 265 HG2 GLU 340 2HG GLU 340 11.485 30.564 21.253 266 HG3 GLU 340 1HG GLU 340 11.321 28.812 21.228 267 H CYS 341 H CYS 341 11.553 27.454 17.573 268 HA CYS 341 HA CYS 341 10.019 25.792 19.502 269 HB2 CYS 341 2HB CYS 341 9.089 27.198 16.953 270 HB3 CYS 341 1HB CYS 341 8.062 26.272 18.044 271 H ASP 342 H ASP 342 12.108 25.491 16.902 272 HA ASP 342 HA ASP 342 12.639 23.996 15.306 273 HB2 ASP 342 2HB ASP 342 11.350 22.080 17.305 274 HB3 ASP 342 1HB ASP 342 12.281 21.541 15.910 275 H MET 343 H MET 343 9.855 25.203 15.181 276 HA MET 343 HA MET 343 8.362 23.147 13.673 277 HB2 MET 343 2HB MET 343 7.211 24.155 15.651 278 HB3 MET 343 1HB MET 343 7.373 25.747 14.936 279 HG2 MET 343 2HG MET 343 5.211 25.313 14.338 280 HG3 MET 343 1HG MET 343 5.983 24.555 12.952 281 HE1 MET 343 1HE MET 343 5.695 20.708 13.900 282 HE2 MET 343 2HE MET 343 7.092 21.743 14.198 283 HE3 MET 343 3HE MET 343 6.216 21.863 12.671 284 H ALA 344 H ALA 344 8.190 23.393 11.513 285 HA ALA 344 HA ALA 344 9.196 25.712 10.135 286 HB1 ALA 344 1HB ALA 344 9.380 23.452 9.165 287 HB2 ALA 344 2HB ALA 344 8.499 24.537 8.090 288 HB3 ALA 344 3HB ALA 344 7.621 23.343 9.050 289 H PHE 345 H PHE 345 8.034 27.308 9.082 290 HA PHE 345 HA PHE 345 5.090 27.362 9.292 291 HB2 PHE 345 2HB PHE 345 6.897 29.734 9.970 292 HB3 PHE 345 1HB PHE 345 5.143 29.785 9.865 293 HD1 PHE 345 HD1 PHE 345 8.004 28.854 11.947 294 HD2 PHE 345 HD2 PHE 345 3.754 28.722 11.597 295 HE1 PHE 345 HE1 PHE 345 7.815 28.314 14.332 296 HE2 PHE 345 HE2 PHE 345 3.579 28.182 13.982 297 HZ PHE 345 HZ PHE 345 5.607 27.977 15.346 298 H HIS 346 H HIS 346 4.100 28.444 7.629 299 HA HIS 346 HA HIS 346 5.635 29.133 5.249 300 HB2 HIS 346 2HB HIS 346 2.633 29.204 5.819 301 HB3 HIS 346 1HB HIS 346 3.361 29.579 4.262 302 HD2 HIS 346 HD2 HIS 346 5.157 27.227 3.503 303 HE1 HIS 346 HE1 HIS 346 2.101 24.630 4.810 304 HE2 HIS 346 HE2 HIS 346 4.329 24.787 3.661 305 H LEU 347 H LEU 347 5.759 31.245 4.384 306 HA LEU 347 HA LEU 347 5.946 33.432 6.159 307 HB2 LEU 347 2HB LEU 347 5.719 33.369 3.126 308 HB3 LEU 347 1HB LEU 347 6.147 34.805 4.049 309 HG LEU 347 HG LEU 347 7.798 32.236 4.043 310 HD11 LEU 347 1HD1 LEU 347 7.830 33.221 1.814 311 HD12 LEU 347 2HD1 LEU 347 9.391 33.418 2.602 312 HD13 LEU 347 3HD1 LEU 347 8.286 34.791 2.481 313 HD21 LEU 347 1HD2 LEU 347 8.072 33.580 6.088 314 HD22 LEU 347 2HD2 LEU 347 8.461 35.004 5.118 315 HD23 LEU 347 3HD2 LEU 347 9.540 33.605 5.109 316 H TYR 348 H TYR 348 3.301 32.262 4.188 317 HA TYR 348 HA TYR 348 1.559 34.538 4.754 318 HB2 TYR 348 2HB TYR 348 -0.090 33.228 3.308 319 HB3 TYR 348 1HB TYR 348 1.370 33.781 2.513 320 HD1 TYR 348 HD1 TYR 348 -0.569 30.822 3.499 321 HD2 TYR 348 HD2 TYR 348 3.165 32.130 1.875 322 HE1 TYR 348 HE1 TYR 348 -0.129 28.553 2.655 323 HE2 TYR 348 HE2 TYR 348 3.592 29.864 1.041 324 HH TYR 348 HH TYR 348 1.232 27.475 0.854 325 H CYS 349 H CYS 349 2.489 32.103 6.642 326 HA CYS 349 HA CYS 349 -0.157 31.810 7.984 327 HB2 CYS 349 2HB CYS 349 2.302 30.006 8.102 328 HB3 CYS 349 1HB CYS 349 0.915 29.840 9.176 329 H LEU 350 H LEU 350 2.286 33.831 8.039 330 HA LEU 350 HA LEU 350 2.895 33.841 10.909 331 HB2 LEU 350 2HB LEU 350 3.942 35.598 8.654 332 HB3 LEU 350 1HB LEU 350 4.498 35.646 10.323 333 HG LEU 350 HG LEU 350 4.807 33.271 8.440 334 HD11 LEU 350 1HD1 LEU 350 6.228 35.162 7.799 335 HD12 LEU 350 2HD1 LEU 350 7.171 33.803 8.389 336 HD13 LEU 350 3HD1 LEU 350 6.918 35.210 9.425 337 HD21 LEU 350 1HD2 LEU 350 5.874 33.639 11.261 338 HD22 LEU 350 2HD2 LEU 350 6.239 32.286 10.184 339 HD23 LEU 350 3HD2 LEU 350 4.594 32.528 10.764 340 H LYS 351 H LYS 351 2.924 36.090 11.917 341 HA LYS 351 HA LYS 351 0.564 37.714 11.168 342 HB2 LYS 351 2HB LYS 351 0.227 36.438 13.308 343 HB3 LYS 351 1HB LYS 351 1.672 37.191 13.971 344 HG2 LYS 351 2HG LYS 351 -0.269 38.325 14.865 345 HG3 LYS 351 1HG LYS 351 0.565 39.423 13.766 346 HD2 LYS 351 2HD LYS 351 -1.714 39.719 13.230 347 HD3 LYS 351 1HD LYS 351 -1.137 38.635 11.968 348 HE2 LYS 351 2HE LYS 351 -2.672 37.798 14.453 349 HE3 LYS 351 1HE LYS 351 -3.365 37.992 12.845 350 HZ1 LYS 351 1HZ LYS 351 -1.841 36.212 12.092 351 HZ2 LYS 351 2HZ LYS 351 -2.959 35.698 13.249 352 HZ3 LYS 351 3HZ LYS 351 -1.353 35.983 13.686 353 HA PRO 352 HA PRO 352 0.407 39.143 9.905 354 HB2 PRO 352 2HB PRO 352 0.971 41.067 8.123 355 HB3 PRO 352 1HB PRO 352 0.491 41.497 9.770 356 HG2 PRO 352 2HG PRO 352 3.257 41.420 8.569 357 HG3 PRO 352 1HG PRO 352 2.536 42.654 9.622 358 HD2 PRO 352 2HD PRO 352 4.190 40.593 10.519 359 HD3 PRO 352 1HD PRO 352 3.040 41.478 11.545 360 HA PRO 353 HA PRO 353 2.060 36.382 6.706 361 HB2 PRO 353 2HB PRO 353 0.203 37.699 4.729 362 HB3 PRO 353 1HB PRO 353 0.384 35.990 5.152 363 HG2 PRO 353 2HG PRO 353 -1.710 37.357 6.063 364 HG3 PRO 353 1HG PRO 353 -0.880 36.192 7.115 365 HD2 PRO 353 2HD PRO 353 -0.659 39.211 7.094 366 HD3 PRO 353 1HD PRO 353 -0.779 38.089 8.477 367 H LEU 354 H LEU 354 4.077 36.841 6.123 368 HA LEU 354 HA LEU 354 4.884 39.394 5.050 369 HB2 LEU 354 2HB LEU 354 6.499 36.874 5.628 370 HB3 LEU 354 1HB LEU 354 7.188 38.429 5.167 371 HG LEU 354 HG LEU 354 5.600 37.890 7.711 372 HD11 LEU 354 1HD1 LEU 354 8.566 38.407 7.385 373 HD12 LEU 354 2HD1 LEU 354 7.811 36.860 7.778 374 HD13 LEU 354 3HD1 LEU 354 7.694 38.202 8.910 375 HD21 LEU 354 1HD2 LEU 354 6.980 40.446 6.829 376 HD22 LEU 354 2HD2 LEU 354 6.239 40.165 8.409 377 HD23 LEU 354 3HD2 LEU 354 5.239 40.183 6.961 378 H THR 355 H THR 355 5.611 39.858 3.045 379 HA THR 355 HA THR 355 4.625 38.282 0.841 380 HB THR 355 HB THR 355 4.462 40.761 0.850 381 HG1 THR 355 HG1 THR 355 5.521 39.307 -1.221 382 HG21 THR 355 1HG2 THR 355 6.561 41.344 1.969 383 HG22 THR 355 2HG2 THR 355 6.438 42.175 0.417 384 HG23 THR 355 3HG2 THR 355 7.486 40.764 0.579 385 H SER 356 H SER 356 7.639 38.579 2.487 386 HA SER 356 HA SER 356 8.994 36.762 0.647 387 HB2 SER 356 2HB SER 356 10.118 39.509 1.354 388 HB3 SER 356 1HB SER 356 10.990 38.254 0.474 389 HG SER 356 HG SER 356 8.809 38.544 -0.875 390 H VAL 357 H VAL 357 11.194 36.146 1.605 391 HA VAL 357 HA VAL 357 11.113 35.593 4.391 392 HB VAL 357 HB VAL 357 12.356 34.075 3.025 393 HG11 VAL 357 1HG1 VAL 357 14.141 36.373 2.132 394 HG12 VAL 357 2HG1 VAL 357 12.952 35.532 1.136 395 HG13 VAL 357 3HG1 VAL 357 14.376 34.669 1.718 396 HG21 VAL 357 1HG2 VAL 357 14.384 35.650 4.655 397 HG22 VAL 357 2HG2 VAL 357 14.555 33.970 4.135 398 HG23 VAL 357 3HG2 VAL 357 13.292 34.414 5.287 399 HA PRO 358 HA PRO 358 12.397 39.639 5.985 400 HB2 PRO 358 2HB PRO 358 13.388 37.920 8.265 401 HB3 PRO 358 1HB PRO 358 12.401 39.392 8.310 402 HG2 PRO 358 2HG PRO 358 11.259 37.014 8.667 403 HG3 PRO 358 1HG PRO 358 10.446 38.256 7.692 404 HD2 PRO 358 2HD PRO 358 11.943 35.809 6.776 405 HD3 PRO 358 1HD PRO 358 10.460 36.541 6.121 406 HA PRO 359 HA PRO 359 16.916 39.545 5.241 407 HB2 PRO 359 2HB PRO 359 17.447 42.171 5.439 408 HB3 PRO 359 1HB PRO 359 16.479 41.545 4.094 409 HG2 PRO 359 2HG PRO 359 15.534 42.859 6.645 410 HG3 PRO 359 1HG PRO 359 15.014 43.175 4.976 411 HD2 PRO 359 2HD PRO 359 13.622 41.533 6.716 412 HD3 PRO 359 1HD PRO 359 13.571 41.351 4.946 413 H GLU 360 H GLU 360 15.345 39.765 8.097 414 HA GLU 360 HA GLU 360 17.164 40.843 9.941 415 HB2 GLU 360 2HB GLU 360 15.107 38.638 10.423 416 HB3 GLU 360 1HB GLU 360 15.824 39.685 11.643 417 HG2 GLU 360 2HG GLU 360 13.901 40.492 9.446 418 HG3 GLU 360 1HG GLU 360 13.562 40.408 11.172 419 HA PRO 361 HA PRO 361 20.276 37.600 10.031 420 HB2 PRO 361 2HB PRO 361 21.569 38.226 12.338 421 HB3 PRO 361 1HB PRO 361 21.646 39.262 10.905 422 HG2 PRO 361 2HG PRO 361 19.900 39.548 13.353 423 HG3 PRO 361 1HG PRO 361 20.854 40.790 12.517 424 HD2 PRO 361 2HD PRO 361 18.168 40.481 12.116 425 HD3 PRO 361 1HD PRO 361 19.266 41.075 10.847 426 H GLU 362 H GLU 362 17.551 37.423 11.754 427 HA GLU 362 HA GLU 362 18.027 34.714 12.674 428 HB2 GLU 362 2HB GLU 362 17.056 35.181 14.933 429 HB3 GLU 362 1HB GLU 362 18.580 36.027 14.685 430 HG2 GLU 362 2HG GLU 362 17.218 38.090 14.084 431 HG3 GLU 362 1HG GLU 362 15.788 37.208 14.613 432 H TRP 363 H TRP 363 16.116 33.486 12.462 433 HA TRP 363 HA TRP 363 13.636 34.955 11.780 434 HB2 TRP 363 2HB TRP 363 14.710 33.657 9.831 435 HB3 TRP 363 1HB TRP 363 14.280 32.185 10.696 436 HD1 TRP 363 HD1 TRP 363 12.752 34.977 8.597 437 HE1 TRP 363 HE1 TRP 363 10.288 34.440 8.104 438 HE3 TRP 363 HE3 TRP 363 12.119 30.950 11.718 439 HZ2 TRP 363 HZ2 TRP 363 8.346 32.601 8.917 440 HZ3 TRP 363 HZ3 TRP 363 9.905 29.876 11.797 441 HH2 TRP 363 HH2 TRP 363 8.065 30.694 10.425 442 H TYR 364 H TYR 364 12.155 34.736 13.235 443 HA TYR 364 HA TYR 364 11.655 32.169 14.570 444 HB2 TYR 364 2HB TYR 364 11.887 34.857 15.989 445 HB3 TYR 364 1HB TYR 364 11.158 33.434 16.722 446 HD1 TYR 364 HD1 TYR 364 12.566 31.453 17.274 447 HD2 TYR 364 HD2 TYR 364 14.306 35.075 15.839 448 HE1 TYR 364 HE1 TYR 364 14.763 30.693 18.045 449 HE2 TYR 364 HE2 TYR 364 16.509 34.320 16.608 450 HH TYR 364 HH TYR 364 17.074 31.060 17.658 451 H CYS 365 H CYS 365 9.449 32.102 15.532 452 HA CYS 365 HA CYS 365 7.443 33.172 13.765 453 HB2 CYS 365 2HB CYS 365 5.894 31.799 15.027 454 HB3 CYS 365 1HB CYS 365 7.366 30.866 14.784 455 HA PRO 366 HA PRO 366 6.207 36.958 15.881 456 HB2 PRO 366 2HB PRO 366 3.434 35.754 15.896 457 HB3 PRO 366 1HB PRO 366 3.961 37.361 15.377 458 HG2 PRO 366 2HG PRO 366 3.406 35.492 13.575 459 HG3 PRO 366 1HG PRO 366 4.790 36.575 13.329 460 HD2 PRO 366 2HD PRO 366 4.744 33.699 14.161 461 HD3 PRO 366 1HD PRO 366 5.928 34.574 13.167 462 H SER 367 H SER 367 4.870 33.952 17.180 463 HA SER 367 HA SER 367 4.053 34.803 19.707 464 HB2 SER 367 2HB SER 367 5.089 32.069 18.886 465 HB3 SER 367 1HB SER 367 4.057 32.404 20.276 466 HG SER 367 HG SER 367 2.365 32.760 18.955 467 H CYS 368 H CYS 368 7.258 34.144 18.533 468 HA CYS 368 HA CYS 368 8.546 33.890 21.100 469 HB2 CYS 368 2HB CYS 368 9.489 33.933 18.240 470 HB3 CYS 368 1HB CYS 368 10.660 34.230 19.520 471 H ARG 369 H ARG 369 8.156 36.526 18.681 472 HA ARG 369 HA ARG 369 10.113 38.243 19.849 473 HB2 ARG 369 2HB ARG 369 9.411 39.933 18.289 474 HB3 ARG 369 1HB ARG 369 9.362 38.391 17.449 475 HG2 ARG 369 2HG ARG 369 6.907 38.323 17.675 476 HG3 ARG 369 1HG ARG 369 6.936 39.832 18.582 477 HD2 ARG 369 2HD ARG 369 7.973 40.912 16.527 478 HD3 ARG 369 1HD ARG 369 7.610 39.420 15.655 479 HE ARG 369 HE ARG 369 5.219 39.843 16.224 480 HH11 ARG 369 1HH1 ARG 369 7.445 42.560 16.153 481 HH12 ARG 369 2HH1 ARG 369 6.193 43.738 15.915 482 HH21 ARG 369 1HH2 ARG 369 3.584 41.378 15.907 483 HH22 ARG 369 2HH2 ARG 369 3.984 43.056 15.769 484 H THR 370 H THR 370 6.708 37.766 20.484 485 HA THR 370 HA THR 370 6.292 40.313 21.814 486 HB THR 370 HB THR 370 4.467 39.315 20.484 487 HG1 THR 370 HG1 THR 370 3.966 40.660 22.308 488 HG21 THR 370 1HG2 THR 370 4.350 37.113 22.583 489 HG22 THR 370 2HG2 THR 370 4.867 36.902 20.907 490 HG23 THR 370 3HG2 THR 370 3.200 37.359 21.264 491 H ASP 371 H ASP 371 6.026 40.652 23.978 492 HA ASP 371 HA ASP 371 7.033 38.693 25.886 493 HB2 ASP 371 2HB ASP 371 6.070 41.567 26.271 494 HB3 ASP 371 1HB ASP 371 6.731 40.559 27.557 495 H SER 372 H SER 372 4.051 39.319 24.505 496 HA SER 372 HA SER 372 2.285 38.863 26.719 497 HB2 SER 372 2HB SER 372 1.611 40.000 24.578 498 HB3 SER 372 1HB SER 372 1.755 38.453 23.741 499 HG SER 372 HG SER 372 0.154 37.703 25.387 500 H SER 373 H SER 373 4.433 36.810 25.131 501 HA SER 373 HA SER 373 3.024 34.331 25.189 502 HB2 SER 373 2HB SER 373 5.365 33.370 24.942 503 HB3 SER 373 1HB SER 373 4.938 34.574 23.726 504 HG SER 373 HG SER 373 6.638 35.619 24.361 505 H GLU 374 H GLU 374 4.096 32.457 26.547 506 HA GLU 374 HA GLU 374 3.477 32.857 29.283 507 HB2 GLU 374 2HB GLU 374 4.918 30.541 27.922 508 HB3 GLU 374 1HB GLU 374 4.252 30.500 29.553 509 HG2 GLU 374 2HG GLU 374 2.665 30.799 26.976 510 HG3 GLU 374 1HG GLU 374 2.778 29.353 27.979 511 H VAL 375 H VAL 375 4.846 32.868 31.131 512 HA VAL 375 HA VAL 375 7.256 34.350 30.793 513 HB VAL 375 HB VAL 375 7.451 34.223 33.315 514 HG11 VAL 375 1HG1 VAL 375 5.486 35.665 33.752 515 HG12 VAL 375 2HG1 VAL 375 4.762 35.148 32.226 516 HG13 VAL 375 3HG1 VAL 375 6.264 36.079 32.220 517 HG21 VAL 375 1HG2 VAL 375 5.550 33.319 34.642 518 HG22 VAL 375 2HG2 VAL 375 6.368 32.038 33.745 519 HG23 VAL 375 3HG2 VAL 375 4.827 32.670 33.163 520 H VAL 376 H VAL 376 9.019 33.443 30.027 521 HA VAL 376 HA VAL 376 9.894 30.751 30.824 522 HB VAL 376 HB VAL 376 11.088 32.643 28.735 523 HG11 VAL 376 1HG1 VAL 376 11.660 29.686 29.219 524 HG12 VAL 376 2HG1 VAL 376 12.769 31.021 29.545 525 HG13 VAL 376 3HG1 VAL 376 12.305 30.643 27.884 526 HG21 VAL 376 1HG2 VAL 376 8.806 31.966 28.084 527 HG22 VAL 376 2HG2 VAL 376 9.233 30.268 28.304 528 HG23 VAL 376 3HG2 VAL 376 10.003 31.209 27.025 529 H GLN 377 H GLN 377 11.751 30.414 32.032 530 HA GLN 377 HA GLN 377 12.937 32.559 33.521 531 HB2 GLN 377 2HB GLN 377 14.523 30.769 34.366 532 HB3 GLN 377 1HB GLN 377 12.817 30.461 34.660 533 HG2 GLN 377 2HG GLN 377 12.744 28.837 32.850 534 HG3 GLN 377 1HG GLN 377 14.398 29.221 32.387 535 HE21 GLN 377 1HE2 GLN 377 13.248 26.648 33.126 536 HE22 GLN 377 2HE2 GLN 377 14.173 26.075 34.466 537 H ALA 378 H ALA 378 13.501 33.850 31.618 538 HA ALA 378 HA ALA 378 15.790 33.116 29.989 539 HB1 ALA 378 1HB ALA 378 15.463 35.360 29.003 540 HB2 ALA 378 2HB ALA 378 14.258 35.737 30.236 541 HB3 ALA 378 3HB ALA 378 13.941 34.465 29.053 542 H GLY 379 H GLY 379 17.821 34.273 30.044 543 HA2 GLY 379 2HA GLY 379 19.496 35.549 31.131 544 HA3 GLY 379 1HA GLY 379 18.501 35.653 32.577 545 H GLU 380 H GLU 380 20.112 33.251 30.521 546 HA GLU 380 HA GLU 380 20.195 31.154 32.468 547 HB2 GLU 380 2HB GLU 380 21.702 31.504 29.832 548 HB3 GLU 380 1HB GLU 380 21.582 29.989 30.730 549 HG2 GLU 380 2HG GLU 380 19.247 29.813 30.308 550 HG3 GLU 380 1HG GLU 380 19.147 31.471 29.725 Start of MODEL 9 1 H1 SER 303 H SER 303 -0.564 5.274 8.691 2 HA SER 303 HA SER 303 0.741 3.518 6.740 3 HB2 SER 303 2HB SER 303 -1.403 4.629 6.126 4 HB3 SER 303 1HB SER 303 -0.656 6.209 6.349 5 HG SER 303 HG SER 303 -0.446 4.408 4.258 6 H GLY 304 H GLY 304 1.103 6.719 8.240 7 HA2 GLY 304 2HA GLY 304 3.493 7.498 6.874 8 HA3 GLY 304 1HA GLY 304 2.822 8.245 8.314 9 HA PRO 305 HA PRO 305 6.765 5.675 9.177 10 HB2 PRO 305 2HB PRO 305 8.627 7.609 9.558 11 HB3 PRO 305 1HB PRO 305 8.151 7.089 7.932 12 HG2 PRO 305 2HG PRO 305 7.231 9.500 9.498 13 HG3 PRO 305 1HG PRO 305 7.745 9.405 7.801 14 HD2 PRO 305 2HD PRO 305 5.108 9.406 8.574 15 HD3 PRO 305 1HD PRO 305 5.677 8.615 7.088 16 H SER 306 H SER 306 8.125 5.602 11.185 17 HA SER 306 HA SER 306 6.481 5.840 13.490 18 HB2 SER 306 2HB SER 306 8.453 4.915 14.722 19 HB3 SER 306 1HB SER 306 8.070 3.989 13.271 20 HG SER 306 HG SER 306 9.778 5.801 12.494 21 H CYS 307 H CYS 307 5.944 7.884 13.956 22 HA CYS 307 HA CYS 307 7.823 10.067 14.158 23 HB2 CYS 307 2HB CYS 307 4.862 9.778 14.694 24 HB3 CYS 307 1HB CYS 307 5.725 11.231 15.182 25 H ARG 308 H ARG 308 9.327 9.672 15.715 26 HA ARG 308 HA ARG 308 8.781 8.792 18.403 27 HB2 ARG 308 2HB ARG 308 11.245 10.302 17.410 28 HB3 ARG 308 1HB ARG 308 11.140 9.243 18.821 29 HG2 ARG 308 2HG ARG 308 10.879 7.293 17.348 30 HG3 ARG 308 1HG ARG 308 10.884 8.342 15.925 31 HD2 ARG 308 2HD ARG 308 13.212 9.071 16.549 32 HD3 ARG 308 1HD ARG 308 13.184 7.885 17.863 33 HE ARG 308 HE ARG 308 12.602 6.787 15.250 34 HH11 ARG 308 1HH1 ARG 308 15.184 7.490 17.529 35 HH12 ARG 308 2HH1 ARG 308 16.299 6.399 16.771 36 HH21 ARG 308 1HH2 ARG 308 14.085 5.396 14.265 37 HH22 ARG 308 2HH2 ARG 308 15.679 5.236 14.921 38 H PHE 309 H PHE 309 9.605 11.879 16.884 39 HA PHE 309 HA PHE 309 9.656 13.397 19.336 40 HB2 PHE 309 2HB PHE 309 9.904 14.218 16.416 41 HB3 PHE 309 1HB PHE 309 10.113 15.325 17.764 42 HD1 PHE 309 HD1 PHE 309 12.276 15.712 18.558 43 HD2 PHE 309 HD2 PHE 309 11.501 12.091 16.438 44 HE1 PHE 309 HE1 PHE 309 14.671 15.191 18.566 45 HE2 PHE 309 HE2 PHE 309 13.900 11.566 16.456 46 HZ PHE 309 HZ PHE 309 15.493 13.113 17.524 47 H CYS 310 H CYS 310 7.153 12.584 17.134 48 HA CYS 310 HA CYS 310 5.387 14.638 18.332 49 HB2 CYS 310 2HB CYS 310 4.223 14.020 15.807 50 HB3 CYS 310 1HB CYS 310 5.021 15.516 16.254 51 H LYS 311 H LYS 311 6.086 11.461 18.373 52 HA LYS 311 HA LYS 311 5.069 9.529 18.940 53 HB2 LYS 311 2HB LYS 311 3.557 11.561 20.598 54 HB3 LYS 311 1HB LYS 311 3.279 9.837 20.799 55 HG2 LYS 311 2HG LYS 311 5.893 11.313 21.255 56 HG3 LYS 311 1HG LYS 311 4.831 10.634 22.493 57 HD2 LYS 311 2HD LYS 311 6.470 9.096 20.431 58 HD3 LYS 311 1HD LYS 311 6.763 9.183 22.169 59 HE2 LYS 311 2HE LYS 311 4.384 7.855 20.814 60 HE3 LYS 311 1HE LYS 311 5.750 7.032 21.562 61 HZ1 LYS 311 1HZ LYS 311 3.861 7.018 23.017 62 HZ2 LYS 311 2HZ LYS 311 3.726 8.702 22.960 63 HZ3 LYS 311 3HZ LYS 311 5.071 7.984 23.693 64 H ASP 312 H ASP 312 4.162 10.287 16.500 65 HA ASP 312 HA ASP 312 2.625 10.040 14.881 66 HB2 ASP 312 2HB ASP 312 1.508 7.884 16.713 67 HB3 ASP 312 1HB ASP 312 1.171 8.032 14.995 68 H ASP 313 H ASP 313 2.011 12.264 16.005 69 HA ASP 313 HA ASP 313 -0.697 12.439 16.924 70 HB2 ASP 313 2HB ASP 313 -0.458 14.927 16.457 71 HB3 ASP 313 1HB ASP 313 0.661 14.249 17.626 72 H GLU 314 H GLU 314 -1.747 11.169 15.453 73 HA GLU 314 HA GLU 314 -2.168 11.957 12.700 74 HB2 GLU 314 2HB GLU 314 -3.905 10.146 12.753 75 HB3 GLU 314 1HB GLU 314 -2.312 9.607 13.276 76 HG2 GLU 314 2HG GLU 314 -3.017 9.745 15.637 77 HG3 GLU 314 1HG GLU 314 -4.609 10.320 15.132 78 H ASN 315 H ASN 315 -3.467 12.788 15.771 79 HA ASN 315 HA ASN 315 -6.079 13.692 14.911 80 HB2 ASN 315 2HB ASN 315 -5.917 12.881 17.191 81 HB3 ASN 315 1HB ASN 315 -4.531 13.910 17.532 82 HD21 ASN 315 1HD2 ASN 315 -8.008 13.950 16.869 83 HD22 ASN 315 2HD2 ASN 315 -8.335 15.423 17.700 84 H LYS 316 H LYS 316 -3.208 15.293 16.258 85 HA LYS 316 HA LYS 316 -3.931 17.890 15.125 86 HB2 LYS 316 2HB LYS 316 -1.659 17.007 16.971 87 HB3 LYS 316 1HB LYS 316 -1.889 18.671 16.422 88 HG2 LYS 316 2HG LYS 316 -4.086 18.741 17.540 89 HG3 LYS 316 1HG LYS 316 -3.873 17.069 18.073 90 HD2 LYS 316 2HD LYS 316 -1.980 17.711 19.475 91 HD3 LYS 316 1HD LYS 316 -2.042 19.372 18.867 92 HE2 LYS 316 2HE LYS 316 -4.222 17.993 20.488 93 HE3 LYS 316 1HE LYS 316 -3.084 19.194 21.099 94 HZ1 LYS 316 1HZ LYS 316 -5.085 19.670 18.951 95 HZ2 LYS 316 2HZ LYS 316 -4.015 20.818 19.579 96 HZ3 LYS 316 3HZ LYS 316 -5.227 20.170 20.557 97 HA PRO 317 HA PRO 317 -0.895 17.675 11.684 98 HB2 PRO 317 2HB PRO 317 -0.127 20.437 12.634 99 HB3 PRO 317 1HB PRO 317 -0.493 19.871 10.997 100 HG2 PRO 317 2HG PRO 317 -2.295 21.295 12.326 101 HG3 PRO 317 1HG PRO 317 -2.816 19.886 11.375 102 HD2 PRO 317 2HD PRO 317 -2.441 20.127 14.360 103 HD3 PRO 317 1HD PRO 317 -3.731 19.311 13.445 104 H CYS 318 H CYS 318 1.409 17.479 11.450 105 HA CYS 318 HA CYS 318 2.661 16.478 13.846 106 HB2 CYS 318 2HB CYS 318 3.146 16.238 10.952 107 HB3 CYS 318 1HB CYS 318 4.630 16.382 11.878 108 H ARG 319 H ARG 319 3.499 17.848 15.239 109 HA ARG 319 HA ARG 319 4.442 20.468 14.761 110 HB2 ARG 319 2HB ARG 319 5.136 20.429 17.110 111 HB3 ARG 319 1HB ARG 319 3.573 19.638 16.938 112 HG2 ARG 319 2HG ARG 319 5.130 17.441 16.790 113 HG3 ARG 319 1HG ARG 319 6.244 18.472 17.686 114 HD2 ARG 319 2HD ARG 319 4.974 17.157 19.264 115 HD3 ARG 319 1HD ARG 319 4.418 18.832 19.394 116 HE ARG 319 HE ARG 319 2.796 17.499 17.531 117 HH11 ARG 319 1HH1 ARG 319 3.336 17.466 21.002 118 HH12 ARG 319 2HH1 ARG 319 1.750 16.858 21.347 119 HH21 ARG 319 1HH2 ARG 319 0.769 16.689 17.988 120 HH22 ARG 319 2HH2 ARG 319 0.287 16.417 19.633 121 H LYS 320 H LYS 320 6.020 17.419 14.430 122 HA LYS 320 HA LYS 320 8.720 18.620 14.205 123 HB2 LYS 320 2HB LYS 320 7.814 15.960 15.371 124 HB3 LYS 320 1HB LYS 320 9.502 16.289 14.982 125 HG2 LYS 320 2HG LYS 320 7.942 18.141 16.801 126 HG3 LYS 320 1HG LYS 320 8.657 16.652 17.427 127 HD2 LYS 320 2HD LYS 320 10.885 17.391 16.756 128 HD3 LYS 320 1HD LYS 320 10.219 18.830 15.983 129 HE2 LYS 320 2HE LYS 320 9.536 19.739 18.112 130 HE3 LYS 320 1HE LYS 320 9.943 18.235 18.944 131 HZ1 LYS 320 1HZ LYS 320 11.628 20.032 19.162 132 HZ2 LYS 320 2HZ LYS 320 11.949 19.883 17.507 133 HZ3 LYS 320 3HZ LYS 320 12.231 18.580 18.546 134 H CYS 321 H CYS 321 6.464 17.778 12.153 135 HA CYS 321 HA CYS 321 8.465 16.784 10.209 136 HB2 CYS 321 2HB CYS 321 5.600 15.724 10.277 137 HB3 CYS 321 1HB CYS 321 6.823 15.321 9.075 138 H ALA 322 H ALA 322 5.780 18.877 10.953 139 HA ALA 322 HA ALA 322 5.671 19.901 8.182 140 HB1 ALA 322 1HB ALA 322 3.861 18.225 8.416 141 HB2 ALA 322 2HB ALA 322 3.209 19.851 8.209 142 HB3 ALA 322 3HB ALA 322 3.220 19.103 9.811 143 H CYS 323 H CYS 323 4.200 21.846 8.070 144 HA CYS 323 HA CYS 323 4.659 23.757 10.239 145 HB2 CYS 323 2HB CYS 323 5.094 24.706 8.107 146 HB3 CYS 323 1HB CYS 323 3.686 23.956 7.376 147 H HIS 324 H HIS 324 3.233 23.701 11.868 148 HA HIS 324 HA HIS 324 0.964 22.031 11.871 149 HB2 HIS 324 2HB HIS 324 2.333 22.457 13.870 150 HB3 HIS 324 1HB HIS 324 1.877 24.154 13.860 151 HD1 HIS 324 HD1 HIS 324 -0.605 24.706 14.619 152 HD2 HIS 324 HD2 HIS 324 0.543 20.740 15.109 153 HE1 HIS 324 HE1 HIS 324 -2.305 23.667 16.156 154 H VAL 325 H VAL 325 1.328 25.422 11.214 155 HA VAL 325 HA VAL 325 -1.203 26.368 12.025 156 HB VAL 325 HB VAL 325 0.605 27.686 9.961 157 HG11 VAL 325 1HG1 VAL 325 -1.358 28.899 11.947 158 HG12 VAL 325 2HG1 VAL 325 -1.574 28.788 10.198 159 HG13 VAL 325 3HG1 VAL 325 -0.305 29.816 10.865 160 HG21 VAL 325 1HG2 VAL 325 0.858 27.837 12.993 161 HG22 VAL 325 2HG2 VAL 325 1.757 28.835 11.848 162 HG23 VAL 325 3HG2 VAL 325 2.008 27.089 11.880 163 H CYS 326 H CYS 326 -0.198 24.716 9.166 164 HA CYS 326 HA CYS 326 -2.927 24.905 8.032 165 HB2 CYS 326 2HB CYS 326 -2.000 24.981 5.739 166 HB3 CYS 326 1HB CYS 326 -1.447 26.365 6.677 167 H GLY 327 H GLY 327 -0.663 22.968 9.374 168 HA2 GLY 327 2HA GLY 327 -0.281 20.730 9.508 169 HA3 GLY 327 1HA GLY 327 -1.749 20.488 8.580 170 H GLY 328 H GLY 328 0.776 22.375 7.125 171 HA2 GLY 328 2HA GLY 328 1.032 20.257 5.065 172 HA3 GLY 328 1HA GLY 328 0.991 21.979 4.742 173 H ARG 329 H ARG 329 2.958 19.630 4.347 174 HA ARG 329 HA ARG 329 5.473 20.872 5.266 175 HB2 ARG 329 2HB ARG 329 4.923 18.327 3.672 176 HB3 ARG 329 1HB ARG 329 6.524 18.866 4.174 177 HG2 ARG 329 2HG ARG 329 5.855 18.617 6.540 178 HG3 ARG 329 1HG ARG 329 4.258 18.070 6.026 179 HD2 ARG 329 2HD ARG 329 5.737 16.191 6.660 180 HD3 ARG 329 1HD ARG 329 5.227 16.099 4.973 181 HE ARG 329 HE ARG 329 7.719 17.419 5.112 182 HH11 ARG 329 1HH1 ARG 329 6.406 14.197 5.566 183 HH12 ARG 329 2HH1 ARG 329 7.870 13.400 5.093 184 HH21 ARG 329 1HH2 ARG 329 9.629 16.356 4.473 185 HH22 ARG 329 2HH2 ARG 329 9.690 14.626 4.485 186 H GLU 330 H GLU 330 3.550 22.003 3.240 187 HA GLU 330 HA GLU 330 4.427 21.606 0.577 188 HB2 GLU 330 2HB GLU 330 2.763 23.890 1.739 189 HB3 GLU 330 1HB GLU 330 2.791 23.361 0.057 190 HG2 GLU 330 2HG GLU 330 1.730 21.250 0.650 191 HG3 GLU 330 1HG GLU 330 1.825 21.635 2.364 192 H ALA 331 H ALA 331 5.398 23.153 -0.855 193 HA ALA 331 HA ALA 331 7.060 24.562 -1.538 194 HB1 ALA 331 1HB ALA 331 4.956 25.816 -1.625 195 HB2 ALA 331 2HB ALA 331 6.344 26.881 -1.377 196 HB3 ALA 331 3HB ALA 331 5.279 26.477 -0.023 197 HA PRO 332 HA PRO 332 9.709 24.415 2.295 198 HB2 PRO 332 2HB PRO 332 11.906 24.106 0.286 199 HB3 PRO 332 1HB PRO 332 11.508 23.100 1.686 200 HG2 PRO 332 2HG PRO 332 11.012 22.291 -0.832 201 HG3 PRO 332 1HG PRO 332 9.937 21.862 0.514 202 HD2 PRO 332 2HD PRO 332 9.580 23.945 -1.622 203 HD3 PRO 332 1HD PRO 332 8.380 22.853 -0.899 204 H GLU 333 H GLU 333 10.580 26.166 -0.666 205 HA GLU 333 HA GLU 333 12.387 28.024 0.442 206 HB2 GLU 333 2HB GLU 333 12.056 29.314 -1.651 207 HB3 GLU 333 1HB GLU 333 12.311 27.597 -1.940 208 HG2 GLU 333 2HG GLU 333 9.782 27.369 -2.155 209 HG3 GLU 333 1HG GLU 333 9.701 29.131 -2.120 210 H LYS 334 H LYS 334 8.897 28.023 0.520 211 HA LYS 334 HA LYS 334 8.828 30.787 1.581 212 HB2 LYS 334 2HB LYS 334 6.572 29.030 0.520 213 HB3 LYS 334 1HB LYS 334 6.342 30.640 1.211 214 HG2 LYS 334 2HG LYS 334 7.745 31.616 -0.576 215 HG3 LYS 334 1HG LYS 334 7.991 30.012 -1.272 216 HD2 LYS 334 2HD LYS 334 5.335 31.498 -1.050 217 HD3 LYS 334 1HD LYS 334 6.282 31.272 -2.524 218 HE2 LYS 334 2HE LYS 334 5.980 28.779 -2.229 219 HE3 LYS 334 1HE LYS 334 4.882 29.134 -0.892 220 HZ1 LYS 334 1HZ LYS 334 3.656 28.731 -2.886 221 HZ2 LYS 334 2HZ LYS 334 4.520 29.905 -3.733 222 HZ3 LYS 334 3HZ LYS 334 3.488 30.363 -2.478 223 H GLN 335 H GLN 335 9.071 27.665 2.730 224 HA GLN 335 HA GLN 335 7.590 27.955 5.178 225 HB2 GLN 335 2HB GLN 335 9.967 26.152 4.538 226 HB3 GLN 335 1HB GLN 335 9.085 26.117 6.062 227 HG2 GLN 335 2HG GLN 335 7.027 25.482 4.799 228 HG3 GLN 335 1HG GLN 335 7.993 25.409 3.324 229 HE21 GLN 335 1HE2 GLN 335 7.647 23.204 2.979 230 HE22 GLN 335 2HE2 GLN 335 8.306 21.975 3.999 231 H LEU 336 H LEU 336 8.271 28.710 7.129 232 HA LEU 336 HA LEU 336 11.026 29.721 7.465 233 HB2 LEU 336 2HB LEU 336 8.426 31.129 8.181 234 HB3 LEU 336 1HB LEU 336 9.957 31.555 8.931 235 HG LEU 336 HG LEU 336 9.364 31.755 5.955 236 HD11 LEU 336 1HD1 LEU 336 9.589 33.971 8.026 237 HD12 LEU 336 2HD1 LEU 336 8.107 33.435 7.230 238 HD13 LEU 336 3HD1 LEU 336 9.383 34.194 6.284 239 HD21 LEU 336 1HD2 LEU 336 11.827 32.651 7.501 240 HD22 LEU 336 2HD2 LEU 336 11.512 32.957 5.791 241 HD23 LEU 336 3HD2 LEU 336 11.741 31.307 6.357 242 H LEU 337 H LEU 337 11.811 28.265 8.810 243 HA LEU 337 HA LEU 337 10.192 27.072 10.941 244 HB2 LEU 337 2HB LEU 337 13.023 26.439 9.988 245 HB3 LEU 337 1HB LEU 337 12.244 25.653 11.352 246 HG LEU 337 HG LEU 337 10.447 24.848 9.732 247 HD11 LEU 337 1HD1 LEU 337 10.979 24.719 7.345 248 HD12 LEU 337 2HD1 LEU 337 12.419 25.707 7.596 249 HD13 LEU 337 3HD1 LEU 337 10.816 26.395 7.870 250 HD21 LEU 337 1HD2 LEU 337 12.187 23.351 10.596 251 HD22 LEU 337 2HD2 LEU 337 13.272 23.828 9.286 252 HD23 LEU 337 3HD2 LEU 337 11.783 22.950 8.926 253 H CYS 338 H CYS 338 10.173 27.907 12.922 254 HA CYS 338 HA CYS 338 12.170 29.816 13.859 255 HB2 CYS 338 2HB CYS 338 9.735 30.145 14.366 256 HB3 CYS 338 1HB CYS 338 9.752 28.655 15.320 257 H ASP 339 H ASP 339 14.083 28.862 14.436 258 HA ASP 339 HA ASP 339 14.554 26.266 15.327 259 HB2 ASP 339 2HB ASP 339 16.375 27.689 14.564 260 HB3 ASP 339 1HB ASP 339 16.109 28.832 15.876 261 H GLU 340 H GLU 340 13.837 29.145 17.232 262 HA GLU 340 HA GLU 340 14.168 28.282 19.840 263 HB2 GLU 340 2HB GLU 340 13.736 30.612 19.168 264 HB3 GLU 340 1HB GLU 340 12.099 30.196 18.691 265 HG2 GLU 340 2HG GLU 340 12.123 31.373 20.821 266 HG3 GLU 340 1HG GLU 340 11.496 29.735 21.006 267 H CYS 341 H CYS 341 11.380 27.728 17.696 268 HA CYS 341 HA CYS 341 9.884 26.377 19.882 269 HB2 CYS 341 2HB CYS 341 8.886 27.641 17.285 270 HB3 CYS 341 1HB CYS 341 7.859 26.839 18.481 271 H ASP 342 H ASP 342 11.798 25.632 17.270 272 HA ASP 342 HA ASP 342 12.051 24.027 15.706 273 HB2 ASP 342 2HB ASP 342 10.437 22.391 17.711 274 HB3 ASP 342 1HB ASP 342 11.230 21.693 16.300 275 H MET 343 H MET 343 9.554 25.725 15.589 276 HA MET 343 HA MET 343 7.606 23.894 14.365 277 HB2 MET 343 2HB MET 343 6.825 25.303 16.275 278 HB3 MET 343 1HB MET 343 7.200 26.748 15.350 279 HG2 MET 343 2HG MET 343 4.889 26.510 15.130 280 HG3 MET 343 1HG MET 343 5.502 25.857 13.618 281 HE1 MET 343 1HE MET 343 6.261 22.724 14.225 282 HE2 MET 343 2HE MET 343 5.298 23.368 12.884 283 HE3 MET 343 3HE MET 343 4.657 22.064 13.882 284 H ALA 344 H ALA 344 7.645 23.785 12.239 285 HA ALA 344 HA ALA 344 8.691 25.774 10.486 286 HB1 ALA 344 1HB ALA 344 8.667 23.397 9.858 287 HB2 ALA 344 2HB ALA 344 7.782 24.363 8.677 288 HB3 ALA 344 3HB ALA 344 6.900 23.395 9.862 289 H PHE 345 H PHE 345 7.652 27.329 9.353 290 HA PHE 345 HA PHE 345 4.714 27.657 9.572 291 HB2 PHE 345 2HB PHE 345 6.841 29.844 9.781 292 HB3 PHE 345 1HB PHE 345 5.122 30.161 9.578 293 HD1 PHE 345 HD1 PHE 345 3.563 29.872 11.429 294 HD2 PHE 345 HD2 PHE 345 7.715 29.005 11.937 295 HE1 PHE 345 HE1 PHE 345 3.257 29.817 13.869 296 HE2 PHE 345 HE2 PHE 345 7.399 28.947 14.372 297 HZ PHE 345 HZ PHE 345 5.173 29.349 15.343 298 H HIS 346 H HIS 346 4.198 29.571 7.890 299 HA HIS 346 HA HIS 346 5.881 29.461 5.474 300 HB2 HIS 346 2HB HIS 346 2.844 29.109 5.545 301 HB3 HIS 346 1HB HIS 346 3.679 29.665 4.102 302 HD2 HIS 346 HD2 HIS 346 5.802 27.783 3.316 303 HE1 HIS 346 HE1 HIS 346 3.445 24.523 4.587 304 HE2 HIS 346 HE2 HIS 346 5.582 25.238 3.463 305 H LEU 347 H LEU 347 5.490 31.381 4.094 306 HA LEU 347 HA LEU 347 5.686 33.818 5.386 307 HB2 LEU 347 2HB LEU 347 4.761 33.158 2.563 308 HB3 LEU 347 1HB LEU 347 5.089 34.802 3.095 309 HG LEU 347 HG LEU 347 7.128 32.542 2.910 310 HD11 LEU 347 1HD1 LEU 347 8.144 33.883 1.108 311 HD12 LEU 347 2HD1 LEU 347 6.837 35.062 1.234 312 HD13 LEU 347 3HD1 LEU 347 6.492 33.412 0.706 313 HD21 LEU 347 1HD2 LEU 347 7.545 35.425 3.770 314 HD22 LEU 347 2HD2 LEU 347 8.819 34.233 3.498 315 HD23 LEU 347 3HD2 LEU 347 7.661 33.997 4.803 316 H TYR 348 H TYR 348 2.755 32.301 4.049 317 HA TYR 348 HA TYR 348 1.038 34.487 4.977 318 HB2 TYR 348 2HB TYR 348 -0.758 33.380 3.686 319 HB3 TYR 348 1HB TYR 348 0.653 33.711 2.699 320 HD1 TYR 348 HD1 TYR 348 2.308 31.703 2.290 321 HD2 TYR 348 HD2 TYR 348 -1.708 31.177 3.657 322 HE1 TYR 348 HE1 TYR 348 2.325 29.400 1.440 323 HE2 TYR 348 HE2 TYR 348 -1.680 28.864 2.799 324 HH TYR 348 HH TYR 348 -0.494 27.547 1.070 325 H CYS 349 H CYS 349 2.250 31.717 6.372 326 HA CYS 349 HA CYS 349 -0.144 31.118 7.998 327 HB2 CYS 349 2HB CYS 349 2.600 29.799 7.918 328 HB3 CYS 349 1HB CYS 349 1.279 29.297 8.978 329 H LEU 350 H LEU 350 1.900 33.541 8.072 330 HA LEU 350 HA LEU 350 2.514 33.549 10.951 331 HB2 LEU 350 2HB LEU 350 3.346 35.484 8.746 332 HB3 LEU 350 1HB LEU 350 3.887 35.549 10.422 333 HG LEU 350 HG LEU 350 4.494 33.305 8.452 334 HD11 LEU 350 1HD1 LEU 350 5.726 35.338 7.911 335 HD12 LEU 350 2HD1 LEU 350 6.806 34.088 8.523 336 HD13 LEU 350 3HD1 LEU 350 6.334 35.434 9.565 337 HD21 LEU 350 1HD2 LEU 350 5.434 33.650 11.317 338 HD22 LEU 350 2HD2 LEU 350 5.997 32.410 10.196 339 HD23 LEU 350 3HD2 LEU 350 4.317 32.420 10.724 340 H LYS 351 H LYS 351 2.269 35.913 11.883 341 HA LYS 351 HA LYS 351 -0.151 37.310 11.087 342 HB2 LYS 351 2HB LYS 351 -0.855 35.274 12.539 343 HB3 LYS 351 1HB LYS 351 -0.037 36.059 13.878 344 HG2 LYS 351 2HG LYS 351 -2.395 36.508 14.048 345 HG3 LYS 351 1HG LYS 351 -1.577 38.014 13.620 346 HD2 LYS 351 2HD LYS 351 -2.258 37.750 11.270 347 HD3 LYS 351 1HD LYS 351 -3.002 36.191 11.638 348 HE2 LYS 351 2HE LYS 351 -4.730 37.894 11.473 349 HE3 LYS 351 1HE LYS 351 -4.614 37.358 13.148 350 HZ1 LYS 351 1HZ LYS 351 -3.392 39.834 12.050 351 HZ2 LYS 351 2HZ LYS 351 -3.345 39.333 13.667 352 HZ3 LYS 351 3HZ LYS 351 -4.817 39.762 12.955 353 HA PRO 352 HA PRO 352 -0.001 39.310 10.338 354 HB2 PRO 352 2HB PRO 352 1.598 41.236 9.253 355 HB3 PRO 352 1HB PRO 352 0.467 41.580 10.571 356 HG2 PRO 352 2HG PRO 352 3.439 41.037 10.710 357 HG3 PRO 352 1HG PRO 352 2.501 42.322 11.506 358 HD2 PRO 352 2HD PRO 352 3.228 40.040 12.805 359 HD3 PRO 352 1HD PRO 352 1.717 40.897 13.174 360 HA PRO 353 HA PRO 353 2.272 36.487 7.612 361 HB2 PRO 353 2HB PRO 353 0.599 37.696 5.424 362 HB3 PRO 353 1HB PRO 353 0.763 36.003 5.914 363 HG2 PRO 353 2HG PRO 353 -1.452 37.360 6.512 364 HG3 PRO 353 1HG PRO 353 -0.747 36.229 7.688 365 HD2 PRO 353 2HD PRO 353 -0.535 39.247 7.606 366 HD3 PRO 353 1HD PRO 353 -0.862 38.177 8.991 367 H LEU 354 H LEU 354 4.277 36.813 6.835 368 HA LEU 354 HA LEU 354 5.186 39.376 5.822 369 HB2 LEU 354 2HB LEU 354 6.610 36.681 5.998 370 HB3 LEU 354 1HB LEU 354 7.377 38.173 5.467 371 HG LEU 354 HG LEU 354 6.240 37.653 8.239 372 HD11 LEU 354 1HD1 LEU 354 8.306 36.403 7.867 373 HD12 LEU 354 2HD1 LEU 354 8.580 37.714 9.010 374 HD13 LEU 354 3HD1 LEU 354 9.133 37.873 7.341 375 HD21 LEU 354 1HD2 LEU 354 7.243 39.819 8.890 376 HD22 LEU 354 2HD2 LEU 354 5.977 40.013 7.682 377 HD23 LEU 354 3HD2 LEU 354 7.673 40.124 7.203 378 H THR 355 H THR 355 5.454 39.943 3.731 379 HA THR 355 HA THR 355 4.125 38.508 1.636 380 HB THR 355 HB THR 355 4.963 40.388 0.173 381 HG1 THR 355 HG1 THR 355 6.776 41.221 0.908 382 HG21 THR 355 1HG2 THR 355 3.703 42.204 1.250 383 HG22 THR 355 2HG2 THR 355 3.724 41.335 2.785 384 HG23 THR 355 3HG2 THR 355 2.836 40.670 1.411 385 H SER 356 H SER 356 7.485 39.100 2.520 386 HA SER 356 HA SER 356 8.451 37.128 0.526 387 HB2 SER 356 2HB SER 356 9.796 39.774 1.265 388 HB3 SER 356 1HB SER 356 10.392 38.596 0.096 389 HG SER 356 HG SER 356 8.820 40.632 -0.357 390 H VAL 357 H VAL 357 10.494 36.095 1.189 391 HA VAL 357 HA VAL 357 10.745 35.457 3.932 392 HB VAL 357 HB VAL 357 11.549 33.903 2.189 393 HG11 VAL 357 1HG1 VAL 357 13.779 35.891 1.608 394 HG12 VAL 357 2HG1 VAL 357 12.432 35.502 0.538 395 HG13 VAL 357 3HG1 VAL 357 13.633 34.268 0.918 396 HG21 VAL 357 1HG2 VAL 357 13.822 34.777 4.016 397 HG22 VAL 357 2HG2 VAL 357 13.700 33.207 3.213 398 HG23 VAL 357 3HG2 VAL 357 12.517 33.666 4.438 399 HA PRO 358 HA PRO 358 12.723 39.330 5.135 400 HB2 PRO 358 2HB PRO 358 13.241 38.795 7.759 401 HB3 PRO 358 1HB PRO 358 11.594 39.041 7.159 402 HG2 PRO 358 2HG PRO 358 13.058 36.447 7.665 403 HG3 PRO 358 1HG PRO 358 11.418 36.914 8.161 404 HD2 PRO 358 2HD PRO 358 11.860 35.379 5.969 405 HD3 PRO 358 1HD PRO 358 10.525 36.553 6.032 406 HA PRO 359 HA PRO 359 17.117 38.578 4.619 407 HB2 PRO 359 2HB PRO 359 18.164 40.993 5.095 408 HB3 PRO 359 1HB PRO 359 16.954 40.794 3.811 409 HG2 PRO 359 2HG PRO 359 16.549 41.743 6.663 410 HG3 PRO 359 1HG PRO 359 16.007 42.518 5.153 411 HD2 PRO 359 2HD PRO 359 14.384 40.903 6.670 412 HD3 PRO 359 1HD PRO 359 14.211 41.047 4.904 413 H GLU 360 H GLU 360 15.881 38.318 7.516 414 HA GLU 360 HA GLU 360 17.780 39.092 9.421 415 HB2 GLU 360 2HB GLU 360 15.794 36.796 9.649 416 HB3 GLU 360 1HB GLU 360 16.551 37.668 10.982 417 HG2 GLU 360 2HG GLU 360 14.524 38.752 9.008 418 HG3 GLU 360 1HG GLU 360 14.250 38.390 10.708 419 HA PRO 361 HA PRO 361 20.895 35.790 8.901 420 HB2 PRO 361 2HB PRO 361 22.410 36.345 11.096 421 HB3 PRO 361 1HB PRO 361 22.418 37.394 9.670 422 HG2 PRO 361 2HG PRO 361 20.868 37.705 12.248 423 HG3 PRO 361 1HG PRO 361 21.843 38.915 11.382 424 HD2 PRO 361 2HD PRO 361 19.135 38.802 11.136 425 HD3 PRO 361 1HD PRO 361 20.178 39.294 9.782 426 H GLU 362 H GLU 362 18.639 36.166 11.445 427 HA GLU 362 HA GLU 362 18.470 33.314 11.952 428 HB2 GLU 362 2HB GLU 362 18.510 33.643 14.470 429 HB3 GLU 362 1HB GLU 362 20.074 33.901 13.701 430 HG2 GLU 362 2HG GLU 362 19.606 36.377 13.760 431 HG3 GLU 362 1HG GLU 362 18.164 36.026 14.714 432 H TRP 363 H TRP 363 16.299 32.808 12.220 433 HA TRP 363 HA TRP 363 14.417 35.092 12.416 434 HB2 TRP 363 2HB TRP 363 14.472 34.090 10.119 435 HB3 TRP 363 1HB TRP 363 13.970 32.543 10.794 436 HD1 TRP 363 HD1 TRP 363 12.627 36.105 10.128 437 HE1 TRP 363 HE1 TRP 363 10.058 36.054 10.185 438 HE3 TRP 363 HE3 TRP 363 11.912 31.273 11.713 439 HZ2 TRP 363 HZ2 TRP 363 8.008 34.248 10.822 440 HZ3 TRP 363 HZ3 TRP 363 9.602 30.475 12.032 441 HH2 TRP 363 HH2 TRP 363 7.692 31.936 11.597 442 H TYR 364 H TYR 364 12.983 35.030 13.944 443 HA TYR 364 HA TYR 364 12.143 32.473 15.169 444 HB2 TYR 364 2HB TYR 364 12.305 35.168 16.608 445 HB3 TYR 364 1HB TYR 364 11.912 33.607 17.324 446 HD1 TYR 364 HD1 TYR 364 13.766 31.785 17.324 447 HD2 TYR 364 HD2 TYR 364 14.575 35.907 16.531 448 HE1 TYR 364 HE1 TYR 364 16.153 31.405 17.781 449 HE2 TYR 364 HE2 TYR 364 16.957 35.520 16.993 450 HH TYR 364 HH TYR 364 18.374 33.967 18.201 451 H CYS 365 H CYS 365 9.879 32.472 15.812 452 HA CYS 365 HA CYS 365 8.227 33.563 13.751 453 HB2 CYS 365 2HB CYS 365 6.417 32.297 14.793 454 HB3 CYS 365 1HB CYS 365 7.875 31.309 14.733 455 HA PRO 366 HA PRO 366 6.372 37.369 15.451 456 HB2 PRO 366 2HB PRO 366 3.806 35.790 15.071 457 HB3 PRO 366 1HB PRO 366 4.135 37.490 14.692 458 HG2 PRO 366 2HG PRO 366 4.158 35.640 12.761 459 HG3 PRO 366 1HG PRO 366 5.351 36.958 12.763 460 HD2 PRO 366 2HD PRO 366 5.727 34.068 13.400 461 HD3 PRO 366 1HD PRO 366 6.898 35.244 12.772 462 H SER 367 H SER 367 4.977 34.267 16.561 463 HA SER 367 HA SER 367 3.828 35.088 18.970 464 HB2 SER 367 2HB SER 367 3.367 32.910 17.865 465 HB3 SER 367 1HB SER 367 4.975 32.344 18.306 466 HG SER 367 HG SER 367 4.165 32.903 20.570 467 H CYS 368 H CYS 368 7.207 34.359 18.288 468 HA CYS 368 HA CYS 368 8.130 34.081 20.972 469 HB2 CYS 368 2HB CYS 368 9.460 34.459 18.313 470 HB3 CYS 368 1HB CYS 368 10.408 34.864 19.740 471 H ARG 369 H ARG 369 7.777 36.917 18.824 472 HA ARG 369 HA ARG 369 8.864 38.697 20.907 473 HB2 ARG 369 2HB ARG 369 8.902 40.434 19.179 474 HB3 ARG 369 1HB ARG 369 9.763 39.000 18.664 475 HG2 ARG 369 2HG ARG 369 8.657 39.603 16.715 476 HG3 ARG 369 1HG ARG 369 7.552 38.408 17.392 477 HD2 ARG 369 2HD ARG 369 6.458 40.501 16.443 478 HD3 ARG 369 1HD ARG 369 6.004 40.096 18.101 479 HE ARG 369 HE ARG 369 8.166 41.890 18.200 480 HH11 ARG 369 1HH1 ARG 369 4.808 41.953 17.182 481 HH12 ARG 369 2HH1 ARG 369 4.587 43.608 17.642 482 HH21 ARG 369 1HH2 ARG 369 7.854 44.037 18.823 483 HH22 ARG 369 2HH2 ARG 369 6.310 44.793 18.565 484 H THR 370 H THR 370 5.876 37.532 19.917 485 HA THR 370 HA THR 370 4.090 39.670 20.284 486 HB THR 370 HB THR 370 3.755 36.662 20.653 487 HG1 THR 370 HG1 THR 370 2.825 38.358 18.570 488 HG21 THR 370 1HG2 THR 370 1.502 38.703 20.495 489 HG22 THR 370 2HG2 THR 370 1.907 37.740 21.916 490 HG23 THR 370 3HG2 THR 370 1.308 36.947 20.457 491 H ASP 371 H ASP 371 2.564 39.922 22.103 492 HA ASP 371 HA ASP 371 3.892 40.762 24.413 493 HB2 ASP 371 2HB ASP 371 0.897 40.417 23.966 494 HB3 ASP 371 1HB ASP 371 1.645 41.447 25.185 495 H SER 372 H SER 372 3.131 37.606 23.792 496 HA SER 372 HA SER 372 3.370 35.712 24.971 497 HB2 SER 372 2HB SER 372 4.784 36.853 26.663 498 HB3 SER 372 1HB SER 372 3.342 37.340 27.552 499 HG SER 372 HG SER 372 2.944 35.217 28.055 500 H SER 373 H SER 373 0.873 37.999 25.817 501 HA SER 373 HA SER 373 -1.088 36.146 26.699 502 HB2 SER 373 2HB SER 373 -1.320 38.594 27.074 503 HB3 SER 373 1HB SER 373 -1.450 38.856 25.333 504 HG SER 373 HG SER 373 -3.231 37.179 26.770 505 H GLU 374 H GLU 374 -1.282 34.364 25.383 506 HA GLU 374 HA GLU 374 -2.039 34.773 22.549 507 HB2 GLU 374 2HB GLU 374 -1.367 32.215 22.405 508 HB3 GLU 374 1HB GLU 374 -0.132 33.455 22.353 509 HG2 GLU 374 2HG GLU 374 0.631 31.654 23.751 510 HG3 GLU 374 1HG GLU 374 0.362 33.085 24.738 511 H VAL 375 H VAL 375 -3.461 32.953 21.726 512 HA VAL 375 HA VAL 375 -5.959 33.227 23.046 513 HB VAL 375 HB VAL 375 -6.875 31.856 21.141 514 HG11 VAL 375 1HG1 VAL 375 -6.324 33.480 19.337 515 HG12 VAL 375 2HG1 VAL 375 -4.978 34.093 20.298 516 HG13 VAL 375 3HG1 VAL 375 -6.634 34.296 20.874 517 HG21 VAL 375 1HG2 VAL 375 -4.991 30.308 20.756 518 HG22 VAL 375 2HG2 VAL 375 -3.965 31.645 20.240 519 HG23 VAL 375 3HG2 VAL 375 -5.365 31.183 19.268 520 H VAL 376 H VAL 376 -6.969 31.937 24.466 521 HA VAL 376 HA VAL 376 -5.623 29.708 25.655 522 HB VAL 376 HB VAL 376 -7.695 29.540 27.127 523 HG11 VAL 376 1HG1 VAL 376 -6.407 32.293 26.940 524 HG12 VAL 376 2HG1 VAL 376 -5.764 30.899 27.813 525 HG13 VAL 376 3HG1 VAL 376 -7.269 31.649 28.344 526 HG21 VAL 376 1HG2 VAL 376 -8.632 31.990 25.563 527 HG22 VAL 376 2HG2 VAL 376 -9.370 31.385 27.051 528 HG23 VAL 376 3HG2 VAL 376 -9.415 30.407 25.582 529 H GLN 377 H GLN 377 -5.425 27.937 24.361 530 HA GLN 377 HA GLN 377 -7.767 26.861 22.915 531 HB2 GLN 377 2HB GLN 377 -4.844 26.016 22.693 532 HB3 GLN 377 1HB GLN 377 -6.169 25.483 21.659 533 HG2 GLN 377 2HG GLN 377 -5.060 28.308 21.833 534 HG3 GLN 377 1HG GLN 377 -4.751 27.142 20.545 535 HE21 GLN 377 1HE2 GLN 377 -7.084 29.341 21.926 536 HE22 GLN 377 2HE2 GLN 377 -8.182 29.326 20.594 537 H ALA 378 H ALA 378 -8.642 26.283 25.062 538 HA ALA 378 HA ALA 378 -7.464 24.105 26.569 539 HB1 ALA 378 1HB ALA 378 -8.746 25.861 27.724 540 HB2 ALA 378 2HB ALA 378 -9.489 24.282 27.981 541 HB3 ALA 378 3HB ALA 378 -10.199 25.416 26.827 542 H GLY 379 H GLY 379 -8.640 22.095 27.002 543 HA2 GLY 379 2HA GLY 379 -9.770 20.176 26.358 544 HA3 GLY 379 1HA GLY 379 -10.488 21.059 25.018 545 H GLU 380 H GLU 380 -7.072 21.105 25.527 546 HA GLU 380 HA GLU 380 -5.240 20.360 24.491 547 HB2 GLU 380 2HB GLU 380 -6.965 18.034 23.524 548 HB3 GLU 380 1HB GLU 380 -5.206 18.112 23.408 549 HG2 GLU 380 2HG GLU 380 -4.955 18.014 25.790 550 HG3 GLU 380 1HG GLU 380 -6.681 18.237 26.064 Start of MODEL 10 1 H1 SER 303 H SER 303 10.654 -1.646 9.950 2 HA SER 303 HA SER 303 12.074 0.003 11.911 3 HB2 SER 303 2HB SER 303 11.896 -2.524 12.080 4 HB3 SER 303 1HB SER 303 12.947 -2.638 10.672 5 HG SER 303 HG SER 303 13.532 -2.000 13.293 6 H GLY 304 H GLY 304 11.766 0.266 8.676 7 HA2 GLY 304 2HA GLY 304 14.555 0.523 7.842 8 HA3 GLY 304 1HA GLY 304 13.120 0.734 6.856 9 HA PRO 305 HA PRO 305 14.635 5.064 7.466 10 HB2 PRO 305 2HB PRO 305 14.027 6.006 5.014 11 HB3 PRO 305 1HB PRO 305 15.390 4.902 5.248 12 HG2 PRO 305 2HG PRO 305 12.586 4.273 4.313 13 HG3 PRO 305 1HG PRO 305 14.136 3.781 3.593 14 HD2 PRO 305 2HD PRO 305 12.698 2.148 5.259 15 HD3 PRO 305 1HD PRO 305 14.472 2.090 5.156 16 H SER 306 H SER 306 12.230 4.247 8.655 17 HA SER 306 HA SER 306 10.034 5.912 7.707 18 HB2 SER 306 2HB SER 306 10.101 3.968 10.059 19 HB3 SER 306 1HB SER 306 8.671 4.614 9.247 20 HG SER 306 HG SER 306 9.821 3.570 7.298 21 H CYS 307 H CYS 307 9.397 7.766 8.705 22 HA CYS 307 HA CYS 307 11.222 9.085 10.470 23 HB2 CYS 307 2HB