NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
7328 | 1k91 | 5205 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H GLY 220 H GLY 220 -18.294 -2.879 8.085 2 1HA GLY 220 1HA GLY 220 -18.287 -5.340 8.553 3 2HA GLY 220 2HA GLY 220 -18.733 -5.529 6.848 4 H LYS 221 H LYS 221 -17.176 -4.250 5.244 5 HA LYS 221 HA LYS 221 -14.511 -3.872 6.338 6 1HB LYS 221 1HB LYS 221 -14.736 -5.543 3.840 7 2HB LYS 221 2HB LYS 221 -13.313 -5.220 4.773 8 1HG LYS 221 1HG LYS 221 -14.111 -6.623 6.537 9 2HG LYS 221 2HG LYS 221 -15.516 -7.050 5.548 10 1HD LYS 221 1HD LYS 221 -13.990 -7.889 3.773 11 2HD LYS 221 2HD LYS 221 -12.597 -7.551 4.805 12 1HE LYS 221 1HE LYS 221 -14.854 -9.404 5.665 13 2HE LYS 221 2HE LYS 221 -13.504 -9.966 4.684 14 1HZ LYS 221 1HZ LYS 221 -13.180 -8.733 7.358 15 2HZ LYS 221 2HZ LYS 221 -13.182 -10.327 7.042 16 3HZ LYS 221 3HZ LYS 221 -11.986 -9.376 6.421 17 HA PRO 222 HA PRO 222 -14.833 -0.525 3.396 18 1HB PRO 222 1HB PRO 222 -12.098 -0.239 2.656 19 2HB PRO 222 2HB PRO 222 -12.898 0.514 4.036 20 1HG PRO 222 1HG PRO 222 -10.951 -1.666 4.035 21 2HG PRO 222 2HG PRO 222 -11.643 -0.787 5.418 22 1HD PRO 222 1HD PRO 222 -12.337 -3.426 4.339 23 2HD PRO 222 2HD PRO 222 -12.831 -2.676 5.886 24 H GLU 223 H GLU 223 -14.002 0.255 1.130 25 HA GLU 223 HA GLU 223 -14.753 -1.644 -0.828 26 1HB GLU 223 1HB GLU 223 -13.097 0.879 -1.204 27 2HB GLU 223 2HB GLU 223 -14.052 0.034 -2.421 28 1HG GLU 223 1HG GLU 223 -15.773 1.375 -1.916 29 2HG GLU 223 2HG GLU 223 -15.918 0.566 -0.366 30 H HIS 224 H HIS 224 -11.506 -0.682 0.373 31 HA HIS 224 HA HIS 224 -10.315 -2.913 -1.159 32 1HB HIS 224 1HB HIS 224 -8.794 -0.348 -0.780 33 2HB HIS 224 2HB HIS 224 -8.522 -1.637 -1.946 34 HD1 HIS 224 1HD HIS 224 -10.048 1.697 -1.609 35 HD2 HIS 224 2HD HIS 224 -10.496 -1.711 -4.046 36 HE1 HIS 224 1HE HIS 224 -11.520 2.412 -3.568 37 H ILE 225 H ILE 225 -8.210 -3.561 -0.186 38 HA ILE 225 HA ILE 225 -8.233 -3.308 2.789 39 HB ILE 225 HB ILE 225 -8.255 -5.701 0.971 40 1HG1 ILE 225 1HG1 ILE 225 -9.825 -4.608 3.327 41 2HG1 ILE 225 2HG1 ILE 225 -10.383 -5.018 1.713 42 1HG2 ILE 225 1HG2 ILE 225 -6.271 -5.966 2.505 43 2HG2 ILE 225 2HG2 ILE 225 -7.413 -5.917 3.874 44 3HG2 ILE 225 3HG2 ILE 225 -7.508 -7.188 2.646 45 1HD1 ILE 225 1HD1 ILE 225 -9.912 -7.441 2.291 46 2HD1 ILE 225 2HD1 ILE 225 -9.564 -6.849 3.955 47 3HD1 ILE 225 3HD1 ILE 225 -11.181 -6.645 3.266 48 HA PRO 226 HA PRO 226 -4.104 -2.155 1.728 49 1HB PRO 226 1HB PRO 226 -2.754 -2.212 4.014 50 2HB PRO 226 2HB PRO 226 -4.161 -1.126 3.792 51 1HG PRO 226 1HG PRO 226 -4.094 -3.803 5.221 52 2HG PRO 226 2HG PRO 226 -4.888 -2.296 5.761 53 1HD PRO 226 1HD PRO 226 -6.108 -4.394 4.421 54 2HD PRO 226 2HD PRO 226 -6.780 -2.758 4.403 55 H ASP 227 H ASP 227 -1.767 -2.837 1.825 56 HA ASP 227 HA ASP 227 -1.569 -5.790 1.564 57 1HB ASP 227 1HB ASP 227 -1.140 -4.464 -0.457 58 2HB ASP 227 2HB ASP 227 0.221 -3.681 0.354 59 HA PRO 228 HA PRO 228 1.283 -5.259 5.142 60 1HB PRO 228 1HB PRO 228 0.979 -7.678 6.252 61 2HB PRO 228 2HB PRO 228 -0.331 -6.453 6.348 62 1HG PRO 228 1HG PRO 228 -0.086 -8.773 4.406 63 2HG PRO 228 2HG PRO 228 -1.509 -8.304 5.398 64 1HD PRO 228 1HD PRO 228 -1.172 -7.516 2.774 65 2HD PRO 228 2HD PRO 228 -2.009 -6.516 3.974 66 H ASP 229 H ASP 229 1.218 -7.402 2.439 67 HA ASP 229 HA ASP 229 3.659 -8.902 3.168 68 1HB ASP 229 1HB ASP 229 1.644 -9.934 2.050 69 2HB ASP 229 2HB ASP 229 2.024 -9.000 0.593 70 H ALA 230 H ALA 230 2.748 -6.198 1.167 71 HA ALA 230 HA ALA 230 5.249 -5.891 -0.262 72 1HB ALA 230 1HB ALA 230 3.137 -3.891 0.654 73 2HB ALA 230 2HB ALA 230 4.495 -3.495 -0.429 74 3HB ALA 230 3HB ALA 230 3.259 -4.637 -0.958 75 H LYS 231 H LYS 231 6.933 -4.333 0.277 76 HA LYS 231 HA LYS 231 7.076 -3.461 3.099 77 1HB LYS 231 1HB LYS 231 9.153 -5.121 1.609 78 2HB LYS 231 2HB LYS 231 9.564 -4.161 3.018 79 1HG LYS 231 1HG LYS 231 7.522 -6.441 3.003 80 2HG LYS 231 2HG LYS 231 9.182 -6.530 3.575 81 1HD LYS 231 1HD LYS 231 8.521 -4.501 5.116 82 2HD LYS 231 2HD LYS 231 6.853 -5.043 4.791 83 1HE LYS 231 1HE LYS 231 7.546 -7.354 5.538 84 2HE LYS 231 2HE LYS 231 9.152 -6.695 5.925 85 1HZ LYS 231 1HZ LYS 231 6.583 -6.089 7.241 86 2HZ LYS 231 2HZ LYS 231 8.006 -6.601 7.902 87 3HZ LYS 231 3HZ LYS 231 7.875 -5.061 7.346 88 H LYS 232 H LYS 232 8.318 -1.607 3.381 89 HA LYS 232 HA LYS 232 9.075 0.344 1.723 90 1HB LYS 232 1HB LYS 232 10.433 -0.917 4.056 91 2HB LYS 232 2HB LYS 232 11.477 0.039 3.009 92 1HG LYS 232 1HG LYS 232 10.046 1.982 3.268 93 2HG LYS 232 2HG LYS 232 8.931 1.051 4.291 94 1HD LYS 232 1HD LYS 232 10.720 0.638 5.926 95 2HD LYS 232 2HD LYS 232 11.867 1.507 4.890 96 1HE LYS 232 1HE LYS 232 10.406 3.512 5.014 97 2HE LYS 232 2HE LYS 232 9.368 2.679 6.179 98 1HZ LYS 232 1HZ LYS 232 11.195 2.560 7.709 99 2HZ LYS 232 2HZ LYS 232 12.268 3.126 6.579 100 3HZ LYS 232 3HZ LYS 232 11.112 4.116 7.182 101 HA PRO 233 HA PRO 233 11.098 -1.866 -1.533 102 1HB PRO 233 1HB PRO 233 12.308 0.668 -2.489 103 2HB PRO 233 2HB PRO 233 11.225 -0.466 -3.331 104 1HG PRO 233 1HG PRO 233 10.514 2.031 -2.214 105 2HG PRO 233 2HG PRO 233 9.376 0.779 -2.716 106 1HD PRO 233 1HD PRO 233 10.082 1.615 -0.003 107 2HD PRO 233 2HD PRO 233 8.816 0.479 -0.536 108 H GLU 234 H GLU 234 13.086 -2.751 -1.888 109 HA GLU 234 HA GLU 234 15.185 -2.529 -0.002 110 1HB GLU 234 1HB GLU 234 14.380 -4.316 -1.821 111 2HB GLU 234 2HB GLU 234 15.624 -3.592 -2.802 112 1HG GLU 234 1HG GLU 234 16.081 -4.681 0.023 113 2HG GLU 234 2HG GLU 234 16.199 -5.670 -1.432 114 H ASP 235 H ASP 235 14.422 -0.569 -2.652 115 HA ASP 235 HA ASP 235 17.072 0.803 -2.709 116 1HB ASP 235 1HB ASP 235 16.299 -0.525 -4.753 117 2HB ASP 235 2HB ASP 235 15.017 0.673 -4.934 118 H TRP 236 H TRP 236 14.308 1.250 -1.116 119 HA TRP 236 HA TRP 236 13.180 3.680 -1.933 120 1HB TRP 236 1HB TRP 236 12.307 2.006 -0.268 121 2HB TRP 236 2HB TRP 236 13.521 2.546 0.875 122 HD1 TRP 236 HD TRP 236 12.346 3.880 2.662 123 HE1 TRP 236 1HE TRP 236 10.561 5.781 2.778 124 HE3 TRP 236 3HE TRP 236 11.075 4.089 -2.262 125 HZ2 TRP 236 2HZ TRP 236 8.565 6.860 1.039 126 HZ3 TRP 236 3HZ TRP 236 9.231 5.609 -3.019 127 HH2 TRP 236 HH TRP 236 7.942 6.933 -1.364 128 H ASP 237 H ASP 237 13.325 5.780 -0.847 129 HA ASP 237 HA ASP 237 16.037 6.449 0.186 130 1HB ASP 237 1HB ASP 237 14.389 8.005 -1.847 131 2HB ASP 237 2HB ASP 237 15.727 8.672 -0.911 132 H GLU 238 H GLU 238 15.072 6.171 2.274 133 HA GLU 238 HA GLU 238 12.708 7.473 3.156 134 1HB GLU 238 1HB GLU 238 15.237 6.673 4.649 135 2HB GLU 238 2HB GLU 238 13.752 7.242 5.439 136 1HG GLU 238 1HG GLU 238 12.521 5.356 4.385 137 2HG GLU 238 2HG GLU 238 14.043 4.781 3.676 138 H GLU 239 H GLU 239 15.995 8.772 2.675 139 HA GLU 239 HA GLU 239 15.406 11.141 4.296 140 1HB GLU 239 1HB GLU 239 17.700 9.787 3.612 141 2HB GLU 239 2HB GLU 239 17.780 11.126 2.478 142 1HG GLU 239 1HG GLU 239 17.316 11.492 5.481 143 2HG GLU 239 2HG GLU 239 18.926 11.353 4.774 144 H MET 240 H MET 240 14.688 10.161 1.064 145 HA MET 240 HA MET 240 14.451 12.947 0.057 146 1HB MET 240 1HB MET 240 14.239 10.195 -1.194 147 2HB MET 240 2HB MET 240 13.528 11.566 -1.972 148 1HG MET 240 1HG MET 240 15.740 11.161 -2.856 149 2HG MET 240 2HG MET 240 15.624 12.740 -2.074 150 1HE MET 240 1HE MET 240 16.730 13.339 0.287 151 2HE MET 240 2HE MET 240 18.443 12.876 0.340 152 3HE MET 240 3HE MET 240 17.767 13.626 -1.125 153 H ASP 241 H ASP 241 12.475 9.972 0.591 154 HA ASP 241 HA ASP 241 10.082 11.680 0.131 155 1HB ASP 241 1HB ASP 241 10.813 9.344 -1.127 156 2HB ASP 241 2HB ASP 241 9.707 8.771 0.122 157 H GLY 242 H GLY 242 11.634 10.040 2.759 158 1HA GLY 242 1HA GLY 242 11.005 9.933 4.965 159 2HA GLY 242 2HA GLY 242 9.541 10.839 4.581 160 H GLU 243 H GLU 243 7.821 9.750 5.041 161 HA GLU 243 HA GLU 243 7.745 7.089 5.784 162 1HB GLU 243 1HB GLU 243 5.871 7.733 6.717 163 2HB GLU 243 2HB GLU 243 6.159 9.334 6.094 164 1HG GLU 243 1HG GLU 243 4.708 8.860 4.135 165 2HG GLU 243 2HG GLU 243 4.416 7.223 4.756 166 H TRP 244 H TRP 244 7.714 5.295 4.626 167 HA TRP 244 HA TRP 244 6.751 5.264 1.829 168 1HB TRP 244 1HB TRP 244 8.629 3.809 2.459 169 2HB TRP 244 2HB TRP 244 7.666 3.094 3.750 170 HD1 TRP 244 HD TRP 244 7.429 3.483 -0.112 171 HE1 TRP 244 1HE TRP 244 6.378 1.357 -1.087 172 HE3 TRP 244 3HE TRP 244 6.792 0.863 4.209 173 HZ2 TRP 244 2HZ TRP 244 5.195 -1.087 -0.074 174 HZ3 TRP 244 3HZ TRP 244 5.953 -1.455 4.155 175 HH2 TRP 244 HH TRP 244 4.903 -2.355 2.069 176 H GLU 245 H GLU 245 4.832 4.044 1.303 177 HA GLU 245 HA GLU 245 3.019 3.297 3.476 178 1HB GLU 245 1HB GLU 245 2.125 5.353 3.005 179 2HB GLU 245 2HB GLU 245 2.481 5.246 1.272 180 1HG GLU 245 1HG GLU 245 0.229 5.115 1.238 181 2HG GLU 245 2HG GLU 245 0.626 3.430 1.210 182 HA PRO 246 HA PRO 246 3.100 -0.150 0.634 183 1HB PRO 246 1HB PRO 246 0.858 -1.541 1.707 184 2HB PRO 246 2HB PRO 246 2.567 -1.742 2.134 185 1HG PRO 246 1HG PRO 246 0.429 -0.471 3.688 186 2HG PRO 246 2HG PRO 246 2.105 -0.868 4.163 187 1HD PRO 246 1HD PRO 246 1.029 1.764 3.418 188 2HD PRO 246 2HD PRO 246 2.630 1.350 4.042 189 HA PRO 247 HA PRO 247 -0.398 0.305 -2.186 190 1HB PRO 247 1HB PRO 247 -0.442 -2.180 -3.350 191 2HB PRO 247 2HB PRO 247 0.661 -0.871 -3.782 192 1HG PRO 247 1HG PRO 247 1.177 -3.344 -2.171 193 2HG PRO 247 2HG PRO 247 2.312 -2.433 -3.206 194 1HD PRO 247 1HD PRO 247 2.025 -2.288 -0.374 195 2HD PRO 247 2HD PRO 247 3.003 -1.187 -1.376 196 H VAL 248 H VAL 248 -2.308 -1.428 -2.790 197 HA VAL 248 HA VAL 248 -3.472 -2.517 -0.333 198 HB VAL 248 HB VAL 248 -5.571 -1.652 -1.278 199 1HG1 VAL 248 1HG1 VAL 248 -4.531 -0.351 0.509 200 2HG1 VAL 248 2HG1 VAL 248 -3.492 0.490 -0.663 201 3HG1 VAL 248 3HG1 VAL 248 -5.236 0.757 -0.692 202 1HG2 VAL 248 1HG2 VAL 248 -5.661 0.094 -2.962 203 2HG2 VAL 248 2HG2 VAL 248 -3.907 -0.003 -3.192 204 3HG2 VAL 248 3HG2 VAL 248 -4.945 -1.371 -3.633 205 H ILE 249 H ILE 249 -5.576 -3.749 -1.219 206 HA ILE 249 HA ILE 249 -4.977 -5.256 -3.639 207 HB ILE 249 HB ILE 249 -5.433 -7.321 -2.612 208 1HG1 ILE 249 1HG1 ILE 249 -5.878 -6.168 0.152 209 2HG1 ILE 249 2HG1 ILE 249 -7.229 -6.385 -0.958 210 1HG2 ILE 249 1HG2 ILE 249 -3.595 -7.568 -0.977 211 2HG2 ILE 249 2HG2 ILE 249 -3.120 -6.395 -2.217 212 3HG2 ILE 249 3HG2 ILE 249 -3.637 -5.833 -0.617 213 1HD1 ILE 249 1HD1 ILE 249 -7.051 -8.291 0.537 214 2HD1 ILE 249 2HD1 ILE 249 -6.840 -8.755 -1.158 215 3HD1 ILE 249 3HD1 ILE 249 -5.433 -8.650 -0.083 216 H GLN 250 H GLN 250 -6.877 -5.893 -4.654 217 HA GLN 250 HA GLN 250 -9.299 -4.367 -4.162 218 1HB GLN 250 1HB GLN 250 -10.177 -5.341 -6.033 219 2HB GLN 250 2HB GLN 250 -8.478 -5.426 -6.385 220 1HG GLN 250 1HG GLN 250 -9.397 -7.475 -7.105 221 2HG GLN 250 2HG GLN 250 -8.509 -7.853 -5.632 222 1HE2 GLN 250 1HE2 GLN 250 -11.749 -6.274 -5.483 223 2HE2 GLN 250 2HE2 GLN 250 -12.477 -7.637 -4.688 224 H ASN 251 H ASN 251 -11.055 -4.987 -2.843 225 HA ASN 251 HA ASN 251 -10.263 -6.735 -0.667 226 1HB ASN 251 1HB ASN 251 -11.591 -4.706 -0.292 227 2HB ASN 251 2HB ASN 251 -12.907 -5.403 -1.238 228 1HD2 ASN 251 1HD2 ASN 251 -13.393 -4.541 1.411 229 2HD2 ASN 251 2HD2 ASN 251 -13.660 -5.998 2.366 230 HA PRO 252 HA PRO 252 -11.898 -10.327 -2.868 231 1HB PRO 252 1HB PRO 252 -11.602 -12.259 -0.936 232 2HB PRO 252 2HB PRO 252 -10.238 -11.560 -1.866 233 1HG PRO 252 1HG PRO 252 -11.178 -10.722 0.882 234 2HG PRO 252 2HG PRO 252 -9.513 -11.146 0.354 235 1HD PRO 252 1HD PRO 252 -10.321 -8.577 0.448 236 2HD PRO 252 2HD PRO 252 -9.310 -9.137 -0.905 237 H GLU 253 H GLU 253 -13.280 -8.977 0.090 238 HA GLU 253 HA GLU 253 -15.918 -9.765 -0.770 239 1HB GLU 253 1HB GLU 253 -14.868 -10.628 1.950 240 2HB GLU 253 2HB GLU 253 -16.577 -10.395 1.575 241 1HG GLU 253 1HG GLU 253 -16.137 -12.069 -0.400 242 2HG GLU 253 2HG GLU 253 -14.740 -12.566 0.585 243 H TYR 254 H TYR 254 -15.321 -7.465 -1.228 244 HA TYR 254 HA TYR 254 -15.861 -5.536 0.933 245 1HB TYR 254 1HB TYR 254 -14.831 -4.583 -1.001 246 2HB TYR 254 2HB TYR 254 -15.984 -5.346 -2.089 247 HD1 TYR 254 1HD TYR 254 -17.137 -3.640 -3.152 248 HD2 TYR 254 2HD TYR 254 -16.423 -3.272 1.086 249 HE1 TYR 254 1HE TYR 254 -18.371 -1.488 -3.129 250 HE2 TYR 254 2HE TYR 254 -17.645 -1.146 1.119 251 HH TYR 254 HH TYR 254 -18.545 0.538 -0.187 252 H LYS 255 H LYS 255 -17.709 -5.711 1.955 253 HA LYS 255 HA LYS 255 -20.230 -6.235 0.408 254 1HB LYS 255 1HB LYS 255 -19.664 -7.861 2.251 255 2HB LYS 255 2HB LYS 255 -19.837 -6.542 3.415 256 1HG LYS 255 1HG LYS 255 -22.057 -7.265 1.453 257 2HG LYS 255 2HG