CYS 307 9.765 10.125 8.602 24 HB3 CYS 307 1HB CYS 307 8.444 10.073 9.755 25 H ARG 308 H ARG 308 11.322 8.367 12.533 26 HA ARG 308 HA ARG 308 9.600 6.664 13.807 27 HB2 ARG 308 2HB ARG 308 11.644 8.536 15.051 28 HB3 ARG 308 1HB ARG 308 10.919 7.171 15.895 29 HG2 ARG 308 2HG ARG 308 12.461 6.804 13.307 30 HG3 ARG 308 1HG ARG 308 13.263 6.846 14.876 31 HD2 ARG 308 2HD ARG 308 12.866 4.525 14.167 32 HD3 ARG 308 1HD ARG 308 11.954 4.906 15.624 33 HE ARG 308 HE ARG 308 9.943 4.993 14.315 34 HH11 ARG 308 1HH1 ARG 308 12.666 3.611 12.578 35 HH12 ARG 308 2HH1 ARG 308 11.652 2.740 11.476 36 HH21 ARG 308 1HH2 ARG 308 8.644 3.893 12.841 37 HH22 ARG 308 2HH2 ARG 308 9.379 2.902 11.622 38 H PHE 309 H PHE 309 9.785 10.196 14.448 39 HA PHE 309 HA PHE 309 7.858 10.144 16.586 40 HB2 PHE 309 2HB PHE 309 9.042 12.444 14.992 41 HB3 PHE 309 1HB PHE 309 7.957 12.671 16.353 42 HD1 PHE 309 HD1 PHE 309 8.751 12.494 18.624 43 HD2 PHE 309 HD2 PHE 309 11.340 11.481 15.379 44 HE1 PHE 309 HE1 PHE 309 10.676 12.471 20.160 45 HE2 PHE 309 HE2 PHE 309 13.257 11.458 16.918 46 HZ PHE 309 HZ PHE 309 12.931 11.957 19.309 47 H CYS 310 H CYS 310 7.380 9.838 13.291 48 HA CYS 310 HA CYS 310 4.629 10.948 13.397 49 HB2 CYS 310 2HB CYS 310 6.337 10.894 10.877 50 HB3 CYS 310 1HB CYS 310 4.877 11.829 11.177 51 H LYS 311 H LYS 311 6.510 8.186 13.072 52 HA LYS 311 HA LYS 311 6.416 6.103 12.219 53 HB2 LYS 311 2HB LYS 311 3.475 6.711 11.660 54 HB3 LYS 311 1HB LYS 311 4.206 5.117 11.539 55 HG2 LYS 311 2HG LYS 311 4.501 4.942 13.882 56 HG3 LYS 311 1HG LYS 311 4.212 6.667 14.140 57 HD2 LYS 311 2HD LYS 311 2.127 4.670 13.157 58 HD3 LYS 311 1HD LYS 311 2.275 5.245 14.822 59 HE2 LYS 311 2HE LYS 311 1.795 7.544 14.097 60 HE3 LYS 311 1HE LYS 311 1.713 7.027 12.413 61 HZ1 LYS 311 1HZ LYS 311 -0.485 7.235 13.251 62 HZ2 LYS 311 2HZ LYS 311 -0.138 6.294 14.607 63 HZ3 LYS 311 3HZ LYS 311 -0.174 5.584 13.080 64 H ASP 312 H ASP 312 4.265 7.966 10.148 65 HA ASP 312 HA ASP 312 4.781 8.503 7.799 66 HB2 ASP 312 2HB ASP 312 6.475 6.593 7.544 67 HB3 ASP 312 1HB ASP 312 5.131 5.457 7.568 68 H ASP 313 H ASP 313 2.754 8.715 9.323 69 HA ASP 313 HA ASP 313 0.716 6.738 9.325 70 HB2 ASP 313 2HB ASP 313 1.026 8.415 11.130 71 HB3 ASP 313 1HB ASP 313 0.587 9.701 10.016 72 H GLU 314 H GLU 314 -1.305 6.749 8.300 73 HA GLU 314 HA GLU 314 -1.257 7.281 5.540 74 HB2 GLU 314 2HB GLU 314 -3.718 6.688 7.246 75 HB3 GLU 314 1HB GLU 314 -3.571 6.442 5.509 76 HG2 GLU 314 2HG GLU 314 -2.049 4.926 7.660 77 HG3 GLU 314 1HG GLU 314 -3.450 4.328 6.775 78 H ASN 315 H ASN 315 -2.651 9.092 8.235 79 HA ASN 315 HA ASN 315 -4.128 10.931 6.496 80 HB2 ASN 315 2HB ASN 315 -5.175 10.167 8.622 81 HB3 ASN 315 1HB ASN 315 -3.850 10.881 9.536 82 HD21 ASN 315 1HD2 ASN 315 -5.241 12.243 10.687 83 HD22 ASN 315 2HD2 ASN 315 -6.040 13.597 9.977 84 H LYS 316 H LYS 316 -1.420 11.067 8.844 85 HA LYS 316 HA LYS 316 -0.292 13.387 7.390 86 HB2 LYS 316 2HB LYS 316 -0.512 13.224 10.410 87 HB3 LYS 316 1HB LYS 316 0.440 14.427 9.553 88 HG2 LYS 316 2HG LYS 316 -2.573 14.120 9.366 89 HG3 LYS 316 1HG LYS 316 -1.730 15.306 10.367 90 HD2 LYS 316 2HD LYS 316 -0.830 16.417 8.383 91 HD3 LYS 316 1HD LYS 316 -1.480 15.154 7.331 92 HE2 LYS 316 2HE LYS 316 -3.119 17.097 8.996 93 HE3 LYS 316 1HE LYS 316 -2.887 17.162 7.246 94 HZ1 LYS 316 1HZ LYS 316 -3.934 14.927 7.142 95 HZ2 LYS 316 2HZ LYS 316 -4.975 16.139 7.692 96 HZ3 LYS 316 3HZ LYS 316 -4.294 15.055 8.794 97 HA PRO 317 HA PRO 317 3.003 10.167 7.764 98 HB2 PRO 317 2HB PRO 317 4.525 11.241 5.685 99 HB3 PRO 317 1HB PRO 317 3.242 10.047 5.472 100 HG2 PRO 317 2HG PRO 317 3.136 13.030 5.108 101 HG3 PRO 317 1HG PRO 317 2.405 11.750 4.118 102 HD2 PRO 317 2HD PRO 317 0.958 13.199 5.897 103 HD3 PRO 317 1HD PRO 317 0.588 11.493 5.583 104 H CYS 318 H CYS 318 3.081 13.651 7.865 105 HA CYS 318 HA CYS 318 4.993 13.534 10.051 106 HB2 CYS 318 2HB CYS 318 5.606 14.948 7.462 107 HB3 CYS 318 1HB CYS 318 6.194 15.618 8.980 108 H ARG 319 H ARG 319 3.582 14.323 11.557 109 HA ARG 319 HA ARG 319 2.107 16.793 11.185 110 HB2 ARG 319 2HB ARG 319 1.285 15.014 12.742 111 HB3 ARG 319 1HB ARG 319 2.736 15.202 13.723 112 HG2 ARG 319 2HG ARG 319 1.992 17.658 14.045 113 HG3 ARG 319 1HG ARG 319 0.440 17.153 13.379 114 HD2 ARG 319 2HD ARG 319 1.772 16.041 15.874 115 HD3 ARG 319 1HD ARG 319 0.398 17.149 15.838 116 HE ARG 319 HE ARG 319 -0.506 15.048 14.405 117 HH11 ARG 319 1HH1 ARG 319 0.926 15.232 17.612 118 HH12 ARG 319 2HH1 ARG 319 0.066 13.849 18.198 119 HH21 ARG 319 1HH2 ARG 319 -1.593 13.225 15.169 120 HH22 ARG 319 2HH2 ARG 319 -1.364 12.700 16.805 121 H LYS 320 H LYS 320 4.886 15.702 13.107 122 HA LYS 320 HA LYS 320 5.393 18.210 14.365 123 HB2 LYS 320 2HB LYS 320 7.099 15.693 14.270 124 HB3 LYS 320 1HB LYS 320 7.303 17.028 15.404 125 HG2 LYS 320 2HG LYS 320 5.167 16.544 16.454 126 HG3 LYS 320 1HG LYS 320 4.794 15.320 15.235 127 HD2 LYS 320 2HD LYS 320 6.729 13.969 16.021 128 HD3 LYS 320 1HD LYS 320 7.068 15.186 17.254 129 HE2 LYS 320 2HE LYS 320 4.475 13.613 17.076 130 HE3 LYS 320 1HE LYS 320 5.836 13.182 18.114 131 HZ1 LYS 320 1HZ LYS 320 5.595 15.240 19.289 132 HZ2 LYS 320 2HZ LYS 320 4.109 14.435 19.279 133 HZ3 LYS 320 3HZ LYS 320 4.361 15.755 18.255 134 H CYS 321 H CYS 321 6.570 16.777 11.416 135 HA CYS 321 HA CYS 321 8.899 18.587 11.262 136 HB2 CYS 321 2HB CYS 321 8.105 16.455 9.239 137 HB3 CYS 321 1HB CYS 321 9.674 17.237 9.423 138 H ALA 322 H ALA 322 5.691 18.756 10.594 139 HA ALA 322 HA ALA 322 5.930 20.270 8.066 140 HB1 ALA 322 1HB ALA 322 3.492 19.940 7.856 141 HB2 ALA 322 2HB ALA 322 3.459 19.093 9.406 142 HB3 ALA 322 3HB ALA 322 4.321 18.391 8.036 143 H CYS 323 H CYS 323 4.196 22.028 7.976 144 HA CYS 323 HA CYS 323 4.472 23.861 10.243 145 HB2 CYS 323 2HB CYS 323 4.920 24.922 8.180 146 HB3 CYS 323 1HB CYS 323 3.597 24.117 7.355 147 H HIS 324 H HIS 324 3.063 23.418 11.828 148 HA HIS 324 HA HIS 324 0.702 21.898 11.588 149 HB2 HIS 324 2HB HIS 324 1.705 23.667 13.861 150 HB3 HIS 324 1HB HIS 324 0.300 22.615 13.999 151 HD1 HIS 324 HD1 HIS 324 4.069 22.400 13.530 152 HD2 HIS 324 HD2 HIS 324 0.842 20.025 14.630 153 HE1 HIS 324 HE1 HIS 324 5.038 20.248 14.405 154 H VAL 325 H VAL 325 1.277 25.269 11.216 155 HA VAL 325 HA VAL 325 -1.183 26.345 12.045 156 HB VAL 325 HB VAL 325 0.618 27.578 9.912 157 HG11 VAL 325 1HG1 VAL 325 -1.177 28.878 12.002 158 HG12 VAL 325 2HG1 VAL 325 -1.510 28.768 10.274 159 HG13 VAL 325 3HG1 VAL 325 -0.154 29.739 10.846 160 HG21 VAL 325 1HG2 VAL 325 1.918 28.645 11.745 161 HG22 VAL 325 2HG2 VAL 325 2.064 26.888 11.776 162 HG23 VAL 325 3HG2 VAL 325 1.011 27.702 12.933 163 H CYS 326 H CYS 326 -0.152 24.918 8.989 164 HA CYS 326 HA CYS 326 -2.969 24.909 8.055 165 HB2 CYS 326 2HB CYS 326 -2.163 24.972 5.713 166 HB3 CYS 326 1HB CYS 326 -1.651 26.403 6.599 167 H GLY 327 H GLY 327 -0.838 23.060 9.485 168 HA2 GLY 327 2HA GLY 327 -0.519 20.835 9.811 169 HA3 GLY 327 1HA GLY 327 -2.053 20.611 8.995 170 H GLY 328 H GLY 328 0.840 21.977 7.436 171 HA2 GLY 328 2HA GLY 328 1.496 19.563 5.999 172 HA3 GLY 328 1HA GLY 328 0.507 20.660 5.044 173 H ARG 329 H ARG 329 2.522 20.436 3.707 174 HA ARG 329 HA ARG 329 4.659 22.344 4.473 175 HB2 ARG 329 2HB ARG 329 5.015 19.651 3.101 176 HB3 ARG 329 1HB ARG 329 6.294 20.837 3.338 177 HG2 ARG 329 2HG ARG 329 5.782 20.588 5.871 178 HG3 ARG 329 1HG ARG 329 4.892 19.137 5.409 179 HD2 ARG 329 2HD ARG 329 7.145 18.535 6.095 180 HD3 ARG 329 1HD ARG 329 6.951 18.230 4.366 181 HE ARG 329 HE ARG 329 8.040 20.820 4.794 182 HH11 ARG 329 1HH1 ARG 329 8.985 17.437 4.858 183 HH12 ARG 329 2HH1 ARG 329 10.661 17.776 4.583 184 HH21 ARG 329 1HH2 ARG 329 10.256 21.243 4.441 185 HH22 ARG 329 2HH2 ARG 329 11.376 19.926 4.332 186 H GLU 330 H GLU 330 2.194 22.365 2.705 187 HA GLU 330 HA GLU 330 2.613 22.742 0.043 188 HB2 GLU 330 2HB GLU 330 0.918 24.677 0.291 189 HB3 GLU 330 1HB GLU 330 0.425 23.104 0.922 190 HG2 GLU 330 2HG GLU 330 1.021 23.792 3.185 191 HG3 GLU 330 1HG GLU 330 1.584 25.346 2.596 192 H ALA 331 H ALA 331 4.145 23.790 -1.031 193 HA ALA 331 HA ALA 331 5.860 25.118 -1.646 194 HB1 ALA 331 1HB ALA 331 5.874 27.492 -1.047 195 HB2 ALA 331 2HB ALA 331 4.708 27.187 0.247 196 HB3 ALA 331 3HB ALA 331 4.232 26.972 -1.438 197 HA PRO 332 HA PRO 332 8.150 23.586 2.050 198 HB2 PRO 332 2HB PRO 332 10.199 22.350 0.729 199 HB3 PRO 332 1HB PRO 332 8.584 21.636 0.854 200 HG2 PRO 332 2HG PRO 332 9.793 23.195 -1.428 201 HG3 PRO 332 1HG PRO 332 8.875 21.673 -1.475 202 HD2 PRO 332 2HD PRO 332 7.727 24.091 -2.020 203 HD3 PRO 332 1HD PRO 332 6.822 22.756 -1.276 204 H GLU 333 H GLU 333 9.466 25.527 -0.603 205 HA GLU 333 HA GLU 333 11.812 26.370 0.890 206 HB2 GLU 333 2HB GLU 333 12.054 28.016 -1.123 207 HB3 GLU 333 1HB GLU 333 12.301 26.301 -1.383 208 HG2 GLU 333 2HG GLU 333 11.061 27.349 -3.203 209 HG3 GLU 333 1HG GLU 333 10.147 26.071 -2.421 210 H LYS 334 H LYS 334 8.542 27.369 0.798 211 HA LYS 334 HA LYS 334 9.096 30.031 1.844 212 HB2 LYS 334 2HB LYS 334 6.472 28.535 1.472 213 HB3 LYS 334 1HB LYS 334 6.577 30.147 2.179 214 HG2 LYS 334 2HG LYS 334 7.605 30.972 0.056 215 HG3 LYS 334 1HG LYS 334 7.373 29.365 -0.644 216 HD2 LYS 334 2HD LYS 334 4.908 29.604 -0.242 217 HD3 LYS 334 1HD LYS 334 5.196 31.249 0.333 218 HE2 LYS 334 2HE LYS 334 6.103 31.847 -1.897 219 HE3 LYS 334 1HE LYS 334 5.771 30.206 -2.464 220 HZ1 LYS 334 1HZ LYS 334 4.020 31.746 -3.097 221 HZ2 LYS 334 2HZ LYS 334 3.740 32.134 -1.476 222 HZ3 LYS 334 3HZ LYS 334 3.427 30.572 -2.038 223 H GLN 335 H GLN 335 9.291 26.982 3.149 224 HA GLN 335 HA GLN 335 7.925 27.347 5.621 225 HB2 GLN 335 2HB GLN 335 9.965 25.271 4.782 226 HB3 GLN 335 1HB GLN 335 9.276 25.312 6.402 227 HG2 GLN 335 2HG GLN 335 6.975 25.320 4.980 228 HG3 GLN 335 1HG GLN 335 8.016 24.525 3.804 229 HE21 GLN 335 1HE2 GLN 335 9.661 23.072 5.696 230 HE22 GLN 335 2HE2 GLN 335 8.662 21.857 6.412 231 H LEU 336 H LEU 336 8.468 28.853 6.977 232 HA LEU 336 HA LEU 336 11.255 29.544 7.581 233 HB2 LEU 336 2HB LEU 336 8.591 30.727 8.445 234 HB3 LEU 336 1HB LEU 336 10.132 31.275 9.091 235 HG LEU 336 HG LEU 336 9.372 31.403 6.151 236 HD11 LEU 336 1HD1 LEU 336 9.381 33.620 8.230 237 HD12 LEU 336 2HD1 LEU 336 7.953 32.916 7.466 238 HD13 LEU 336 3HD1 LEU 336 9.103 33.832 6.498 239 HD21 LEU 336 1HD2 LEU 336 11.744 32.607 7.628 240 HD22 LEU 336 2HD2 LEU 336 11.348 32.875 5.929 241 HD23 LEU 336 3HD2 LEU 336 11.806 31.266 6.478 242 H LEU 337 H LEU 337 12.148 28.029 8.851 243 HA LEU 337 HA LEU 337 10.676 26.776 11.051 244 HB2 LEU 337 2HB LEU 337 13.454 26.302 9.913 245 HB3 LEU 337 1HB LEU 337 12.943 25.584 11.430 246 HG LEU 337 HG LEU 337 11.034 24.477 10.167 247 HD11 LEU 337 1HD1 LEU 337 11.217 24.226 7.737 248 HD12 LEU 337 2HD1 LEU 337 12.576 25.350 7.710 249 HD13 LEU 337 3HD1 LEU 337 10.972 25.913 8.184 250 HD21 LEU 337 1HD2 LEU 337 12.439 22.659 9.285 251 HD22 LEU 337 2HD2 LEU 337 13.029 23.225 10.844 252 HD23 LEU 337 3HD2 LEU 337 13.859 23.707 9.362 253 H CYS 338 H CYS 338 10.387 28.171 12.656 254 HA CYS 338 HA CYS 338 12.046 30.251 13.543 255 HB2 CYS 338 2HB CYS 338 9.582 29.898 14.051 256 HB3 CYS 338 1HB CYS 338 10.073 28.696 15.256 257 H ASP 339 H ASP 339 13.983 30.141 14.535 258 HA ASP 339 HA ASP 339 15.447 27.825 14.713 259 HB2 ASP 339 2HB ASP 339 15.976 30.422 16.222 260 HB3 ASP 339 1HB ASP 339 17.176 29.183 15.873 261 H GLU 340 H GLU 340 14.186 29.662 17.465 262 HA GLU 340 HA GLU 340 15.191 27.848 19.443 263 HB2 GLU 340 2HB GLU 340 14.566 29.505 21.020 264 HB3 GLU 340 1HB GLU 340 15.019 30.398 19.583 265 HG2 GLU 340 2HG GLU 340 12.283 29.981 20.739 266 HG3 GLU 340 1HG GLU 340 13.134 31.495 20.484 267 H CYS 341 H CYS 341 12.171 28.198 17.787 268 HA CYS 341 HA CYS 341 10.570 26.568 19.601 269 HB2 CYS 341 2HB CYS 341 10.015 27.746 16.854 270 HB3 CYS 341 1HB CYS 341 8.913 26.595 17.594 271 H ASP 342 H ASP 342 12.648 26.049 16.851 272 HA ASP 342 HA ASP 342 13.032 24.422 15.354 273 HB2 ASP 342 2HB ASP 342 12.277 22.709 17.762 274 HB3 ASP 342 1HB ASP 342 12.848 21.987 16.264 275 H MET 343 H MET 343 10.623 25.643 14.979 276 HA MET 343 HA MET 343 8.731 23.492 14.197 277 HB2 MET 343 2HB MET 343 7.966 24.731 16.247 278 HB3 MET 343 1HB MET 343 7.977 26.228 15.324 279 HG2 MET 343 2HG MET 343 5.711 25.261 15.563 280 HG3 MET 343 1HG MET 343 6.212 25.411 13.878 281 HE1 MET 343 1HE MET 343 6.228 21.369 16.146 282 HE2 MET 343 2HE MET 343 5.819 22.903 16.917 283 HE3 MET 343 3HE MET 343 7.475 22.593 16.386 284 H ALA 344 H ALA 344 8.053 23.556 12.152 285 HA ALA 344 HA ALA 344 9.008 25.552 10.298 286 HB1 ALA 344 1HB ALA 344 7.956 24.140 8.574 287 HB2 ALA 344 2HB ALA 344 7.199 23.152 9.827 288 HB3 ALA 344 3HB ALA 344 8.955 23.178 9.667 289 H PHE 345 H PHE 345 7.887 27.145 9.349 290 HA PHE 345 HA PHE 345 4.952 27.407 9.692 291 HB2 PHE 345 2HB PHE 345 7.043 29.627 9.986 292 HB3 PHE 345 1HB PHE 345 5.312 29.920 9.860 293 HD1 PHE 345 HD1 PHE 345 3.815 29.439 11.744 294 HD2 PHE 345 HD2 PHE 345 8.009 28.661 12.062 295 HE1 PHE 345 HE1 PHE 345 3.588 29.177 14.184 296 HE2 PHE 345 HE2 PHE 345 7.768 28.397 14.494 297 HZ PHE 345 HZ PHE 345 5.562 28.652 15.559 298 H HIS 346 H HIS 346 4.362 29.430 8.039 299 HA HIS 346 HA HIS 346 6.064 29.351 5.618 300 HB2 HIS 346 2HB HIS 346 3.029 29.077 5.644 301 HB3 HIS 346 1HB HIS 346 3.915 29.574 4.211 302 HD2 HIS 346 HD2 HIS 346 6.026 27.532 3.599 303 HE1 HIS 346 HE1 HIS 346 3.296 24.495 4.658 304 HE2 HIS 346 HE2 HIS 346 5.268 25.099 3.201 305 H LEU 347 H LEU 347 5.734 31.274 4.243 306 HA LEU 347 HA LEU 347 6.002 33.705 5.539 307 HB2 LEU 347 2HB LEU 347 4.990 33.199 2.709 308 HB3 LEU 347 1HB LEU 347 5.601 34.740 3.295 309 HG LEU 347 HG LEU 347 7.230 32.187 2.963 310 HD11 LEU 347 1HD1 LEU 347 6.674 33.227 0.812 311 HD12 LEU 347 2HD1 LEU 347 8.391 33.392 1.162 312 HD13 LEU 347 3HD1 LEU 347 7.314 34.775 1.374 313 HD21 LEU 347 1HD2 LEU 347 8.070 33.470 4.865 314 HD22 LEU 347 2HD2 LEU 347 8.146 34.932 3.883 315 HD23 LEU 347 3HD2 LEU 347 9.200 33.563 3.518 316 H TYR 348 H TYR 348 3.091 32.372 4.013 317 HA TYR 348 HA TYR 348 1.390 34.594 4.758 318 HB2 TYR 348 2HB TYR 348 -0.423 33.007 3.692 319 HB3 TYR 348 1HB TYR 348 0.784 33.766 2.663 320 HD1 TYR 348 HD1 TYR 348 -0.046 30.520 4.372 321 HD2 TYR 348 HD2 TYR 348 2.241 32.432 1.302 322 HE1 TYR 348 HE1 TYR 348 0.633 28.322 3.493 323 HE2 TYR 348 HE2 TYR 348 2.903 30.231 0.427 324 HH TYR 348 HH TYR 348 1.417 27.318 1.417 325 H CYS 349 H CYS 349 2.381 31.776 6.361 326 HA CYS 349 HA CYS 349 -0.093 31.360 7.899 327 HB2 CYS 349 2HB CYS 349 2.573 29.882 7.967 328 HB3 CYS 349 1HB CYS 349 1.145 29.434 8.895 329 H LEU 350 H LEU 350 1.434 33.873 8.209 330 HA LEU 350 HA LEU 350 2.291 33.722 11.050 331 HB2 LEU 350 2HB LEU 350 3.358 35.629 8.927 332 HB3 LEU 350 1HB LEU 350 3.921 35.493 10.586 333 HG LEU 350 HG LEU 350 4.225 33.362 8.443 334 HD11 LEU 350 1HD1 LEU 350 6.309 35.229 9.606 335 HD12 LEU 350 2HD1 LEU 350 5.634 35.299 7.975 336 HD13 LEU 350 3HD1 LEU 350 6.610 33.916 8.463 337 HD21 LEU 350 1HD2 LEU 350 5.675 32.187 10.043 338 HD22 LEU 350 2HD2 LEU 350 4.041 32.354 10.678 339 HD23 LEU 350 3HD2 LEU 350 5.329 33.405 11.274 340 H LYS 351 H LYS 351 2.280 36.009 12.027 341 HA LYS 351 HA LYS 351 0.196 37.819 11.057 342 HB2 LYS 351 2HB LYS 351 -0.859 36.070 12.624 343 HB3 LYS 351 1HB LYS 351 0.114 36.747 13.916 344 HG2 LYS 351 2HG LYS 351 -1.878 38.407 12.334 345 HG3 LYS 351 1HG LYS 351 -2.347 37.482 13.758 346 HD2 LYS 351 2HD LYS 351 -0.341 39.780 13.677 347 HD3 LYS 351 1HD LYS 351 -1.975 39.835 14.346 348 HE2 LYS 351 2HE LYS 351 0.337 38.158 15.393 349 HE3 LYS 351 1HE LYS 351 -0.306 39.618 16.139 350 HZ1 LYS 351 1HZ LYS 351 -1.066 37.489 17.128 351 HZ2 LYS 351 2HZ LYS 351 -1.921 37.169 15.709 352 HZ3 LYS 351 3HZ LYS 351 -2.316 38.519 16.650 353 HA PRO 352 HA PRO 352 0.543 39.559 10.203 354 HB2 PRO 352 2HB PRO 352 2.085 41.472 9.056 355 HB3 PRO 352 1HB PRO 352 1.011 41.832 10.417 356 HG2 PRO 352 2HG PRO 352 3.982 41.334 10.425 357 HG3 PRO 352 1HG PRO 352 3.052 42.587 11.278 358 HD2 PRO 352 2HD PRO 352 3.909 40.246 12.459 359 HD3 PRO 352 1HD PRO 352 2.489 41.153 13.010 360 HA PRO 353 HA PRO 353 2.769 36.634 7.614 361 HB2 PRO 353 2HB PRO 353 1.515 37.083 5.191 362 HB3 PRO 353 1HB PRO 353 0.775 36.186 6.524 363 HG2 PRO 353 2HG PRO 353 0.424 39.087 5.770 364 HG3 PRO 353 1HG PRO 353 -0.818 37.878 6.172 365 HD2 PRO 353 2HD PRO 353 0.009 39.667 8.000 366 HD3 PRO 353 1HD PRO 353 -0.367 37.996 8.476 367 H LEU 354 H LEU 354 4.690 36.681 6.578 368 HA LEU 354 HA LEU 354 5.834 39.173 5.619 369 HB2 LEU 354 2HB LEU 354 6.957 36.344 5.731 370 HB3 LEU 354 1HB LEU 354 7.868 37.740 5.174 371 HG LEU 354 HG LEU 354 6.807 37.313 7.995 372 HD11 LEU 354 1HD1 LEU 354 8.741 35.888 7.478 373 HD12 LEU 354 2HD1 LEU 354 9.170 37.131 8.649 374 HD13 LEU 354 3HD1 LEU 354 9.663 37.303 6.962 375 HD21 LEU 354 1HD2 LEU 354 8.043 39.364 8.614 376 HD22 LEU 354 2HD2 LEU 354 6.754 39.704 7.464 377 HD23 LEU 354 3HD2 LEU 354 8.430 39.645 6.912 378 H THR 355 H THR 355 6.307 39.683 3.519 379 HA THR 355 HA THR 355 4.838 38.343 1.393 380 HB THR 355 HB THR 355 4.923 40.806 1.436 381 HG1 THR 355 HG1 THR 355 6.395 39.895 -0.832 382 HG21 THR 355 1HG2 THR 355 7.174 41.147 2.406 383 HG22 THR 355 2HG2 THR 355 6.988 42.057 0.907 384 HG23 THR 355 3HG2 THR 355 7.912 40.554 0.912 385 H SER 356 H SER 356 8.010 38.249 2.697 386 HA SER 356 HA SER 356 8.961 36.267 0.830 387 HB2 SER 356 2HB SER 356 9.424 38.454 -0.361 388 HB3 SER 356 1HB SER 356 10.442 38.944 0.991 389 HG SER 356 HG SER 356 10.829 36.741 -0.761 390 H VAL 357 H VAL 357 11.257 35.631 1.443 391 HA VAL 357 HA VAL 357 11.635 35.151 4.191 392 HB VAL 357 HB VAL 357 12.659 33.711 2.491 393 HG11 VAL 357 1HG1 VAL 357 14.413 36.073 1.694 394 HG12 VAL 357 2HG1 VAL 357 13.113 35.370 0.731 395 HG13 VAL 357 3HG1 VAL 357 14.560 34.425 1.077 396 HG21 VAL 357 1HG2 VAL 357 13.794 33.770 4.676 397 HG22 VAL 357 2HG2 VAL 357 14.834 35.084 4.121 398 HG23 VAL 357 3HG2 VAL 357 14.958 33.485 3.380 399 HA PRO 358 HA PRO 358 13.333 39.208 5.379 400 HB2 PRO 358 2HB PRO 358 14.369 38.554 7.843 401 HB3 PRO 358 1HB PRO 358 12.639 38.790 7.559 402 HG2 PRO 358 2HG PRO 358 14.210 36.214 7.663 403 HG3 PRO 358 1HG PRO 358 12.657 36.607 8.430 404 HD2 PRO 358 2HD PRO 358 12.776 35.195 6.125 405 HD3 PRO 358 1HD PRO 358 11.457 36.348 6.435 406 HA PRO 359 HA PRO 359 17.761 38.677 4.291 407 HB2 PRO 359 2HB PRO 359 18.505 41.271 4.218 408 HB3 PRO 359 1HB PRO 359 17.382 40.616 3.014 409 HG2 PRO 359 2HG PRO 359 16.766 42.193 5.516 410 HG3 PRO 359 1HG PRO 359 16.137 42.426 3.870 411 HD2 PRO 359 2HD PRO 359 14.761 41.069 5.833 412 HD3 PRO 359 1HD PRO 359 14.568 40.726 4.098 413 H GLU 360 H GLU 360 16.552 39.113 7.221 414 HA GLU 360 HA GLU 360 18.694 40.107 8.828 415 HB2 GLU 360 2HB GLU 360 16.322 38.342 9.594 416 HB3 GLU 360 1HB GLU 360 17.297 39.312 10.698 417 HG2 GLU 360 2HG GLU 360 16.488 41.371 9.559 418 HG3 GLU 360 1HG GLU 360 15.482 40.374 8.509 419 HA PRO 361 HA PRO 361 20.976 36.178 9.269 420 HB2 PRO 361 2HB PRO 361 22.377 36.575 11.532 421 HB3 PRO 361 1HB PRO 361 22.631 37.627 10.128 422 HG2 PRO 361 2HG PRO 361 20.957 38.126 12.595 423 HG3 PRO 361 1HG PRO 361 22.132 39.206 11.811 424 HD2 PRO 361 2HD PRO 361 19.406 39.347 11.390 425 HD3 PRO 361 1HD PRO 361 20.609 39.886 10.199 426 H GLU 362 H GLU 362 18.241 36.768 10.960 427 HA GLU 362 HA GLU 362 17.939 34.179 12.167 428 HB2 GLU 362 2HB GLU 362 17.623 35.035 14.522 429 HB3 GLU 362 1HB GLU 362 19.278 35.193 13.945 430 HG2 GLU 362 2HG GLU 362 18.586 37.633 13.311 431 HG3 GLU 362 1HG GLU 362 17.227 37.364 14.398 432 H TRP 363 H TRP 363 15.737 33.831 12.924 433 HA TRP 363 HA TRP 363 13.770 35.957 12.541 434 HB2 TRP 363 2HB TRP 363 13.897 34.949 10.278 435 HB3 TRP 363 1HB TRP 363 13.617 33.347 10.947 436 HD1 TRP 363 HD1 TRP 363 11.763 36.666 10.262 437 HE1 TRP 363 HE1 TRP 363 9.233 36.227 10.294 438 HE3 TRP 363 HE3 TRP 363 11.773 31.773 11.792 439 HZ2 TRP 363 HZ2 TRP 363 7.483 34.117 10.887 440 HZ3 TRP 363 HZ3 TRP 363 9.618 30.624 12.073 441 HH2 TRP 363 HH2 TRP 363 7.512 31.774 11.633 442 H TYR 364 H TYR 364 11.977 35.714 13.748 443 HA TYR 364 HA TYR 364 11.592 33.286 15.395 444 HB2 TYR 364 2HB TYR 364 11.401 36.148 16.473 445 HB3 TYR 364 1HB TYR 364 11.227 34.658 17.397 446 HD1 TYR 364 HD1 TYR 364 13.656 36.985 15.845 447 HD2 TYR 364 HD2 TYR 364 13.245 33.307 17.994 448 HE1 TYR 364 HE1 TYR 364 16.077 36.966 16.301 449 HE2 TYR 364 HE2 TYR 364 15.652 33.294 18.438 450 HH TYR 364 HH TYR 364 17.680 36.014 17.775 451 H CYS 365 H CYS 365 9.374 32.901 15.925 452 HA CYS 365 HA CYS 365 7.567 33.767 13.832 453 HB2 CYS 365 2HB CYS 365 6.054 32.029 14.665 454 HB3 CYS 365 1HB CYS 365 7.695 31.387 14.554 455 HA PRO 366 HA PRO 366 4.771 36.683 16.000 456 HB2 PRO 366 2HB PRO 366 2.339 35.197 15.644 457 HB3 PRO 366 1HB PRO 366 2.960 36.483 14.606 458 HG2 PRO 366 2HG PRO 366 3.258 33.505 14.314 459 HG3 PRO 366 1HG PRO 366 2.998 34.741 13.060 460 HD2 PRO 366 2HD PRO 366 5.409 33.697 13.377 461 HD3 PRO 366 1HD PRO 366 5.254 35.450 13.128 462 H SER 367 H SER 367 4.380 33.194 16.674 463 HA SER 367 HA SER 367 3.069 33.311 19.138 464 HB2 SER 367 2HB SER 367 5.102 31.188 18.349 465 HB3 SER 367 1HB SER 367 3.692 30.992 19.392 466 HG SER 367 HG SER 367 2.388 31.025 17.648 467 H CYS 368 H CYS 368 6.462 33.833 18.399 468 HA CYS 368 HA CYS 368 7.487 33.505 21.071 469 HB2 CYS 368 2HB CYS 368 8.649 34.384 18.436 470 HB3 CYS 368 1HB CYS 368 9.529 34.774 19.905 471 H ARG 369 H ARG 369 6.780 36.341 18.997 472 HA ARG 369 HA ARG 369 7.444 38.279 21.031 473 HB2 ARG 369 2HB ARG 369 6.676 39.951 19.405 474 HB3 ARG 369 1HB ARG 369 7.725 38.771 18.629 475 HG2 ARG 369 2HG ARG 369 5.557 37.597 17.863 476 HG3 ARG 369 1HG ARG 369 4.725 39.070 18.361 477 HD2 ARG 369 2HD ARG 369 6.903 38.853 16.252 478 HD3 ARG 369 1HD ARG 369 5.181 39.101 15.955 479 HE ARG 369 HE ARG 369 5.919 41.207 17.554 480 HH11 ARG 369 1HH1 ARG 369 7.017 39.993 14.452 481 HH12 ARG 369 2HH1 ARG 369 7.501 41.551 13.872 482 HH21 ARG 369 1HH2 ARG 369 6.566 43.263 16.777 483 HH22 ARG 369 2HH2 ARG 369 7.248 43.401 15.189 484 H THR 370 H THR 370 4.639 36.467 20.235 485 HA THR 370 HA THR 370 2.706 38.091 21.625 486 HB THR 370 HB THR 370 2.636 35.199 20.643 487 HG1 THR 370 HG1 THR 370 2.638 37.142 19.164 488 HG21 THR 370 1HG2 THR 370 0.187 35.270 20.931 489 HG22 THR 370 2HG2 THR 370 0.318 36.845 21.717 490 HG23 THR 370 3HG2 THR 370 1.013 35.414 22.482 491 H ASP 371 H ASP 371 1.891 37.724 23.710 492 HA ASP 371 HA ASP 371 3.680 36.772 25.731 493 HB2 ASP 371 2HB ASP 371 2.141 38.741 25.955 494 HB3 ASP 371 1HB ASP 371 0.760 37.652 25.921 495 H SER 372 H SER 372 1.710 35.055 23.727 496 HA SER 372 HA SER 372 1.143 32.936 23.474 497 HB2 SER 372 2HB SER 372 3.262 32.311 24.572 498 HB3 SER 372 1HB SER 372 2.482 32.395 26.154 499 HG SER 372 HG SER 372 1.230 30.662 25.627 500 H SER 373 H SER 373 -1.003 33.551 23.492 501 HA SER 373 HA SER 373 -2.604 33.088 25.909 502 HB2 SER 373 2HB SER 373 -4.488 33.915 24.373 503 HB3 SER 373 1HB SER 373 -3.224 35.085 24.743 504 HG SER 373 HG SER 373 -3.370 35.257 22.609 505 H GLU 374 H GLU 374 -1.258 31.168 23.716 506 HA GLU 374 HA GLU 374 -3.374 29.221 23.310 507 HB2 GLU 374 2HB GLU 374 -0.366 29.202 22.832 508 HB3 GLU 374 1HB GLU 374 -1.400 27.824 22.459 509 HG2 GLU 374 2HG GLU 374 -1.671 30.586 21.222 510 HG3 GLU 374 1HG GLU 374 -0.824 29.230 20.483 511 H VAL 375 H VAL 375 -3.332 27.076 24.260 512 HA VAL 375 HA VAL 375 -2.530 27.002 27.044 513 HB VAL 375 HB VAL 375 -4.680 25.964 26.381 514 HG11 VAL 375 1HG1 VAL 375 -4.789 23.842 25.115 515 HG12 VAL 375 2HG1 VAL 375 -3.053 23.934 24.808 516 HG13 VAL 375 3HG1 VAL 375 -4.135 25.156 24.136 517 HG21 VAL 375 1HG2 VAL 375 -3.580 25.104 28.409 518 HG22 VAL 375 2HG2 VAL 375 -2.718 23.894 27.458 519 HG23 VAL 375 3HG2 VAL 375 -4.476 23.812 27.606 520 H VAL 376 H VAL 376 -0.830 25.876 27.943 521 HA VAL 376 HA VAL 376 1.389 25.050 26.390 522 HB VAL 376 HB VAL 376 2.298 24.071 28.564 523 HG11 VAL 376 1HG1 VAL 376 1.314 26.946 28.667 524 HG12 VAL 376 2HG1 VAL 376 2.796 26.375 27.899 525 HG13 VAL 376 3HG1 VAL 376 2.617 26.270 29.650 526 HG21 VAL 376 1HG2 VAL 376 0.163 23.458 29.655 527 HG22 VAL 376 2HG2 VAL 376 -0.291 25.159 29.761 528 HG23 VAL 376 3HG2 VAL 376 1.090 24.554 30.680 529 H GLN 377 H GLN 377 1.748 23.241 25.358 530 HA GLN 377 HA GLN 377 -0.030 20.913 25.625 531 HB2 GLN 377 2HB GLN 377 1.012 20.206 23.448 532 HB3 GLN 377 1HB GLN 377 0.217 21.773 23.363 533 HG2 GLN 377 2HG GLN 377 2.420 22.895 23.552 534 HG3 GLN 377 1HG GLN 377 3.209 21.319 23.612 535 HE21 GLN 377 1HE2 GLN 377 4.424 21.768 21.763 536 HE22 GLN 377 2HE2 GLN 377 3.729 21.810 20.178 537 H ALA 378 H ALA 378 1.036 18.726 25.417 538 HA ALA 378 HA ALA 378 2.893 18.308 27.533 539 HB1 ALA 378 1HB ALA 378 1.957 16.352 25.398 540 HB2 ALA 378 2HB ALA 378 1.150 16.659 26.938 541 HB3 ALA 378 3HB ALA 378 2.755 15.927 26.914 542 H GLY 379 H GLY 379 5.061 17.758 27.515 543 HA2 GLY 379 2HA GLY 379 7.153 17.166 26.757 544 HA3 GLY 379 1HA GLY 379 6.497 16.976 25.141 545 H GLU 380 H GLU 380 6.437 19.906 27.159 546 HA GLU 380 HA GLU 380 7.936 21.402 25.131 547 HB2 GLU 380 2HB GLU 380 6.523 22.329 27.670 548 HB3 GLU 380 1HB GLU 380 7.388 23.400 26.571 549 HG2 GLU 380 2HG GLU 380 4.919 21.761 25.930 550 HG3 GLU 380 1HG GLU 380 4.996 23.510 26.156 Start of MODEL 11 1 H1 SER 303 H SER 303 7.310 4.648 -3.979 2 HA SER 303 HA SER 303 9.834 3.675 -4.827 3 HB2 SER 303 2HB SER 303 8.246 4.819 -6.362 4 HB3 SER 303 1HB SER 303 8.461 6.328 -5.479 5 HG SER 303 HG SER 303 10.430 4.916 -6.967 6 H GLY 304 H GLY 304 8.837 6.588 -3.060 7 HA2 GLY 304 2HA GLY 304 11.568 7.413 -2.443 8 HA3 GLY 304 1HA GLY 304 10.082 8.251 -2.015 9 HA PRO 305 HA PRO 305 11.873 5.750 1.651 10 HB2 PRO 305 2HB PRO 305 12.981 7.701 3.152 11 HB3 PRO 305 1HB PRO 305 13.837 7.022 1.761 12 HG2 PRO 305 2HG PRO 305 12.233 9.578 1.928 13 HG3 PRO 305 1HG PRO 305 13.848 9.322 1.232 14 HD2 PRO 305 2HD PRO 305 11.573 9.392 -0.287 15 HD3 PRO 305 1HD PRO 305 12.996 8.426 -0.737 16 H SER 306 H SER 306 11.205 5.826 3.940 17 HA SER 306 HA SER 306 8.594 6.857 4.460 18 HB2 SER 306 2HB SER 306 10.659 5.779 6.441 19 HB3 SER 306 1HB SER 306 8.932 5.966 6.740 20 HG SER 306 HG SER 306 8.690 4.487 4.861 21 H CYS 307 H CYS 307 8.106 8.870 5.018 22 HA CYS 307 HA CYS 307 10.088 10.892 5.519 23 HB2 CYS 307 2HB CYS 307 7.899 11.146 4.243 24 HB3 CYS 307 1HB CYS 307 7.067 11.072 5.778 25 H ARG 308 H ARG 308 11.140 10.696 7.456 26 HA ARG 308 HA ARG 308 10.295 8.967 9.474 27 HB2 ARG 308 2HB ARG 308 12.375 9.668 10.679 28 HB3 ARG 308 1HB ARG 308 12.636 9.236 8.993 29 HG2 ARG 308 2HG ARG 308 12.872 11.558 8.357 30 HG3 ARG 308 1HG ARG 308 12.381 12.102 9.960 31 HD2 ARG 308 2HD ARG 308 14.908 10.533 9.342 32 HD3 ARG 308 1HD ARG 308 14.821 12.280 9.616 33 HE ARG 308 HE ARG 308 13.668 10.866 11.801 34 HH11 ARG 308 1HH1 ARG 308 16.814 11.607 10.439 35 HH12 ARG 308 2HH1 ARG 308 17.612 11.552 11.977 36 HH21 ARG 308 1HH2 ARG 308 14.740 10.775 13.801 37 HH22 ARG 308 2HH2 ARG 308 16.448 11.069 13.871 38 H PHE 309 H PHE 309 10.426 12.529 9.608 39 HA PHE 309 HA PHE 309 10.141 12.689 12.442 40 HB2 PHE 309 2HB PHE 309 10.816 14.482 10.283 41 HB3 PHE 309 1HB PHE 309 9.546 15.246 11.220 42 HD1 PHE 309 HD1 PHE 309 12.995 13.845 11.402 43 HD2 PHE 309 HD2 PHE 309 9.986 16.134 13.408 44 HE1 PHE 309 HE1 PHE 309 14.651 14.562 13.083 45 HE2 PHE 309 HE2 PHE 309 11.639 16.847 15.072 46 HZ PHE 309 HZ PHE 309 13.975 16.065 14.920 47 H CYS 310 H CYS 310 7.861 12.059 10.176 48 HA CYS 310 HA CYS 310 5.624 12.792 11.983 49 HB2 CYS 310 2HB CYS 310 4.267 13.273 9.984 50 HB3 CYS 310 1HB CYS 310 5.717 14.275 9.951 51 H LYS 311 H LYS 311 7.313 10.437 10.155 52 HA LYS 311 HA LYS 311 7.162 8.301 9.616 53 HB2 LYS 311 2HB LYS 311 4.685 8.238 11.363 54 HB3 LYS 311 1HB LYS 311 5.337 6.816 10.558 55 HG2 LYS 311 2HG LYS 311 7.490 7.184 11.802 56 HG3 LYS 311 1HG LYS 311 6.691 8.476 12.704 57 HD2 LYS 311 2HD LYS 311 5.831 5.550 12.644 58 HD3 LYS 311 1HD LYS 311 6.697 6.335 13.965 59 HE2 LYS 311 2HE LYS 311 3.894 7.035 13.013 60 HE3 LYS 311 1HE LYS 311 4.300 6.128 14.469 61 HZ1 LYS 311 1HZ LYS 311 5.022 8.955 13.917 62 HZ2 LYS 311 2HZ LYS 311 5.458 8.092 15.307 63 HZ3 LYS 311 3HZ LYS 311 3.828 8.420 14.989 64 H ASP 312 H ASP 312 4.252 10.189 9.035 65 HA ASP 312 HA ASP 312 2.584 10.153 7.577 66 HB2 ASP 312 2HB ASP 312 4.770 9.027 5.812 67 HB3 ASP 312 1HB ASP 312 3.125 9.189 5.199 68 H ASP 313 H ASP 313 1.175 9.010 8.631 69 HA ASP 313 HA ASP 313 1.130 6.151 8.833 70 HB2 ASP 313 2HB ASP 313 0.306 7.622 10.640 71 HB3 ASP 313 1HB ASP 313 -0.928 8.277 9.568 72 H GLU 314 H GLU 314 -0.720 4.828 8.139 73 HA GLU 314 HA GLU 314 -1.216 4.971 5.357 74 HB2 GLU 314 2HB GLU 314 -2.445 3.245 7.542 75 HB3 GLU 314 1HB GLU 314 -2.736 2.997 5.823 76 HG2 GLU 314 2HG GLU 314 -0.054 2.793 7.235 77 HG3 GLU 314 1HG GLU 314 -1.048 1.448 6.665 78 H ASN 315 H ASN 315 -2.840 6.490 7.941 79 HA ASN 315 HA ASN 315 -5.252 7.043 6.297 80 HB2 ASN 315 2HB ASN 315 -4.938 7.280 9.330 81 HB3 ASN 315 1HB ASN 315 -6.421 7.535 8.410 82 HD21 ASN 315 1HD2 ASN 315 -4.136 5.136 9.549 83 HD22 ASN 315 2HD2 ASN 315 -5.171 3.772 9.351 84 H LYS 316 H LYS 316 -2.457 8.411 7.857 85 HA LYS 316 HA LYS 316 -3.549 11.161 7.630 86 HB2 LYS 316 2HB LYS 316 -1.650 10.038 9.723 87 HB3 LYS 316 1HB LYS 316 -2.046 11.745 9.573 88 HG2 LYS 316 2HG LYS 316 -4.156 9.624 10.078 89 HG3 LYS 316 1HG LYS 316 -3.267 10.404 11.379 90 HD2 LYS 316 2HD LYS 316 -5.274 11.632 11.275 91 HD3 LYS 316 1HD LYS 316 -4.132 12.645 10.401 92 HE2 LYS 316 2HE LYS 316 -5.059 11.761 8.253 93 HE3 LYS 316 1HE LYS 316 -6.243 10.828 9.171 94 HZ1 LYS 316 1HZ LYS 316 -5.970 13.787 9.185 95 HZ2 LYS 316 2HZ LYS 316 -7.120 12.899 10.050 96 HZ3 LYS 316 3HZ LYS 316 -7.159 12.913 8.360 97 HA PRO 317 HA PRO 317 0.171 12.052 5.112 98 HB2 PRO 317 2HB PRO 317 -0.973 14.788 4.971 99 HB3 PRO 317 1HB PRO 317 -0.639 13.654 3.660 100 HG2 PRO 317 2HG PRO 317 -3.172 14.262 4.400 101 HG3 PRO 317 1HG PRO 317 -2.729 12.645 3.811 102 HD2 PRO 317 2HD PRO 317 -3.080 13.589 6.661 103 HD3 PRO 317 1HD PRO 317 -3.700 12.113 5.888 104 H CYS 318 H CYS 318 1.267 14.644 5.272 105 HA CYS 318 HA CYS 318 2.812 14.268 7.664 106 HB2 CYS 318 2HB CYS 318 2.987 16.268 5.391 107 HB3 CYS 318 1HB CYS 318 4.081 16.299 6.773 108 H ARG 319 H ARG 319 2.536 15.219 9.587 109 HA ARG 319 HA ARG 319 1.449 17.969 9.755 110 HB2 ARG 319 2HB ARG 319 -0.164 16.393 10.771 111 HB3 ARG 319 1HB ARG 319 1.105 15.705 11.778 112 HG2 ARG 319 2HG ARG 319 1.366 17.958 12.876 113 HG3 ARG 319 1HG ARG 319 -0.026 18.520 11.952 114 HD2 ARG 319 2HD ARG 319 -0.092 16.189 13.894 115 HD3 ARG 319 1HD ARG 319 -0.531 17.842 14.320 116 HE ARG 319 HE ARG 319 -1.975 16.157 12.347 117 HH11 ARG 319 1HH1 ARG 319 -1.976 18.716 14.749 118 HH12 ARG 319 2HH1 ARG 319 -3.696 18.895 14.749 119 HH21 ARG 319 1HH2 ARG 319 -4.257 16.372 12.381 120 HH22 ARG 319 2HH2 ARG 319 -4.995 17.561 13.409 121 H LYS 320 H LYS 320 3.404 15.585 11.646 122 HA LYS 320 HA LYS 320 4.551 17.681 13.258 123 HB2 LYS 320 2HB LYS 320 3.750 15.517 14.200 124 HB3 LYS 320 1HB LYS 320 5.035 14.675 13.353 125 HG2 LYS 320 2HG LYS 320 5.466 15.016 15.796 126 HG3 LYS 320 1HG LYS 320 6.720 15.686 14.753 127 HD2 LYS 320 2HD LYS 320 6.250 17.234 16.585 128 HD3 LYS 320 1HD LYS 320 5.776 17.957 15.052 129 HE2 LYS 320 2HE LYS 320 4.119 18.422 16.809 130 HE3 LYS 320 1HE LYS 320 3.404 17.439 15.533 131 HZ1 LYS 320 1HZ LYS 320 2.809 16.680 17.760 132 HZ2 LYS 320 2HZ LYS 320 4.438 16.409 18.116 133 HZ3 LYS 320 3HZ LYS 320 3.672 15.496 16.915 134 H CYS 321 H CYS 321 5.441 16.784 10.258 135 HA CYS 321 HA CYS 321 8.279 17.528 10.776 136 HB2 CYS 321 2HB CYS 321 8.964 16.348 8.844 137 HB3 CYS 321 1HB CYS 321 7.795 15.268 9.595 138 H ALA 322 H ALA 322 5.361 18.737 9.862 139 HA ALA 322 HA ALA 322 6.283 20.417 7.613 140 HB1 ALA 322 1HB ALA 322 3.911 20.473 6.941 141 HB2 ALA 322 2HB ALA 322 3.473 19.493 8.343 142 HB3 ALA 322 3HB ALA 322 4.483 18.809 7.067 143 H CYS 323 H CYS 323 4.642 22.396 7.465 144 HA CYS 323 HA CYS 323 4.877 24.074 9.785 145 HB2 CYS 323 2HB CYS 323 4.985 25.210 7.700 146 HB3 CYS 323 1HB CYS 323 3.561 24.389 7.060 147 H HIS 324 H HIS 324 3.705 23.540 11.547 148 HA HIS 324 HA HIS 324 1.477 21.783 11.484 149 HB2 HIS 324 2HB HIS 324 2.560 23.414 13.822 150 HB3 HIS 324 1HB HIS 324 1.495 22.016 13.947 151 HD1 HIS 324 HD1 HIS 324 5.076 22.958 13.376 152 HD2 HIS 324 HD2 HIS 324 2.721 19.543 13.602 153 HE1 HIS 324 HE1 HIS 324 6.670 21.002 13.513 154 H VAL 325 H VAL 325 1.719 25.242 11.546 155 HA VAL 325 HA VAL 325 -0.603 25.955 12.947 156 HB VAL 325 HB VAL 325 0.751 27.555 10.724 157 HG11 VAL 325 1HG1 VAL 325 -0.122 29.565 11.879 158 HG12 VAL 325 2HG1 VAL 325 -0.963 28.539 13.046 159 HG13 VAL 325 3HG1 VAL 325 -1.435 28.513 11.346 160 HG21 VAL 325 1HG2 VAL 325 1.375 27.497 13.701 161 HG22 VAL 325 2HG2 VAL 325 2.105 28.593 12.523 162 HG23 VAL 325 3HG2 VAL 325 2.390 26.857 12.408 163 H CYS 326 H CYS 326 -0.127 25.096 9.572 164 HA CYS 326 HA CYS 326 -3.067 25.153 9.125 165 HB2 CYS 326 2HB CYS 326 -2.613 25.404 6.719 166 HB3 CYS 326 1HB CYS 326 -1.832 26.703 7.617 167 H GLY 327 H GLY 327 -0.445 23.135 9.708 168 HA2 GLY 327 2HA GLY 327 0.022 20.907 9.392 169 HA3 GLY 327 1HA GLY 327 -1.646 20.697 8.874 170 H GLY 328 H GLY 328 0.520 22.944 7.334 171 HA2 GLY 328 2HA GLY 328 0.007 21.611 4.755 172 HA3 GLY 328 1HA GLY 328 0.367 23.315 5.002 173 H ARG 329 H ARG 329 1.586 21.539 3.165 174 HA ARG 329 HA ARG 329 4.418 21.512 4.038 175 HB2 ARG 329 2HB ARG 329 3.016 19.478 2.237 176 HB3 ARG 329 1HB ARG 329 4.747 19.527 2.540 177 HG2 ARG 329 2HG ARG 329 3.981 17.805 3.917 178 HG3 ARG 329 1HG ARG 329 4.174 19.169 5.010 179 HD2 ARG 329 2HD ARG 329 2.136 18.075 5.599 180 HD3 ARG 329 1HD ARG 329 1.680 19.576 4.792 181 HE ARG 329 HE ARG 329 1.771 17.588 2.840 182 HH11 ARG 329 1HH1 ARG 329 -0.166 18.268 5.717 183 HH12 ARG 329 2HH1 ARG 329 -1.560 17.453 5.083 184 HH21 ARG 329 1HH2 ARG 329 -0.052 16.507 2.080 185 HH22 ARG 329 2HH2 ARG 329 -1.497 16.460 3.036 186 H GLU 330 H GLU 330 2.205 22.948 2.030 187 HA GLU 330 HA GLU 330 3.523 22.594 -0.533 188 HB2 GLU 330 2HB GLU 330 1.161 24.389 0.153 189 HB3 GLU 330 1HB GLU 330 1.705 23.953 -1.468 190 HG2 GLU 330 2HG GLU 330 1.247 21.526 -0.807 191 HG3 GLU 330 1HG GLU 330 0.441 22.160 0.618 192 H ALA 331 H ALA 331 4.922 23.942 -1.456 193 HA ALA 331 HA ALA 331 6.617 25.390 -1.617 194 HB1 ALA 331 1HB ALA 331 4.895 27.167 -1.716 195 HB2 ALA 331 2HB ALA 331 6.385 27.720 -0.951 196 HB3 ALA 331 3HB ALA 331 4.975 27.332 0.042 197 HA PRO 332 HA PRO 332 8.149 23.908 2.577 198 HB2 PRO 332 2HB PRO 332 10.253 22.444 1.502 199 HB3 PRO 332 1HB PRO 332 8.652 21.775 1.840 200 HG2 PRO 332 2HG PRO 332 9.770 22.793 -0.767 201 HG3 PRO 332 1HG PRO 332 8.831 21.318 -0.454 202 HD2 PRO 332 2HD PRO 332 7.676 23.513 -1.494 203 HD3 PRO 332 1HD PRO 332 6.802 22.486 -0.335 204 H GLU 333 H GLU 333 9.621 25.311 -0.278 205 HA GLU 333 HA GLU 333 11.960 26.446 0.773 206 HB2 GLU 333 2HB GLU 333 11.733 28.095 -1.107 207 HB3 GLU 333 1HB GLU 333 11.529 26.423 -1.625 208 HG2 GLU 333 2HG GLU 333 9.100 26.695 -1.697 209 HG3 GLU 333 1HG GLU 333 9.238 28.327 -1.060 210 H LYS 334 H LYS 334 8.593 27.485 1.002 211 HA LYS 334 HA LYS 334 9.296 30.038 2.296 212 HB2 LYS 334 2HB LYS 334 6.515 29.037 1.525 213 HB3 LYS 334 1HB LYS 334 6.974 30.680 1.970 214 HG2 LYS 334 2HG LYS 334 8.471 30.712 -0.076 215 HG3 LYS 334 1HG LYS 334 7.748 29.175 -0.541 216 HD2 LYS 334 2HD LYS 334 6.504 30.734 -1.780 217 HD3 LYS 334 1HD LYS 334 5.470 30.429 -0.381 218 HE2 LYS 334 2HE LYS 334 5.567 32.826 -0.862 219 HE3 LYS 334 1HE LYS 334 6.345 32.496 0.688 220 HZ1 LYS 334 1HZ LYS 334 8.485 32.634 -0.376 221 HZ2 LYS 334 2HZ LYS 334 7.610 34.042 -0.701 222 HZ3 LYS 334 3HZ LYS 334 7.776 32.856 -1.892 223 H GLN 335 H GLN 335 9.019 26.963 3.338 224 HA GLN 335 HA GLN 335 7.631 27.540 5.858 225 HB2 GLN 335 2HB GLN 335 8.925 24.987 4.814 226 HB3 GLN 335 1HB GLN 335 8.169 25.134 6.403 227 HG2 GLN 335 2HG GLN 335 6.031 25.754 5.253 228 HG3 GLN 335 1HG GLN 335 6.816 25.431 3.714 229 HE21 GLN 335 1HE2 GLN 335 8.262 23.105 4.446 230 HE22 GLN 335 2HE2 GLN 335 7.120 21.844 4.727 231 H LEU 336 H LEU 336 9.013 29.114 6.655 232 HA LEU 336 HA LEU 336 11.812 28.700 7.103 233 HB2 LEU 336 2HB LEU 336 9.809 30.768 8.016 234 HB3 LEU 336 1HB LEU 336 11.410 30.731 8.725 235 HG LEU 336 HG LEU 336 11.232 32.410 6.975 236 HD11 LEU 336 1HD1 LEU 336 13.404 31.479 7.394 237 HD12 LEU 336 2HD1 LEU 336 13.223 31.867 5.689 238 HD13 LEU 336 3HD1 LEU 336 13.122 30.188 6.219 239 HD21 LEU 336 1HD2 LEU 336 10.953 31.884 4.624 240 HD22 LEU 336 2HD2 LEU 336 9.553 31.339 5.539 241 HD23 LEU 336 3HD2 LEU 336 10.760 30.169 5.001 242 H LEU 337 H LEU 337 12.728 27.650 8.689 243 HA LEU 337 HA LEU 337 11.157 26.473 10.865 244 HB2 LEU 337 2HB LEU 337 14.049 25.998 10.012 245 HB3 LEU 337 1HB LEU 337 13.294 25.229 11.397 246 HG LEU 337 HG LEU 337 11.575 24.267 9.711 247 HD11 LEU 337 1HD1 LEU 337 12.332 23.970 7.397 248 HD12 LEU 337 2HD1 LEU 337 13.712 25.027 7.707 249 HD13 LEU 337 3HD1 LEU 337 12.071 25.669 7.785 250 HD21 LEU 337 1HD2 LEU 337 13.241 22.873 10.827 251 HD22 LEU 337 2HD2 LEU 337 14.444 23.289 9.606 252 HD23 LEU 337 3HD2 LEU 337 13.018 22.350 9.159 253 H CYS 338 H CYS 338 10.771 28.058 12.295 254 HA CYS 338 HA CYS 338 12.390 30.223 12.971 255 HB2 CYS 338 2HB CYS 338 9.937 30.033 13.453 256 HB3 CYS 338 1HB CYS 338 10.315 28.930 14.780 257 H ASP 339 H ASP 339 13.942 30.597 14.454 258 HA ASP 339 HA ASP 339 15.750 28.582 14.963 259 HB2 ASP 339 2HB ASP 339 16.394 30.928 14.782 260 HB3 ASP 339 1HB ASP 339 15.550 31.319 16.273 261 H GLU 340 H GLU 340 13.887 30.267 17.579 262 HA GLU 340 HA GLU 340 14.882 28.338 19.518 263 HB2 GLU 340 2HB GLU 340 14.484 29.938 21.090 264 HB3 GLU 340 1HB GLU 340 14.394 31.014 19.712 265 HG2 GLU 340 2HG GLU 340 11.993 29.759 21.069 266 HG3 GLU 340 1HG GLU 340 12.644 31.338 21.464 267 H CYS 341 H CYS 341 11.879 29.006 17.832 268 HA CYS 341 HA CYS 341 10.164 27.358 19.436 269 HB2 CYS 341 2HB CYS 341 9.743 28.394 16.601 270 HB3 CYS 341 1HB CYS 341 8.495 27.647 17.599 271 H ASP 342 H ASP 342 12.312 26.771 16.773 272 HA ASP 342 HA ASP 342 13.128 24.936 15.760 273 HB2 ASP 342 2HB ASP 342 13.184 24.110 18.175 274 HB3 ASP 342 1HB ASP 342 11.660 23.295 17.874 275 H MET 343 H MET 343 10.319 25.956 15.144 276 HA MET 343 HA MET 343 9.140 23.561 13.845 277 HB2 MET 343 2HB MET 343 7.721 25.898 15.194 278 HB3 MET 343 1HB MET 343 6.894 24.721 14.171 279 HG2 MET 343 2HG MET 343 8.345 24.158 16.765 280 HG3 MET 343 1HG MET 343 6.599 24.109 16.485 281 HE1 MET 343 1HE MET 343 6.659 21.641 17.595 282 HE2 MET 343 2HE MET 343 8.419 21.666 17.735 283 HE3 MET 343 3HE MET 343 7.613 20.309 16.946 284 H ALA 344 H ALA 344 8.148 23.805 11.878 285 HA ALA 344 HA ALA 344 9.176 25.904 10.142 286 HB1 ALA 344 1HB ALA 344 9.190 23.561 9.378 287 HB2 ALA 344 2HB ALA 344 8.209 24.563 8.309 288 HB3 ALA 344 3HB ALA 344 7.431 23.496 9.485 289 H PHE 345 H PHE 345 8.018 27.546 9.249 290 HA PHE 345 HA PHE 345 5.087 27.728 9.583 291 HB2 PHE 345 2HB PHE 345 7.027 30.008 10.242 292 HB3 PHE 345 1HB PHE 345 5.272 30.114 10.269 293 HD1 PHE 345 HD1 PHE 345 3.986 28.952 12.063 294 HD2 PHE 345 HD2 PHE 345 8.253 29.112 12.133 295 HE1 PHE 345 HE1 PHE 345 3.973 28.346 14.448 296 HE2 PHE 345 HE2 PHE 345 8.228 28.502 14.518 297 HZ PHE 345 HZ PHE 345 6.093 28.117 15.675 298 H HIS 346 H HIS 346 4.202 28.258 7.604 299 HA HIS 346 HA HIS 346 5.679 29.347 5.410 300 HB2 HIS 346 2HB HIS 346 2.672 29.234 5.921 301 HB3 HIS 346 1HB HIS 346 3.366 29.887 4.447 302 HD2 HIS 346 HD2 HIS 346 5.136 27.814 3.166 303 HE1 HIS 346 HE1 HIS 346 2.323 24.848 4.269 304 HE2 HIS 346 HE2 HIS 346 4.260 25.417 2.748 305 H LEU 347 H LEU 347 5.684 31.491 4.622 306 HA LEU 347 HA LEU 347 5.727 33.622 6.451 307 HB2 LEU 347 2HB LEU 347 5.493 33.611 3.417 308 HB3 LEU 347 1HB LEU 347 5.632 35.093 4.346 309 HG LEU 347 HG LEU 347 7.807 34.738 3.583 310 HD11 LEU 347 1HD1 LEU 347 9.221 34.195 5.475 311 HD12 LEU 347 2HD1 LEU 347 7.865 33.431 6.310 312 HD13 LEU 347 3HD1 LEU 347 7.842 35.167 5.988 313 HD21 LEU 347 1HD2 LEU 347 8.994 32.620 3.533 314 HD22 LEU 347 2HD2 LEU 347 7.489 32.546 2.622 315 HD23 LEU 347 3HD2 LEU 347 7.587 31.802 4.221 316 H TYR 348 H TYR 348 3.166 32.355 4.410 317 HA TYR 348 HA TYR 348 1.277 34.482 5.009 318 HB2 TYR 348 2HB TYR 348 0.839 31.872 3.494 319 HB3 TYR 348 1HB TYR 348 -0.222 33.279 3.481 320 HD1 TYR 348 HD1 TYR 348 0.807 35.518 2.581 321 HD2 TYR 348 HD2 TYR 348 2.528 31.682 1.833 322 HE1 TYR 348 HE1 TYR 348 2.066 36.450 0.689 323 HE2 TYR 348 HE2 TYR 348 3.778 32.616 -0.062 324 HH TYR 348 HH TYR 348 3.577 34.551 -1.631 325 H CYS 349 H CYS 349 2.375 32.089 6.893 326 HA CYS 349 HA CYS 349 -0.228 31.542 8.206 327 HB2 CYS 349 2HB CYS 349 2.394 29.986 8.294 328 HB3 CYS 349 1HB CYS 349 0.996 29.629 9.319 329 H LEU 350 H LEU 350 1.576 33.941 8.343 330 HA LEU 350 HA LEU 350 2.190 33.996 11.239 331 HB2 LEU 350 2HB LEU 350 3.158 35.868 9.041 332 HB3 LEU 350 1HB LEU 350 3.646 35.913 10.729 333 HG LEU 350 HG LEU 350 4.298 33.713 8.727 334 HD11 LEU 350 1HD1 LEU 350 6.610 34.459 8.961 335 HD12 LEU 350 2HD1 LEU 350 6.112 35.741 10.064 336 HD13 LEU 350 3HD1 LEU 350 5.585 35.766 8.379 337 HD21 LEU 350 1HD2 LEU 350 5.681 32.692 10.511 338 HD22 LEU 350 2HD2 LEU 350 3.973 32.704 10.937 339 HD23 LEU 350 3HD2 LEU 350 5.069 33.877 11.670 340 H LYS 351 H LYS 351 2.005 36.400 12.070 341 HA LYS 351 HA LYS 351 -0.255 37.879 10.973 342 HB2 LYS 351 2HB LYS 351 -1.200 36.244 12.685 343 HB3 LYS 351 1HB LYS 351 -0.215 37.034 13.908 344 HG2 LYS 351 2HG LYS 351 -2.454 37.909 14.070 345 HG3 LYS 351 1HG LYS 351 -1.406 39.181 13.443 346 HD2 LYS 351 2HD LYS 351 -3.499 39.208 12.213 347 HD3 LYS 351 1HD LYS 351 -2.215 38.667 11.130 348 HE2 LYS 351 2HE LYS 351 -2.922 36.319 11.491 349 HE3 LYS 351 1HE LYS 351 -4.219 36.875 12.551 350 HZ1 LYS 351 1HZ LYS 351 -5.194 38.046 10.681 351 HZ2 LYS 351 2HZ LYS 351 -5.003 36.402 10.317 352 HZ3 LYS 351 3HZ LYS 351 -3.932 37.540 9.675 353 HA PRO 352 HA PRO 352 -0.166 39.680 10.000 354 HB2 PRO 352 2HB PRO 352 1.855 41.617 9.017 355 HB3 PRO 352 1HB PRO 352 0.120 41.848 9.267 356 HG2 PRO 352 2HG PRO 352 1.944 43.034 10.875 357 HG3 PRO 352 1HG PRO 352 0.386 42.453 11.506 358 HD2 PRO 352 2HD PRO 352 3.091 41.091 11.616 359 HD3 PRO 352 1HD PRO 352 1.909 41.345 12.923 360 HA PRO 353 HA PRO 353 2.251 36.708 7.679 361 HB2 PRO 353 2HB PRO 353 0.572 37.367 5.301 362 HB3 PRO 353 1HB PRO 353 0.725 35.837 6.173 363 HG2 PRO 353 2HG PRO 353 -1.502 37.321 6.384 364 HG3 PRO 353 1HG PRO 353 -0.849 36.442 7.784 365 HD2 PRO 353 2HD PRO 353 -0.565 39.374 7.100 366 HD3 PRO 353 1HD PRO 353 -0.977 38.617 8.657 367 H LEU 354 H LEU 354 4.056 36.710 6.458 368 HA LEU 354 HA LEU 354 4.894 39.115 4.984 369 HB2 LEU 354 2HB LEU 354 6.413 36.581 5.726 370 HB3 LEU 354 1HB LEU 354 7.117 37.982 4.932 371 HG LEU 354 HG LEU 354 5.970 37.948 7.752 372 HD11 LEU 354 1HD1 LEU 354 8.864 38.055 6.841 373 HD12 LEU 354 2HD1 LEU 354 8.060 36.686 7.614 374 HD13 LEU 354 3HD1 LEU 354 8.293 38.185 8.508 375 HD21 LEU 354 1HD2 LEU 354 6.924 40.213 7.973 376 HD22 LEU 354 2HD2 LEU 354 5.683 40.156 6.727 377 HD23 LEU 354 3HD2 LEU 354 7.389 40.194 6.269 378 H THR 355 H THR 355 6.271 38.491 2.913 379 HA THR 355 HA THR 355 4.733 36.553 1.267 380 HB THR 355 HB THR 355 4.566 38.856 0.412 381 HG1 THR 355 HG1 THR 355 5.272 36.741 -0.978 382 HG21 THR 355 1HG2 THR 355 6.510 40.046 -0.541 383 HG22 THR 355 2HG2 THR 355 7.587 38.785 0.056 384 HG23 THR 355 3HG2 THR 355 6.713 39.806 1.197 385 H SER 356 H SER 356 7.883 37.354 2.511 386 HA SER 356 HA SER 356 9.184 35.143 1.119 387 HB2 SER 356 2HB SER 356 10.954 36.666 0.160 388 HB3 SER 356 1HB SER 356 9.364 36.929 -0.555 389 HG SER 356 HG SER 356 9.545 38.527 1.553 390 H VAL 357 H VAL 357 11.721 35.401 1.686 391 HA VAL 357 HA VAL 357 11.833 35.131 4.556 392 HB VAL 357 HB VAL 357 14.121 34.888 2.548 393 HG11 VAL 357 1HG1 VAL 357 15.186 33.465 4.286 394 HG12 VAL 357 2HG1 VAL 357 13.848 33.816 5.381 395 HG13 VAL 357 3HG1 VAL 357 14.917 35.115 4.853 396 HG21 VAL 357 1HG2 VAL 357 12.306 33.350 1.913 397 HG22 VAL 357 2HG2 VAL 357 12.262 32.696 3.548 398 HG23 VAL 357 3HG2 VAL 357 13.686 32.449 2.542 399 HA PRO 358 HA PRO 358 13.287 39.449 5.279 400 HB2 PRO 358 2HB PRO 358 13.881 38.277 7.980 401 HB3 PRO 358 1HB PRO 358 12.954 39.724 7.569 402 HG2 PRO 358 2HG PRO 358 11.726 37.477 8.383 403 HG3 PRO 358 1HG PRO 358 11.006 38.510 7.125 404 HD2 PRO 358 2HD PRO 358 12.492 35.910 6.840 405 HD3 PRO 358 1HD PRO 358 11.053 36.488 5.970 406 HA PRO 359 HA PRO 359 17.754 38.707 4.884 407 HB2 PRO 359 2HB PRO 359 18.743 41.199 5.181 408 HB3 PRO 359 1HB PRO 359 17.682 40.807 3.815 409 HG2 PRO 359 2HG PRO 359 16.970 42.108 6.455 410 HG3 PRO 359 1HG PRO 359 16.561 42.648 4.809 411 HD2 PRO 359 2HD PRO 359 14.821 41.219 6.369 412 HD3 PRO 359 1HD PRO 359 14.838 41.084 4.596 413 H GLU 360 H GLU 360 16.342 38.890 7.775 414 HA GLU 360 HA GLU 360 18.486 39.498 9.573 415 HB2 GLU 360 2HB GLU 360 15.942 37.892 10.049 416 HB3 GLU 360 1HB GLU 360 16.972 38.583 11.303 417 HG2 GLU 360 2HG GLU 360 16.410 40.858 10.475 418 HG3 GLU 360 1HG GLU 360 15.358 40.143 9.253 419 HA PRO 361 HA PRO 361 20.684 35.532 9.280 420 HB2 PRO 361 2HB PRO 361 21.976 35.503 11.706 421 HB3 PRO 361 1HB PRO 361 22.458 36.569 10.381 422 HG2 PRO 361 2HG PRO 361 20.725 37.188 12.774 423 HG3 PRO 361 1HG PRO 361 22.077 38.129 12.105 424 HD2 PRO 361 2HD PRO 361 19.500 38.767 11.574 425 HD3 PRO 361 1HD PRO 361 20.774 38.990 10.354 426 H GLU 362 H GLU 362 18.632 36.281 11.981 427 HA GLU 362 HA GLU 362 18.034 33.441 12.537 428 HB2 GLU 362 2HB GLU 362 17.525 34.308 14.914 429 HB3 GLU 362 1HB GLU 362 19.227 34.259 14.454 430 HG2 GLU 362 2HG GLU 362 19.007 36.725 13.846 431 HG3 GLU 362 1HG GLU 362 17.427 36.686 14.630 432 H TRP 363 H TRP 363 15.872 32.953 12.574 433 HA TRP 363 HA TRP 363 14.001 35.105 11.761 434 HB2 TRP 363 2HB TRP 363 14.586 33.301 10.032 435 HB3 TRP 363 1HB TRP 363 13.745 32.144 11.057 436 HD1 TRP 363 HD1 TRP 363 13.104 35.131 8.732 437 HE1 TRP 363 HE1 TRP 363 10.621 35.163 8.085 438 HE3 TRP 363 HE3 TRP 363 11.365 31.482 11.879 439 HZ2 TRP 363 HZ2 TRP 363 8.271 33.843 8.778 440 HZ3 TRP 363 HZ3 TRP 363 8.963 30.935 11.822 441 HH2 TRP 363 HH2 TRP 363 7.443 32.100 10.302 442 H TYR 364 H TYR 364 12.895 35.642 13.512 443 HA TYR 364 HA TYR 364 11.693 33.556 15.234 444 HB2 TYR 364 2HB TYR 364 12.281 36.492 15.833 445 HB3 TYR 364 1HB TYR 364 11.413 35.408 16.918 446 HD1 TYR 364 HD1 TYR 364 14.622 36.708 16.141 447 HD2 TYR 364 HD2 TYR 364 12.706 33.150 17.529 448 HE1 TYR 364 HE1 TYR 364 16.730 35.937 17.119 449 HE2 TYR 364 HE2 TYR 364 14.825 32.392 18.514 450 HH TYR 364 HH TYR 364 17.312 32.840 18.094 451 H CYS 365 H CYS 365 9.695 33.132 14.647 452 HA CYS 365 HA CYS 365 7.914 34.714 13.115 453 HB2 CYS 365 2HB CYS 365 6.250 32.985 13.683 454 HB3 CYS 365 1HB CYS 365 7.798 32.222 13.350 455 HA PRO 366 HA PRO 366 5.939 37.398 16.281 456 HB2 PRO 366 2HB PRO 366 3.256 37.202 15.502 457 HB3 PRO 366 1HB PRO 366 4.442 38.285 14.762 458 HG2 PRO 366 2HG PRO 366 3.559 35.543 13.855 459 HG3 PRO 366 1HG PRO 366 3.774 37.022 12.890 460 HD2 PRO 366 2HD PRO 366 5.648 35.130 12.866 461 HD3 PRO 366 1HD PRO 366 6.132 36.841 12.925 462 H SER 367 H SER 367 4.864 34.102 15.726 463 HA SER 367 HA SER 367 3.297 33.657 18.025 464 HB2 SER 367 2HB SER 367 5.019 31.576 16.639 465 HB3 SER 367 1HB SER 367 3.486 31.329 17.480 466 HG SER 367 HG SER 367 2.478 32.516 15.817 467 H CYS 368 H CYS 368 6.724 34.049 17.679 468 HA CYS 368 HA CYS 368 7.850 32.699 19.834 469 HB2 CYS 368 2HB CYS 368 8.475 35.380 18.575 470 HB3 CYS 368 1HB CYS 368 9.437 34.762 19.902 471 H ARG 369 H ARG 369 6.550 36.036 19.755 472 HA ARG 369 HA ARG 369 7.007 36.448 22.573 473 HB2 ARG 369 2HB ARG 369 6.193 38.753 22.130 474 HB3 ARG 369 1HB ARG 369 7.481 38.265 21.048 475 HG2 ARG 369 2HG ARG 369 6.089 39.328 19.551 476 HG3 ARG 369 1HG ARG 369 5.484 37.679 19.402 477 HD2 ARG 369 2HD ARG 369 3.599 38.206 20.875 478 HD3 ARG 369 1HD ARG 369 4.242 39.830 21.155 479 HE ARG 369 HE ARG 369 3.875 39.379 18.376 480 HH11 ARG 369 1HH1 ARG 369 1.995 40.081 21.263 481 HH12 ARG 369 2HH1 ARG 369 0.714 40.838 20.376 482 HH21 ARG 369 1HH2 ARG 369 2.206 40.402 17.249 483 HH22 ARG 369 2HH2 ARG 369 0.842 41.032 18.116 484 H THR 370 H THR 370 4.435 35.211 20.734 485 HA THR 370 HA THR 370 2.138 36.087 22.050 486 HB THR 370 HB THR 370 2.726 33.413 20.724 487 HG1 THR 370 HG1 THR 370 1.379 35.721 19.727 488 HG21 THR 370 1HG2 THR 370 0.264 33.145 20.479 489 HG22 THR 370 2HG2 THR 370 0.007 34.598 21.446 490 HG23 THR 370 3HG2 THR 370 0.732 33.167 22.180 491 H ASP 371 H ASP 371 1.887 36.060 24.195 492 HA ASP 371 HA ASP 371 1.309 35.331 26.233 493 HB2 ASP 371 2HB ASP 371 0.153 33.495 25.024 494 HB3 ASP 371 1HB ASP 371 1.609 32.516 25.111 495 H SER 372 H SER 372 4.353 34.900 24.994 496 HA SER 372 HA SER 372 5.571 33.545 27.283 497 HB2 SER 372 2HB SER 372 7.632 33.615 25.913 498 HB3 SER 372 1HB SER 372 6.289 32.932 24.993 499 HG SER 372 HG SER 372 7.497 34.491 23.813 500 H SER 373 H SER 373 4.340 36.178 27.636 501 HA SER 373 HA SER 373 6.293 38.180 28.133 502 HB2 SER 373 2HB SER 373 3.582 37.676 29.443 503 HB3 SER 373 1HB SER 373 4.529 39.154 29.620 504 HG SER 373 HG SER 373 3.926 39.770 27.718 505 H GLU 374 H GLU 374 6.279 38.955 30.714 506 HA GLU 374 HA GLU 374 7.939 37.138 32.108 507 HB2 GLU 374 2HB GLU 374 7.498 39.785 32.391 508 HB3 GLU 374 1HB GLU 374 6.398 39.231 33.638 509 HG2 GLU 374 2HG GLU 374 9.392 38.774 33.506 510 HG3 GLU 374 1HG GLU 374 8.522 39.813 34.629 511 H VAL 375 H VAL 375 7.354 35.343 33.103 512 HA VAL 375 HA VAL 375 4.539 34.745 33.670 513 HB VAL 375 HB VAL 375 6.932 32.841 33.805 514 HG11 VAL 375 1HG1 VAL 375 5.224 31.045 33.778 515 HG12 VAL 375 2HG1 VAL 375 3.943 32.257 33.816 516 HG13 VAL 375 3HG1 VAL 375 5.041 32.089 35.188 517 HG21 VAL 375 1HG2 VAL 375 4.926 33.199 31.537 518 HG22 VAL 375 2HG2 VAL 375 6.175 31.954 31.618 519 HG23 VAL 375 3HG2 VAL 375 6.630 33.653 31.493 520 H VAL 376 H VAL 376 3.754 34.923 35.694 521 HA VAL 376 HA VAL 376 5.242 35.640 37.957 522 HB VAL 376 HB VAL 376 3.193 35.055 39.305 523 HG11 VAL 376 1HG1 VAL 376 1.729 36.779 38.313 524 HG12 VAL 376 2HG1 VAL 376 2.656 36.713 36.811 525 HG13 VAL 376 3HG1 VAL 376 3.420 37.283 38.296 526 HG21 VAL 376 1HG2 VAL 376 2.375 33.115 38.015 527 HG22 VAL 376 2HG2 VAL 376 2.017 34.157 36.636 528 HG23 VAL 376 3HG2 VAL 376 1.120 34.347 38.145 529 H GLN 377 H GLN 377 6.569 34.499 39.179 530 HA GLN 377 HA GLN 377 6.450 31.541 39.229 531 HB2 GLN 377 2HB GLN 377 8.794 33.437 39.708 532 HB3 GLN 377 1HB GLN 377 8.866 31.701 39.980 533 HG2 GLN 377 2HG GLN 377 8.428 33.095 37.326 534 HG3 GLN 377 1HG GLN 377 9.895 32.273 37.852 535 HE21 GLN 377 1HE2 GLN 377 9.838 29.947 38.059 536 HE22 GLN 377 2HE2 GLN 377 8.688 29.014 37.171 537 H ALA 378 H ALA 378 5.005 31.265 40.877 538 HA ALA 378 HA ALA 378 5.535 32.365 43.547 539 HB1 ALA 378 1HB ALA 378 3.201 32.371 42.732 540 HB2 ALA 378 2HB ALA 378 3.372 31.336 44.150 541 HB3 ALA 378 3HB ALA 378 3.252 30.616 42.542 542 H GLY 379 H GLY 379 6.170 31.077 45.261 543 HA2 GLY 379 2HA GLY 379 6.935 29.216 46.408 544 HA3 GLY 379 1HA GLY 379 6.569 28.205 45.017 545 H GLU 380 H GLU 380 8.611 31.101 45.344 546 HA GLU 380 HA GLU 380 10.900 29.715 44.149 547 HB2 GLU 380 2HB GLU 380 10.493 32.653 44.872 548 HB3 GLU 380 1HB GLU 380 11.948 32.000 44.127 549 HG2 GLU 380 2HG GLU 380 9.169 32.035 42.912 550 HG3 GLU 380 1HG GLU 380 10.513 33.085 42.471 Start of MODEL 12 1 H1 SER 303 H SER 303 8.049 9.884 0.991 2 HA SER 303 HA SER 303 9.108 11.768 -0.976 3 HB2 SER 303 2HB SER 303 7.021 10.452 -1.444 4 HB3 SER 303 1HB SER 303 6.216 11.271 -0.106 5 HG SER 303 HG SER 303 6.624 13.263 -1.267 6 H GLY 304 H GLY 304 7.910 11.755 2.307 7 HA2 GLY 304 2HA GLY 304 7.335 14.567 2.538 8 HA3 GLY 304 1HA GLY 304 7.414 13.396 3.843 9 HA PRO 305 HA PRO 305 11.332 16.209 3.701 10 HB2 PRO 305 2HB PRO 305 10.740 17.984 5.711 11 HB3 PRO 305 1HB PRO 305 10.289 18.265 4.024 12 HG2 PRO 305 2HG PRO 305 8.605 17.175 6.277 13 HG3 PRO 305 1HG PRO 305 8.188 18.416 5.075 14 HD2 PRO 305 2HD PRO 305 7.375 15.836 4.820 15 HD3 PRO 305 1HD PRO 305 7.762 16.837 3.404 16 H SER 306 H SER 306 12.799 16.632 5.641 17 HA SER 306 HA SER 306 13.550 14.229 6.775 18 HB2 SER 306 2HB SER 306 15.116 15.649 8.182 19 HB3 SER 306 1HB SER 306 15.145 16.018 6.456 20 HG SER 306 HG SER 306 14.902 17.979 7.253 21 H CYS 307 H CYS 307 13.104 13.159 8.635 22 HA CYS 307 HA CYS 307 10.968 14.258 10.354 23 HB2 CYS 307 2HB CYS 307 11.234 11.596 8.986 24 HB3 CYS 307 1HB CYS 307 10.303 11.729 10.482 25 H ARG 308 H ARG 308 12.141 14.889 12.004 26 HA ARG 308 HA ARG 308 14.019 13.193 13.456 27 HB2 ARG 308 2HB ARG 308 12.982 16.003 14.053 28 HB3 ARG 308 1HB ARG 308 14.394 15.245 14.786 29 HG2 ARG 308 2HG ARG 308 15.687 15.470 12.822 30 HG3 ARG 308 1HG ARG 308 14.268 15.702 11.796 31 HD2 ARG 308 2HD ARG 308 15.538 17.807 12.133 32 HD3 ARG 308 1HD ARG 308 13.885 17.916 12.750 33 HE ARG 308 HE ARG 308 16.036 17.231 14.627 34 HH11 ARG 308 1HH1 ARG 308 13.758 19.692 13.532 35 HH12 ARG 308 2HH1 ARG 308 14.003 20.692 14.927 36 HH21 ARG 308 1HH2 ARG 308 16.324 18.558 16.432 37 HH22 ARG 308 2HH2 ARG 308 15.450 20.053 16.560 38 H PHE 309 H PHE 309 10.963 14.908 13.996 39 HA PHE 309 HA PHE 309 10.452 13.902 16.637 40 HB2 PHE 309 2HB PHE 309 8.542 15.279 14.691 41 HB3 PHE 309 1HB PHE 309 8.287 15.077 16.420 42 HD1 PHE 309 HD1 PHE 309 10.513 16.755 13.915 43 HD2 PHE 309 HD2 PHE 309 9.088 16.721 17.952 44 HE1 PHE 309 HE1 PHE 309 11.569 18.941 14.311 45 HE2 PHE 309 HE2 PHE 309 10.151 18.903 18.334 46 HZ PHE 309 HZ PHE 309 11.389 20.014 16.520 47 H CYS 310 H CYS 310 9.490 12.992 13.387 48 HA CYS 310 HA CYS 310 7.254 11.324 14.165 49 HB2 CYS 310 2HB CYS 310 8.531 11.504 11.409 50 HB3 CYS 310 1HB CYS 310 6.877 11.032 11.793 51 H LYS 311 H LYS 311 10.473 10.822 14.465 52 HA LYS 311 HA LYS 311 11.921 9.106 14.662 53 HB2 LYS 311 2HB LYS 311 9.358 7.478 14.869 54 HB3 LYS 311 1HB LYS 311 10.957 6.827 15.214 55 HG2 LYS 311 2HG LYS 311 11.217 8.450 17.062 56 HG3 LYS 311 1HG LYS 311 9.620 9.109 16.715 57 HD2 LYS 311 2HD LYS 311 9.389 7.636 18.600 58 HD3 LYS 311 1HD LYS 311 8.651 6.824 17.221 59 HE2 LYS 311 2HE LYS 311 11.462 6.247 18.244 60 HE3 LYS 311 1HE LYS 311 10.040 5.317 18.701 61 HZ1 LYS 311 1HZ LYS 311 9.770 4.836 16.268 62 HZ2 LYS 311 2HZ LYS 311 11.124 4.142 17.000 63 HZ3 LYS 311 3HZ LYS 311 11.304 5.509 16.026 64 H ASP 312 H ASP 312 10.872 9.877 11.998 65 HA ASP 312 HA ASP 312 10.503 9.316 9.876 66 HB2 ASP 312 2HB ASP 312 12.979 9.405 10.006 67 HB3 ASP 312 1HB ASP 312 13.018 7.661 10.268 68 H ASP 313 H ASP 313 8.542 8.253 10.098 69 HA ASP 313 HA ASP 313 8.655 5.404 9.304 70 HB2 ASP 313 2HB ASP 313 7.758 5.503 11.601 71 HB3 ASP 313 1HB ASP 313 6.570 6.707 11.110 72 H GLU 314 H GLU 314 7.066 4.766 7.817 73 HA GLU 314 HA GLU 314 6.486 6.689 5.789 74 HB2 GLU 314 2HB GLU 314 5.591 3.794 6.048 75 HB3 GLU 314 1HB GLU 314 5.507 4.767 4.579 76 HG2 GLU 314 2HG GLU 314 7.960 4.930 4.530 77 HG3 GLU 314 1HG GLU 314 8.067 3.996 6.023 78 H ASN 315 H ASN 315 4.577 5.117 8.309 79 HA ASN 315 HA ASN 315 2.027 5.697 6.991 80 HB2 ASN 315 2HB ASN 315 2.638 4.168 9.559 81 HB3 ASN 315 1HB ASN 315 1.035 4.331 8.847 82 HD21 ASN 315 1HD2 ASN 315 2.457 1.906 9.383 83 HD22 ASN 315 2HD2 ASN 315 2.691 1.093 7.875 84 H LYS 316 H LYS 316 3.895 6.898 9.721 85 HA LYS 316 HA LYS 316 1.781 8.072 11.197 86 HB2 LYS 316 2HB LYS 316 4.727 8.854 11.199 87 HB3 LYS 316 1HB LYS 316 3.541 9.352 12.404 88 HG2 LYS 316 2HG LYS 316 4.538 6.538 11.887 89 HG3 LYS 316 1HG LYS 316 4.895 7.550 13.285 90 HD2 LYS 316 2HD LYS 316 2.592 7.408 14.051 91 HD3 LYS 316 1HD LYS 316 2.095 6.589 12.567 92 HE2 LYS 316 2HE LYS 316 4.025 5.449 14.622 93 HE3 LYS 316 1HE LYS 316 2.318 5.026 14.481 94 HZ1 LYS 316 1HZ LYS 316 4.346 4.611 12.346 95 HZ2 LYS 316 2HZ LYS 316 2.729 4.126 12.302 96 HZ3 LYS 316 3HZ LYS 316 3.791 3.415 13.405 97 HA PRO 317 HA PRO 317 0.941 11.816 8.744 98 HB2 PRO 317 2HB PRO 317 -0.344 12.819 11.257 99 HB3 PRO 317 1HB PRO 317 -1.050 12.582 9.653 100 HG2 PRO 317 2HG PRO 317 -1.666 10.934 11.676 101 HG3 PRO 317 1HG PRO 317 -1.464 10.306 10.025 102 HD2 PRO 317 2HD PRO 317 0.497 10.242 12.329 103 HD3 PRO 317 1HD PRO 317 0.047 8.942 11.197 104 H CYS 318 H CYS 318 2.076 13.786 8.496 105 HA CYS 318 HA CYS 318 4.112 14.317 10.584 106 HB2 CYS 318 2HB CYS 318 5.139 13.188 8.729 107 HB3 CYS 318 1HB CYS 318 4.384 14.282 7.563 108 H ARG 319 H ARG 319 3.594 16.121 11.529 109 HA ARG 319 HA ARG 319 2.874 18.554 9.993 110 HB2 ARG 319 2HB ARG 319 1.609 19.233 12.086 111 HB3 ARG 319 1HB ARG 319 0.926 17.851 11.235 112 HG2 ARG 319 2HG ARG 319 1.885 16.311 12.878 113 HG3 ARG 319 1HG ARG 319 2.705 17.647 13.693 114 HD2 ARG 319 2HD ARG 319 -0.312 17.389 13.428 115 HD3 ARG 319 1HD ARG 319 0.621 16.883 14.840 116 HE ARG 319 HE ARG 319 1.397 19.343 14.817 117 HH11 ARG 319 1HH1 ARG 319 -1.848 18.348 13.933 118 HH12 ARG 319 2HH1 ARG 319 -2.574 19.808 14.525 119 HH21 ARG 319 1HH2 ARG 319 0.426 21.229 15.607 120 HH22 ARG 319 2HH2 ARG 319 -1.290 21.426 15.469 121 H LYS 320 H LYS 320 5.006 17.093 12.278 122 HA LYS 320 HA LYS 320 5.889 19.584 13.530 123 HB2 LYS 320 2HB LYS 320 6.684 16.682 14.002 124 HB3 LYS 320 1HB LYS 320 7.298 18.047 14.936 125 HG2 LYS 320 2HG LYS 320 5.097 18.536 15.813 126 HG3 LYS 320 1HG LYS 320 4.348 17.350 14.736 127 HD2 LYS 320 2HD LYS 320 5.547 15.533 15.916 128 HD3 LYS 320 1HD LYS 320 6.293 16.716 16.994 129 HE2 LYS 320 2HE LYS 320 3.288 16.305 16.750 130 HE3 LYS 320 1HE LYS 320 4.297 15.509 17.964 131 HZ1 LYS 320 1HZ LYS 320 3.232 17.496 18.829 132 HZ2 LYS 320 2HZ LYS 320 3.986 18.447 17.652 133 HZ3 LYS 320 3HZ LYS 320 4.913 17.666 18.832 134 H CYS 321 H CYS 321 6.715 17.989 10.718 135 HA CYS 321 HA CYS 321 9.282 19.493 10.592 136 HB2 CYS 321 2HB CYS 321 8.578 17.336 8.582 137 HB3 CYS 321 1HB CYS 321 10.168 17.932 9.063 138 H ALA 322 H ALA 322 6.154 19.744 10.008 139 HA ALA 322 HA ALA 322 6.316 21.097 7.391 140 HB1 ALA 322 1HB ALA 322 3.937 20.438 7.093 141 HB2 ALA 322 2HB ALA 322 3.967 19.587 8.642 142 HB3 ALA 322 3HB ALA 322 4.960 19.014 7.303 143 H CYS 323 H CYS 323 4.362 22.686 7.281 144 HA CYS 323 HA CYS 323 4.240 24.359 9.673 145 HB2 CYS 323 2HB CYS 323 4.510 25.546 7.605 146 HB3 CYS 323 1HB CYS 323 3.184 24.684 6.848 147 H HIS 324 H HIS 324 3.048 23.267 11.145 148 HA HIS 324 HA HIS 324 0.706 21.740 10.592 149 HB2 HIS 324 2HB HIS 324 0.519 21.531 13.048 150 HB3 HIS 324 1HB HIS 324 2.172 21.247 12.513 151 HD1 HIS 324 HD1 HIS 324 3.959 22.639 13.629 152 HD2 HIS 324 HD2 HIS 324 0.140 24.146 14.271 153 HE1 HIS 324 HE1 HIS 324 4.197 24.535 15.281 154 H VAL 325 H VAL 325 1.236 25.078 11.031 155 HA VAL 325 HA VAL 325 -1.130 25.998 12.196 156 HB VAL 325 HB VAL 325 0.543 27.463 10.102 157 HG11 VAL 325 1HG1 VAL 325 -1.584 28.614 10.600 158 HG12 VAL 325 2HG1 VAL 325 -0.217 29.537 11.219 159 HG13 VAL 325 3HG1 VAL 325 -1.213 28.588 12.327 160 HG21 VAL 325 1HG2 VAL 325 0.983 27.347 13.114 161 HG22 VAL 325 2HG2 VAL 325 1.875 28.370 11.984 162 HG23 VAL 325 3HG2 VAL 325 2.015 26.616 11.879 163 H CYS 326 H CYS 326 -0.476 24.921 8.923 164 HA CYS 326 HA CYS 326 -3.369 25.111 8.324 165 HB2 CYS 326 2HB CYS 326 -2.867 25.611 5.969 166 HB3 CYS 326 1HB CYS 326 -2.182 26.848 7.016 167 H GLY 327 H GLY 327 -1.047 23.067 9.097 168 HA2 GLY 327 2HA GLY 327 -0.599 20.848 8.830 169 HA3 GLY 327 1HA GLY 327 -2.256 20.718 8.262 170 H GLY 328 H GLY 328 0.814 22.071 6.972 171 HA2 GLY 328 2HA GLY 328 0.468 20.489 4.497 172 HA3 GLY 328 1HA GLY 328 0.538 22.245 4.386 173 H ARG 329 H ARG 329 2.294 19.806 3.643 174 HA ARG 329 HA ARG 329 4.936 20.730 4.537 175 HB2 ARG 329 2HB ARG 329 4.106 18.469 2.655 176 HB3 ARG 329 1HB ARG 329 5.774 18.873 3.026 177 HG2 ARG 329 2HG ARG 329 5.208 16.966 4.332 178 HG3 ARG 329 1HG ARG 329 5.317 18.335 5.434 179 HD2 ARG 329 2HD ARG 329 3.409 16.792 5.917 180 HD3 ARG 329 1HD ARG 329 2.914 18.456 5.624 181 HE ARG 329 HE ARG 329 1.673 17.735 3.870 182 HH11 ARG 329 1HH1 ARG 329 4.117 15.258 4.351 183 HH12 ARG 329 2HH1 ARG 329 3.362 14.142 3.268 184 HH21 ARG 329 1HH2 ARG 329 0.709 16.276 2.459 185 HH22 ARG 329 2HH2 ARG 329 1.433 14.724 2.181 186 H GLU 330 H GLU 330 2.751 21.856 2.507 187 HA GLU 330 HA GLU 330 3.802 22.092 -0.077 188 HB2 GLU 330 2HB GLU 330 1.915 23.979 1.402 189 HB3 GLU 330 1HB GLU 330 2.062 23.815 -0.348 190 HG2 GLU 330 2HG GLU 330 1.083 21.610 -0.300 191 HG3 GLU 330 1HG GLU 330 1.168 21.552 1.461 192 H ALA 331 H ALA 331 5.412 23.380 -0.862 193 HA ALA 331 HA ALA 331 7.112 24.858 -1.035 194 HB1 ALA 331 1HB ALA 331 5.219 26.385 -1.446 195 HB2 ALA 331 2HB ALA 331 6.577 27.220 -0.690 196 HB3 ALA 331 3HB ALA 331 5.164 26.782 0.275 197 HA PRO 332 HA PRO 332 8.609 24.273 3.409 198 HB2 PRO 332 2HB PRO 332 10.872 22.833 2.724 199 HB3 PRO 332 1HB PRO 332 9.307 22.086 3.072 200 HG2 PRO 332 2HG PRO 332 10.535 22.762 0.402 201 HG3 PRO 332 1HG PRO 332 9.702 21.276 0.903 202 HD2 PRO 332 2HD PRO 332 8.441 23.163 -0.561 203 HD3 PRO 332 1HD PRO 332 7.575 22.237 0.683 204 H GLU 333 H GLU 333 9.834 25.511 0.450 205 HA GLU 333 HA GLU 333 12.119 26.925 1.268 206 HB2 GLU 333 2HB GLU 333 11.620 28.352 -0.763 207 HB3 GLU 333 1HB GLU 333 11.665 26.618 -1.069 208 HG2 GLU 333 2HG GLU 333 9.171 26.566 -0.987 209 HG3 GLU 333 1HG GLU 333 9.163 28.314 -0.775 210 H LYS 334 H LYS 334 8.660 27.874 1.333 211 HA LYS 334 HA LYS 334 9.286 30.366 2.729 212 HB2 LYS 334 2HB LYS 334 6.841 29.315 1.307 213 HB3 LYS 334 1HB LYS 334 6.608 30.512 2.576 214 HG2 LYS 334 2HG LYS 334 6.824 31.951 0.817 215 HG3 LYS 334 1HG LYS 334 8.515 31.810 1.257 216 HD2 LYS 334 2HD LYS 334 8.550 31.629 -1.066 217 HD3 LYS 334 1HD LYS 334 8.635 29.946 -0.538 218 HE2 LYS 334 2HE LYS 334 6.322 29.575 -1.080 219 HE3 LYS 334 1HE LYS 334 6.022 31.304 -1.292 220 HZ1 LYS 334 1HZ LYS 334 6.213 30.259 -3.423 221 HZ2 LYS 334 2HZ LYS 334 7.703 29.567 -3.022 222 HZ3 LYS 334 3HZ LYS 334 7.573 31.244 -3.199 223 H GLN 335 H GLN 335 8.667 27.185 3.588 224 HA GLN 335 HA GLN 335 7.466 27.831 6.173 225 HB2 GLN 335 2HB GLN 335 8.445 25.196 5.012 226 HB3 GLN 335 1HB GLN 335 7.788 25.372 6.640 227 HG2 GLN 335 2HG GLN 335 5.663 26.233 5.621 228 HG3 GLN 335 1HG GLN 335 6.334 25.865 4.031 229 HE21 GLN 335 1HE2 GLN 335 4.552 24.461 3.733 230 HE22 GLN 335 2HE2 GLN 335 4.538 22.887 4.419 231 H LEU 336 H LEU 336 9.006 29.226 6.988 232 HA LEU 336 HA LEU 336 11.799 28.580 7.171 233 HB2 LEU 336 2HB LEU 336 10.191 30.795 8.496 234 HB3 LEU 336 1HB LEU 336 11.949 30.709 8.439 235 HG LEU 336 HG LEU 336 10.129 30.998 6.010 236 HD11 LEU 336 1HD1 LEU 336 11.909 33.060 7.334 237 HD12 LEU 336 2HD1 LEU 336 10.145 33.044 7.341 238 HD13 LEU 336 3HD1 LEU 336 11.013 33.279 5.826 239 HD21 LEU 336 1HD2 LEU 336 12.182 29.799 5.461 240 HD22 LEU 336 2HD2 LEU 336 13.145 31.090 6.189 241 HD23 LEU 336 3HD2 LEU 336 12.178 31.409 4.747 242 H LEU 337 H LEU 337 12.891 27.777 8.851 243 HA LEU 337 HA LEU 337 11.405 26.370 10.929 244 HB2 LEU 337 2HB LEU 337 14.235 26.209 9.849 245 HB3 LEU 337 1HB LEU 337 13.817 25.413 11.359 246 HG LEU 337 HG LEU 337 12.332 24.843 8.755 247 HD11 LEU 337 1HD1 LEU 337 14.654 23.258 9.898 248 HD12 LEU 337 2HD1 LEU 337 14.688 24.231 8.424 249 HD13 LEU 337 3HD1 LEU 337 13.653 22.808 8.513 250 HD21 LEU 337 1HD2 LEU 337 11.586 22.809 9.932 251 HD22 LEU 337 2HD2 LEU 337 11.114 24.257 10.815 252 HD23 LEU 337 3HD2 LEU 337 12.485 23.294 11.372 253 H CYS 338 H CYS 338 10.864 27.807 12.449 254 HA CYS 338 HA CYS 338 12.488 29.797 13.666 255 HB2 CYS 338 2HB CYS 338 9.912 29.496 13.705 256 HB3 CYS 338 1HB CYS 338 10.190 28.349 15.014 257 H ASP 339 H ASP 339 14.264 29.377 14.825 258 HA ASP 339 HA ASP 339 15.365 26.904 15.294 259 HB2 ASP 339 2HB ASP 339 16.716 28.904 15.203 260 HB3 ASP 339 1HB ASP 339 15.910 29.589 16.605 261 H GLU 340 H GLU 340 13.980 28.996 17.813 262 HA GLU 340 HA GLU 340 14.344 27.113 19.931 263 HB2 GLU 340 2HB GLU 340 13.527 28.826 21.367 264 HB3 GLU 340 1HB GLU 340 14.403 29.651 20.088 265 HG2 GLU 340 2HG GLU 340 11.447 29.581 20.620 266 HG3 GLU 340 1HG GLU 340 12.501 30.982 20.490 267 H CYS 341 H CYS 341 11.772 27.666 17.691 268 HA CYS 341 HA CYS 341 9.758 26.082 19.109 269 HB2 CYS 341 2HB CYS 341 9.817 27.395 16.363 270 HB3 CYS 341 1HB CYS 341 8.538 26.266 16.801 271 H ASP 342 H ASP 342 12.358 25.564 16.898 272 HA ASP 342 HA ASP 342 13.009 24.012 15.421 273 HB2 ASP 342 2HB ASP 342 11.994 22.398 17.761 274 HB3 ASP 342 1HB ASP 342 12.442 21.507 16.313 275 H MET 343 H MET 343 10.661 25.197 14.641 276 HA MET 343 HA MET 343 9.119 23.051 13.326 277 HB2 MET 343 2HB MET 343 8.005 23.791 15.485 278 HB3 MET 343 1HB MET 343 7.834 25.399 14.794 279 HG2 MET 343 2HG MET 343 5.756 24.242 14.543 280 HG3 MET 343 1HG MET 343 6.484 24.386 12.944 281 HE1 MET 343 1HE MET 343 6.585 20.465 15.403 282 HE2 MET 343 2HE MET 343 5.851 21.952 16.001 283 HE3 MET 343 3HE MET 343 7.599 21.859 15.773 284 H ALA 344 H ALA 344 8.371 23.548 11.346 285 HA ALA 344 HA ALA 344 9.332 25.941 10.010 286 HB1 ALA 344 1HB ALA 344 8.571 24.792 7.960 287 HB2 ALA 344 2HB ALA 344 7.852 23.508 8.935 288 HB3 ALA 344 3HB ALA 344 9.604 23.748 8.937 289 H PHE 345 H PHE 345 8.079 27.633 9.384 290 HA PHE 345 HA PHE 345 5.128 27.505 9.591 291 HB2 PHE 345 2HB PHE 345 6.837 29.845 10.577 292 HB3 PHE 345 1HB PHE 345 5.080 29.769 10.584 293 HD1 PHE 345 HD1 PHE 345 3.966 27.974 12.063 294 HD2 PHE 345 HD2 PHE 345 8.063 29.105 12.456 295 HE1 PHE 345 HE1 PHE 345 3.997 27.075 14.352 296 HE2 PHE 345 HE2 PHE 345 8.084 28.207 14.739 297 HZ PHE 345 HZ PHE 345 6.060 27.192 15.689 298 H HIS 346 H HIS 346 4.206 28.242 7.717 299 HA HIS 346 HA HIS 346 5.594 29.502 5.600 300 HB2 HIS 346 2HB HIS 346 2.641 29.356 6.260 301 HB3 HIS 346 1HB HIS 346 3.199 30.325 4.905 302 HD2 HIS 346 HD2 HIS 346 4.909 28.583 3.096 303 HE1 HIS 346 HE1 HIS 346 2.028 25.539 3.710 304 HE2 HIS 346 HE2 HIS 346 3.710 26.523 2.087 305 H LEU 347 H LEU 347 5.911 31.558 5.088 306 HA LEU 347 HA LEU 347 5.853 33.769 6.734 307 HB2 LEU 347 2HB LEU 347 5.626 33.473 3.718 308 HB3 LEU 347 1HB LEU 347 5.891 35.026 4.511 309 HG LEU 347 HG LEU 347 7.790 32.674 4.870 310 HD11 LEU 347 1HD1 LEU 347 8.022 34.913 2.853 311 HD12 LEU 347 2HD1 LEU 347 7.711 33.217 2.499 312 HD13 LEU 347 3HD1 LEU 347 9.249 33.696 3.206 313 HD21 LEU 347 1HD2 LEU 347 8.098 35.650 5.410 314 HD22 LEU 347 2HD2 LEU 347 9.367 34.440 5.595 315 HD23 LEU 347 3HD2 LEU 347 7.937 34.372 6.621 316 H TYR 348 H TYR 348 3.334 32.454 4.682 317 HA TYR 348 HA TYR 348 1.555 34.752 4.911 318 HB2 TYR 348 2HB TYR 348 0.870 32.117 3.548 319 HB3 TYR 348 1HB TYR 348 0.299 33.735 3.152 320 HD1 TYR 348 HD1 TYR 348 1.877 35.363 1.988 321 HD2 TYR 348 HD2 TYR 348 2.913 31.257 2.592 322 HE1 TYR 348 HE1 TYR 348 3.718 35.587 0.380 323 HE2 TYR 348 HE2 TYR 348 4.746 31.480 0.975 324 HH TYR 348 HH TYR 348 5.859 34.496 -0.155 325 H CYS 349 H CYS 349 2.240 32.113 6.826 326 HA CYS 349 HA CYS 349 -0.484 31.929 7.994 327 HB2 CYS 349 2HB CYS 349 1.924 30.074 8.272 328 HB3 CYS 349 1HB CYS 349 0.384 29.858 9.110 329 H LEU 350 H LEU 350 1.841 33.975 8.310 330 HA LEU 350 HA LEU 350 2.157 33.954 11.249 331 HB2 LEU 350 2HB LEU 350 3.535 35.729 9.192 332 HB3 LEU 350 1HB LEU 350 3.922 35.607 10.904 333 HG LEU 350 HG LEU 350 4.357 33.450 8.809 334 HD11 LEU 350 1HD1 LEU 350 6.413 35.083 10.321 335 HD12 LEU 350 2HD1 LEU 350 5.897 35.376 8.657 336 HD13 LEU 350 3HD1 LEU 350 6.706 33.872 9.069 337 HD21 LEU 350 1HD2 LEU 350 5.522 32.166 10.568 338 HD22 LEU 350 2HD2 LEU 350 3.819 32.394 10.952 339 HD23 LEU 350 3HD2 LEU 350 5.041 33.365 11.771 340 H LYS 351 H LYS 351 2.110 36.224 12.232 341 HA LYS 351 HA LYS 351 0.327 38.115 10.831 342 HB2 LYS 351 2HB LYS 351 -0.937 37.030 12.671 343 HB3 LYS 351 1HB LYS 351 0.295 37.526 13.822 344 HG2 LYS 351 2HG LYS 351 -1.704 38.972 13.928 345 HG3 LYS 351 1HG LYS 351 -0.258 39.875 13.476 346 HD2 LYS 351 2HD LYS 351 -2.161 40.620 12.128 347 HD3 LYS 351 1HD LYS 351 -0.974 39.828 11.097 348 HE2 LYS 351 2HE LYS 351 -3.251 39.176 10.470 349 HE3 LYS 351 1HE LYS 351 -2.358 37.783 11.080 350 HZ1 LYS 351 1HZ LYS 351 -4.606 37.881 11.947 351 HZ2 LYS 351 2HZ LYS 351 -4.303 39.394 12.641 352 HZ3 LYS 351 3HZ LYS 351 -3.474 38.028 13.189 353 HA PRO 352 HA PRO 352 0.513 39.907 9.844 354 HB2 PRO 352 2HB PRO 352 2.021 41.405 8.174 355 HB3 PRO 352 1HB PRO 352 1.355 42.094 9.664 356 HG2 PRO 352 2HG PRO 352 4.132 41.006 9.161 357 HG3 PRO 352 1HG PRO 352 3.664 42.543 9.923 358 HD2 PRO 352 2HD PRO 352 4.314 40.328 11.383 359 HD3 PRO 352 1HD PRO 352 3.139 41.532 11.955 360 HA PRO 353 HA PRO 353 1.866 36.524 7.170 361 HB2 PRO 353 2HB PRO 353 0.063 37.564 5.046 362 HB3 PRO 353 1HB PRO 353 -0.020 36.044 5.941 363 HG2 PRO 353 2HG PRO 353 -1.800 38.029 6.373 364 HG3 PRO 353 1HG PRO 353 -1.239 36.972 7.686 365 HD2 PRO 353 2HD PRO 353 -0.329 39.773 6.997 366 HD3 PRO 353 1HD PRO 353 -0.724 39.075 8.588 367 H LEU 354 H LEU 354 3.914 36.939 6.599 368 HA LEU 354 HA LEU 354 4.808 39.220 5.123 369 HB2 LEU 354 2HB LEU 354 6.284 36.647 5.830 370 HB3 LEU 354 1HB LEU 354 7.041 38.126 5.243 371 HG LEU 354 HG LEU 354 5.526 37.866 7.871 372 HD11 LEU 354 1HD1 LEU 354 7.612 36.605 7.962 373 HD12 LEU 354 2HD1 LEU 354 7.710 38.036 8.983 374 HD13 LEU 354 3HD1 LEU 354 8.520 38.016 7.413 375 HD21 LEU 354 1HD2 LEU 354 7.132 40.212 6.798 376 HD22 LEU 354 2HD2 LEU 354 6.419 40.097 8.410 377 HD23 LEU 354 3HD2 LEU 354 5.376 40.144 6.993 378 H THR 355 H THR 355 5.373 39.412 3.016 379 HA THR 355 HA THR 355 4.156 37.605 1.117 380 HB THR 355 HB THR 355 4.010 40.063 0.815 381 HG1 THR 355 HG1 THR 355 3.805 39.468 -1.182 382 HG21 THR 355 1HG2 THR 355 6.241 40.735 1.652 383 HG22 THR 355 2HG2 THR 355 5.944 41.374 0.033 384 HG23 THR 355 3HG2 THR 355 6.995 39.973 0.249 385 H SER 356 H SER 356 7.427 38.338 2.192 386 HA SER 356 HA SER 356 8.504 36.034 0.772 387 HB2 SER 356 2HB SER 356 8.815 37.955 -0.823 388 HB3 SER 356 1HB SER 356 9.737 38.808 0.414 389 HG SER 356 HG SER 356 11.174 37.757 -0.929 390 H VAL 357 H VAL 357 10.870 35.741 1.437 391 HA VAL 357 HA VAL 357 10.931 35.411 4.248 392 HB VAL 357 HB VAL 357 13.194 35.093 2.217 393 HG11 VAL 357 1HG1 VAL 357 14.300 33.623 3.885 394 HG12 VAL 357 2HG1 VAL 357 13.035 34.001 5.057 395 HG13 VAL 357 3HG1 VAL 357 14.122 35.272 4.497 396 HG21 VAL 357 1HG2 VAL 357 11.277 33.009 3.336 397 HG22 VAL 357 2HG2 VAL 357 12.636 32.673 2.259 398 HG23 VAL 357 3HG2 VAL 357 11.277 33.644 1.688 399 HA PRO 358 HA PRO 358 12.611 39.506 5.345 400 HB2 PRO 358 2HB PRO 358 13.322 38.156 7.927 401 HB3 PRO 358 1HB PRO 358 12.365 39.619 7.656 402 HG2 PRO 358 2HG PRO 358 11.175 37.328 8.366 403 HG3 PRO 358 1HG PRO 358 10.415 38.409 7.176 404 HD2 PRO 358 2HD PRO 358 11.983 35.869 6.700 405 HD3 PRO 358 1HD PRO 358 10.464 36.413 5.948 406 HA PRO 359 HA PRO 359 17.022 38.707 4.605 407 HB2 PRO 359 2HB PRO 359 17.994 41.217 4.720 408 HB3 PRO 359 1HB PRO 359 16.865 40.739 3.441 409 HG2 PRO 359 2HG PRO 359 16.287 42.204 6.026 410 HG3 PRO 359 1HG PRO 359 15.762 42.614 4.377 411 HD2 PRO 359 2HD PRO 359 14.162 41.259 6.152 412 HD3 PRO 359 1HD PRO 359 14.052 41.030 4.391 413 H GLU 360 H GLU 360 15.754 39.086 7.531 414 HA GLU 360 HA GLU 360 17.826 39.979 9.230 415 HB2 GLU 360 2HB GLU 360 15.539 38.078 9.910 416 HB3 GLU 360 1HB GLU 360 16.419 39.117 11.028 417 HG2 GLU 360 2HG GLU 360 14.607 40.081 8.795 418 HG3 GLU 360 1HG GLU 360 14.141 39.940 10.488 419 HA PRO 361 HA PRO 361 20.350 36.160 9.246 420 HB2 PRO 361 2HB PRO 361 21.924 36.690 11.413 421 HB3 PRO 361 1HB PRO 361 22.128 37.547 9.879 422 HG2 PRO 361 2HG PRO 361 20.630 38.429 12.352 423 HG3 PRO 361 1HG PRO 361 21.804 39.343 11.378 424 HD2 PRO 361 2HD PRO 361 19.122 39.670 11.064 425 HD3 PRO 361 1HD PRO 361 20.246 39.797 9.691 426 H GLU 362 H GLU 362 18.235 37.224 11.729 427 HA GLU 362 HA GLU 362 18.035 34.528 12.933 428 HB2 GLU 362 2HB GLU 362 17.336 35.660 15.035 429 HB3 GLU 362 1HB GLU 362 18.985 36.070 14.574 430 HG2 GLU 362 2HG GLU 362 18.235 38.242 13.716 431 HG3 GLU 362 1HG GLU 362 16.559 37.830 14.099 432 H TRP 363 H TRP 363 15.897 33.813 13.331 433 HA TRP 363 HA TRP 363 13.648 35.464 12.429 434 HB2 TRP 363 2HB TRP 363 14.530 34.114 10.455 435 HB3 TRP 363 1HB TRP 363 14.069 32.658 11.326 436 HD1 TRP 363 HD1 TRP 363 12.549 35.636 9.433 437 HE1 TRP 363 HE1 TRP 363 10.096 35.115 8.888 438 HE3 TRP 363 HE3 TRP 363 11.968 31.328 12.165 439 HZ2 TRP 363 HZ2 TRP 363 8.211 33.152 9.478 440 HZ3 TRP 363 HZ3 TRP 363 9.774 30.205 12.116 441 HH2 TRP 363 HH2 TRP 363 7.923 31.113 10.810 442 H TYR 364 H TYR 364 12.717 35.523 14.348 443 HA TYR 364 HA TYR 364 11.816 33.019 15.640 444 HB2 TYR 364 2HB TYR 364 11.932 35.844 16.819 445 HB3 TYR 364 1HB TYR 364 11.498 34.371 17.684 446 HD1 TYR 364 HD1 TYR 364 14.312 36.361 16.341 447 HD2 TYR 364 HD2 TYR 364 13.267 32.723 18.327 448 HE1 TYR 364 HE1 TYR 364 16.673 35.982 16.916 449 HE2 TYR 364 HE2 TYR 364 15.622 32.349 18.887 450 HH TYR 364 HH TYR 364 17.813 32.985 18.121 451 H CYS 365 H CYS 365 9.710 32.544 15.244 452 HA CYS 365 HA CYS 365 8.018 33.997 13.566 453 HB2 CYS 365 2HB CYS 365 6.272 32.381 14.108 454 HB3 CYS 365 1HB CYS 365 7.809 31.533 14.024 455 HA PRO 366 HA PRO 366 5.749 37.340 15.585 456 HB2 PRO 366 2HB PRO 366 3.437 35.373 15.392 457 HB3 PRO 366 1HB PRO 366 3.428 37.126 15.128 458 HG2 PRO 366 2HG PRO 366 3.627 35.387 13.075 459 HG3 PRO 366 1HG PRO 366 4.443 36.962 13.051 460 HD2 PRO 366 2HD PRO 366 5.623 34.281 13.218 461 HD3 PRO 366 1HD PRO 366 6.424 35.830 12.907 462 H SER 367 H SER 367 4.597 34.197 16.852 463 HA SER 367 HA SER 367 3.692 35.074 19.341 464 HB2 SER 367 2HB SER 367 4.734 32.300 18.640 465 HB3 SER 367 1HB SER 367 3.555 32.699 19.895 466 HG SER 367 HG SER 367 2.132 32.399 18.377 467 H CYS 368 H CYS 368 6.918 33.983 18.365 468 HA CYS 368 HA CYS 368 8.097 33.800 20.950 469 HB2 CYS 368 2HB CYS 368 9.193 33.905 18.139 470 HB3 CYS 368 1HB CYS 368 10.293 33.955 19.524 471 H ARG 369 H ARG 369 7.683 36.512 18.718 472 HA ARG 369 HA ARG 369 9.589 38.144 20.262 473 HB2 ARG 369 2HB ARG 369 9.379 39.806 18.404 474 HB3 ARG 369 1HB ARG 369 9.979 38.237 17.906 475 HG2 ARG 369 2HG ARG 369 8.537 38.824 16.169 476 HG3 ARG 369 1HG ARG 369 7.558 37.739 17.149 477 HD2 ARG 369 2HD ARG 369 6.401 39.673 18.153 478 HD3 ARG 369 1HD ARG 369 7.409 40.780 17.218 479 HE ARG 369 HE ARG 369 5.130 39.252 16.295 480 HH11 ARG 369 1HH1 ARG 369 7.984 41.041 15.259 481 HH12 ARG 369 2HH1 ARG 369 7.377 41.296 13.656 482 HH21 ARG 369 1HH2 ARG 369 4.358 39.611 14.186 483 HH22 ARG 369 2HH2 ARG 369 5.333 40.499 13.058 484 H THR 370 H THR 370 6.213 37.638 20.124 485 HA THR 370 HA THR 370 5.669 40.237 21.467 486 HB THR 370 HB THR 370 4.385 39.929 19.352 487 HG1 THR 370 HG1 THR 370 3.286 41.146 20.800 488 HG21 THR 370 1HG2 THR 370 4.148 37.472 19.334 489 HG22 THR 370 2HG2 THR 370 2.582 38.258 19.191 490 HG23 THR 370 3HG2 THR 370 3.081 37.552 20.729 491 H ASP 371 H ASP 371 3.848 40.088 23.095 492 HA ASP 371 HA ASP 371 4.232 38.134 25.112 493 HB2 ASP 371 2HB ASP 371 1.910 40.060 24.698 494 HB3 ASP 371 1HB ASP 371 2.167 39.118 26.167 495 H SER 372 H SER 372 2.262 38.237 22.295 496 HA SER 372 HA SER 372 1.114 36.709 21.124 497 HB2 SER 372 2HB SER 372 2.896 35.098 21.918 498 HB3 SER 372 1HB SER 372 1.842 34.656 23.260 499 HG SER 372 HG SER 372 0.301 33.977 21.672 500 H SER 373 H SER 373 0.098 38.158 23.680 501 HA SER 373 HA SER 373 -1.724 38.393 24.985 502 HB2 SER 373 2HB SER 373 -3.131 36.990 22.668 503 HB3 SER 373 1HB SER 373 -3.927 37.954 23.916 504 HG SER 373 HG SER 373 -2.930 38.801 21.648 505 H GLU 374 H GLU 374 -0.148 36.377 25.800 506 HA GLU 374 HA GLU 374 -1.403 33.854 26.187 507 HB2 GLU 374 2HB GLU 374 0.442 33.472 27.864 508 HB3 GLU 374 1HB GLU 374 0.995 33.964 26.276 509 HG2 GLU 374 2HG GLU 374 2.390 35.101 27.805 510 HG3 GLU 374 1HG GLU 374 1.273 36.318 27.204 511 H VAL 375 H VAL 375 -2.007 32.944 28.324 512 HA VAL 375 HA VAL 375 -3.961 34.578 29.609 513 HB VAL 375 HB VAL 375 -4.442 32.221 29.389 514 HG11 VAL 375 1HG1 VAL 375 -2.175 31.268 29.405 515 HG12 VAL 375 2HG1 VAL 375 -3.204 30.425 30.565 516 HG13 VAL 375 3HG1 VAL 375 -2.024 31.609 31.130 517 HG21 VAL 375 1HG2 VAL 375 -4.035 32.890 32.327 518 HG22 VAL 375 2HG2 VAL 375 -5.125 31.652 31.699 519 HG23 VAL 375 3HG2 VAL 375 -5.426 33.355 31.344 520 H VAL 376 H VAL 376 -3.233 36.265 30.758 521 HA VAL 376 HA VAL 376 -0.896 36.394 32.343 522 HB VAL 376 HB VAL 376 -1.808 38.507 33.282 523 HG11 VAL 376 1HG1 VAL 376 -2.316 38.294 30.290 524 HG12 VAL 376 2HG1 VAL 376 -0.752 38.583 31.052 525 HG13 VAL 376 3HG1 VAL 376 -2.034 39.790 31.187 526 HG21 VAL 376 1HG2 VAL 376 -4.401 37.822 31.834 527 HG22 VAL 376 2HG2 VAL 376 -4.056 39.350 32.649 528 HG23 VAL 376 3HG2 VAL 376 -4.171 37.858 33.585 529 H GLN 377 H GLN 377 -0.649 36.344 34.629 530 HA GLN 377 HA GLN 377 -2.138 34.335 35.985 531 HB2 GLN 377 2HB GLN 377 -0.729 34.722 37.897 532 HB3 GLN 377 1HB GLN 377 0.283 34.886 36.474 533 HG2 GLN 377 2HG GLN 377 -0.831 37.194 38.105 534 HG3 GLN 377 1HG GLN 377 0.800 36.541 38.251 535 HE21 GLN 377 1HE2 GLN 377 -1.351 38.495 36.336 536 HE22 GLN 377 2HE2 GLN 377 -0.153 39.152 35.282 537 H ALA 378 H ALA 378 -3.633 34.514 37.710 538 HA ALA 378 HA ALA 378 -5.380 36.805 37.710 539 HB1 ALA 378 1HB ALA 378 -5.355 34.382 39.556 540 HB2 ALA 378 2HB ALA 378 -6.251 34.518 38.041 541 HB3 ALA 378 3HB ALA 378 -6.668 35.555 39.405 542 H GLY 379 H GLY 379 -6.079 37.694 39.984 543 HA2 GLY 379 2HA GLY 379 -5.416 38.340 42.206 544 HA3 GLY 379 1HA GLY 379 -3.729 38.219 41.729 545 H GLU 380 H GLU 380 -6.602 39.836 40.428 546 HA GLU 380 HA GLU 380 -5.295 42.224 39.596 547 HB2 GLU 380 2HB GLU 380 -7.711 43.048 39.283 548 HB3 GLU 380 1HB GLU 380 -7.245 41.598 38.400 549 HG2 GLU 380 2HG GLU 380 -8.342 40.239 40.240 550 HG3 GLU 380 1HG GLU 380 -8.970 41.753 40.895 Start of MODEL 13 1 H1 SER 303 H SER 303 15.715 10.810 1.364 2 HA SER 303 HA SER 303 18.380 10.585 2.556 3 HB2 SER 303 2HB SER 303 18.054 10.661 0.070 4 HB3 SER 303 1HB SER 303 17.376 12.281 0.218 5 HG SER 303 HG SER 303 19.318 13.067 0.394 6 H GLY 304 H GLY 304 16.602 11.514 4.414 7 HA2 GLY 304 2HA GLY 304 17.661 14.113 5.126 8 HA3 GLY 304 1HA GLY 304 15.933 14.112 4.769 9 HA PRO 305 HA PRO 305 16.244 13.162 9.327 10 HB2 PRO 305 2HB PRO 305 13.726 14.197 9.922 11 HB3 PRO 305 1HB PRO 305 15.214 15.153 9.902 12 HG2 PRO 305 2HG PRO 305 13.119 14.849 7.751 13 HG3 PRO 305 1HG PRO 305 13.921 16.327 8.332 14 HD2 PRO 305 2HD PRO 305 14.701 15.127 6.049 15 HD3 PRO 305 1HD PRO 305 15.897 15.874 7.132 16 H SER 306 H SER 306 15.731 11.191 10.082 17 HA SER 306 HA SER 306 14.055 9.329 8.707 18 HB2 SER 306 2HB SER 306 15.311 9.125 11.485 19 HB3 SER 306 1HB SER 306 14.689 7.772 10.528 20 HG SER 306 HG SER 306 17.101 9.008 10.406 21 H CYS 307 H CYS 307 12.193 8.150 9.738 22 HA CYS 307 HA CYS 307 10.500 9.975 11.374 23 HB2 CYS 307 2HB CYS 307 9.747 8.562 8.786 24 HB3 CYS 307 1HB CYS 307 8.578 9.330 9.864 25 H ARG 308 H ARG 308 10.707 8.745 13.249 26 HA ARG 308 HA ARG 308 9.416 6.068 13.242 27 HB2 ARG 308 2HB ARG 308 10.491 5.700 15.441 28 HB3 ARG 308 1HB ARG 308 11.684 6.087 14.208 29 HG2 ARG 308 2HG ARG 308 11.753 8.443 15.073 30 HG3 ARG 308 1HG ARG 308 10.657 7.963 16.366 31 HD2 ARG 308 2HD ARG 308 12.324 6.411 17.248 32 HD3 ARG 308 1HD ARG 308 13.409 6.774 15.897 33 HE ARG 308 HE ARG 308 12.546 8.952 17.689 34 HH11 ARG 308 1HH1 ARG 308 15.174 6.938 16.542 35 HH12 ARG 308 2HH1 ARG 308 16.402 7.988 17.164 36 HH21 ARG 308 1HH2 ARG 308 14.162 10.305 18.513 37 HH22 ARG 308 2HH2 ARG 308 15.831 9.889 18.282 38 H PHE 309 H PHE 309 9.455 9.224 14.886 39 HA PHE 309 HA PHE 309 7.219 8.718 16.602 40 HB2 PHE 309 2HB PHE 309 7.329 11.305 16.913 41 HB3 PHE 309 1HB PHE 309 8.668 10.331 17.496 42 HD1 PHE 309 HD1 PHE 309 7.606 12.779 14.917 43 HD2 PHE 309 HD2 PHE 309 10.892 10.536 16.493 44 HE1 PHE 309 HE1 PHE 309 9.190 14.177 13.639 45 HE2 PHE 309 HE2 PHE 309 12.454 11.940 15.214 46 HZ PHE 309 HZ PHE 309 11.610 13.756 13.792 47 H CYS 310 H CYS 310 7.610 10.212 13.451 48 HA CYS 310 HA CYS 310 4.989 11.194 13.088 49 HB2 CYS 310 2HB CYS 310 6.759 10.019 10.916 50 HB3 CYS 310 1HB CYS 310 5.433 11.157 10.697 51 H LYS 311 H LYS 311 6.440 8.018 12.886 52 HA LYS 311 HA LYS 311 5.910 5.973 12.114 53 HB2 LYS 311 2HB LYS 311 3.112 6.860 12.933 54 HB3 LYS 311 1HB LYS 311 3.514 5.207 12.471 55 HG2 LYS 311 2HG LYS 311 5.154 5.133 14.374 56 HG3 LYS 311 1HG LYS 311 4.603 6.738 14.864 57 HD2 LYS 311 2HD LYS 311 3.542 4.913 16.194 58 HD3 LYS 311 1HD LYS 311 2.356 5.880 15.319 59 HE2 LYS 311 2HE LYS 311 1.897 3.413 15.247 60 HE3 LYS 311 1HE LYS 311 2.079 4.127 13.647 61 HZ1 LYS 311 1HZ LYS 311 3.222 1.984 13.955 62 HZ2 LYS 311 2HZ LYS 311 4.259 2.713 15.073 63 HZ3 LYS 311 3HZ LYS 311 4.254 3.228 13.463 64 H ASP 312 H ASP 312 5.866 8.263 10.258 65 HA ASP 312 HA ASP 312 4.957 9.314 8.488 66 HB2 ASP 312 2HB ASP 312 4.921 6.443 7.503 67 HB3 ASP 312 1HB ASP 312 4.748 7.852 6.458 68 H ASP 313 H ASP 313 3.137 10.296 9.005 69 HA ASP 313 HA ASP 313 0.871 9.151 10.161 70 HB2 ASP 313 2HB ASP 313 1.161 11.860 8.772 71 HB3 ASP 313 1HB ASP 313 -0.181 11.417 9.828 72 H GLU 314 H GLU 314 -1.246 8.764 9.424 73 HA GLU 314 HA GLU 314 -1.410 7.545 6.851 74 HB2 GLU 314 2HB GLU 314 -2.562 6.764 8.987 75 HB3 GLU 314 1HB GLU 314 -3.678 8.112 8.821 76 HG2 GLU 314 2HG GLU 314 -3.361 5.882 6.773 77 HG3 GLU 314 1HG GLU 314 -4.544 5.860 8.079 78 H ASN 315 H ASN 315 -2.973 10.383 8.320 79 HA ASN 315 HA ASN 315 -4.674 11.001 6.143 80 HB2 ASN 315 2HB ASN 315 -3.726 12.819 8.407 81 HB3 ASN 315 1HB ASN 315 -5.112 13.123 7.370 82 HD21 ASN 315 1HD2 ASN 315 -5.995 10.287 7.409 83 HD22 ASN 315 2HD2 ASN 315 -6.686 10.051 8.970 84 H LYS 316 H LYS 316 -1.548 12.317 7.154 85 HA LYS 316 HA LYS 316 -1.112 13.584 4.518 86 HB2 LYS 316 2HB LYS 316 -0.634 14.884 7.251 87 HB3 LYS 316 1HB LYS 316 -0.033 15.541 5.727 88 HG2 LYS 316 2HG LYS 316 -2.401 15.755 4.934 89 HG3 LYS 316 1HG LYS 316 -2.949 15.196 6.519 90 HD2 LYS 316 2HD LYS 316 -1.931 17.145 7.595 91 HD3 LYS 316 1HD LYS 316 -1.256 17.683 6.055 92 HE2 LYS 316 2HE LYS 316 -3.596 17.931 5.188 93 HE3 LYS 316 1HE LYS 316 -4.194 17.547 6.807 94 HZ1 LYS 316 1HZ LYS 316 -4.087 19.924 6.421 95 HZ2 LYS 316 2HZ LYS 316 -2.427 19.830 6.109 96 HZ3 LYS 316 3HZ LYS 316 -3.019 19.467 7.652 97 HA PRO 317 