LYS 255 -21.806 -8.171 2.951 258 1HD LYS 255 1HD LYS 255 -22.214 -6.281 4.330 259 2HD LYS 255 2HD LYS 255 -22.281 -5.174 2.971 260 1HE LYS 255 1HE LYS 255 -24.163 -7.541 3.159 261 2HE LYS 255 2HE LYS 255 -24.486 -6.055 4.063 262 1HZ LYS 255 1HZ LYS 255 -24.191 -6.219 1.126 263 2HZ LYS 255 2HZ LYS 255 -25.588 -5.994 1.954 264 3HZ LYS 255 3HZ LYS 255 -24.425 -4.839 1.995 265 H GLY 256 H GLY 256 -18.609 -4.273 2.880 266 1HA GLY 256 1HA GLY 256 -19.004 -1.861 3.106 267 2HA GLY 256 2HA GLY 256 -20.723 -2.246 2.804 Start of MODEL 2 1 H GLY 220 H GLY 220 -19.304 -0.934 6.205 2 1HA GLY 220 1HA GLY 220 -18.900 -2.286 8.252 3 2HA GLY 220 2HA GLY 220 -19.358 -3.690 7.281 4 H LYS 221 H LYS 221 -17.998 -4.079 5.266 5 HA LYS 221 HA LYS 221 -15.165 -3.780 5.945 6 1HB LYS 221 1HB LYS 221 -16.808 -5.646 4.404 7 2HB LYS 221 2HB LYS 221 -15.455 -5.102 3.428 8 1HG LYS 221 1HG LYS 221 -13.953 -5.726 5.206 9 2HG LYS 221 2HG LYS 221 -15.263 -5.998 6.343 10 1HD LYS 221 1HD LYS 221 -15.956 -7.827 4.444 11 2HD LYS 221 2HD LYS 221 -14.204 -7.748 4.169 12 1HE LYS 221 1HE LYS 221 -14.584 -9.492 5.755 13 2HE LYS 221 2HE LYS 221 -13.883 -8.138 6.645 14 1HZ LYS 221 1HZ LYS 221 -16.789 -8.701 6.545 15 2HZ LYS 221 2HZ LYS 221 -15.791 -9.272 7.696 16 3HZ LYS 221 3HZ LYS 221 -16.018 -7.651 7.561 17 HA PRO 222 HA PRO 222 -14.730 -0.260 3.303 18 1HB PRO 222 1HB PRO 222 -12.000 -0.590 2.615 19 2HB PRO 222 2HB PRO 222 -12.667 0.332 3.975 20 1HG PRO 222 1HG PRO 222 -11.230 -2.234 4.009 21 2HG PRO 222 2HG PRO 222 -11.730 -1.211 5.386 22 1HD PRO 222 1HD PRO 222 -12.956 -3.655 4.375 23 2HD PRO 222 2HD PRO 222 -13.354 -2.726 5.846 24 H GLU 223 H GLU 223 -13.771 0.282 1.059 25 HA GLU 223 HA GLU 223 -14.868 -1.634 -0.849 26 1HB GLU 223 1HB GLU 223 -13.399 1.007 -1.170 27 2HB GLU 223 2HB GLU 223 -14.206 0.142 -2.486 28 1HG GLU 223 1HG GLU 223 -16.376 0.450 -1.558 29 2HG GLU 223 2HG GLU 223 -15.772 0.886 0.033 30 H HIS 224 H HIS 224 -11.590 -0.649 0.201 31 HA HIS 224 HA HIS 224 -10.449 -2.810 -1.470 32 1HB HIS 224 1HB HIS 224 -9.001 -0.210 -0.867 33 2HB HIS 224 2HB HIS 224 -8.553 -1.477 -2.002 34 HD1 HIS 224 1HD HIS 224 -10.703 1.691 -1.831 35 HD2 HIS 224 2HD HIS 224 -10.006 -1.655 -4.329 36 HE1 HIS 224 1HE HIS 224 -11.747 2.239 -4.058 37 H ILE 225 H ILE 225 -8.209 -3.461 -0.522 38 HA ILE 225 HA ILE 225 -8.146 -3.295 2.434 39 HB ILE 225 HB ILE 225 -8.343 -5.664 0.580 40 1HG1 ILE 225 1HG1 ILE 225 -9.684 -4.555 3.073 41 2HG1 ILE 225 2HG1 ILE 225 -10.381 -4.901 1.505 42 1HG2 ILE 225 1HG2 ILE 225 -7.369 -6.063 3.426 43 2HG2 ILE 225 2HG2 ILE 225 -7.601 -7.248 2.144 44 3HG2 ILE 225 3HG2 ILE 225 -6.291 -6.095 1.992 45 1HD1 ILE 225 1HD1 ILE 225 -11.170 -6.527 3.028 46 2HD1 ILE 225 2HD1 ILE 225 -9.963 -7.361 2.002 47 3HD1 ILE 225 3HD1 ILE 225 -9.531 -6.799 3.660 48 HA PRO 226 HA PRO 226 -3.895 -2.437 1.408 49 1HB PRO 226 1HB PRO 226 -2.593 -2.883 3.705 50 2HB PRO 226 2HB PRO 226 -3.792 -1.548 3.562 51 1HG PRO 226 1HG PRO 226 -4.172 -4.276 4.810 52 2HG PRO 226 2HG PRO 226 -4.745 -2.694 5.408 53 1HD PRO 226 1HD PRO 226 -6.239 -4.487 3.974 54 2HD PRO 226 2HD PRO 226 -6.639 -2.788 4.014 55 H ASP 227 H ASP 227 -1.684 -3.492 1.477 56 HA ASP 227 HA ASP 227 -1.880 -6.446 1.118 57 1HB ASP 227 1HB ASP 227 -1.007 -5.288 -0.825 58 2HB ASP 227 2HB ASP 227 0.243 -4.535 0.148 59 HA PRO 228 HA PRO 228 0.065 -5.947 5.246 60 1HB PRO 228 1HB PRO 228 -0.272 -8.496 6.186 61 2HB PRO 228 2HB PRO 228 -1.613 -7.317 6.112 62 1HG PRO 228 1HG PRO 228 -0.945 -9.508 4.123 63 2HG PRO 228 2HG PRO 228 -2.537 -9.110 4.834 64 1HD PRO 228 1HD PRO 228 -1.771 -8.203 2.360 65 2HD PRO 228 2HD PRO 228 -2.778 -7.227 3.457 66 H ASP 229 H ASP 229 0.649 -8.332 2.751 67 HA ASP 229 HA ASP 229 3.239 -9.156 3.835 68 1HB ASP 229 1HB ASP 229 1.305 -10.254 1.859 69 2HB ASP 229 2HB ASP 229 2.998 -10.512 1.476 70 H ALA 230 H ALA 230 2.602 -6.402 2.681 71 HA ALA 230 HA ALA 230 4.543 -6.126 0.501 72 1HB ALA 230 1HB ALA 230 3.841 -3.754 0.679 73 2HB ALA 230 2HB ALA 230 2.459 -4.832 0.534 74 3HB ALA 230 3HB ALA 230 2.876 -4.140 2.116 75 H LYS 231 H LYS 231 6.717 -5.766 0.828 76 HA LYS 231 HA LYS 231 7.542 -4.218 3.247 77 1HB LYS 231 1HB LYS 231 9.048 -6.175 1.483 78 2HB LYS 231 2HB LYS 231 9.897 -4.933 2.371 79 1HG LYS 231 1HG LYS 231 8.269 -7.168 3.611 80 2HG LYS 231 2HG LYS 231 10.018 -7.001 3.560 81 1HD LYS 231 1HD LYS 231 9.746 -6.146 5.637 82 2HD LYS 231 2HD LYS 231 9.453 -4.646 4.764 83 1HE LYS 231 1HE LYS 231 6.963 -5.201 4.807 84 2HE LYS 231 2HE LYS 231 7.338 -6.621 5.770 85 1HZ LYS 231 1HZ LYS 231 6.646 -4.718 7.096 86 2HZ LYS 231 2HZ LYS 231 8.154 -5.218 7.503 87 3HZ LYS 231 3HZ LYS 231 7.950 -3.848 6.617 88 H LYS 232 H LYS 232 8.240 -2.255 2.956 89 HA LYS 232 HA LYS 232 8.394 -0.789 0.696 90 1HB LYS 232 1HB LYS 232 9.634 0.820 1.951 91 2HB LYS 232 2HB LYS 232 8.661 -0.036 3.136 92 1HG LYS 232 1HG LYS 232 10.633 -1.470 3.703 93 2HG LYS 232 2HG LYS 232 11.602 -0.508 2.574 94 1HD LYS 232 1HD LYS 232 10.725 1.553 3.946 95 2HD LYS 232 2HD LYS 232 10.373 0.349 5.200 96 1HE LYS 232 1HE LYS 232 13.044 0.844 3.820 97 2HE LYS 232 2HE LYS 232 12.606 1.389 5.446 98 1HZ LYS 232 1HZ LYS 232 13.145 -1.352 4.542 99 2HZ LYS 232 2HZ LYS 232 13.798 -0.506 5.792 100 3HZ LYS 232 3HZ LYS 232 12.264 -1.084 5.908 101 HA PRO 233 HA PRO 233 11.989 -1.900 -1.634 102 1HB PRO 233 1HB PRO 233 12.866 0.863 -2.105 103 2HB PRO 233 2HB PRO 233 12.148 -0.296 -3.261 104 1HG PRO 233 1HG PRO 233 10.827 1.964 -2.312 105 2HG PRO 233 2HG PRO 233 10.021 0.525 -2.929 106 1HD PRO 233 1HD PRO 233 10.428 1.344 -0.074 107 2HD PRO 233 2HD PRO 233 9.072 0.470 -0.851 108 H GLU 234 H GLU 234 14.308 -2.078 -1.392 109 HA GLU 234 HA GLU 234 15.348 -1.339 1.176 110 1HB GLU 234 1HB GLU 234 15.591 -3.452 -0.281 111 2HB GLU 234 2HB GLU 234 16.743 -2.539 -1.263 112 1HG GLU 234 1HG GLU 234 18.272 -2.350 0.516 113 2HG GLU 234 2HG GLU 234 17.022 -2.660 1.736 114 H ASP 235 H ASP 235 15.362 -0.055 -2.037 115 HA ASP 235 HA ASP 235 17.633 1.792 -1.834 116 1HB ASP 235 1HB ASP 235 16.783 2.567 -4.030 117 2HB ASP 235 2HB ASP 235 17.124 0.844 -3.980 118 H TRP 236 H TRP 236 14.524 1.770 -0.480 119 HA TRP 236 HA TRP 236 13.431 4.178 -1.224 120 1HB TRP 236 1HB TRP 236 12.304 2.334 -0.085 121 2HB TRP 236 2HB TRP 236 13.156 2.707 1.420 122 HD1 TRP 236 HD TRP 236 12.005 4.376 2.942 123 HE1 TRP 236 1HE TRP 236 10.073 6.107 2.766 124 HE3 TRP 236 3HE TRP 236 11.053 4.011 -2.052 125 HZ2 TRP 236 2HZ TRP 236 8.088 6.800 0.814 126 HZ3 TRP 236 3HZ TRP 236 9.091 5.162 -3.047 127 HH2 TRP 236 HH TRP 236 7.585 6.549 -1.616 128 H ASP 237 H ASP 237 14.011 6.219 -0.984 129 HA ASP 237 HA ASP 237 15.963 7.108 0.972 130 1HB ASP 237 1HB ASP 237 14.796 7.974 -1.647 131 2HB ASP 237 2HB ASP 237 15.043 9.244 -0.480 132 H GLU 238 H GLU 238 14.762 6.900 2.896 133 HA GLU 238 HA GLU 238 12.227 8.140 3.421 134 1HB GLU 238 1HB GLU 238 13.229 6.366 4.742 135 2HB GLU 238 2HB GLU 238 14.562 7.384 5.207 136 1HG GLU 238 1HG GLU 238 11.672 8.027 5.939 137 2HG GLU 238 2HG GLU 238 12.682 6.947 6.900 138 H GLU 239 H GLU 239 15.295 9.563 2.824 139 HA GLU 239 HA GLU 239 14.756 12.018 4.334 140 1HB GLU 239 1HB GLU 239 17.061 10.579 3.434 141 2HB GLU 239 2HB GLU 239 17.038 12.022 2.456 142 1HG GLU 239 1HG GLU 239 16.711 12.200 5.499 143 2HG GLU 239 2HG GLU 239 18.282 11.816 4.817 144 H MET 240 H MET 240 13.756 10.701 1.419 145 HA MET 240 HA MET 240 13.575 13.356 0.055 146 1HB MET 240 1HB MET 240 13.610 10.568 -1.167 147 2HB MET 240 2HB MET 240 13.278 12.016 -2.032 148 1HG MET 240 1HG MET 240 15.865 11.717 -0.473 149 2HG MET 240 2HG MET 240 15.709 11.048 -2.089 150 1HE MET 240 1HE MET 240 16.146 12.279 -4.235 151 2HE MET 240 2HE MET 240 14.435 12.682 -4.000 152 3HE MET 240 3HE MET 240 15.583 13.939 -4.489 153 H ASP 241 H ASP 241 11.948 10.128 0.172 154 HA ASP 241 HA ASP 241 9.479 11.504 -0.656 155 1HB ASP 241 1HB ASP 241 10.079 9.290 -1.622 156 2HB ASP 241 2HB ASP 241 9.805 8.555 -0.046 157 H GLY 242 H GLY 242 10.153 9.161 2.042 158 1HA GLY 242 1HA GLY 242 9.596 10.380 4.301 159 2HA GLY 242 2HA GLY 242 7.970 10.404 3.596 160 H GLU 243 H GLU 243 7.117 9.027 5.251 161 HA GLU 243 HA GLU 243 8.027 6.350 5.628 162 1HB GLU 243 1HB GLU 243 5.974 8.176 6.669 163 2HB GLU 243 2HB GLU 243 5.319 6.603 6.353 164 1HG GLU 243 1HG GLU 243 7.869 7.019 7.915 165 2HG GLU 243 2HG GLU 243 6.292 6.940 8.678 166 H TRP 244 H TRP 244 7.935 4.876 4.045 167 HA TRP 244 HA TRP 244 6.536 5.122 1.631 168 1HB TRP 244 1HB TRP 244 8.472 3.631 1.943 169 2HB TRP 244 2HB TRP 244 7.557 2.645 3.063 170 HD1 TRP 244 HD TRP 244 7.375 3.718 -0.656 171 HE1 TRP 244 1HE TRP 244 6.502 1.734 -2.048 172 HE3 TRP 244 3HE TRP 244 6.312 0.510 3.153 173 HZ2 TRP 244 2HZ TRP 244 5.780 -1.024 -1.551 174 HZ3 TRP 244 3HZ TRP 244 5.802 -1.867 2.675 175 HH2 TRP 244 HH TRP 244 5.533 -2.623 0.292 176 H GLU 245 H GLU 245 4.433 4.876 1.150 177 HA GLU 245 HA GLU 245 2.675 3.368 2.990 178 1HB GLU 245 1HB GLU 245 1.956 4.814 0.446 179 2HB GLU 245 2HB GLU 245 0.899 3.851 1.499 180 1HG GLU 245 1HG GLU 245 1.770 5.443 3.402 181 2HG GLU 245 2HG GLU 245 2.164 6.533 2.072 182 HA PRO 246 HA PRO 246 3.398 -0.263 0.322 183 1HB PRO 246 1HB PRO 246 1.496 -1.871 1.672 184 2HB PRO 246 2HB PRO 246 3.231 -1.768 1.994 185 1HG PRO 246 1HG PRO 246 0.994 -0.603 3.532 186 2HG PRO 246 2HG PRO 246 2.657 -0.938 4.033 187 1HD PRO 246 1HD PRO 246 1.536 1.604 3.335 188 2HD PRO 246 2HD PRO 246 3.254 1.239 3.632 189 HA PRO 247 HA PRO 247 -0.113 -0.067 -2.397 190 1HB PRO 247 1HB PRO 247 -0.317 -2.607 -3.413 191 2HB PRO 247 2HB PRO 247 0.937 -1.437 -3.883 192 1HG PRO 247 1HG PRO 247 1.101 -3.773 -1.981 193 2HG PRO 247 2HG PRO 247 2.344 -3.186 -3.121 194 1HD PRO 247 1HD PRO 247 2.266 -2.647 -0.395 195 2HD PRO 247 2HD PRO 247 3.114 -1.615 -1.567 196 H VAL 248 H VAL 248 -2.144 -1.504 -3.119 197 HA VAL 248 HA VAL 248 -3.564 -2.604 -0.795 198 HB VAL 248 HB VAL 248 -5.492 -1.382 -1.791 199 1HG1 VAL 248 1HG1 VAL 248 -4.364 -0.584 0.257 200 2HG1 VAL 248 2HG1 VAL 248 -3.204 0.338 -0.733 201 3HG1 VAL 248 3HG1 VAL 248 -4.930 0.802 -0.702 202 1HG2 VAL 248 1HG2 VAL 248 -4.430 -0.785 -4.012 203 2HG2 VAL 248 2HG2 VAL 248 -5.273 0.546 -3.202 204 3HG2 VAL 248 3HG2 VAL 248 -3.496 0.472 -3.170 205 H ILE 249 H ILE 249 -5.636 -3.695 -1.630 206 HA ILE 249 HA ILE 249 -5.208 -5.242 -4.056 207 HB ILE 249 HB ILE 249 -5.102 -7.273 -2.832 208 1HG1 ILE 249 1HG1 ILE 249 -4.866 -6.855 -0.094 209 2HG1 ILE 249 2HG1 ILE 249 -6.156 -5.736 -0.501 210 1HG2 ILE 249 1HG2 ILE 249 -2.960 -6.021 -2.911 211 2HG2 ILE 249 2HG2 ILE 249 -3.286 -5.416 -1.269 212 3HG2 ILE 249 3HG2 ILE 249 -3.054 -7.157 -1.552 213 1HD1 ILE 249 1HD1 ILE 249 -7.112 -7.886 0.056 214 2HD1 ILE 249 2HD1 ILE 249 -7.313 -7.631 -1.673 215 3HD1 ILE 249 3HD1 ILE 249 -6.040 -8.712 -1.091 216 H GLN 250 H GLN 250 -7.161 -6.424 -4.524 217 HA GLN 250 HA GLN 250 -9.541 -4.818 -4.035 218 1HB GLN 250 1HB GLN 250 -8.784 -7.049 -5.857 219 2HB GLN 250 2HB GLN 250 -10.419 -7.195 -5.227 220 1HG GLN 250 1HG GLN 250 -9.331 -4.807 -6.722 221 2HG GLN 250 2HG GLN 250 -10.482 -6.010 -7.316 222 1HE2 GLN 250 1HE2 GLN 250 -12.571 -6.267 -5.832 223 2HE2 GLN 250 2HE2 GLN 250 -13.245 -4.682 -5.399 224 H ASN 251 H ASN 251 -11.031 -5.067 -2.488 225 HA ASN 251 HA ASN 251 -10.642 -6.916 -0.344 226 1HB ASN 251 1HB ASN 251 -11.761 -4.690 -0.134 227 2HB ASN 251 2HB ASN 251 -13.103 -5.322 -1.050 228 1HD2 ASN 251 1HD2 ASN 251 -13.459 -4.337 1.603 229 2HD2 ASN 251 2HD2 ASN 251 -13.759 -5.711 2.664 230 HA PRO 252 HA PRO 252 -12.618 -10.222 -2.769 231 1HB PRO 252 1HB PRO 252 -12.149 -12.344 -1.139 232 2HB PRO 252 2HB PRO 252 -10.817 -11.507 -1.998 233 1HG PRO 252 1HG PRO 252 -11.760 -11.023 0.864 234 2HG PRO 252 2HG PRO 252 -10.101 -11.378 0.305 235 1HD PRO 252 1HD PRO 252 -10.994 -8.835 0.702 236 2HD PRO 252 2HD PRO 252 -9.858 -9.223 -0.620 237 H GLU 253 H GLU 253 -13.675 -8.930 0.272 238 HA GLU 253 HA GLU 253 -16.092 -10.615 0.262 239 1HB GLU 253 1HB GLU 253 -14.402 -10.809 2.132 240 2HB GLU 253 2HB GLU 253 -14.867 -9.182 2.619 241 1HG GLU 253 1HG GLU 253 -17.033 -9.883 3.284 242 2HG GLU 253 2HG GLU 253 -16.993 -11.295 2.206 243 H TYR 254 H TYR 254 -15.056 -7.580 -0.627 244 HA TYR 254 HA TYR 254 -17.393 -6.070 0.283 245 1HB TYR 254 1HB TYR 254 -15.247 -4.938 0.025 246 2HB TYR 254 2HB TYR 254 -15.176 -5.404 -1.681 247 HD1 TYR 254 1HD TYR 254 -16.030 -3.926 -3.310 248 HD2 TYR 254 2HD TYR 254 -17.279 -3.551 0.807 249 HE1 TYR 254 1HE TYR 254 -17.368 -1.941 -3.909 250 HE2 TYR 254 2HE TYR 254 -18.674 -1.616 0.215 251 HH TYR 254 HH TYR 254 -19.581 -0.396 -1.557 252 H LYS 255 H LYS 255 -19.224 -7.206 -0.670 253 HA LYS 255 HA LYS 255 -19.206 -7.444 -3.620 254 1HB LYS 255 1HB LYS 255 -20.382 -9.108 -1.978 255 2HB LYS 255 2HB LYS 255 -21.738 -7.976 -2.071 256 1HG LYS 255 1HG LYS 255 -20.275 -9.115 -4.490 257 2HG LYS 255 2HG LYS 255 -21.690 -9.880 -3.794 258 1HD LYS 255 1HD LYS 255 -23.117 -8.051 -4.321 259 2HD LYS 255 2HD LYS 255 -21.794 -7.006 -4.800 260 1HE LYS 255 1HE LYS 255 -22.590 -9.498 -6.311 261 2HE LYS 255 2HE LYS 255 -22.969 -7.830 -6.758 262 1HZ LYS 255 1HZ LYS 255 -21.095 -8.460 -7.956 263 2HZ LYS 255 2HZ LYS 255 -20.499 -7.455 -6.774 264 3HZ LYS 255 3HZ LYS 255 -20.319 -9.094 -6.661 265 H GLY 256 H GLY 256 -18.663 -5.229 -3.816 266 1HA GLY 256 1HA GLY 256 -21.200 -3.971 -4.710 267 2HA GLY 256 2HA GLY 256 -19.612 -3.168 -4.815 Start of MODEL 3 1 H GLY 220 H GLY 220 -17.119 -1.201 9.304 2 1HA GLY 220 1HA GLY 220 -17.817 -3.836 8.158 3 2HA GLY 220 2HA GLY 220 -18.036 -2.294 7.323 4 H LYS 221 H LYS 221 -16.482 -4.519 6.336 5 HA LYS 221 HA LYS 221 -13.669 -3.729 6.531 6 1HB LYS 221 1HB LYS 221 -15.213 -5.486 4.581 7 2HB LYS 221 2HB LYS 221 -13.492 -5.153 4.471 8 1HG LYS 221 1HG LYS 221 -13.541 -5.979 6.981 9 2HG LYS 221 2HG LYS 221 -15.052 -6.747 6.492 10 1HD LYS 221 1HD LYS 221 -13.717 -7.873 4.608 11 2HD LYS 221 2HD LYS 221 -12.249 -7.220 5.379 12 1HE LYS 221 1HE LYS 221 -13.037 -8.302 7.545 13 2HE LYS 221 2HE LYS 221 -14.320 -9.092 6.621 14 1HZ LYS 221 1HZ LYS 221 -12.571 -10.200 5.323 15 2HZ LYS 221 2HZ LYS 221 -11.414 -9.466 6.289 16 3HZ LYS 221 3HZ LYS 221 -12.506 -10.537 6.908 17 HA PRO 222 HA PRO 222 -14.366 -0.401 3.564 18 1HB PRO 222 1HB PRO 222 -11.679 -0.222 2.649 19 2HB PRO 222 2HB PRO 222 -12.456 0.729 3.922 20 1HG PRO 222 1HG PRO 222 -10.497 -1.448 4.180 21 2HG PRO 222 2HG PRO 222 -11.075 -0.305 5.421 22 1HD PRO 222 1HD PRO 222 -11.792 -3.079 5.024 23 2HD PRO 222 2HD PRO 222 -12.363 -1.958 6.298 24 H GLU 223 H GLU 223 -13.890 -0.004 1.247 25 HA GLU 223 HA GLU 223 -14.623 -2.244 -0.335 26 1HB GLU 223 1HB GLU 223 -13.871 0.663 -0.832 27 2HB GLU 223 2HB GLU 223 -14.395 -0.418 -2.150 28 1HG GLU 223 1HG GLU 223 -16.501 -0.740 -1.277 29 2HG GLU 223 2HG GLU 223 -16.057 -0.393 0.376 30 H HIS 224 H HIS 224 -11.483 -0.959 0.531 31 HA HIS 224 HA HIS 224 -10.242 -3.026 -1.166 32 1HB HIS 224 1HB HIS 224 -9.058 -0.259 -0.709 33 2HB HIS 224 2HB HIS 224 -8.312 -1.594 -1.569 34 HD1 HIS 224 1HD HIS 224 -10.919 1.169 -2.148 35 HD2 HIS 224 2HD HIS 224 -9.388 -2.339 -3.955 36 HE1 HIS 224 1HE HIS 224 -11.665 1.210 -4.573 37 H ILE 225 H ILE 225 -7.975 -3.510 -0.216 38 HA ILE 225 HA ILE 225 -7.889 -3.257 2.719 39 HB ILE 225 HB ILE 225 -7.900 -5.731 0.985 40 1HG1 ILE 225 1HG1 ILE 225 -9.435 -4.600 3.349 41 2HG1 ILE 225 2HG1 ILE 225 -10.035 -5.151 1.781 42 1HG2 ILE 225 1HG2 ILE 225 -5.836 -5.873 2.398 43 2HG2 ILE 225 2HG2 ILE 225 -6.868 -5.694 3.839 44 3HG2 ILE 225 3HG2 ILE 225 -7.023 -7.096 2.770 45 1HD1 ILE 225 1HD1 ILE 225 -8.993 -6.787 4.067 46 2HD1 ILE 225 2HD1 ILE 225 -10.666 -6.708 3.482 47 3HD1 ILE 225 3HD1 ILE 225 -9.411 -7.474 2.461 48 HA PRO 226 HA PRO 226 -3.804 -2.172 1.207 49 1HB PRO 226 1HB PRO 226 -2.335 -2.020 3.408 50 2HB PRO 226 2HB PRO 226 -3.660 -0.844 3.097 51 1HG PRO 226 1HG PRO 226 -3.709 -3.177 5.002 52 2HG PRO 226 2HG PRO 226 -4.522 -1.595 5.150 53 1HD PRO 226 1HD PRO 226 -5.570 -4.076 4.224 54 2HD PRO 226 2HD PRO 226 -6.420 -2.531 4.116 55 H ASP 227 H ASP 227 -1.573 -2.927 1.207 56 HA ASP 227 HA ASP 227 -1.566 -5.859 0.922 57 1HB ASP 227 1HB ASP 227 -0.565 -4.452 -0.812 58 2HB ASP 227 2HB ASP 227 0.642 -3.877 0.328 59 HA PRO 228 HA PRO 228 0.216 -5.904 5.098 60 1HB PRO 228 1HB PRO 228 -0.094 -8.519 5.699 61 2HB PRO 228 2HB PRO 228 -1.535 -7.461 5.512 62 1HG PRO 228 1HG PRO 228 -0.353 -9.347 3.447 63 2HG PRO 228 2HG PRO 228 -2.051 -9.184 3.945 64 1HD PRO 228 1HD PRO 228 -1.022 -7.904 1.757 65 2HD PRO 228 2HD PRO 228 -2.342 -7.220 2.740 66 H ASP 229 H ASP 229 1.195 -7.943 2.389 67 HA ASP 229 HA ASP 229 3.416 -9.225 3.788 68 1HB ASP 229 1HB ASP 229 1.972 -10.377 2.103 69 2HB ASP 229 2HB ASP 229 2.608 -9.276 0.866 70 H ALA 230 H ALA 230 2.858 -6.654 1.441 71 HA ALA 230 HA ALA 230 5.521 -6.095 0.685 72 1HB ALA 230 1HB ALA 230 4.651 -3.844 0.157 73 2HB ALA 230 2HB ALA 230 3.577 -5.101 -0.407 74 3HB ALA 230 3HB ALA 230 3.161 -4.191 1.070 75 H LYS 231 H LYS 231 7.066 -4.773 1.468 76 HA LYS 231 HA LYS 231 6.723 -3.244 3.962 77 1HB LYS 231 1HB LYS 231 8.877 -5.285 3.312 78 2HB LYS 231 2HB LYS 231 9.286 -3.882 4.281 79 1HG LYS 231 1HG LYS 231 8.057 -4.475 6.067 80 2HG LYS 231 2HG LYS 231 6.848 -5.384 5.167 81 1HD LYS 231 1HD LYS 231 9.713 -6.395 5.346 82 2HD LYS 231 2HD LYS 231 8.541 -6.725 6.635 83 1HE LYS 231 1HE LYS 231 6.947 -7.651 4.968 84 2HE LYS 231 2HE LYS 231 8.109 -7.350 3.675 85 1HZ LYS 231 1HZ LYS 231 9.557 -8.929 4.578 86 2HZ LYS 231 2HZ LYS 231 8.738 -9.105 5.971 87 3HZ LYS 231 3HZ LYS 231 8.074 -9.633 4.531 88 H LYS 232 H LYS 232 8.116 -1.457 3.980 89 HA LYS 232 HA LYS 232 8.557 0.062 1.854 90 1HB LYS 232 1HB LYS 232 9.839 -0.077 4.501 91 2HB LYS 232 2HB LYS 232 10.953 0.543 3.276 92 1HG LYS 232 1HG LYS 232 9.159 2.078 2.484 93 2HG LYS 232 2HG LYS 232 8.324 1.726 4.021 94 1HD LYS 232 1HD LYS 232 11.158 2.818 3.723 95 2HD LYS 232 2HD LYS 232 9.720 3.752 4.021 96 1HE LYS 232 1HE LYS 232 10.299 3.533 6.188 97 2HE LYS 232 2HE LYS 232 9.428 1.998 6.052 98 1HZ LYS 232 1HZ LYS 232 11.632 1.831 7.049 99 2HZ LYS 232 2HZ LYS 232 11.602 0.912 5.687 100 3HZ LYS 232 3HZ LYS 232 12.342 2.416 5.718 101 HA PRO 233 HA PRO 233 11.251 -1.959 -0.908 102 1HB PRO 233 1HB PRO 233 12.363 0.617 -1.880 103 2HB PRO 233 2HB PRO 233 11.421 -0.624 -2.748 104 1HG PRO 233 1HG PRO 233 10.506 1.897 -1.768 105 2HG PRO 233 2HG PRO 233 9.488 0.610 -2.419 106 1HD PRO 233 1HD PRO 233 9.779 1.474 0.339 107 2HD PRO 233 2HD PRO 233 8.682 0.228 -0.333 108 H GLU 234 H GLU 234 13.313 -2.682 -0.957 109 HA GLU 234 HA GLU 234 15.194 -2.084 1.103 110 1HB GLU 234 1HB GLU 234 14.739 -4.144 -0.574 111 2HB GLU 234 2HB GLU 234 15.984 -3.374 -1.530 112 1HG GLU 234 1HG GLU 234 16.301 -4.175 1.406 113 2HG GLU 234 2HG GLU 234 16.658 -5.251 0.059 114 H ASP 235 H ASP 235 14.448 -0.560 -1.838 115 HA ASP 235 HA ASP 235 17.039 0.860 -2.187 116 1HB ASP 235 1HB ASP 235 16.212 -0.840 -3.850 117 2HB ASP 235 2HB ASP 235 14.799 0.160 -4.124 118 H TRP 236 H TRP 236 14.266 1.494 -0.623 119 HA TRP 236 HA TRP 236 13.215 3.891 -1.741 120 1HB TRP 236 1HB TRP 236 12.135 2.254 -0.103 121 2HB TRP 236 2HB TRP 236 13.215 2.882 1.124 122 HD1 TRP 236 HD TRP 236 12.114 4.571 2.608 123 HE1 TRP 236 1HE TRP 236 10.207 6.339 2.442 124 HE3 TRP 236 3HE TRP 236 11.017 4.031 -2.297 125 HZ2 TRP 236 2HZ TRP 236 8.426 7.313 0.434 126 HZ3 TRP 236 3HZ TRP 236 9.377 5.607 -3.398 127 HH2 TRP 236 HH TRP 236 8.035 7.180 -2.006 128 H ASP 237 H ASP 237 13.201 5.957 -0.267 129 HA ASP 237 HA ASP 237 15.829 6.517 0.999 130 1HB ASP 237 1HB ASP 237 14.583 8.235 -1.180 131 2HB ASP 237 2HB ASP 237 15.956 8.672 -0.150 132 H GLU 238 H GLU 238 14.603 6.442 2.986 133 HA GLU 238 HA GLU 238 12.363 8.088 3.557 134 1HB GLU 238 1HB GLU 238 14.425 6.533 5.082 135 2HB GLU 238 2HB GLU 238 13.578 7.791 5.997 136 1HG GLU 238 1HG GLU 238 11.446 6.883 5.566 137 2HG GLU 238 2HG GLU 238 12.042 5.799 4.323 138 H GLU 239 H GLU 239 15.635 9.173 3.022 139 HA GLU 239 HA GLU 239 15.227 11.613 4.591 140 1HB GLU 239 1HB GLU 239 17.411 10.177 4.196 141 2HB GLU 239 2HB GLU 239 17.545 11.081 2.697 142 1HG GLU 239 1HG GLU 239 17.044 12.435 5.358 143 2HG GLU 239 2HG GLU 239 18.658 11.868 4.973 144 H MET 240 H MET 240 14.889 10.405 1.287 145 HA MET 240 HA MET 240 14.810 13.143 0.173 146 1HB MET 240 1HB MET 240 14.961 10.408 -1.075 147 2HB MET 240 2HB MET 240 14.369 11.785 -1.982 148 1HG MET 240 1HG MET 240 16.695 11.542 -2.407 149 2HG MET 240 2HG MET 240 16.377 13.044 -1.542 150 1HE MET 240 1HE MET 240 18.406 9.286 -0.045 151 2HE MET 240 2HE MET 240 17.643 9.591 -1.620 152 3HE MET 240 3HE MET 240 19.312 10.109 -1.322 153 H ASP 241 H ASP 241 12.797 10.141 -0.096 154 HA ASP 241 HA ASP 241 10.581 11.805 -1.031 155 1HB ASP 241 1HB ASP 241 11.195 9.423 -1.894 156 2HB ASP 241 2HB ASP 241 10.410 8.842 -0.434 157 H GLY 242 H GLY 242 10.949 9.450 1.682 158 1HA GLY 242 1HA GLY 242 10.516 10.371 3.949 159 2HA GLY 242 2HA GLY 242 9.044 11.111 3.299 160 H GLU 243 H GLU 243 7.412 10.056 4.334 161 HA GLU 243 HA GLU 243 7.411 7.358 5.170 162 1HB GLU 243 1HB GLU 243 5.641 9.687 5.261 163 2HB GLU 243 2HB GLU 243 4.728 8.258 4.796 164 1HG GLU 243 1HG GLU 243 5.604 7.025 6.768 165 2HG GLU 243 2HG GLU 243 6.461 8.493 7.271 166 H TRP 244 H TRP 244 7.339 5.618 3.920 167 HA TRP 244 HA TRP 244 6.495 5.660 1.132 168 1HB TRP 244 1HB TRP 244 8.229 4.170 1.961 169 2HB TRP 244 2HB TRP 244 7.115 3.494 3.145 170 HD1 TRP 244 HD TRP 244 7.373 3.714 -0.708 171 HE1 TRP 244 1HE TRP 244 6.342 1.607 -1.728 172 HE3 TRP 244 3HE TRP 244 6.234 1.308 3.598 173 HZ2 TRP 244 2HZ TRP 244 5.543 -1.037 -0.734 174 HZ3 TRP 244 3HZ TRP 244 5.685 -1.105 3.577 175 HH2 TRP 244 HH TRP 244 5.186 -2.244 1.433 176 H GLU 245 H GLU 245 4.641 4.223 0.407 177 HA GLU 245 HA GLU 245 2.592 3.695 2.438 178 1HB GLU 245 1HB GLU 245 2.094 5.052 -0.246 179 2HB GLU 245 2HB GLU 245 0.884 4.071 0.592 180 1HG GLU 245 1HG GLU 245 1.363 5.607 2.650 181 2HG GLU 245 2HG GLU 245 2.096 6.700 1.480 182 HA PRO 246 HA PRO 246 3.161 -0.139 0.192 183 1HB PRO 246 1HB PRO 246 1.213 -1.683 1.384 184 2HB PRO 246 2HB PRO 246 2.778 -1.295 2.151 185 1HG PRO 246 1HG PRO 246 0.073 -0.006 2.582 186 2HG PRO 246 2HG PRO 246 1.339 -0.402 3.793 187 1HD PRO 246 1HD PRO 246 0.932 2.113 2.681 188 2HD PRO 246 2HD PRO 246 2.482 1.564 3.382 189 HA PRO 247 HA PRO 247 -0.171 -0.099 -2.833 190 1HB PRO 247 1HB PRO 247 -0.181 -3.013 -2.966 191 2HB PRO 247 2HB PRO 247 0.288 -1.848 -4.237 192 1HG PRO 247 1HG PRO 247 2.107 -3.481 -2.904 193 2HG PRO 247 2HG PRO 247 2.523 -1.878 -3.610 194 1HD PRO 247 1HD PRO 247 1.948 -2.629 -0.767 195 2HD PRO 247 2HD PRO 247 3.118 -1.459 -1.407 196 H VAL 248 H VAL 248 -2.404 -1.405 -3.294 197 HA VAL 248 HA VAL 248 -3.523 -2.606 -0.886 198 HB VAL 248 HB VAL 248 -5.557 -1.494 -1.553 199 1HG1 VAL 248 1HG1 VAL 248 -3.275 0.481 -1.189 200 2HG1 VAL 248 2HG1 VAL 248 -4.988 0.782 -0.787 201 3HG1 VAL 248 3HG1 VAL 248 -4.061 -0.429 0.102 202 1HG2 VAL 248 1HG2 VAL 248 -5.672 0.369 -3.140 203 2HG2 VAL 248 2HG2 VAL 248 -4.004 0.053 -3.645 204 3HG2 VAL 248 3HG2 VAL 248 -5.272 -1.147 -3.951 205 H ILE 249 H ILE 249 -5.558 -3.740 -1.501 206 HA ILE 249 HA ILE 249 -5.265 -5.344 -3.941 207 HB ILE 249 HB ILE 249 -5.145 -7.360 -2.695 208 1HG1 ILE 249 1HG1 ILE 249 -4.692 -6.895 0.002 209 2HG1 ILE 249 2HG1 ILE 249 -5.962 -5.755 -0.314 210 1HG2 ILE 249 1HG2 ILE 249 -2.986 -7.200 -1.599 211 2HG2 ILE 249 2HG2 ILE 249 -3.003 -6.110 -2.986 212 3HG2 ILE 249 3HG2 ILE 249 -3.176 -5.458 -1.336 213 1HD1 ILE 249 1HD1 ILE 249 -7.423 -7.534 -1.172 214 2HD1 ILE 249 2HD1 ILE 249 -6.110 -8.720 -0.988 215 3HD1 ILE 249 3HD1 ILE 249 -6.826 -7.955 0.441 216 H GLN 250 H GLN 250 -7.231 -5.806 -4.789 217 HA GLN 250 HA GLN 250 -9.637 -4.613 -3.823 218 1HB GLN 250 1HB GLN 250 -8.846 -6.419 -6.044 219 2HB GLN 250 2HB GLN 250 -10.476 -6.721 -5.459 220 1HG GLN 250 1HG GLN 250 -9.446 -3.962 -6.264 221 2HG GLN 250 2HG GLN 250 -10.335 -5.060 -7.325 222 1HE2 GLN 250 1HE2 GLN 250 -11.555 -2.684 -7.071 223 2HE2 GLN 250 2HE2 GLN 250 -12.953 -2.791 -6.034 224 H ASN 251 H ASN 251 -11.134 -5.274 -2.432 225 HA ASN 251 HA ASN 251 -10.232 -6.999 -0.405 226 1HB ASN 251 1HB ASN 251 -11.631 -5.000 -0.074 227 2HB ASN 251 2HB ASN 251 -12.989 -5.832 -0.836 228 1HD2 ASN 251 1HD2 ASN 251 -13.075 -4.746 1.850 229 2HD2 ASN 251 2HD2 ASN 251 -13.230 -6.141 2.904 230 HA PRO 252 HA PRO 252 -11.801 -10.849 -2.252 231 1HB PRO 252 1HB PRO 252 -11.237 -12.573 -0.165 232 2HB PRO 252 2HB PRO 252 -10.003 -11.939 -1.295 233 1HG PRO 252 1HG PRO 252 -10.718 -10.879 1.437 234 2HG PRO 252 2HG PRO 252 -9.083 -11.208 0.759 235 1HD PRO 252 1HD PRO 252 -10.095 -8.739 0.787 236 2HD PRO 252 2HD PRO 252 -9.162 -9.315 -0.622 237 H GLU 253 H GLU 253 -13.139 -9.369 0.603 238 HA GLU 253 HA GLU 253 -15.658 -10.022 -0.436 239 1HB GLU 253 1HB GLU 253 -14.990 -11.290 2.240 240 