HA PRO 317 2.886 11.578 4.289 98 HB2 PRO 317 2HB PRO 317 4.079 14.369 4.204 99 HB3 PRO 317 1HB PRO 317 4.456 12.963 3.190 100 HG2 PRO 317 2HG PRO 317 2.873 14.900 2.266 101 HG3 PRO 317 1HG PRO 317 2.483 13.199 1.925 102 HD2 PRO 317 2HD PRO 317 1.176 15.101 3.837 103 HD3 PRO 317 1HD PRO 317 0.471 13.748 2.931 104 H CYS 318 H CYS 318 3.084 14.493 6.330 105 HA CYS 318 HA CYS 318 3.951 12.978 8.639 106 HB2 CYS 318 2HB CYS 318 5.776 14.964 7.262 107 HB3 CYS 318 1HB CYS 318 5.903 14.675 8.993 108 H ARG 319 H ARG 319 3.622 14.038 10.565 109 HA ARG 319 HA ARG 319 2.215 16.620 10.568 110 HB2 ARG 319 2HB ARG 319 1.371 14.575 11.868 111 HB3 ARG 319 1HB ARG 319 2.776 14.732 12.908 112 HG2 ARG 319 2HG ARG 319 0.921 15.730 14.041 113 HG3 ARG 319 1HG ARG 319 1.992 17.041 13.536 114 HD2 ARG 319 2HD ARG 319 0.526 17.588 11.675 115 HD3 ARG 319 1HD ARG 319 -0.493 16.181 12.006 116 HE ARG 319 HE ARG 319 -0.291 18.628 13.645 117 HH11 ARG 319 1HH1 ARG 319 -1.970 15.617 12.965 118 HH12 ARG 319 2HH1 ARG 319 -3.357 16.033 13.921 119 HH21 ARG 319 1HH2 ARG 319 -2.103 19.190 14.862 120 HH22 ARG 319 2HH2 ARG 319 -3.429 18.077 15.004 121 H LYS 320 H LYS 320 4.953 15.004 12.288 122 HA LYS 320 HA LYS 320 5.959 17.537 13.313 123 HB2 LYS 320 2HB LYS 320 6.783 14.653 13.784 124 HB3 LYS 320 1HB LYS 320 7.701 15.996 14.435 125 HG2 LYS 320 2HG LYS 320 6.332 15.293 16.214 126 HG3 LYS 320 1HG LYS 320 5.557 16.755 15.601 127 HD2 LYS 320 2HD LYS 320 3.954 15.299 14.318 128 HD3 LYS 320 1HD LYS 320 4.699 13.880 15.067 129 HE2 LYS 320 2HE LYS 320 3.252 16.129 16.517 130 HE3 LYS 320 1HE LYS 320 2.637 14.497 16.243 131 HZ1 LYS 320 1HZ LYS 320 4.465 13.643 17.592 132 HZ2 LYS 320 2HZ LYS 320 3.506 14.727 18.467 133 HZ3 LYS 320 3HZ LYS 320 5.014 15.214 17.875 134 H CYS 321 H CYS 321 6.317 16.532 10.315 135 HA CYS 321 HA CYS 321 9.053 17.697 10.142 136 HB2 CYS 321 2HB CYS 321 7.790 15.755 8.158 137 HB3 CYS 321 1HB CYS 321 9.330 16.572 7.928 138 H ALA 322 H ALA 322 5.988 18.569 10.015 139 HA ALA 322 HA ALA 322 6.069 20.058 7.455 140 HB1 ALA 322 1HB ALA 322 3.639 19.160 9.065 141 HB2 ALA 322 2HB ALA 322 4.244 18.391 7.595 142 HB3 ALA 322 3HB ALA 322 3.605 20.032 7.527 143 H CYS 323 H CYS 323 4.618 22.062 7.549 144 HA CYS 323 HA CYS 323 5.316 23.813 9.754 145 HB2 CYS 323 2HB CYS 323 5.292 25.032 7.764 146 HB3 CYS 323 1HB CYS 323 3.931 24.146 7.101 147 H HIS 324 H HIS 324 4.201 23.839 11.598 148 HA HIS 324 HA HIS 324 2.109 22.012 12.070 149 HB2 HIS 324 2HB HIS 324 3.878 22.684 13.716 150 HB3 HIS 324 1HB HIS 324 3.129 24.266 13.863 151 HD1 HIS 324 HD1 HIS 324 2.713 20.681 14.920 152 HD2 HIS 324 HD2 HIS 324 0.790 24.330 15.455 153 HE1 HIS 324 HE1 HIS 324 1.050 20.341 16.784 154 H VAL 325 H VAL 325 2.070 25.342 11.189 155 HA VAL 325 HA VAL 325 -0.329 26.190 12.417 156 HB VAL 325 HB VAL 325 0.917 27.449 9.943 157 HG11 VAL 325 1HG1 VAL 325 0.043 29.578 10.854 158 HG12 VAL 325 2HG1 VAL 325 -0.667 28.712 12.220 159 HG13 VAL 325 3HG1 VAL 325 -1.257 28.416 10.584 160 HG21 VAL 325 1HG2 VAL 325 2.730 27.093 11.549 161 HG22 VAL 325 2HG2 VAL 325 1.789 27.857 12.833 162 HG23 VAL 325 3HG2 VAL 325 2.340 28.813 11.456 163 H CYS 326 H CYS 326 0.347 24.670 9.302 164 HA CYS 326 HA CYS 326 -2.565 24.511 8.725 165 HB2 CYS 326 2HB CYS 326 -2.087 24.726 6.321 166 HB3 CYS 326 1HB CYS 326 -1.515 26.143 7.189 167 H GLY 327 H GLY 327 0.084 22.774 9.557 168 HA2 GLY 327 2HA GLY 327 0.700 20.582 9.526 169 HA3 GLY 327 1HA GLY 327 -0.951 20.222 9.057 170 H GLY 328 H GLY 328 1.498 22.051 7.201 171 HA2 GLY 328 2HA GLY 328 1.735 19.877 5.226 172 HA3 GLY 328 1HA GLY 328 0.942 21.357 4.699 173 H ARG 329 H ARG 329 3.361 20.148 3.680 174 HA ARG 329 HA ARG 329 5.391 22.249 4.214 175 HB2 ARG 329 2HB ARG 329 5.680 19.576 2.768 176 HB3 ARG 329 1HB ARG 329 6.982 20.740 3.031 177 HG2 ARG 329 2HG ARG 329 6.731 20.398 5.495 178 HG3 ARG 329 1HG ARG 329 5.492 19.183 5.173 179 HD2 ARG 329 2HD ARG 329 7.596 18.062 5.604 180 HD3 ARG 329 1HD ARG 329 7.175 17.849 3.899 181 HE ARG 329 HE ARG 329 8.894 20.108 4.349 182 HH11 ARG 329 1HH1 ARG 329 8.936 16.621 3.888 183 HH12 ARG 329 2HH1 ARG 329 10.600 16.599 3.410 184 HH21 ARG 329 1HH2 ARG 329 11.051 20.035 3.705 185 HH22 ARG 329 2HH2 ARG 329 11.785 18.516 3.308 186 H GLU 330 H GLU 330 2.830 22.234 2.469 187 HA GLU 330 HA GLU 330 3.570 22.282 -0.273 188 HB2 GLU 330 2HB GLU 330 1.208 23.719 1.020 189 HB3 GLU 330 1HB GLU 330 1.349 23.220 -0.672 190 HG2 GLU 330 2HG GLU 330 1.314 20.853 0.017 191 HG3 GLU 330 1HG GLU 330 1.228 21.325 1.711 192 H ALA 331 H ALA 331 4.382 23.931 -1.509 193 HA ALA 331 HA ALA 331 5.635 25.722 -2.036 194 HB1 ALA 331 1HB ALA 331 3.725 27.145 -1.434 195 HB2 ALA 331 2HB ALA 331 5.256 27.928 -1.049 196 HB3 ALA 331 3HB ALA 331 4.277 27.208 0.237 197 HA PRO 332 HA PRO 332 8.596 24.220 1.178 198 HB2 PRO 332 2HB PRO 332 10.649 23.588 -0.511 199 HB3 PRO 332 1HB PRO 332 9.229 22.544 -0.318 200 HG2 PRO 332 2HG PRO 332 9.794 24.601 -2.463 201 HG3 PRO 332 1HG PRO 332 9.224 22.926 -2.646 202 HD2 PRO 332 2HD PRO 332 7.520 25.036 -2.723 203 HD3 PRO 332 1HD PRO 332 7.034 23.468 -2.038 204 H GLU 333 H GLU 333 9.223 26.583 -1.374 205 HA GLU 333 HA GLU 333 11.626 27.655 -0.199 206 HB2 GLU 333 2HB GLU 333 11.597 29.332 -1.975 207 HB3 GLU 333 1HB GLU 333 11.291 27.740 -2.654 208 HG2 GLU 333 2HG GLU 333 9.096 29.761 -2.066 209 HG3 GLU 333 1HG GLU 333 9.927 29.651 -3.619 210 H LYS 334 H LYS 334 8.248 28.201 0.215 211 HA LYS 334 HA LYS 334 8.602 30.877 1.370 212 HB2 LYS 334 2HB LYS 334 6.003 29.325 1.022 213 HB3 LYS 334 1HB LYS 334 6.189 31.050 1.353 214 HG2 LYS 334 2HG LYS 334 7.392 31.191 -0.920 215 HG3 LYS 334 1HG LYS 334 6.803 29.555 -1.213 216 HD2 LYS 334 2HD LYS 334 5.229 31.008 -2.269 217 HD3 LYS 334 1HD LYS 334 4.437 30.459 -0.788 218 HE2 LYS 334 2HE LYS 334 4.065 32.858 -1.056 219 HE3 LYS 334 1HE LYS 334 5.136 32.601 0.322 220 HZ1 LYS 334 1HZ LYS 334 5.892 34.409 -1.088 221 HZ2 LYS 334 2HZ LYS 334 6.004 33.367 -2.416 222 HZ3 LYS 334 3HZ LYS 334 7.017 33.149 -1.078 223 H GLN 335 H GLN 335 9.310 28.033 2.634 224 HA GLN 335 HA GLN 335 7.756 28.145 5.100 225 HB2 GLN 335 2HB GLN 335 10.044 26.276 4.334 226 HB3 GLN 335 1HB GLN 335 9.063 26.149 5.796 227 HG2 GLN 335 2HG GLN 335 7.048 25.857 4.300 228 HG3 GLN 335 1HG GLN 335 8.154 25.754 2.930 229 HE21 GLN 335 1HE2 GLN 335 7.607 23.648 2.421 230 HE22 GLN 335 2HE2 GLN 335 8.035 22.308 3.419 231 H LEU 336 H LEU 336 8.488 28.684 7.055 232 HA LEU 336 HA LEU 336 11.283 29.572 7.498 233 HB2 LEU 336 2HB LEU 336 8.710 30.836 8.566 234 HB3 LEU 336 1HB LEU 336 10.314 31.226 9.174 235 HG LEU 336 HG LEU 336 9.438 31.708 6.289 236 HD11 LEU 336 1HD1 LEU 336 9.600 33.714 8.559 237 HD12 LEU 336 2HD1 LEU 336 8.119 33.115 7.809 238 HD13 LEU 336 3HD1 LEU 336 9.251 34.081 6.868 239 HD21 LEU 336 1HD2 LEU 336 11.896 32.692 7.800 240 HD22 LEU 336 2HD2 LEU 336 11.461 33.116 6.143 241 HD23 LEU 336 3HD2 LEU 336 11.885 31.453 6.537 242 H LEU 337 H LEU 337 11.936 29.288 9.803 243 HA LEU 337 HA LEU 337 10.317 27.327 11.297 244 HB2 LEU 337 2HB LEU 337 12.144 26.310 9.619 245 HB3 LEU 337 1HB LEU 337 13.258 26.713 10.909 246 HG LEU 337 HG LEU 337 10.845 24.871 11.241 247 HD11 LEU 337 1HD1 LEU 337 12.436 22.997 11.197 248 HD12 LEU 337 2HD1 LEU 337 13.758 24.114 10.846 249 HD13 LEU 337 3HD1 LEU 337 12.455 23.895 9.678 250 HD21 LEU 337 1HD2 LEU 337 13.193 25.366 13.114 251 HD22 LEU 337 2HD2 LEU 337 11.906 24.180 13.362 252 HD23 LEU 337 3HD2 LEU 337 11.530 25.901 13.366 253 H CYS 338 H CYS 338 10.218 27.949 13.353 254 HA CYS 338 HA CYS 338 12.090 29.909 14.452 255 HB2 CYS 338 2HB CYS 338 9.600 30.041 14.928 256 HB3 CYS 338 1HB CYS 338 9.742 28.532 15.843 257 H ASP 339 H ASP 339 14.049 29.001 14.972 258 HA ASP 339 HA ASP 339 14.629 26.367 15.686 259 HB2 ASP 339 2HB ASP 339 16.094 28.941 16.428 260 HB3 ASP 339 1HB ASP 339 16.781 27.325 16.630 261 H GLU 340 H GLU 340 13.713 29.102 17.670 262 HA GLU 340 HA GLU 340 14.301 28.115 20.239 263 HB2 GLU 340 2HB GLU 340 13.954 30.506 19.569 264 HB3 GLU 340 1HB GLU 340 12.231 30.191 19.408 265 HG2 GLU 340 2HG GLU 340 12.022 29.797 21.778 266 HG3 GLU 340 1HG GLU 340 13.768 29.853 21.995 267 H CYS 341 H CYS 341 11.636 27.429 18.129 268 HA CYS 341 HA CYS 341 10.121 26.080 20.304 269 HB2 CYS 341 2HB CYS 341 9.089 27.354 17.738 270 HB3 CYS 341 1HB CYS 341 8.098 26.408 18.851 271 H ASP 342 H ASP 342 11.950 25.593 17.496 272 HA ASP 342 HA ASP 342 12.261 24.014 15.933 273 HB2 ASP 342 2HB ASP 342 11.045 22.214 18.068 274 HB3 ASP 342 1HB ASP 342 11.853 21.605 16.633 275 H MET 343 H MET 343 9.574 25.407 16.069 276 HA MET 343 HA MET 343 7.870 23.508 14.584 277 HB2 MET 343 2HB MET 343 7.226 26.080 16.083 278 HB3 MET 343 1HB MET 343 6.076 25.337 14.972 279 HG2 MET 343 2HG MET 343 7.234 24.048 17.457 280 HG3 MET 343 1HG MET 343 5.597 24.682 17.258 281 HE1 MET 343 1HE MET 343 4.950 22.125 18.246 282 HE2 MET 343 2HE MET 343 6.627 21.582 18.116 283 HE3 MET 343 3HE MET 343 5.336 20.657 17.347 284 H ALA 344 H ALA 344 7.341 23.814 12.563 285 HA ALA 344 HA ALA 344 8.753 25.881 11.023 286 HB1 ALA 344 1HB ALA 344 8.287 24.485 9.056 287 HB2 ALA 344 2HB ALA 344 7.335 23.373 10.047 288 HB3 ALA 344 3HB ALA 344 9.067 23.548 10.333 289 H PHE 345 H PHE 345 7.628 26.853 9.196 290 HA PHE 345 HA PHE 345 4.831 27.604 9.627 291 HB2 PHE 345 2HB PHE 345 7.182 29.556 9.855 292 HB3 PHE 345 1HB PHE 345 5.549 30.095 9.488 293 HD1 PHE 345 HD1 PHE 345 7.591 28.366 12.089 294 HD2 PHE 345 HD2 PHE 345 3.988 30.494 11.219 295 HE1 PHE 345 HE1 PHE 345 7.077 28.489 14.479 296 HE2 PHE 345 HE2 PHE 345 3.479 30.605 13.628 297 HZ PHE 345 HZ PHE 345 5.021 29.599 15.255 298 H HIS 346 H HIS 346 4.366 29.453 7.977 299 HA HIS 346 HA HIS 346 5.978 29.342 5.515 300 HB2 HIS 346 2HB HIS 346 2.937 29.096 5.715 301 HB3 HIS 346 1HB HIS 346 3.708 29.690 4.257 302 HD2 HIS 346 HD2 HIS 346 5.749 27.746 3.324 303 HE1 HIS 346 HE1 HIS 346 3.149 24.597 4.379 304 HE2 HIS 346 HE2 HIS 346 4.996 25.333 2.829 305 H LEU 347 H LEU 347 5.691 31.330 4.245 306 HA LEU 347 HA LEU 347 5.779 33.726 5.711 307 HB2 LEU 347 2HB LEU 347 5.247 33.242 2.756 308 HB3 LEU 347 1HB LEU 347 5.610 34.819 3.449 309 HG LEU 347 HG LEU 347 7.526 32.446 3.521 310 HD11 LEU 347 1HD1 LEU 347 7.218 33.177 1.209 311 HD12 LEU 347 2HD1 LEU 347 8.822 33.615 1.793 312 HD13 LEU 347 3HD1 LEU 347 7.564 34.846 1.669 313 HD21 LEU 347 1HD2 LEU 347 7.860 34.042 5.366 314 HD22 LEU 347 2HD2 LEU 347 8.005 35.364 4.205 315 HD23 LEU 347 3HD2 LEU 347 9.208 34.071 4.231 316 H TYR 348 H TYR 348 3.158 32.265 3.774 317 HA TYR 348 HA TYR 348 1.234 34.318 4.360 318 HB2 TYR 348 2HB TYR 348 -0.404 32.771 3.244 319 HB3 TYR 348 1HB TYR 348 0.994 33.177 2.270 320 HD1 TYR 348 HD1 TYR 348 -0.692 30.423 4.117 321 HD2 TYR 348 HD2 TYR 348 2.613 31.440 1.589 322 HE1 TYR 348 HE1 TYR 348 -0.296 28.032 3.653 323 HE2 TYR 348 HE2 TYR 348 2.992 29.050 1.129 324 HH TYR 348 HH TYR 348 0.747 26.653 1.817 325 H CYS 349 H CYS 349 2.390 31.656 6.158 326 HA CYS 349 HA CYS 349 -0.041 31.359 7.799 327 HB2 CYS 349 2HB CYS 349 2.619 29.867 7.893 328 HB3 CYS 349 1HB CYS 349 1.279 29.574 9.006 329 H LEU 350 H LEU 350 1.718 33.839 7.726 330 HA LEU 350 HA LEU 350 2.370 34.060 10.614 331 HB2 LEU 350 2HB LEU 350 3.392 35.779 8.306 332 HB3 LEU 350 1HB LEU 350 3.831 35.960 10.001 333 HG LEU 350 HG LEU 350 4.562 33.637 8.177 334 HD11 LEU 350 1HD1 LEU 350 6.877 34.405 8.521 335 HD12 LEU 350 2HD1 LEU 350 6.292 35.765 9.480 336 HD13 LEU 350 3HD1 LEU 350 5.885 35.649 7.766 337 HD21 LEU 350 1HD2 LEU 350 5.158 33.974 11.143 338 HD22 LEU 350 2HD2 LEU 350 5.834 32.719 10.100 339 HD23 LEU 350 3HD2 LEU 350 4.102 32.761 10.415 340 H LYS 351 H LYS 351 2.148 36.422 11.378 341 HA LYS 351 HA LYS 351 -0.015 37.970 10.150 342 HB2 LYS 351 2HB LYS 351 -0.895 36.260 11.984 343 HB3 LYS 351 1HB LYS 351 -0.203 37.394 13.136 344 HG2 LYS 351 2HG LYS 351 -2.348 38.058 11.078 345 HG3 LYS 351 1HG LYS 351 -2.658 37.685 12.775 346 HD2 LYS 351 2HD LYS 351 -1.316 39.718 13.409 347 HD3 LYS 351 1HD LYS 351 -1.127 40.089 11.692 348 HE2 LYS 351 2HE LYS 351 -2.939 41.430 12.659 349 HE3 LYS 351 1HE LYS 351 -3.594 40.295 11.477 350 HZ1 LYS 351 1HZ LYS 351 -3.611 39.926 14.419 351 HZ2 LYS 351 2HZ LYS 351 -4.263 38.855 13.285 352 HZ3 LYS 351 3HZ LYS 351 -4.932 40.393 13.471 353 HA PRO 352 HA PRO 352 0.167 39.832 9.200 354 HB2 PRO 352 2HB PRO 352 1.796 41.547 7.841 355 HB3 PRO 352 1HB PRO 352 0.730 42.097 9.145 356 HG2 PRO 352 2HG PRO 352 3.678 41.424 9.264 357 HG3 PRO 352 1HG PRO 352 2.835 42.856 9.901 358 HD2 PRO 352 2HD PRO 352 3.487 40.744 11.484 359 HD3 PRO 352 1HD PRO 352 2.019 41.700 11.764 360 HA PRO 353 HA PRO 353 2.356 36.631 6.855 361 HB2 PRO 353 2HB PRO 353 0.867 36.687 4.534 362 HB3 PRO 353 1HB PRO 353 0.288 35.956 6.038 363 HG2 PRO 353 2HG PRO 353 -0.275 38.707 4.927 364 HG3 PRO 353 1HG PRO 353 -1.417 37.521 5.604 365 HD2 PRO 353 2HD PRO 353 -0.503 39.592 7.083 366 HD3 PRO 353 1HD PRO 353 -0.802 38.002 7.820 367 H LEU 354 H LEU 354 4.092 36.616 5.538 368 HA LEU 354 HA LEU 354 4.928 39.088 4.187 369 HB2 LEU 354 2HB LEU 354 6.493 36.569 4.883 370 HB3 LEU 354 1HB LEU 354 7.177 38.014 4.142 371 HG LEU 354 HG LEU 354 5.960 37.864 6.939 372 HD11 LEU 354 1HD1 LEU 354 8.251 38.186 7.764 373 HD12 LEU 354 2HD1 LEU 354 8.871 38.113 6.112 374 HD13 LEU 354 3HD1 LEU 354 8.099 36.698 6.832 375 HD21 LEU 354 1HD2 LEU 354 7.299 40.234 5.564 376 HD22 LEU 354 2HD2 LEU 354 6.803 40.173 7.257 377 HD23 LEU 354 3HD2 LEU 354 5.589 40.094 5.986 378 H THR 355 H THR 355 5.961 38.943 2.060 379 HA THR 355 HA THR 355 4.699 36.922 0.302 380 HB THR 355 HB THR 355 4.230 39.279 -0.246 381 HG1 THR 355 HG1 THR 355 4.703 37.505 -1.902 382 HG21 THR 355 1HG2 THR 355 7.206 39.590 -0.794 383 HG22 THR 355 2HG2 THR 355 6.320 40.362 0.526 384 HG23 THR 355 3HG2 THR 355 5.958 40.777 -1.154 385 H SER 356 H SER 356 7.752 38.257 1.334 386 HA SER 356 HA SER 356 9.230 36.047 0.044 387 HB2 SER 356 2HB SER 356 11.137 37.679 -0.305 388 HB3 SER 356 1HB SER 356 9.723 38.031 -1.289 389 HG SER 356 HG SER 356 10.527 39.351 1.092 390 H VAL 357 H VAL 357 11.290 35.569 1.153 391 HA VAL 357 HA VAL 357 11.078 35.265 3.926 392 HB VAL 357 HB VAL 357 12.429 33.783 2.497 393 HG11 VAL 357 1HG1 VAL 357 13.405 35.398 0.927 394 HG12 VAL 357 2HG1 VAL 357 14.675 34.424 1.667 395 HG13 VAL 357 3HG1 VAL 357 14.408 36.082 2.213 396 HG21 VAL 357 1HG2 VAL 357 12.919 33.791 4.896 397 HG22 VAL 357 2HG2 VAL 357 14.098 35.085 4.679 398 HG23 VAL 357 3HG2 VAL 357 14.394 33.493 3.974 399 HA PRO 358 HA PRO 358 12.410 39.393 5.272 400 HB2 PRO 358 2HB PRO 358 12.948 38.846 7.923 401 HB3 PRO 358 1HB PRO 358 11.303 38.993 7.290 402 HG2 PRO 358 2HG PRO 358 12.930 36.492 7.779 403 HG3 PRO 358 1HG PRO 358 11.243 36.829 8.227 404 HD2 PRO 358 2HD PRO 358 11.840 35.378 6.033 405 HD3 PRO 358 1HD PRO 358 10.457 36.495 6.038 406 HA PRO 359 HA PRO 359 16.938 39.262 5.012 407 HB2 PRO 359 2HB PRO 359 17.638 41.706 5.943 408 HB3 PRO 359 1HB PRO 359 16.667 41.541 4.467 409 HG2 PRO 359 2HG PRO 359 15.728 42.062 7.303 410 HG3 PRO 359 1HG PRO 359 15.335 42.971 5.825 411 HD2 PRO 359 2HD PRO 359 13.667 41.074 6.817 412 HD3 PRO 359 1HD PRO 359 13.841 41.327 5.063 413 H GLU 360 H GLU 360 15.467 38.566 7.784 414 HA GLU 360 HA GLU 360 17.392 39.103 9.810 415 HB2 GLU 360 2HB GLU 360 15.177 37.024 9.840 416 HB3 GLU 360 1HB GLU 360 16.007 37.689 11.246 417 HG2 GLU 360 2HG GLU 360 14.135 39.166 9.369 418 HG3 GLU 360 1HG GLU 360 13.778 38.646 11.013 419 HA PRO 361 HA PRO 361 20.142 35.551 8.867 420 HB2 PRO 361 2HB PRO 361 21.793 35.795 11.045 421 HB3 PRO 361 1HB PRO 361 21.893 36.882 9.653 422 HG2 PRO 361 2HG PRO 361 20.527 37.317 12.306 423 HG3 PRO 361 1HG PRO 361 21.575 38.428 11.394 424 HD2 PRO 361 2HD PRO 361 18.838 38.615 11.329 425 HD3 PRO 361 1HD PRO 361 19.850 39.048 9.932 426 H GLU 362 H GLU 362 18.396 36.119 11.847 427 HA GLU 362 HA GLU 362 17.988 33.228 12.323 428 HB2 GLU 362 2HB GLU 362 18.011 33.756 14.794 429 HB3 GLU 362 1HB GLU 362 19.573 34.037 14.022 430 HG2 GLU 362 2HG GLU 362 18.892 36.502 13.846 431 HG3 GLU 362 1HG GLU 362 17.540 36.108 14.904 432 H TRP 363 H TRP 363 15.809 32.717 12.750 433 HA TRP 363 HA TRP 363 13.899 34.989 12.673 434 HB2 TRP 363 2HB TRP 363 14.026 33.813 10.443 435 HB3 TRP 363 1HB TRP 363 13.498 32.325 11.226 436 HD1 TRP 363 HD1 TRP 363 12.189 35.802 10.204 437 HE1 TRP 363 HE1 TRP 363 9.621 35.773 10.267 438 HE3 TRP 363 HE3 TRP 363 11.458 31.165 12.247 439 HZ2 TRP 363 HZ2 TRP 363 7.570 34.042 11.075 440 HZ3 TRP 363 HZ3 TRP 363 9.155 30.397 12.643 441 HH2 TRP 363 HH2 TRP 363 7.243 31.813 12.067 442 H TYR 364 H TYR 364 12.253 34.925 14.022 443 HA TYR 364 HA TYR 364 11.660 32.520 15.636 444 HB2 TYR 364 2HB TYR 364 11.798 35.375 16.728 445 HB3 TYR 364 1HB TYR 364 11.433 33.919 17.653 446 HD1 TYR 364 HD1 TYR 364 14.052 36.119 16.511 447 HD2 TYR 364 HD2 TYR 364 13.302 32.115 17.812 448 HE1 TYR 364 HE1 TYR 364 16.456 35.792 16.917 449 HE2 TYR 364 HE2 TYR 364 15.708 31.802 18.229 450 HH TYR 364 HH TYR 364 17.967 34.428 18.131 451 H CYS 365 H CYS 365 9.512 32.399 16.338 452 HA CYS 365 HA CYS 365 7.517 33.486 14.580 453 HB2 CYS 365 2HB CYS 365 5.977 32.034 15.779 454 HB3 CYS 365 1HB CYS 365 7.478 31.149 15.536 455 HA PRO 366 HA PRO 366 6.067 37.142 16.703 456 HB2 PRO 366 2HB PRO 366 3.309 36.543 17.129 457 HB3 PRO 366 1HB PRO 366 4.014 37.308 15.700 458 HG2 PRO 366 2HG PRO 366 3.338 34.403 16.170 459 HG3 PRO 366 1HG PRO 366 3.110 35.387 14.705 460 HD2 PRO 366 2HD PRO 366 5.119 33.657 14.842 461 HD3 PRO 366 1HD PRO 366 5.398 35.265 14.128 462 H SER 367 H SER 367 4.948 34.112 18.278 463 HA SER 367 HA SER 367 4.363 35.219 20.822 464 HB2 SER 367 2HB SER 367 3.496 33.034 20.044 465 HB3 SER 367 1HB SER 367 5.116 32.348 20.147 466 HG SER 367 HG SER 367 4.669 33.425 22.494 467 H CYS 368 H CYS 368 7.429 34.320 19.388 468 HA CYS 368 HA CYS 368 8.908 34.183 21.881 469 HB2 CYS 368 2HB CYS 368 9.670 33.975 18.968 470 HB3 CYS 368 1HB CYS 368 10.922 34.204 20.187 471 H ARG 369 H ARG 369 7.635 36.781 20.225 472 HA ARG 369 HA ARG 369 9.613 38.630 21.440 473 HB2 ARG 369 2HB ARG 369 9.290 40.202 19.526 474 HB3 ARG 369 1HB ARG 369 10.060 38.687 19.066 475 HG2 ARG 369 2HG ARG 369 7.766 37.889 18.295 476 HG3 ARG 369 1HG ARG 369 7.205 39.551 18.509 477 HD2 ARG 369 2HD ARG 369 7.827 39.077 16.163 478 HD3 ARG 369 1HD ARG 369 8.863 40.331 16.860 479 HE ARG 369 HE ARG 369 10.220 37.989 17.308 480 HH11 ARG 369 1HH1 ARG 369 9.059 39.580 14.400 481 HH12 ARG 369 2HH1 ARG 369 10.306 38.905 13.405 482 HH21 ARG 369 1HH2 ARG 369 11.837 37.139 16.007 483 HH22 ARG 369 2HH2 ARG 369 11.887 37.525 14.317 484 H THR 370 H THR 370 6.382 37.655 21.268 485 HA THR 370 HA THR 370 5.538 40.084 22.769 486 HB THR 370 HB THR 370 4.387 39.831 20.489 487 HG1 THR 370 HG1 THR 370 2.527 40.587 21.355 488 HG21 THR 370 1HG2 THR 370 2.548 38.227 20.269 489 HG22 THR 370 2HG2 THR 370 2.927 37.523 21.842 490 HG23 THR 370 3HG2 THR 370 4.057 37.352 20.496 491 H ASP 371 H ASP 371 3.496 39.450 24.135 492 HA ASP 371 HA ASP 371 2.621 38.401 25.944 493 HB2 ASP 371 2HB ASP 371 2.004 36.745 24.147 494 HB3 ASP 371 1HB ASP 371 3.487 35.855 24.473 495 H SER 372 H SER 372 5.451 39.165 25.955 496 HA SER 372 HA SER 372 6.965 37.135 27.407 497 HB2 SER 372 2HB SER 372 7.803 39.945 26.552 498 HB3 SER 372 1HB SER 372 8.868 38.621 27.028 499 HG SER 372 HG SER 372 7.600 37.556 25.106 500 H SER 373 H SER 373 4.767 37.993 28.903 501 HA SER 373 HA SER 373 5.192 40.121 30.700 502 HB2 SER 373 2HB SER 373 3.522 37.596 31.130 503 HB3 SER 373 1HB SER 373 3.331 39.130 31.978 504 HG SER 373 HG SER 373 2.029 38.444 29.897 505 H GLU 374 H GLU 374 6.278 40.217 32.665 506 HA GLU 374 HA GLU 374 8.435 38.428 33.055 507 HB2 GLU 374 2HB GLU 374 8.573 40.796 33.662 508 HB3 GLU 374 1HB GLU 374 7.353 40.582 34.905 509 HG2 GLU 374 2HG GLU 374 9.566 40.735 35.898 510 HG3 GLU 374 1HG GLU 374 8.877 39.139 36.185 511 H VAL 375 H VAL 375 8.730 36.748 34.337 512 HA VAL 375 HA VAL 375 6.445 35.665 35.886 513 HB VAL 375 HB VAL 375 8.849 34.182 34.692 514 HG11 VAL 375 1HG1 VAL 375 6.370 33.055 36.062 515 HG12 VAL 375 2HG1 VAL 375 8.016 33.035 36.697 516 HG13 VAL 375 3HG1 VAL 375 7.620 32.101 35.256 517 HG21 VAL 375 1HG2 VAL 375 7.346 35.010 32.916 518 HG22 VAL 375 2HG2 VAL 375 5.962 34.247 33.704 519 HG23 VAL 375 3HG2 VAL 375 7.258 33.251 33.036 520 H VAL 376 H VAL 376 6.679 35.724 38.057 521 HA VAL 376 HA VAL 376 8.858 36.852 39.384 522 HB VAL 376 HB VAL 376 6.663 36.947 40.383 523 HG11 VAL 376 1HG1 VAL 376 5.464 34.996 41.327 524 HG12 VAL 376 2HG1 VAL 376 6.723 33.924 40.709 525 HG13 VAL 376 3HG1 VAL 376 5.713 34.830 39.584 526 HG21 VAL 376 1HG2 VAL 376 8.486 35.308 42.202 527 HG22 VAL 376 2HG2 VAL 376 7.145 36.324 42.741 528 HG23 VAL 376 3HG2 VAL 376 8.553 37.054 41.972 529 H GLN 377 H GLN 377 10.825 36.093 39.799 530 HA GLN 377 HA GLN 377 11.626 33.387 39.445 531 HB2 GLN 377 2HB GLN 377 13.097 35.804 40.570 532 HB3 GLN 377 1HB GLN 377 13.860 34.224 40.396 533 HG2 GLN 377 2HG GLN 377 13.464 34.290 37.960 534 HG3 GLN 377 1HG GLN 377 12.684 35.868 38.129 535 HE21 GLN 377 1HE2 GLN 377 15.726 34.140 38.299 536 HE22 GLN 377 2HE2 GLN 377 16.751 35.527 38.184 537 H ALA 378 H ALA 378 10.516 32.068 40.784 538 HA ALA 378 HA ALA 378 10.637 32.308 43.685 539 HB1 ALA 378 1HB ALA 378 8.572 31.494 42.625 540 HB2 ALA 378 2HB ALA 378 9.269 30.248 43.661 541 HB3 ALA 378 3HB ALA 378 9.452 30.142 41.907 542 H GLY 379 H GLY 379 11.185 30.110 44.817 543 HA2 GLY 379 2HA GLY 379 12.691 28.409 45.298 544 HA3 GLY 379 1HA GLY 379 13.431 28.617 43.715 545 H GLU 380 H GLU 380 12.983 31.450 45.641 546 HA GLU 380 HA GLU 380 15.819 31.471 46.506 547 HB2 GLU 380 2HB GLU 380 15.447 32.988 44.555 548 HB3 GLU 380 1HB GLU 380 14.182 33.831 45.443 549 HG2 GLU 380 2HG GLU 380 15.852 34.572 47.119 550 HG3 GLU 380 1HG GLU 380 17.116 33.719 46.227 Start of MODEL 14 1 H1 SER 303 H SER 303 15.067 2.417 3.186 2 HA SER 303 HA SER 303 16.800 3.164 5.403 3 HB2 SER 303 2HB SER 303 17.481 1.484 3.660 4 HB3 SER 303 1HB SER 303 17.469 2.763 2.448 5 HG SER 303 HG SER 303 19.109 3.819 3.700 6 H GLY 304 H GLY 304 14.710 4.977 3.720 7 HA2 GLY 304 2HA GLY 304 16.244 7.186 2.729 8 HA3 GLY 304 1HA GLY 304 14.513 7.145 3.012 9 HA PRO 305 HA PRO 305 16.287 9.935 6.350 10 HB2 PRO 305 2HB PRO 305 15.280 12.312 5.544 11 HB3 PRO 305 1HB PRO 305 16.760 11.664 4.817 12 HG2 PRO 305 2HG PRO 305 13.929 11.589 3.762 13 HG3 PRO 305 1HG PRO 305 15.430 12.004 2.907 14 HD2 PRO 305 2HD PRO 305 14.260 9.506 2.783 15 HD3 PRO 305 1HD PRO 305 16.003 9.779 2.566 16 H SER 306 H SER 306 14.213 8.124 6.644 17 HA SER 306 HA SER 306 11.629 9.246 7.008 18 HB2 SER 306 2HB SER 306 12.746 6.658 8.180 19 HB3 SER 306 1HB SER 306 11.041 7.077 7.991 20 HG SER 306 HG SER 306 11.149 6.583 5.944 21 H CYS 307 H CYS 307 11.504 10.910 8.342 22 HA CYS 307 HA CYS 307 12.903 11.245 10.798 23 HB2 CYS 307 2HB CYS 307 11.087 13.177 10.968 24 HB3 CYS 307 1HB CYS 307 12.387 13.275 9.800 25 H ARG 308 H ARG 308 12.492 10.176 12.587 26 HA ARG 308 HA ARG 308 10.478 8.252 12.886 27 HB2 ARG 308 2HB ARG 308 12.342 9.439 14.981 28 HB3 ARG 308 1HB ARG 308 11.417 7.952 15.194 29 HG2 ARG 308 2HG ARG 308 13.645 8.418 13.173 30 HG3 ARG 308 1HG ARG 308 13.748 7.463 14.656 31 HD2 ARG 308 2HD ARG 308 11.981 5.943 13.723 32 HD3 ARG 308 1HD ARG 308 12.054 6.850 12.207 33 HE ARG 308 HE ARG 308 14.311 5.294 13.360 34 HH11 ARG 308 1HH1 ARG 308 12.640 6.549 10.539 35 HH12 ARG 308 2HH1 ARG 308 13.627 5.673 9.418 36 HH21 ARG 308 1HH2 ARG 308 15.605 4.155 11.856 37 HH22 ARG 308 2HH2 ARG 308 15.299 4.323 10.156 38 H PHE 309 H PHE 309 10.657 11.553 14.091 39 HA PHE 309 HA PHE 309 8.669 11.476 16.098 40 HB2 PHE 309 2HB PHE 309 9.715 13.751 14.390 41 HB3 PHE 309 1HB PHE 309 8.554 14.005 15.683 42 HD1 PHE 309 HD1 PHE 309 11.994 12.615 15.052 43 HD2 PHE 309 HD2 PHE 309 9.330 14.435 17.857 44 HE1 PHE 309 HE1 PHE 309 13.847 12.864 16.660 45 HE2 PHE 309 HE2 PHE 309 11.181 14.676 19.452 46 HZ PHE 309 HZ PHE 309 13.439 13.890 18.861 47 H CYS 310 H CYS 310 8.248 11.167 12.741 48 HA CYS 310 HA CYS 310 5.329 11.328 13.042 49 HB2 CYS 310 2HB CYS 310 5.698 12.458 10.480 50 HB3 CYS 310 1HB CYS 310 5.265 13.331 11.942 51 H LYS 311 H LYS 311 7.946 9.594 12.156 52 HA LYS 311 HA LYS 311 8.474 7.726 11.061 53 HB2 LYS 311 2HB LYS 311 5.498 7.103 11.230 54 HB3 LYS 311 1HB LYS 311 6.802 5.933 11.039 55 HG2 LYS 311 2HG LYS 311 7.671 6.809 13.314 56 HG3 LYS 311 1HG LYS 311 6.093 7.589 13.483 57 HD2 LYS 311 2HD LYS 311 6.662 4.601 13.223 58 HD3 LYS 311 1HD LYS 311 6.073 5.447 14.654 59 HE2 LYS 311 2HE LYS 311 4.557 5.028 12.050 60 HE3 LYS 311 1HE LYS 311 4.260 4.209 13.582 61 HZ1 LYS 311 1HZ LYS 311 3.727 6.410 14.529 62 HZ2 LYS 311 2HZ LYS 311 2.675 5.934 13.290 63 HZ3 LYS 311 3HZ LYS 311 3.875 7.083 12.986 64 H ASP 312 H ASP 312 7.240 10.044 9.294 65 HA ASP 312 HA ASP 312 6.292 10.482 7.261 66 HB2 ASP 312 2HB ASP 312 8.273 8.292 6.523 67 HB3 ASP 312 1HB ASP 312 7.506 9.362 5.343 68 H ASP 313 H ASP 313 4.551 8.935 8.698 69 HA ASP 313 HA ASP 313 3.597 6.579 7.538 70 HB2 ASP 313 2HB ASP 313 2.045 8.727 9.056 71 HB3 ASP 313 1HB ASP 313 1.397 7.141 8.654 72 H GLU 314 H GLU 314 2.600 6.184 5.674 73 HA GLU 314 HA GLU 314 1.818 8.311 3.880 74 HB2 GLU 314 2HB GLU 314 1.657 5.287 3.537 75 HB3 GLU 314 1HB GLU 314 1.401 6.478 2.257 76 HG2 GLU 314 2HG GLU 314 3.777 7.280 2.699 77 HG3 GLU 314 1HG GLU 314 3.983 5.877 3.744 78 H ASN 315 H ASN 315 0.238 6.438 6.281 79 HA ASN 315 HA ASN 315 -2.460 6.718 5.287 80 HB2 ASN 315 2HB ASN 315 -1.387 6.090 8.085 81 HB3 ASN 315 1HB ASN 315 -3.103 6.113 7.681 82 HD21 ASN 315 1HD2 ASN 315 -1.411 3.906 8.629 83 HD22 ASN 315 2HD2 ASN 315 -1.570 2.648 7.458 84 H LYS 316 H LYS 316 -0.864 8.191 8.141 85 HA LYS 316 HA LYS 316 -2.284 10.742 7.645 86 HB2 LYS 316 2HB LYS 316 -0.933 9.709 10.187 87 HB3 LYS 316 1HB LYS 316 -1.702 11.288 10.024 88 HG2 LYS 316 2HG LYS 316 -3.883 10.214 9.669 89 HG3 LYS 316 1HG LYS 316 -3.126 8.617 9.766 90 HD2 LYS 316 2HD LYS 316 -2.490 9.034 12.104 91 HD3 LYS 316 1HD LYS 316 -3.149 10.672 12.015 92 HE2 LYS 316 2HE LYS 316 -4.786 8.129 11.689 93 HE3 LYS 316 1HE LYS 316 -4.665 9.073 13.175 94 HZ1 LYS 316 1HZ LYS 316 -6.659 9.574 11.873 95 HZ2 LYS 316 2HZ LYS 316 -5.694 10.120 10.600 96 HZ3 LYS 316 3HZ LYS 316 -5.673 10.931 12.084 97 HA PRO 317 HA PRO 317 1.679 11.906 5.926 98 HB2 PRO 317 2HB PRO 317 1.311 14.594 5.579 99 HB3 PRO 317 1HB PRO 317 0.460 13.391 4.601 100 HG2 PRO 317 2HG PRO 317 -0.519 14.882 7.036 101 HG3 PRO 317 1HG PRO 317 -1.340 14.624 5.481 102 HD2 PRO 317 2HD PRO 317 -1.893 13.084 7.647 103 HD3 PRO 317 1HD PRO 317 -1.925 12.412 6.004 104 H CYS 318 H CYS 318 3.275 14.018 6.279 105 HA CYS 318 HA CYS 318 4.208 13.782 8.994 106 HB2 CYS 318 2HB CYS 318 5.242 15.018 6.480 107 HB3 CYS 318 1HB CYS 318 5.795 15.731 7.991 108 H ARG 319 H ARG 319 3.139 14.759 10.511 109 HA ARG 319 HA ARG 319 1.906 17.410 10.195 110 HB2 ARG 319 2HB ARG 319 0.788 16.866 12.421 111 HB3 ARG 319 1HB ARG 319 0.318 15.821 11.090 112 HG2 ARG 319 2HG ARG 319 2.469 14.961 13.057 113 HG3 ARG 319 1HG ARG 319 0.761 14.764 13.447 114 HD2 ARG 319 2HD ARG 319 0.431 13.273 11.585 115 HD3 ARG 319 1HD ARG 319 2.030 13.633 10.935 116 HE ARG 319 HE ARG 319 2.193 12.506 13.559 117 HH11 ARG 319 1HH1 ARG 319 1.694 11.561 10.186 118 HH12 ARG 319 2HH1 ARG 319 2.332 9.967 10.439 119 HH21 ARG 319 1HH2 ARG 319 3.048 10.413 13.811 120 HH22 ARG 319 2HH2 ARG 319 3.082 9.331 12.451 121 H LYS 320 H LYS 320 4.202 15.604 12.184 122 HA LYS 320 HA LYS 320 4.644 17.573 14.155 123 HB2 LYS 320 2HB LYS 320 5.114 15.197 14.564 124 HB3 LYS 320 1HB LYS 320 6.382 15.211 13.348 125 HG2 LYS 320 2HG LYS 320 7.599 15.326 15.327 126 HG3 LYS 320 1HG LYS 320 7.521 17.021 14.862 127 HD2 LYS 320 2HD LYS 320 5.659 15.713 16.891 128 HD3 LYS 320 1HD LYS 320 7.147 16.537 17.326 129 HE2 LYS 320 2HE LYS 320 4.739 17.831 15.993 130 HE3 LYS 320 1HE LYS 320 5.165 17.955 17.703 131 HZ1 LYS 320 1HZ LYS 320 6.781 18.950 15.416 132 HZ2 LYS 320 2HZ LYS 320 7.238 19.035 17.042 133 HZ3 LYS 320 3HZ LYS 320 5.889 19.895 16.494 134 H CYS 321 H CYS 321 6.543 16.710 11.228 135 HA CYS 321 HA CYS 321 8.403 18.928 11.765 136 HB2 CYS 321 2HB CYS 321 9.972 17.904 10.281 137 HB3 CYS 321 1HB CYS 321 9.307 16.606 11.257 138 H ALA 322 H ALA 322 5.567 18.714 10.319 139 HA ALA 322 HA ALA 322 6.073 20.284 7.914 140 HB1 ALA 322 1HB ALA 322 3.461 19.521 9.296 141 HB2 ALA 322 2HB ALA 322 4.195 18.693 7.921 142 HB3 ALA 322 3HB ALA 322 3.595 20.341 7.735 143 H CYS 323 H CYS 323 4.638 22.333 7.752 144 HA CYS 323 HA CYS 323 5.058 24.183 9.916 145 HB2 CYS 323 2HB CYS 323 5.051 25.259 7.843 146 HB3 CYS 323 1HB CYS 323 3.698 24.316 7.232 147 H HIS 324 H HIS 324 3.992 23.896 11.734 148 HA HIS 324 HA HIS 324 1.990 21.959 12.040 149 HB2 HIS 324 2HB HIS 324 3.707 22.386 13.735 150 HB3 HIS 324 1HB HIS 324 3.108 24.022 13.980 151 HD1 HIS 324 HD1 HIS 324 1.529 20.515 14.245 152 HD2 HIS 324 HD2 HIS 324 1.675 24.159 16.246 153 HE1 HIS 324 HE1 HIS 324 0.139 20.238 16.335 154 H VAL 325 H VAL 325 1.801 25.431 11.694 155 HA VAL 325 HA VAL 325 -0.617 25.962 13.005 156 HB VAL 325 HB VAL 325 0.453 27.538 10.623 157 HG11 VAL 325 1HG1 VAL 325 -1.257 28.441 12.980 158 HG12 VAL 325 2HG1 VAL 325 -1.808 28.237 11.316 159 HG13 VAL 325 3HG1 VAL 325 -0.631 29.494 11.705 160 HG21 VAL 325 1HG2 VAL 325 1.248 27.804 13.546 161 HG22 VAL 325 2HG2 VAL 325 1.737 28.901 12.250 162 HG23 VAL 325 3HG2 VAL 325 2.271 27.219 12.232 163 H CYS 326 H CYS 326 0.020 24.865 9.715 164 HA CYS 326 HA CYS 326 -2.897 24.551 9.228 165 HB2 CYS 326 2HB CYS 326 -2.462 24.728 6.826 166 HB3 CYS 326 1HB CYS 326 -1.808 26.143 7.639 167 H GLY 327 H GLY 327 -0.146 22.892 10.016 168 HA2 GLY 327 2HA GLY 327 0.530 20.717 10.017 169 HA3 GLY 327 1HA GLY 327 -1.144 20.303 9.680 170 H GLY 328 H GLY 328 1.225 22.074 7.648 171 HA2 GLY 328 2HA GLY 328 1.205 19.904 5.648 172 HA3 GLY 328 1HA GLY 328 0.524 21.460 5.182 173 H ARG 329 H ARG 329 2.664 20.231 3.877 174 HA ARG 329 HA ARG 329 5.034 21.894 4.537 175 HB2 ARG 329 2HB ARG 329 4.891 19.212 3.094 176 HB3 ARG 329 1HB ARG 329 6.366 20.152 3.340 177 HG2 ARG 329 2HG ARG 329 6.107 19.884 5.795 178 HG3 ARG 329 1HG ARG 329 4.655 18.916 5.528 179 HD2 ARG 329 2HD ARG 329 6.586 17.470 5.967 180 HD3 ARG 329 1HD ARG 329 6.003 17.233 4.314 181 HE ARG 329 HE ARG 329 8.196 19.133 4.693 182 HH11 ARG 329 1HH1 ARG 329 7.302 15.878 3.675 183 HH12 ARG 329 2HH1 ARG 329 8.821 15.598 2.886 184 HH21 ARG 329 1HH2 ARG 329 10.145 18.736 3.647 185 HH22 ARG 329 2HH2 ARG 329 10.420 17.211 2.865 186 H GLU 330 H GLU 330 2.546 22.305 2.726 187 HA GLU 330 HA GLU 330 3.331 22.187 0.007 188 HB2 GLU 330 2HB GLU 330 1.201 23.955 1.279 189 HB3 GLU 330 1HB GLU 330 1.306 23.505 -0.425 190 HG2 GLU 330 2HG GLU 330 0.900 21.148 0.176 191 HG3 GLU 330 1HG GLU 330 0.827 21.589 1.880 192 H ALA 331 H ALA 331 4.710 23.468 -1.062 193 HA ALA 331 HA ALA 331 6.099 25.117 -1.702 194 HB1 ALA 331 1HB ALA 331 4.242 26.728 -1.509 195 HB2 ALA 331 2HB ALA 331 5.788 27.460 -1.072 196 HB3 ALA 331 3HB ALA 331 4.638 26.992 0.191 197 HA PRO 332 HA PRO 332 8.752 24.122 1.989 198 HB2 PRO 332 2HB PRO 332 10.855 23.111 0.523 199 HB3 PRO 332 1HB PRO 332 9.466 22.135 1.022 200 HG2 PRO 332 2HG PRO 332 9.989 23.489 -1.625 201 HG3 PRO 332 1HG PRO 332 9.393 21.845 -1.311 202 HD2 PRO 332 2HD PRO 332 7.717 23.863 -1.996 203 HD3 PRO 332 1HD PRO 332 7.216 22.581 -0.871 204 H GLU 333 H GLU 333 9.200 26.005 -0.909 205 HA GLU 333 HA GLU 333 11.567 27.423 -0.190 206 HB2 GLU 333 2HB GLU 333 10.950 29.012 -1.955 207 HB3 GLU 333 1HB GLU 333 10.731 27.361 -2.525 208 HG2 GLU 333 2HG GLU 333 8.324 27.524 -2.293 209 HG3 GLU 333 1HG GLU 333 8.452 29.075 -1.476 210 H LYS 334 H LYS 334 8.285 27.632 0.861 211 HA LYS 334 HA LYS 334 8.687 30.280 2.129 212 HB2 LYS 334 2HB LYS 334 6.140 28.797 1.312 213 HB3 LYS 334 1HB LYS 334 6.133 30.258 2.308 214 HG2 LYS 334 2HG LYS 334 7.220 31.527 0.504 215 HG3 LYS 334 1HG LYS 334 7.301 30.076 -0.498 216 HD2 LYS 334 2HD LYS 334 4.852 29.995 -0.629 217 HD3 LYS 334 1HD LYS 334 4.721 31.380 0.461 218 HE2 LYS 334 2HE LYS 334 4.390 32.053 -1.889 219 HE3 LYS 334 1HE LYS 334 5.827 32.815 -1.211 220 HZ1 LYS 334 1HZ LYS 334 7.202 31.211 -2.349 221 HZ2 LYS 334 2HZ LYS 334 6.176 31.969 -3.455 222 HZ3 LYS 334 3HZ LYS 334 5.841 30.399 -2.932 223 H GLN 335 H GLN 335 8.901 27.054 2.900 224 HA GLN 335 HA GLN 335 7.847 27.232 5.610 225 HB2 GLN 335 2HB GLN 335 9.557 25.107 4.249 226 HB3 GLN 335 1HB GLN 335 8.987 25.000 5.913 227 HG2 GLN 335 2HG GLN 335 6.625 25.148 4.997 228 HG3 GLN 335 1HG GLN 335 7.323 24.991 3.388 229 HE21 GLN 335 1HE2 GLN 335 6.776 23.365 6.437 230 HE22 GLN 335 2HE2 GLN 335 7.072 21.762 5.872 231 H LEU 336 H LEU 336 8.932 29.002 6.459 232 HA LEU 336 HA LEU 336 11.847 28.985 6.737 233 HB2 LEU 336 2HB LEU 336 9.725 30.959 7.666 234 HB3 LEU 336 1HB LEU 336 11.456 31.178 7.902 235 HG LEU 336 HG LEU 336 10.088 30.999 5.190 236 HD11 LEU 336 1HD1 LEU 336 11.160 33.460 6.622 237 HD12 LEU 336 2HD1 LEU 336 9.458 33.084 6.337 238 HD13 LEU 336 3HD1 LEU 336 10.524 33.412 4.974 239 HD21 LEU 336 1HD2 LEU 336 12.265 31.748 4.292 240 HD22 LEU 336 2HD2 LEU 336 12.381 30.184 5.092 241 HD23 LEU 336 3HD2 LEU 336 12.965 31.639 5.909 242 H LEU 337 H LEU 337 12.851 28.264 8.523 243 HA LEU 337 HA LEU 337 11.238 26.930 10.556 244 HB2 LEU 337 2HB LEU 337 14.203 26.793 9.899 245 HB3 LEU 337 1HB LEU 337 13.525 26.034 11.329 246 HG LEU 337 HG LEU 337 12.018 24.675 9.802 247 HD11 LEU 337 1HD1 LEU 337 13.796 25.721 7.580 248 HD12 LEU 337 2HD1 LEU 337 12.073 26.048 7.784 249 HD13 LEU 337 3HD1 LEU 337 12.621 24.410 7.438 250 HD21 LEU 337 1HD2 LEU 337 13.755 23.042 9.207 251 HD22 LEU 337 2HD2 LEU 337 14.016 23.697 10.821 252 HD23 LEU 337 3HD2 LEU 337 15.007 24.260 9.472 253 H CYS 338 H CYS 338 10.635 28.026 12.245 254 HA CYS 338 HA CYS 338 11.942 30.305 13.344 255 HB2 CYS 338 2HB CYS 338 9.496 29.905 13.572 256 HB3 CYS 338 1HB CYS 338 9.836 28.525 14.626 257 H ASP 339 H ASP 339 13.713 30.286 14.569 258 HA ASP 339 HA ASP 339 15.134 28.117 15.518 259 HB2 ASP 339 2HB ASP 339 16.156 30.319 15.332 260 HB3 ASP 339 1HB ASP 339 15.068 30.991 16.539 261 H GLU 340 H GLU 340 12.977 30.235 17.415 262 HA GLU 340 HA GLU 340 13.162 29.007 19.916 263 HB2 GLU 340 2HB GLU 340 12.161 31.261 19.429 264 HB3 GLU 340 1HB GLU 340 10.746 30.459 18.769 265 HG2 GLU 340 2HG GLU 340 10.220 31.181 20.993 266 HG3 GLU 340 1HG GLU 340 10.345 29.419 21.014 267 H CYS 341 H CYS 341 10.794 28.452 17.323 268 HA CYS 341 HA CYS 341 9.318 26.431 18.800 269 HB2 CYS 341 2HB CYS 341 9.012 27.480 15.960 270 HB3 CYS 341 1HB CYS 341 7.924 26.309 16.709 271 H ASP 342 H ASP 342 12.104 26.476 16.929 272 HA ASP 342 HA ASP 342 13.398 25.043 15.802 273 HB2 ASP 342 2HB ASP 342 11.937 23.031 17.571 274 HB3 ASP 342 1HB ASP 342 13.303 22.589 16.556 275 H MET 343 H MET 343 10.693 25.688 14.600 276 HA MET 343 HA MET 343 10.462 23.418 12.785 277 HB2 MET 343 2HB MET 343 8.922 23.015 14.758 278 HB3 MET 343 1HB MET 343 8.026 24.450 14.280 279 HG2 MET 343 2HG MET 343 6.775 22.690 13.398 280 HG3 MET 343 1HG MET 343 7.703 23.234 12.008 281 HE1 MET 343 1HE MET 343 10.682 21.661 12.499 282 HE2 MET 343 2HE MET 343 9.806 21.807 10.973 283 HE3 MET 343 3HE MET 343 10.282 20.217 11.567 284 H ALA 344 H ALA 344 9.485 23.756 10.877 285 HA ALA 344 HA ALA 344 9.734 26.291 9.673 286 HB1 ALA 344 1HB ALA 344 8.426 23.754 8.625 287 HB2 ALA 344 2HB ALA 344 10.136 24.173 8.486 288 HB3 ALA 344 3HB ALA 344 8.925 25.144 7.651 289 H PHE 345 H PHE 345 8.202 27.751 9.022 290 HA PHE 345 HA PHE 345 5.335 27.185 9.233 291 HB2 PHE 345 2HB PHE 345 6.630 29.710 10.384 292 HB3 PHE 345 1HB PHE 345 4.896 29.439 10.241 293 HD1 PHE 345 HD1 PHE 345 7.442 29.500 12.563 294 HD2 PHE 345 HD2 PHE 345 4.200 26.996 11.342 295 HE1 PHE 345 HE1 PHE 345 7.391 28.467 14.790 296 HE2 PHE 345 HE2 PHE 345 4.156 25.968 13.577 297 HZ PHE 345 HZ PHE 345 5.751 26.703 15.303 298 H HIS 346 H HIS 346 4.187 28.152 7.590 299 HA HIS 346 HA HIS 346 5.630 29.210 5.333 300 HB2 HIS 346 2HB HIS 346 2.634 28.904 5.806 301 HB3 HIS 346 1HB HIS 346 3.358 29.406 4.282 302 HD2 HIS 346 HD2 HIS 346 5.479 27.260 3.607 303 HE1 HIS 346 HE1 HIS 346 2.536 24.393 4.559 304 HE2 HIS 346 HE2 HIS 346 4.577 24.888 3.165 305 H LEU 347 H LEU 347 5.384 31.273 4.420 306 HA LEU 347 HA LEU 347 5.523 33.497 6.068 307 HB2 LEU 347 2HB LEU 347 5.027 33.168 3.102 308 HB3 LEU 347 1HB LEU 347 4.922 34.764 3.808 309 HG LEU 347 HG LEU 347 7.294 34.553 4.584 310 HD11 LEU 347 1HD1 LEU 347 8.746 32.831 3.670 311 HD12 LEU 347 2HD1 LEU 347 7.350 32.014 2.964 312 HD13 LEU 347 3HD1 LEU 347 7.503 32.147 4.718 313 HD21 LEU 347 1HD2 LEU 347 6.780 35.758 2.512 314 HD22 LEU 347 2HD2 LEU 347 6.892 34.258 1.587 315 HD23 LEU 347 3HD2 LEU 347 8.327 34.919 2.378 316 H TYR 348 H TYR 348 2.691 32.140 4.434 317 HA TYR 348 HA TYR 348 0.986 34.411 5.137 318 HB2 TYR 348 2HB TYR 348 0.183 31.864 3.683 319 HB3 TYR 348 1HB TYR 348 -0.670 33.405 3.688 320 HD1 TYR 348 HD1 TYR 348 0.948 35.478 2.849 321 HD2 TYR 348 HD2 TYR 348 1.373 31.373 1.724 322 HE1 TYR 348 HE1 TYR 348 2.188 36.149 0.834 323 HE2 TYR 348 HE2 TYR 348 2.610 32.053 -0.285 324 HH TYR 348 HH TYR 348 2.830 34.013 -1.729 325 H CYS 349 H CYS 349 1.933 31.565 6.656 326 HA CYS 349 HA CYS 349 -0.560 31.141 8.164 327 HB2 CYS 349 2HB CYS 349 2.123 29.701 8.268 328 HB3 CYS 349 1HB CYS 349 0.696 29.251 9.214 329 H LEU 350 H LEU 350 1.027 33.628 8.364 330 HA LEU 350 HA LEU 350 1.811 33.656 11.221 331 HB2 LEU 350 2HB LEU 350 3.036 35.253 8.924 332 HB3 LEU 350 1HB LEU 350 3.549 35.296 10.607 333 HG LEU 350 HG LEU 350 3.784 32.879 8.762 334 HD11 LEU 350 1HD1 LEU 350 5.285 34.686 8.092 335 HD12 LEU 350 2HD1 LEU 350 6.180 33.311 8.728 336 HD13 LEU 350 3HD1 LEU 350 5.960 34.756 9.724 337 HD21 LEU 350 1HD2 LEU 350 5.163 31.858 10.544 338 HD22 LEU 350 2HD2 LEU 350 3.520 32.168 11.094 339 HD23 LEU 350 3HD2 LEU 350 4.830 33.236 11.599 340 H LYS 351 H LYS 351 1.750 35.979 12.074 341 HA LYS 351 HA LYS 351 -0.173 37.772 10.777 342 HB2 LYS 351 2HB LYS 351 -1.369 36.158 12.452 343 HB3 LYS 351 1HB LYS 351 -0.535 37.036 13.726 344 HG2 LYS 351 2HG LYS 351 -2.415 38.339 11.713 345 HG3 LYS 351 1HG LYS 351 -2.944 37.736 13.284 346 HD2 LYS 351 2HD LYS 351 -0.927 39.978 12.806 347 HD3 LYS 351 1HD LYS 351 -2.614 40.190 13.285 348 HE2 LYS 351 2HE LYS 351 -2.174 39.088 15.429 349 HE3 LYS 351 1HE LYS 351 -0.516 38.737 14.942 350 HZ1 LYS 351 1HZ LYS 351 -0.605 40.632 16.386 351 HZ2 LYS 351 2HZ LYS 351 -1.677 41.428 15.354 352 HZ3 LYS 351 3HZ LYS 351 -0.094 41.120 14.843 353 HA PRO 352 HA PRO 352 0.204 39.683 9.938 354 HB2 PRO 352 2HB PRO 352 2.032 41.246 8.678 355 HB3 PRO 352 1HB PRO 352 1.061 41.857 10.025 356 HG2 PRO 352 2HG PRO 352 3.899 40.809 10.053 357 HG3 PRO 352 1HG PRO 352 3.246 42.286 10.798 358 HD2 PRO 352 2HD PRO 352 3.636 39.974 12.207 359 HD3 PRO 352 1HD PRO 352 2.353 41.134 12.613 360 HA PRO 353 HA PRO 353 1.963 36.359 7.388 361 HB2 PRO 353 2HB PRO 353 0.438 37.619 5.129 362 HB3 PRO 353 1HB PRO 353 0.352 35.971 5.763 363 HG2 PRO 353 2HG PRO 353 -1.617 37.734 6.235 364 HG3 PRO 353 1HG PRO 353 -1.121 36.563 7.476 365 HD2 PRO 353 2HD PRO 353 -0.416 39.497 7.248 366 HD3 PRO 353 1HD PRO 353 -0.878 38.555 8.688 367 H LEU 354 H LEU 354 4.066 36.567 6.847 368 HA LEU 354 HA LEU 354 5.288 38.946 5.895 369 HB2 LEU 354 2HB LEU 354 6.327 36.081 5.909 370 HB3 LEU 354 1HB LEU 354 7.309 37.481 5.486 371 HG LEU 354 HG LEU 354 6.050 36.938 8.204 372 HD11 LEU 354 1HD1 LEU 354 8.361 36.654 8.999 373 HD12 LEU 354 2HD1 LEU 354 8.967 36.859 7.354 374 HD13 LEU 354 3HD1 LEU 354 7.954 35.469 7.759 375 HD21 LEU 354 1HD2 LEU 354 6.080 39.347 7.807 376 HD22 LEU 354 2HD2 LEU 354 7.784 39.288 7.347 377 HD23 LEU 354 3HD2 LEU 354 7.302 38.923 9.006 378 H THR 355 H THR 355 5.833 39.609 3.903 379 HA THR 355 HA THR 355 4.776 38.152 1.557 380 HB THR 355 HB THR 355 4.009 40.483 1.838 381 HG1 THR 355 HG1 THR 355 5.018 39.442 -0.343 382 HG21 THR 355 1HG2 THR 355 6.924 41.297 1.531 383 HG22 THR 355 2HG2 THR 355 5.961 41.451 3.006 384 HG23 THR 355 3HG2 THR 355 5.547 42.394 1.571 385 H SER 356 H SER 356 7.598 38.426 3.250 386 HA SER 356 HA SER 356 9.305 37.437 1.152 387 HB2 SER 356 2HB SER 356 9.949 40.151 2.427 388 HB3 SER 356 1HB SER 356 11.061 39.216 1.424 389 HG SER 356 HG SER 356 9.184 39.354 -0.164 390 H VAL 357 H VAL 357 11.268 36.544 2.020 391 HA VAL 357 HA VAL 357 11.272 35.822 4.798 392 HB VAL 357 HB VAL 357 12.155 34.206 3.217 393 HG11 VAL 357 1HG1 VAL 357 14.292 36.229 2.439 394 HG12 VAL 357 2HG1 VAL 357 12.951 35.691 1.429 395 HG13 VAL 357 3HG1 VAL 357 14.218 34.551 1.884 396 HG21 VAL 357 1HG2 VAL 357 13.170 34.166 5.458 397 HG22 VAL 357 2HG2 VAL 357 14.428 35.287 4.931 398 HG23 VAL 357 3HG2 VAL 357 14.349 33.663 4.245 399 HA PRO 358 HA PRO 358 13.567 39.506 6.246 400 HB2 PRO 358 2HB PRO 358 14.059 37.778 8.648 401 HB3 PRO 358 1HB PRO 358 13.368 39.404 8.556 402 HG2 PRO 358 2HG PRO 358 11.830 37.270 9.055 403 HG3 PRO 358 1HG PRO 358 11.232 38.610 8.052 404 HD2 PRO 358 2HD PRO 358 12.278 35.912 7.191 405 HD3 PRO 358 1HD PRO 358 10.897 36.839 6.565 406 HA PRO 359 HA PRO 359 17.732 38.062 5.121 407 HB2 PRO 359 2HB PRO 359 19.160 40.322 5.779 408 HB3 PRO 359 1HB PRO 359 18.138 40.211 4.337 409 HG2 PRO 359 2HG PRO 359 17.483 41.398 7.040 410 HG3 PRO 359 1HG PRO 359 17.217 42.092 5.423 411 HD2 PRO 359 2HD PRO 359 15.209 40.888 6.759 412 HD3 PRO 359 1HD PRO 359 15.360 40.719 4.997 413 H GLU 360 H GLU 360 16.679 38.692 8.304 414 HA GLU 360 HA GLU 360 19.180 38.292 9.687 415 HB2 GLU 360 2HB GLU 360 17.789 38.300 11.724 416 HB3 GLU 360 1HB GLU 360 17.353 39.642 10.670 417 HG2 GLU 360 2HG GLU 360 15.455 38.145 9.819 418 HG3 GLU 360 1HG GLU 360 15.802 37.082 11.174 419 HA PRO 361 HA PRO 361 18.985 33.731 9.595 420 HB2 PRO 361 2HB PRO 361 20.951 33.183 11.381 421 HB3 PRO 361 1HB PRO 361 21.323 33.889 9.799 422 HG2 PRO 361 2HG PRO 361 21.025 35.277 12.472 423 HG3 PRO 361 1HG PRO 361 22.324 35.451 11.271 424 HD2 PRO 361 2HD PRO 361 20.246 37.217 11.428 425 HD3 PRO 361 1HD PRO 361 21.041 36.824 9.886 426 H GLU 362 H GLU 362 18.507 35.720 12.373 427 HA GLU 362 HA GLU 362 17.532 33.657 14.172 428 HB2 GLU 362 2HB GLU 362 17.171 35.678 15.696 429 HB3 GLU 362 1HB GLU 362 18.838 35.389 15.205 430 HG2 GLU 362 2HG GLU 362 18.518 37.165 13.421 431 HG3 GLU 362 1HG GLU 362 16.946 37.509 14.139 432 H TRP 363 H TRP 363 15.877 33.029 12.524 433 HA TRP 363 HA TRP 363 13.659 34.866 12.095 434 HB2 TRP 363 2HB TRP 363 14.520 33.131 10.355 435 HB3 TRP 363 1HB TRP 363 13.658 31.922 11.301 436 HD1 TRP 363 HD1 TRP 363 13.065 34.936 9.025 437 HE1 TRP 363 HE1 TRP 363 10.617 34.953 8.264 438 HE3 TRP 363 HE3 TRP 363 11.231 31.171 11.951 439 HZ2 TRP 363 HZ2 TRP 363 8.250 33.590 8.800 440 HZ3 TRP 363 HZ3 TRP 363 8.845 30.580 11.772 441 HH2 TRP 363 HH2 TRP 363 7.377 31.776 10.222 442 H TYR 364 H TYR 364 12.716 35.223 14.034 443 HA TYR 364 HA TYR 364 11.411 32.947 15.398 444 HB2 TYR 364 2HB TYR 364 11.796 35.842 16.319 445 HB3 TYR 364 1HB TYR 364 10.939 34.600 17.228 446 HD1 TYR 364 HD1 TYR 364 14.269 35.773 16.134 447 HD2 TYR 364 HD2 TYR 364 12.181 32.796 18.370 448 HE1 TYR 364 HE1 TYR 364 16.374 35.070 17.171 449 HE2 TYR 364 HE2 TYR 364 14.299 32.096 19.412 450 HH TYR 364 HH TYR 364 16.781 32.219 18.825 451 H CYS 365 H CYS 365 9.399 32.569 14.776 452 HA CYS 365 HA CYS 365 7.816 34.055 13.033 453 HB2 CYS 365 2HB CYS 365 6.012 32.518 13.571 454 HB3 CYS 365 1HB CYS 365 7.514 31.606 13.597 455 HA PRO 366 HA PRO 366 5.761 37.594 14.988 456 HB2 PRO 366 2HB PRO 366 3.346 35.769 14.665 457 HB3 PRO 366 1HB PRO 366 3.446 37.526 14.448 458 HG2 PRO 366 2HG PRO 366 3.627 35.839 12.357 459 HG3 PRO 366 1HG PRO 366 4.561 37.350 12.417 460 HD2 PRO 366 2HD PRO 366 5.525 34.570 12.580 461 HD3 PRO 366 1HD PRO 366 6.458 36.061 12.327 462 H SER 367 H SER 367 4.368 34.508 16.156 463 HA SER 367 HA SER 367 3.417 35.372 18.618 464 HB2 SER 367 2HB SER 367 4.352 32.595 17.839 465 HB3 SER 367 1HB SER 367 3.192 32.992 19.121 466 HG SER 367 HG SER 367 1.816 33.842 17.499 467 H CYS 368 H CYS 368 6.649 34.290 17.795 468 HA CYS 368 HA CYS 368 7.616 34.043 20.502 469 HB2 CYS 368 2HB CYS 368 8.937 33.951 17.782 470 HB3 CYS 368 1HB CYS 368 9.885 33.912 19.273 471 H ARG 369 H ARG 369 7.809 36.518 17.926 472 HA ARG 369 HA ARG 369 9.363 38.323 19.651 473 HB2 ARG 369 2HB ARG 369 9.417 39.844 17.656 474 HB3 ARG 369 1HB ARG 369 10.092 38.254 17.330 475 HG2 ARG 369 2HG ARG 369 8.223 37.601 16.013 476 HG3 ARG 369 1HG ARG 369 7.232 38.932 16.607 477 HD2 ARG 369 2HD ARG 369 7.946 39.345 14.299 478 HD3 ARG 369 1HD ARG 369 8.627 40.549 15.392 479 HE ARG 369 HE ARG 369 10.413 38.337 14.843 480 HH11 ARG 369 1HH1 ARG 369 9.372 41.532 13.768 481 HH12 ARG 369 2HH1 ARG 369 10.777 41.777 12.786 482 HH21 ARG 369 1HH2 ARG 369 12.254 38.719 13.517 483 HH22 ARG 369 2HH2 ARG 369 12.398 40.210 12.651 484 H THR 370 H THR 370 6.196 37.551 19.404 485 HA THR 370 HA THR 370 5.254 40.086 20.564 486 HB THR 370 HB THR 370 3.789 38.606 18.315 487 HG1 THR 370 HG1 THR 370 5.484 40.791 18.345 488 HG21 THR 370 1HG2 THR 370 2.974 41.134 19.802 489 HG22 THR 370 2HG2 THR 370 2.193 39.557 19.951 490 HG23 THR 370 3HG2 THR 370 2.128 40.430 18.419 491 H ASP 371 H ASP 371 4.906 39.296 22.592 492 HA ASP 371 HA ASP 371 4.057 36.636 23.214 493 HB2 ASP 371 2HB ASP 371 4.051 37.368 25.552 494 HB3 ASP 371 1HB ASP 371 5.489 37.976 24.743 495 H SER 372 H SER 372 2.308 39.315 22.155 496 HA SER 372 HA SER 372 -0.250 38.721 23.387 497 HB2 SER 372 2HB SER 372 0.439 40.496 20.994 498 HB3 SER 372 1HB SER 372 -1.088 40.498 21.880 499 HG SER 372 HG SER 372 0.332 40.977 23.781 500 H SER 373 H SER 373 1.492 36.977 21.218 501 HA SER 373 HA SER 373 -0.865 35.929 19.775 502 HB2 SER 373 2HB SER 373 0.309 37.439 18.224 503 HB3 SER 373 1HB SER 373 1.838 36.608 18.510 504 HG SER 373 HG SER 373 -0.389 35.823 17.025 505 H GLU 374 H GLU 374 -0.733 33.746 19.203 506 HA GLU 374 HA GLU 374 1.581 32.111 19.923 507 HB2 GLU 374 2HB GLU 374 0.092 30.428 21.055 508 HB3 GLU 374 1HB GLU 374 0.220 31.947 21.933 509 HG2 GLU 374 2HG GLU 374 -1.983 32.640 21.063 510 HG3 GLU 374 1HG GLU 374 -2.115 31.121 20.179 511 H VAL 375 H VAL 375 1.926 30.456 18.456 512 HA VAL 375 HA VAL 375 -0.222 29.818 16.504 513 HB VAL 375 HB VAL 375 1.637 29.242 14.834 514 HG11 VAL 375 1HG1 VAL 375 0.234 31.247 14.555 515 HG12 VAL 375 2HG1 VAL 375 1.884 31.568 14.020 516 HG13 VAL 375 3HG1 VAL 375 1.328 32.181 15.580 517 HG21 VAL 375 1HG2 VAL 375 3.841 30.368 15.083 518 HG22 VAL 375 2HG2 VAL 375 3.576 29.192 16.370 519 HG23 VAL 375 3HG2 VAL 375 3.379 30.912 16.700 520 H VAL 376 H VAL 376 -0.978 28.145 17.682 521 HA VAL 376 HA VAL 376 0.498 25.622 17.447 522 HB VAL 376 HB VAL 376 0.731 26.289 19.832 523 HG11 VAL 376 1HG1 VAL 376 -1.234 26.521 21.340 524 HG12 VAL 376 2HG1 VAL 376 -2.313 26.361 19.954 525 HG13 VAL 376 3HG1 VAL 376 -1.239 27.754 20.074 526 HG21 VAL 376 1HG2 VAL 376 0.535 23.877 19.337 527 HG22 VAL 376 2HG2 VAL 376 -1.220 23.970 19.485 528 HG23 VAL 376 3HG2 VAL 376 -0.201 24.237 20.902 529 H GLN 377 H GLN 377 -0.876 23.858 16.967 530 HA GLN 377 HA GLN 377 -3.691 24.505 16.327 531 HB2 GLN 377 2HB GLN 377 -2.048 24.676 14.332 532 HB3 GLN 377 1HB GLN 377 -1.870 22.931 14.451 533 HG2 GLN 377 2HG GLN 377 -4.518 24.347 13.999 534 HG3 GLN 377 1HG GLN 377 -3.490 23.765 12.693 535 HE21 GLN 377 1HE2 GLN 377 -6.249 23.023 13.408 536 HE22 GLN 377 2HE2 GLN 377 -6.232 21.310 13.633 537 H ALA 378 H ALA 378 -5.018 23.034 17.162 538 HA ALA 378 HA ALA 378 -4.139 20.230 17.571 539 HB1 ALA 378 1HB ALA 378 -6.108 21.836 19.267 540 HB2 ALA 378 2HB ALA 378 -4.469 21.379 19.742 541 HB3 ALA 378 3HB ALA 378 -5.693 20.133 19.494 542 H GLY 379 H GLY 379 -5.738 18.631 17.111 543 HA2 GLY 379 2HA GLY 379 -7.967 18.009 16.385 544 HA3 GLY 379 1HA GLY 379 -8.078 19.520 15.492 545 H GLU 380 H GLU 380 -5.210 19.134 14.500 546 HA GLU 380 HA GLU 380 -5.785 17.153 12.386 547 HB2 GLU 380 2HB GLU 380 -3.577 19.265 12.510 548 HB3 GLU 380 1HB GLU 380 -3.859 18.153 11.171 549 HG2 GLU 380 2HG GLU 380 -5.636 20.425 12.098 550 HG3 GLU 380 1HG GLU 380 -4.750 20.298 10.580 Start of MODEL 15 1 H1 SER 303 H SER 303 5.028 -0.395 13.780 2 HA SER 303 HA SER 303 6.916 -2.550 13.816 3 HB2 SER 303 2HB SER 303 5.036 -1.701 11.572 4 HB3 SER 303 1HB SER 303 5.800 -3.282 11.759 5 HG SER 303 HG SER 303 3.946 -2.107 13.573 6 H GLY 304 H GLY 304 7.229 0.667 12.772 7 HA2 GLY 304 2HA GLY 304 9.840 0.265 11.697 8 HA3 GLY 304 1HA GLY 304 8.684 0.606 10.411 9 HA PRO 305 HA PRO 305 10.011 4.822 11.897 10 HB2 PRO 305 2HB PRO 305 10.522 5.922 9.499 11 HB3 PRO 305 1HB PRO 305 11.635 4.726 10.181 12 HG2 PRO 305 2HG PRO 305 9.470 4.344 8.113 13 HG3 PRO 305 1HG PRO 305 11.154 3.775 8.084 14 HD2 PRO 305 2HD PRO 305 9.029 2.196 8.875 15 HD3 PRO 305 1HD PRO 305 10.695 1.956 9.444 16 H SER 306 H SER 306 7.349 4.026 11.937 17 HA SER 306 HA SER 306 5.718 5.406 10.002 18 HB2 SER 306 2HB SER 306 4.953 3.785 12.463 19 HB3 SER 306 1HB SER 306 3.849 4.292 11.171 20 HG SER 306 HG SER 306 5.403 3.105 9.748 21 H CYS 307 H CYS 307 4.346 7.090 10.351 22 HA CYS 307 HA CYS 307 5.004 9.054 12.320 23 HB2 CYS 307 2HB CYS 307 3.105 8.827 10.015 24 HB3 CYS 307 1HB CYS 307 2.783 10.067 11.213 25 H ARG 308 H ARG 308 4.456 8.613 14.432 26 HA ARG 308 HA ARG 308 2.238 6.942 15.125 27 HB2 ARG 308 2HB ARG 308 2.875 7.466 17.516 28 HB3 ARG 308 1HB ARG 308 4.146 6.756 16.535 29 HG2 ARG 308 2HG ARG 308 5.280 8.890 16.340 30 HG3 ARG 308 1HG ARG 308 3.943 9.728 17.126 31 HD2 ARG 308 2HD ARG 308 5.933 9.337 18.618 32 HD3 ARG 308 1HD ARG 308 4.424 8.670 19.245 33 HE ARG 308 HE ARG 308 5.457 6.538 17.999 34 HH11 ARG 308 1HH1 ARG 308 7.109 8.790 20.138 35 HH12 ARG 308 2HH1 ARG 308 8.088 7.556 20.863 36 HH21 ARG 308 1HH2 ARG 308 6.728 4.943 18.975 37 HH22 ARG 308 2HH2 ARG 308 7.869 5.380 20.209 38 H PHE 309 H PHE 309 2.816 10.451 15.681 39 HA PHE 309 HA PHE 309 0.266 10.883 16.946 40 HB2 PHE 309 2HB PHE 309 2.162 12.955 15.769 41 HB3 PHE 309 1HB PHE 309 0.819 13.289 16.853 42 HD1 PHE 309 HD1 PHE 309 3.939 13.842 17.030 43 HD2 PHE 309 HD2 PHE 309 1.306 11.016 18.858 44 HE1 PHE 309 HE1 PHE 309 5.434 13.704 18.960 45 HE2 PHE 309 HE2 PHE 309 2.819 10.869 20.792 46 HZ PHE 309 HZ PHE 309 4.889 12.211 20.850 47 H CYS 310 H CYS 310 1.548 11.313 13.684 48 HA CYS 310 HA CYS 310 -0.769 12.613 12.576 49 HB2 CYS 310 2HB CYS 310 1.184 11.060 10.848 50 HB3 CYS 310 1HB CYS 310 0.392 12.599 10.513 51 H LYS 311 H LYS 311 -0.054 9.382 13.472 52 HA LYS 311 HA LYS 311 -0.757 7.299 13.004 53 HB2 LYS 311 2HB LYS 311 -3.336 8.832 12.525 54 HB3 LYS 311 1HB LYS 311 -3.276 7.073 12.427 55 HG2 LYS 311 2HG LYS 311 -2.421 7.022 14.784 56 HG3 LYS 311 1HG LYS 311 -2.633 8.770 14.867 57 HD2 LYS 311 2HD LYS 311 -4.509 7.504 15.929 58 HD3 LYS 311 1HD LYS 311 -5.052 8.538 14.607 59 HE2 LYS 311 2HE LYS 311 -6.129 6.271 14.625 60 HE3 LYS 311 1HE LYS 311 -5.279 6.629 13.124 61 HZ1 LYS 311 1HZ LYS 311 -3.463 5.243 13.820 62 HZ2 LYS 311 2HZ LYS 311 -4.899 4.361 13.947 63 HZ3 LYS 311 3HZ LYS 311 -4.166 4.985 15.334 64 H ASP 312 H ASP 312 0.657 8.541 11.030 65 HA ASP 312 HA ASP 312 1.343 8.586 8.914 66 HB2 ASP 312 2HB ASP 312 -0.102 5.915 8.862 67 HB3 ASP 312 1HB ASP 312 0.919 6.482 7.547 68 H ASP 313 H ASP 313 0.148 10.462 8.468 69 HA ASP 313 HA ASP 313 -2.236 10.486 6.913 70 HB2 ASP 313 2HB ASP 313 0.060 12.498 6.971 71 HB3 ASP 313 1HB ASP 313 -1.502 12.768 6.210 72 H GLU 314 H GLU 314 -1.639 8.584 5.578 73 HA GLU 314 HA GLU 314 0.141 9.050 3.324 74 HB2 GLU 314 2HB GLU 314 -0.906 6.702 2.622 75 HB3 GLU 314 1HB GLU 314 0.345 6.820 3.842 76 HG2 GLU 314 2HG GLU 314 -1.318 5.242 4.571 77 HG3 GLU 314 1HG GLU 314 -1.357 6.650 5.625 78 H ASN 315 H ASN 315 -2.996 9.879 4.101 79 HA ASN 315 HA ASN 315 -3.718 10.351 1.246 80 HB2 ASN 315 2HB ASN 315 -5.459 9.580 3.600 81 HB3 ASN 315 1HB ASN 315 -6.150 10.628 2.368 82 HD21 ASN 315 1HD2 ASN 315 -4.971 7.419 3.052 83 HD22 ASN 315 2HD2 ASN 315 -5.592 6.664 1.631 84 H LYS 316 H LYS 316 -2.499 11.845 3.893 85 HA LYS 316 HA LYS 316 -3.553 14.507 3.143 86 HB2 LYS 316 2HB LYS 316 -3.105 13.532 6.017 87 HB3 LYS 316 1HB LYS 316 -3.548 15.173 5.561 88 HG2 LYS 316 2HG LYS 316 -5.256 12.694 5.175 89 HG3 LYS 316 1HG LYS 316 -5.455 13.897 6.456 90 HD2 LYS 316 2HD LYS 316 -6.033 15.609 4.821 91 HD3 LYS 316 1HD LYS 316 -5.679 14.514 3.481 92 HE2 LYS 316 2HE LYS 316 -7.559 13.070 4.159 93 HE3 LYS 316 1HE LYS 316 -7.896 14.135 5.526 94 HZ1 LYS 316 1HZ LYS 316 -8.042 14.898 2.662 95 HZ2 LYS 316 2HZ LYS 316 -8.371 15.918 3.968 96 HZ3 LYS 316 3HZ LYS 316 -9.359 14.581 3.670 97 HA PRO 317 HA PRO 317 0.903 15.639 3.951 98 HB2 PRO 317 2HB PRO 317 -0.126 18.347 4.696 99 HB3 PRO 317 1HB PRO 317 1.057 17.907 3.460 100 HG2 PRO 317 2HG PRO 317 -1.405 18.746 2.774 101 HG3 PRO 317 1HG PRO 317 -0.589 17.463 1.852 102 HD2 PRO 317 2HD PRO 317 -2.712 17.197 3.992 103 HD3 PRO 317 1HD PRO 317 -2.608 16.392 2.407 104 H CYS 318 H CYS 318 2.104 16.283 5.988 105 HA CYS 318 HA CYS 318 0.796 15.087 8.265 106 HB2 CYS 318 2HB CYS 318 3.610 16.069 7.802 107 HB3 CYS 318 1HB CYS 318 3.049 15.714 9.434 108 H ARG 319 H ARG 319 -0.384 16.115 9.706 109 HA ARG 319 HA ARG 319 -0.115 18.964 10.284 110 HB2 ARG 319 2HB ARG 319 -1.967 16.807 11.399 111 HB3 ARG 319 1HB ARG 319 -1.956 18.460 11.995 112 HG2 ARG 319 2HG ARG 319 -3.787 18.291 10.486 113 HG3 ARG 319 1HG ARG 319 -2.547 19.241 9.673 114 HD2 ARG 319 2HD ARG 319 -3.595 17.677 8.119 115 HD3 ARG 319 1HD ARG 319 -1.901 17.258 8.348 116 HE ARG 319 HE ARG 319 -2.521 15.256 9.275 117 HH11 ARG 319 1HH1 ARG 319 -5.400 17.282 9.120 118 HH12 ARG 319 2HH1 ARG 319 -6.466 15.971 9.503 119 HH21 ARG 319 1HH2 ARG 319 -3.943 13.570 9.770 120 HH22 ARG 319 2HH2 ARG 319 -5.655 13.878 9.879 121 H LYS 320 H LYS 320 1.650 16.342 11.164 122 HA LYS 320 HA LYS 320 2.388 17.350 13.834 123 HB2 LYS 320 2HB LYS 320 1.730 14.481 13.075 124 HB3 LYS 320 1HB LYS 320 2.611 14.888 14.542 125 HG2 LYS 320 2HG LYS 320 -0.160 15.950 13.890 126 HG3 LYS 320 1HG LYS 320 0.125 14.482 14.836 127 HD2 LYS 320 2HD LYS 320 1.192 15.712 16.596 128 HD3 LYS 320 1HD LYS 320 1.313 17.171 15.617 129 HE2 LYS 320 2HE LYS 320 -1.142 17.408 15.660 130 HE3 LYS 320 1HE LYS 320 -1.268 15.934 16.625 131 HZ1 LYS 320 1HZ LYS 320 -0.008 17.016 18.381 132 HZ2 LYS 320 2HZ LYS 320 -1.394 17.909 17.997 133 HZ3 LYS 320 3HZ LYS 320 0.122 18.427 17.454 134 H CYS 321 H CYS 321 3.631 17.335 10.970 135 HA CYS 321 HA CYS 321 6.353 16.967 11.987 136 HB2 CYS 321 2HB CYS 321 5.548 15.697 9.329 137 HB3 CYS 321 1HB CYS 321 7.181 15.778 9.980 138 H ALA 322 H ALA 322 4.262 18.093 9.344 139 HA ALA 322 HA ALA 322 6.265 19.734 8.072 140 HB1 ALA 322 1HB ALA 322 4.445 20.266 6.503 141 HB2 ALA 322 2HB ALA 322 3.272 19.519 7.593 142 HB3 ALA 322 3HB ALA 322 4.508 18.529 6.816 143 H CYS 323 H CYS 323 4.585 21.986 7.337 144 HA CYS 323 HA CYS 323 4.743 23.761 9.586 145 HB2 CYS 323 2HB CYS 323 5.030 24.654 7.343 146 HB3 CYS 323 1HB CYS 323 3.453 24.054 6.837 147 H HIS 324 H HIS 324 3.416 23.334 11.306 148 HA HIS 324 HA HIS 324 1.065 21.729 11.045 149 HB2 HIS 324 2HB HIS 324 2.161 23.154 13.505 150 HB3 HIS 324 1HB HIS 324 0.933 21.889 13.520 151 HD1 HIS 324 HD1 HIS 324 3.844 21.796 14.907 152 HD2 HIS 324 HD2 HIS 324 2.671 19.913 11.399 153 HE1 HIS 324 HE1 HIS 324 5.423 19.857 14.577 154 H VAL 325 H VAL 325 1.524 25.117 10.962 155 HA VAL 325 HA VAL 325 -0.849 26.043 12.201 156 HB VAL 325 HB VAL 325 0.690 27.442 9.967 157 HG11 VAL 325 1HG1 VAL 325 -0.106 29.547 11.015 158 HG12 VAL 325 2HG1 VAL 325 -1.029 28.612 12.195 159 HG13 VAL 325 3HG1 VAL 325 -1.452 28.538 10.483 160 HG21 VAL 325 1HG2 VAL 325 2.269 26.751 11.704 161 HG22 VAL 325 2HG2 VAL 325 1.267 27.494 12.952 162 HG23 VAL 325 3HG2 VAL 325 2.057 28.503 11.737 163 H CYS 326 H CYS 326 -0.150 24.847 9.008 164 HA CYS 326 HA CYS 326 -3.016 24.992 8.250 165 HB2 CYS 326 2HB CYS 326 -2.273 25.229 5.890 166 HB3 CYS 326 1HB CYS 326 -1.703 26.569 6.883 167 H GLY 327 H GLY 327 -0.627 22.994 9.245 168 HA2 GLY 327 2HA GLY 327 -0.112 20.773 9.134 169 HA3 GLY 327 1HA GLY 327 -1.765 20.544 8.591 170 H GLY 328 H GLY 328 0.770 22.344 6.894 171 HA2 GLY 328 2HA GLY 328 0.343 20.587 4.539 172 HA3 GLY 328 1HA GLY 328 0.425 22.337 4.458 173 H ARG 329 H ARG 329 1.989 20.237 3.129 174 HA ARG 329 HA ARG 329 4.762 20.702 4.052 175 HB2 ARG 329 2HB ARG 329 3.559 18.674 2.114 176 HB3 ARG 329 1HB ARG 329 5.292 18.849 2.385 177 HG2 ARG 329 2HG ARG 329 5.024 18.201 4.725 178 HG3 ARG 329 1HG ARG 329 3.273 18.096 4.523 179 HD2 ARG 329 2HD ARG 329 4.502 15.889 4.481 180 HD3 ARG 329 1HD ARG 329 3.465 16.194 3.087 181 HE ARG 329 HE ARG 329 5.310 16.272 1.715 182 HH11 ARG 329 1HH1 ARG 329 6.506 16.304 5.024 183 HH12 ARG 329 2HH1 ARG 329 8.139 15.971 4.554 184 HH21 ARG 329 1HH2 ARG 329 7.451 15.833 1.131 185 HH22 ARG 329 2HH2 ARG 329 8.678 15.705 2.353 186 H GLU 330 H GLU 330 2.544 21.974 1.965 187 HA GLU 330 HA GLU 330 3.907 22.243 -0.507 188 HB2 GLU 330 2HB GLU 330 2.157 24.002 -0.973 189 HB3 GLU 330 1HB GLU 330 1.515 22.447 -0.455 190 HG2 GLU 330 2HG GLU 330 1.254 23.393 1.860 191 HG3 GLU 330 1HG GLU 330 1.747 24.960 1.228 192 H ALA 331 H ALA 331 4.825 24.095 -1.459 193 HA ALA 331 HA ALA 331 6.417 25.688 -1.602 194 HB1 ALA 331 1HB ALA 331 5.767 27.878 -0.725 195 HB2 ALA 331 2HB ALA 331 4.607 27.119 0.372 196 HB3 ALA 331 3HB ALA 331 4.363 27.030 -1.373 197 HA PRO 332 HA PRO 332 8.707 24.553 2.387 198 HB2 PRO 332 2HB PRO 332 10.808 23.219 1.209 199 HB3 PRO 332 1HB PRO 332 9.294 22.425 1.670 200 HG2 PRO 332 2HG PRO 332 10.151 23.470 -1.027 201 HG3 PRO 332 1HG PRO 332 9.404 21.908 -0.623 202 HD2 PRO 332 2HD PRO 332 7.953 23.959 -1.620 203 HD3 PRO 332 1HD PRO 332 7.263 22.842 -0.425 204 H GLU 333 H GLU 333 9.621 26.032 -0.666 205 HA GLU 333 HA GLU 333 11.941 27.442 0.190 206 HB2 GLU 333 2HB GLU 333 11.568 28.876 -1.790 207 HB3 GLU 333 1HB GLU 333 11.399 27.173 -2.199 208 HG2 GLU 333 2HG GLU 333 8.951 27.387 -2.180 209 HG3 GLU 333 1HG GLU 333 9.086 29.068 -1.689 210 H LYS 334 H LYS 334 8.550 27.904 0.752 211 HA LYS 334 HA LYS 334 8.952 30.597 1.910 212 HB2 LYS 334 2HB LYS 334 6.282 29.300 1.190 213 HB3 LYS 334 1HB LYS 334 6.580 30.993 1.601 214 HG2 LYS 334 2HG LYS 334 7.924 31.218 -0.501 215 HG3 LYS 334 1HG LYS 334 7.520 29.549 -0.898 216 HD2 LYS 334 2HD LYS 334 5.997 30.868 -2.159 217 HD3 LYS 334 1HD LYS 334 5.054 30.248 -0.802 218 HE2 LYS 334 2HE LYS 334 4.508 32.582 -1.124 219 HE3 LYS 334 1HE LYS 334 5.419 32.432 0.378 220 HZ1 LYS 334 1HZ LYS 334 6.563 33.268 -2.232 221 HZ2 LYS 334 2HZ LYS 334 7.376 33.212 -0.753 222 HZ3 LYS 334 3HZ LYS 334 6.120 34.317 -0.984 223 H GLN 335 H GLN 335 9.076 27.519 2.945 224 HA GLN 335 HA GLN 335 7.706 27.986 5.512 225 HB2 GLN 335 2HB GLN 335 8.945 25.494 4.277 226 HB3 GLN 335 1HB GLN 335 8.517 25.567 5.986 227 HG2 GLN 335 2HG GLN 335 6.161 26.000 5.387 228 HG3 GLN 335 1HG GLN 335 6.580 25.949 3.675 229 HE21 GLN 335 1HE2 GLN 335 6.895 23.955 2.685 230 HE22 GLN 335 2HE2 GLN 335 6.572 22.447 3.460 231 H LEU 336 H LEU 336 8.786 28.405 7.325 232 HA LEU 336 HA LEU 336 11.726 28.549 7.399 233 HB2 LEU 336 2HB LEU 336 9.695 30.701 8.101 234 HB3 LEU 336 1HB LEU 336 11.329 30.741 8.746 235 HG LEU 336 HG LEU 336 10.668 30.814 5.769 236 HD11 LEU 336 1HD1 LEU 336 11.230 33.201 5.839 237 HD12 LEU 336 2HD1 LEU 336 11.445 33.120 7.590 238 HD13 LEU 336 3HD1 LEU 336 9.851 32.854 6.882 239 HD21 LEU 336 1HD2 LEU 336 12.897 29.890 6.250 240 HD22 LEU 336 2HD2 LEU 336 13.284 31.310 7.229 241 HD23 LEU 336 3HD2 LEU 336 13.016 31.478 5.494 242 H LEU 337 H LEU 337 12.519 27.611 9.161 243 HA LEU 337 HA LEU 337 10.768 26.625 11.283 244 HB2 LEU 337 2HB LEU 337 13.642 26.083 10.460 245 HB3 LEU 337 1HB LEU 337 13.027 25.503 12.000 246 HG LEU 337 HG LEU 337 11.565 24.786 9.434 247 HD11 LEU 337 1HD1 LEU 337 12.849 22.711 9.249 248 HD12 LEU 337 2HD1 LEU 337 13.934 23.246 10.537 249 HD13 LEU 337 3HD1 LEU 337 13.879 24.122 9.004 250 HD21 LEU 337 1HD2 LEU 337 10.434 24.311 11.574 251 HD22 LEU 337 2HD2 LEU 337 11.821 23.363 12.115 252 HD23 LEU 337 3HD2 LEU 337 10.857 22.815 10.740 253 H CYS 338 H CYS 338 10.385 28.015 12.944 254 HA CYS 338 HA CYS 338 12.222 29.975 13.937 255 HB2 CYS 338 2HB CYS 338 9.766 30.097 14.389 256 HB3 CYS 338 1HB CYS 338 9.894 28.669 15.420 257 H ASP 339 H ASP 339 13.906 29.713 15.325 258 HA ASP 339 HA ASP 339 15.127 27.222 15.437 259 HB2 ASP 339 2HB ASP 339 16.355 29.378 15.519 260 HB3 ASP 339 1HB ASP 339 15.768 29.655 17.152 261 H GLU 340 H GLU 340 13.957 29.024 18.363 262 HA GLU 340 HA GLU 340 14.610 26.803 20.058 263 HB2 GLU 340 2HB GLU 340 14.237 28.256 21.842 264 HB3 GLU 340 1HB GLU 340 14.639 29.378 20.569 265 HG2 GLU 340 2HG GLU 340 11.774 28.747 21.301 266 HG3 GLU 340 1HG GLU 340 12.711 29.979 22.140 267 H CYS 341 H CYS 341 11.685 27.886 18.499 268 HA CYS 341 HA CYS 341 9.878 26.138 19.943 269 HB2 CYS 341 2HB CYS 341 9.486 27.662 17.326 270 HB3 CYS 341 1HB CYS 341 8.211 26.823 18.215 271 H ASP 342 H ASP 342 11.975 25.833 17.183 272 HA ASP 342 HA ASP 342 12.413 24.299 15.590 273 HB2 ASP 342 2HB ASP 342 12.822 22.939 17.696 274 HB3 ASP 342 1HB ASP 342 11.201 22.287 17.541 275 H MET 343 H MET 343 10.099 25.685 15.090 276 HA MET 343 HA MET 343 8.126 23.694 14.122 277 HB2 MET 343 2HB MET 343 7.552 25.111 16.256 278 HB3 MET 343 1HB MET 343 7.344 26.452 15.142 279 HG2 MET 343 2HG MET 343 5.213 25.388 15.668 280 HG3 MET 343 1HG MET 343 5.602 25.207 13.955 281 HE1 MET 343 1HE MET 343 6.246 21.726 16.970 282 HE2 MET 343 2HE MET 343 5.794 23.353 17.485 283 HE3 MET 343 3HE MET 343 7.395 23.054 16.799 284 H ALA 344 H ALA 344 7.547 23.895 12.029 285 HA ALA 344 HA ALA 344 8.754 25.950 10.363 286 HB1 ALA 344 1HB ALA 344 8.831 23.628 9.605 287 HB2 ALA 344 2HB ALA 344 7.900 24.602 8.467 288 HB3 ALA 344 3HB ALA 344 7.066 23.530 9.599 289 H PHE 345 H PHE 345 7.757 27.660 9.576 290 HA PHE 345 HA PHE 345 4.809 27.933 9.604 291 HB2 PHE 345 2HB PHE 345 6.852 30.102 10.327 292 HB3 PHE 345 1HB PHE 345 5.116 30.348 10.176 293 HD1 PHE 345 HD1 PHE 345 3.597 29.664 11.951 294 HD2 PHE 345 HD2 PHE 345 7.791 28.917 12.287 295 HE1 PHE 345 HE1 PHE 345 3.321 29.176 14.349 296 HE2 PHE 345 HE2 PHE 345 7.503 28.431 14.680 297 HZ PHE 345 HZ PHE 345 5.272 28.556 15.711 298 H HIS 346 H HIS 346 4.095 28.454 7.539 299 HA HIS 346 HA HIS 346 5.723 29.460 5.439 300 HB2 HIS 346 2HB HIS 346 2.723 29.498 5.909 301 HB3 HIS 346 1HB HIS 346 3.416 30.346 4.536 302 HD2 HIS 346 HD2 HIS 346 4.938 28.607 2.781 303 HE1 HIS 346 HE1 HIS 346 2.477 25.318 3.774 304 HE2 HIS 346 HE2 HIS 346 3.981 26.343 2.023 305 H LEU 347 H LEU 347 5.793 31.646 4.582 306 HA LEU 347 HA LEU 347 5.962 33.780 6.392 307 HB2 LEU 347 2HB LEU 347 5.632 33.715 3.380 308 HB3 LEU 347 1HB LEU 347 5.669 35.237 4.242 309 HG LEU 347 HG LEU 347 7.853 34.936 3.427 310 HD11 LEU 347 1HD1 LEU 347 7.975 34.063 6.316 311 HD12 LEU 347 2HD1 LEU 347 7.797 35.718 5.734 312 HD13 LEU 347 3HD1 LEU 347 9.268 34.821 5.379 313 HD21 LEU 347 1HD2 LEU 347 9.243 32.951 3.726 314 HD22 LEU 347 2HD2 LEU 347 7.776 32.583 2.822 315 HD23 LEU 347 3HD2 LEU 347 7.904 32.116 4.520 316 H TYR 348 H TYR 348 3.230 32.612 4.475 317 HA TYR 348 HA TYR 348 1.434 34.702 5.346 318 HB2 TYR 348 2HB TYR 348 0.743 32.079 3.977 319 HB3 TYR 348 1HB TYR 348 -0.292 33.495 4.111 320 HD1 TYR 348 HD1 TYR 348 0.662 35.732 3.000 321 HD2 TYR 348 HD2 TYR 348 2.033 31.804 2.047 322 HE1 TYR 348 HE1 TYR 348 1.561 36.559 0.862 323 HE2 TYR 348 HE2 TYR 348 2.919 32.629 -0.082 324 HH TYR 348 HH TYR 348 2.643 34.435 -1.620 325 H CYS 349 H CYS 349 2.566 31.811 6.740 326 HA CYS 349 HA CYS 349 0.309 31.524 8.610 327 HB2 CYS 349 2HB CYS 349 2.802 29.830 8.169 328 HB3 CYS 349 1HB CYS 349 1.635 29.522 9.455 329 H LEU 350 H LEU 350 2.110 33.883 8.545 330 HA LEU 350 HA LEU 350 3.169 33.838 11.312 331 HB2 LEU 350 2HB LEU 350 3.830 35.745 9.022 332 HB3 LEU 350 1HB LEU 350 4.516 35.821 10.642 333 HG LEU 350 HG LEU 350 4.973 33.625 8.581 334 HD11 LEU 350 1HD1 LEU 350 6.230 35.653 8.096 335 HD12 LEU 350 2HD1 LEU 350 7.313 34.366 8.616 336 HD13 LEU 350 3HD1 LEU 350 6.893 35.667 9.733 337 HD21 LEU 350 1HD2 LEU 350 6.066 33.782 11.407 338 HD22 LEU 350 2HD2 LEU 350 6.520 32.591 10.185 339 HD23 LEU 350 3HD2 LEU 350 4.876 32.621 10.815 340 H LYS 351 H LYS 351 3.203 36.458 11.943 341 HA LYS 351 HA LYS 351 0.541 37.624 11.580 342 HB2 LYS 351 2HB LYS 351 0.562 36.024 13.635 343 HB3 LYS 351 1HB LYS 351 1.655 37.172 14.387 344 HG2 LYS 351 2HG LYS 351 -0.528 37.647 15.218 345 HG3 LYS 351 1HG LYS 351 -0.107 38.945 14.101 346 HD2 LYS 351 2HD LYS 351 -2.420 38.296 13.725 347 HD3 LYS 351 1HD LYS 351 -1.457 37.827 12.322 348 HE2 LYS 351 2HE LYS 351 -1.375 35.496 13.166 349 HE3 LYS 351 1HE LYS 351 -2.351 35.965 14.562 350 HZ1 LYS 351 1HZ LYS 351 -4.122 36.595 13.007 351 HZ2 LYS 351 2HZ LYS 351 -3.723 34.958 12.891 352 HZ3 LYS 351 3HZ LYS 351 -3.182 36.042 11.716 353 HA PRO 352 HA PRO 352 0.276 39.154 10.370 354 HB2 PRO 352 2HB PRO 352 0.841 41.081 8.583 355 HB3 PRO 352 1HB PRO 352 0.268 41.492 10.208 356 HG2 PRO 352 2HG PRO 352 3.077 41.533 9.114 357 HG3 PRO 352 1HG PRO 352 2.257 42.728 10.144 358 HD2 PRO 352 2HD PRO 352 3.979 40.735 11.079 359 HD3 PRO 352 1HD PRO 352 2.773 41.572 12.075 360 HA PRO 353 HA PRO 353 1.978 36.363 7.208 361 HB2 PRO 353 2HB PRO 353 -0.093 37.741 5.481 362 HB3 PRO 353 1HB PRO 353 0.268 36.015 5.640 363 HG2 PRO 353 2HG PRO 353 -1.840 37.002 6.897 364 HG3 PRO 353 1HG PRO 353 -0.774 35.861 7.749 365 HD2 PRO 353 2HD PRO 353 -0.942 38.863 8.014 366 HD3 PRO 353 1HD PRO 353 -0.719 37.628 9.276 367 H LEU 354 H LEU 354 3.972 36.954 6.567 368 HA LEU 354 HA LEU 354 4.604 39.299 4.983 369 HB2 LEU 354 2HB LEU 354 6.326 36.839 5.521 370 HB3 LEU 354 1HB LEU 354 6.887 38.378 4.882 371 HG LEU 354 HG LEU 354 5.900 37.838 7.716 372 HD11 LEU 354 1HD1 LEU 354 8.159 36.976 7.270 373 HD12 LEU 354 2HD1 LEU 354 8.211 38.338 8.385 374 HD13 LEU 354 3HD1 LEU 354 8.670 38.566 6.694 375 HD21 LEU 354 1HD2 LEU 354 5.213 40.093 7.074 376 HD22 LEU 354 2HD2 LEU 354 6.849 40.463 6.521 377 HD23 LEU 354 3HD2 LEU 354 6.540 40.166 8.235 378 H THR 355 H THR 355 5.806 38.991 2.837 379 HA THR 355 HA THR 355 4.261 37.224 1.076 380 HB THR 355 HB THR 355 4.433 39.502 0.303 381 HG1 THR 355 HG1 THR 355 4.689 38.855 -1.682 382 HG21 THR 355 1HG2 THR 355 6.527 40.216 1.411 383 HG22 THR 355 2HG2 THR 355 6.544 40.611 -0.310 384 HG23 THR 355 3HG2 THR 355 7.462 39.226 0.290 385 H SER 356 H SER 356 7.732 37.830 1.821 386 HA SER 356 HA SER 356 8.444 35.121 0.906 387 HB2 SER 356 2HB SER 356 9.761 37.677 -0.121 388 HB3 SER 356 1HB SER 356 10.380 36.049 -0.398 389 HG SER 356 HG SER 356 7.955 37.179 -1.325 390 H VAL 357 H VAL 357 10.847 34.685 1.425 391 HA VAL 357 HA VAL 357 11.192 34.822 4.204 392 HB VAL 357 HB VAL 357 13.323 34.219 2.093 393 HG11 VAL 357 1HG1 VAL 357 14.355 34.682 4.272 394 HG12 VAL 357 2HG1 VAL 357 14.491 32.966 3.893 395 HG13 VAL 357 3HG1 VAL 357 13.283 33.517 5.056 396 HG21 VAL 357 1HG2 VAL 357 11.370 32.730 1.850 397 HG22 VAL 357 2HG2 VAL 357 11.462 32.298 3.559 398 HG23 VAL 357 3HG2 VAL 357 12.761 31.831 2.457 399 HA PRO 358 HA PRO 358 12.914 39.048 4.298 400 HB2 PRO 358 2HB PRO 358 13.053 39.350 7.001 401 HB3 PRO 358 1HB PRO 358 11.516 39.410 6.126 402 HG2 PRO 358 2HG PRO 358 12.744 37.112 7.653 403 HG3 PRO 358 1HG PRO 358 11.070 37.706 7.681 404 HD2 PRO 358 2HD PRO 358 11.842 35.548 6.201 405 HD3 PRO 358 1HD PRO 358 10.516 36.606 5.705 406 HA PRO 359 HA PRO 359 17.326 38.146 4.707 407 HB2 PRO 359 2HB PRO 359 18.393 40.613 4.642 408 HB3 PRO 359 1HB PRO 359 17.447 40.011 3.266 409 HG2 PRO 359 2HG PRO 359 16.532 41.760 5.567 410 HG3 PRO 359 1HG PRO 359 16.350 42.053 3.820 411 HD2 PRO 359 2HD PRO 359 14.353 40.970 5.322 412 HD3 PRO 359 1HD PRO 359 14.604 40.506 3.621 413 H GLU 360 H GLU 360 15.621 38.754 7.303 414 HA GLU 360 HA GLU 360 17.135 39.880 9.307 415 HB2 GLU 360 2HB GLU 360 15.278 37.484 9.538 416 HB3 GLU 360 1HB GLU 360 15.812 38.483 10.885 417 HG2 GLU 360 2HG GLU 360 14.072 39.380 8.568 418 HG3 GLU 360 1HG GLU 360 13.526 39.013 10.200 419 HA PRO 361 HA PRO 361 20.589 36.895 9.583 420 HB2 PRO 361 2HB PRO 361 21.953 38.101 11.608 421 HB3 PRO 361 1HB PRO 361 21.907 38.781 9.974 422 HG2 PRO 361 2HG PRO 361 20.253 39.528 12.390 423 HG3 PRO 361 1HG PRO 361 21.108 40.594 11.252 424 HD2 PRO 361 2HD PRO 361 18.424 40.095 11.053 425 HD3 PRO 361 1HD PRO 361 19.438 40.405 9.627 426 H GLU 362 H GLU 362 18.108 37.434 11.794 427 HA GLU 362 HA GLU 362 18.428 34.794 12.988 428 HB2 GLU 362 2HB GLU 362 17.833 35.677 15.270 429 HB3 GLU 362 1HB GLU 362 19.406 36.238 14.712 430 HG2 GLU 362 2HG GLU 362 18.327 38.389 14.011 431 HG3 GLU 362 1HG GLU 362 16.828 37.833 14.746 432 H TRP 363 H TRP 363 16.428 33.785 13.065 433 HA TRP 363 HA TRP 363 14.026 35.435 12.554 434 HB2 TRP 363 2HB TRP 363 14.903 34.276 10.434 435 HB3 TRP 363 1HB TRP 363 14.485 32.743 11.191 436 HD1 TRP 363 HD1 TRP 363 12.891 35.822 9.558 437 HE1 TRP 363 HE1 TRP 363 10.404 35.361 9.124 438 HE3 TRP 363 HE3 TRP 363 12.389 31.371 12.080 439 HZ2 TRP 363 HZ2 TRP 363 8.499 33.411 9.744 440 HZ3 TRP 363 HZ3 TRP 363 10.173 30.294 12.115 441 HH2 TRP 363 HH2 TRP 363 8.262 31.300 10.976 442 H TYR 364 H TYR 364 12.570 35.125 14.019 443 HA TYR 364 HA TYR 364 12.007 32.434 15.092 444 HB2 TYR 364 2HB TYR 364 11.809 34.973 16.788 445 HB3 TYR 364 1HB TYR 364 11.528 33.319 17.314 446 HD1 TYR 364 HD1 TYR 364 14.089 35.836 16.493 447 HD2 TYR 364 HD2 TYR 364 13.501 31.789 17.876 448 HE1 TYR 364 HE1 TYR 364 16.444 35.709 17.177 449 HE2 TYR 364 HE2 TYR 364 15.860 31.707 18.526 450 HH TYR 364 HH TYR 364 17.831 34.416 18.797 451 H CYS 365 H CYS 365 9.692 32.344 15.874 452 HA CYS 365 HA CYS 365 7.933 33.297 13.823 453 HB2 CYS 365 2HB CYS 365 6.192 32.013 15.013 454 HB3 CYS 365 1HB CYS 365 7.671 31.060 14.898 455 HA PRO 366 HA PRO 366 6.224 37.066 15.644 456 HB2 PRO 366 2HB PRO 366 3.461 36.642 15.488 457 HB3 PRO 366 1HB PRO 366 4.475 37.192 14.148 458 HG2 PRO 366 2HG PRO 366 3.566 34.385 14.808 459 HG3 PRO 366 1HG PRO 366 3.560 35.223 13.239 460 HD2 PRO 366 2HD PRO 366 5.478 33.481 13.802 461 HD3 PRO 366 1HD PRO 366 5.895 35.003 12.980 462 H SER 367 H SER 367 4.994 33.972 16.870 463 HA SER 367 HA SER 367 3.879 34.866 19.309 464 HB2 SER 367 2HB SER 367 3.468 32.615 18.274 465 HB3 SER 367 1HB SER 367 5.094 32.134 18.750 466 HG SER 367 HG SER 367 4.342 31.736 20.661 467 H CYS 368 H CYS 368 7.171 34.547 18.348 468 HA CYS 368 HA CYS 368 8.290 34.380 21.016 469 HB2 CYS 368 2HB CYS 368 9.418 34.413 18.238 470 HB3 CYS 368 1HB CYS 368 10.479 34.878 19.570 471 H ARG 369 H ARG 369 6.869 36.944 19.418 472 HA ARG 369 HA ARG 369 8.423 38.902 21.033 473 HB2 ARG 369 2HB ARG 369 8.081 40.615 19.252 474 HB3 ARG 369 1HB ARG 369 9.103 39.284 18.733 475 HG2 ARG 369 2HG ARG 369 7.306 38.337 17.405 476 HG3 ARG 369 1HG ARG 369 6.157 39.516 18.040 477 HD2 ARG 369 2HD ARG 369 8.571 40.159 16.303 478 HD3 ARG 369 1HD ARG 369 6.890 40.089 15.755 479 HE ARG 369 HE ARG 369 6.868 41.880 17.831 480 HH11 ARG 369 1HH1 ARG 369 8.597 41.723 14.779 481 HH12 ARG 369 2HH1 ARG 369 8.723 43.445 14.627 482 HH21 ARG 369 1HH2 ARG 369 7.040 44.122 17.629 483 HH22 ARG 369 2HH2 ARG 369 7.843 44.806 16.251 484 H THR 370 H THR 370 5.339 37.988 19.643 485 HA THR 370 HA THR 370 3.789 39.499 21.600 486 HB THR 370 HB THR 370 4.064 41.100 19.706 487 HG1 THR 370 HG1 THR 370 1.831 41.500 19.389 488 HG21 THR 370 1HG2 THR 370 3.097 40.653 17.491 489 HG22 THR 370 2HG2 THR 370 2.671 39.015 17.989 490 HG23 THR 370 3HG2 THR 370 4.368 39.482 17.854 491 H ASP 371 H ASP 371 1.474 38.713 21.603 492 HA ASP 371 HA ASP 371 -0.167 37.109 21.501 493 HB2 ASP 371 2HB ASP 371 -0.120 37.766 19.088 494 HB3 ASP 371 1HB ASP 371 1.112 36.555 18.768 495 H SER 372 H SER 372 2.285 36.463 22.836 496 HA SER 372 HA SER 372 3.504 34.043 21.986 497 HB2 SER 372 2HB SER 372 4.623 35.851 23.326 498 HB3 SER 372 1HB SER 372 3.698 35.335 24.734 499 HG SER 372 HG SER 372 5.619 33.845 23.266 500 H SER 373 H SER 373 0.651 34.569 23.778 501 HA SER 373 HA SER 373 0.613 32.196 25.365 502 HB2 SER 373 2HB SER 373 -1.862 32.773 25.597 503 HB3 SER 373 1HB SER 373 -0.745 34.052 26.080 504 HG SER 373 HG SER 373 -2.112 33.854 23.596 505 H GLU 374 H GLU 374 1.312 30.687 23.754 506 HA GLU 374 HA GLU 374 -0.782 29.703 21.907 507 HB2 GLU 374 2HB GLU 374 1.044 28.696 20.583 508 HB3 GLU 374 1HB GLU 374 1.292 30.432 20.736 509 HG2 GLU 374 2HG GLU 374 3.032 30.113 22.379 510 HG3 GLU 374 1HG GLU 374 2.704 28.384 22.478 511 H VAL 375 H VAL 375 -0.206 27.192 21.499 512 HA VAL 375 HA VAL 375 -0.587 25.691 23.866 513 HB VAL 375 HB VAL 375 -0.175 23.669 22.468 514 HG11 VAL 375 1HG1 VAL 375 -2.413 24.700 22.376 515 HG12 VAL 375 2HG1 VAL 375 -2.000 23.991 20.816 516 HG13 VAL 375 3HG1 VAL 375 -1.903 25.739 21.042 517 HG21 VAL 375 1HG2 VAL 375 0.421 23.881 20.061 518 HG22 VAL 375 2HG2 VAL 375 1.712 24.487 21.097 519 HG23 VAL 375 3HG2 VAL 375 0.644 25.620 20.267 520 H VAL 376 H VAL 376 0.857 24.210 24.917 521 HA VAL 376 HA VAL 376 3.472 25.197 25.398 522 HB VAL 376 HB VAL 376 3.816 23.189 26.824 523 HG11 VAL 376 1HG1 VAL 376 2.645 25.138 27.765 524 HG12 VAL 376 2HG1 VAL 376 2.019 23.643 28.464 525 HG13 VAL 376 3HG1 VAL 376 1.093 24.493 27.223 526 HG21 VAL 376 1HG2 VAL 376 2.634 21.485 25.471 527 HG22 VAL 376 2HG2 VAL 376 1.086 22.254 25.827 528 HG23 VAL 376 3HG2 VAL 376 2.019 21.507 27.126 529 H GLN 377 H GLN 377 5.465 24.490 24.722 530 HA GLN 377 HA GLN 377 5.672 22.323 22.734 531 HB2 GLN 377 2HB GLN 377 7.056 23.676 21.235 532 HB3 GLN 377 1HB GLN 377 5.500 24.455 21.450 533 HG2 GLN 377 2HG GLN 377 8.108 25.301 22.764 534 HG3 GLN 377 1HG GLN 377 7.366 26.075 21.368 535 HE21 GLN 377 1HE2 GLN 377 5.472 27.316 21.689 536 HE22 GLN 377 2HE2 GLN 377 5.031 27.919 23.244 537 H ALA 378 H ALA 378 7.393 21.020 23.127 538 HA ALA 378 HA ALA 378 9.059 21.491 25.452 539 HB1 ALA 378 1HB ALA 378 9.912 19.224 25.024 540 HB2 ALA 378 2HB ALA 378 9.068 19.184 23.475 541 HB3 ALA 378 3HB ALA 378 8.147 19.252 24.979 542 H GLY 379 H GLY 379 11.445 21.135 25.330 543 HA2 GLY 379 2HA GLY 379 13.540 21.461 24.321 544 HA3 GLY 379 1HA GLY 379 12.762 22.108 22.883 545 H GLU 380 H GLU 380 11.171 23.644 25.267 546 HA GLU 380 HA GLU 380 13.110 25.526 26.239 547 HB2 GLU 380 2HB GLU 380 12.740 26.370 23.895 548 HB3 GLU 380 1HB GLU 380 11.024 26.528 24.233 549 HG2 GLU 380 2HG GLU 380 12.128 28.697 24.342 550 HG3 GLU 380 1HG GLU 380 11.481 28.248 25.918 Start of MODEL 16 1 H1 SER 303 H SER 303 19.338 4.425 5.724 2 HA SER 303 HA SER 303 20.347 6.112 7.805 3 HB2 SER 303 2HB SER 303 21.702 4.340 6.650 4 HB3 SER 303 1HB SER 303 21.701 5.322 5.187 5 HG SER 303 HG SER 303 22.842 6.930 6.347 6 H GLY 304 H GLY 304 18.597 6.919 5.018 7 HA2 GLY 304 2HA GLY 304 19.702 9.521 4.437 8 HA3 GLY 304 1HA GLY 304 18.131 8.910 3.943 9 HA PRO 305 HA PRO 305 17.204 12.029 7.293 10 HB2 PRO 305 2HB PRO 305 15.610 13.699 5.933 11 HB3 PRO 305 1HB PRO 305 17.353 13.695 5.621 12 HG2 PRO 305 2HG PRO 305 15.143 12.393 4.036 13 HG3 PRO 305 1HG PRO 305 16.530 13.332 3.447 14 HD2 PRO 305 2HD PRO 305 16.443 10.538 3.553 15 HD3 PRO 305 1HD PRO 305 17.937 11.497 3.498 16 H SER 306 H SER 306 16.138 9.480 7.267 17 HA SER 306 HA SER 306 13.414 9.147 6.722 18 HB2 SER 306 2HB SER 306 13.629 7.127 8.232 19 HB3 SER 306 1HB SER 306 14.878 7.233 6.992 20 HG SER 306 HG SER 306 16.038 6.854 8.761 21 H CYS 307 H CYS 307 11.637 9.875 7.714 22 HA CYS 307 HA CYS 307 11.787 11.530 10.057 23 HB2 CYS 307 2HB CYS 307 9.625 10.739 8.133 24 HB3 CYS 307 1HB CYS 307 9.155 11.410 9.688 25 H ARG 308 H ARG 308 12.380 10.317 11.799 26 HA ARG 308 HA ARG 308 10.948 7.929 12.605 27 HB2 ARG 308 2HB ARG 308 12.546 7.991 14.588 28 HB3 ARG 308 1HB ARG 308 13.296 7.860 13.010 29 HG2 ARG 308 2HG ARG 308 14.696 9.387 14.051 30 HG3 ARG 308 1HG ARG 308 13.603 10.457 13.186 31 HD2 ARG 308 2HD ARG 308 12.353 10.836 15.293 32 HD3 ARG 308 1HD ARG 308 13.474 9.759 16.137 33 HE ARG 308 HE ARG 308 14.469 12.170 14.749 34 HH11 ARG 308 1HH1 ARG 308 14.112 10.390 17.773 35 HH12 ARG 308 2HH1 ARG 308 15.162 11.459 18.643 36 HH21 ARG 308 1HH2 ARG 308 15.812 13.561 15.930 37 HH22 ARG 308 2HH2 ARG 308 16.121 13.237 17.604 38 H PHE 309 H PHE 309 10.874 11.360 13.356 39 HA PHE 309 HA PHE 309 9.380 11.046 15.817 40 HB2 PHE 309 2HB PHE 309 10.790 13.223 14.537 41 HB3 PHE 309 1HB PHE 309 9.134 13.763 14.784 42 HD1 PHE 309 HD1 PHE 309 8.300 14.209 17.020 43 HD2 PHE 309 HD2 PHE 309 12.170 12.500 16.448 44 HE1 PHE 309 HE1 PHE 309 8.823 14.583 19.397 45 HE2 PHE 309 HE2 PHE 309 12.693 12.865 18.797 46 HZ PHE 309 HZ PHE 309 11.019 13.913 20.292 47 H CYS 310 H CYS 310 8.626 11.767 12.457 48 HA CYS 310 HA CYS 310 5.870 12.447 12.883 49 HB2 CYS 310 2HB CYS 310 7.238 11.642 10.296 50 HB3 CYS 310 1HB CYS 310 5.681 12.458 10.435 51 H LYS 311 H LYS 311 7.600 9.472 12.510 52 HA LYS 311 HA LYS 311 7.046 7.323 12.917 53 HB2 LYS 311 2HB LYS 311 4.276 8.343 13.653 54 HB3 LYS 311 1HB LYS 311 4.914 6.746 14.027 55 HG2 LYS 311 2HG LYS 311 6.028 9.355 15.112 56 HG3 LYS 311 1HG LYS 311 4.910 8.293 15.970 57 HD2 LYS 311 2HD LYS 311 6.603 6.485 15.935 58 HD3 LYS 311 1HD LYS 311 7.721 7.547 15.070 59 HE2 LYS 311 2HE LYS 311 8.303 7.525 17.430 60 HE3 LYS 311 1HE LYS 311 7.677 9.116 17.009 61 HZ1 LYS 311 1HZ LYS 311 5.528 8.449 17.966 62 HZ2 LYS 311 2HZ LYS 311 6.774 8.402 19.105 63 HZ3 LYS 311 3HZ LYS 311 6.189 6.961 18.432 64 H ASP 312 H ASP 312 5.757 9.000 10.400 65 HA ASP 312 HA ASP 312 4.409 8.767 8.628 66 HB2 ASP 312 2HB ASP 312 6.248 7.121 8.072 67 HB3 ASP 312 1HB ASP 312 5.242 5.836 8.726 68 H ASP 313 H ASP 313 2.514 9.272 9.800 69 HA ASP 313 HA ASP 313 0.908 7.309 11.138 70 HB2 ASP 313 2HB ASP 313 0.886 9.635 11.910 71 HB3 ASP 313 1HB ASP 313 0.335 10.196 10.342 72 H GLU 314 H GLU 314 -1.284 6.822 10.604 73 HA GLU 314 HA GLU 314 -1.707 5.570 8.175 74 HB2 GLU 314 2HB GLU 314 -3.843 6.523 10.124 75 HB3 GLU 314 1HB GLU 314 -4.012 5.214 8.961 76 HG2 GLU 314 2HG GLU 314 -2.144 5.220 11.353 77 HG3 GLU 314 1HG GLU 314 -3.706 4.402 11.272 78 H ASN 315 H ASN 315 -2.843 8.706 9.287 79 HA ASN 315 HA ASN 315 -4.458 9.168 6.891 80 HB2 ASN 315 2HB ASN 315 -4.056 10.980 9.314 81 HB3 ASN 315 1HB ASN 315 -5.287 11.149 8.068 82 HD21 ASN 315 1HD2 ASN 315 -5.834 8.179 8.082 83 HD22 ASN 315 2HD2 ASN 315 -6.721 7.914 9.537 84 H LYS 316 H LYS 316 -1.764 10.720 8.663 85 HA LYS 316 HA LYS 316 -0.857 12.088 6.197 86 HB2 LYS 316 2HB LYS 316 -1.368 13.468 8.866 87 HB3 LYS 316 1HB LYS 316 -0.293 14.142 7.657 88 HG2 LYS 316 2HG LYS 316 -2.222 15.305 7.195 89 HG3 LYS 316 1HG LYS 316 -2.381 13.957 6.072 90 HD2 LYS 316 2HD LYS 316 -3.855 12.820 7.784 91 HD3 LYS 316 1HD LYS 316 -3.772 14.291 8.755 92 HE2 LYS 316 2HE LYS 316 -4.950 14.024 5.965 93 HE3 LYS 316 1HE LYS 316 -5.841 14.280 7.465 94 HZ1 LYS 316 1HZ LYS 316 -5.634 16.345 6.283 95 HZ2 LYS 316 2HZ LYS 316 -3.955 16.186 6.178 96 HZ3 LYS 316 3HZ LYS 316 -4.689 16.436 7.683 97 HA PRO 317 HA PRO 317 2.809 9.878 7.681 98 HB2 PRO 317 2HB PRO 317 4.148 11.583 5.591 99 HB3 PRO 317 1HB PRO 317 4.248 9.835 5.846 100 HG2 PRO 317 2HG PRO 317 2.785 10.811 3.845 101 HG3 PRO 317 1HG PRO 317 2.181 9.434 4.794 102 HD2 PRO 317 2HD PRO 317 1.394 12.342 4.948 103 HD3 PRO 317 1HD PRO 317 0.369 10.891 5.050 104 H CYS 318 H CYS 318 3.035 13.405 6.980 105 HA CYS 318 HA CYS 318 4.889 13.729 9.284 106 HB2 CYS 318 2HB CYS 318 4.684 15.243 6.681 107 HB3 CYS 318 1HB CYS 318 5.478 15.941 8.090 108 H ARG 319 H ARG 319 3.577 14.218 11.005 109 HA ARG 319 HA ARG 319 2.453 16.951 10.899 110 HB2 ARG 319 2HB ARG 319 1.330 14.620 12.527 111 HB3 ARG 319 1HB ARG 319 0.801 16.295 12.673 112 HG2 ARG 319 2HG ARG 319 0.098 16.198 10.246 113 HG3 ARG 319 1HG ARG 319 0.455 14.467 10.272 114 HD2 ARG 319 2HD ARG 319 -1.617 15.932 11.944 115 HD3 ARG 319 1HD ARG 319 -1.931 14.820 10.608 116 HE ARG 319 HE ARG 319 -0.732 14.035 13.203 117 HH11 ARG 319 1HH1 ARG 319 -2.794 13.251 10.472 118 HH12 ARG 319 2HH1 ARG 319 -3.202 11.683 11.081 119 HH21 ARG 319 1HH2 ARG 319 -1.291 12.009 13.997 120 HH22 ARG 319 2HH2 ARG 319 -2.370 10.988 13.100 121 H LYS 320 H LYS 320 5.127 15.720 11.613 122 HA LYS 320 HA LYS 320 5.478 16.972 14.269 123 HB2 LYS 320 2HB LYS 320 6.715 14.341 13.348 124 HB3 LYS 320 1HB LYS 320 7.157 15.186 14.826 125 HG2 LYS 320 2HG LYS 320 4.383 14.105 14.229 126 HG3 LYS 320 1HG LYS 320 5.606 13.262 15.184 127 HD2 LYS 320 2HD LYS 320 5.581 15.062 16.854 128 HD3 LYS 320 1HD LYS 320 4.428 15.981 15.882 129 HE2 LYS 320 2HE LYS 320 2.734 14.247 16.206 130 HE3 LYS 320 1HE LYS 320 3.888 13.246 17.092 131 HZ1 LYS 320 1HZ LYS 320 2.389 14.458 18.553 132 HZ2 LYS 320 2HZ LYS 320 2.947 15.929 17.940 133 HZ3 LYS 320 3HZ LYS 320 3.997 14.918 18.805 134 H CYS 321 H CYS 321 6.282 17.283 11.091 135 HA CYS 321 HA CYS 321 8.542 18.987 11.780 136 HB2 CYS 321 2HB CYS 321 10.217 18.051 10.405 137 HB3 CYS 321 1HB CYS 321 9.492 16.643 11.167 138 H ALA 322 H ALA 322 5.724 18.670 10.198 139 HA ALA 322 HA ALA 322 6.264 20.316 7.859 140 HB1 ALA 322 1HB ALA 322 3.828 20.146 7.470 141 HB2 ALA 322 2HB ALA 322 3.624 19.348 9.032 142 HB3 ALA 322 3HB ALA 322 4.530 18.549 7.745 143 H CYS 323 H CYS 323 4.608 22.289 7.641 144 HA CYS 323 HA CYS 323 4.778 24.035 9.969 145 HB2 CYS 323 2HB CYS 323 5.049 25.171 7.893 146 HB3 CYS 323 1HB CYS 323 3.656 24.383 7.175 147 H HIS 324 H HIS 324 3.534 23.261 11.590 148 HA HIS 324 HA HIS 324 1.100 21.786 11.128 149 HB2 HIS 324 2HB HIS 324 2.327 22.598 13.793 150 HB3 HIS 324 1HB HIS 324 1.175 21.294 13.516 151 HD1 HIS 324 HD1 HIS 324 4.472 21.498 14.414 152 HD2 HIS 324 HD2 HIS 324 2.576 19.578 11.255 153 HE1 HIS 324 HE1 HIS 324 6.081 19.748 13.591 154 H VAL 325 H VAL 325 1.736 25.062 11.467 155 HA VAL 325 HA VAL 325 -0.475 26.018 12.949 156 HB VAL 325 HB VAL 325 0.926 27.441 10.642 157 HG11 VAL 325 1HG1 VAL 325 -1.078 28.631 11.430 158 HG12 VAL 325 2HG1 VAL 325 0.378 29.521 11.871 159 HG13 VAL 325 3HG1 VAL 325 -0.481 28.579 13.092 160 HG21 VAL 325 1HG2 VAL 325 2.522 28.323 12.312 161 HG22 VAL 325 2HG2 VAL 325 2.624 26.568 12.179 162 HG23 VAL 325 3HG2 VAL 325 1.793 27.302 13.554 163 H CYS 326 H CYS 326 -0.129 24.880 9.675 164 HA CYS 326 HA CYS 326 -3.048 25.132 9.189 165 HB2 CYS 326 2HB CYS 326 -2.564 25.441 6.785 166 HB3 CYS 326 1HB CYS 326 -1.760 26.696 7.727 167 H GLY 327 H GLY 327 -0.539 23.062 9.785 168 HA2 GLY 327 2HA GLY 327 -0.075 20.846 9.474 169 HA3 GLY 