2HB GLU 253 2HB GLU 253 -16.574 -10.560 1.967 241 1HG GLU 253 1HG GLU 253 -16.478 -12.100 -0.224 242 2HG GLU 253 2HG GLU 253 -15.468 -13.075 0.842 243 H TYR 254 H TYR 254 -15.085 -7.765 -0.759 244 HA TYR 254 HA TYR 254 -15.732 -6.024 1.524 245 1HB TYR 254 1HB TYR 254 -14.978 -4.910 -0.566 246 2HB TYR 254 2HB TYR 254 -16.308 -5.629 -1.454 247 HD1 TYR 254 1HD TYR 254 -17.813 -3.881 -2.026 248 HD2 TYR 254 2HD TYR 254 -16.075 -3.894 1.938 249 HE1 TYR 254 1HE TYR 254 -19.133 -1.880 -1.421 250 HE2 TYR 254 2HE TYR 254 -17.432 -1.957 2.547 251 HH TYR 254 HH TYR 254 -18.633 0.107 0.386 252 H LYS 255 H LYS 255 -17.683 -6.216 2.582 253 HA LYS 255 HA LYS 255 -19.980 -7.442 1.243 254 1HB LYS 255 1HB LYS 255 -18.432 -8.976 2.835 255 2HB LYS 255 2HB LYS 255 -19.361 -8.172 4.108 256 1HG LYS 255 1HG LYS 255 -20.402 -10.180 3.681 257 2HG LYS 255 2HG LYS 255 -21.452 -9.018 2.851 258 1HD LYS 255 1HD LYS 255 -20.407 -9.583 0.719 259 2HD LYS 255 2HD LYS 255 -19.217 -10.619 1.479 260 1HE LYS 255 1HE LYS 255 -22.199 -11.171 1.711 261 2HE LYS 255 2HE LYS 255 -21.239 -11.761 0.347 262 1HZ LYS 255 1HZ LYS 255 -21.441 -13.368 2.201 263 2HZ LYS 255 2HZ LYS 255 -19.876 -13.016 1.805 264 3HZ LYS 255 3HZ LYS 255 -20.570 -12.381 3.150 265 H GLY 256 H GLY 256 -18.909 -6.094 4.462 266 1HA GLY 256 1HA GLY 256 -19.241 -3.502 3.936 267 2HA GLY 256 2HA GLY 256 -20.866 -3.982 4.439 Start of MODEL 4 1 H GLY 220 H GLY 220 -17.843 -2.943 10.149 2 1HA GLY 220 1HA GLY 220 -17.784 -4.722 8.524 3 2HA GLY 220 2HA GLY 220 -18.685 -3.346 7.849 4 H LYS 221 H LYS 221 -17.697 -5.063 6.037 5 HA LYS 221 HA LYS 221 -14.960 -4.956 5.454 6 1HB LYS 221 1HB LYS 221 -15.562 -5.928 3.299 7 2HB LYS 221 2HB LYS 221 -16.318 -6.755 4.644 8 1HG LYS 221 1HG LYS 221 -18.299 -4.966 3.946 9 2HG LYS 221 2HG LYS 221 -17.492 -5.240 2.404 10 1HD LYS 221 1HD LYS 221 -19.102 -6.837 2.329 11 2HD LYS 221 2HD LYS 221 -17.816 -7.810 3.044 12 1HE LYS 221 1HE LYS 221 -19.869 -6.268 4.718 13 2HE LYS 221 2HE LYS 221 -20.230 -7.854 4.065 14 1HZ LYS 221 1HZ LYS 221 -18.032 -7.315 5.974 15 2HZ LYS 221 2HZ LYS 221 -19.456 -8.090 6.272 16 3HZ LYS 221 3HZ LYS 221 -18.334 -8.748 5.276 17 HA PRO 222 HA PRO 222 -14.970 -0.887 3.467 18 1HB PRO 222 1HB PRO 222 -12.263 -0.840 2.719 19 2HB PRO 222 2HB PRO 222 -12.970 -0.339 4.267 20 1HG PRO 222 1HG PRO 222 -11.464 -2.840 3.579 21 2HG PRO 222 2HG PRO 222 -11.627 -2.068 5.168 22 1HD PRO 222 1HD PRO 222 -13.037 -4.328 4.123 23 2HD PRO 222 2HD PRO 222 -13.362 -3.531 5.660 24 H GLU 223 H GLU 223 -14.055 -0.042 1.346 25 HA GLU 223 HA GLU 223 -14.926 -1.607 -0.888 26 1HB GLU 223 1HB GLU 223 -13.032 0.790 -0.835 27 2HB GLU 223 2HB GLU 223 -13.934 0.171 -2.227 28 1HG GLU 223 1HG GLU 223 -16.059 0.731 -0.950 29 2HG GLU 223 2HG GLU 223 -15.036 1.570 0.227 30 H HIS 224 H HIS 224 -11.635 -0.835 0.351 31 HA HIS 224 HA HIS 224 -10.489 -3.006 -1.298 32 1HB HIS 224 1HB HIS 224 -9.037 -0.407 -0.754 33 2HB HIS 224 2HB HIS 224 -8.689 -1.624 -1.975 34 HD1 HIS 224 1HD HIS 224 -10.609 1.608 -1.476 35 HD2 HIS 224 2HD HIS 224 -10.486 -1.675 -4.148 36 HE1 HIS 224 1HE HIS 224 -12.070 2.244 -3.435 37 H ILE 225 H ILE 225 -8.331 -3.735 -0.329 38 HA ILE 225 HA ILE 225 -8.280 -3.399 2.622 39 HB ILE 225 HB ILE 225 -8.410 -5.831 0.869 40 1HG1 ILE 225 1HG1 ILE 225 -9.705 -4.686 3.365 41 2HG1 ILE 225 2HG1 ILE 225 -10.443 -5.048 1.826 42 1HG2 ILE 225 1HG2 ILE 225 -6.318 -6.142 2.268 43 2HG2 ILE 225 2HG2 ILE 225 -7.359 -6.096 3.702 44 3HG2 ILE 225 3HG2 ILE 225 -7.562 -7.344 2.462 45 1HD1 ILE 225 1HD1 ILE 225 -9.497 -6.942 3.959 46 2HD1 ILE 225 2HD1 ILE 225 -11.157 -6.666 3.423 47 3HD1 ILE 225 3HD1 ILE 225 -10.014 -7.505 2.334 48 HA PRO 226 HA PRO 226 -4.050 -2.356 1.735 49 1HB PRO 226 1HB PRO 226 -2.866 -2.772 4.142 50 2HB PRO 226 2HB PRO 226 -3.961 -1.396 3.817 51 1HG PRO 226 1HG PRO 226 -4.556 -3.935 5.306 52 2HG PRO 226 2HG PRO 226 -5.159 -2.283 5.616 53 1HD PRO 226 1HD PRO 226 -6.481 -4.346 4.284 54 2HD PRO 226 2HD PRO 226 -6.939 -2.650 4.146 55 H ASP 227 H ASP 227 -1.770 -3.298 1.977 56 HA ASP 227 HA ASP 227 -1.947 -6.199 1.283 57 1HB ASP 227 1HB ASP 227 -1.263 -4.636 -0.502 58 2HB ASP 227 2HB ASP 227 0.189 -4.263 0.425 59 HA PRO 228 HA PRO 228 0.220 -6.259 5.256 60 1HB PRO 228 1HB PRO 228 -0.023 -8.890 5.884 61 2HB PRO 228 2HB PRO 228 -1.437 -7.792 5.888 62 1HG PRO 228 1HG PRO 228 -0.542 -9.664 3.663 63 2HG PRO 228 2HG PRO 228 -2.173 -9.503 4.369 64 1HD PRO 228 1HD PRO 228 -1.455 -8.207 2.084 65 2HD PRO 228 2HD PRO 228 -2.543 -7.436 3.272 66 H ASP 229 H ASP 229 0.977 -8.408 2.505 67 HA ASP 229 HA ASP 229 3.482 -9.377 3.613 68 1HB ASP 229 1HB ASP 229 2.111 -10.694 2.023 69 2HB ASP 229 2HB ASP 229 2.417 -9.494 0.770 70 H ALA 230 H ALA 230 2.445 -6.849 1.312 71 HA ALA 230 HA ALA 230 5.020 -5.989 0.491 72 1HB ALA 230 1HB ALA 230 2.956 -5.344 -0.650 73 2HB ALA 230 2HB ALA 230 2.459 -4.403 0.786 74 3HB ALA 230 3HB ALA 230 3.897 -3.920 -0.154 75 H LYS 231 H LYS 231 6.492 -5.738 2.007 76 HA LYS 231 HA LYS 231 6.249 -3.784 4.231 77 1HB LYS 231 1HB LYS 231 8.372 -4.689 4.939 78 2HB LYS 231 2HB LYS 231 7.412 -6.086 4.430 79 1HG LYS 231 1HG LYS 231 8.541 -5.709 2.095 80 2HG LYS 231 2HG LYS 231 9.641 -4.646 2.982 81 1HD LYS 231 1HD LYS 231 10.406 -6.522 4.352 82 2HD LYS 231 2HD LYS 231 9.299 -7.610 3.446 83 1HE LYS 231 1HE LYS 231 10.310 -6.678 1.304 84 2HE LYS 231 2HE LYS 231 11.507 -5.835 2.308 85 1HZ LYS 231 1HZ LYS 231 11.142 -8.745 2.062 86 2HZ LYS 231 2HZ LYS 231 12.394 -7.839 1.468 87 3HZ LYS 231 3HZ LYS 231 12.222 -7.992 3.092 88 H LYS 232 H LYS 232 7.888 -1.988 4.224 89 HA LYS 232 HA LYS 232 8.300 -0.408 2.158 90 1HB LYS 232 1HB LYS 232 9.835 -0.870 4.613 91 2HB LYS 232 2HB LYS 232 10.898 -0.352 3.325 92 1HG LYS 232 1HG LYS 232 9.516 1.645 2.958 93 2HG LYS 232 2HG LYS 232 8.390 1.106 4.221 94 1HD LYS 232 1HD LYS 232 10.043 1.316 5.943 95 2HD LYS 232 2HD LYS 232 11.350 1.546 4.754 96 1HE LYS 232 1HE LYS 232 10.275 3.592 3.964 97 2HE LYS 232 2HE LYS 232 8.983 3.420 5.167 98 1HZ LYS 232 1HZ LYS 232 10.533 3.664 6.911 99 2HZ LYS 232 2HZ LYS 232 11.840 3.708 5.921 100 3HZ LYS 232 3HZ LYS 232 10.744 4.948 5.940 101 HA PRO 233 HA PRO 233 11.133 -2.181 -0.908 102 1HB PRO 233 1HB PRO 233 12.237 0.526 -1.367 103 2HB PRO 233 2HB PRO 233 11.366 -0.516 -2.513 104 1HG PRO 233 1HG PRO 233 10.282 1.791 -1.427 105 2HG PRO 233 2HG PRO 233 9.315 0.410 -1.955 106 1HD PRO 233 1HD PRO 233 10.147 1.168 0.832 107 2HD PRO 233 2HD PRO 233 8.613 0.468 0.254 108 H GLU 234 H GLU 234 13.177 -3.002 -0.514 109 HA GLU 234 HA GLU 234 14.676 -2.160 1.747 110 1HB GLU 234 1HB GLU 234 15.940 -3.987 1.229 111 2HB GLU 234 2HB GLU 234 14.333 -4.374 0.623 112 1HG GLU 234 1HG GLU 234 15.098 -3.800 -1.693 113 2HG GLU 234 2HG GLU 234 16.727 -3.593 -1.058 114 H ASP 235 H ASP 235 14.327 -1.082 -1.374 115 HA ASP 235 HA ASP 235 16.894 0.364 -1.620 116 1HB ASP 235 1HB ASP 235 15.813 -1.364 -3.310 117 2HB ASP 235 2HB ASP 235 14.858 0.029 -3.808 118 H TRP 236 H TRP 236 14.263 1.224 -0.073 119 HA TRP 236 HA TRP 236 13.154 3.459 -1.381 120 1HB TRP 236 1HB TRP 236 12.169 2.064 0.462 121 2HB TRP 236 2HB TRP 236 13.371 2.709 1.577 122 HD1 TRP 236 HD TRP 236 12.320 4.458 3.074 123 HE1 TRP 236 1HE TRP 236 10.405 6.276 2.867 124 HE3 TRP 236 3HE TRP 236 11.017 3.742 -1.787 125 HZ2 TRP 236 2HZ TRP 236 8.493 7.067 0.936 126 HZ3 TRP 236 3HZ TRP 236 9.177 5.087 -2.816 127 HH2 TRP 236 HH TRP 236 7.945 6.743 -1.458 128 H ASP 237 H ASP 237 13.328 5.702 -0.824 129 HA ASP 237 HA ASP 237 15.810 6.559 0.586 130 1HB ASP 237 1HB ASP 237 14.457 7.933 -1.773 131 2HB ASP 237 2HB ASP 237 15.639 8.647 -0.696 132 H GLU 238 H GLU 238 14.499 6.477 2.544 133 HA GLU 238 HA GLU 238 12.107 8.068 2.785 134 1HB GLU 238 1HB GLU 238 12.975 6.210 4.362 135 2HB GLU 238 2HB GLU 238 14.012 7.434 5.063 136 1HG GLU 238 1HG GLU 238 11.523 8.690 5.118 137 2HG GLU 238 2HG GLU 238 11.066 6.992 5.221 138 H GLU 239 H GLU 239 15.489 9.026 2.587 139 HA GLU 239 HA GLU 239 15.069 11.543 3.960 140 1HB GLU 239 1HB GLU 239 17.234 9.840 3.208 141 2HB GLU 239 2HB GLU 239 17.472 11.310 2.309 142 1HG GLU 239 1HG GLU 239 17.134 11.054 5.334 143 2HG GLU 239 2HG GLU 239 18.666 11.263 4.488 144 H MET 240 H MET 240 14.248 10.345 0.879 145 HA MET 240 HA MET 240 14.458 13.010 -0.449 146 1HB MET 240 1HB MET 240 14.402 10.172 -1.494 147 2HB MET 240 2HB MET 240 13.939 11.502 -2.484 148 1HG MET 240 1HG MET 240 16.268 11.046 -2.932 149 2HG MET 240 2HG MET 240 16.164 12.573 -2.067 150 1HE MET 240 1HE MET 240 18.422 12.914 -1.205 151 2HE MET 240 2HE MET 240 17.305 13.101 0.167 152 3HE MET 240 3HE MET 240 18.861 12.268 0.393 153 H ASP 241 H ASP 241 12.452 10.030 -0.195 154 HA ASP 241 HA ASP 241 10.127 11.573 -1.041 155 1HB ASP 241 1HB ASP 241 10.341 9.257 -1.872 156 2HB ASP 241 2HB ASP 241 10.267 8.654 -0.213 157 H GLY 242 H GLY 242 10.411 9.195 1.654 158 1HA GLY 242 1HA GLY 242 10.345 10.404 4.025 159 2HA GLY 242 2HA GLY 242 8.850 11.059 3.334 160 H GLU 243 H GLU 243 7.237 10.055 4.353 161 HA GLU 243 HA GLU 243 7.293 7.412 5.393 162 1HB GLU 243 1HB GLU 243 5.511 9.741 5.382 163 2HB GLU 243 2HB GLU 243 4.610 8.260 5.054 164 1HG GLU 243 1HG GLU 243 5.538 7.207 7.070 165 2HG GLU 243 2HG GLU 243 6.481 8.668 7.418 166 H TRP 244 H TRP 244 7.409 5.697 4.134 167 HA TRP 244 HA TRP 244 6.275 5.511 1.468 168 1HB TRP 244 1HB TRP 244 8.232 4.180 2.197 169 2HB TRP 244 2HB TRP 244 7.240 3.390 3.418 170 HD1 TRP 244 HD TRP 244 7.267 3.808 -0.446 171 HE1 TRP 244 1HE TRP 244 6.421 1.641 -1.512 172 HE3 TRP 244 3HE TRP 244 6.187 1.210 3.815 173 HZ2 TRP 244 2HZ TRP 244 5.439 -0.949 -0.597 174 HZ3 TRP 244 3HZ TRP 244 5.588 -1.174 3.709 175 HH2 TRP 244 HH TRP 244 5.028 -2.208 1.482 176 H GLU 245 H GLU 245 4.405 4.234 0.911 177 HA GLU 245 HA GLU 245 2.676 3.383 3.137 178 1HB GLU 245 1HB GLU 245 1.673 4.923 0.739 179 2HB GLU 245 2HB GLU 245 0.691 4.093 1.955 180 1HG GLU 245 1HG GLU 245 1.621 5.546 3.717 181 2HG GLU 245 2HG GLU 245 2.509 6.461 2.476 182 HA PRO 246 HA PRO 246 2.982 -0.171 0.487 183 1HB PRO 246 1HB PRO 246 0.963 -1.700 1.832 184 2HB PRO 246 2HB PRO 246 2.718 -1.750 2.074 185 1HG PRO 246 1HG PRO 246 0.653 -0.455 3.743 186 2HG PRO 246 2HG PRO 246 2.329 -0.895 4.155 187 1HD PRO 246 1HD PRO 246 1.372 1.713 3.625 188 2HD PRO 246 2HD PRO 246 3.080 1.197 3.689 189 HA PRO 247 HA PRO 247 -0.454 -0.109 -2.327 190 1HB PRO 247 1HB PRO 247 -0.558 -2.688 -3.254 191 2HB PRO 247 2HB PRO 247 0.636 -1.495 -3.786 192 1HG PRO 247 1HG PRO 247 0.929 -3.736 -1.786 193 2HG PRO 247 2HG PRO 247 2.150 -3.123 -2.933 194 1HD PRO 247 1HD PRO 247 2.031 -2.476 -0.230 195 2HD PRO 247 2HD PRO 247 2.818 -1.459 -1.452 196 H VAL 248 H VAL 248 -2.423 -1.749 -2.953 197 HA VAL 248 HA VAL 248 -3.685 -2.736 -0.501 198 HB VAL 248 HB VAL 248 -5.752 -1.864 -1.577 199 1HG1 VAL 248 1HG1 VAL 248 -5.417 0.474 -0.724 200 2HG1 VAL 248 2HG1 VAL 248 -4.735 -0.755 0.364 201 3HG1 VAL 248 3HG1 VAL 248 -3.662 0.153 -0.708 202 1HG2 VAL 248 1HG2 VAL 248 -4.871 -1.415 -3.863 203 2HG2 VAL 248 2HG2 VAL 248 -5.755 -0.056 -3.163 204 3HG2 VAL 248 3HG2 VAL 248 -3.988 -0.013 -3.212 205 H ILE 249 H ILE 249 -5.762 -3.942 -1.361 206 HA ILE 249 HA ILE 249 -5.275 -5.507 -3.767 207 HB ILE 249 HB ILE 249 -5.514 -7.576 -2.737 208 1HG1 ILE 249 1HG1 ILE 249 -5.947 -6.569 0.072 209 2HG1 ILE 249 2HG1 ILE 249 -7.329 -6.737 -0.984 210 1HG2 ILE 249 1HG2 ILE 249 -3.667 -7.759 -1.124 211 2HG2 ILE 249 2HG2 ILE 249 -3.275 -6.533 -2.330 212 3HG2 ILE 249 3HG2 ILE 249 -3.808 -6.031 -0.718 213 1HD1 ILE 249 1HD1 ILE 249 -7.017 -8.753 0.369 214 2HD1 ILE 249 2HD1 ILE 249 -6.920 -9.084 -1.366 215 3HD1 ILE 249 3HD1 ILE 249 -5.439 -9.036 -0.402 216 H GLN 250 H GLN 250 -7.244 -6.184 -4.650 217 HA GLN 250 HA GLN 250 -9.746 -4.898 -4.028 218 1HB GLN 250 1HB GLN 250 -9.075 -7.507 -5.478 219 2HB GLN 250 2HB GLN 250 -10.705 -6.846 -5.383 220 1HG GLN 250 1HG GLN 250 -8.376 -5.271 -6.581 221 2HG GLN 250 2HG GLN 250 -9.318 -6.417 -7.509 222 1HE2 GLN 250 1HE2 GLN 250 -11.415 -4.717 -5.190 223 2HE2 GLN 250 2HE2 GLN 250 -12.001 -3.585 -6.315 224 H ASN 251 H ASN 251 -11.239 -5.480 -2.544 225 HA ASN 251 HA ASN 251 -10.396 -7.116 -0.305 226 1HB ASN 251 1HB ASN 251 -11.609 -4.984 -0.012 227 2HB ASN 251 2HB ASN 251 -12.960 -5.640 -0.900 228 1HD2 ASN 251 1HD2 ASN 251 -13.589 -4.696 1.571 229 2HD2 ASN 251 2HD2 ASN 251 -13.729 -6.022 2.727 230 HA PRO 252 HA PRO 252 -12.371 -10.661 -2.334 231 1HB PRO 252 