327 1HA GLY 327 -1.744 20.652 8.953 170 H GLY 328 H GLY 328 0.604 22.766 7.390 171 HA2 GLY 328 2HA GLY 328 0.226 21.238 4.871 172 HA3 GLY 328 1HA GLY 328 0.321 22.987 4.978 173 H ARG 329 H ARG 329 1.901 20.970 3.489 174 HA ARG 329 HA ARG 329 4.640 21.765 4.330 175 HB2 ARG 329 2HB ARG 329 3.868 19.445 2.503 176 HB3 ARG 329 1HB ARG 329 5.463 19.794 3.172 177 HG2 ARG 329 2HG ARG 329 4.626 19.270 5.442 178 HG3 ARG 329 1HG ARG 329 3.027 18.935 4.769 179 HD2 ARG 329 2HD ARG 329 5.596 17.385 4.349 180 HD3 ARG 329 1HD ARG 329 4.089 16.810 5.071 181 HE ARG 329 HE ARG 329 4.600 17.316 2.204 182 HH11 ARG 329 1HH1 ARG 329 2.558 15.804 4.610 183 HH12 ARG 329 2HH1 ARG 329 1.501 15.112 3.435 184 HH21 ARG 329 1HH2 ARG 329 3.182 16.431 0.688 185 HH22 ARG 329 2HH2 ARG 329 1.849 15.459 1.217 186 H GLU 330 H GLU 330 2.515 23.146 2.700 187 HA GLU 330 HA GLU 330 2.947 22.977 -0.073 188 HB2 GLU 330 2HB GLU 330 1.822 25.378 1.423 189 HB3 GLU 330 1HB GLU 330 1.478 24.884 -0.233 190 HG2 GLU 330 2HG GLU 330 0.306 22.878 0.610 191 HG3 GLU 330 1HG GLU 330 0.671 23.360 2.265 192 H ALA 331 H ALA 331 4.917 23.405 -0.930 193 HA ALA 331 HA ALA 331 6.815 24.423 -1.596 194 HB1 ALA 331 1HB ALA 331 5.347 26.316 -2.182 195 HB2 ALA 331 2HB ALA 331 6.938 26.869 -1.659 196 HB3 ALA 331 3HB ALA 331 5.560 26.983 -0.562 197 HA PRO 332 HA PRO 332 8.749 24.033 2.623 198 HB2 PRO 332 2HB PRO 332 10.931 22.602 1.679 199 HB3 PRO 332 1HB PRO 332 9.425 21.865 2.236 200 HG2 PRO 332 2HG PRO 332 10.313 22.488 -0.570 201 HG3 PRO 332 1HG PRO 332 9.501 21.034 0.049 202 HD2 PRO 332 2HD PRO 332 8.137 22.945 -1.287 203 HD3 PRO 332 1HD PRO 332 7.396 22.061 0.067 204 H GLU 333 H GLU 333 9.845 25.256 -0.447 205 HA GLU 333 HA GLU 333 12.136 26.710 0.224 206 HB2 GLU 333 2HB GLU 333 11.498 28.169 -1.715 207 HB3 GLU 333 1HB GLU 333 11.395 26.450 -2.080 208 HG2 GLU 333 2HG GLU 333 8.935 26.540 -1.710 209 HG3 GLU 333 1HG GLU 333 9.061 28.272 -1.424 210 H LYS 334 H LYS 334 8.760 27.382 0.899 211 HA LYS 334 HA LYS 334 9.383 30.035 2.040 212 HB2 LYS 334 2HB LYS 334 6.857 28.897 0.776 213 HB3 LYS 334 1HB LYS 334 6.800 30.336 1.800 214 HG2 LYS 334 2HG LYS 334 8.403 31.470 0.284 215 HG3 LYS 334 1HG LYS 334 8.427 30.047 -0.758 216 HD2 LYS 334 2HD LYS 334 5.844 31.514 -0.126 217 HD3 LYS 334 1HD LYS 334 6.908 32.045 -1.426 218 HE2 LYS 334 2HE LYS 334 5.722 29.258 -1.235 219 HE3 LYS 334 1HE LYS 334 5.034 30.576 -2.185 220 HZ1 LYS 334 1HZ LYS 334 7.058 30.675 -3.486 221 HZ2 LYS 334 2HZ LYS 334 6.415 29.114 -3.534 222 HZ3 LYS 334 3HZ LYS 334 7.757 29.442 -2.565 223 H GLN 335 H GLN 335 9.235 27.015 3.173 224 HA GLN 335 HA GLN 335 7.782 27.650 5.651 225 HB2 GLN 335 2HB GLN 335 9.382 25.136 5.038 226 HB3 GLN 335 1HB GLN 335 8.286 25.390 6.396 227 HG2 GLN 335 2HG GLN 335 6.411 25.574 4.739 228 HG3 GLN 335 1HG GLN 335 7.552 25.142 3.470 229 HE21 GLN 335 1HE2 GLN 335 6.799 23.167 2.898 230 HE22 GLN 335 2HE2 GLN 335 6.695 21.811 3.964 231 H LEU 336 H LEU 336 8.990 29.236 6.616 232 HA LEU 336 HA LEU 336 11.835 28.925 7.121 233 HB2 LEU 336 2HB LEU 336 9.818 30.990 8.092 234 HB3 LEU 336 1HB LEU 336 11.551 31.065 8.388 235 HG LEU 336 HG LEU 336 10.287 31.127 5.622 236 HD11 LEU 336 1HD1 LEU 336 11.392 33.438 7.248 237 HD12 LEU 336 2HD1 LEU 336 9.693 33.147 6.862 238 HD13 LEU 336 3HD1 LEU 336 10.835 33.516 5.573 239 HD21 LEU 336 1HD2 LEU 336 13.150 31.625 6.492 240 HD22 LEU 336 2HD2 LEU 336 12.515 31.838 4.857 241 HD23 LEU 336 3HD2 LEU 336 12.554 30.233 5.580 242 H LEU 337 H LEU 337 12.609 27.830 8.771 243 HA LEU 337 HA LEU 337 10.879 26.836 10.910 244 HB2 LEU 337 2HB LEU 337 13.740 26.171 10.094 245 HB3 LEU 337 1HB LEU 337 13.041 25.587 11.594 246 HG LEU 337 HG LEU 337 11.255 24.420 10.237 247 HD11 LEU 337 1HD1 LEU 337 11.322 25.692 8.172 248 HD12 LEU 337 2HD1 LEU 337 11.640 23.990 7.845 249 HD13 LEU 337 3HD1 LEU 337 12.972 25.150 7.852 250 HD21 LEU 337 1HD2 LEU 337 12.687 22.527 9.579 251 HD22 LEU 337 2HD2 LEU 337 13.159 23.183 11.144 252 HD23 LEU 337 3HD2 LEU 337 14.116 23.557 9.709 253 H CYS 338 H CYS 338 10.587 28.182 12.594 254 HA CYS 338 HA CYS 338 12.405 30.155 13.505 255 HB2 CYS 338 2HB CYS 338 9.998 30.184 14.102 256 HB3 CYS 338 1HB CYS 338 10.231 28.744 15.102 257 H ASP 339 H ASP 339 14.376 29.736 14.228 258 HA ASP 339 HA ASP 339 15.434 27.299 15.008 259 HB2 ASP 339 2HB ASP 339 16.760 29.276 14.301 260 HB3 ASP 339 1HB ASP 339 16.367 30.086 15.815 261 H GLU 340 H GLU 340 14.139 29.877 17.024 262 HA GLU 340 HA GLU 340 14.632 28.984 19.604 263 HB2 GLU 340 2HB GLU 340 13.763 31.231 18.971 264 HB3 GLU 340 1HB GLU 340 12.217 30.515 18.539 265 HG2 GLU 340 2HG GLU 340 11.980 31.559 20.670 266 HG3 GLU 340 1HG GLU 340 11.929 29.815 20.915 267 H CYS 341 H CYS 341 12.068 27.981 17.364 268 HA CYS 341 HA CYS 341 10.673 26.463 19.507 269 HB2 CYS 341 2HB CYS 341 9.545 27.675 16.951 270 HB3 CYS 341 1HB CYS 341 8.613 26.750 18.126 271 H ASP 342 H ASP 342 12.579 26.005 16.785 272 HA ASP 342 HA ASP 342 12.978 24.449 15.203 273 HB2 ASP 342 2HB ASP 342 11.798 22.602 17.317 274 HB3 ASP 342 1HB ASP 342 12.624 22.020 15.874 275 H MET 343 H MET 343 10.181 25.668 15.266 276 HA MET 343 HA MET 343 8.604 23.604 13.867 277 HB2 MET 343 2HB MET 343 7.778 26.154 15.301 278 HB3 MET 343 1HB MET 343 6.675 25.274 14.252 279 HG2 MET 343 2HG MET 343 7.980 24.125 16.731 280 HG3 MET 343 1HG MET 343 6.352 24.787 16.647 281 HE1 MET 343 1HE MET 343 8.329 21.566 16.625 282 HE2 MET 343 2HE MET 343 8.674 21.965 14.940 283 HE3 MET 343 3HE MET 343 7.644 20.589 15.325 284 H ALA 344 H ALA 344 7.852 23.917 11.853 285 HA ALA 344 HA ALA 344 9.066 25.984 10.190 286 HB1 ALA 344 1HB ALA 344 8.138 24.678 8.301 287 HB2 ALA 344 2HB ALA 344 7.299 23.612 9.434 288 HB3 ALA 344 3HB ALA 344 9.063 23.647 9.393 289 H PHE 345 H PHE 345 7.973 27.635 9.255 290 HA PHE 345 HA PHE 345 5.037 27.874 9.529 291 HB2 PHE 345 2HB PHE 345 7.030 30.131 10.079 292 HB3 PHE 345 1HB PHE 345 5.282 30.296 10.050 293 HD1 PHE 345 HD1 PHE 345 3.966 29.832 11.978 294 HD2 PHE 345 HD2 PHE 345 8.114 28.805 11.946 295 HE1 PHE 345 HE1 PHE 345 3.881 29.397 14.399 296 HE2 PHE 345 HE2 PHE 345 8.015 28.360 14.360 297 HZ PHE 345 HZ PHE 345 5.902 28.653 15.587 298 H HIS 346 H HIS 346 4.156 28.370 7.564 299 HA HIS 346 HA HIS 346 5.709 29.195 5.297 300 HB2 HIS 346 2HB HIS 346 2.688 29.158 5.744 301 HB3 HIS 346 1HB HIS 346 3.432 29.618 4.217 302 HD2 HIS 346 HD2 HIS 346 5.316 27.409 3.369 303 HE1 HIS 346 HE1 HIS 346 2.397 24.621 4.610 304 HE2 HIS 346 HE2 HIS 346 4.358 25.027 3.075 305 H LEU 347 H LEU 347 5.723 31.238 4.276 306 HA LEU 347 HA LEU 347 5.953 33.553 5.763 307 HB2 LEU 347 2HB LEU 347 5.256 33.165 2.834 308 HB3 LEU 347 1HB LEU 347 5.590 34.751 3.518 309 HG LEU 347 HG LEU 347 7.573 32.437 3.443 310 HD11 LEU 347 1HD1 LEU 347 8.779 33.737 1.747 311 HD12 LEU 347 2HD1 LEU 347 7.489 34.942 1.731 312 HD13 LEU 347 3HD1 LEU 347 7.166 33.293 1.190 313 HD21 LEU 347 1HD2 LEU 347 9.227 34.105 4.179 314 HD22 LEU 347 2HD2 LEU 347 7.949 33.894 5.371 315 HD23 LEU 347 3HD2 LEU 347 7.953 35.319 4.325 316 H TYR 348 H TYR 348 3.090 32.168 4.326 317 HA TYR 348 HA TYR 348 1.394 34.505 4.779 318 HB2 TYR 348 2HB TYR 348 0.600 31.822 3.572 319 HB3 TYR 348 1HB TYR 348 -0.179 33.382 3.331 320 HD1 TYR 348 HD1 TYR 348 2.414 31.129 2.147 321 HD2 TYR 348 HD2 TYR 348 1.048 35.178 1.984 322 HE1 TYR 348 HE1 TYR 348 3.850 31.529 0.188 323 HE2 TYR 348 HE2 TYR 348 2.470 35.580 0.022 324 HH TYR 348 HH TYR 348 4.464 34.693 -1.037 325 H CYS 349 H CYS 349 2.411 31.851 6.560 326 HA CYS 349 HA CYS 349 -0.049 31.621 8.191 327 HB2 CYS 349 2HB CYS 349 2.510 29.959 8.178 328 HB3 CYS 349 1HB CYS 349 1.143 29.679 9.260 329 H LEU 350 H LEU 350 2.141 33.829 8.071 330 HA LEU 350 HA LEU 350 2.974 33.946 10.881 331 HB2 LEU 350 2HB LEU 350 3.675 35.775 8.548 332 HB3 LEU 350 1HB LEU 350 4.363 35.870 10.165 333 HG LEU 350 HG LEU 350 4.739 33.588 8.187 334 HD11 LEU 350 1HD1 LEU 350 6.738 35.639 9.173 335 HD12 LEU 350 2HD1 LEU 350 6.006 35.566 7.567 336 HD13 LEU 350 3HD1 LEU 350 7.079 34.275 8.101 337 HD21 LEU 350 1HD2 LEU 350 5.883 33.858 10.986 338 HD22 LEU 350 2HD2 LEU 350 6.300 32.606 9.813 339 HD23 LEU 350 3HD2 LEU 350 4.665 32.696 10.456 340 H LYS 351 H LYS 351 2.992 36.522 11.545 341 HA LYS 351 HA LYS 351 0.535 37.886 10.884 342 HB2 LYS 351 2HB LYS 351 -0.092 36.127 12.656 343 HB3 LYS 351 1HB LYS 351 0.910 37.023 13.785 344 HG2 LYS 351 2HG LYS 351 -1.473 37.551 14.055 345 HG3 LYS 351 1HG LYS 351 -0.543 38.974 13.582 346 HD2 LYS 351 2HD LYS 351 -2.754 38.781 12.421 347 HD3 LYS 351 1HD LYS 351 -1.386 38.853 11.311 348 HE2 LYS 351 2HE LYS 351 -3.122 37.195 10.642 349 HE3 LYS 351 1HE LYS 351 -1.542 36.456 10.902 350 HZ1 LYS 351 1HZ LYS 351 -3.790 36.449 12.845 351 HZ2 LYS 351 2HZ LYS 351 -2.286 35.712 13.072 352 HZ3 LYS 351 3HZ LYS 351 -3.333 35.147 11.871 353 HA PRO 352 HA PRO 352 0.454 39.808 9.956 354 HB2 PRO 352 2HB PRO 352 1.888 41.532 8.372 355 HB3 PRO 352 1HB PRO 352 0.959 42.071 9.774 356 HG2 PRO 352 2HG PRO 352 3.915 41.505 9.569 357 HG3 PRO 352 1HG PRO 352 3.100 42.897 10.314 358 HD2 PRO 352 2HD PRO 352 4.012 40.816 11.797 359 HD3 PRO 352 1HD PRO 352 2.543 41.710 12.243 360 HA PRO 353 HA PRO 353 2.219 36.548 7.338 361 HB2 PRO 353 2HB PRO 353 0.104 37.357 5.364 362 HB3 PRO 353 1HB PRO 353 0.401 35.783 6.113 363 HG2 PRO 353 2HG PRO 353 -1.677 37.272 6.878 364 HG3 PRO 353 1HG PRO 353 -0.744 36.348 8.074 365 HD2 PRO 353 2HD PRO 353 -0.586 39.298 7.420 366 HD3 PRO 353 1HD PRO 353 -0.628 38.498 9.010 367 H LEU 354 H LEU 354 4.040 36.828 6.244 368 HA LEU 354 HA LEU 354 4.603 39.229 4.704 369 HB2 LEU 354 2HB LEU 354 6.325 36.784 5.322 370 HB3 LEU 354 1HB LEU 354 6.897 38.252 4.537 371 HG LEU 354 HG LEU 354 5.872 38.039 7.392 372 HD11 LEU 354 1HD1 LEU 354 8.183 38.530 8.054 373 HD12 LEU 354 2HD1 LEU 354 8.684 38.509 6.360 374 HD13 LEU 354 3HD1 LEU 354 8.072 37.039 7.122 375 HD21 LEU 354 1HD2 LEU 354 6.927 40.489 5.939 376 HD22 LEU 354 2HD2 LEU 354 6.563 40.395 7.666 377 HD23 LEU 354 3HD2 LEU 354 5.270 40.217 6.486 378 H THR 355 H THR 355 5.130 39.293 2.540 379 HA THR 355 HA THR 355 4.112 37.147 0.810 380 HB THR 355 HB THR 355 3.425 39.513 0.346 381 HG1 THR 355 HG1 THR 355 3.560 37.971 -1.389 382 HG21 THR 355 1HG2 THR 355 6.345 39.976 -0.377 383 HG22 THR 355 2HG2 THR 355 5.503 40.687 1.001 384 HG23 THR 355 3HG2 THR 355 5.020 41.114 -0.642 385 H SER 356 H SER 356 7.071 38.485 1.990 386 HA SER 356 HA SER 356 8.714 36.880 0.122 387 HB2 SER 356 2HB SER 356 10.379 38.774 0.144 388 HB3 SER 356 1HB SER 356 8.847 39.225 -0.604 389 HG SER 356 HG SER 356 9.461 40.855 0.792 390 H VAL 357 H VAL 357 10.827 36.258 1.038 391 HA VAL 357 HA VAL 357 10.728 35.572 3.829 392 HB VAL 357 HB VAL 357 11.712 33.966 2.315 393 HG11 VAL 357 1HG1 VAL 357 13.803 34.334 1.046 394 HG12 VAL 357 2HG1 VAL 357 13.831 36.020 1.568 395 HG13 VAL 357 3HG1 VAL 357 12.529 35.443 0.526 396 HG21 VAL 357 1HG2 VAL 357 13.867 33.480 3.423 397 HG22 VAL 357 2HG2 VAL 357 12.646 33.997 4.588 398 HG23 VAL 357 3HG2 VAL 357 13.902 35.122 4.075 399 HA PRO 358 HA PRO 358 12.893 39.374 5.141 400 HB2 PRO 358 2HB PRO 358 13.026 38.852 7.814 401 HB3 PRO 358 1HB PRO 358 11.519 39.345 7.026 402 HG2 PRO 358 2HG PRO 358 12.447 36.586 7.792 403 HG3 PRO 358 1HG PRO 358 10.842 37.317 7.994 404 HD2 PRO 358 2HD PRO 358 11.451 35.603 5.944 405 HD3 PRO 358 1HD PRO 358 10.231 36.884 5.796 406 HA PRO 359 HA PRO 359 17.119 37.787 5.154 407 HB2 PRO 359 2HB PRO 359 18.522 40.058 5.466 408 HB3 PRO 359 1HB PRO 359 17.482 39.832 4.049 409 HG2 PRO 359 2HG PRO 359 16.888 41.336 6.604 410 HG3 PRO 359 1HG PRO 359 16.654 41.870 4.924 411 HD2 PRO 359 2HD PRO 359 14.631 40.809 6.455 412 HD3 PRO 359 1HD PRO 359 14.677 40.666 4.683 413 H GLU 360 H GLU 360 15.580 38.344 7.961 414 HA GLU 360 HA GLU 360 17.591 38.977 9.860 415 HB2 GLU 360 2HB GLU 360 14.932 37.551 10.244 416 HB3 GLU 360 1HB GLU 360 15.904 38.239 11.540 417 HG2 GLU 360 2HG GLU 360 15.599 40.488 10.597 418 HG3 GLU 360 1HG GLU 360 14.667 39.816 9.264 419 HA PRO 361 HA PRO 361 19.591 34.870 9.936 420 HB2 PRO 361 2HB PRO 361 21.403 35.410 11.950 421 HB3 PRO 361 1HB PRO 361 21.619 35.924 10.274 422 HG2 PRO 361 2HG PRO 361 20.634 37.501 12.630 423 HG3 PRO 361 1HG PRO 361 21.718 38.006 11.318 424 HD2 PRO 361 2HD PRO 361 19.065 38.672 11.402 425 HD3 PRO 361 1HD PRO 361 19.955 38.481 9.880 426 H GLU 362 H GLU 362 18.678 36.472 13.013 427 HA GLU 362 HA GLU 362 18.008 33.899 14.277 428 HB2 GLU 362 2HB GLU 362 17.584 35.337 16.312 429 HB3 GLU 362 1HB GLU 362 19.223 35.467 15.689 430 HG2 GLU 362 2HG GLU 362 18.616 37.605 14.585 431 HG3 GLU 362 1HG GLU 362 16.999 37.482 15.269 432 H TRP 363 H TRP 363 16.350 33.575 12.545 433 HA TRP 363 HA TRP 363 14.067 35.285 12.360 434 HB2 TRP 363 2HB TRP 363 14.852 33.730 10.486 435 HB3 TRP 363 1HB TRP 363 14.184 32.384 11.409 436 HD1 TRP 363 HD1 TRP 363 13.126 35.478 9.424 437 HE1 TRP 363 HE1 TRP 363 10.640 35.280 8.831 438 HE3 TRP 363 HE3 TRP 363 11.937 31.320 12.155 439 HZ2 TRP 363 HZ2 TRP 363 8.478 33.614 9.417 440 HZ3 TRP 363 HZ3 TRP 363 9.620 30.492 12.089 441 HH2 TRP 363 HH2 TRP 363 7.923 31.625 10.749 442 H TYR 364 H TYR 364 13.026 35.575 14.231 443 HA TYR 364 HA TYR 364 11.998 33.271 15.748 444 HB2 TYR 364 2HB TYR 364 12.147 36.220 16.514 445 HB3 TYR 364 1HB TYR 364 11.456 34.955 17.529 446 HD1 TYR 364 HD1 TYR 364 13.933 36.935 17.935 447 HD2 TYR 364 HD2 TYR 364 13.562 32.784 16.986 448 HE1 TYR 364 HE1 TYR 364 16.142 36.512 18.914 449 HE2 TYR 364 HE2 TYR 364 15.773 32.360 17.968 450 HH TYR 364 HH TYR 364 17.398 34.596 19.910 451 H CYS 365 H CYS 365 10.057 32.649 15.215 452 HA CYS 365 HA CYS 365 8.149 33.761 13.560 453 HB2 CYS 365 2HB CYS 365 6.606 32.097 14.476 454 HB3 CYS 365 1HB CYS 365 8.215 31.382 14.395 455 HA PRO 366 HA PRO 366 6.074 37.076 15.864 456 HB2 PRO 366 2HB PRO 366 3.378 36.492 15.287 457 HB3 PRO 366 1HB PRO 366 4.466 37.420 14.252 458 HG2 PRO 366 2HG PRO 366 3.771 34.492 14.125 459 HG3 PRO 366 1HG PRO 366 3.906 35.665 12.795 460 HD2 PRO 366 2HD PRO 366 5.885 33.949 13.245 461 HD3 PRO 366 1HD PRO 366 6.273 35.634 12.846 462 H SER 367 H SER 367 5.073 33.744 16.361 463 HA SER 367 HA SER 367 3.608 33.904 18.729 464 HB2 SER 367 2HB SER 367 5.552 31.670 18.037 465 HB3 SER 367 1HB SER 367 4.076 31.553 18.999 466 HG SER 367 HG SER 367 2.870 31.889 17.139 467 H CYS 368 H CYS 368 7.102 33.900 18.218 468 HA CYS 368 HA CYS 368 8.023 33.536 20.859 469 HB2 CYS 368 2HB CYS 368 9.226 34.559 18.311 470 HB3 CYS 368 1HB CYS 368 10.082 34.939 19.798 471 H ARG 369 H ARG 369 6.831 36.463 19.247 472 HA ARG 369 HA ARG 369 7.646 38.100 21.578 473 HB2 ARG 369 2HB ARG 369 7.378 40.060 20.231 474 HB3 ARG 369 1HB ARG 369 8.302 38.902 19.286 475 HG2 ARG 369 2HG ARG 369 6.267 38.359 17.973 476 HG3 ARG 369 1HG ARG 369 5.345 39.522 18.929 477 HD2 ARG 369 2HD ARG 369 7.633 40.117 17.017 478 HD3 ARG 369 1HD ARG 369 5.936 40.575 16.834 479 HE ARG 369 HE ARG 369 7.623 41.631 19.030 480 HH11 ARG 369 1HH1 ARG 369 5.388 42.261 16.386 481 HH12 ARG 369 2HH1 ARG 369 5.329 43.965 16.695 482 HH21 ARG 369 1HH2 ARG 369 7.553 43.857 19.397 483 HH22 ARG 369 2HH2 ARG 369 6.565 44.871 18.403 484 H THR 370 H THR 370 4.861 36.637 20.164 485 HA THR 370 HA THR 370 2.953 38.564 21.215 486 HB THR 370 HB THR 370 2.714 37.186 18.968 487 HG1 THR 370 HG1 THR 370 0.269 37.113 19.657 488 HG21 THR 370 1HG2 THR 370 1.340 35.173 19.122 489 HG22 THR 370 2HG2 THR 370 1.338 35.257 20.882 490 HG23 THR 370 3HG2 THR 370 2.839 34.906 20.019 491 H ASP 371 H ASP 371 1.089 37.781 22.560 492 HA ASP 371 HA ASP 371 2.152 36.696 24.995 493 HB2 ASP 371 2HB ASP 371 0.558 38.535 25.101 494 HB3 ASP 371 1HB ASP 371 -0.650 37.593 24.232 495 H SER 372 H SER 372 -0.167 35.541 22.576 496 HA SER 372 HA SER 372 -0.901 33.211 24.143 497 HB2 SER 372 2HB SER 372 -2.632 34.516 22.865 498 HB3 SER 372 1HB SER 372 -1.868 33.984 21.365 499 HG SER 372 HG SER 372 -2.671 32.109 23.319 500 H SER 373 H SER 373 1.284 32.497 24.116 501 HA SER 373 HA SER 373 1.741 30.454 22.076 502 HB2 SER 373 2HB SER 373 3.098 32.311 21.229 503 HB3 SER 373 1HB SER 373 3.813 32.572 22.816 504 HG SER 373 HG SER 373 4.976 30.714 22.608 505 H GLU 374 H GLU 374 2.684 28.629 22.917 506 HA GLU 374 HA GLU 374 2.778 28.301 25.768 507 HB2 GLU 374 2HB GLU 374 3.377 26.441 23.443 508 HB3 GLU 374 1HB GLU 374 3.620 25.942 25.113 509 HG2 GLU 374 2HG GLU 374 1.480 25.137 24.222 510 HG3 GLU 374 1HG GLU 374 1.254 26.210 25.598 511 H VAL 375 H VAL 375 4.562 27.738 27.038 512 HA VAL 375 HA VAL 375 6.871 29.311 26.583 513 HB VAL 375 HB VAL 375 7.744 28.341 28.721 514 HG11 VAL 375 1HG1 VAL 375 5.973 29.230 30.198 515 HG12 VAL 375 2HG1 VAL 375 4.826 29.191 28.858 516 HG13 VAL 375 3HG1 VAL 375 6.218 30.273 28.794 517 HG21 VAL 375 1HG2 VAL 375 6.909 26.028 28.517 518 HG22 VAL 375 2HG2 VAL 375 5.246 26.599 28.680 519 HG23 VAL 375 3HG2 VAL 375 6.369 26.752 30.035 520 H VAL 376 H VAL 376 8.824 28.839 25.763 521 HA VAL 376 HA VAL 376 9.378 26.154 24.708 522 HB VAL 376 HB VAL 376 10.947 28.758 24.365 523 HG11 VAL 376 1HG1 VAL 376 12.171 27.588 22.556 524 HG12 VAL 376 2HG1 VAL 376 11.306 26.098 22.932 525 HG13 VAL 376 3HG1 VAL 376 12.417 26.790 24.115 526 HG21 VAL 376 1HG2 VAL 376 8.731 28.893 23.287 527 HG22 VAL 376 2HG2 VAL 376 9.047 27.387 22.422 528 HG23 VAL 376 3HG2 VAL 376 10.012 28.823 22.070 529 H GLN 377 H GLN 377 10.492 24.752 25.929 530 HA GLN 377 HA GLN 377 11.426 25.370 28.524 531 HB2 GLN 377 2HB GLN 377 12.026 22.888 26.859 532 HB3 GLN 377 1HB GLN 377 12.300 23.040 28.590 533 HG2 GLN 377 2HG GLN 377 9.649 22.957 27.138 534 HG3 GLN 377 1HG GLN 377 10.301 21.774 28.268 535 HE21 GLN 377 1HE2 GLN 377 10.370 22.331 30.537 536 HE22 GLN 377 2HE2 GLN 377 9.301 23.534 31.168 537 H ALA 378 H ALA 378 13.357 25.937 29.311 538 HA ALA 378 HA ALA 378 15.549 26.694 27.608 539 HB1 ALA 378 1HB ALA 378 16.623 27.396 29.711 540 HB2 ALA 378 2HB ALA 378 15.362 26.582 30.640 541 HB3 ALA 378 3HB ALA 378 14.956 27.973 29.634 542 H GLY 379 H GLY 379 17.835 25.984 28.297 543 HA2 GLY 379 2HA GLY 379 19.376 24.232 28.610 544 HA3 GLY 379 1HA GLY 379 18.058 23.066 28.696 545 H GLU 380 H GLU 380 18.595 25.596 26.310 546 HA GLU 380 HA GLU 380 18.549 23.683 24.103 547 HB2 GLU 380 2HB GLU 380 17.228 25.958 24.231 548 HB3 GLU 380 1HB GLU 380 18.755 26.706 23.808 549 HG2 GLU 380 2HG GLU 380 17.293 24.638 22.127 550 HG3 GLU 380 1HG GLU 380 17.224 26.376 21.875 Start of MODEL 17 1 H1 SER 303 H SER 303 12.412 1.643 4.006 2 HA SER 303 HA SER 303 15.018 2.903 3.621 3 HB2 SER 303 2HB SER 303 14.384 2.756 1.189 4 HB3 SER 303 1HB SER 303 14.330 1.196 2.015 5 HG SER 303 HG SER 303 12.424 1.203 1.050 6 H GLY 304 H GLY 304 11.747 3.804 4.096 7 HA2 GLY 304 2HA GLY 304 11.759 6.375 2.793 8 HA3 GLY 304 1HA GLY 304 10.551 5.759 3.911 9 HA PRO 305 HA PRO 305 13.172 9.202 5.917 10 HB2 PRO 305 2HB PRO 305 10.446 10.319 6.504 11 HB3 PRO 305 1HB PRO 305 11.893 11.146 5.912 12 HG2 PRO 305 2HG PRO 305 9.850 10.667 4.260 13 HG3 PRO 305 1HG PRO 305 11.526 10.492 3.697 14 HD2 PRO 305 2HD PRO 305 9.587 8.335 4.548 15 HD3 PRO 305 1HD PRO 305 10.677 8.380 3.140 16 H SER 306 H SER 306 13.875 8.315 7.777 17 HA SER 306 HA SER 306 12.408 6.818 9.650 18 HB2 SER 306 2HB SER 306 14.862 6.712 9.528 19 HB3 SER 306 1HB SER 306 14.990 8.397 10.030 20 HG SER 306 HG SER 306 14.609 7.840 12.040 21 H CYS 307 H CYS 307 10.723 7.553 10.722 22 HA CYS 307 HA CYS 307 10.692 10.230 11.962 23 HB2 CYS 307 2HB CYS 307 8.739 9.067 9.967 24 HB3 CYS 307 1HB CYS 307 8.171 10.193 11.189 25 H ARG 308 H ARG 308 10.890 9.424 14.001 26 HA ARG 308 HA ARG 308 9.436 7.180 15.037 27 HB2 ARG 308 2HB ARG 308 10.470 7.922 17.233 28 HB3 ARG 308 1HB ARG 308 11.609 7.600 15.932 29 HG2 ARG 308 2HG ARG 308 11.682 10.097 15.502 30 HG3 ARG 308 1HG ARG 308 10.735 10.315 16.974 31 HD2 ARG 308 2HD ARG 308 12.522 9.326 18.309 32 HD3 ARG 308 1HD ARG 308 13.447 8.949 16.852 33 HE ARG 308 HE ARG 308 13.541 11.418 16.472 34 HH11 ARG 308 1HH1 ARG 308 13.116 10.209 19.740 35 HH12 ARG 308 2HH1 ARG 308 13.882 11.581 20.474 36 HH21 ARG 308 1HH2 ARG 308 14.533 13.205 17.441 37 HH22 ARG 308 2HH2 ARG 308 14.668 13.287 19.169 38 H PHE 309 H PHE 309 9.057 10.715 15.309 39 HA PHE 309 HA PHE 309 6.773 10.525 17.103 40 HB2 PHE 309 2HB PHE 309 7.999 12.919 15.686 41 HB3 PHE 309 1HB PHE 309 6.693 13.015 16.860 42 HD1 PHE 309 HD1 PHE 309 10.061 13.608 16.521 43 HD2 PHE 309 HD2 PHE 309 7.378 11.561 19.150 44 HE1 PHE 309 HE1 PHE 309 11.683 13.825 18.357 45 HE2 PHE 309 HE2 PHE 309 9.010 11.780 20.978 46 HZ PHE 309 HZ PHE 309 11.160 12.914 20.585 47 H CYS 310 H CYS 310 7.254 10.681 13.638 48 HA CYS 310 HA CYS 310 4.396 11.192 13.142 49 HB2 CYS 310 2HB CYS 310 6.419 10.485 10.992 50 HB3 CYS 310 1HB CYS 310 4.885 11.319 10.801 51 H LYS 311 H LYS 311 6.165 8.601 14.147 52 HA LYS 311 HA LYS 311 5.795 6.373 14.345 53 HB2 LYS 311 2HB LYS 311 3.011 7.151 13.403 54 HB3 LYS 311 1HB LYS 311 3.415 5.559 14.044 55 HG2 LYS 311 2HG LYS 311 3.946 6.489 16.217 56 HG3 LYS 311 1HG LYS 311 3.776 8.141 15.616 57 HD2 LYS 311 2HD LYS 311 1.529 6.089 15.779 58 HD3 LYS 311 1HD LYS 311 1.811 7.384 16.947 59 HE2 LYS 311 2HE LYS 311 1.436 9.066 15.169 60 HE3 LYS 311 1HE LYS 311 1.147 7.770 14.004 61 HZ1 LYS 311 1HZ LYS 311 -0.760 7.073 15.287 62 HZ2 LYS 311 2HZ LYS 311 -0.902 8.706 14.871 63 HZ3 LYS 311 3HZ LYS 311 -0.465 8.268 16.444 64 H ASP 312 H ASP 312 6.648 7.509 11.707 65 HA ASP 312 HA ASP 312 7.206 6.941 9.615 66 HB2 ASP 312 2HB ASP 312 6.856 4.117 10.689 67 HB3 ASP 312 1HB ASP 312 7.684 4.516 9.187 68 H ASP 313 H ASP 313 4.449 7.567 10.030 69 HA ASP 313 HA ASP 313 2.753 6.082 8.333 70 HB2 ASP 313 2HB ASP 313 2.789 9.048 9.024 71 HB3 ASP 313 1HB ASP 313 1.563 8.323 7.997 72 H GLU 314 H GLU 314 3.718 5.411 6.517 73 HA GLU 314 HA GLU 314 5.559 6.983 4.956 74 HB2 GLU 314 2HB GLU 314 5.812 4.873 3.643 75 HB3 GLU 314 1HB GLU 314 6.026 4.632 5.375 76 HG2 GLU 314 2HG GLU 314 3.691 3.787 5.525 77 HG3 GLU 314 1HG GLU 314 3.535 3.966 3.779 78 H ASN 315 H ASN 315 2.179 6.520 4.852 79 HA ASN 315 HA ASN 315 1.981 7.251 1.968 80 HB2 ASN 315 2HB ASN 315 -0.117 5.902 3.745 81 HB3 ASN 315 1HB ASN 315 -0.299 6.272 2.033 82 HD21 ASN 315 1HD2 ASN 315 1.091 4.120 4.361 83 HD22 ASN 315 2HD2 ASN 315 1.627 2.919 3.242 84 H LYS 316 H LYS 316 1.881 8.654 4.955 85 HA LYS 316 HA LYS 316 -0.508 10.340 4.438 86 HB2 LYS 316 2HB LYS 316 0.444 9.197 7.089 87 HB3 LYS 316 1HB LYS 316 -0.942 10.257 6.890 88 HG2 LYS 316 2HG LYS 316 -2.193 8.578 5.749 89 HG3 LYS 316 1HG LYS 316 -0.763 7.574 5.503 90 HD2 LYS 316 2HD LYS 316 -2.234 6.652 7.259 91 HD3 LYS 316 1HD LYS 316 -0.643 7.081 7.888 92 HE2 LYS 316 2HE LYS 316 -1.606 9.191 8.804 93 HE3 LYS 316 1HE LYS 316 -3.196 8.699 8.211 94 HZ1 LYS 316 1HZ LYS 316 -2.888 8.170 10.545 95 HZ2 LYS 316 2HZ LYS 316 -1.552 7.205 10.170 96 HZ3 LYS 316 3HZ LYS 316 -3.092 6.764 9.628 97 HA PRO 317 HA PRO 317 2.001 13.977 4.952 98 HB2 PRO 317 2HB PRO 317 -0.118 15.088 6.783 99 HB3 PRO 317 1HB PRO 317 0.571 15.786 5.309 100 HG2 PRO 317 2HG PRO 317 -1.859 14.717 5.245 101 HG3 PRO 317 1HG PRO 317 -0.731 14.429 3.902 102 HD2 PRO 317 2HD PRO 317 -1.453 12.594 6.193 103 HD3 PRO 317 1HD PRO 317 -1.285 12.222 4.461 104 H CYS 318 H CYS 318 3.568 14.741 6.206 105 HA CYS 318 HA CYS 318 4.173 13.403 8.700 106 HB2 CYS 318 2HB CYS 318 5.648 14.777 6.567 107 HB3 CYS 318 1HB CYS 318 6.198 15.299 8.150 108 H ARG 319 H ARG 319 3.196 14.209 10.475 109 HA ARG 319 HA ARG 319 2.274 16.880 10.836 110 HB2 ARG 319 2HB ARG 319 2.724 14.772 12.999 111 HB3 ARG 319 1HB ARG 319 1.611 16.141 13.072 112 HG2 ARG 319 2HG ARG 319 0.180 15.150 11.384 113 HG3 ARG 319 1HG ARG 319 1.366 13.880 11.064 114 HD2 ARG 319 2HD ARG 319 1.040 13.180 13.526 115 HD3 ARG 319 1HD ARG 319 -0.380 14.229 13.513 116 HE ARG 319 HE ARG 319 -1.410 12.808 11.930 117 HH11 ARG 319 1HH1 ARG 319 1.612 11.473 13.160 118 HH12 ARG 319 2HH1 ARG 319 1.325 9.898 12.486 119 HH21 ARG 319 1HH2 ARG 319 -1.778 10.728 11.102 120 HH22 ARG 319 2HH2 ARG 319 -0.604 9.472 11.355 121 H LYS 320 H LYS 320 5.048 15.081 12.086 122 HA LYS 320 HA LYS 320 6.103 17.283 13.685 123 HB2 LYS 320 2HB LYS 320 6.026 14.925 14.525 124 HB3 LYS 320 1HB LYS 320 7.100 14.440 13.231 125 HG2 LYS 320 2HG LYS 320 8.477 14.525 15.115 126 HG3 LYS 320 1HG LYS 320 8.836 16.023 14.274 127 HD2 LYS 320 2HD LYS 320 6.862 15.905 16.579 128 HD3 LYS 320 1HD LYS 320 8.592 16.097 16.842 129 HE2 LYS 320 2HE LYS 320 8.480 18.174 15.388 130 HE3 LYS 320 1HE LYS 320 6.722 18.011 15.418 131 HZ1 LYS 320 1HZ LYS 320 7.440 19.521 17.108 132 HZ2 LYS 320 2HZ LYS 320 8.500 18.379 17.757 133 HZ3 LYS 320 3HZ LYS 320 6.830 18.131 17.848 134 H CYS 321 H CYS 321 6.109 17.156 10.550 135 HA CYS 321 HA CYS 321 8.852 18.193 10.242 136 HB2 CYS 321 2HB CYS 321 7.660 16.176 8.282 137 HB3 CYS 321 1HB CYS 321 9.253 16.925 8.183 138 H ALA 322 H ALA 322 5.751 18.952 10.131 139 HA ALA 322 HA ALA 322 5.764 20.357 7.518 140 HB1 ALA 322 1HB ALA 322 3.301 20.333 7.672 141 HB2 ALA 322 2HB ALA 322 3.394 19.498 9.226 142 HB3 ALA 322 3HB ALA 322 3.959 18.698 7.759 143 H CYS 323 H CYS 323 4.308 22.302 7.537 144 HA CYS 323 HA CYS 323 4.779 24.154 9.714 145 HB2 CYS 323 2HB CYS 323 4.812 25.170 7.570 146 HB3 CYS 323 1HB CYS 323 3.375 24.317 7.029 147 H HIS 324 H HIS 324 3.653 23.772 11.547 148 HA HIS 324 HA HIS 324 1.510 21.954 11.723 149 HB2 HIS 324 2HB HIS 324 3.127 22.203 13.533 150 HB3 HIS 324 1HB HIS 324 2.678 23.886 13.769 151 HD1 HIS 324 HD1 HIS 324 1.328 24.133 15.850 152 HD2 HIS 324 HD2 HIS 324 0.586 20.500 13.970 153 HE1 HIS 324 HE1 HIS 324 -0.380 22.940 17.272 154 H VAL 325 H VAL 325 1.560 25.414 11.391 155 HA VAL 325 HA VAL 325 -0.898 26.158 12.451 156 HB VAL 325 HB VAL 325 0.636 27.391 10.128 157 HG11 VAL 325 1HG1 VAL 325 -1.702 28.147 9.981 158 HG12 VAL 325 2HG1 VAL 325 -0.667 29.472 10.511 159 HG13 VAL 325 3HG1 VAL 325 -1.678 28.621 11.682 160 HG21 VAL 325 1HG2 VAL 325 0.517 28.164 13.068 161 HG22 VAL 325 2HG2 VAL 325 1.417 29.026 11.816 162 HG23 VAL 325 3HG2 VAL 325 1.872 27.378 12.254 163 H CYS 326 H CYS 326 -0.152 24.806 9.267 164 HA CYS 326 HA CYS 326 -3.046 24.556 8.671 165 HB2 CYS 326 2HB CYS 326 -2.629 25.086 6.326 166 HB3 CYS 326 1HB CYS 326 -1.999 26.396 7.324 167 H GLY 327 H GLY 327 -0.362 22.852 9.407 168 HA2 GLY 327 2HA GLY 327 0.285 20.668 9.223 169 HA3 GLY 327 1HA GLY 327 -1.378 20.332 8.790 170 H GLY 328 H GLY 328 1.529 21.775 7.229 171 HA2 GLY 328 2HA GLY 328 1.464 19.810 5.080 172 HA3 GLY 328 1HA GLY 328 0.997 21.433 4.586 173 H ARG 329 H ARG 329 3.436 19.533 4.151 174 HA ARG 329 HA ARG 329 5.691 21.282 4.853 175 HB2 ARG 329 2HB ARG 329 5.686 18.739 3.168 176 HB3 ARG 329 1HB ARG 329 7.104 19.557 3.825 177 HG2 ARG 329 2HG ARG 329 6.183 19.051 6.138 178 HG3 ARG 329 1HG ARG 329 4.967 18.041 5.350 179 HD2 ARG 329 2HD ARG 329 6.785 16.629 6.089 180 HD3 ARG 329 1HD ARG 329 6.827 16.704 4.325 181 HE ARG 329 HE ARG 329 8.552 18.498 5.914 182 HH11 ARG 329 1HH1 ARG 329 8.327 15.889 3.557 183 HH12 ARG 329 2HH1 ARG 329 10.040 15.845 3.277 184 HH21 ARG 329 1HH2 ARG 329 10.780 18.426 5.522 185 HH22 ARG 329 2HH2 ARG 329 11.420 17.279 4.388 186 H GLU 330 H GLU 330 3.386 21.568 2.720 187 HA GLU 330 HA GLU 330 4.368 21.672 0.121 188 HB2 GLU 330 2HB GLU 330 2.132 23.343 1.366 189 HB3 GLU 330 1HB GLU 330 2.307 22.945 -0.343 190 HG2 GLU 330 2HG GLU 330 1.849 20.607 0.080 191 HG3 GLU 330 1HG GLU 330 1.904 20.854 1.822 192 H ALA 331 H ALA 331 5.487 23.196 -1.027 193 HA ALA 331 HA ALA 331 6.918 24.886 -1.484 194 HB1 ALA 331 1HB ALA 331 6.065 27.160 -1.186 195 HB2 ALA 331 2HB ALA 331 4.862 26.572 -0.033 196 HB3 ALA 331 3HB ALA 331 4.778 26.079 -1.726 197 HA PRO 332 HA PRO 332 8.950 24.633 2.791 198 HB2 PRO 332 2HB PRO 332 11.302 23.728 1.199 199 HB3 PRO 332 1HB PRO 332 10.540 22.962 2.596 200 HG2 PRO 332 2HG PRO 332 10.323 21.952 0.102 201 HG3 PRO 332 1HG PRO 332 9.008 21.802 1.285 202 HD2 PRO 332 2HD PRO 332 9.285 23.700 -1.033 203 HD3 PRO 332 1HD PRO 332 7.847 22.833 -0.453 204 H GLU 333 H GLU 333 10.014 25.846 -0.284 205 HA GLU 333 HA GLU 333 11.951 27.708 0.178 206 HB2 GLU 333 2HB GLU 333 10.913 29.001 -1.731 207 HB3 GLU 333 1HB GLU 333 11.125 27.283 -2.047 208 HG2 GLU 333 2HG GLU 333 8.742 26.875 -1.599 209 HG3 GLU 333 1HG GLU 333 8.512 28.574 -1.201 210 H LYS 334 H LYS 334 8.549 28.006 1.001 211 HA LYS 334 HA LYS 334 8.934 30.765 1.990 212 HB2 LYS 334 2HB LYS 334 6.477 29.349 0.874 213 HB3 LYS 334 1HB LYS 334 6.373 30.888 1.737 214 HG2 LYS 334 2HG LYS 334 7.969 31.857 0.027 215 HG3 LYS 334 1HG LYS 334 7.817 30.352 -0.889 216 HD2 LYS 334 2HD LYS 334 5.471 32.153 -0.137 217 HD3 LYS 334 1HD LYS 334 6.321 32.235 -1.681 218 HE2 LYS 334 2HE LYS 334 4.905 29.751 -0.653 219 HE3 LYS 334 1HE LYS 334 4.187 30.927 -1.756 220 HZ1 LYS 334 1HZ LYS 334 6.677 29.419 -2.323 221 HZ2 LYS 334 2HZ LYS 334 5.844 30.437 -3.382 222 HZ3 LYS 334 3HZ LYS 334 5.139 28.986 -2.877 223 H GLN 335 H GLN 335 9.149 27.874 3.299 224 HA GLN 335 HA GLN 335 7.483 28.446 5.683 225 HB2 GLN 335 2HB GLN 335 9.066 25.912 5.073 226 HB3 GLN 335 1HB GLN 335 7.952 26.156 6.420 227 HG2 GLN 335 2HG GLN 335 6.150 26.540 4.650 228 HG3 GLN 335 1HG GLN 335 7.302 25.912 3.475 229 HE21 GLN 335 1HE2 GLN 335 4.791 24.791 4.050 230 HE22 GLN 335 2HE2 GLN 335 5.039 23.216 4.693 231 H LEU 336 H LEU 336 8.557 29.890 6.877 232 HA LEU 336 HA LEU 336 11.377 29.765 7.480 233 HB2 LEU 336 2HB LEU 336 9.073 31.414 8.588 234 HB3 LEU 336 1HB LEU 336 10.735 31.604 9.127 235 HG LEU 336 HG LEU 336 9.875 31.993 6.238 236 HD11 LEU 336 1HD1 LEU 336 9.968 34.407 6.616 237 HD12 LEU 336 2HD1 LEU 336 10.291 34.152 8.334 238 HD13 LEU 336 3HD1 LEU 336 8.740 33.666 7.642 239 HD21 LEU 336 1HD2 LEU 336 12.244 31.464 6.494 240 HD22 LEU 336 2HD2 LEU 336 12.428 32.746 7.696 241 HD23 LEU 336 3HD2 LEU 336 12.041 33.149 6.023 242 H LEU 337 H LEU 337 12.178 28.316 8.872 243 HA LEU 337 HA LEU 337 10.470 26.919 10.788 244 HB2 LEU 337 2HB LEU 337 13.398 26.491 10.039 245 HB3 LEU 337 1HB LEU 337 12.565 25.562 11.270 246 HG LEU 337 HG LEU 337 10.945 24.810 9.425 247 HD11 LEU 337 1HD1 LEU 337 11.732 24.878 7.109 248 HD12 LEU 337 2HD1 LEU 337 13.090 25.899 7.590 249 HD13 LEU 337 3HD1 LEU 337 11.435 26.499 7.736 250 HD21 LEU 337 1HD2 LEU 337 12.441 23.028 8.627 251 HD22 LEU 337 2HD2 LEU 337 12.639 23.309 10.356 252 HD23 LEU 337 3HD2 LEU 337 13.840 23.928 9.220 253 H CYS 338 H CYS 338 10.111 27.953 12.634 254 HA CYS 338 HA CYS 338 11.828 29.863 13.878 255 HB2 CYS 338 2HB CYS 338 9.278 29.624 14.144 256 HB3 CYS 338 1HB CYS 338 9.626 28.304 15.261 257 H ASP 339 H ASP 339 13.594 29.449 15.031 258 HA ASP 339 HA ASP 339 14.821 26.993 15.263 259 HB2 ASP 339 2HB ASP 339 16.073 29.071 15.368 260 HB3 ASP 339 1HB ASP 339 15.249 29.560 16.841 261 H GLU 340 H GLU 340 13.479 28.819 18.030 262 HA GLU 340 HA GLU 340 13.963 26.716 19.905 263 HB2 GLU 340 2HB GLU 340 13.331 28.309 21.551 264 HB3 GLU 340 1HB GLU 340 14.022 29.258 20.256 265 HG2 GLU 340 2HG GLU 340 11.123 29.013 21.041 266 HG3 GLU 340 1HG GLU 340 12.136 30.453 21.079 267 H CYS 341 H CYS 341 11.184 27.587 17.993 268 HA CYS 341 HA CYS 341 9.251 25.926 19.376 269 HB2 CYS 341 2HB CYS 341 9.194 27.333 16.680 270 HB3 CYS 341 1HB CYS 341 7.915 26.222 17.152 271 H ASP 342 H ASP 342 11.647 25.502 16.894 272 HA ASP 342 HA ASP 342 12.318 23.869 15.528 273 HB2 ASP 342 2HB ASP 342 12.489 22.653 17.740 274 HB3 ASP 342 1HB ASP 342 10.886 22.017 17.498 275 H MET 343 H MET 343 10.057 25.216 14.685 276 HA MET 343 HA MET 343 8.428 23.166 13.321 277 HB2 MET 343 2HB MET 343 7.346 23.956 15.517 278 HB3 MET 343 1HB MET 343 7.148 25.530 14.762 279 HG2 MET 343 2HG MET 343 5.099 24.193 14.649 280 HG3 MET 343 1HG MET 343 5.730 24.538 13.038 281 HE1 MET 343 1HE MET 343 5.680 21.766 15.914 282 HE2 MET 343 2HE MET 343 7.385 21.838 15.441 283 HE3 MET 343 3HE MET 343 6.413 20.413 15.056 284 H ALA 344 H ALA 344 7.996 23.658 11.273 285 HA ALA 344 HA ALA 344 8.940 26.052 10.005 286 HB1 ALA 344 1HB ALA 344 9.019 23.882 8.849 287 HB2 ALA 344 2HB ALA 344 8.039 25.028 7.934 288 HB3 ALA 344 3HB ALA 344 7.256 23.766 8.893 289 H PHE 345 H PHE 345 7.729 27.737 9.165 290 HA PHE 345 HA PHE 345 4.803 27.787 9.485 291 HB2 PHE 345 2HB PHE 345 6.659 29.992 10.516 292 HB3 PHE 345 1HB PHE 345 4.904 30.095 10.455 293 HD1 PHE 345 HD1 PHE 345 3.697 28.004 11.685 294 HD2 PHE 345 HD2 PHE 345 7.574 29.526 12.625 295 HE1 PHE 345 HE1 PHE 345 3.512 27.070 13.949 296 HE2 PHE 345 HE2 PHE 345 7.382 28.586 14.890 297 HZ PHE 345 HZ PHE 345 5.358 27.357 15.553 298 H HIS 346 H HIS 346 4.046 28.291 7.484 299 HA HIS 346 HA HIS 346 5.474 29.414 5.345 300 HB2 HIS 346 2HB HIS 346 2.497 29.309 5.928 301 HB3 HIS 346 1HB HIS 346 3.100 30.090 4.475 302 HD2 HIS 346 HD2 HIS 346 4.759 28.220 2.872 303 HE1 HIS 346 HE1 HIS 346 2.089 25.125 3.942 304 HE2 HIS 346 HE2 HIS 346 3.599 26.038 2.137 305 H LEU 347 H LEU 347 5.454 31.472 4.415 306 HA LEU 347 HA LEU 347 5.642 33.773 5.935 307 HB2 LEU 347 2HB LEU 347 4.790 33.518 3.026 308 HB3 LEU 347 1HB LEU 347 5.385 34.988 3.780 309 HG LEU 347 HG LEU 347 7.006 32.451 3.315 310 HD11 LEU 347 1HD1 LEU 347 8.263 33.776 1.673 311 HD12 LEU 347 2HD1 LEU 347 7.167 35.139 1.920 312 HD13 LEU 347 3HD1 LEU 347 6.563 33.631 1.228 313 HD21 LEU 347 1HD2 LEU 347 7.753 33.579 5.352 314 HD22 LEU 347 2HD2 LEU 347 7.913 35.103 4.476 315 HD23 LEU 347 3HD2 LEU 347 8.954 33.736 4.072 316 H TYR 348 H TYR 348 2.825 32.496 4.152 317 HA TYR 348 HA TYR 348 1.040 34.615 5.035 318 HB2 TYR 348 2HB TYR 348 -0.678 33.337 3.674 319 HB3 TYR 348 1HB TYR 348 0.724 33.886 2.775 320 HD1 TYR 348 HD1 TYR 348 -1.009 30.886 4.116 321 HD2 TYR 348 HD2 TYR 348 2.292 32.283 1.778 322 HE1 TYR 348 HE1 TYR 348 -0.655 28.610 3.241 323 HE2 TYR 348 HE2 TYR 348 2.636 30.010 0.904 324 HH TYR 348 HH TYR 348 0.368 27.543 1.204 325 H CYS 349 H CYS 349 2.213 32.070 6.694 326 HA CYS 349 HA CYS 349 -0.281 31.603 8.247 327 HB2 CYS 349 2HB CYS 349 2.275 29.951 8.057 328 HB3 CYS 349 1HB CYS 349 0.988 29.628 9.219 329 H LEU 350 H LEU 350 1.650 33.927 8.286 330 HA LEU 350 HA LEU 350 2.582 33.843 11.096 331 HB2 LEU 350 2HB LEU 350 3.547 35.543 8.762 332 HB3 LEU 350 1HB LEU 350 4.137 35.683 10.413 333 HG LEU 350 HG LEU 350 4.456 33.242 8.631 334 HD11 LEU 350 1HD1 LEU 350 6.841 33.800 8.575 335 HD12 LEU 350 2HD1 LEU 350 6.531 35.273 9.497 336 HD13 LEU 350 3HD1 LEU 350 5.858 35.086 7.875 337 HD21 LEU 350 1HD2 LEU 350 5.514 33.727 11.437 338 HD22 LEU 350 2HD2 LEU 350 5.903 32.341 10.414 339 HD23 LEU 350 3HD2 LEU 350 4.252 32.580 10.978 340 H LYS 351 H LYS 351 2.872 36.434 11.732 341 HA LYS 351 HA LYS 351 0.442 37.941 11.216 342 HB2 LYS 351 2HB LYS 351 -0.077 36.175 13.053 343 HB3 LYS 351 1HB LYS 351 1.023 37.074 14.087 344 HG2 LYS 351 2HG LYS 351 -1.241 37.745 14.590 345 HG3 LYS 351 1HG LYS 351 -0.417 39.096 13.799 346 HD2 LYS 351 2HD LYS 351 -1.517 38.571 11.674 347 HD3 LYS 351 1HD LYS 351 -2.259 37.131 12.375 348 HE2 LYS 351 2HE LYS 351 -3.522 38.612 13.949 349 HE3 LYS 351 1HE LYS 351 -2.832 40.016 13.130 350 HZ1 LYS 351 1HZ LYS 351 -4.487 37.938 11.806 351 HZ2 LYS 351 2HZ LYS 351 -3.928 39.379 11.114 352 HZ3 LYS 351 3HZ LYS 351 -5.071 39.423 12.357 353 HA PRO 352 HA PRO 352 0.537 39.732 10.193 354 HB2 PRO 352 2HB PRO 352 2.406 41.537 8.825 355 HB3 PRO 352 1HB PRO 352 0.833 41.915 9.527 356 HG2 PRO 352 2HG PRO 352 3.198 42.838 10.568 357 HG3 PRO 352 1HG PRO 352 1.741 42.566 11.546 358 HD2 PRO 352 2HD PRO 352 4.152 40.786 11.205 359 HD3 PRO 352 1HD PRO 352 3.269 41.217 12.689 360 HA PRO 353 HA PRO 353 2.381 36.636 7.570 361 HB2 PRO 353 2HB PRO 353 0.700 36.640 5.432 362 HB3 PRO 353 1HB PRO 353 0.172 36.098 7.033 363 HG2 PRO 353 2HG PRO 353 -0.205 38.803 5.738 364 HG3 PRO 353 1HG PRO 353 -1.412 37.784 6.550 365 HD2 PRO 353 2HD PRO 353 -0.204 39.841 7.837 366 HD3 PRO 353 1HD PRO 353 -0.645 38.345 8.692 367 H LEU 354 H LEU 354 4.156 36.682 6.340 368 HA LEU 354 HA LEU 354 4.978 39.081 4.951 369 HB2 LEU 354 2HB LEU 354 6.374 36.386 5.187 370 HB3 LEU 354 1HB LEU 354 7.103 37.873 4.589 371 HG LEU 354 HG LEU 354 6.145 37.376 7.436 372 HD11 LEU 354 1HD1 LEU 354 8.514 37.459 8.049 373 HD12 LEU 354 2HD1 LEU 354 8.964 37.628 6.350 374 HD13 LEU 354 3HD1 LEU 354 8.186 36.148 6.918 375 HD21 LEU 354 1HD2 LEU 354 7.132 39.557 8.000 376 HD22 LEU 354 2HD2 LEU 354 5.823 39.731 6.832 377 HD23 LEU 354 3HD2 LEU 354 7.501 39.844 6.295 378 H THR 355 H THR 355 5.554 39.211 2.767 379 HA THR 355 HA THR 355 4.325 37.274 0.897 380 HB THR 355 HB THR 355 4.656 39.220 -0.776 381 HG1 THR 355 HG1 THR 355 4.654 40.999 1.378 382 HG21 THR 355 1HG2 THR 355 2.636 40.435 -0.027 383 HG22 THR 355 2HG2 THR 355 2.769 39.680 1.562 384 HG23 THR 355 3HG2 THR 355 2.427 38.687 0.144 385 H SER 356 H SER 356 7.263 38.008 2.264 386 HA SER 356 HA SER 356 8.736 36.475 0.293 387 HB2 SER 356 2HB SER 356 10.536 38.252 0.066 388 HB3 SER 356 1HB SER 356 9.003 38.701 -0.689 389 HG SER 356 HG SER 356 9.593 39.448 1.975 390 H VAL 357 H VAL 357 10.849 35.823 1.098 391 HA VAL 357 HA VAL 357 10.983 35.441 3.948 392 HB VAL 357 HB VAL 357 11.741 33.603 2.568 393 HG11 VAL 357 1HG1 VAL 357 13.701 33.721 1.054 394 HG12 VAL 357 2HG1 VAL 357 13.816 35.457 1.349 395 HG13 VAL 357 3HG1 VAL 357 12.399 34.793 0.536 396 HG21 VAL 357 1HG2 VAL 357 12.950 33.883 4.707 397 HG22 VAL 357 2HG2 VAL 357 14.189 34.831 3.892 398 HG23 VAL 357 3HG2 VAL 357 13.977 33.125 3.490 399 HA PRO 358 HA PRO 358 13.237 39.295 4.747 400 HB2 PRO 358 2HB PRO 358 13.982 38.064 7.363 401 HB3 PRO 358 1HB PRO 358 13.058 39.537 7.043 402 HG2 PRO 358 2HG PRO 358 11.856 37.316 7.966 403 HG3 PRO 358 1HG PRO 358 11.048 38.377 6.789 404 HD2 PRO 358 2HD PRO 358 12.492 35.765 6.305 405 HD3 PRO 358 1HD PRO 358 10.927 36.326 5.666 406 HA PRO 359 HA PRO 359 17.625 38.093 4.242 407 HB2 PRO 359 2HB PRO 359 18.816 40.497 4.312 408 HB3 PRO 359 1HB PRO 359 17.707 40.092 2.992 409 HG2 PRO 359 2HG PRO 359 17.187 41.734 5.472 410 HG3 PRO 359 1HG PRO 359 16.724 42.076 3.792 411 HD2 PRO 359 2HD PRO 359 15.018 40.936 5.675 412 HD3 PRO 359 1HD PRO 359 14.835 40.736 3.916 413 H GLU 360 H GLU 360 16.178 38.865 7.068 414 HA GLU 360 HA GLU 360 18.256 39.646 8.835 415 HB2 GLU 360 2HB GLU 360 15.656 38.179 9.452 416 HB3 GLU 360 1HB GLU 360 16.652 39.040 10.622 417 HG2 GLU 360 2HG GLU 360 16.174 41.165 9.456 418 HG3 GLU 360 1HG GLU 360 15.178 40.301 8.287 419 HA PRO 361 HA PRO 361 20.275 35.588 9.295 420 HB2 PRO 361 2HB PRO 361 21.827 36.152 11.486 421 HB3 PRO 361 1HB PRO 361 22.203 36.757 9.868 422 HG2 PRO 361 2HG PRO 361 20.821 38.172 12.142 423 HG3 PRO 361 1HG PRO 361 22.094 38.777 11.061 424 HD2 PRO 361 2HD PRO 361 19.473 39.391 10.693 425 HD3 PRO 361 1HD PRO 361 20.597 39.217 9.330 426 H GLU 362 H GLU 362 18.726 37.244 11.992 427 HA GLU 362 HA GLU 362 18.019 34.777 13.400 428 HB2 GLU 362 2HB GLU 362 17.693 37.741 13.989 429 HB3 GLU 362 1HB GLU 362 16.759 36.557 14.889 430 HG2 GLU 362 2HG GLU 362 18.697 37.233 16.144 431 HG3 GLU 362 1HG GLU 362 18.796 35.529 15.715 432 H TRP 363 H TRP 363 15.867 34.078 13.638 433 HA TRP 363 HA TRP 363 13.702 35.789 12.991 434 HB2 TRP 363 2HB TRP 363 14.194 34.841 10.697 435 HB3 TRP 363 1HB TRP 363 13.874 33.225 11.325 436 HD1 TRP 363 HD1 TRP 363 12.066 36.482 10.348 437 HE1 TRP 363 HE1 TRP 363 9.545 36.014 10.193 438 HE3 TRP 363 HE3 TRP 363 11.973 31.696 12.199 439 HZ2 TRP 363 HZ2 TRP 363 7.767 33.937 10.778 440 HZ3 TRP 363 HZ3 TRP 363 9.802 30.551 12.372 441 HH2 TRP 363 HH2 TRP 363 7.737 31.651 11.681 442 H TYR 364 H TYR 364 12.141 35.426 14.361 443 HA TYR 364 HA TYR 364 11.616 32.800 15.595 444 HB2 TYR 364 2HB TYR 364 11.712 35.457 17.134 445 HB3 TYR 364 1HB TYR 364 11.363 33.875 17.820 446 HD1 TYR 364 HD1 TYR 364 13.203 32.396 18.510 447 HD2 TYR 364 HD2 TYR 364 14.068 35.993 16.369 448 HE1 TYR 364 HE1 TYR 364 15.586 32.102 18.984 449 HE2 TYR 364 HE2 TYR 364 16.458 35.702 16.853 450 HH TYR 364 HH TYR 364 17.759 32.806 18.015 451 H CYS 365 H CYS 365 9.373 32.435 15.759 452 HA CYS 365 HA CYS 365 7.689 33.877 14.000 453 HB2 CYS 365 2HB CYS 365 5.950 32.282 14.568 454 HB3 CYS 365 1HB CYS 365 7.479 31.413 14.523 455 HA PRO 366 HA PRO 366 5.424 37.214 16.046 456 HB2 PRO 366 2HB PRO 366 3.074 35.287 16.049 457 HB3 PRO 366 1HB PRO 366 3.096 37.018 15.669 458 HG2 PRO 366 2HG PRO 366 3.138 35.136 13.732 459 HG3 PRO 366 1HG PRO 366 3.984 36.683 13.554 460 HD2 PRO 366 2HD PRO 366 5.112 33.985 13.869 461 HD3 PRO 366 1HD PRO 366 5.915 35.478 13.350 462 H SER 367 H SER 367 4.478 34.061 17.446 463 HA SER 367 HA SER 367 3.644 34.985 19.971 464 HB2 SER 367 2HB SER 367 3.770 32.552 20.600 465 HB3 SER 367 1HB SER 367 2.921 32.828 19.079 466 HG SER 367 HG SER 367 4.354 31.142 18.799 467 H CYS 368 H CYS 368 6.816 34.026 18.787 468 HA CYS 368 HA CYS 368 8.098 33.902 21.376 469 HB2 CYS 368 2HB CYS 368 9.144 33.695 18.532 470 HB3 CYS 368 1HB CYS 368 10.202 33.618 19.950 471 H ARG 369 H ARG 369 8.170 36.168 18.602 472 HA ARG 369 HA ARG 369 10.380 37.685 19.575 473 HB2 ARG 369 2HB ARG 369 9.861 39.260 17.746 474 HB3 ARG 369 1HB ARG 369 9.868 37.588 17.194 475 HG2 ARG 369 2HG ARG 369 7.405 37.551 17.202 476 HG3 ARG 369 1HG ARG 369 7.370 39.208 17.813 477 HD2 ARG 369 2HD ARG 369 8.560 38.372 15.143 478 HD3 ARG 369 1HD ARG 369 6.940 39.038 15.368 479 HE ARG 369 HE ARG 369 8.528 40.911 16.511 480 HH11 ARG 369 1HH1 ARG 369 8.647 39.402 13.341 481 HH12 ARG 369 2HH1 ARG 369 9.227 40.837 12.562 482 HH21 ARG 369 1HH2 ARG 369 9.288 42.766 15.485 483 HH22 ARG 369 2HH2 ARG 369 9.596 42.744 13.776 484 H THR 370 H THR 370 6.982 37.881 20.226 485 HA THR 370 HA THR 370 7.447 40.128 22.078 486 HB THR 370 HB THR 370 6.344 41.137 20.108 487 HG1 THR 370 HG1 THR 370 5.138 42.285 21.400 488 HG21 THR 370 1HG2 THR 370 4.095 39.140 20.553 489 HG22 THR 370 2HG2 THR 370 5.208 39.158 19.181 490 HG23 THR 370 3HG2 THR 370 4.072 40.488 19.412 491 H ASP 371 H ASP 371 5.468 40.232 23.648 492 HA ASP 371 HA ASP 371 5.052 37.589 24.801 493 HB2 ASP 371 2HB ASP 371 4.295 40.389 25.755 494 HB3 ASP 371 1HB ASP 371 3.865 38.930 26.640 495 H SER 372 H SER 372 3.877 37.190 22.646 496 HA SER 372 HA SER 372 0.978 37.751 22.852 497 HB2 SER 372 2HB SER 372 2.164 38.457 20.732 498 HB3 SER 372 1HB SER 372 2.534 36.762 20.417 499 HG SER 372 HG SER 372 0.005 38.033 20.531 500 H SER 373 H SER 373 3.319 35.347 23.359 501 HA SER 373 HA SER 373 1.432 33.081 23.156 502 HB2 SER 373 2HB SER 373 3.741 32.813 22.208 503 HB3 SER 373 1HB SER 373 4.432 33.123 23.796 504 HG SER 373 HG SER 373 3.837 31.159 24.451 505 H GLU 374 H GLU 374 1.737 31.500 25.079 506 HA GLU 374 HA GLU 374 1.623 32.907 27.658 507 HB2 GLU 374 2HB GLU 374 -0.228 31.296 27.010 508 HB3 GLU 374 1HB GLU 374 0.947 29.989 27.050 509 HG2 GLU 374 2HG GLU 374 -0.420 30.081 29.101 510 HG3 GLU 374 1HG GLU 374 1.296 30.318 29.439 511 H VAL 375 H VAL 375 2.919 32.161 29.431 512 HA VAL 375 HA VAL 375 5.622 31.571 28.832 513 HB VAL 375 HB VAL 375 5.079 32.867 30.836 514 HG11 VAL 375 1HG1 VAL 375 2.915 31.864 31.442 515 HG12 VAL 375 2HG1 VAL 375 3.996 31.915 32.837 516 HG13 VAL 375 3HG1 VAL 375 3.734 30.393 31.982 517 HG21 VAL 375 1HG2 VAL 375 7.198 31.602 30.899 518 HG22 VAL 375 2HG2 VAL 375 6.372 30.228 31.633 519 HG23 VAL 375 3HG2 VAL 375 6.513 31.746 32.521 520 H VAL 376 H VAL 376 6.495 29.633 28.319 521 HA VAL 376 HA VAL 376 5.207 27.108 28.835 522 HB VAL 376 HB VAL 376 7.252 26.053 27.914 523 HG11 VAL 376 1HG1 VAL 376 7.163 26.997 25.628 524 HG12 VAL 376 2HG1 VAL 376 6.329 28.422 26.247 525 HG13 VAL 376 3HG1 VAL 376 5.551 26.841 26.330 526 HG21 VAL 376 1HG2 VAL 376 8.452 28.854 27.802 527 HG22 VAL 376 2HG2 VAL 376 9.175 27.404 27.098 528 HG23 VAL 376 3HG2 VAL 376 8.987 27.536 28.848 529 H GLN 377 H GLN 377 5.850 25.514 30.371 530 HA GLN 377 HA GLN 377 6.641 26.636 32.901 531 HB2 GLN 377 2HB GLN 377 4.870 24.868 32.623 532 HB3 GLN 377 1HB GLN 377 6.134 23.714 32.205 533 HG2 GLN 377 2HG GLN 377 7.147 24.025 34.449 534 HG3 GLN 377 1HG GLN 377 5.875 25.178 34.853 535 HE21 GLN 377 1HE2 GLN 377 6.629 21.796 34.349 536 HE22 GLN 377 2HE2 GLN 377 5.156 21.168 35.000 537 H ALA 378 H ALA 378 8.758 27.268 32.817 538 HA ALA 378 HA ALA 378 10.929 25.626 31.901 539 HB1 ALA 378 1HB ALA 378 12.368 27.427 32.788 540 HB2 ALA 378 2HB ALA 378 10.974 28.163 33.585 541 HB3 ALA 378 3HB ALA 378 11.046 28.091 31.824 542 H GLY 379 H GLY 379 12.819 25.194 33.423 543 HA2 GLY 379 2HA GLY 379 13.693 24.020 35.194 544 HA3 GLY 379 1HA GLY 379 12.308 24.502 36.164 545 H GLU 380 H GLU 380 12.844 22.498 33.259 546 HA GLU 380 HA GLU 380 10.779 20.634 33.934 547 HB2 GLU 380 2HB GLU 380 11.381 21.202 31.589 548 HB3 GLU 380 1HB GLU 380 12.949 20.439 31.810 549 HG2 GLU 380 2HG GLU 380 11.463 18.968 30.574 550 HG3 GLU 380 1HG GLU 380 11.850 18.254 32.139 Start of MODEL 18 1 H1 SER 303 H SER 303 13.307 10.014 -2.456 2 HA SER 303 HA SER 303 14.099 11.482 -0.050 3 HB2 SER 303 2HB SER 303 14.087 13.464 -1.597 4 HB3 SER 303 1HB SER 303 15.153 12.175 -2.149 5 HG SER 303 HG SER 303 12.700 13.043 -3.187 6 H GLY 304 H GLY 304 11.746 10.170 0.366 7 HA2 GLY 304 2HA GLY 304 9.370 11.669 -0.107 8 HA3 GLY 304 1HA GLY 304 9.595 10.411 1.095 9 HA PRO 305 HA PRO 305 8.933 14.577 3.265 10 HB2 PRO 305 2HB PRO 305 7.265 13.558 5.233 11 HB3 PRO 305 1HB PRO 305 6.692 14.197 3.686 12 HG2 PRO 305 2HG PRO 305 7.202 11.331 4.482 13 HG3 PRO 305 1HG PRO 305 5.816 12.025 3.608 14 HD2 PRO 305 2HD PRO 305 7.781 10.756 2.286 15 HD3 PRO 305 1HD PRO 305 7.008 12.199 1.590 16 H SER 306 H SER 306 10.902 14.872 4.164 17 HA SER 306 HA SER 306 12.414 13.068 5.658 18 HB2 SER 306 2HB SER 306 12.540 16.108 5.615 19 HB3 SER 306 1HB SER 306 13.791 15.057 6.289 20 HG SER 306 HG SER 306 13.702 14.039 4.083 21 H CYS 307 H CYS 307 12.085 12.295 7.583 22 HA CYS 307 HA CYS 307 10.689 13.735 9.694 23 HB2 CYS 307 2HB CYS 307 9.553 11.416 8.134 24 HB3 CYS 307 1HB CYS 307 9.218 11.510 9.860 25 H ARG 308 H ARG 308 12.520 13.609 10.928 26 HA ARG 308 HA ARG 308 13.973 11.229 11.507 27 HB2 ARG 308 2HB ARG 308 14.977 12.595 13.372 28 HB3 ARG 308 1HB ARG 308 15.060 13.377 11.797 29 HG2 ARG 308 2HG ARG 308 13.060 14.753 12.425 30 HG3 ARG 308 1HG ARG 308 13.103 14.030 14.031 31 HD2 ARG 308 2HD ARG 308 15.300 15.029 14.451 32 HD3 ARG 308 1HD ARG 308 15.344 15.678 12.804 33 HE ARG 308 HE ARG 308 13.001 16.603 14.026 34 HH11 ARG 308 1HH1 ARG 308 16.462 17.087 14.411 35 HH12 ARG 308 2HH1 ARG 308 16.276 18.698 15.024 36 HH21 ARG 308 1HH2 ARG 308 12.786 18.698 14.865 37 HH22 ARG 308 2HH2 ARG 308 14.208 19.604 15.273 38 H PHE 309 H PHE 309 11.332 12.935 13.173 39 HA PHE 309 HA PHE 309 11.216 11.141 15.427 40 HB2 PHE 309 2HB PHE 309 9.210 13.231 14.473 41 HB3 PHE 309 1HB PHE 309 9.153 12.407 16.027 42 HD1 PHE 309 HD1 PHE 309 11.686 12.563 17.233 43 HD2 PHE 309 HD2 PHE 309 9.867 15.470 14.674 44 HE1 PHE 309 HE1 PHE 309 13.049 14.333 18.261 45 HE2 PHE 309 HE2 PHE 309 11.243 17.230 15.707 46 HZ PHE 309 HZ PHE 309 12.835 16.662 17.498 47 H CYS 310 H CYS 310 9.384 11.536 12.407 48 HA CYS 310 HA CYS 310 7.462 9.443 13.092 49 HB2 CYS 310 2HB CYS 310 7.587 10.866 10.427 50 HB3 CYS 310 1HB CYS 310 6.182 10.199 11.255 51 H LYS 311 H LYS 311 10.543 9.308 12.049 52 HA LYS 311 HA LYS 311 11.873 7.662 11.270 53 HB2 LYS 311 2HB LYS 311 9.337 5.994 11.324 54 HB3 LYS 311 1HB LYS 311 10.954 5.337 11.109 55 HG2 LYS 311 2HG LYS 311 11.568 6.086 13.376 56 HG3 LYS 311 1HG LYS 311 9.959 6.786 13.590 57 HD2 LYS 311 2HD LYS 311 10.153 4.562 14.682 58 HD3 LYS 311 1HD LYS 311 8.933 4.567 13.405 59 HE2 LYS 311 2HE LYS 311 10.590 3.514 11.858 60 HE3 LYS 311 1HE LYS 311 11.761 3.473 13.176 61 HZ1 LYS 311 1HZ LYS 311 9.158 2.054 13.114 62 HZ2 LYS 311 2HZ LYS 311 10.261 2.017 14.394 63 HZ3 LYS 311 3HZ LYS 311 10.683 1.351 12.897 64 H ASP 312 H ASP 312 10.270 9.378 9.375 65 HA ASP 312 HA ASP 312 9.977 9.808 7.185 66 HB2 ASP 312 2HB ASP 312 11.949 7.520 6.821 67 HB3 ASP 312 1HB ASP 312 11.411 8.557 5.502 68 H ASP 313 H ASP 313 8.386 7.561 8.608 69 HA ASP 313 HA ASP 313 7.356 5.927 6.494 70 HB2 ASP 313 2HB ASP 313 6.370 6.535 9.302 71 HB3 ASP 313 1HB ASP 313 5.430 5.548 8.192 72 H GLU 314 H GLU 314 6.162 6.600 4.912 73 HA GLU 314 HA GLU 314 4.970 9.219 4.802 74 HB2 GLU 314 2HB GLU 314 4.868 6.921 2.807 75 HB3 GLU 314 1HB GLU 314 4.451 8.604 2.472 76 HG2 GLU 314 2HG GLU 314 6.773 9.286 2.884 77 HG3 GLU 314 1HG GLU 314 7.208 7.635 3.309 78 H ASN 315 H ASN 315 3.890 5.967 5.442 79 HA ASN 315 HA ASN 315 1.094 6.249 5.108 80 HB2 ASN 315 2HB ASN 315 2.072 4.033 5.318 81 HB3 ASN 315 1HB ASN 315 2.756 4.418 6.893 82 HD21 ASN 315 1HD2 ASN 315 -0.210 3.662 5.151 83 HD22 ASN 315 2HD2 ASN 315 -1.137 3.233 6.542 84 H LYS 316 H LYS 316 3.265 7.274 7.657 85 HA LYS 316 HA LYS 316 1.163 7.781 9.601 86 HB2 LYS 316 2HB LYS 316 4.099 8.549 9.702 87 HB3 LYS 316 1HB LYS 316 2.973 8.624 11.050 88 HG2 LYS 316 2HG LYS 316 3.971 6.118 9.651 89 HG3 LYS 316 1HG LYS 316 4.406 6.665 11.271 90 HD2 LYS 316 2HD LYS 316 1.638 5.756 10.374 91 HD3 LYS 316 1HD LYS 316 2.779 4.804 11.322 92 HE2 LYS 316 2HE LYS 316 2.630 6.497 13.145 93 HE3 LYS 316 1HE LYS 316 1.433 7.383 12.196 94 HZ1 LYS 316 1HZ LYS 316 -0.014 5.456 12.283 95 HZ2 LYS 316 2HZ LYS 316 0.400 5.963 13.843 96 HZ3 LYS 316 3HZ LYS 316 1.139 4.597 13.176 97 HA PRO 317 HA PRO 317 0.535 12.018 7.994 98 HB2 PRO 317 2HB PRO 317 -1.516 12.718 9.633 99 HB3 PRO 317 1HB PRO 317 -1.743 11.606 8.277 100 HG2 PRO 317 2HG PRO 317 -1.388 10.979 11.203 101 HG3 PRO 317 1HG PRO 317 -2.536 10.280 10.042 102 HD2 PRO 317 2HD PRO 317 -0.181 9.054 10.767 103 HD3 PRO 317 1HD PRO 317 -0.953 8.801 9.188 104 H CYS 318 H CYS 318 1.046 14.178 8.822 105 HA CYS 318 HA CYS 318 2.597 14.180 11.322 106 HB2 CYS 318 2HB CYS 318 4.152 13.202 9.791 107 HB3 CYS 318 1HB CYS 318 3.760 14.362 8.525 108 H ARG 319 H ARG 319 2.894 16.117 12.215 109 HA ARG 319 HA ARG 319 2.777 18.585 10.645 110 HB2 ARG 319 2HB ARG 319 1.359 19.617 12.573 111 HB3 ARG 319 1HB ARG 319 0.559 18.651 11.347 112 HG2 ARG 319 2HG ARG 319 -0.454 17.995 13.355 113 HG3 ARG 319 1HG ARG 319 0.679 16.690 13.013 114 HD2 ARG 319 2HD ARG 319 2.247 17.597 14.663 115 HD3 ARG 319 1HD ARG 319 1.187 18.982 14.944 116 HE ARG 319 HE ARG 319 0.420 16.183 15.567 117 HH11 ARG 319 1HH1 ARG 319 0.422 19.587 16.459 118 HH12 ARG 319 2HH1 ARG 319 -0.408 19.305 17.955 119 HH21 ARG 319 1HH2 ARG 319 -0.663 15.852 17.520 120 HH22 ARG 319 2HH2 ARG 319 -1.007 17.203 18.555 121 H LYS 320 H LYS 320 4.299 16.746 13.023 122 HA LYS 320 HA LYS 320 5.320 18.879 14.684 123 HB2 LYS 320 2HB LYS 320 4.869 16.604 15.573 124 HB3 LYS 320 1HB LYS 320 6.107 15.949 14.524 125 HG2 LYS 320 2HG LYS 320 7.173 16.024 16.595 126 HG3 LYS 320 1HG LYS 320 7.754 17.498 15.827 127 HD2 LYS 320 2HD LYS 320 5.471 17.365 17.840 128 HD3 LYS 320 1HD LYS 320 7.135 17.766 18.245 129 HE2 LYS 320 2HE LYS 320 6.990 19.774 16.798 130 HE3 LYS 320 1HE LYS 320 5.310 19.376 16.420 131 HZ1 LYS 320 1HZ LYS 320 5.534 21.045 18.170 132 HZ2 LYS 320 2HZ LYS 320 6.341 19.928 19.146 133 HZ3 LYS 320 3HZ LYS 320 4.730 19.662 18.712 134 H CYS 321 H CYS 321 6.316 17.468 11.689 135 HA CYS 321 HA CYS 321 8.895 18.934 11.846 136 HB2 CYS 321 2HB CYS 321 8.328 16.994 9.617 137 HB3 CYS 321 1HB CYS 321 9.864 17.396 10.377 138 H ALA 322 H ALA 322 5.774 19.197 10.789 139 HA ALA 322 HA ALA 322 6.288 20.528 8.230 140 HB1 ALA 322 1HB ALA 322 3.834 20.428 7.954 141 HB2 ALA 322 2HB ALA 322 3.660 19.760 9.579 142 HB3 ALA 322 3HB ALA 322 4.485 18.832 8.326 143 H CYS 323 H CYS 323 4.775 22.503 7.890 144 HA CYS 323 HA CYS 323 5.240 24.530 9.849 145 HB2 CYS 323 2HB CYS 323 5.138 25.334 7.647 146 HB3 CYS 323 1HB CYS 323 3.687 24.419 7.261 147 H HIS 324 H HIS 324 4.269 24.366 11.783 148 HA HIS 324 HA HIS 324 2.297 22.413 12.255 149 HB2 HIS 324 2HB HIS 324 4.215 23.153 13.787 150 HB3 HIS 324 1HB HIS 324 3.228 24.535 14.232 151 HD1 HIS 324 HD1 HIS 324 1.751 24.144 16.256 152 HD2 HIS 324 HD2 HIS 324 2.908 20.592 14.435 153 HE1 HIS 324 HE1 HIS 324 0.885 22.280 17.728 154 H VAL 325 H VAL 325 2.111 25.834 11.792 155 HA VAL 325 HA VAL 325 -0.356 26.346 13.078 156 HB VAL 325 HB VAL 325 -0.335 28.507 11.641 157 HG11 VAL 325 1HG1 VAL 325 2.056 27.953 13.438 158 HG12 VAL 325 2HG1 VAL 325 0.455 28.458 13.978 159 HG13 VAL 325 3HG1 VAL 325 1.437 29.550 13.001 160 HG21 VAL 325 1HG2 VAL 325 1.056 27.669 9.789 161 HG22 VAL 325 2HG2 VAL 325 2.412 27.435 10.893 162 HG23 VAL 325 3HG2 VAL 325 1.820 29.062 10.556 163 H CYS 326 H CYS 326 0.359 25.012 9.939 164 HA CYS 326 HA CYS 326 -2.558 24.710 9.460 165 HB2 CYS 326 2HB CYS 326 -2.260 24.833 7.043 166 HB3 CYS 326 1HB CYS 326 -1.611 26.301 7.757 167 H GLY 327 H GLY 327 0.180 23.193 10.325 168 HA2 GLY 327 2HA GLY 327 0.994 21.075 10.379 169 HA3 GLY 327 1HA GLY 327 -0.651 20.563 10.057 170 H GLY 328 H GLY 328 1.151 22.495 7.734 171 HA2 GLY 328 2HA GLY 328 0.884 20.253 5.801 172 HA3 GLY 328 1HA GLY 328 0.727 21.956 5.406 173 H ARG 329 H ARG 329 2.539 19.615 4.564 174 HA ARG 329 HA ARG 329 5.178 20.928 4.647 175 HB2 ARG 329 2HB ARG 329 4.239 18.257 3.518 176 HB3 ARG 329 1HB ARG 329 5.869 18.874 3.264 177 HG2 ARG 329 2HG ARG 329 4.626 18.201 5.955 178 HG3 ARG 329 1HG ARG 329 5.813 17.221 5.086 179 HD2 ARG 329 2HD ARG 329 6.275 20.032 6.151 180 HD3 ARG 329 1HD ARG 329 6.835 18.543 6.911 181 HE ARG 329 HE ARG 329 7.822 18.649 4.279 182 HH11 ARG 329 1HH1 ARG 329 8.294 20.349 7.328 183 HH12 ARG 329 2HH1 ARG 329 9.958 20.701 7.005 184 HH21 ARG 329 1HH2 ARG 329 9.996 19.132 3.887 185 HH22 ARG 329 2HH2 ARG 329 10.921 20.025 5.053 186 H GLU 330 H GLU 330 2.722 21.907 3.273 187 HA GLU 330 HA GLU 330 3.036 21.911 0.454 188 HB2 GLU 330 2HB GLU 330 1.762 24.114 2.138 189 HB3 GLU 330 1HB GLU 330 1.322 23.607 0.508 190 HG2 GLU 330 2HG GLU 330 0.385 21.515 1.372 191 HG3 GLU 330 1HG GLU 330 0.951 21.904 2.992 192 H ALA 331 H ALA 331 3.525 24.043 -0.749 193 HA ALA 331 HA ALA 331 5.211 25.477 -1.433 194 HB1 ALA 331 1HB ALA 331 4.871 27.666 -0.355 195 HB2 ALA 331 2HB ALA 331 4.071 26.872 1.005 196 HB3 ALA 331 3HB ALA 331 3.339 26.820 -0.596 197 HA PRO 332 HA PRO 332 8.187 23.639 1.699 198 HB2 PRO 332 2HB PRO 332 10.257 23.051 -0.096 199 HB3 PRO 332 1HB PRO 332 8.901 21.983 0.278 200 HG2 PRO 332 2HG PRO 332 9.231 23.889 -2.032 201 HG3 PRO 332 1HG PRO 332 8.618 22.221 -2.037 202 HD2 PRO 332 2HD PRO 332 6.930 24.302 -2.147 203 HD3 PRO 332 1HD PRO 332 6.518 22.860 -1.190 204 H GLU 333 H GLU 333 9.089 26.077 -0.708 205 HA GLU 333 HA GLU 333 11.452 27.000 0.608 206 HB2 GLU 333 2HB GLU 333 11.360 28.896 -0.966 207 HB3 GLU 333 1HB GLU 333 11.129 27.360 -1.794 208 HG2 GLU 333 2HG GLU 333 8.718 27.759 -1.948 209 HG3 GLU 333 1HG GLU 333 8.879 29.245 -1.016 210 H LYS 334 H LYS 334 8.036 27.875 0.808 211 HA LYS 334 HA LYS 334 8.426 30.359 2.207 212 HB2 LYS 334 2HB LYS 334 5.904 28.678 1.878 213 HB3 LYS 334 1HB LYS 334 5.946 30.313 2.531 214 HG2 LYS 334 2HG LYS 334 6.679 29.497 -0.301 215 HG3 LYS 334 1HG LYS 334 5.178 30.281 0.200 216 HD2 LYS 334 2HD LYS 334 6.597 32.235 1.010 217 HD3 LYS 334 1HD LYS 334 7.985 31.455 0.248 218 HE2 LYS 334 2HE LYS 334 5.463 32.365 -1.186 219 HE3 LYS 334 1HE LYS 334 7.008 33.213 -1.186 220 HZ1 LYS 334 1HZ LYS 334 6.502 30.514 -2.310 221 HZ2 LYS 334 2HZ LYS 334 8.001 31.293 -2.285 222 HZ3 LYS 334 3HZ LYS 334 6.729 31.936 -3.192 223 H GLN 335 H GLN 335 8.302 27.031 3.171 224 HA GLN 335 HA GLN 335 7.460 27.371 5.890 225 HB2 GLN 335 2HB GLN 335 9.006 25.104 4.560 226 HB3 GLN 335 1HB GLN 335 8.475 25.068 6.238 227 HG2 GLN 335 2HG GLN 335 6.106 25.363 5.366 228 HG3 GLN 335 1HG GLN 335 6.752 25.074 3.751 229 HE21 GLN 335 1HE2 GLN 335 7.530 22.990 3.244 230 HE22 GLN 335 2HE2 GLN 335 7.143 21.603 4.196 231 H LEU 336 H LEU 336 8.713 29.165 6.584 232 HA LEU 336 HA LEU 336 11.582 28.971 6.866 233 HB2 LEU 336 2HB LEU 336 9.560 30.965 7.942 234 HB3 LEU 336 1HB LEU 336 11.295 31.101 8.203 235 HG LEU 336 HG LEU 336 9.911 31.183 5.496 236 HD11 LEU 336 1HD1 LEU 336 11.227 33.416 7.079 237 HD12 LEU 336 2HD1 LEU 336 9.496 33.218 6.796 238 HD13 LEU 336 3HD1 LEU 336 10.572 33.549 5.443 239 HD21 LEU 336 1HD2 LEU 336 12.131 31.797 4.602 240 HD22 LEU 336 2HD2 LEU 336 12.130 30.179 5.293 241 HD23 LEU 336 3HD2 LEU 336 12.846 31.520 6.192 242 H LEU 337 H LEU 337 12.676 28.224 8.534 243 HA LEU 337 HA LEU 337 11.266 26.838 10.681 244 HB2 LEU 337 2HB LEU 337 14.141 26.817 9.681 245 HB3 LEU 337 1HB LEU 337 13.723 26.082 11.214 246 HG LEU 337 HG LEU 337 13.887 24.378 9.491 247 HD11 LEU 337 1HD1 LEU 337 11.006 24.769 10.335 248 HD12 LEU 337 2HD1 LEU 337 12.284 23.982 11.265 249 HD13 LEU 337 3HD1 LEU 337 11.731 23.263 9.757 250 HD21 LEU 337 1HD2 LEU 337 13.392 25.730 7.511 251 HD22 LEU 337 2HD2 LEU 337 11.691 25.822 7.977 252 HD23 LEU 337 3HD2 LEU 337 12.411 24.267 7.548 253 H CYS 338 H CYS 338 11.026 27.680 12.641 254 HA CYS 338 HA CYS 338 12.550 30.020 13.567 255 HB2 CYS 338 2HB CYS 338 10.011 29.964 13.710 256 HB3 CYS 338 1HB CYS 338 10.168 28.641 14.868 257 H ASP 339 H ASP 339 14.426 29.429 14.511 258 HA ASP 339 HA ASP 339 15.299 26.901 15.069 259 HB2 ASP 339 2HB ASP 339 16.807 28.817 14.807 260 HB3 ASP 339 1HB ASP 339 16.250 29.507 16.326 261 H GLU 340 H GLU 340 14.088 29.184 17.519 262 HA GLU 340 HA GLU 340 14.447 27.489 19.756 263 HB2 GLU 340 2HB GLU 340 14.349 29.584 20.600 264 HB3 GLU 340 1HB GLU 340 13.484 30.210 19.215 265 HG2 GLU 340 2HG GLU 340 12.078 28.723 21.426 266 HG3 GLU 340 1HG GLU 340 12.424 30.444 21.543 267 H CYS 341 H CYS 341 11.597 28.114 17.705 268 HA CYS 341 HA CYS 341 9.799 26.458 19.232 269 HB2 CYS 341 2HB CYS 341 9.586 27.686 16.460 270 HB3 CYS 341 1HB CYS 341 8.312 26.689 17.153 271 H ASP 342 H ASP 342 12.153 25.835 16.801 272 HA ASP 342 HA ASP 342 12.765 24.162 15.447 273 HB2 ASP 342 2HB ASP 342 11.168 22.423 17.373 274 HB3 ASP 342 1HB ASP 342 12.223 21.777 16.122 275 H MET 343 H MET 343 10.085 25.519 15.005 276 HA MET 343 HA MET 343 8.729 23.439 13.389 277 HB2 MET 343 2HB MET 343 7.409 25.897 14.617 278 HB3 MET 343 1HB MET 343 6.610 24.601 13.730 279 HG2 MET 343 2HG MET 343 7.821 24.506 16.480 280 HG3 MET 343 1HG MET 343 6.145 24.235 16.017 281 HE1 MET 343 1HE MET 343 6.609 20.736 14.105 282 HE2 MET 343 2HE MET 343 6.823 22.309 13.350 283 HE3 MET 343 3HE MET 343 5.462 22.026 14.440 284 H ALA 344 H ALA 344 8.052 23.917 11.381 285 HA ALA 344 HA ALA 344 9.226 26.164 9.965 286 HB1 ALA 344 1HB ALA 344 9.180 23.946 8.904 287 HB2 ALA 344 2HB ALA 344 8.250 25.104 7.953 288 HB3 ALA 344 3HB ALA 344 7.416 23.926 8.971 289 H PHE 345 H PHE 345 7.975 27.743 8.798 290 HA PHE 345 HA PHE 345 5.117 28.039 9.384 291 HB2 PHE 345 2HB PHE 345 7.172 30.159 10.179 292 HB3 PHE 345 1HB PHE 345 5.434 30.414 10.163 293 HD1 PHE 345 HD1 PHE 345 8.245 29.211 12.101 294 HD2 PHE 345 HD2 PHE 345 3.985 29.055 11.758 295 HE1 PHE 345 HE1 PHE 345 8.079 28.402 14.420 296 HE2 PHE 345 HE2 PHE 345 3.835 28.254 14.077 297 HZ PHE 345 HZ PHE 345 5.877 27.924 15.410 298 H HIS 346 H HIS 346 4.248 28.451 7.425 299 HA HIS 346 HA HIS 346 5.616 29.509 5.170 300 HB2 HIS 346 2HB HIS 346 2.642 29.222 5.768 301 HB3 HIS 346 1HB HIS 346 3.247 29.830 4.235 302 HD2 HIS 346 HD2 HIS 346 5.263 27.776 3.196 303 HE1 HIS 346 HE1 HIS 346 2.543 24.762 4.308 304 HE2 HIS 346 HE2 HIS 346 4.688 25.292 3.095 305 H LEU 347 H LEU 347 5.546 31.590 4.251 306 HA LEU 347 HA LEU 347 5.588 33.849 5.877 307 HB2 LEU 347 2HB LEU 347 5.221 33.542 2.886 308 HB3 LEU 347 1HB LEU 347 5.333 35.123 3.640 309 HG LEU 347 HG LEU 347 7.513 32.995 3.651 310 HD11 LEU 347 1HD1 LEU 347 8.764 34.559 2.224 311 HD12 LEU 347 2HD1 LEU 347 7.381 35.655 2.192 312 HD13 LEU 347 3HD1 LEU 347 7.259 34.055 1.455 313 HD21 LEU 347 1HD2 LEU 347 8.932 34.713 4.712 314 HD22 LEU 347 2HD2 LEU 347 7.572 34.272 5.738 315 HD23 LEU 347 3HD2 LEU 347 7.540 35.792 4.840 316 H TYR 348 H TYR 348 2.950 32.633 3.829 317 HA TYR 348 HA TYR 348 1.102 34.722 4.550 318 HB2 TYR 348 2HB TYR 348 -0.553 33.411 3.202 319 HB3 TYR 348 1HB TYR 348 0.921 33.784 2.328 320 HD1 TYR 348 HD1 TYR 348 -1.240 31.113 3.532 321 HD2 TYR 348 HD2 TYR 348 2.635 31.932 1.910 322 HE1 TYR 348 HE1 TYR 348 -0.985 28.742 2.917 323 HE2 TYR 348 HE2 TYR 348 2.880 29.559 1.297 324 HH TYR 348 HH TYR 348 0.337 27.376 1.231 325 H CYS 349 H CYS 349 2.093 31.864 6.115 326 HA CYS 349 HA CYS 349 -0.353 31.538 7.708 327 HB2 CYS 349 2HB CYS 349 2.308 30.077 7.713 328 HB3 CYS 349 1HB CYS 349 1.059 29.784 8.917 329 H LEU 350 H LEU 350 2.063 33.759 7.768 330 HA LEU 350 HA LEU 350 2.515 33.816 10.662 331 HB2 LEU 350 2HB LEU 350 3.429 35.766 8.504 332 HB3 LEU 350 1HB LEU 350 3.969 35.748 10.177 333 HG LEU 350 HG LEU 350 4.534 33.613 8.080 334 HD11 LEU 350 1HD1 LEU 350 6.883 34.285 8.328 335 HD12 LEU 350 2HD1 LEU 350 6.405 35.557 9.458 336 HD13 LEU 350 3HD1 LEU 350 5.875 35.622 7.777 337 HD21 LEU 350 1HD2 LEU 350 4.222 32.522 10.245 338 HD22 LEU 350 2HD2 LEU 350 5.352 33.638 11.006 339 HD23 LEU 350 3HD2 LEU 350 5.925 32.492 9.796 340 H LYS 351 H LYS 351 2.274 36.145 11.658 341 HA LYS 351 HA LYS 351 -0.020 37.635 10.682 342 HB2 LYS 351 2HB LYS 351 -0.803 35.742 12.308 343 HB3 LYS 351 1HB LYS 351 -0.072 36.714 13.579 344 HG2 LYS 351 2HG LYS 351 -2.466 37.172 13.443 345 HG3 LYS 351 1HG LYS 351 -1.546 38.609 12.977 346 HD2 LYS 351 2HD LYS 351 -1.933 38.084 10.578 347 HD3 LYS 351 1HD LYS 351 -2.838 36.639 11.037 348 HE2 LYS 351 2HE LYS 351 -3.629 39.503 11.672 349 HE3 LYS 351 1HE LYS 351 -4.343 38.485 10.420 350 HZ1 LYS 351 1HZ LYS 351 -4.922 36.913 12.277 351 HZ2 LYS 351 2HZ LYS 351 -5.767 38.372 12.248 352 HZ3 LYS 351 3HZ LYS 351 -4.512 38.152 13.350 353 HA PRO 352 HA PRO 352 0.011 39.644 9.921 354 HB2 PRO 352 2HB PRO 352 1.592 41.416 8.604 355 HB3 PRO 352 1HB PRO 352 0.636 41.893 10.016 356 HG2 PRO 352 2HG PRO 352 3.555 41.129 9.884 357 HG3 PRO 352 1HG PRO 352 2.802 42.532 10.675 358 HD2 PRO 352 2HD PRO 352 3.476 40.289 12.058 359 HD3 PRO 352 1HD PRO 352 2.071 41.278 12.498 360 HA PRO 353 HA PRO 353 1.930 36.588 7.160 361 HB2 PRO 353 2HB PRO 353 0.146 37.839 5.085 362 HB3 PRO 353 1HB PRO 353 0.297 36.143 5.564 363 HG2 PRO 353 2HG PRO 353 -1.834 37.568 6.320 364 HG3 PRO 353 1HG PRO 353 -1.080 36.406 7.435 365 HD2 PRO 353 2HD PRO 353 -0.806 39.414 7.369 366 HD3 PRO 353 1HD PRO 353 -1.011 38.333 8.766 367 H LEU 354 H LEU 354 3.951 37.009 6.497 368 HA LEU 354 HA LEU 354 4.738 39.511 5.245 369 HB2 LEU 354 2HB LEU 354 6.353 36.971 5.727 370 HB3 LEU 354 1HB LEU 354 7.012 38.510 5.188 371 HG LEU 354 HG LEU 354 5.791 37.914 7.906 372 HD11 LEU 354 1HD1 LEU 354 8.044 38.342 8.780 373 HD12 LEU 354 2HD1 LEU 354 8.649 38.592 7.141 374 HD13 LEU 354 3HD1 LEU 354 8.049 37.005 7.630 375 HD21 LEU 354 1HD2 LEU 354 5.188 40.201 7.282 376 HD22 LEU 354 2HD2 LEU 354 6.870 40.567 6.887 377 HD23 LEU 354 3HD2 LEU 354 6.407 40.215 8.554 378 H THR 355 H THR 355 5.754 39.622 3.160 379 HA THR 355 HA THR 355 4.848 37.574 1.204 380 HB THR 355 HB THR 355 3.862 39.816 0.843 381 HG1 THR 355 HG1 THR 355 4.628 38.365 -0.953 382 HG21 THR 355 1HG2 THR 355 5.665 41.239 1.774 383 HG22 THR 355 2HG2 THR 355 5.245 41.725 0.133 384 HG23 THR 355 3HG2 THR 355 6.712 40.792 0.418 385 H SER 356 H SER 356 7.549 38.695 2.831 386 HA SER 356 HA SER 356 9.433 37.572 0.865 387 HB2 SER 356 2HB SER 356 9.798 40.279 2.247 388 HB3 SER 356 1HB SER 356 10.984 39.485 1.207 389 HG SER 356 HG SER 356 8.752 39.565 -0.170 390 H VAL 357 H VAL 357 11.174 36.544 1.782 391 HA VAL 357 HA VAL 357 11.160 35.791 4.537 392 HB VAL 357 HB VAL 357 13.333 35.414 2.414 393 HG11 VAL 357 1HG1 VAL 357 14.244 33.632 3.876 394 HG12 VAL 357 2HG1 VAL 357 13.055 34.038 5.114 395 HG13 VAL 357 3HG1 VAL 357 14.296 35.210 4.669 396 HG21 VAL 357 1HG2 VAL 357 11.212 34.325 1.781 397 HG22 VAL 357 2HG2 VAL 357 11.167 33.479 3.328 398 HG23 VAL 357 3HG2 VAL 357 12.442 33.120 2.161 399 HA PRO 358 HA PRO 358 13.370 39.525 6.036 400 HB2 PRO 358 2HB PRO 358 13.808 37.704 8.394 401 HB3 PRO 358 1HB PRO 358 13.234 39.380 8.360 402 HG2 PRO 358 2HG PRO 358 11.519 37.396 8.770 403 HG3 PRO 358 1HG PRO 358 11.062 38.756 7.721 404 HD2 PRO 358 2HD PRO 358 11.944 35.975 6.950 405 HD3 PRO 358 1HD PRO 358 10.667 36.990 6.241 406 HA PRO 359 HA PRO 359 17.608 38.076 5.188 407 HB2 PRO 359 2HB PRO 359 18.895 40.439 5.214 408 HB3 PRO 359 1HB PRO 359 17.669 40.101 3.981 409 HG2 PRO 359 2HG PRO 359 17.390 41.667 6.546 410 HG3 PRO 359 1HG PRO 359 16.844 42.107 4.914 411 HD2 PRO 359 2HD PRO 359 15.208 40.985 6.840 412 HD3 PRO 359 1HD PRO 359 14.921 40.822 5.093 413 H GLU 360 H GLU 360 16.431 38.631 8.123 414 HA GLU 360 HA GLU 360 18.645 39.377 9.748 415 HB2 GLU 360 2HB GLU 360 16.050 37.945 10.468 416 HB3 GLU 360 1HB GLU 360 17.139 38.719 11.622 417 HG2 GLU 360 2HG GLU 360 16.696 40.911 10.611 418 HG3 GLU 360 1HG GLU 360 15.681 40.165 9.379 419 HA PRO 361 HA PRO 361 20.921 35.541 9.814 420 HB2 PRO 361 2HB PRO 361 22.318 35.747 12.158 421 HB3 PRO 361 1HB PRO 361 22.646 36.783 10.764 422 HG2 PRO 361 2HG PRO 361 20.962 37.369 13.200 423 HG3 PRO 361 1HG PRO 361 22.218 38.377 12.447 424 HD2 PRO 361 2HD PRO 361 19.589 38.805 11.972 425 HD3 PRO 361 1HD PRO 361 20.809 39.057 10.702 426 H GLU 362 H GLU 362 18.809 36.222 12.538 427 HA GLU 362 HA GLU 362 18.358 33.331 12.946 428 HB2 GLU 362 2HB GLU 362 18.058 33.833 15.421 429 HB3 GLU 362 1HB GLU 362 19.710 33.939 14.823 430 HG2 GLU 362 2HG GLU 362 19.476 36.405 14.712 431 HG3 GLU 362 1HG GLU 362 17.865 36.266 15.410 432 H TRP 363 H TRP 363 16.492 33.193 11.938 433 HA TRP 363 HA TRP 363 14.426 35.191 12.007 434 HB2 TRP 363 2HB TRP 363 14.893 33.757 9.991 435 HB3 TRP 363 1HB TRP 363 14.283 32.362 10.875 436 HD1 TRP 363 HD1 TRP 363 13.102 35.628 9.230 437 HE1 TRP 363 HE1 TRP 363 10.570 35.496 8.840 438 HE3 TRP 363 HE3 TRP 363 12.087 31.266 11.717 439 HZ2 TRP 363 HZ2 TRP 363 8.445 33.804 9.467 440 HZ3 TRP 363 HZ3 TRP 363 9.756 30.473 11.788 441 HH2 TRP 363 HH2 TRP 363 7.967 31.726 10.691 442 H TYR 364 H TYR 364 12.699 35.294 13.296 443 HA TYR 364 HA TYR 364 11.811 32.918 14.811 444 HB2 TYR 364 2HB TYR 364 11.945 35.788 15.842 445 HB3 TYR 364 1HB TYR 364 11.104 34.478 16.671 446 HD1 TYR 364 HD1 TYR 364 12.513 32.390 17.348 447 HD2 TYR 364 HD2 TYR 364 14.286 36.127 16.250 448 HE1 TYR 364 HE1 TYR 364 14.609 31.720 18.454 449 HE2 TYR 364 HE2 TYR 364 16.373 35.453 17.365 450 HH TYR 364 HH TYR 364 17.107 33.909 19.150 451 H CYS 365 H CYS 365 9.612 32.749 15.135 452 HA CYS 365 HA CYS 365 7.936 33.844 13.044 453 HB2 CYS 365 2HB CYS 365 6.273 32.246 13.814 454 HB3 CYS 365 1HB CYS 365 7.837 31.435 13.797 455 HA PRO 366 HA PRO 366 6.035 37.179 15.531 456 HB2 PRO 366 2HB PRO 366 3.402 36.964 14.586 457 HB3 PRO 366 1HB PRO 366 4.697 37.859 13.784 458 HG2 PRO 366 2HG PRO 366 3.733 35.048 13.265 459 HG3 PRO 366 1HG PRO 366 4.118 36.331 12.097 460 HD2 PRO 366 2HD PRO 366 5.863 34.379 12.545 461 HD3 PRO 366 1HD PRO 366 6.448 36.052 12.378 462 H SER 367 H SER 367 4.676 33.920 15.470 463 HA SER 367 HA SER 367 2.933 34.059 17.684 464 HB2 SER 367 2HB SER 367 2.901 32.211 16.037 465 HB3 SER 367 1HB SER 367 4.474 31.656 16.614 466 HG SER 367 HG SER 367 2.242 31.902 18.335 467 H CYS 368 H CYS 368 6.398 34.006 17.557 468 HA CYS 368 HA CYS 368 6.957 33.237 20.262 469 HB2 CYS 368 2HB CYS 368 8.528 34.458 18.019 470 HB3 CYS 368 1HB CYS 368 9.135 34.738 19.636 471 H ARG 369 H ARG 369 6.688 36.441 18.615 472 HA ARG 369 HA ARG 369 7.091 37.927 21.061 473 HB2 ARG 369 2HB ARG 369 6.776 39.945 19.702 474 HB3 ARG 369 1HB ARG 369 7.889 38.840 18.901 475 HG2 ARG 369 2HG ARG 369 6.248 38.211 17.276 476 HG3 ARG 369 1HG ARG 369 4.945 38.982 18.180 477 HD2 ARG 369 2HD ARG 369 7.251 40.433 16.833 478 HD3 ARG 369 1HD ARG 369 5.607 40.302 16.196 479 HE ARG 369 HE ARG 369 5.372 41.377 18.743 480 HH11 ARG 369 1HH1 ARG 369 6.829 42.355 15.703 481 HH12 ARG 369 2HH1 ARG 369 6.699 44.047 16.054 482 HH21 ARG 369 1HH2 ARG 369 5.174 43.587 19.170 483 HH22 ARG 369 2HH2 ARG 369 5.748 44.749 18.017 484 H THR 370 H THR 370 4.336 36.535 19.542 485 HA THR 370 HA THR 370 2.280 38.289 20.304 486 HB THR 370 HB THR 370 2.164 35.250 20.016 487 HG1 THR 370 HG1 THR 370 1.583 35.690 17.899 488 HG21 THR 370 1HG2 THR 370 -0.243 35.570 19.548 489 HG22 THR 370 2HG2 THR 370 -0.086 37.292 19.899 490 HG23 THR 370 3HG2 THR 370 0.159 36.105 21.182 491 H ASP 371 H ASP 371 2.008 39.025 22.341 492 HA ASP 371 HA ASP 371 2.770 37.711 24.744 493 HB2 ASP 371 2HB ASP 371 0.814 40.009 24.292 494 HB3 ASP 371 1HB ASP 371 1.395 39.505 25.877 495 H SER 372 H SER 372 -0.155 37.727 22.838 496 HA SER 372 HA SER 372 -1.982 36.582 24.667 497 HB2 SER 372 2HB SER 372 -1.980 36.329 21.628 498 HB3 SER 372 1HB SER 372 -3.362 36.110 22.696 499 HG SER 372 HG SER 372 -2.031 38.518 22.961 500 H SER 373 H SER 373 0.662 35.204 22.897 501 HA SER 373 HA SER 373 -0.206 32.442 22.974 502 HB2 SER 373 2HB SER 373 1.379 33.381 21.220 503 HB3 SER 373 1HB SER 373 2.594 33.562 22.479 504 HG SER 373 HG SER 373 2.969 31.644 21.428 505 H GLU 374 H GLU 374 1.988 31.066 23.957 506 HA GLU 374 HA GLU 374 1.456 30.894 26.709 507 HB2 GLU 374 2HB GLU 374 3.989 29.861 25.361 508 HB3 GLU 374 1HB GLU 374 3.202 29.214 26.798 509 HG2 GLU 374 2HG GLU 374 2.217 29.069 23.931 510 HG3 GLU 374 1HG GLU 374 2.794 27.740 24.931 511 H VAL 375 H VAL 375 2.110 32.134 28.356 512 HA VAL 375 HA VAL 375 3.627 34.467 27.983 513 HB VAL 375 HB VAL 375 1.895 34.411 29.677 514 HG11 VAL 375 1HG1 VAL 375 3.595 32.450 31.263 515 HG12 VAL 375 2HG1 VAL 375 2.079 32.081 30.440 516 HG13 VAL 375 3HG1 VAL 375 2.087 33.190 31.810 517 HG21 VAL 375 1HG2 VAL 375 4.597 34.901 31.001 518 HG22 VAL 375 2HG2 VAL 375 3.048 35.528 31.567 519 HG23 VAL 375 3HG2 VAL 375 3.701 36.062 30.018 520 H VAL 376 H VAL 376 5.721 34.674 27.752 521 HA VAL 376 HA VAL 376 7.681 32.773 28.734 522 HB VAL 376 HB VAL 376 8.173 35.477 27.390 523 HG11 VAL 376 1HG1 VAL 376 9.999 33.058 27.646 524 HG12 VAL 376 2HG1 VAL 376 10.165 34.578 28.529 525 HG13 VAL 376 3HG1 VAL 376 10.376 34.550 26.778 526 HG21 VAL 376 1HG2 VAL 376 8.379 34.244 25.247 527 HG22 VAL 376 2HG2 VAL 376 6.755 34.098 25.922 528 HG23 VAL 376 3HG2 VAL 376 7.889 32.753 26.057 529 H GLN 377 H GLN 377 8.967 33.064 30.515 530 HA GLN 377 HA GLN 377 8.145 34.771 32.623 531 HB2 GLN 377 2HB GLN 377 10.724 33.174 32.299 532 HB3 GLN 377 1HB GLN 377 10.158 33.879 33.811 533 HG2 GLN 377 2HG GLN 377 8.217 32.396 33.820 534 HG3 GLN 377 1HG GLN 377 8.667 31.743 32.245 535 HE21 GLN 377 1HE2 GLN 377 8.747 29.633 33.112 536 HE22 GLN 377 2HE2 GLN 377 10.038 29.109 34.132 537 H ALA 378 H ALA 378 8.470 36.937 32.682 538 HA ALA 378 HA ALA 378 10.499 38.329 31.206 539 HB1 ALA 378 1HB ALA 378 9.612 40.348 32.307 540 HB2 ALA 378 2HB ALA 378 8.680 39.344 33.419 541 HB3 ALA 378 3HB ALA 378 8.297 39.340 31.698 542 H GLY 379 H GLY 379 11.935 39.996 32.417 543 HA2 GLY 379 2HA GLY 379 13.780 40.367 33.741 544 HA3 GLY 379 1HA GLY 379 13.135 39.227 34.919 545 H GLU 380 H GLU 380 13.831 38.679 31.530 546 HA GLU 380 HA GLU 380 15.105 36.217 31.895 547 HB2 GLU 380 2HB GLU 380 15.594 36.250 29.489 548 HB3 GLU 380 1HB GLU 380 13.937 36.730 29.806 549 HG2 GLU 380 2HG GLU 380 16.231 38.587 29.053 550 HG3 GLU 380 1HG GLU 380 14.953 38.027 27.981 Start of MODEL 19 1 H1 SER 303 H SER 303 15.011 4.445 2.214 2 HA SER 303 HA SER 303 17.538 4.439 3.566 3 HB2 SER 303 2HB SER 303 18.296 5.842 1.615 4 HB3 SER 303 1HB SER 303 17.489 4.352 1.133 5 HG SER 303 HG SER 303 16.767 6.144 -0.071 6 H GLY 304 H GLY 304 14.977 6.846 3.102 7 HA2 GLY 304 2HA GLY 304 16.275 9.047 4.387 8 HA3 GLY 304 1HA GLY 304 14.547 8.872 4.105 9 HA PRO 305 HA PRO 305 16.082 8.068 8.715 10 HB2 PRO 305 2HB PRO 305 14.911 10.813 9.178 11 HB3 PRO 305 1HB PRO 305 16.349 10.069 9.894 12 HG2 PRO 305 2HG PRO 305 16.622 11.924 8.007 13 HG3 PRO 305 1HG PRO 305 17.669 10.487 8.002 14 HD2 PRO 305 2HD PRO 305 15.237 11.061 6.305 15 HD3 PRO 305 1HD PRO 305 16.805 10.368 5.828 16 H SER 306 H SER 306 14.691 7.019 10.009 17 HA SER 306 HA SER 306 11.940 6.715 9.434 18 HB2 SER 306 2HB SER 306 11.912 5.441 11.650 19 HB3 SER 306 1HB SER 306 13.110 4.890 10.486 20 HG SER 306 HG SER 306 14.697 5.615 11.714 21 H CYS 307 H CYS 307 10.368 8.092 9.825 22 HA CYS 307 HA CYS 307 10.488 10.341 11.567 23 HB2 CYS 307 2HB CYS 307 8.483 9.152 9.713 24 HB3 CYS 307 1HB CYS 307 7.808 10.088 11.035 25 H ARG 308 H ARG 308 10.766 9.825 13.729 26 HA ARG 308 HA ARG 308 9.629 7.506 14.950 27 HB2 ARG 308 2HB ARG 308 10.927 9.951 16.218 28 HB3 ARG 308 1HB ARG 308 10.561 8.446 17.066 29 HG2 ARG 308 2HG ARG 308 12.099 7.251 15.484 30 HG3 ARG 308 1HG ARG 308 12.522 8.809 14.771 31 HD2 ARG 308 2HD ARG 308 14.226 8.108 16.377 32 HD3 ARG 308 1HD ARG 308 13.403 9.556 16.963 33 HE ARG 308 HE ARG 308 12.077 7.353 18.048 34 HH11 ARG 308 1HH1 ARG 308 15.267 8.777 18.300 35 HH12 ARG 308 2HH1 ARG 308 15.513 8.235 19.926 36 HH21 ARG 308 1HH2 ARG 308 12.398 6.646 20.181 37 HH22 ARG 308 2HH2 ARG 308 13.884 7.025 20.991 38 H PHE 309 H PHE 309 8.830 10.967 15.116 39 HA PHE 309 HA PHE 309 6.662 10.610 16.997 40 HB2 PHE 309 2HB PHE 309 7.580 13.053 15.433 41 HB3 PHE 309 1HB PHE 309 6.334 13.086 16.675 42 HD1 PHE 309 HD1 PHE 309 6.928 13.109 19.025 43 HD2 PHE 309 HD2 PHE 309 9.976 12.572 16.075 44 HE1 PHE 309 HE1 PHE 309 8.656 13.470 20.740 45 HE2 PHE 309 HE2 PHE 309 11.695 12.933 17.796 46 HZ PHE 309 HZ PHE 309 11.042 13.381 20.130 47 H CYS 310 H CYS 310 6.798 9.956 13.724 48 HA CYS 310 HA CYS 310 3.892 10.430 13.359 49 HB2 CYS 310 2HB CYS 310 5.394 10.742 10.842 50 HB3 CYS 310 1HB CYS 310 4.154 11.775 11.521 51 H LYS 311 H LYS 311 6.213 8.148 13.564 52 HA LYS 311 HA LYS 311 6.631 6.049 12.897 53 HB2 LYS 311 2HB LYS 311 3.646 6.014 12.291 54 HB3 LYS 311 1HB LYS 311 4.670 4.581 12.377 55 HG2 LYS 311 2HG LYS 311 5.172 5.060 14.741 56 HG3 LYS 311 1HG LYS 311 4.154 6.503 14.676 57 HD2 LYS 311 2HD LYS 311 3.242 3.609 14.347 58 HD3 LYS 311 1HD LYS 311 2.932 4.664 15.728 59 HE2 LYS 311 2HE LYS 311 1.841 5.020 12.912 60 HE3 LYS 311 1HE LYS 311 0.943 4.491 14.334 61 HZ1 LYS 311 1HZ LYS 311 2.177 7.161 13.938 62 HZ2 LYS 311 2HZ LYS 311 1.363 6.673 15.334 63 HZ3 LYS 311 3HZ LYS 311 0.527 6.802 13.869 64 H ASP 312 H ASP 312 7.981 6.828 11.236 65 HA ASP 312 HA ASP 312 8.719 7.337 9.112 66 HB2 ASP 312 2HB ASP 312 9.115 5.161 7.901 67 HB3 ASP 312 1HB ASP 312 9.585 5.170 9.592 68 H ASP 313 H ASP 313 6.373 8.544 8.889 69 HA ASP 313 HA ASP 313 4.539 7.344 7.048 70 HB2 ASP 313 2HB ASP 313 3.219 9.418 7.242 71 HB3 ASP 313 1HB ASP 313 3.662 8.749 8.808 72 H GLU 314 H GLU 314 5.982 6.961 5.308 73 HA GLU 314 HA GLU 314 6.526 9.085 3.422 74 HB2 GLU 314 2HB GLU 314 7.039 7.231 1.879 75 HB3 GLU 314 1HB GLU 314 7.859 7.021 3.421 76 HG2 GLU 314 2HG GLU 314 6.129 5.372 4.106 77 HG3 GLU 314 1HG GLU 314 5.336 5.568 2.545 78 H ASN 315 H ASN 315 3.831 7.151 4.382 79 HA ASN 315 HA ASN 315 2.270 7.338 1.960 80 HB2 ASN 315 2HB ASN 315 2.024 5.397 3.512 81 HB3 ASN 315 1HB ASN 315 1.465 6.487 4.778 82 HD21 ASN 315 1HD2 ASN 315 0.640 4.870 1.800 83 HD22 ASN 315 2HD2 ASN 315 -1.058 5.187 1.858 84 H LYS 316 H LYS 316 1.920 8.619 5.268 85 HA LYS 316 HA LYS 316 -0.054 10.612 4.427 86 HB2 LYS 316 2HB LYS 316 1.005 9.774 7.167 87 HB3 LYS 316 1HB LYS 316 -0.194 11.045 6.933 88 HG2 LYS 316 2HG LYS 316 -0.552 8.119 6.182 89 HG3 LYS 316 1HG LYS 316 -1.216 8.907 7.617 90 HD2 LYS 316 2HD LYS 316 -2.476 10.469 6.056 91 HD3 LYS 316 1HD LYS 316 -1.926 9.466 4.709 92 HE2 LYS 316 2HE LYS 316 -3.660 8.531 7.032 93 HE3 LYS 316 1HE LYS 316 -4.214 8.877 5.395 94 HZ1 LYS 316 1HZ LYS 316 -3.913 6.502 5.766 95 HZ2 LYS 316 2HZ LYS 316 -2.278 6.745 6.126 96 HZ3 LYS 316 3HZ LYS 316 -2.854 7.067 4.573 97 HA PRO 317 HA PRO 317 2.997 14.023 4.754 98 HB2 PRO 317 2HB PRO 317 1.337 16.149 5.102 99 HB3 PRO 317 1HB PRO 317 1.460 15.313 3.546 100 HG2 PRO 317 2HG PRO 317 -0.621 14.992 5.712 101 HG3 PRO 317 1HG PRO 317 -0.854 15.161 3.958 102 HD2 PRO 317 2HD PRO 317 -0.900 12.738 5.221 103 HD3 PRO 317 1HD PRO 317 -0.344 12.925 3.545 104 H CYS 318 H CYS 318 4.045 15.099 6.443 105 HA CYS 318 HA CYS 318 3.297 14.370 9.145 106 HB2 CYS 318 2HB CYS 318 5.635 16.058 8.176 107 HB3 CYS 318 1HB CYS 318 5.383 15.496 9.831 108 H ARG 319 H ARG 319 2.755 15.723 10.780 109 HA ARG 319 HA ARG 319 2.293 18.605 10.317 110 HB2 ARG 319 2HB ARG 319 0.829 18.412 12.384 111 HB3 ARG 319 1HB ARG 319 0.255 17.475 11.007 112 HG2 ARG 319 2HG ARG 319 1.332 15.437 12.041 113 HG3 ARG 319 1HG ARG 319 1.688 16.412 13.469 114 HD2 ARG 319 2HD ARG 319 -0.709 16.766 13.856 115 HD3 ARG 319 1HD ARG 319 -1.102 15.890 12.373 116 HE ARG 319 HE ARG 319 -0.295 13.867 13.382 117 HH11 ARG 319 1HH1 ARG 319 -0.615 16.523 15.679 118 HH12 ARG 319 2HH1 ARG 319 -0.798 15.465 17.040 119 HH21 ARG 319 1HH2 ARG 319 -0.504 12.511 15.175 120 HH22 ARG 319 2HH2 ARG 319 -0.731 13.190 16.755 121 H LYS 320 H LYS 320 4.040 16.192 12.121 122 HA LYS 320 HA LYS 320 5.147 17.939 14.144 123 HB2 LYS 320 2HB LYS 320 5.633 15.035 13.409 124 HB3 LYS 320 1HB LYS 320 6.575 15.845 14.654 125 HG2 LYS 320 2HG LYS 320 3.549 15.602 14.779 126 HG3 LYS 320 1HG LYS 320 4.648 14.399 15.441 127 HD2 LYS 320 2HD LYS 320 4.196 15.676 17.338 128 HD3 LYS 320 1HD LYS 320 5.687 16.415 16.771 129 HE2 LYS 320 2HE LYS 320 4.283 18.184 15.640 130 HE3 LYS 320 1HE LYS 320 2.865 17.487 16.421 131 HZ1 LYS 320 1HZ LYS 320 3.673 19.338 17.673 132 HZ2 LYS 320 2HZ LYS 320 5.228 18.682 17.756 133 HZ3 LYS 320 3HZ LYS 320 3.952 17.921 18.563 134 H CYS 321 H CYS 321 6.133 16.903 10.947 135 HA CYS 321 HA CYS 321 8.859 18.040 11.353 136 HB2 CYS 321 2HB CYS 321 7.872 16.301 9.046 137 HB3 CYS 321 1HB CYS 321 9.535 16.818 9.337 138 H ALA 322 H ALA 322 6.018 19.209 10.612 139 HA ALA 322 HA ALA 322 6.700 20.589 8.071 140 HB1 ALA 322 1HB ALA 322 4.274 20.647 7.646 141 HB2 ALA 322 2HB ALA 322 3.959 19.814 9.171 142 HB3 ALA 322 3HB ALA 322 4.817 18.984 7.870 143 H CYS 323 H CYS 323 5.170 22.606 7.882 144 HA CYS 323 HA CYS 323 5.353 24.411 10.073 145 HB2 CYS 323 2HB CYS 323 5.174 25.460 7.981 146 HB3 CYS 323 1HB CYS 323 3.873 24.405 7.443 147 H HIS 324 H HIS 324 4.398 23.999 11.915 148 HA HIS 324 HA HIS 324 2.538 21.905 12.306 149 HB2 HIS 324 2HB HIS 324 4.418 22.598 13.838 150 HB3 HIS 324 1HB HIS 324 3.496 24.030 14.268 151 HD1 HIS 324 HD1 HIS 324 1.445 23.666 15.891 152 HD2 HIS 324 HD2 HIS 324 3.626 20.227 15.049 153 HE1 HIS 324 HE1 HIS 324 0.786 21.963 17.637 154 H VAL 325 H VAL 325 2.114 25.225 11.703 155 HA VAL 325 HA VAL 325 -0.192 25.913 13.147 156 HB VAL 325 HB VAL 325 0.658 27.048 10.446 157 HG11 VAL 325 1HG1 VAL 325 -0.359 29.164 11.241 158 HG12 VAL 325 2HG1 VAL 325 -0.886 28.354 12.720 159 HG13 VAL 325 3HG1 VAL 325 -1.547 27.858 11.160 160 HG21 VAL 325 1HG2 VAL 325 2.601 27.011 11.932 161 HG22 VAL 325 2HG2 VAL 325 1.682 27.833 13.195 162 HG23 VAL 325 3HG2 VAL 325 2.049 28.670 11.685 163 H CYS 326 H CYS 326 0.250 24.632 9.885 164 HA CYS 326 HA CYS 326 -2.667 24.146 9.577 165 HB2 CYS 326 2HB CYS 326 -2.309 24.362 7.138 166 HB3 CYS 326 1HB CYS 326 -1.760 25.816 7.969 167 H GLY 327 H GLY 327 0.258 22.645 10.148 168 HA2 GLY 327 2HA GLY 327 1.064 20.507 10.042 169 HA3 GLY 327 1HA GLY 327 -0.599 19.992 9.788 170 H GLY 328 H GLY 328 1.655 21.945 7.818 171 HA2 GLY 328 2HA GLY 328 1.557 19.977 5.628 172 HA3 GLY 328 1HA GLY 328 0.845 21.559 5.336 173 H ARG 329 H ARG 329 3.127 20.156 4.126 174 HA ARG 329 HA ARG 329 5.339 22.082 4.555 175 HB2 ARG 329 2HB ARG 329 5.267 19.372 3.159 176 HB3 ARG 329 1HB ARG 329 6.692 20.405 3.260 177 HG2 ARG 329 2HG ARG 329 6.812 20.122 5.658 178 HG3 ARG 329 1HG ARG 329 5.257 19.286 5.687 179 HD2 ARG 329 2HD ARG 329 7.157 17.723 5.894 180 HD3 ARG 329 1HD ARG 329 6.193 17.408 4.446 181 HE ARG 329 HE ARG 329 8.544 19.097 4.089 182 HH11 ARG 329 1HH1 ARG 329 7.280 15.825 3.893 183 HH12 ARG 329 2HH1 ARG 329 8.548 15.262 2.857 184 HH21 ARG 329 1HH2 ARG 329 10.204 18.345 2.737 185 HH22 ARG 329 2HH2 ARG 329 10.196 16.700 2.196 186 H GLU 330 H GLU 330 2.693 22.157 2.912 187 HA GLU 330 HA GLU 330 3.317 22.074 0.146 188 HB2 GLU 330 2HB GLU 330 0.950 23.353 1.588 189 HB3 GLU 330 1HB GLU 330 1.020 22.928 -0.125 190 HG2 GLU 330 2HG GLU 330 1.118 20.563 0.393 191 HG3 GLU 330 1HG GLU 330 1.319 20.894 2.110 192 H ALA 331 H ALA 331 4.705 23.441 -0.710 193 HA ALA 331 HA ALA 331 5.865 25.247 -1.365 194 HB1 ALA 331 1HB ALA 331 5.318 27.558 -0.830 195 HB2 ALA 331 2HB ALA 331 4.148 27.029 0.386 196 HB3 ALA 331 3HB ALA 331 3.864 26.687 -1.322 197 HA PRO 332 HA PRO 332 8.415 24.559 2.483 198 HB2 PRO 332 2HB PRO 332 10.487 23.725 0.517 199 HB3 PRO 332 1HB PRO 332 9.851 22.844 1.912 200 HG2 PRO 332 2HG PRO 332 9.277 22.119 -0.621 201 HG3 PRO 332 1HG PRO 332 8.094 21.926 0.691 202 HD2 PRO 332 2HD PRO 332 8.274 24.097 -1.409 203 HD3 PRO 332 1HD PRO 332 6.847 23.199 -0.837 204 H GLU 333 H GLU 333 9.164 25.983 -0.606 205 HA GLU 333 HA GLU 333 11.170 27.780 -0.134 206 HB2 GLU 333 2HB GLU 333 10.062 29.197 -1.900 207 HB3 GLU 333 1HB GLU 333 10.254 27.506 -2.345 208 HG2 GLU 333 2HG GLU 333 7.924 27.043 -2.001 209 HG3 GLU 333 1HG GLU 333 7.658 28.593 -1.208 210 H LYS 334 H LYS 334 7.802 28.045 0.869 211 HA LYS 334 HA LYS 334 8.115 30.805 1.826 212 HB2 LYS 334 2HB LYS 334 5.682 29.030 1.354 213 HB3 LYS 334 1HB LYS 334 5.572 30.606 2.146 214 HG2 LYS 334 2HG LYS 334 6.531 31.675 0.117 215 HG3 LYS 334 1HG LYS 334 6.575 30.101 -0.685 216 HD2 LYS 334 2HD LYS 334 4.166 29.948 -0.680 217 HD3 LYS 334 1HD LYS 334 4.013 31.348 0.386 218 HE2 LYS 334 2HE LYS 334 3.445 31.951 -1.915 219 HE3 LYS 334 1HE LYS 334 4.897 32.804 -1.402 220 HZ1 LYS 334 1HZ LYS 334 6.228 31.224 -2.643 221 HZ2 LYS 334 2HZ LYS 334 5.081 31.947 -3.653 222 HZ3 LYS 334 3HZ LYS 334 4.847 30.368 -3.098 223 H GLN 335 H GLN 335 8.525 27.748 3.082 224 HA GLN 335 HA GLN 335 7.433 28.228 5.733 225 HB2 GLN 335 2HB GLN 335 9.121 25.953 4.620 226 HB3 GLN 335 1HB GLN 335 8.583 26.039 6.295 227 HG2 GLN 335 2HG GLN 335 6.197 26.133 5.388 228 HG3 GLN 335 1HG GLN 335 6.872 25.740 3.810 229 HE21 GLN 335 1HE2 GLN 335 7.793 23.665 3.510 230 HE22 GLN 335 2HE2 GLN 335 7.469 22.355 4.568 231 H LEU 336 H LEU 336 8.463 29.912 6.703 232 HA LEU 336 HA LEU 336 11.330 30.092 7.041 233 HB2 LEU 336 2HB LEU 336 9.031 31.521 8.435 234 HB3 LEU 336 1HB LEU 336 10.731 31.931 8.634 235 HG LEU 336 HG LEU 336 9.203 32.119 6.012 236 HD11 LEU 336 1HD1 LEU 336 9.300 34.565 6.331 237 HD12 LEU 336 2HD1 LEU 336 10.015 34.335 7.930 238 HD13 LEU 336 3HD1 LEU 336 8.371 33.781 7.605 239 HD21 LEU 336 1HD2 LEU 336 11.168 33.380 5.213 240 HD22 LEU 336 2HD2 LEU 336 11.575 31.720 5.641 241 HD23 LEU 336 3HD2 LEU 336 11.999 33.044 6.734 242 H LEU 337 H LEU 337 12.469 29.058 