1HB PRO 252 -11.742 -12.619 -0.541 232 2HB PRO 252 2HB PRO 252 -10.525 -11.828 -1.593 233 1HG PRO 252 1HG PRO 252 -11.156 -11.124 1.281 234 2HG PRO 252 2HG PRO 252 -9.553 -11.463 0.533 235 1HD PRO 252 1HD PRO 252 -10.468 -8.924 0.804 236 2HD PRO 252 2HD PRO 252 -9.530 -9.432 -0.633 237 H GLU 253 H GLU 253 -13.451 -9.103 0.510 238 HA GLU 253 HA GLU 253 -15.825 -10.878 0.752 239 1HB GLU 253 1HB GLU 253 -14.157 -10.188 2.733 240 2HB GLU 253 2HB GLU 253 -15.197 -8.759 2.780 241 1HG GLU 253 1HG GLU 253 -17.182 -10.301 2.967 242 2HG GLU 253 2HG GLU 253 -16.087 -11.688 2.982 243 H TYR 254 H TYR 254 -14.796 -7.772 -0.472 244 HA TYR 254 HA TYR 254 -17.337 -6.392 -0.032 245 1HB TYR 254 1HB TYR 254 -15.117 -5.249 -0.089 246 2HB TYR 254 2HB TYR 254 -14.959 -5.701 -1.788 247 HD1 TYR 254 1HD TYR 254 -15.264 -3.941 -3.236 248 HD2 TYR 254 2HD TYR 254 -17.452 -3.947 0.487 249 HE1 TYR 254 1HE TYR 254 -16.262 -1.820 -3.852 250 HE2 TYR 254 2HE TYR 254 -18.440 -1.762 -0.103 251 HH TYR 254 HH TYR 254 -17.455 0.034 -2.977 252 H LYS 255 H LYS 255 -18.396 -5.413 -2.158 253 HA LYS 255 HA LYS 255 -18.084 -7.155 -4.507 254 1HB LYS 255 1HB LYS 255 -20.795 -6.423 -3.345 255 2HB LYS 255 2HB LYS 255 -20.520 -6.824 -5.033 256 1HG LYS 255 1HG LYS 255 -21.083 -8.892 -4.301 257 2HG LYS 255 2HG LYS 255 -19.328 -8.970 -4.105 258 1HD LYS 255 1HD LYS 255 -19.843 -8.086 -1.668 259 2HD LYS 255 2HD LYS 255 -21.504 -8.588 -2.028 260 1HE LYS 255 1HE LYS 255 -20.592 -10.528 -1.032 261 2HE LYS 255 2HE LYS 255 -20.405 -10.856 -2.765 262 1HZ LYS 255 1HZ LYS 255 -18.338 -9.857 -0.890 263 2HZ LYS 255 2HZ LYS 255 -18.326 -11.307 -1.616 264 3HZ LYS 255 3HZ LYS 255 -18.097 -9.929 -2.500 265 H GLY 256 H GLY 256 -16.545 -5.325 -4.704 266 1HA GLY 256 1HA GLY 256 -17.819 -3.391 -6.563 267 2HA GLY 256 2HA GLY 256 -16.104 -3.362 -6.037 Start of MODEL 5 1 H GLY 220 H GLY 220 -19.473 -1.069 8.529 2 1HA GLY 220 1HA GLY 220 -19.763 -3.362 7.683 3 2HA GLY 220 2HA GLY 220 -20.196 -2.651 6.125 4 H LYS 221 H LYS 221 -18.452 -3.847 5.215 5 HA LYS 221 HA LYS 221 -15.724 -3.405 6.149 6 1HB LYS 221 1HB LYS 221 -17.123 -5.552 4.959 7 2HB LYS 221 2HB LYS 221 -16.157 -4.943 3.615 8 1HG LYS 221 1HG LYS 221 -14.257 -5.788 4.459 9 2HG LYS 221 2HG LYS 221 -14.547 -5.191 6.063 10 1HD LYS 221 1HD LYS 221 -15.737 -7.086 6.748 11 2HD LYS 221 2HD LYS 221 -16.058 -7.616 5.083 12 1HE LYS 221 1HE LYS 221 -13.806 -8.254 4.680 13 2HE LYS 221 2HE LYS 221 -13.216 -7.306 6.054 14 1HZ LYS 221 1HZ LYS 221 -14.007 -8.854 7.552 15 2HZ LYS 221 2HZ LYS 221 -14.869 -9.716 6.416 16 3HZ LYS 221 3HZ LYS 221 -13.233 -9.725 6.411 17 HA PRO 222 HA PRO 222 -14.987 -0.258 3.192 18 1HB PRO 222 1HB PRO 222 -12.250 -0.428 2.747 19 2HB PRO 222 2HB PRO 222 -13.033 0.228 4.191 20 1HG PRO 222 1HG PRO 222 -11.748 -2.470 3.725 21 2HG PRO 222 2HG PRO 222 -11.792 -1.528 5.241 22 1HD PRO 222 1HD PRO 222 -13.427 -3.708 4.490 23 2HD PRO 222 2HD PRO 222 -13.747 -2.621 5.847 24 H GLU 223 H GLU 223 -13.895 0.271 1.191 25 HA GLU 223 HA GLU 223 -14.702 -1.371 -0.991 26 1HB GLU 223 1HB GLU 223 -12.727 0.914 -1.000 27 2HB GLU 223 2HB GLU 223 -13.698 0.356 -2.379 28 1HG GLU 223 1HG GLU 223 -15.750 1.099 -1.110 29 2HG GLU 223 2HG GLU 223 -14.708 1.725 0.179 30 H HIS 224 H HIS 224 -11.497 -0.749 0.427 31 HA HIS 224 HA HIS 224 -10.332 -2.968 -1.149 32 1HB HIS 224 1HB HIS 224 -8.891 -0.336 -0.594 33 2HB HIS 224 2HB HIS 224 -8.396 -1.653 -1.653 34 HD1 HIS 224 1HD HIS 224 -10.550 1.504 -1.660 35 HD2 HIS 224 2HD HIS 224 -9.917 -1.980 -3.982 36 HE1 HIS 224 1HE HIS 224 -11.744 1.879 -3.848 37 H ILE 225 H ILE 225 -8.221 -3.710 -0.187 38 HA ILE 225 HA ILE 225 -8.023 -3.378 2.731 39 HB ILE 225 HB ILE 225 -8.286 -5.882 1.081 40 1HG1 ILE 225 1HG1 ILE 225 -9.537 -4.582 3.537 41 2HG1 ILE 225 2HG1 ILE 225 -10.281 -5.031 2.020 42 1HG2 ILE 225 1HG2 ILE 225 -7.444 -7.319 2.775 43 2HG2 ILE 225 2HG2 ILE 225 -6.177 -6.178 2.457 44 3HG2 ILE 225 3HG2 ILE 225 -7.183 -5.996 3.917 45 1HD1 ILE 225 1HD1 ILE 225 -9.371 -6.781 4.242 46 2HD1 ILE 225 2HD1 ILE 225 -11.031 -6.522 3.668 47 3HD1 ILE 225 3HD1 ILE 225 -9.871 -7.443 2.657 48 HA PRO 226 HA PRO 226 -3.911 -2.475 1.372 49 1HB PRO 226 1HB PRO 226 -2.503 -2.507 3.649 50 2HB PRO 226 2HB PRO 226 -3.814 -1.293 3.370 51 1HG PRO 226 1HG PRO 226 -3.940 -3.795 5.052 52 2HG PRO 226 2HG PRO 226 -4.630 -2.181 5.368 53 1HD PRO 226 1HD PRO 226 -5.974 -4.359 4.275 54 2HD PRO 226 2HD PRO 226 -6.548 -2.687 4.165 55 H ASP 227 H ASP 227 -1.655 -3.389 1.486 56 HA ASP 227 HA ASP 227 -1.754 -6.379 1.450 57 1HB ASP 227 1HB ASP 227 -1.123 -5.214 -0.631 58 2HB ASP 227 2HB ASP 227 0.301 -4.576 0.201 59 HA PRO 228 HA PRO 228 0.564 -5.446 5.316 60 1HB PRO 228 1HB PRO 228 -0.142 -7.609 6.756 61 2HB PRO 228 2HB PRO 228 -1.327 -6.318 6.417 62 1HG PRO 228 1HG PRO 228 -0.954 -8.942 4.912 63 2HG PRO 228 2HG PRO 228 -2.473 -8.240 5.556 64 1HD PRO 228 1HD PRO 228 -1.715 -7.890 2.944 65 2HD PRO 228 2HD PRO 228 -2.554 -6.636 3.875 66 H ASP 229 H ASP 229 0.739 -8.087 3.075 67 HA ASP 229 HA ASP 229 3.144 -9.268 4.358 68 1HB ASP 229 1HB ASP 229 1.535 -10.744 3.178 69 2HB ASP 229 2HB ASP 229 1.954 -9.963 1.662 70 H ALA 230 H ALA 230 2.336 -7.081 1.728 71 HA ALA 230 HA ALA 230 4.883 -6.770 0.545 72 1HB ALA 230 1HB ALA 230 2.830 -5.693 -0.322 73 2HB ALA 230 2HB ALA 230 2.756 -4.677 1.144 74 3HB ALA 230 3HB ALA 230 4.087 -4.483 -0.030 75 H LYS 231 H LYS 231 6.723 -5.686 1.127 76 HA LYS 231 HA LYS 231 6.775 -4.049 3.581 77 1HB LYS 231 1HB LYS 231 8.866 -5.105 4.253 78 2HB LYS 231 2HB LYS 231 7.493 -6.207 4.203 79 1HG LYS 231 1HG LYS 231 9.228 -7.489 3.448 80 2HG LYS 231 2HG LYS 231 8.373 -7.089 1.977 81 1HD LYS 231 1HD LYS 231 10.122 -5.531 1.315 82 2HD LYS 231 2HD LYS 231 10.871 -5.606 2.940 83 1HE LYS 231 1HE LYS 231 11.388 -7.978 2.623 84 2HE LYS 231 2HE LYS 231 10.518 -8.014 1.089 85 1HZ LYS 231 1HZ LYS 231 12.928 -6.386 1.594 86 2HZ LYS 231 2HZ LYS 231 12.915 -7.830 0.800 87 3HZ LYS 231 3HZ LYS 231 12.120 -6.529 0.172 88 H LYS 232 H LYS 232 8.131 -2.349 3.504 89 HA LYS 232 HA LYS 232 8.528 -1.026 1.204 90 1HB LYS 232 1HB LYS 232 9.645 0.659 2.471 91 2HB LYS 232 2HB LYS 232 8.498 -0.116 3.532 92 1HG LYS 232 1HG LYS 232 10.216 -1.373 4.629 93 2HG LYS 232 2HG LYS 232 11.431 -0.851 3.467 94 1HD LYS 232 1HD LYS 232 11.698 0.429 5.508 95 2HD LYS 232 2HD LYS 232 11.243 1.471 4.174 96 1HE LYS 232 1HE LYS 232 10.103 2.143 6.206 97 2HE LYS 232 2HE LYS 232 8.905 1.576 5.027 98 1HZ LYS 232 1HZ LYS 232 8.541 -0.316 6.286 99 2HZ LYS 232 2HZ LYS 232 9.987 -0.273 7.046 100 3HZ LYS 232 3HZ LYS 232 8.785 0.790 7.454 101 HA PRO 233 HA PRO 233 12.249 -2.054 -0.931 102 1HB PRO 233 1HB PRO 233 13.131 0.763 -1.110 103 2HB PRO 233 2HB PRO 233 12.642 -0.333 -2.412 104 1HG PRO 233 1HG PRO 233 11.125 1.792 -1.560 105 2HG PRO 233 2HG PRO 233 10.420 0.313 -2.222 106 1HD PRO 233 1HD PRO 233 10.656 1.150 0.654 107 2HD PRO 233 2HD PRO 233 9.340 0.288 -0.183 108 H GLU 234 H GLU 234 14.478 -1.883 -1.118 109 HA GLU 234 HA GLU 234 16.122 -1.176 1.226 110 1HB GLU 234 1HB GLU 234 16.362 -2.698 -1.345 111 2HB GLU 234 2HB GLU 234 17.840 -1.904 -0.732 112 1HG GLU 234 1HG GLU 234 17.621 -3.038 1.428 113 2HG GLU 234 2HG GLU 234 16.066 -3.708 0.929 114 H ASP 235 H ASP 235 15.384 -0.165 -2.197 115 HA ASP 235 HA ASP 235 17.024 2.227 -1.875 116 1HB ASP 235 1HB ASP 235 15.432 1.043 -4.193 117 2HB ASP 235 2HB ASP 235 16.409 2.509 -4.268 118 H TRP 236 H TRP 236 15.105 2.380 -0.016 119 HA TRP 236 HA TRP 236 13.126 4.270 -1.028 120 1HB TRP 236 1HB TRP 236 12.493 2.380 0.626 121 2HB TRP 236 2HB TRP 236 13.481 3.234 1.818 122 HD1 TRP 236 HD TRP 236 11.927 4.601 3.347 123 HE1 TRP 236 1HE TRP 236 9.919 6.238 2.999 124 HE3 TRP 236 3HE TRP 236 11.225 3.901 -1.609 125 HZ2 TRP 236 2HZ TRP 236 8.101 6.902 0.870 126 HZ3 TRP 236 3HZ TRP 236 9.358 5.115 -2.827 127 HH2 TRP 236 HH TRP 236 7.803 6.551 -1.578 128 H ASP 237 H ASP 237 13.035 6.374 -0.122 129 HA ASP 237 HA ASP 237 15.613 7.380 0.961 130 1HB ASP 237 1HB ASP 237 14.010 8.536 -1.356 131 2HB ASP 237 2HB ASP 237 15.400 9.292 -0.574 132 H GLU 238 H GLU 238 14.431 7.430 3.012 133 HA GLU 238 HA GLU 238 11.871 8.642 3.300 134 1HB GLU 238 1HB GLU 238 14.165 8.375 5.271 135 2HB GLU 238 2HB GLU 238 12.530 8.856 5.706 136 1HG GLU 238 1HG GLU 238 11.612 6.748 4.946 137 2HG GLU 238 2HG GLU 238 13.193 6.204 4.386 138 H GLU 239 H GLU 239 15.054 10.142 3.000 139 HA GLU 239 HA GLU 239 14.142 12.681 4.055 140 1HB GLU 239 1HB GLU 239 16.478 11.518 4.090 141 2HB GLU 239 2HB GLU 239 16.675 12.203 2.470 142 1HG GLU 239 1HG GLU 239 16.420 14.446 3.352 143 2HG GLU 239 2HG GLU 239 15.934 13.820 4.938 144 H MET 240 H MET 240 13.890 11.084 1.095 145 HA MET 240 HA MET 240 13.575 13.576 -0.548 146 1HB MET 240 1HB MET 240 13.526 10.652 -1.343 147 2HB MET 240 2HB MET 240 13.206 11.949 -2.435 148 1HG MET 240 1HG MET 240 15.853 11.768 -0.968 149 2HG MET 240 2HG MET 240 15.528 10.810 -2.386 150 1HE MET 240 1HE MET 240 16.307 15.336 -2.345 151 2HE MET 240 2HE MET 240 14.723 14.785 -1.784 152 3HE MET 240 3HE MET 240 16.194 14.263 -0.922 153 H ASP 241 H ASP 241 11.923 10.457 0.059 154 HA ASP 241 HA ASP 241 9.455 11.646 -0.913 155 1HB ASP 241 1HB ASP 241 10.237 9.343 -1.627 156 2HB ASP 241 2HB ASP 241 9.886 8.777 0.020 157 H GLY 242 H GLY 242 10.217 9.617 1.974 158 1HA GLY 242 1HA GLY 242 9.606 10.731 4.215 159 2HA GLY 242 2HA GLY 242 8.024 11.000 3.463 160 H GLU 243 H GLU 243 6.651 9.607 4.494 161 HA GLU 243 HA GLU 243 7.394 6.936 5.291 162 1HB GLU 243 1HB GLU 243 5.095 8.805 5.612 163 2HB GLU 243 2HB GLU 243 4.628 7.153 5.295 164 1HG GLU 243 1HG GLU 243 6.435 6.567 7.164 165 2HG GLU 243 2HG GLU 243 6.185 8.251 7.626 166 H TRP 244 H TRP 244 7.243 5.186 4.103 167 HA TRP 244 HA TRP 244 6.267 5.102 1.368 168 1HB TRP 244 1HB TRP 244 8.142 3.690 2.247 169 2HB TRP 244 2HB TRP 244 7.020 2.934 3.373 170 HD1 TRP 244 HD TRP 244 7.265 3.377 -0.483 171 HE1 TRP 244 1HE TRP 244 6.574 1.189 -1.613 172 HE3 TRP 244 3HE TRP 244 6.164 0.627 3.682 173 HZ2 TRP 244 2HZ TRP 244 5.784 -1.476 -0.803 174 HZ3 TRP 244 3HZ TRP 244 5.707 -1.794 3.498 175 HH2 TRP 244 HH TRP 244 5.371 -2.825 1.242 176 H GLU 245 H GLU 245 4.397 3.746 0.778 177 HA GLU 245 HA GLU 245 2.654 2.933 3.015 178 1HB GLU 245 1HB GLU 245 1.648 4.127 0.406 179 2HB GLU 245 2HB GLU 245 0.688 3.222 1.591 180 1HG GLU 245 1HG GLU 245 1.572 5.013 3.293 181 2HG GLU 245 2HG GLU 245 1.881 5.994 1.837 182 HA PRO 246 HA PRO 246 3.169 -0.851 0.598 183 1HB PRO 246 1HB PRO 246 1.188 -2.326 1.947 184 2HB PRO 246 2HB PRO 246 2.920 -2.249 2.359 185 1HG PRO 246 1HG PRO 246 0.607 -0.870 3.646 186 2HG PRO 246 2HG PRO 246 2.166 -1.324 4.369 187 1HD PRO 246 1HD PRO 246 1.405 1.240 3.554 188 2HD PRO 246 2HD PRO 246 3.090 0.707 3.820 189 HA PRO 247 HA PRO 247 -0.173 -0.453 -2.256 190 1HB PRO 247 1HB PRO 247 -0.382 -3.002 -3.330 191 2HB PRO 247 2HB PRO 247 0.868 -1.828 -3.744 192 1HG PRO 247 1HG PRO 247 1.023 -4.225 -1.945 193 2HG PRO 247 2HG PRO 247 2.327 -3.509 -2.909 194 1HD PRO 247 1HD PRO 247 1.943 -3.146 -0.165 195 2HD PRO 247 2HD PRO 247 2.976 -2.133 -1.205 196 H VAL 248 H VAL 248 -2.245 -1.829 -3.088 197 HA VAL 248 HA VAL 248 -3.674 -2.867 -0.743 198 HB VAL 248 HB VAL 248 -5.597 -1.739 -1.765 199 1HG1 VAL 248 1HG1 VAL 248 -4.442 -0.756 0.179 200 2HG1 VAL 248 2HG1 VAL 248 -3.325 0.100 -0.910 201 3HG1 VAL 248 3HG1 VAL 248 -5.062 0.514 -0.885 202 1HG2 VAL 248 1HG2 VAL 248 -4.647 -1.329 -4.062 203 2HG2 VAL 248 2HG2 VAL 248 -5.468 0.061 -3.326 204 3HG2 VAL 248 3HG2 VAL 248 -3.698 -0.007 -3.356 205 H ILE 249 H ILE 249 -5.681 -3.988 -1.437 206 HA ILE 249 HA ILE 249 -5.394 -5.635 -3.820 207 HB ILE 249 HB ILE 249 -5.534 -7.609 -2.616 208 1HG1 ILE 249 1HG1 ILE 249 -5.931 -6.398 0.131 209 2HG1 ILE 249 2HG1 ILE 249 -7.323 -6.676 -0.891 210 1HG2 ILE 249 1HG2 ILE 249 -3.677 -7.653 -0.961 211 2HG2 ILE 249 2HG2 ILE 249 -3.280 -6.559 -2.308 212 3HG2 ILE 249 3HG2 ILE 249 -3.793 -5.913 -0.742 213 1HD1 ILE 249 1HD1 ILE 249 -6.976 -8.565 0.607 214 2HD1 ILE 249 2HD1 ILE 249 -6.864 -9.045 -1.103 215 3HD1 ILE 249 3HD1 ILE 249 -5.399 -8.870 -0.128 216 H GLN 250 H GLN 250 -7.530 -6.497 -4.334 217 HA GLN 250 HA GLN 250 -9.819 -4.724 -3.799 218 1HB GLN 250 1HB GLN 250 -9.534 -7.475 -5.070 219 2HB GLN 250 2HB GLN 250 -11.104 -6.765 -4.764 220 1HG GLN 250 1HG GLN 250 -8.989 -5.298 -6.390 221 2HG GLN 250 2HG GLN 250 -10.097 -6.475 -7.105 222 1HE2 GLN 250 1HE2 GLN 250 -12.404 -6.062 -7.049 223 2HE2 GLN 250 2HE2 GLN 250 -13.029 -4.431 -6.846 224 H ASN 251 H ASN 251 -11.269 -4.950 -2.077 225 HA ASN 251 HA ASN 251 -10.593 -6.734 0.104 226 1HB ASN 251 1HB ASN 251 -11.744 -4.601 0.584 227 2HB ASN 251 2HB ASN 251 -13.026 -5.080 -0.504 228 1HD2 ASN 251 1HD2 ASN 251 -14.295 -4.539 1.587 229 2HD2 ASN 251 2HD2 ASN 251 -14.671 -5.939 2.563 230 HA PRO 252 HA PRO 252 -12.616 -10.114 -2.128 231 1HB PRO 252 1HB PRO 252 -12.534 -12.011 -0.098 232 2HB PRO 252 2HB PRO 252 -11.165 -11.632 -1.218 233 1HG PRO 252 1HG PRO 252 -11.664 -10.648 1.607 234 2HG PRO 252 2HG PRO 252 -10.126 -11.191 0.851 235 1HD PRO 252 1HD PRO 252 -10.762 -8.562 1.107 236 2HD PRO 252 2HD PRO 252 -9.854 -9.180 -0.300 237 H GLU 253 H GLU 253 -13.726 -8.832 0.969 238 HA GLU 253 HA GLU 253 -16.276 -10.283 0.818 239 1HB GLU 253 1HB GLU 253 -14.670 -9.427 2.878 240 2HB GLU 253 2HB GLU 253 -15.787 -8.089 2.806 241 1HG GLU 253 1HG GLU 253 -16.508 -11.041 3.158 242 2HG GLU 253 2HG GLU 253 -16.399 -9.860 4.436 243 H TYR 254 H TYR 254 -14.973 -7.311 -0.409 244 HA TYR 254 HA TYR 254 -17.283 -5.623 0.029 245 1HB TYR 254 1HB TYR 254 -15.103 -4.647 -0.221 246 2HB TYR 254 2HB TYR 254 -14.865 -5.378 -1.799 247 HD1 TYR 254 1HD TYR 254 -17.222 -3.098 0.047 248 HD2 TYR 254 2HD TYR 254 -15.086 -3.922 -3.619 249 HE1 TYR 254 1HE TYR 254 -17.935 -0.903 -0.846 250 HE2 TYR 254 2HE TYR 254 -15.732 -1.699 -4.496 251 HH TYR 254 HH TYR 254 -16.456 0.478 -3.701 252 H LYS 255 H LYS 255 -19.163 -6.464 -0.996 253 HA LYS 255 HA LYS 255 -18.985 -7.416 -3.783 254 1HB LYS 255 1HB LYS 255 -20.285 -8.507 -1.777 255 2HB LYS 255 2HB LYS 255 -21.547 -7.334 -2.198 256 1HG LYS 255 1HG LYS 255 -20.311 -8.941 -4.451 257 2HG LYS 255 2HG LYS 255 -21.281 -9.834 -3.284 258 1HD LYS 255 1HD LYS 255 -23.239 -8.658 -3.719 259 2HD LYS 255 2HD LYS 255 -22.389 -7.298 -4.451 260 1HE LYS 255 1HE LYS 255 -22.412 -10.059 -5.709 261 2HE LYS 255 2HE LYS 255 -23.648 -8.851 -6.048 262 1HZ LYS 255 1HZ LYS 255 -21.981 -8.752 -7.690 263 2HZ LYS 255 2HZ LYS 255 -21.847 -7.361 -6.803 264 3HZ LYS 255 3HZ LYS 255 -20.772 -8.605 -6.610 265 H GLY 256 H GLY 256 -19.209 -4.416 -2.265 266 1HA GLY 256 1HA GLY 256 -19.035 -2.554 -3.839 267 2HA GLY 256 2HA GLY 256 -20.435 -3.218 -4.720 Start of MODEL 6 1 H GLY 220 H GLY 220 -17.371 -2.244 9.953 2 1HA GLY 220 1HA GLY 220 -18.316 -3.898 8.438 3 2HA GLY 220 2HA GLY 220 -18.466 -2.604 7.225 4 H LYS 221 H LYS 221 -16.964 -3.148 5.626 5 HA LYS 221 HA LYS 221 -14.192 -2.940 6.457 6 1HB LYS 221 1HB LYS 221 -15.248 -5.462 5.701 7 2HB LYS 221 2HB LYS 221 -14.440 -4.868 4.251 8 1HG LYS 221 1HG LYS 221 -12.407 -4.664 5.422 9 2HG LYS 221 2HG LYS 221 -13.149 -4.889 7.007 10 1HD LYS 221 1HD LYS 221 -13.250 -7.131 4.964 11 2HD LYS 221 2HD LYS 221 -11.776 -6.794 5.859 12 1HE LYS 221 1HE LYS 221 -12.692 -8.351 7.223 13 2HE LYS 221 2HE LYS 221 -13.214 -6.866 8.014 14 1HZ LYS 221 1HZ LYS 221 -14.867 -8.504 6.178 15 2HZ LYS 221 2HZ LYS 221 -14.953 -8.571 7.816 16 3HZ LYS 221 3HZ LYS 221 -15.414 -7.211 6.998 17 HA PRO 222 HA PRO 222 -14.609 -0.078 3.112 18 1HB PRO 222 1HB PRO 222 -11.865 -0.063 2.245 19 2HB PRO 222 2HB PRO 222 -12.660 1.063 3.365 20 1HG PRO 222 1HG PRO 222 -10.683 -0.902 4.031 21 2HG PRO 222 2HG PRO 222 -11.638 0.104 5.145 22 1HD PRO 222 1HD PRO 222 -12.026 -2.735 4.367 23 2HD PRO 222 2HD PRO 222 -12.535 -1.862 5.844 24 H GLU 223 H GLU 223 -14.079 0.276 0.723 25 HA GLU 223 HA GLU 223 -14.764 -1.892 -0.938 26 1HB GLU 223 1HB GLU 223 -13.063 0.118 -2.242 27 2HB GLU 223 2HB GLU 223 -14.680 -0.407 -2.645 28 1HG GLU 223 1HG GLU 223 -13.880 1.683 -0.578 29 2HG GLU 223 2HG GLU 223 -14.460 2.009 -2.202 30 H HIS 224 H HIS 224 -11.632 -0.920 0.337 31 HA HIS 224 HA HIS 224 -10.267 -3.043 -1.202 32 1HB HIS 224 1HB HIS 224 -9.015 -0.393 -0.492 33 2HB HIS 224 2HB HIS 224 -8.387 -1.622 -1.583 34 HD1 HIS 224 1HD HIS 224 -9.566 1.674 -1.906 35 HD2 HIS 224 2HD HIS 224 -10.532 -1.971 -3.744 36 HE1 HIS 224 1HE HIS 224 -10.781 2.281 -4.039 37 H ILE 225 H ILE 225 -8.093 -3.508 -0.054 38 HA ILE 225 HA ILE 225 -8.206 -3.320 2.902 39 HB ILE 225 HB ILE 225 -8.104 -5.737 1.125 40 1HG1 ILE 225 1HG1 ILE 225 -9.747 -4.685 3.437 41 2HG1 ILE 225 2HG1 ILE 225 -10.250 -5.124 1.809 42 1HG2 ILE 225 1HG2 ILE 225 -7.347 -7.161 2.865 43 2HG2 ILE 225 2HG2 ILE 225 -6.136 -5.928 2.703 44 3HG2 ILE 225 3HG2 ILE 225 -7.307 -5.853 4.052 45 1HD1 ILE 225 1HD1 ILE 225 -11.027 -6.789 3.343 46 2HD1 ILE 225 2HD1 ILE 225 -9.713 -7.514 2.374 47 3HD1 ILE 225 3HD1 ILE 225 -9.409 -6.918 4.049 48 HA PRO 226 HA PRO 226 -3.982 -2.071 1.775 49 1HB PRO 226 1HB PRO 226 -2.594 -2.372 4.075 50 2HB PRO 226 2HB PRO 226 -3.834 -1.108 3.869 51 1HG PRO 226 1HG PRO 226 -4.035 -3.683 5.393 52 2HG PRO 226 2HG PRO 226 -4.814 -2.108 5.732 53 1HD PRO 226 1HD PRO 226 -5.890 -4.374 4.422 54 2HD PRO 226 2HD PRO 226 -6.691 -2.800 4.526 55 H ASP 227 H ASP 227 -1.644 -3.003 1.878 56 HA ASP 227 HA ASP 227 -1.801 -5.975 1.627 57 1HB ASP 227 1HB ASP 227 -1.242 -4.805 -0.446 58 2HB ASP 227 2HB ASP 227 0.173 -4.114 0.327 59 HA PRO 228 HA PRO 228 0.576 -5.063 5.481 60 1HB PRO 228 1HB PRO 228 -0.138 -7.309 6.861 61 2HB PRO 228 2HB PRO 228 -1.231 -5.892 6.712 62 1HG PRO 228 1HG PRO 228 -1.213 -8.475 5.114 63 2HG PRO 228 2HG PRO 228 -2.620 -7.633 5.852 64 1HD PRO 228 1HD PRO 228 -1.939 -7.354 3.218 65 2HD PRO 228 2HD PRO 228 -2.630 -6.021 4.155 66 H ASP 229 H ASP 229 0.555 -7.620 3.209 67 HA ASP 229 HA ASP 229 2.912 -9.021 4.296 68 1HB ASP 229 1HB ASP 229 0.987 -10.159 3.092 69 2HB ASP 229 2HB ASP 229 1.629 -9.474 1.592 70 H ALA 230 H ALA 230 2.456 -6.245 2.422 71 HA ALA 230 HA ALA 230 4.635 -6.439 0.597 72 1HB ALA 230 1HB ALA 230 3.263 -3.972 1.767 73 2HB ALA 230 2HB ALA 230 4.177 -4.056 0.242 74 3HB ALA 230 3HB ALA 230 2.646 -4.913 0.393 75 H LYS 231 H LYS 231 6.573 -4.987 0.643 76 HA LYS 231 HA LYS 231 7.550 -4.194 3.333 77 1HB LYS 231 1HB LYS 231 8.897 -6.177 1.452 78 2HB LYS 231 2HB LYS 231 9.873 -5.036 2.373 79 1HG LYS 231 1HG LYS 231 9.996 -6.705 3.754 80 2HG LYS 231 2HG LYS 231 8.669 -5.770 4.452 81 1HD LYS 231 1HD LYS 231 7.048 -7.369 3.423 82 2HD LYS 231 2HD LYS 231 8.411 -8.295 2.736 83 1HE LYS 231 1HE LYS 231 9.294 -8.799 4.842 84 2HE LYS 231 2HE LYS 231 8.429 -7.477 5.626 85 1HZ LYS 231 1HZ LYS 231 7.456 -9.690 6.128 86 2HZ LYS 231 2HZ LYS 231 6.405 -8.637 5.411 87 3HZ LYS 231 3HZ LYS 231 7.070 -9.841 4.516 88 H LYS 232 H LYS 232 8.388 -2.185 3.249 89 HA LYS 232 HA LYS 232 8.549 -0.598 1.114 90 1HB LYS 232 1HB LYS 232 9.928 0.915 2.339 91 2HB LYS 232 2HB LYS 232 8.874 0.102 3.475 92 1HG LYS 232 1HG LYS 232 10.671 -1.350 4.205 93 2HG LYS 232 2HG LYS 232 11.781 -0.662 3.006 94 1HD LYS 232 1HD LYS 232 12.240 0.360 5.154 95 2HD LYS 232 2HD LYS 232 11.613 1.552 4.025 96 1HE LYS 232 1HE LYS 232 10.611 1.983 6.148 97 2HE LYS 232 2HE LYS 232 9.345 1.344 5.101 98 1HZ LYS 232 1HZ LYS 232 10.824 -0.132 7.193 99 2HZ LYS 232 2HZ LYS 232 9.248 0.333 7.245 100 3HZ LYS 232 3HZ LYS 232 9.733 -0.846 6.209 101 HA PRO 233 HA PRO 233 11.826 -1.671 -1.568 102 1HB PRO 233 1HB PRO 233 12.676 1.105 -2.020 103 2HB PRO 233 2HB PRO 233 11.900 -0.034 -3.145 104 1HG PRO 233 1HG PRO 233 10.640 2.183 -2.012 105 2HG PRO 233 2HG PRO 233 9.791 0.762 -2.614 106 1HD PRO 233 1HD PRO 233 10.363 1.516 0.213 107 2HD PRO 233 2HD PRO 233 9.028 0.572 -0.499 108 H GLU 234 H GLU 234 14.014 -2.097 -1.579 109 HA GLU 234 HA GLU 234 15.643 -1.367 0.701 110 1HB GLU 234 1HB GLU 234 15.633 -3.344 -1.368 111 2HB GLU 234 2HB GLU 234 17.077 -2.394 -1.612 112 1HG GLU 234 1HG GLU 234 16.912 -3.002 1.216 113 2HG GLU 234 2HG GLU 234 16.547 -4.468 0.327 114 H ASP 235 H ASP 235 14.852 0.195 -2.265 115 HA ASP 235 HA ASP 235 17.114 2.094 -2.079 116 1HB ASP 235 1HB ASP 235 15.564 0.909 -4.395 117 2HB ASP 235 2HB ASP 235 16.287 2.495 -4.541 118 H TRP 236 H TRP 236 14.540 1.999 -0.472 119 HA TRP 236 HA TRP 236 13.010 4.284 -1.326 120 1HB TRP 236 1HB TRP 236 12.229 2.432 0.210 121 2HB TRP 236 2HB TRP 236 13.358 3.010 1.434 122 HD1 TRP 236 HD TRP 236 12.198 4.487 3.142 123 HE1 TRP 236 1HE TRP 236 10.394 6.369 3.111 124 HE3 TRP 236 3HE TRP 236 10.896 4.232 -1.736 125 HZ2 TRP 236 2HZ TRP 236 8.450 7.392 1.244 126 HZ3 TRP 236 3HZ TRP 236 9.055 5.706 -2.652 127 HH2 TRP 236 HH TRP 236 7.857 7.254 -1.161 128 H ASP 237 H ASP 237 13.188 6.407 -0.475 129 HA ASP 237 HA ASP 237 15.898 7.064 0.570 130 1HB ASP 237 1HB ASP 237 14.416 8.403 -1.735 131 2HB ASP 237 2HB ASP 237 15.947 8.902 -1.038 132 H GLU 238 H GLU 238 14.795 7.222 2.622 133 HA GLU 238 HA GLU 238 12.401 8.601 3.059 134 1HB GLU 238 1HB GLU 238 14.731 8.186 4.960 135 2HB GLU 238 2HB GLU 238 13.091 8.627 5.457 136 1HG GLU 238 1HG GLU 238 12.211 6.525 4.529 137 2HG GLU 238 2HG GLU 238 13.828 6.056 3.979 138 H GLU 239 H GLU 239 15.660 9.967 2.892 139 HA GLU 239 HA GLU 239 14.885 12.509 3.997 140 1HB GLU 239 1HB GLU 239 17.276 11.294 3.652 141 2HB GLU 239 2HB GLU 239 17.258 12.231 2.158 142 1HG GLU 239 1HG GLU 239 16.622 14.250 3.789 143 2HG GLU 239 2HG GLU 239 17.324 13.205 5.014 144 H MET 240 H MET 240 14.210 11.058 1.113 145 HA MET 240 HA MET 240 13.879 13.615 -0.420 146 1HB MET 240 1HB MET 240 14.818 10.894 -1.128 147 2HB MET 240 2HB MET 240 13.582 11.529 -2.218 148 1HG MET 240 1HG MET 240 15.994 13.185 -1.359 149 2HG MET 240 2HG MET 240 16.109 12.034 -2.682 150 1HE MET 240 1HE MET 240 14.136 13.459 -5.565 151 2HE MET 240 2HE MET 240 15.433 12.384 -5.010 152 3HE MET 240 3HE MET 240 13.759 12.092 -4.491 153 H ASP 241 H ASP 241 12.271 10.570 0.521 154 HA ASP 241 HA ASP 241 9.798 11.632 -0.718 155 1HB ASP 241 1HB ASP 241 11.164 9.506 -1.588 156 2HB ASP 241 2HB ASP 241 10.224 8.698 -0.377 157 H GLY 242 H GLY 242 11.080 10.379 2.288 158 1HA GLY 242 1HA GLY 242 10.052 10.923 4.319 159 2HA GLY 242 2HA GLY 242 8.469 10.962 3.540 160 H GLU 243 H GLU 243 7.290 9.492 4.679 161 HA GLU 243 HA GLU 243 8.339 6.959 5.688 162 1HB GLU 243 1HB GLU 243 5.910 8.677 6.035 163 2HB GLU 243 2HB GLU 243 5.564 6.969 5.863 164 1HG GLU 243 1HG GLU 243 7.187 6.462 7.697 165 2HG GLU 243 2HG GLU 243 7.493 8.194 7.875 166 H TRP 244 H TRP 244 8.072 5.056 4.558 167 HA TRP 244 HA TRP 244 6.898 5.159 1.866 168 1HB TRP 244 1HB TRP 244 8.783 3.620 2.316 169 2HB TRP 244 2HB TRP 244 7.842 2.818 3.568 170 HD1 TRP 244 HD TRP 244 7.520 3.562 -0.231 171 HE1 TRP 244 1HE TRP 244 6.333 1.553 -1.367 172 HE3 TRP 244 3HE TRP 244 6.650 0.651 3.886 173 HZ2 TRP 244 2HZ TRP 244 5.520 -1.076 -0.641 174 HZ3 TRP 244 3HZ TRP 244 5.972 -1.706 3.609 175 HH2 TRP 244 HH TRP 244 5.302 -2.554 1.366 176 H GLU 245 H GLU 245 4.839 4.396 1.357 177 HA GLU 245 HA GLU 245 3.077 3.490 3.579 178 1HB GLU 245 1HB GLU 245 2.435 5.147 1.122 179 2HB GLU 245 2HB GLU 245 1.229 4.389 2.164 180 1HG GLU 245 1HG GLU 245 1.904 5.730 4.068 181 2HG GLU 245 2HG GLU 245 3.289 6.394 3.182 182 HA PRO 246 HA PRO 246 3.243 0.001 0.810 183 1HB PRO 246 1HB PRO 246 1.367 -1.689 1.969 184 2HB PRO 246 2HB PRO 246 3.018 -1.406 2.574 185 1HG PRO 246 1HG PRO 246 0.402 -0.158 3.468 186 2HG PRO 246 2HG PRO 246 1.757 -0.770 4.465 187 1HD PRO 246 1HD PRO 246 1.375 1.930 3.822 188 2HD PRO 246 2HD PRO 246 2.981 1.217 4.166 189 HA PRO 247 HA PRO 247 -0.289 0.205 -1.903 190 1HB PRO 247 1HB PRO 247 -0.233 -2.304 -3.085 191 2HB PRO 247 2HB PRO 247 0.853 -0.965 -3.477 192 1HG PRO 247 1HG PRO 247 1.375 -3.407 -1.796 193 2HG PRO 247 2HG PRO 247 2.517 -2.493 -2.824 194 1HD PRO 247 1HD PRO 247 2.177 -2.335 -0.021 195 2HD PRO 247 2HD PRO 247 3.100 -1.176 -1.001 196 H VAL 248 H VAL 248 -2.190 -1.430 -2.654 197 HA VAL 248 HA VAL 248 -3.505 -2.558 -0.285 198 HB VAL 248 HB VAL 248 -5.506 -1.610 -1.252 199 1HG1 VAL 248 1HG1 VAL 248 -3.401 0.546 -0.766 200 2HG1 VAL 248 2HG1 VAL 248 -5.145 0.766 -0.671 201 3HG1 VAL 248 3HG1 VAL 248 -4.332 -0.296 0.483 202 1HG2 VAL 248 1HG2 VAL 248 -4.971 -1.428 -3.600 203 2HG2 VAL 248 2HG2 VAL 248 -5.547 0.102 -2.974 204 3HG2 VAL 248 3HG2 VAL 248 -3.808 -0.131 -3.260 205 H ILE 249 H ILE 249 -5.612 -3.720 -1.230 206 HA ILE 249 HA ILE 249 -5.017 -5.370 -3.568 207 HB ILE 249 HB ILE 249 -5.319 -7.395 -2.318 208 1HG1 ILE 249 1HG1 ILE 249 -5.123 -6.718 0.448 209 2HG1 ILE 249 2HG1 ILE 249 -6.411 -5.724 -0.194 210 1HG2 ILE 249 1HG2 ILE 249 -3.299 -7.445 -0.960 211 2HG2 ILE 249 2HG2 ILE 249 -3.022 -6.380 -2.349 212 3HG2 ILE 249 3HG2 ILE 249 -3.349 -5.706 -0.736 213 1HD1 ILE 249 1HD1 ILE 249 -7.231 -7.927 0.642 214 