8.560 243 HA LEU 337 HA LEU 337 11.094 27.402 10.563 244 HB2 LEU 337 2HB LEU 337 13.941 27.396 9.488 245 HB3 LEU 337 1HB LEU 337 13.500 26.488 10.924 246 HG LEU 337 HG LEU 337 11.842 25.190 9.552 247 HD11 LEU 337 1HD1 LEU 337 11.950 25.222 7.107 248 HD12 LEU 337 2HD1 LEU 337 13.074 26.582 7.160 249 HD13 LEU 337 3HD1 LEU 337 11.419 26.781 7.742 250 HD21 LEU 337 1HD2 LEU 337 14.072 24.267 10.022 251 HD22 LEU 337 2HD2 LEU 337 14.711 25.033 8.566 252 HD23 LEU 337 3HD2 LEU 337 13.496 23.760 8.432 253 H CYS 338 H CYS 338 10.857 28.071 12.549 254 HA CYS 338 HA CYS 338 12.292 30.332 13.698 255 HB2 CYS 338 2HB CYS 338 9.773 29.961 13.897 256 HB3 CYS 338 1HB CYS 338 10.129 28.623 14.990 257 H ASP 339 H ASP 339 13.791 30.170 15.337 258 HA ASP 339 HA ASP 339 15.405 27.861 15.415 259 HB2 ASP 339 2HB ASP 339 15.428 30.216 17.368 260 HB3 ASP 339 1HB ASP 339 16.754 29.090 17.083 261 H GLU 340 H GLU 340 13.564 29.326 18.088 262 HA GLU 340 HA GLU 340 14.097 27.158 19.910 263 HB2 GLU 340 2HB GLU 340 13.211 28.595 21.590 264 HB3 GLU 340 1HB GLU 340 14.010 29.660 20.446 265 HG2 GLU 340 2HG GLU 340 11.064 29.305 20.957 266 HG3 GLU 340 1HG GLU 340 12.036 30.764 21.094 267 H CYS 341 H CYS 341 11.433 27.989 17.818 268 HA CYS 341 HA CYS 341 9.543 26.103 18.968 269 HB2 CYS 341 2HB CYS 341 9.543 27.616 16.327 270 HB3 CYS 341 1HB CYS 341 8.290 26.454 16.751 271 H ASP 342 H ASP 342 12.141 26.039 16.678 272 HA ASP 342 HA ASP 342 13.147 24.498 15.406 273 HB2 ASP 342 2HB ASP 342 13.323 23.205 17.468 274 HB3 ASP 342 1HB ASP 342 11.673 22.644 17.322 275 H MET 343 H MET 343 10.305 25.444 14.784 276 HA MET 343 HA MET 343 9.452 23.335 12.884 277 HB2 MET 343 2HB MET 343 7.724 25.094 14.668 278 HB3 MET 343 1HB MET 343 7.071 24.283 13.248 279 HG2 MET 343 2HG MET 343 8.412 22.804 15.508 280 HG3 MET 343 1HG MET 343 6.686 23.137 15.461 281 HE1 MET 343 1HE MET 343 9.514 20.738 14.414 282 HE2 MET 343 2HE MET 343 9.472 21.585 12.866 283 HE3 MET 343 3HE MET 343 8.893 19.928 12.977 284 H ALA 344 H ALA 344 8.600 23.943 10.974 285 HA ALA 344 HA ALA 344 9.413 26.449 9.822 286 HB1 ALA 344 1HB ALA 344 8.427 25.475 7.761 287 HB2 ALA 344 2HB ALA 344 7.809 24.121 8.708 288 HB3 ALA 344 3HB ALA 344 9.551 24.368 8.551 289 H PHE 345 H PHE 345 7.903 27.925 8.753 290 HA PHE 345 HA PHE 345 5.063 27.877 9.524 291 HB2 PHE 345 2HB PHE 345 6.933 30.216 10.201 292 HB3 PHE 345 1HB PHE 345 5.178 30.302 10.259 293 HD1 PHE 345 HD1 PHE 345 8.166 28.805 11.920 294 HD2 PHE 345 HD2 PHE 345 3.961 29.513 12.154 295 HE1 PHE 345 HE1 PHE 345 8.172 28.127 14.282 296 HE2 PHE 345 HE2 PHE 345 3.978 28.832 14.517 297 HZ PHE 345 HZ PHE 345 6.085 28.133 15.584 298 H HIS 346 H HIS 346 4.050 28.193 7.546 299 HA HIS 346 HA HIS 346 5.259 29.303 5.236 300 HB2 HIS 346 2HB HIS 346 2.321 28.914 5.926 301 HB3 HIS 346 1HB HIS 346 2.850 29.521 4.366 302 HD2 HIS 346 HD2 HIS 346 4.698 27.613 3.047 303 HE1 HIS 346 HE1 HIS 346 2.608 24.379 4.791 304 HE2 HIS 346 HE2 HIS 346 4.121 25.094 2.895 305 H LEU 347 H LEU 347 5.033 31.313 4.224 306 HA LEU 347 HA LEU 347 5.198 33.642 5.702 307 HB2 LEU 347 2HB LEU 347 4.272 33.317 2.823 308 HB3 LEU 347 1HB LEU 347 4.754 34.844 3.544 309 HG LEU 347 HG LEU 347 6.567 32.447 3.048 310 HD11 LEU 347 1HD1 LEU 347 5.992 33.663 0.991 311 HD12 LEU 347 2HD1 LEU 347 7.690 33.880 1.409 312 HD13 LEU 347 3HD1 LEU 347 6.536 35.181 1.719 313 HD21 LEU 347 1HD2 LEU 347 7.264 35.139 4.268 314 HD22 LEU 347 2HD2 LEU 347 8.416 33.880 3.813 315 HD23 LEU 347 3HD2 LEU 347 7.253 33.580 5.100 316 H TYR 348 H TYR 348 2.313 32.272 4.127 317 HA TYR 348 HA TYR 348 0.557 34.417 4.966 318 HB2 TYR 348 2HB TYR 348 -1.242 33.024 3.865 319 HB3 TYR 348 1HB TYR 348 0.081 33.496 2.817 320 HD1 TYR 348 HD1 TYR 348 -1.757 30.673 4.202 321 HD2 TYR 348 HD2 TYR 348 1.828 31.764 2.146 322 HE1 TYR 348 HE1 TYR 348 -1.451 28.339 3.476 323 HE2 TYR 348 HE2 TYR 348 2.128 29.435 1.422 324 HH TYR 348 HH TYR 348 -0.279 27.109 1.594 325 H CYS 349 H CYS 349 1.653 31.506 6.401 326 HA CYS 349 HA CYS 349 -0.588 31.232 8.268 327 HB2 CYS 349 2HB CYS 349 2.122 29.828 8.174 328 HB3 CYS 349 1HB CYS 349 0.860 29.473 9.351 329 H LEU 350 H LEU 350 1.482 33.651 7.999 330 HA LEU 350 HA LEU 350 2.318 33.872 10.834 331 HB2 LEU 350 2HB LEU 350 3.334 35.334 8.356 332 HB3 LEU 350 1HB LEU 350 3.912 35.607 9.997 333 HG LEU 350 HG LEU 350 4.189 33.000 8.460 334 HD11 LEU 350 1HD1 LEU 350 6.296 35.081 9.102 335 HD12 LEU 350 2HD1 LEU 350 5.625 34.720 7.509 336 HD13 LEU 350 3HD1 LEU 350 6.585 33.508 8.352 337 HD21 LEU 350 1HD2 LEU 350 3.999 32.577 10.853 338 HD22 LEU 350 2HD2 LEU 350 5.258 33.765 11.193 339 HD23 LEU 350 3HD2 LEU 350 5.652 32.287 10.317 340 H LYS 351 H LYS 351 2.516 36.270 11.515 341 HA LYS 351 HA LYS 351 0.317 38.000 10.637 342 HB2 LYS 351 2HB LYS 351 -0.620 36.620 12.494 343 HB3 LYS 351 1HB LYS 351 0.710 37.107 13.535 344 HG2 LYS 351 2HG LYS 351 -1.305 38.355 14.100 345 HG3 LYS 351 1HG LYS 351 -0.072 39.446 13.465 346 HD2 LYS 351 2HD LYS 351 -2.233 40.060 12.523 347 HD3 LYS 351 1HD LYS 351 -1.220 39.399 11.237 348 HE2 LYS 351 2HE LYS 351 -3.500 38.543 11.044 349 HE3 LYS 351 1HE LYS 351 -2.403 37.226 11.455 350 HZ1 LYS 351 1HZ LYS 351 -4.387 37.074 12.771 351 HZ2 LYS 351 2HZ LYS 351 -4.207 38.662 13.329 352 HZ3 LYS 351 3HZ LYS 351 -3.093 37.475 13.783 353 HA PRO 352 HA PRO 352 0.478 39.748 9.572 354 HB2 PRO 352 2HB PRO 352 1.898 41.421 7.961 355 HB3 PRO 352 1HB PRO 352 1.064 42.011 9.408 356 HG2 PRO 352 2HG PRO 352 3.981 41.309 9.055 357 HG3 PRO 352 1HG PRO 352 3.266 42.741 9.830 358 HD2 PRO 352 2HD PRO 352 4.158 40.582 11.254 359 HD3 PRO 352 1HD PRO 352 2.812 41.601 11.809 360 HA PRO 353 HA PRO 353 2.179 36.613 6.736 361 HB2 PRO 353 2HB PRO 353 0.577 38.104 4.648 362 HB3 PRO 353 1HB PRO 353 0.605 36.372 5.025 363 HG2 PRO 353 2HG PRO 353 -1.448 37.862 5.820 364 HG3 PRO 353 1HG PRO 353 -0.778 36.628 6.909 365 HD2 PRO 353 2HD PRO 353 -0.355 39.621 6.948 366 HD3 PRO 353 1HD PRO 353 -0.639 38.501 8.304 367 H LEU 354 H LEU 354 4.233 36.772 6.038 368 HA LEU 354 HA LEU 354 5.345 39.289 5.100 369 HB2 LEU 354 2HB LEU 354 6.681 36.566 5.421 370 HB3 LEU 354 1HB LEU 354 7.510 38.083 5.082 371 HG LEU 354 HG LEU 354 6.021 37.367 7.634 372 HD11 LEU 354 1HD1 LEU 354 8.982 37.831 7.155 373 HD12 LEU 354 2HD1 LEU 354 8.195 36.285 7.478 374 HD13 LEU 354 3HD1 LEU 354 8.221 37.528 8.722 375 HD21 LEU 354 1HD2 LEU 354 7.377 39.997 6.939 376 HD22 LEU 354 2HD2 LEU 354 6.786 39.545 8.541 377 HD23 LEU 354 3HD2 LEU 354 5.650 39.729 7.210 378 H THR 355 H THR 355 6.238 39.670 3.087 379 HA THR 355 HA THR 355 5.023 38.161 0.876 380 HB THR 355 HB THR 355 4.692 40.575 0.817 381 HG1 THR 355 HG1 THR 355 5.499 39.202 -1.187 382 HG21 THR 355 1HG2 THR 355 7.719 40.856 0.716 383 HG22 THR 355 2HG2 THR 355 6.677 41.337 2.060 384 HG23 THR 355 3HG2 THR 355 6.556 42.166 0.506 385 H SER 356 H SER 356 8.038 38.461 2.454 386 HA SER 356 HA SER 356 9.382 36.714 0.543 387 HB2 SER 356 2HB SER 356 9.861 39.066 -0.249 388 HB3 SER 356 1HB SER 356 10.599 39.416 1.312 389 HG SER 356 HG SER 356 11.560 37.971 -0.828 390 H VAL 357 H VAL 357 11.523 35.999 1.436 391 HA VAL 357 HA VAL 357 11.450 35.335 4.208 392 HB VAL 357 HB VAL 357 12.463 33.752 2.682 393 HG11 VAL 357 1HG1 VAL 357 14.519 34.186 1.384 394 HG12 VAL 357 2HG1 VAL 357 14.519 35.864 1.935 395 HG13 VAL 357 3HG1 VAL 357 13.213 35.275 0.907 396 HG21 VAL 357 1HG2 VAL 357 14.678 34.945 4.390 397 HG22 VAL 357 2HG2 VAL 357 14.640 33.300 3.746 398 HG23 VAL 357 3HG2 VAL 357 13.449 33.808 4.945 399 HA PRO 358 HA PRO 358 13.295 39.231 5.720 400 HB2 PRO 358 2HB PRO 358 13.945 38.293 8.277 401 HB3 PRO 358 1HB PRO 358 12.347 38.888 7.806 402 HG2 PRO 358 2HG PRO 358 13.359 36.049 7.923 403 HG3 PRO 358 1HG PRO 358 11.814 36.711 8.503 404 HD2 PRO 358 2HD PRO 358 11.919 35.396 6.184 405 HD3 PRO 358 1HD PRO 358 10.913 36.854 6.328 406 HA PRO 359 HA PRO 359 17.627 38.485 4.847 407 HB2 PRO 359 2HB PRO 359 18.723 40.867 5.539 408 HB3 PRO 359 1HB PRO 359 17.583 40.726 4.192 409 HG2 PRO 359 2HG PRO 359 17.045 41.580 7.044 410 HG3 PRO 359 1HG PRO 359 16.560 42.382 5.532 411 HD2 PRO 359 2HD PRO 359 14.857 40.771 6.911 412 HD3 PRO 359 1HD PRO 359 14.819 40.873 5.136 413 H GLU 360 H GLU 360 16.533 38.195 7.895 414 HA GLU 360 HA GLU 360 19.026 38.463 9.373 415 HB2 GLU 360 2HB GLU 360 16.274 37.547 10.315 416 HB3 GLU 360 1HB GLU 360 17.647 37.945 11.349 417 HG2 GLU 360 2HG GLU 360 16.098 39.857 9.574 418 HG3 GLU 360 1HG GLU 360 16.021 39.762 11.333 419 HA PRO 361 HA PRO 361 19.912 33.994 8.996 420 HB2 PRO 361 2HB PRO 361 22.031 33.854 10.665 421 HB3 PRO 361 1HB PRO 361 22.144 34.694 9.110 422 HG2 PRO 361 2HG PRO 361 21.680 35.860 11.865 423 HG3 PRO 361 1HG PRO 361 22.828 36.385 10.613 424 HD2 PRO 361 2HD PRO 361 20.399 37.595 10.980 425 HD3 PRO 361 1HD PRO 361 21.188 37.490 9.389 426 H GLU 362 H GLU 362 18.653 35.620 11.664 427 HA GLU 362 HA GLU 362 17.978 33.123 13.121 428 HB2 GLU 362 2HB GLU 362 19.674 34.536 14.361 429 HB3 GLU 362 1HB GLU 362 18.554 35.889 14.319 430 HG2 GLU 362 2HG GLU 362 16.981 34.636 15.729 431 HG3 GLU 362 1HG GLU 362 18.077 33.250 15.743 432 H TRP 363 H TRP 363 15.743 32.980 13.627 433 HA TRP 363 HA TRP 363 14.016 35.293 13.100 434 HB2 TRP 363 2HB TRP 363 14.303 34.157 10.892 435 HB3 TRP 363 1HB TRP 363 13.678 32.663 11.586 436 HD1 TRP 363 HD1 TRP 363 12.495 36.271 10.768 437 HE1 TRP 363 HE1 TRP 363 9.960 36.210 10.353 438 HE3 TRP 363 HE3 TRP 363 11.570 31.385 11.972 439 HZ2 TRP 363 HZ2 TRP 363 7.853 34.366 10.528 440 HZ3 TRP 363 HZ3 TRP 363 9.256 30.555 11.839 441 HH2 TRP 363 HH2 TRP 363 7.435 32.021 11.136 442 H TYR 364 H TYR 364 12.942 35.394 14.929 443 HA TYR 364 HA TYR 364 11.652 33.049 16.139 444 HB2 TYR 364 2HB TYR 364 11.616 35.958 17.095 445 HB3 TYR 364 1HB TYR 364 11.098 34.544 18.009 446 HD1 TYR 364 HD1 TYR 364 12.834 32.952 18.958 447 HD2 TYR 364 HD2 TYR 364 13.983 36.563 16.954 448 HE1 TYR 364 HE1 TYR 364 15.084 32.755 19.889 449 HE2 TYR 364 HE2 TYR 364 16.247 36.342 17.893 450 HH TYR 364 HH TYR 364 17.502 33.648 19.126 451 H CYS 365 H CYS 365 9.500 32.689 15.773 452 HA CYS 365 HA CYS 365 8.123 34.052 13.676 453 HB2 CYS 365 2HB CYS 365 6.328 32.423 14.037 454 HB3 CYS 365 1HB CYS 365 7.885 31.603 14.107 455 HA PRO 366 HA PRO 366 5.581 37.227 15.673 456 HB2 PRO 366 2HB PRO 366 2.989 36.276 14.871 457 HB3 PRO 366 1HB PRO 366 3.986 37.494 14.071 458 HG2 PRO 366 2HG PRO 366 3.742 34.558 13.497 459 HG3 PRO 366 1HG PRO 366 3.969 35.913 12.372 460 HD2 PRO 366 2HD PRO 366 6.004 34.306 12.948 461 HD3 PRO 366 1HD PRO 366 6.279 36.062 12.827 462 H SER 367 H SER 367 4.366 33.903 16.027 463 HA SER 367 HA SER 367 2.796 34.138 18.311 464 HB2 SER 367 2HB SER 367 2.875 32.128 16.899 465 HB3 SER 367 1HB SER 367 4.521 31.794 17.408 466 HG SER 367 HG SER 367 2.331 30.938 18.530 467 H CYS 368 H CYS 368 6.315 33.808 18.035 468 HA CYS 368 HA CYS 368 6.879 33.461 20.808 469 HB2 CYS 368 2HB CYS 368 8.550 34.112 18.379 470 HB3 CYS 368 1HB CYS 368 9.260 34.252 19.990 471 H ARG 369 H ARG 369 6.740 36.354 18.704 472 HA ARG 369 HA ARG 369 7.524 38.116 20.904 473 HB2 ARG 369 2HB ARG 369 7.473 39.940 19.323 474 HB3 ARG 369 1HB ARG 369 8.329 38.593 18.583 475 HG2 ARG 369 2HG ARG 369 6.470 38.102 17.133 476 HG3 ARG 369 1HG ARG 369 5.408 39.207 18.009 477 HD2 ARG 369 2HD ARG 369 7.826 39.980 16.337 478 HD3 ARG 369 1HD ARG 369 6.130 40.217 15.893 479 HE ARG 369 HE ARG 369 7.682 41.701 17.893 480 HH11 ARG 369 1HH1 ARG 369 4.588 41.311 16.280 481 HH12 ARG 369 2HH1 ARG 369 3.955 42.811 16.873 482 HH21 ARG 369 1HH2 ARG 369 6.836 43.656 18.674 483 HH22 ARG 369 2HH2 ARG 369 5.232 44.145 18.215 484 H THR 370 H THR 370 4.629 36.694 19.949 485 HA THR 370 HA THR 370 2.723 38.710 20.548 486 HB THR 370 HB THR 370 2.539 35.668 20.786 487 HG1 THR 370 HG1 THR 370 2.641 37.267 18.673 488 HG21 THR 370 1HG2 THR 370 0.082 35.934 20.635 489 HG22 THR 370 2HG2 THR 370 0.265 37.685 20.753 490 HG23 THR 370 3HG2 THR 370 0.720 36.659 22.116 491 H ASP 371 H ASP 371 1.717 39.283 22.479 492 HA ASP 371 HA ASP 371 3.222 39.217 24.880 493 HB2 ASP 371 2HB ASP 371 1.698 41.071 24.391 494 HB3 ASP 371 1HB ASP 371 0.321 39.980 24.327 495 H SER 372 H SER 372 0.428 37.349 23.793 496 HA SER 372 HA SER 372 0.341 35.677 26.190 497 HB2 SER 372 2HB SER 372 -1.262 35.580 23.591 498 HB3 SER 372 1HB SER 372 -1.604 34.632 25.041 499 HG SER 372 HG SER 372 -2.213 36.446 26.108 500 H SER 373 H SER 373 2.814 35.342 25.341 501 HA SER 373 HA SER 373 3.207 33.385 23.271 502 HB2 SER 373 2HB SER 373 5.599 33.425 24.086 503 HB3 SER 373 1HB SER 373 4.957 35.022 23.703 504 HG SER 373 HG SER 373 5.315 33.861 26.272 505 H GLU 374 H GLU 374 2.614 31.322 23.529 506 HA GLU 374 HA GLU 374 2.401 29.941 26.031 507 HB2 GLU 374 2HB GLU 374 1.845 27.955 24.653 508 HB3 GLU 374 1HB GLU 374 0.921 29.367 24.156 509 HG2 GLU 374 2HG GLU 374 2.451 29.689 22.242 510 HG3 GLU 374 1HG GLU 374 3.371 28.271 22.748 511 H VAL 375 H VAL 375 3.487 27.726 26.274 512 HA VAL 375 HA VAL 375 6.247 28.060 26.643 513 HB VAL 375 HB VAL 375 5.019 26.576 28.086 514 HG11 VAL 375 1HG1 VAL 375 3.290 25.751 26.556 515 HG12 VAL 375 2HG1 VAL 375 4.071 24.405 27.387 516 HG13 VAL 375 3HG1 VAL 375 4.482 24.761 25.707 517 HG21 VAL 375 1HG2 VAL 375 7.413 26.055 27.805 518 HG22 VAL 375 2HG2 VAL 375 7.030 24.933 26.497 519 HG23 VAL 375 3HG2 VAL 375 6.484 24.592 28.140 520 H VAL 376 H VAL 376 7.848 28.035 25.224 521 HA VAL 376 HA VAL 376 7.742 26.366 22.777 522 HB VAL 376 HB VAL 376 9.427 27.913 21.796 523 HG11 VAL 376 1HG1 VAL 376 7.922 29.824 21.368 524 HG12 VAL 376 2HG1 VAL 376 6.912 29.349 22.735 525 HG13 VAL 376 3HG1 VAL 376 7.038 28.296 21.325 526 HG21 VAL 376 1HG2 VAL 376 10.508 28.745 23.854 527 HG22 VAL 376 2HG2 VAL 376 9.036 29.607 24.305 528 HG23 VAL 376 3HG2 VAL 376 9.939 30.095 22.868 529 H GLN 377 H GLN 377 9.828 25.415 22.096 530 HA GLN 377 HA GLN 377 11.296 24.244 24.333 531 HB2 GLN 377 2HB GLN 377 10.473 22.842 22.453 532 HB3 GLN 377 1HB GLN 377 11.448 23.767 21.321 533 HG2 GLN 377 2HG GLN 377 13.502 22.910 22.361 534 HG3 GLN 377 1HG GLN 377 12.553 22.014 23.547 535 HE21 GLN 377 1HE2 GLN 377 11.437 20.137 22.882 536 HE22 GLN 377 2HE2 GLN 377 11.774 19.354 21.379 537 H ALA 378 H ALA 378 12.090 26.489 24.836 538 HA ALA 378 HA ALA 378 14.255 27.557 23.196 539 HB1 ALA 378 1HB ALA 378 14.224 29.449 24.766 540 HB2 ALA 378 2HB ALA 378 13.065 28.600 25.795 541 HB3 ALA 378 3HB ALA 378 12.599 29.108 24.169 542 H GLY 379 H GLY 379 16.357 28.070 24.177 543 HA2 GLY 379 2HA GLY 379 18.203 27.585 25.558 544 HA3 GLY 379 1HA GLY 379 17.267 26.358 26.403 545 H GLU 380 H GLU 380 16.766 25.947 23.151 546 HA GLU 380 HA GLU 380 18.423 23.612 22.906 547 HB2 GLU 380 2HB GLU 380 16.188 23.621 21.925 548 HB3 GLU 380 1HB GLU 380 16.555 25.042 20.963 549 HG2 GLU 380 2HG GLU 380 16.501 22.969 19.629 550 HG3 GLU 380 1HG GLU 380 18.064 23.781 19.553 Start of MODEL 20 1 H1 SER 303 H SER 303 11.331 6.102 5.475 2 HA SER 303 HA SER 303 13.209 7.386 3.730 3 HB2 SER 303 2HB SER 303 10.225 7.975 3.974 4 HB3 SER 303 1HB SER 303 11.263 8.262 2.571 5 HG SER 303 HG SER 303 10.201 5.865 3.567 6 H GLY 304 H GLY 304 10.917 8.599 6.180 7 HA2 GLY 304 2HA GLY 304 12.148 11.280 6.145 8 HA3 GLY 304 1HA GLY 304 10.604 10.839 6.857 9 HA PRO 305 HA PRO 305 13.920 11.110 10.270 10 HB2 PRO 305 2HB PRO 305 12.084 13.250 11.284 11 HB3 PRO 305 1HB PRO 305 13.850 13.233 11.199 12 HG2 PRO 305 2HG PRO 305 12.414 14.739 9.502 13 HG3 PRO 305 1HG PRO 305 13.880 13.897 8.958 14 HD2 PRO 305 2HD PRO 305 10.991 13.115 8.551 15 HD3 PRO 305 1HD PRO 305 12.344 13.079 7.394 16 H SER 306 H SER 306 13.565 10.539 12.495 17 HA SER 306 HA SER 306 11.603 8.593 12.973 18 HB2 SER 306 2HB SER 306 13.294 10.110 15.009 19 HB3 SER 306 1HB SER 306 12.488 8.563 15.277 20 HG SER 306 HG SER 306 13.919 8.214 13.123 21 H CYS 307 H CYS 307 9.519 9.170 12.871 22 HA CYS 307 HA CYS 307 8.309 10.860 14.881 23 HB2 CYS 307 2HB CYS 307 8.779 12.623 13.341 24 HB3 CYS 307 1HB CYS 307 8.325 11.651 11.952 25 H ARG 308 H ARG 308 7.085 9.202 15.591 26 HA ARG 308 HA ARG 308 5.848 7.231 13.958 27 HB2 ARG 308 2HB ARG 308 4.665 6.573 16.127 28 HB3 ARG 308 1HB ARG 308 6.415 6.540 16.142 29 HG2 ARG 308 2HG ARG 308 5.762 7.415 18.243 30 HG3 ARG 308 1HG ARG 308 6.360 8.785 17.320 31 HD2 ARG 308 2HD ARG 308 4.364 9.388 18.619 32 HD3 ARG 308 1HD ARG 308 4.051 9.522 16.889 33 HE ARG 308 HE ARG 308 3.070 7.129 17.255 34 HH11 ARG 308 1HH1 ARG 308 2.728 9.807 19.508 35 HH12 ARG 308 2HH1 ARG 308 1.162 9.292 20.050 36 HH21 ARG 308 1HH2 ARG 308 1.025 6.475 17.994 37 HH22 ARG 308 2HH2 ARG 308 0.214 7.407 19.212 38 H PHE 309 H PHE 309 4.859 10.385 14.654 39 HA PHE 309 HA PHE 309 2.042 10.198 14.731 40 HB2 PHE 309 2HB PHE 309 3.784 12.523 13.793 41 HB3 PHE 309 1HB PHE 309 2.084 12.637 14.243 42 HD1 PHE 309 HD1 PHE 309 1.393 12.476 16.603 43 HD2 PHE 309 HD2 PHE 309 5.524 12.278 15.511 44 HE1 PHE 309 HE1 PHE 309 2.036 12.875 18.944 45 HE2 PHE 309 HE2 PHE 309 6.156 12.679 17.857 46 HZ PHE 309 HZ PHE 309 4.413 12.971 19.573 47 H CYS 310 H CYS 310 4.311 10.211 12.061 48 HA CYS 310 HA CYS 310 2.079 9.667 10.170 49 HB2 CYS 310 2HB CYS 310 3.440 10.725 8.357 50 HB3 CYS 310 1HB CYS 310 3.006 11.866 9.623 51 H LYS 311 H LYS 311 4.483 8.283 11.836 52 HA LYS 311 HA LYS 311 6.129 6.758 11.623 53 HB2 LYS 311 2HB LYS 311 4.073 5.513 9.769 54 HB3 LYS 311 1HB LYS 311 5.480 4.657 10.390 55 HG2 LYS 311 2HG LYS 311 4.607 5.090 12.722 56 HG3 LYS 311 1HG LYS 311 3.142 5.750 11.997 57 HD2 LYS 311 2HD LYS 311 2.743 3.440 12.643 58 HD3 LYS 311 1HD LYS 311 2.738 3.555 10.882 59 HE2 LYS 311 2HE LYS 311 5.064 2.675 10.832 60 HE3 LYS 311 1HE LYS 311 5.050 2.572 12.593 61 HZ1 LYS 311 1HZ LYS 311 4.607 0.432 11.642 62 HZ2 LYS 311 2HZ LYS 311 3.328 1.045 10.722 63 HZ3 LYS 311 3HZ LYS 311 3.198 0.983 12.408 64 H ASP 312 H ASP 312 7.006 8.752 10.437 65 HA ASP 312 HA ASP 312 8.519 9.656 9.105 66 HB2 ASP 312 2HB ASP 312 10.287 8.406 8.265 67 HB3 ASP 312 1HB ASP 312 9.618 7.328 9.475 68 H ASP 313 H ASP 313 5.739 8.415 7.724 69 HA ASP 313 HA ASP 313 6.331 8.245 4.986 70 HB2 ASP 313 2HB ASP 313 4.215 7.357 5.957 71 HB3 ASP 313 1HB ASP 313 3.654 9.004 6.216 72 H GLU 314 H GLU 314 6.444 9.632 3.396 73 HA GLU 314 HA GLU 314 7.041 12.394 3.983 74 HB2 GLU 314 2HB GLU 314 7.938 12.407 1.674 75 HB3 GLU 314 1HB GLU 314 8.537 11.028 2.596 76 HG2 GLU 314 2HG GLU 314 6.681 9.652 1.480 77 HG3 GLU 314 1HG GLU 314 6.433 11.027 0.405 78 H ASN 315 H ASN 315 4.200 10.801 2.950 79 HA ASN 315 HA ASN 315 3.405 12.849 0.976 80 HB2 ASN 315 2HB ASN 315 2.003 10.235 1.699 81 HB3 ASN 315 1HB ASN 315 1.614 11.288 0.336 82 HD21 ASN 315 1HD2 ASN 315 3.856 8.956 1.616 83 HD22 ASN 315 2HD2 ASN 315 4.695 8.650 0.137 84 H LYS 316 H LYS 316 2.276 11.366 4.003 85 HA LYS 316 HA LYS 316 -0.189 12.800 4.075 86 HB2 LYS 316 2HB LYS 316 1.167 11.220 6.292 87 HB3 LYS 316 1HB LYS 316 -0.491 11.816 6.334 88 HG2 LYS 316 2HG LYS 316 0.650 9.706 4.468 89 HG3 LYS 316 1HG LYS 316 -0.512 9.461 5.778 90 HD2 LYS 316 2HD LYS 316 -2.193 10.782 4.556 91 HD3 LYS 316 1HD LYS 316 -1.029 11.114 3.270 92 HE2 LYS 316 2HE LYS 316 -2.553 9.347 2.572 93 HE3 LYS 316 1HE LYS 316 -0.929 8.682 2.761 94 HZ1 LYS 316 1HZ LYS 316 -1.553 7.736 4.857 95 HZ2 LYS 316 2HZ LYS 316 -2.703 7.273 3.704 96 HZ3 LYS 316 3HZ LYS 316 -3.066 8.494 4.812 97 HA PRO 317 HA PRO 317 1.290 16.803 5.651 98 HB2 PRO 317 2HB PRO 317 -1.609 16.892 6.504 99 HB3 PRO 317 1HB PRO 317 -0.638 18.134 5.695 100 HG2 PRO 317 2HG PRO 317 -2.378 16.711 4.287 101 HG3 PRO 317 1HG PRO 317 -0.773 17.059 3.606 102 HD2 PRO 317 2HD PRO 317 -1.800 14.509 4.837 103 HD3 PRO 317 1HD PRO 317 -0.751 14.730 3.420 104 H CYS 318 H CYS 318 2.148 17.316 7.606 105 HA CYS 318 HA CYS 318 1.306 15.859 10.018 106 HB2 CYS 318 2HB CYS 318 2.963 14.433 8.839 107 HB3 CYS 318 1HB CYS 318 4.131 15.751 8.887 108 H ARG 319 H ARG 319 1.068 17.344 11.483 109 HA ARG 319 HA ARG 319 2.171 19.939 11.610 110 HB2 ARG 319 2HB ARG 319 0.024 19.116 12.678 111 HB3 ARG 319 1HB ARG 319 0.983 18.224 13.850 112 HG2 ARG 319 2HG ARG 319 1.859 20.337 14.761 113 HG3 ARG 319 1HG ARG 319 0.961 21.246 13.543 114 HD2 ARG 319 2HD ARG 319 -1.167 20.275 14.492 115 HD3 ARG 319 1HD ARG 319 -0.197 19.556 15.784 116 HE ARG 319 HE ARG 319 0.048 22.444 15.462 117 HH11 ARG 319 1HH1 ARG 319 -1.523 19.826 17.240 118 HH12 ARG 319 2HH1 ARG 319 -2.108 20.891 18.480 119 HH21 ARG 319 1HH2 ARG 319 -0.737 23.796 17.097 120 HH22 ARG 319 2HH2 ARG 319 -1.657 23.124 18.403 121 H LYS 320 H LYS 320 3.303 16.833 12.660 122 HA LYS 320 HA LYS 320 5.430 17.893 14.392 123 HB2 LYS 320 2HB LYS 320 4.485 15.037 13.922 124 HB3 LYS 320 1HB LYS 320 5.698 15.523 15.103 125 HG2 LYS 320 2HG LYS 320 2.826 16.535 15.183 126 HG3 LYS 320 1HG LYS 320 3.334 15.052 15.979 127 HD2 LYS 320 2HD LYS 320 3.357 16.673 17.699 128 HD3 LYS 320 1HD LYS 320 5.050 16.487 17.255 129 HE2 LYS 320 2HE LYS 320 4.902 18.570 15.905 130 HE3 LYS 320 1HE LYS 320 3.215 18.756 16.389 131 HZ1 LYS 320 1HZ LYS 320 4.855 20.077 17.684 132 HZ2 LYS 320 2HZ LYS 320 5.467 18.629 18.307 133 HZ3 LYS 320 3HZ LYS 320 3.867 19.078 18.620 134 H CYS 321 H CYS 321 5.368 17.856 11.268 135 HA CYS 321 HA CYS 321 8.236 17.187 11.074 136 HB2 CYS 321 2HB CYS 321 6.102 16.288 9.118 137 HB3 CYS 321 1HB CYS 321 7.768 16.514 8.593 138 H ALA 322 H ALA 322 5.549 18.642 9.241 139 HA ALA 322 HA ALA 322 7.367 20.639 8.068 140 HB1 ALA 322 1HB ALA 322 6.084 19.205 6.532 141 HB2 ALA 322 2HB ALA 322 5.603 20.895 6.370 142 HB3 ALA 322 3HB ALA 322 4.573 19.766 7.252 143 H CYS 323 H CYS 323 5.433 22.534 7.334 144 HA CYS 323 HA CYS 323 5.352 24.318 9.439 145 HB2 CYS 323 2HB CYS 323 5.090 25.151 7.234 146 HB3 CYS 323 1HB CYS 323 3.694 24.122 6.924 147 H HIS 324 H HIS 324 4.407 24.010 11.352 148 HA HIS 324 HA HIS 324 2.449 22.005 11.794 149 HB2 HIS 324 2HB HIS 324 2.736 22.483 14.146 150 HB3 HIS 324 1HB HIS 324 4.313 22.559 13.380 151 HD1 HIS 324 HD1 HIS 324 2.660 24.194 15.953 152 HD2 HIS 324 HD2 HIS 324 4.675 25.597 12.594 153 HE1 HIS 324 HE1 HIS 324 3.350 26.565 16.473 154 H VAL 325 H VAL 325 2.198 25.348 11.147 155 HA VAL 325 HA VAL 325 -0.098 26.101 12.588 156 HB VAL 325 HB VAL 325 0.826 27.294 9.934 157 HG11 VAL 325 1HG1 VAL 325 -0.167 29.407 10.765 158 HG12 VAL 325 2HG1 VAL 325 -0.730 28.574 12.217 159 HG13 VAL 325 3HG1 VAL 325 -1.381 28.129 10.639 160 HG21 VAL 325 1HG2 VAL 325 2.733 27.162 11.455 161 HG22 VAL 325 2HG2 VAL 325 1.806 27.949 12.735 162 HG23 VAL 325 3HG2 VAL 325 2.224 28.843 11.270 163 H CYS 326 H CYS 326 0.265 24.998 9.216 164 HA CYS 326 HA CYS 326 -2.654 24.509 9.013 165 HB2 CYS 326 2HB CYS 326 -2.293 24.439 6.557 166 HB3 CYS 326 1HB CYS 326 -1.750 25.967 7.231 167 H GLY 327 H GLY 327 0.045 22.893 9.925 168 HA2 GLY 327 2HA GLY 327 0.817 20.728 9.916 169 HA3 GLY 327 1HA GLY 327 -0.805 20.244 9.427 170 H GLY 328 H GLY 328 0.864 22.476 7.401 171 HA2 GLY 328 2HA GLY 328 0.441 20.604 5.185 172 HA3 GLY 328 1HA GLY 328 0.598 22.352 5.077 173 H ARG 329 H ARG 329 2.000 19.793 4.005 174 HA ARG 329 HA ARG 329 4.829 20.456 4.440 175 HB2 ARG 329 2HB ARG 329 3.693 18.237 2.692 176 HB3 ARG 329 1HB ARG 329 5.302 18.333 3.416 177 HG2 ARG 329 2HG ARG 329 4.240 18.090 5.672 178 HG3 ARG 329 1HG ARG 329 2.674 17.897 4.883 179 HD2 ARG 329 2HD ARG 329 3.448 15.718 5.431 180 HD3 ARG 329 1HD ARG 329 3.646 15.894 3.682 181 HE ARG 329 HE ARG 329 6.056 16.567 4.371 182 HH11 ARG 329 1HH1 ARG 329 4.116 14.090 5.899 183 HH12 ARG 329 2HH1 ARG 329 5.486 13.114 6.325 184 HH21 ARG 329 1HH2 ARG 329 7.834 15.313 4.950 185 HH22 ARG 329 2HH2 ARG 329 7.601 13.825 5.801 186 H GLU 330 H GLU 330 2.354 21.438 2.527 187 HA GLU 330 HA GLU 330 3.351 21.765 -0.076 188 HB2 GLU 330 2HB GLU 330 1.638 23.635 -0.170 189 HB3 GLU 330 1HB GLU 330 1.001 22.109 0.442 190 HG2 GLU 330 2HG GLU 330 1.217 22.944 2.760 191 HG3 GLU 330 1HG GLU 330 1.854 24.468 2.149 192 H ALA 331 H ALA 331 3.810 23.954 -1.039 193 HA ALA 331 HA ALA 331 5.450 25.475 -1.456 194 HB1 ALA 331 1HB ALA 331 5.039 27.572 -0.269 195 HB2 ALA 331 2HB ALA 331 4.144 26.703 0.982 196 HB3 ALA 331 3HB ALA 331 3.526 26.758 -0.669 197 HA PRO 332 HA PRO 332 8.483 23.895 1.825 198 HB2 PRO 332 2HB PRO 332 10.394 22.964 0.039 199 HB3 PRO 332 1HB PRO 332 9.047 21.986 0.637 200 HG2 PRO 332 2HG PRO 332 9.298 23.495 -1.959 201 HG3 PRO 332 1HG PRO 332 8.669 21.858 -1.675 202 HD2 PRO 332 2HD PRO 332 7.024 23.975 -2.035 203 HD3 PRO 332 1HD PRO 332 6.599 22.650 -0.927 204 H GLU 333 H GLU 333 8.879 25.852 -1.042 205 HA GLU 333 HA GLU 333 11.275 27.235 -0.401 206 HB2 GLU 333 2HB GLU 333 10.473 28.897 -2.105 207 HB3 GLU 333 1HB GLU 333 10.442 27.235 -2.685 208 HG2 GLU 333 2HG GLU 333 8.029 27.110 -2.392 209 HG3 GLU 333 1HG GLU 333 7.999 28.695 -1.623 210 H LYS 334 H LYS 334 7.859 27.825 0.392 211 HA LYS 334 HA LYS 334 8.467 30.421 1.622 212 HB2 LYS 334 2HB LYS 334 5.815 29.029 1.058 213 HB3 LYS 334 1HB LYS 334 5.953 30.587 1.875 214 HG2 LYS 334 2HG LYS 334 7.088 31.505 -0.149 215 HG3 LYS 334 1HG LYS 334 6.815 29.967 -0.975 216 HD2 LYS 334 2HD LYS 334 4.399 30.276 -0.835 217 HD3 LYS 334 1HD LYS 334 4.600 31.725 0.153 218 HE2 LYS 334 2HE LYS 334 4.050 32.289 -2.178 219 HE3 LYS 334 1HE LYS 334 5.646 32.889 -1.735 220 HZ1 LYS 334 1HZ LYS 334 5.085 30.440 -3.316 221 HZ2 LYS 334 2HZ LYS 334 6.623 30.987 -2.888 222 HZ3 LYS 334 3HZ LYS 334 5.660 31.909 -3.925 223 H GLN 335 H GLN 335 8.609 27.279 2.623 224 HA GLN 335 HA GLN 335 7.519 27.582 5.260 225 HB2 GLN 335 2HB GLN 335 9.235 25.418 4.013 226 HB3 GLN 335 1HB GLN 335 8.909 25.431 5.745 227 HG2 GLN 335 2HG GLN 335 6.429 25.479 5.155 228 HG3 GLN 335 1HG GLN 335 6.900 25.155 3.491 229 HE21 GLN 335 1HE2 GLN 335 9.061 23.313 4.197 230 HE22 GLN 335 2HE2 GLN 335 8.298 21.871 4.760 231 H LEU 336 H LEU 336 8.366 28.537 6.922 232 HA LEU 336 HA LEU 336 11.271 29.116 7.067 233 HB2 LEU 336 2HB LEU 336 8.929 30.938 7.714 234 HB3 LEU 336 1HB LEU 336 10.552 31.251 8.311 235 HG LEU 336 HG LEU 336 9.799 31.107 5.366 236 HD11 LEU 336 1HD1 LEU 336 10.357 33.558 7.069 237 HD12 LEU 336 2HD1 LEU 336 8.792 33.082 6.406 238 HD13 LEU 336 3HD1 LEU 336 10.099 33.541 5.320 239 HD21 LEU 336 1HD2 LEU 336 12.135 30.457 5.745 240 HD22 LEU 336 2HD2 LEU 336 12.414 31.929 6.683 241 HD23 LEU 336 3HD2 LEU 336 12.050 32.031 4.958 242 H LEU 337 H LEU 337 12.138 28.134 8.733 243 HA LEU 337 HA LEU 337 10.521 27.102 10.930 244 HB2 LEU 337 2HB LEU 337 13.447 26.657 10.183 245 HB3 LEU 337 1HB LEU 337 12.713 26.001 11.639 246 HG LEU 337 HG LEU 337 11.076 24.746 10.150 247 HD11 LEU 337 1HD1 LEU 337 11.660 24.377 7.790 248 HD12 LEU 337 2HD1 LEU 337 12.941 25.585 7.914 249 HD13 LEU 337 3HD1 LEU 337 11.252 26.063 8.105 250 HD21 LEU 337 1HD2 LEU 337 12.970 23.598 11.183 251 HD22 LEU 337 2HD2 LEU 337 14.018 24.055 9.839 252 HD23 LEU 337 3HD2 LEU 337 12.668 22.947 9.573 253 H CYS 338 H CYS 338 10.158 28.407 12.617 254 HA CYS 338 HA CYS 338 11.826 30.497 13.541 255 HB2 CYS 338 2HB CYS 338 9.440 30.325 14.217 256 HB3 CYS 338 1HB CYS 338 9.818 28.870 15.152 257 H ASP 339 H ASP 339 13.877 30.066 14.003 258 HA ASP 339 HA ASP 339 15.159 27.831 14.888 259 HB2 ASP 339 2HB ASP 339 16.316 29.863 14.116 260 HB3 ASP 339 1HB ASP 339 15.793 30.744 15.547 261 H GLU 340 H GLU 340 13.687 30.356 16.906 262 HA GLU 340 HA GLU 340 14.371 29.503 19.464 263 HB2 GLU 340 2HB GLU 340 13.330 31.692 18.906 264 HB3 GLU 340 1HB GLU 340 11.820 30.875 18.537 265 HG2 GLU 340 2HG GLU 340 11.592 31.881 20.686 266 HG3 GLU 340 1HG GLU 340 11.670 30.137 20.921 267 H CYS 341 H CYS 341 11.545 28.550 17.474 268 HA CYS 341 HA CYS 341 10.524 26.817 19.633 269 HB2 CYS 341 2HB CYS 341 9.168 27.801 17.094 270 HB3 CYS 341 1HB CYS 341 8.402 26.816 18.341 271 H ASP 342 H ASP 342 12.426 26.484 16.922 272 HA ASP 342 HA ASP 342 13.025 24.896 15.445 273 HB2 ASP 342 2HB ASP 342 11.869 22.954 17.496 274 HB3 ASP 342 1HB ASP 342 13.017 22.534 16.231 275 H MET 343 H MET 343 10.235 25.955 15.250 276 HA MET 343 HA MET 343 8.752 23.725 13.986 277 HB2 MET 343 2HB MET 343 7.795 26.169 15.503 278 HB3 MET 343 1HB MET 343 6.718 25.307 14.412 279 HG2 MET 343 2HG MET 343 8.096 24.030 16.785 280 HG3 MET 343 1HG MET 343 6.465 24.695 16.799 281 HE1 MET 343 1HE MET 343 7.704 20.638 15.044 282 HE2 MET 343 2HE MET 343 8.454 21.487 16.392 283 HE3 MET 343 3HE MET 343 8.716 22.049 14.740 284 H ALA 344 H ALA 344 7.983 23.949 11.970 285 HA ALA 344 HA ALA 344 9.036 26.079 10.294 286 HB1 ALA 344 1HB ALA 344 7.493 23.579 9.534 287 HB2 ALA 344 2HB ALA 344 9.248 23.747 9.541 288 HB3 ALA 344 3HB ALA 344 8.279 24.692 8.410 289 H PHE 345 H PHE 345 7.778 27.387 8.949 290 HA PHE 345 HA PHE 345 4.883 27.653 9.520 291 HB2 PHE 345 2HB PHE 345 7.014 29.833 9.604 292 HB3 PHE 345 1HB PHE 345 5.314 30.215 9.342 293 HD1 PHE 345 HD1 PHE 345 7.637 28.560 11.768 294 HD2 PHE 345 HD2 PHE 345 3.860 30.462 11.165 295 HE1 PHE 345 HE1 PHE 345 7.227 28.536 14.186 296 HE2 PHE 345 HE2 PHE 345 3.462 30.434 13.590 297 HZ PHE 345 HZ PHE 345 5.134 29.466 15.094 298 H HIS 346 H HIS 346 4.141 29.553 7.887 299 HA HIS 346 HA HIS 346 5.542 29.376 5.300 300 HB2 HIS 346 2HB HIS 346 2.564 29.053 5.791 301 HB3 HIS 346 1HB HIS 346 3.116 29.774 4.289 302 HD2 HIS 346 HD2 HIS 346 5.346 27.916 3.253 303 HE1 HIS 346 HE1 HIS 346 2.728 24.699 4.022 304 HE2 HIS 346 HE2 HIS 346 4.739 25.491 2.711 305 H LEU 347 H LEU 347 5.446 31.337 4.083 306 HA LEU 347 HA LEU 347 5.480 33.799 5.341 307 HB2 LEU 347 2HB LEU 347 4.783 33.104 2.462 308 HB3 LEU 347 1HB LEU 347 5.015 34.757 3.008 309 HG LEU 347 HG LEU 347 7.149 32.580 3.044 310 HD11 LEU 347 1HD1 LEU 347 6.639 33.325 0.758 311 HD12 LEU 347 2HD1 LEU 347 8.241 33.864 1.256 312 HD13 LEU 347 3HD1 LEU 347 6.895 35.008 1.233 313 HD21 LEU 347 1HD2 LEU 347 7.456 34.163 4.897 314 HD22 LEU 347 2HD2 LEU 347 7.370 35.523 3.774 315 HD23 LEU 347 3HD2 LEU 347 8.709 34.378 3.677 316 H TYR 348 H TYR 348 2.740 32.021 4.124 317 HA TYR 348 HA TYR 348 0.856 34.232 4.599 318 HB2 TYR 348 2HB TYR 348 -0.712 32.829 3.171 319 HB3 TYR 348 1HB TYR 348 0.716 33.424 2.344 320 HD1 TYR 348 HD1 TYR 348 2.670 31.790 1.928 321 HD2 TYR 348 HD2 TYR 348 -1.190 30.466 3.212 322 HE1 TYR 348 HE1 TYR 348 3.188 29.511 1.146 323 HE2 TYR 348 HE2 TYR 348 -0.664 28.197 2.424 324 HH TYR 348 HH TYR 348 0.814 27.035 0.915 325 H CYS 349 H CYS 349 2.035 31.728 6.365 326 HA CYS 349 HA CYS 349 -0.522 31.121 7.744 327 HB2 CYS 349 2HB CYS 349 2.177 29.727 7.818 328 HB3 CYS 349 1HB CYS 349 0.882 29.364 8.955 329 H LEU 350 H LEU 350 1.220 33.598 7.882 330 HA LEU 350 HA LEU 350 1.901 33.639 10.761 331 HB2 LEU 350 2HB LEU 350 2.828 35.462 8.504 332 HB3 LEU 350 1HB LEU 350 3.321 35.600 10.187 333 HG LEU 350 HG LEU 350 3.897 33.198 8.419 334 HD11 LEU 350 1HD1 LEU 350 5.111 35.134 7.595 335 HD12 LEU 350 2HD1 LEU 350 6.210 33.975 8.336 336 HD13 LEU 350 3HD1 LEU 350 5.761 35.443 9.209 337 HD21 LEU 350 1HD2 LEU 350 4.931 33.885 11.186 338 HD22 LEU 350 2HD2 LEU 350 5.425 32.502 10.208 339 HD23 LEU 350 3HD2 LEU 350 3.770 32.614 10.794 340 H LYS 351 H LYS 351 1.645 35.881 11.718 341 HA LYS 351 HA LYS 351 -0.404 37.596 10.576 342 HB2 LYS 351 2HB LYS 351 -1.481 35.742 12.125 343 HB3 LYS 351 1HB LYS 351 -0.806 36.669 13.456 344 HG2 LYS 351 2HG LYS 351 -2.738 37.795 11.388 345 HG3 LYS 351 1HG LYS 351 -3.242 37.117 12.935 346 HD2 LYS 351 2HD LYS 351 -1.458 39.558 12.561 347 HD3 LYS 351 1HD LYS 351 -3.177 39.589 12.964 348 HE2 LYS 351 2HE LYS 351 -2.711 38.455 15.099 349 HE3 LYS 351 1HE LYS 351 -0.997 38.354 14.691 350 HZ1 LYS 351 1HZ LYS 351 -2.529 40.865 15.080 351 HZ2 LYS 351 2HZ LYS 351 -0.883 40.756 14.708 352 HZ3 LYS 351 3HZ LYS 351 -1.453 40.176 16.189 353 HA PRO 352 HA PRO 352 -0.040 39.419 9.810 354 HB2 PRO 352 2HB PRO 352 1.613 41.287 8.770 355 HB3 PRO 352 1HB PRO 352 0.501 41.671 10.093 356 HG2 PRO 352 2HG PRO 352 3.452 41.057 10.208 357 HG3 PRO 352 1HG PRO 352 2.537 42.332 11.043 358 HD2 PRO 352 2HD PRO 352 3.252 39.932 12.222 359 HD3 PRO 352 1HD PRO 352 1.855 40.903 12.736 360 HA PRO 353 HA PRO 353 2.224 36.436 7.207 361 HB2 PRO 353 2HB PRO 353 0.679 37.824 5.016 362 HB3 PRO 353 1HB PRO 353 0.851 36.093 5.352 363 HG2 PRO 353 2HG PRO 353 -1.408 37.339 6.001 364 HG3 PRO 353 1HG PRO 353 -0.698 36.150 7.119 365 HD2 PRO 353 2HD PRO 353 -0.607 39.169 7.255 366 HD3 PRO 353 1HD PRO 353 -0.866 37.988 8.561 367 H LEU 354 H LEU 354 4.315 36.758 6.721 368 HA LEU 354 HA LEU 354 5.392 39.260 5.764 369 HB2 LEU 354 2HB LEU 354 6.712 36.520 6.009 370 HB3 LEU 354 1HB LEU 354 7.562 38.012 5.630 371 HG LEU 354 HG LEU 354 6.142 37.388 8.244 372 HD11 LEU 354 1HD1 LEU 354 9.115 37.585 7.663 373 HD12 LEU 354 2HD1 LEU 354 8.214 36.107 8.010 374 HD13 LEU 354 3HD1 LEU 354 8.383 37.343 9.254 375 HD21 LEU 354 1HD2 LEU 354 7.717 39.870 7.483 376 HD22 LEU 354 2HD2 LEU 354 7.127 39.487 9.103 377 HD23 LEU 354 3HD2 LEU 354 5.982 39.774 7.800 378 H THR 355 H THR 355 6.151 39.742 3.726 379 HA THR 355 HA THR 355 4.997 38.331 1.469 380 HB THR 355 HB THR 355 6.190 40.164 0.134 381 HG1 THR 355 HG1 THR 355 7.017 41.907 1.453 382 HG21 THR 355 1HG2 THR 355 4.695 41.987 0.881 383 HG22 THR 355 2HG2 THR 355 4.353 41.111 2.374 384 HG23 THR 355 3HG2 THR 355 3.827 40.451 0.824 385 H SER 356 H SER 356 8.134 38.640 2.997 386 HA SER 356 HA SER 356 9.236 36.463 1.409 387 HB2 SER 356 2HB SER 356 9.800 38.529 0.097 388 HB3 SER 356 1HB SER 356 10.638 39.184 1.505 389 HG SER 356 HG SER 356 11.625 37.613 -0.357 390 H VAL 357 H VAL 357 11.435 35.889 2.251 391 HA VAL 357 HA VAL 357 11.505 35.602 5.066 392 HB VAL 357 HB VAL 357 12.503 33.883 3.677 393 HG11 VAL 357 1HG1 VAL 357 14.490 35.947 2.652 394 HG12 VAL 357 2HG1 VAL 357 13.180 35.208 1.731 395 HG13 VAL 357 3HG1 VAL 357 14.525 34.217 2.292 396 HG21 VAL 357 1HG2 VAL 357 14.729 33.591 4.731 397 HG22 VAL 357 2HG2 VAL 357 13.531 34.149 5.899 398 HG23 VAL 357 3HG2 VAL 357 14.711 35.283 5.240 399 HA PRO 358 HA PRO 358 13.511 39.597 6.186 400 HB2 PRO 358 2HB PRO 358 14.213 37.993 8.634 401 HB3 PRO 358 1HB PRO 358 13.460 39.589 8.515 402 HG2 PRO 358 2HG PRO 358 11.996 37.445 9.148 403 HG3 PRO 358 1HG PRO 358 11.341 38.707 8.076 404 HD2 PRO 358 2HD PRO 358 12.437 35.994 7.369 405 HD3 PRO 358 1HD PRO 358 11.037 36.855 6.694 406 HA PRO 359 HA PRO 359 17.878 38.600 5.372 407 HB2 PRO 359 2HB PRO 359 19.036 40.973 5.791 408 HB3 PRO 359 1HB PRO 359 17.770 40.829 4.555 409 HG2 PRO 359 2HG PRO 359 17.507 41.781 7.422 410 HG3 PRO 359 1HG PRO 359 16.962 42.596 5.934 411 HD2 PRO 359 2HD PRO 359 15.302 41.053 7.483 412 HD3 PRO 359 1HD PRO 359 15.091 41.215 5.725 413 H GLU 360 H GLU 360 16.703 38.365 8.266 414 HA GLU 360 HA GLU 360 18.816 39.020 10.080 415 HB2 GLU 360 2HB GLU 360 16.270 37.389 10.418 416 HB3 GLU 360 1HB GLU 360 17.313 37.897 11.750 417 HG2 GLU 360 2HG GLU 360 16.897 40.280 11.110 418 HG3 GLU 360 1HG GLU 360 15.790 39.725 9.856 419 HA PRO 361 HA PRO 361 21.229 35.249 9.901 420 HB2 PRO 361 2HB PRO 361 22.370 35.163 12.360 421 HB3 PRO 361 1HB PRO 361 22.741 36.456 11.209 422 HG2 PRO 361 2HG PRO 361 20.792 36.483 13.524 423 HG3 PRO 361 1HG PRO 361 22.037 37.684 13.103 424 HD2 PRO 361 2HD PRO 361 19.419 37.995 12.417 425 HD3 PRO 361 1HD PRO 361 20.740 38.616 11.402 426 H GLU 362 H GLU 362 18.490 35.416 11.871 427 HA GLU 362 HA GLU 362 18.065 32.570 11.931 428 HB2 GLU 362 2HB GLU 362 17.709 32.504 14.446 429 HB3 GLU 362 1HB GLU 362 19.385 32.682 13.948 430 HG2 GLU 362 2HG GLU 362 18.969 35.248 14.289 431 HG3 GLU 362 1HG GLU 362 17.571 34.723 15.228 432 H TRP 363 H TRP 363 15.864 32.108 12.074 433 HA TRP 363 HA TRP 363 14.142 34.466 11.746 434 HB2 TRP 363 2HB TRP 363 14.300 32.671 9.917 435 HB3 TRP 363 1HB TRP 363 13.404 31.605 10.998 436 HD1 TRP 363 HD1 TRP 363 12.987 34.897 9.019 437 HE1 TRP 363 HE1 TRP 363 10.482 35.332 8.657 438 HE3 TRP 363 HE3 TRP 363 11.061 31.087 11.816 439 HZ2 TRP 363 HZ2 TRP 363 8.037 34.233 9.435 440 HZ3 TRP 363 HZ3 TRP 363 8.623 30.848 11.967 441 HH2 TRP 363 HH2 TRP 363 7.136 32.391 10.800 442 H TYR 364 H TYR 364 12.460 34.894 13.025 443 HA TYR 364 HA TYR 364 11.712 33.009 15.187 444 HB2 TYR 364 2HB TYR 364 11.872 36.058 15.296 445 HB3 TYR 364 1HB TYR 364 11.081 35.087 16.533 446 HD1 TYR 364 HD1 TYR 364 13.268 37.062 17.088 447 HD2 TYR 364 HD2 TYR 364 13.487 32.875 16.220 448 HE1 TYR 364 HE1 TYR 364 15.353 36.900 18.368 449 HE2 TYR 364 HE2 TYR 364 15.590 32.736 17.493 450 HH TYR 364 HH TYR 364 17.369 34.143 18.296 451 H CYS 365 H CYS 365 9.494 33.041 15.776 452 HA CYS 365 HA CYS 365 7.644 33.740 13.607 453 HB2 CYS 365 2HB CYS 365 6.057 32.272 14.731 454 HB3 CYS 365 1HB CYS 365 7.603 31.438 14.631 455 HA PRO 366 HA PRO 366 5.786 37.431 15.462 456 HB2 PRO 366 2HB PRO 366 3.229 35.785 15.283 457 HB3 PRO 366 1HB PRO 366 3.490 37.493 14.887 458 HG2 PRO 366 2HG PRO 366 3.424 35.678 12.937 459 HG3 PRO 366 1HG PRO 366 4.621 36.990 12.888 460 HD2 PRO 366 2HD PRO 366 5.017 34.091 13.526 461 HD3 PRO 366 1HD PRO 366 6.141 35.244 12.779 462 H SER 367 H SER 367 4.489 34.343 16.768 463 HA SER 367 HA SER 367 3.492 35.393 19.197 464 HB2 SER 367 2HB SER 367 2.620 33.321 18.152 465 HB3 SER 367 1HB SER 367 4.136 32.500 18.515 466 HG SER 367 HG SER 367 3.169 33.620 20.759 467 H CYS 368 H CYS 368 6.735 34.649 18.335 468 HA CYS 368 HA CYS 368 7.785 33.979 20.917 469 HB2 CYS 368 2HB CYS 368 8.944 34.577 18.255 470 HB3 CYS 368 1HB CYS 368 9.971 35.054 19.601 471 H ARG 369 H ARG 369 6.761 36.960 19.528 472 HA ARG 369 HA ARG 369 7.799 38.417 21.894 473 HB2 ARG 369 2HB ARG 369 7.931 40.454 20.517 474 HB3 ARG 369 1HB ARG 369 9.000 39.190 19.929 475 HG2 ARG 369 2HG ARG 369 7.434 38.685 18.097 476 HG3 ARG 369 1HG ARG 369 6.317 39.915 18.703 477 HD2 ARG 369 2HD ARG 369 8.097 41.634 18.365 478 HD3 ARG 369 1HD ARG 369 9.126 40.388 17.654 479 HE ARG 369 HE ARG 369 7.391 40.146 15.894 480 HH11 ARG 369 1HH1 ARG 369 7.443 43.159 17.717 481 HH12 ARG 369 2HH1 ARG 369 6.822 44.096 16.397 482 HH21 ARG 369 1HH2 ARG 369 6.593 41.401 14.182 483 HH22 ARG 369 2HH2 ARG 369 6.341 43.104 14.398 484 H THR 370 H THR 370 5.107 37.794 19.751 485 HA THR 370 HA THR 370 3.255 39.673 20.813 486 HB THR 370 HB THR 370 2.743 37.047 19.346 487 HG1 THR 370 HG1 THR 370 3.341 39.656 18.458 488 HG21 THR 370 1HG2 THR 370 0.686 37.858 20.448 489 HG22 THR 370 2HG2 THR 370 0.569 38.013 18.693 490 HG23 THR 370 3HG2 THR 370 0.895 39.434 19.685 491 H ASP 371 H ASP 371 1.660 39.378 22.370 492 HA ASP 371 HA ASP 371 2.309 37.563 24.543 493 HB2 ASP 371 2HB ASP 371 0.173 39.733 24.326 494 HB3 ASP 371 1HB ASP 371 0.607 38.876 25.802 495 H SER 372 H SER 372 1.500 36.005 22.490 496 HA SER 372 HA SER 372 -1.279 35.187 22.772 497 HB2 SER 372 2HB SER 372 -0.093 35.105 20.554 498 HB3 SER 372 1HB SER 372 1.002 33.884 21.207 499 HG SER 372 HG SER 372 -0.842 32.549 21.530 500 H SER 373 H SER 373 1.595 34.689 24.447 501 HA SER 373 HA SER 373 1.135 32.026 25.483 502 HB2 SER 373 2HB SER 373 3.037 32.713 27.050 503 HB3 SER 373 1HB SER 373 3.431 32.827 25.333 504 HG SER 373 HG SER 373 3.828 34.702 26.962 505 H GLU 374 H GLU 374 1.195 31.952 28.059 506 HA GLU 374 HA GLU 374 -1.222 33.164 29.070 507 HB2 GLU 374 2HB GLU 374 0.883 31.413 30.430 508 HB3 GLU 374 1HB GLU 374 -0.659 31.874 31.153 509 HG2 GLU 374 2HG GLU 374 -0.334 30.221 28.622 510 HG3 GLU 374 1HG GLU 374 -0.656 29.569 30.228 511 H VAL 375 H VAL 375 -1.364 35.036 30.169 512 HA VAL 375 HA VAL 375 0.923 36.663 30.780 513 HB VAL 375 HB VAL 375 -1.188 37.706 30.021 514 HG11 VAL 375 1HG1 VAL 375 -3.182 37.891 31.456 515 HG12 VAL 375 2HG1 VAL 375 -2.428 36.844 32.660 516 HG13 VAL 375 3HG1 VAL 375 -2.831 36.205 31.068 517 HG21 VAL 375 1HG2 VAL 375 -0.441 38.607 32.834 518 HG22 VAL 375 2HG2 VAL 375 -1.290 39.583 31.631 519 HG23 VAL 375 3HG2 VAL 375 0.376 39.081 31.343 520 H VAL 376 H VAL 376 1.935 36.949 32.700 521 HA VAL 376 HA VAL 376 1.380 35.134 34.900 522 HB VAL 376 HB VAL 376 3.544 37.294 34.717 523 HG11 VAL 376 1HG1 VAL 376 3.127 36.585 37.039 524 HG12 VAL 376 2HG1 VAL 376 4.701 36.005 36.496 525 HG13 VAL 376 3HG1 VAL 376 3.334 34.891 36.585 526 HG21 VAL 376 1HG2 VAL 376 5.102 35.476 34.049 527 HG22 VAL 376 2HG2 VAL 376 3.810 35.687 32.868 528 HG23 VAL 376 3HG2 VAL 376 3.755 34.334 33.999 529 H GLN 377 H GLN 377 -0.218 35.673 36.285 530 HA GLN 377 HA GLN 377 -1.124 38.334 36.814 531 HB2 GLN 377 2HB GLN 377 -2.623 36.361 36.994 532 HB3 GLN 377 1HB GLN 377 -1.667 35.740 38.332 533 HG2 GLN 377 2HG GLN 377 -3.659 36.735 39.240 534 HG3 GLN 377 1HG GLN 377 -2.296 37.767 39.670 535 HE21 GLN 377 1HE2 GLN 377 -3.545 39.625 39.951 536 HE22 GLN 377 2HE2 GLN 377 -4.328 40.443 38.644 537 H ALA 378 H ALA 378 0.577 39.574 37.533 538 HA ALA 378 HA ALA 378 2.131 38.879 39.908 539 HB1 ALA 378 1HB ALA 378 3.312 41.003 39.462 540 HB2 ALA 378 2HB ALA 378 2.142 41.397 38.199 541 HB3 ALA 378 3HB ALA 378 3.223 40.017 38.001 542 H GLY 379 H GLY 379 2.355 40.726 41.580 543 HA2 GLY 379 2HA GLY 379 1.373 42.214 43.097 544 HA3 GLY 379 1HA GLY 379 -0.149 42.107 42.220 545 H GLU 380 H GLU 380 1.957 39.618 43.600 546 HA GLU 380 HA GLU 380 0.108 38.942 45.729 547 HB2 GLU 380 2HB GLU 380 -0.800 37.665 43.798 548 HB3 GLU 380 1HB GLU 380 0.778 36.943 43.519 549 HG2 GLU 380 2HG GLU 380 -0.742 35.382 44.641 550 HG3 GLU 380 1HG GLU 380 0.664 35.748 45.639
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