2HD1 ILE 249 2HD1 ILE 249 -7.519 -7.758 -1.097 215 3HD1 ILE 249 3HD1 ILE 249 -6.171 -8.758 -0.514 216 H GLN 250 H GLN 250 -6.969 -6.167 -4.443 217 HA GLN 250 HA GLN 250 -9.407 -4.725 -3.956 218 1HB GLN 250 1HB GLN 250 -8.528 -6.976 -5.732 219 2HB GLN 250 2HB GLN 250 -10.240 -6.930 -5.358 220 1HG GLN 250 1HG GLN 250 -8.885 -4.395 -6.321 221 2HG GLN 250 2HG GLN 250 -9.326 -5.671 -7.447 222 1HE2 GLN 250 1HE2 GLN 250 -10.919 -3.735 -4.759 223 2HE2 GLN 250 2HE2 GLN 250 -12.488 -3.801 -5.528 224 H ASN 251 H ASN 251 -10.767 -5.008 -2.302 225 HA ASN 251 HA ASN 251 -10.391 -6.961 -0.288 226 1HB ASN 251 1HB ASN 251 -11.544 -4.740 -0.035 227 2HB ASN 251 2HB ASN 251 -12.909 -5.382 -0.943 228 1HD2 ASN 251 1HD2 ASN 251 -12.931 -4.376 1.834 229 2HD2 ASN 251 2HD2 ASN 251 -13.246 -5.775 2.865 230 HA PRO 252 HA PRO 252 -12.058 -10.222 -2.822 231 1HB PRO 252 1HB PRO 252 -12.184 -12.289 -1.004 232 2HB PRO 252 2HB PRO 252 -10.661 -11.657 -1.713 233 1HG PRO 252 1HG PRO 252 -11.884 -10.912 0.951 234 2HG PRO 252 2HG PRO 252 -10.201 -11.441 0.603 235 1HD PRO 252 1HD PRO 252 -10.789 -8.832 0.778 236 2HD PRO 252 2HD PRO 252 -9.707 -9.399 -0.527 237 H GLU 253 H GLU 253 -13.714 -9.285 0.198 238 HA GLU 253 HA GLU 253 -16.310 -9.637 -1.017 239 1HB GLU 253 1HB GLU 253 -15.521 -11.313 1.398 240 2HB GLU 253 2HB GLU 253 -17.181 -10.797 1.059 241 1HG GLU 253 1HG GLU 253 -16.571 -11.788 -1.392 242 2HG GLU 253 2HG GLU 253 -15.500 -12.795 -0.414 243 H TYR 254 H TYR 254 -15.618 -7.479 -0.969 244 HA TYR 254 HA TYR 254 -15.312 -5.984 1.430 245 1HB TYR 254 1HB TYR 254 -14.785 -4.397 -0.008 246 2HB TYR 254 2HB TYR 254 -15.226 -5.425 -1.340 247 HD1 TYR 254 1HD TYR 254 -17.172 -4.969 -2.665 248 HD2 TYR 254 2HD TYR 254 -16.406 -2.736 0.949 249 HE1 TYR 254 1HE TYR 254 -18.923 -3.344 -3.296 250 HE2 TYR 254 2HE TYR 254 -18.172 -1.107 0.324 251 HH TYR 254 HH TYR 254 -19.376 -0.570 -2.420 252 H LYS 255 H LYS 255 -16.613 -5.190 2.840 253 HA LYS 255 HA LYS 255 -18.431 -4.990 4.152 254 1HB LYS 255 1HB LYS 255 -18.069 -3.039 2.655 255 2HB LYS 255 2HB LYS 255 -19.358 -3.622 1.610 256 1HG LYS 255 1HG LYS 255 -20.941 -2.850 2.944 257 2HG LYS 255 2HG LYS 255 -20.214 -3.500 4.425 258 1HD LYS 255 1HD LYS 255 -18.739 -1.596 4.649 259 2HD LYS 255 2HD LYS 255 -19.165 -1.012 3.034 260 1HE LYS 255 1HE LYS 255 -20.341 0.366 4.524 261 2HE LYS 255 2HE LYS 255 -21.516 -0.706 3.750 262 1HZ LYS 255 1HZ LYS 255 -22.052 -0.594 5.998 263 2HZ LYS 255 2HZ LYS 255 -21.391 -2.072 5.794 264 3HZ LYS 255 3HZ LYS 255 -20.514 -0.864 6.523 265 H GLY 256 H GLY 256 -18.658 -7.531 3.673 266 1HA GLY 256 1HA GLY 256 -21.344 -8.273 2.803 267 2HA GLY 256 2HA GLY 256 -20.256 -9.211 3.837 Start of MODEL 7 1 H GLY 220 H GLY 220 -15.905 -3.056 10.593 2 1HA GLY 220 1HA GLY 220 -17.333 -3.927 8.819 3 2HA GLY 220 2HA GLY 220 -17.362 -2.295 8.132 4 H LYS 221 H LYS 221 -16.503 -3.666 6.172 5 HA LYS 221 HA LYS 221 -13.562 -3.606 6.310 6 1HB LYS 221 1HB LYS 221 -15.283 -5.748 5.141 7 2HB LYS 221 2HB LYS 221 -13.846 -5.191 4.303 8 1HG LYS 221 1HG LYS 221 -12.936 -5.566 6.928 9 2HG LYS 221 2HG LYS 221 -14.120 -6.867 6.745 10 1HD LYS 221 1HD LYS 221 -13.003 -7.543 4.616 11 2HD LYS 221 2HD LYS 221 -11.858 -6.211 4.829 12 1HE LYS 221 1HE LYS 221 -10.790 -8.293 5.391 13 2HE LYS 221 2HE LYS 221 -10.893 -7.250 6.806 14 1HZ LYS 221 1HZ LYS 221 -12.533 -8.581 7.714 15 2HZ LYS 221 2HZ LYS 221 -12.869 -9.384 6.293 16 3HZ LYS 221 3HZ LYS 221 -11.485 -9.655 7.134 17 HA PRO 222 HA PRO 222 -14.621 -0.314 3.605 18 1HB PRO 222 1HB PRO 222 -12.040 0.471 2.841 19 2HB PRO 222 2HB PRO 222 -12.811 0.820 4.407 20 1HG PRO 222 1HG PRO 222 -10.847 -1.354 3.636 21 2HG PRO 222 2HG PRO 222 -10.898 -0.425 5.162 22 1HD PRO 222 1HD PRO 222 -11.843 -2.983 4.861 23 2HD PRO 222 2HD PRO 222 -12.478 -1.850 6.074 24 H GLU 223 H GLU 223 -13.929 0.638 1.488 25 HA GLU 223 HA GLU 223 -14.614 -1.054 -0.620 26 1HB GLU 223 1HB GLU 223 -13.003 1.477 -1.017 27 2HB GLU 223 2HB GLU 223 -14.233 0.749 -2.063 28 1HG GLU 223 1HG GLU 223 -15.731 1.182 0.166 29 2HG GLU 223 2HG GLU 223 -14.517 2.420 0.422 30 H HIS 224 H HIS 224 -11.345 -0.352 0.613 31 HA HIS 224 HA HIS 224 -10.239 -2.396 -1.216 32 1HB HIS 224 1HB HIS 224 -8.818 0.263 -0.803 33 2HB HIS 224 2HB HIS 224 -8.391 -1.037 -1.913 34 HD1 HIS 224 1HD HIS 224 -10.591 2.026 -1.637 35 HD2 HIS 224 2HD HIS 224 -10.122 -1.370 -4.095 36 HE1 HIS 224 1HE HIS 224 -12.111 2.382 -3.646 37 H ILE 225 H ILE 225 -8.409 -3.483 -0.278 38 HA ILE 225 HA ILE 225 -8.133 -3.056 2.659 39 HB ILE 225 HB ILE 225 -7.973 -5.487 0.856 40 1HG1 ILE 225 1HG1 ILE 225 -9.835 -4.391 2.971 41 2HG1 ILE 225 2HG1 ILE 225 -10.187 -5.033 1.370 42 1HG2 ILE 225 1HG2 ILE 225 -6.103 -5.644 2.490 43 2HG2 ILE 225 2HG2 ILE 225 -7.283 -5.473 3.819 44 3HG2 ILE 225 3HG2 ILE 225 -7.301 -6.869 2.731 45 1HD1 ILE 225 1HD1 ILE 225 -9.477 -7.314 2.298 46 2HD1 ILE 225 2HD1 ILE 225 -9.479 -6.484 3.893 47 3HD1 ILE 225 3HD1 ILE 225 -10.982 -6.618 2.914 48 HA PRO 226 HA PRO 226 -3.861 -2.231 1.393 49 1HB PRO 226 1HB PRO 226 -2.576 -2.041 3.639 50 2HB PRO 226 2HB PRO 226 -3.809 -0.802 3.202 51 1HG PRO 226 1HG PRO 226 -4.107 -3.008 5.219 52 2HG PRO 226 2HG PRO 226 -4.875 -1.401 5.216 53 1HD PRO 226 1HD PRO 226 -5.936 -3.904 4.314 54 2HD PRO 226 2HD PRO 226 -6.744 -2.348 4.120 55 H ASP 227 H ASP 227 -1.785 -3.176 1.551 56 HA ASP 227 HA ASP 227 -2.170 -6.110 1.250 57 1HB ASP 227 1HB ASP 227 -1.016 -4.750 -0.504 58 2HB ASP 227 2HB ASP 227 0.318 -4.549 0.607 59 HA PRO 228 HA PRO 228 -0.238 -6.436 5.329 60 1HB PRO 228 1HB PRO 228 -0.625 -9.077 5.846 61 2HB PRO 228 2HB PRO 228 -1.961 -7.882 5.893 62 1HG PRO 228 1HG PRO 228 -1.212 -9.765 3.640 63 2HG PRO 228 2HG PRO 228 -2.837 -9.441 4.314 64 1HD PRO 228 1HD PRO 228 -1.870 -8.220 2.046 65 2HD PRO 228 2HD PRO 228 -3.003 -7.401 3.147 66 H ASP 229 H ASP 229 0.689 -8.367 2.461 67 HA ASP 229 HA ASP 229 3.032 -9.498 3.879 68 1HB ASP 229 1HB ASP 229 1.556 -10.936 2.444 69 2HB ASP 229 2HB ASP 229 2.102 -10.011 1.035 70 H ALA 230 H ALA 230 2.213 -6.903 1.745 71 HA ALA 230 HA ALA 230 4.785 -6.417 0.571 72 1HB ALA 230 1HB ALA 230 2.596 -4.459 1.367 73 2HB ALA 230 2HB ALA 230 3.944 -4.125 0.251 74 3HB ALA 230 3HB ALA 230 2.714 -5.318 -0.194 75 H LYS 231 H LYS 231 6.420 -4.973 1.211 76 HA LYS 231 HA LYS 231 6.481 -3.862 3.949 77 1HB LYS 231 1HB LYS 231 8.632 -4.897 4.401 78 2HB LYS 231 2HB LYS 231 7.466 -6.165 3.994 79 1HG LYS 231 1HG LYS 231 8.438 -5.998 1.578 80 2HG LYS 231 2HG LYS 231 9.736 -5.051 2.317 81 1HD LYS 231 1HD LYS 231 10.177 -7.001 3.857 82 2HD LYS 231 2HD LYS 231 8.959 -7.930 2.935 83 1HE LYS 231 1HE LYS 231 10.253 -7.295 0.819 84 2HE LYS 231 2HE LYS 231 11.509 -6.634 1.880 85 1HZ LYS 231 1HZ LYS 231 12.056 -8.849 1.194 86 2HZ LYS 231 2HZ LYS 231 11.755 -8.848 2.817 87 3HZ LYS 231 3HZ LYS 231 10.625 -9.443 1.753 88 H LYS 232 H LYS 232 7.779 -1.855 3.943 89 HA LYS 232 HA LYS 232 8.265 -0.582 1.692 90 1HB LYS 232 1HB LYS 232 9.770 0.911 2.834 91 2HB LYS 232 2HB LYS 232 8.465 0.418 3.887 92 1HG LYS 232 1HG LYS 232 9.961 -1.107 5.075 93 2HG LYS 232 2HG LYS 232 11.256 -0.781 3.907 94 1HD LYS 232 1HD LYS 232 11.503 0.476 6.076 95 2HD LYS 232 2HD LYS 232 11.556 1.448 4.610 96 1HE LYS 232 1HE LYS 232 10.255 2.614 6.295 97 2HE LYS 232 2HE LYS 232 9.230 2.167 4.937 98 1HZ LYS 232 1HZ LYS 232 8.537 0.205 6.394 99 2HZ LYS 232 2HZ LYS 232 9.276 1.010 7.637 100 3HZ LYS 232 3HZ LYS 232 8.051 1.696 6.862 101 HA PRO 233 HA PRO 233 11.732 -2.150 -0.623 102 1HB PRO 233 1HB PRO 233 12.742 0.573 -1.198 103 2HB PRO 233 2HB PRO 233 12.035 -0.599 -2.325 104 1HG PRO 233 1HG PRO 233 10.773 1.737 -1.527 105 2HG PRO 233 2HG PRO 233 9.913 0.296 -2.088 106 1HD PRO 233 1HD PRO 233 10.349 1.240 0.736 107 2HD PRO 233 2HD PRO 233 8.941 0.404 -0.004 108 H GLU 234 H GLU 234 14.078 -2.202 -0.616 109 HA GLU 234 HA GLU 234 15.288 -1.286 1.890 110 1HB GLU 234 1HB GLU 234 15.508 -3.543 0.494 111 2HB GLU 234 2HB GLU 234 16.801 -2.627 -0.323 112 1HG GLU 234 1HG GLU 234 17.808 -2.148 1.911 113 2HG GLU 234 2HG GLU 234 16.440 -2.970 2.670 114 H ASP 235 H ASP 235 15.133 -0.493 -1.531 115 HA ASP 235 HA ASP 235 17.408 1.308 -1.533 116 1HB ASP 235 1HB ASP 235 15.705 0.014 -3.461 117 2HB ASP 235 2HB ASP 235 15.701 1.681 -3.833 118 H TRP 236 H TRP 236 14.600 1.727 -0.038 119 HA TRP 236 HA TRP 236 13.332 3.973 -1.184 120 1HB TRP 236 1HB TRP 236 12.368 2.292 0.435 121 2HB TRP 236 2HB TRP 236 13.330 3.019 1.714 122 HD1 TRP 236 HD TRP 236 12.067 4.731 3.067 123 HE1 TRP 236 1HE TRP 236 10.122 6.459 2.657 124 HE3 TRP 236 3HE TRP 236 11.140 3.828 -1.869 125 HZ2 TRP 236 2HZ TRP 236 8.174 6.948 0.639 126 HZ3 TRP 236 3HZ TRP 236 9.327 5.074 -3.037 127 HH2 TRP 236 HH TRP 236 7.808 6.572 -1.783 128 H ASP 237 H ASP 237 13.238 6.125 -0.511 129 HA ASP 237 HA ASP 237 15.865 7.141 0.461 130 1HB ASP 237 1HB ASP 237 13.966 8.296 -1.638 131 2HB ASP 237 2HB ASP 237 15.517 8.955 -1.144 132 H GLU 238 H GLU 238 14.701 7.127 2.709 133 HA GLU 238 HA GLU 238 12.357 8.765 3.024 134 1HB GLU 238 1HB GLU 238 14.368 7.833 5.105 135 2HB GLU 238 2HB GLU 238 12.969 8.832 5.475 136 1HG GLU 238 1HG GLU 238 11.673 6.889 4.164 137 2HG GLU 238 2HG GLU 238 13.066 5.949 4.719 138 H GLU 239 H GLU 239 15.589 9.955 2.369 139 HA GLU 239 HA GLU 239 15.131 12.480 3.780 140 1HB GLU 239 1HB GLU 239 17.353 10.851 2.852 141 2HB GLU 239 2HB GLU 239 17.415 12.373 2.035 142 1HG GLU 239 1HG GLU 239 17.122 12.053 5.070 143 2HG GLU 239 2HG GLU 239 18.682 11.959 4.275 144 H MET 240 H MET 240 14.227 10.927 0.894 145 HA MET 240 HA MET 240 13.937 13.453 -0.664 146 1HB MET 240 1HB MET 240 14.046 10.550 -1.517 147 2HB MET 240 2HB MET 240 13.593 11.818 -2.604 148 1HG MET 240 1HG MET 240 16.227 12.131 -1.178 149 2HG MET 240 2HG MET 240 16.091 10.852 -2.369 150 1HE MET 240 1HE MET 240 15.698 15.342 -3.394 151 2HE MET 240 2HE MET 240 14.381 14.498 -2.563 152 3HE MET 240 3HE MET 240 15.954 14.709 -1.753 153 H ASP 241 H ASP 241 12.328 10.261 -0.213 154 HA ASP 241 HA ASP 241 9.885 11.406 -1.234 155 1HB ASP 241 1HB ASP 241 11.077 8.868 -1.410 156 2HB ASP 241 2HB ASP 241 9.731 8.619 -0.308 157 H GLY 242 H GLY 242 10.737 9.636 1.792 158 1HA GLY 242 1HA GLY 242 10.033 10.711 3.911 159 2HA GLY 242 2HA GLY 242 8.456 11.029 3.181 160 H GLU 243 H GLU 243 7.292 9.762 4.810 161 HA GLU 243 HA GLU 243 7.865 7.033 5.366 162 1HB GLU 243 1HB GLU 243 5.801 9.019 6.019 163 2HB GLU 243 2HB GLU 243 5.034 7.529 5.470 164 1HG GLU 243 1HG GLU 243 6.624 6.293 7.098 165 2HG GLU 243 2HG GLU 243 6.990 7.903 7.729 166 H TRP 244 H TRP 244 7.664 5.339 4.081 167 HA TRP 244 HA TRP 244 6.368 5.300 1.494 168 1HB TRP 244 1HB TRP 244 8.320 3.899 2.110 169 2HB TRP 244 2HB TRP 244 7.387 3.154 3.393 170 HD1 TRP 244 HD TRP 244 7.468 3.335 -0.471 171 HE1 TRP 244 1HE TRP 244 6.603 1.091 -1.408 172 HE3 TRP 244 3HE TRP 244 6.103 1.115 3.910 173 HZ2 TRP 244 2HZ TRP 244 5.517 -1.359 -0.342 174 HZ3 TRP 244 3HZ TRP 244 5.360 -1.255 3.948 175 HH2 TRP 244 HH TRP 244 4.897 -2.448 1.810 176 H GLU 245 H GLU 245 4.562 3.595 1.130 177 HA GLU 245 HA GLU 245 2.894 3.062 3.460 178 1HB GLU 245 1HB GLU 245 0.886 3.918 2.552 179 2HB GLU 245 2HB GLU 245 2.069 5.209 2.349 180 1HG GLU 245 1HG GLU 245 2.382 4.037 -0.057 181 2HG GLU 245 2HG GLU 245 0.768 3.434 0.287 182 HA PRO 246 HA PRO 246 2.880 -0.729 1.106 183 1HB PRO 246 1HB PRO 246 0.624 -2.032 2.098 184 2HB PRO 246 2HB PRO 246 2.225 -1.948 2.888 185 1HG PRO 246 1HG PRO 246 -0.266 -0.360 3.469 186 2HG PRO 246 2HG PRO 246 1.002 -0.947 4.597 187 1HD PRO 246 1HD PRO 246 0.778 1.665 3.579 188 2HD PRO 246 2HD PRO 246 2.268 0.957 4.284 189 HA PRO 247 HA PRO 247 -0.090 -0.299 -2.282 190 1HB PRO 247 1HB PRO 247 -0.701 -3.175 -2.132 191 2HB PRO 247 2HB PRO 247 -0.019 -2.261 -3.507 192 1HG PRO 247 1HG PRO 247 1.500 -4.025 -2.001 193 2HG PRO 247 2HG PRO 247 2.161 -2.570 -2.784 194 1HD PRO 247 1HD PRO 247 1.470 -2.958 0.098 195 2HD PRO 247 2HD PRO 247 2.794 -2.028 -0.617 196 H VAL 248 H VAL 248 -2.434 -1.372 -2.879 197 HA VAL 248 HA VAL 248 -3.780 -2.388 -0.594 198 HB VAL 248 HB VAL 248 -5.810 -1.437 -1.618 199 1HG1 VAL 248 1HG1 VAL 248 -3.734 0.420 -0.412 200 2HG1 VAL 248 2HG1 VAL 248 -5.468 0.840 -0.492 201 3HG1 VAL 248 3HG1 VAL 248 -4.910 -0.556 0.458 202 1HG2 VAL 248 1HG2 VAL 248 -4.025 0.583 -3.017 203 2HG2 VAL 248 2HG2 VAL 248 -4.978 -0.694 -3.812 204 3HG2 VAL 248 3HG2 VAL 248 -5.788 0.608 -2.940 205 H ILE 249 H ILE 249 -5.586 -3.646 -1.371 206 HA ILE 249 HA ILE 249 -4.981 -5.256 -3.752 207 HB ILE 249 HB ILE 249 -4.868 -7.256 -2.438 208 1HG1 ILE 249 1HG1 ILE 249 -4.668 -6.733 0.262 209 2HG1 ILE 249 2HG1 ILE 249 -5.947 -5.629 -0.158 210 1HG2 ILE 249 1HG2 ILE 249 -3.189 -5.212 -0.933 211 2HG2 ILE 249 2HG2 ILE 249 -2.828 -6.942 -1.156 212 3HG2 ILE 249 3HG2 ILE 249 -2.788 -5.834 -2.551 213 1HD1 ILE 249 1HD1 ILE 249 -5.897 -8.625 -0.721 214 2HD1 ILE 249 2HD1 ILE 249 -6.838 -7.825 0.540 215 3HD1 ILE 249 3HD1 ILE 249 -7.217 -7.518 -1.171 216 H GLN 250 H GLN 250 -6.917 -5.891 -4.687 217 HA GLN 250 HA GLN 250 -9.247 -4.487 -4.047 218 1HB GLN 250 1HB GLN 250 -10.390 -5.845 -5.628 219 2HB GLN 250 2HB GLN 250 -8.787 -5.455 -6.231 220 1HG GLN 250 1HG GLN 250 -8.442 -7.595 -6.700 221 2HG GLN 250 2HG GLN 250 -8.489 -8.016 -5.005 222 1HE2 GLN 250 1HE2 GLN 250 -11.245 -7.863 -4.269 223 2HE2 GLN 250 2HE2 GLN 250 -12.196 -8.721 -5.470 224 H ASN 251 H ASN 251 -10.893 -4.800 -2.641 225 HA ASN 251 HA ASN 251 -10.471 -6.591 -0.420 226 1HB ASN 251 1HB ASN 251 -11.732 -4.434 -0.272 227 2HB ASN 251 2HB ASN 251 -13.004 -5.153 -1.264 228 1HD2 ASN 251 1HD2 ASN 251 -13.105 -4.135 1.565 229 2HD2 ASN 251 2HD2 ASN 251 -13.736 -5.496 2.471 230 HA PRO 252 HA PRO 252 -11.983 -9.992 -2.869 231 1HB PRO 252 1HB PRO 252 -12.084 -12.008 -0.962 232 2HB PRO 252 2HB PRO 252 -10.598 -11.427 -1.777 233 1HG PRO 252 1HG PRO 252 -11.683 -10.650 0.935 234 2HG PRO 252 2HG PRO 252 -10.001 -11.040 0.476 235 1HD PRO 252 1HD PRO 252 -10.917 -8.489 0.750 236 2HD PRO 252 2HD PRO 252 -9.694 -8.907 -0.479 237 H GLU 253 H GLU 253 -13.740 -8.735 -0.111 238 HA GLU 253 HA GLU 253 -16.305 -9.621 -1.194 239 1HB GLU 253 1HB GLU 253 -16.978 -10.763 0.766 240 2HB GLU 253 2HB GLU 253 -15.560 -11.515 0.061 241 1HG GLU 253 1HG GLU 253 -14.878 -9.492 2.057 242 2HG GLU 253 2HG GLU 253 -15.922 -10.729 2.729 243 H TYR 254 H TYR 254 -15.605 -6.982 -1.299 244 HA TYR 254 HA TYR 254 -15.645 -5.336 0.960 245 1HB TYR 254 1HB TYR 254 -15.014 -4.417 -1.152 246 2HB TYR 254 2HB TYR 254 -16.519 -4.926 -1.901 247 HD1 TYR 254 1HD TYR 254 -15.980 -2.904 1.282 248 HD2 TYR 254 2HD TYR 254 -17.418 -2.974 -2.788 249 HE1 TYR 254 1HE TYR 254 -17.018 -0.679 1.599 250 HE2 TYR 254 2HE TYR 254 -18.395 -0.749 -2.498 251 HH TYR 254 HH TYR 254 -17.848 1.386 -0.680 252 H LYS 255 H LYS 255 -17.125 -4.529 2.317 253 HA LYS 255 HA LYS 255 -20.006 -4.902 1.741 254 1HB LYS 255 1HB LYS 255 -18.817 -6.745 3.148 255 2HB LYS 255 2HB LYS 255 -18.849 -5.572 4.463 256 1HG LYS 255 1HG LYS 255 -21.392 -6.109 2.899 257 2HG LYS 255 2HG LYS 255 -20.796 -7.369 3.968 258 1HD LYS 255 1HD LYS 255 -20.930 -6.001 5.908 259 2HD LYS 255 2HD LYS 255 -21.223 -4.535 4.963 260 1HE LYS 255 1HE LYS 255 -23.108 -6.929 4.947 261 2HE LYS 255 2HE LYS 255 -23.263 -5.584 6.094 262 1HZ LYS 255 1HZ LYS 255 -24.669 -5.330 4.141 263 2HZ LYS 255 2HZ LYS 255 -23.582 -4.092 4.235 264 3HZ LYS 255 3HZ LYS 255 -23.381 -5.305 3.150 265 H GLY 256 H GLY 256 -17.511 -2.957 3.370 266 1HA GLY 256 1HA GLY 256 -18.017 -0.589 3.855 267 2HA GLY 256 2HA GLY 256 -19.601 -1.135 4.437 Start of MODEL 8 1 H GLY 220 H GLY 220 -17.147 -1.978 8.563 2 1HA GLY 220 1HA GLY 220 -16.838 -4.767 9.510 3 2HA GLY 220 2HA GLY 220 -18.055 -4.247 8.323 4 H LYS 221 H LYS 221 -17.490 -4.715 6.300 5 HA LYS 221 HA LYS 221 -14.695 -5.221 5.624 6 1HB LYS 221 1HB LYS 221 -15.898 -5.507 3.308 7 2HB LYS 221 2HB LYS 221 -15.749 -6.792 4.497 8 1HG LYS 221 1HG LYS 221 -18.059 -6.240 5.359 9 2HG LYS 221 2HG LYS 221 -18.214 -5.247 3.900 10 1HD LYS 221 1HD LYS 221 -18.166 -7.162 2.499 11 2HD LYS 221 2HD LYS 221 -17.380 -8.152 3.742 12 1HE LYS 221 1HE LYS 221 -19.463 -8.014 5.115 13 2HE LYS 221 2HE LYS 221 -20.248 -7.145 3.785 14 1HZ LYS 221 1HZ LYS 221 -19.090 -9.857 3.571 15 2HZ LYS 221 2HZ LYS 221 -20.686 -9.551 3.770 16 3HZ LYS 221 3HZ LYS 221 -19.944 -9.112 2.388 17 HA PRO 222 HA PRO 222 -14.534 -0.977 4.150 18 1HB PRO 222 1HB PRO 222 -11.904 -0.935 3.318 19 2HB PRO 222 2HB PRO 222 -12.428 -0.898 5.003 20 1HG PRO 222 1HG PRO 222 -11.382 -3.194 3.346 21 2HG PRO 222 2HG PRO 222 -11.055 -2.853 5.080 22 1HD PRO 222 1HD PRO 222 -12.932 -4.685 4.039 23 2HD PRO 222 2HD PRO 222 -12.989 -4.055 5.688 24 H GLU 223 H GLU 223 -13.441 0.078 2.199 25 HA GLU 223 HA GLU 223 -14.365 -0.972 -0.370 26 1HB GLU 223 1HB GLU 223 -13.365 1.073 -1.249 27 2HB GLU 223 2HB GLU 223 -14.427 1.395 0.105 28 1HG GLU 223 1HG GLU 223 -12.025 1.231 1.411 29 2HG GLU 223 2HG GLU 223 -11.484 1.833 -0.159 30 H HIS 224 H HIS 224 -11.089 -0.354 1.106 31 HA HIS 224 HA HIS 224 -9.992 -2.448 -0.682 32 1HB HIS 224 1HB HIS 224 -8.590 0.085 0.217 33 2HB HIS 224 2HB HIS 224 -7.988 -1.130 -0.883 34 HD1 HIS 224 1HD HIS 224 -8.954 2.191 -1.318 35 HD2 HIS 224 2HD HIS 224 -10.388 -1.465 -2.875 36 HE1 HIS 224 1HE HIS 224 -10.405 2.778 -3.298 37 H ILE 225 H ILE 225 -8.291 -3.656 0.170 38 HA ILE 225 HA ILE 225 -8.046 -3.705 3.139 39 HB ILE 225 HB ILE 225 -8.403 -5.895 1.093 40 1HG1 ILE 225 1HG1 ILE 225 -9.662 -4.926 3.688 41 2HG1 ILE 225 2HG1 ILE 225 -10.403 -5.146 2.097 42 1HG2 ILE 225 1HG2 ILE 225 -7.285 -6.430 3.864 43 2HG2 ILE 225 2HG2 ILE 225 -7.657 -7.605 2.595 44 3HG2 ILE 225 3HG2 ILE 225 -6.332 -6.495 2.355 45 1HD1 ILE 225 1HD1 ILE 225 -10.095 -7.641 2.453 46 2HD1 ILE 225 2HD1 ILE 225 -9.559 -7.219 4.109 47 3HD1 ILE 225 3HD1 ILE 225 -11.208 -6.813 3.577 48 HA PRO 226 HA PRO 226 -3.991 -2.671 1.823 49 1HB PRO 226 1HB PRO 226 -2.442 -2.999 3.933 50 2HB PRO 226 2HB PRO 226 -3.774 -1.788 3.930 51 1HG PRO 226 1HG PRO 226 -3.783 -4.521 5.219 52 2HG PRO 226 2HG PRO 226 -4.464 -2.996 5.857 53 1HD PRO 226 1HD PRO 226 -5.861 -5.003 4.495 54 2HD PRO 226 2HD PRO 226 -6.480 -3.355 4.679 55 H ASP 227 H ASP 227 -1.790 -3.525 1.582 56 HA ASP 227 HA ASP 227 -1.840 -6.404 0.841 57 1HB ASP 227 1HB ASP 227 -1.173 -4.796 -0.851 58 2HB ASP 227 2HB ASP 227 0.123 -4.197 0.181 59 HA PRO 228 HA PRO 228 0.614 -6.716 4.693 60 1HB PRO 228 1HB PRO 228 0.051 -9.253 5.384 61 2HB PRO 228 2HB PRO 228 -1.205 -7.987 5.443 62 1HG PRO 228 1HG PRO 228 -0.735 -10.055 3.292 63 2HG PRO 228 2HG PRO 228 -2.286 -9.550 4.015 64 1HD PRO 228 1HD PRO 228 -1.206 -8.593 1.610 65 2HD PRO 228 2HD PRO 228 -2.425 -7.754 2.581 66 H ASP 229 H ASP 229 1.068 -8.295 1.624 67 HA ASP 229 HA ASP 229 3.482 -9.792 2.424 68 1HB ASP 229 1HB ASP 229 2.303 -9.168 -0.306 69 2HB ASP 229 2HB ASP 229 3.765 -10.092 -0.027 70 H ALA 230 H ALA 230 2.572 -6.556 1.628 71 HA ALA 230 HA ALA 230 4.910 -5.784 0.226 72 1HB ALA 230 1HB ALA 230 2.759 -4.582 0.159 73 2HB ALA 230 2HB ALA 230 2.970 -4.072 1.850 74 3HB ALA 230 3HB ALA 230 4.086 -3.499 0.584 75 H LYS 231 H LYS 231 6.857 -5.022 0.795 76 HA LYS 231 HA LYS 231 7.351 -4.145 3.555 77 1HB LYS 231 1HB LYS 231 9.169 -6.055 2.002 78 2HB LYS 231 2HB LYS 231 9.669 -5.094 3.391 79 1HG LYS 231 1HG LYS 231 7.453 -6.270 4.444 80 2HG LYS 231 2HG LYS 231 7.894 -7.504 3.273 81 1HD LYS 231 1HD LYS 231 8.917 -8.084 5.365 82 2HD LYS 231 2HD LYS 231 10.223 -7.494 4.319 83 1HE LYS 231 1HE LYS 231 10.139 -5.297 5.403 84 2HE LYS 231 2HE LYS 231 8.756 -5.791 6.395 85 1HZ LYS 231 1HZ LYS 231 10.129 -7.210 7.636 86 2HZ LYS 231 2HZ LYS 231 11.362 -7.187 6.534 87 3HZ LYS 231 3HZ LYS 231 11.055 -5.866 7.405 88 H LYS 232 H LYS 232 8.271 -2.185 3.563 89 HA LYS 232 HA LYS 232 8.529 -0.652 1.412 90 1HB LYS 232 1HB LYS 232 9.383 0.980 2.742 91 2HB LYS 232 2HB LYS 232 8.927 -0.162 4.003 92 1HG LYS 232 1HG LYS 232 11.323 -1.001 3.966 93 2HG LYS 232 2HG LYS 232 11.692 0.413 2.938 94 1HD LYS 232 1HD LYS 232 10.549 1.857 4.704 95 2HD LYS 232 2HD LYS 232 10.477 0.423 5.741 96 1HE LYS 232 1HE LYS 232 12.942 1.818 4.662 97 2HE LYS 232 2HE LYS 232 12.359 1.800 6.324 98 1HZ LYS 232 1HZ LYS 232 13.981 0.196 6.335 99 2HZ LYS 232 2HZ LYS 232 12.655 -0.742 6.067 100 3HZ LYS 232 3HZ LYS 232 13.656 -0.298 4.811 101 HA PRO 233 HA PRO 233 11.826 -1.909 -1.150 102 1HB PRO 233 1HB PRO 233 12.646 0.927 -1.570 103 2HB PRO 233 2HB PRO 233 12.131 -0.284 -2.781 104 1HG PRO 233 1HG PRO 233 10.515 1.808 -1.967 105 2HG PRO 233 2HG PRO 233 9.866 0.252 -2.472 106 1HD PRO 233 1HD PRO 233 10.173 1.334 0.308 107 2HD PRO 233 2HD PRO 233 8.945 0.239 -0.389 108 H GLU 234 H GLU 234 13.854 -2.600 -0.657 109 HA GLU 234 HA GLU 234 15.322 -1.726 1.617 110 1HB GLU 234 1HB GLU 234 15.471 -3.782 -0.403 111 2HB GLU 234 2HB GLU 234 17.027 -2.975 -0.373 112 1HG GLU 234 1HG GLU 234 16.371 -3.375 2.369 113 2HG GLU 234 2HG GLU 234 15.829 -4.836 1.559 114 H ASP 235 H ASP 235 14.913 -0.095 -1.258 115 HA ASP 235 HA ASP 235 17.484 1.408 -1.039 116 1HB ASP 235 1HB ASP 235 16.176 0.209 -3.247 117 2HB ASP 235 2HB ASP 235 15.824 1.920 -3.405 118 H TRP 236 H TRP 236 14.261 1.657 -0.105 119 HA TRP 236 HA TRP 236 13.230 3.905 -1.157 120 1HB TRP 236 1HB TRP 236 12.074 2.299 0.287 121 2HB TRP 236 2HB TRP 236 12.942 2.891 1.698 122 HD1 TRP 236 HD TRP 236 11.741 4.635 3.044 123 HE1 TRP 236 1HE TRP 236 9.868 6.397 2.687 124 HE3 TRP 236 3HE TRP 236 10.839 3.843 -1.893 125 HZ2 TRP 236 2HZ TRP 236 7.913 6.962 0.666 126 HZ3 TRP 236 3HZ TRP 236 8.969 5.053 -3.046 127 HH2 TRP 236 HH TRP 236 7.455 6.538 -1.744 128 H ASP 237 H ASP 237 13.094 6.038 -0.778 129 HA ASP 237 HA ASP 237 15.520 7.163 0.546 130 1HB ASP 237 1HB ASP 237 14.027 8.018 -1.969 131 2HB ASP 237 2HB ASP 237 15.378 8.866 -1.210 132 H GLU 238 H GLU 238 14.255 7.296 2.512 133 HA GLU 238 HA GLU 238 11.873 8.798 2.802 134 1HB GLU 238 1HB GLU 238 14.076 8.299 4.797 135 2HB GLU 238 2HB GLU 238 12.476 8.885 5.202 136 1HG GLU 238 1HG GLU 238 11.452 6.834 4.290 137 2HG GLU 238 2HG GLU 238 13.053 6.231 3.831 138 H GLU 239 H GLU 239 15.068 9.939 2.141 139 HA GLU 239 HA GLU 239 14.600 12.633 3.183 140 1HB GLU 239 1HB GLU 239 16.846 11.037 2.834 141 2HB GLU 239 2HB GLU 239 16.978 12.139 1.466 142 1HG GLU 239 1HG GLU 239 16.525 13.124 4.323 143 2HG GLU 239 2HG GLU 239 18.116 12.682 3.724 144 H MET 240 H MET 240 13.613 10.965 0.513 145 HA MET 240 HA MET 240 13.495 13.380 -1.254 146 1HB MET 240 1HB MET 240 14.456 10.674 -1.743 147 2HB MET 240 2HB MET 240 13.102 11.035 -2.792 148 1HG MET 240 1HG MET 240 15.505 12.896 -2.504 149 2HG MET 240 2HG MET 240 15.512 11.498 -3.576 150 1HE MET 240 1HE MET 240 14.438 15.167 -3.110 151 2HE MET 240 2HE MET 240 13.230 15.425 -4.391 152 3HE MET 240 3HE MET 240 12.789 14.499 -2.947 153 H ASP 241 H ASP 241 11.829 10.579 0.096 154 HA ASP 241 HA ASP 241 9.352 11.436 -1.248 155 1HB ASP 241 1HB ASP 241 10.341 9.084 -1.665 156 2HB ASP 241 2HB ASP 241 9.744 8.698 -0.078 157 H GLY 242 H GLY 242 9.982 9.516 1.701 158 1HA GLY 242 1HA GLY 242 9.514 10.929 3.883 159 2HA GLY 242 2HA GLY 242 7.896 10.975 3.145 160 H GLU 243 H GLU 243 7.045 9.639 4.964 161 HA GLU 243 HA GLU 243 7.904 7.032 5.546 162 1HB GLU 243 1HB GLU 243 5.490 8.824 5.889 163 2HB GLU 243 2HB GLU 243 5.321 7.125 6.201 164 1HG GLU 243 1HG GLU 243 6.963 7.126 7.948 165 2HG GLU 243 2HG GLU 243 7.542 8.742 7.493 166 H TRP 244 H TRP 244 7.886 5.405 4.107 167 HA TRP 244 HA TRP 244 6.455 5.172 1.679 168 1HB TRP 244 1HB TRP 244 8.406 3.794 2.331 169 2HB TRP 244 2HB TRP 244 7.519 3.126 3.685 170 HD1 TRP 244 HD TRP 244 7.258 3.151 -0.192 171 HE1 TRP 244 1HE TRP 244 6.312 0.892 -0.959 172 HE3 TRP 244 3HE TRP 244 6.837 0.870 4.356 173 HZ2 TRP 244 2HZ TRP 244 5.344 -1.528 0.261 174 HZ3 TRP 244 3HZ TRP 244 6.071 -1.486 4.502 175 HH2 TRP 244 HH TRP 244 5.162 -2.624 2.513 176 H GLU 245 H GLU 245 4.455 4.069 1.198 177 HA GLU 245 HA GLU 245 2.707 3.292 3.490 178 1HB GLU 245 1HB GLU 245 0.802 3.836 2.222 179 2HB GLU 245 2HB GLU 245 1.853 5.250 2.100 180 1HG GLU 245 1HG GLU 245 2.631 4.366 -0.143 181 2HG GLU 245 2HG GLU 245 1.447 3.060 0.019 182 HA PRO 246 HA PRO 246 3.007 -0.570 1.092 183 1HB PRO 246 1HB PRO 246 0.952 -2.026 2.236 184 2HB PRO 246 2HB PRO 246 2.614 -1.903 2.884 185 1HG PRO 246 1HG PRO 246 0.122 -0.635 3.917 186 2HG PRO 246 2HG PRO 246 1.693 -0.951 4.719 187 1HD PRO 246 1HD PRO 246 0.712 1.532 3.485 188 2HD PRO 246 2HD PRO 246 2.204 1.261 4.430 189 HA PRO 247 HA PRO 247 -0.456 0.147 -1.728 190 1HB PRO 247 1HB PRO 247 -0.486 -2.664 -2.488 191 2HB PRO 247 2HB PRO 247 0.030 -1.259 -3.469 192 1HG PRO 247 1HG PRO 247 1.782 -3.208 -2.530 193 2HG PRO 247 2HG PRO 247 2.245 -1.518 -2.901 194 1HD PRO 247 1HD PRO 247 1.622 -2.754 -0.241 195 2HD PRO 247 2HD PRO 247 2.866 -1.555 -0.666 196 H VAL 248 H VAL 248 -2.658 -1.276 -2.447 197 HA VAL 248 HA VAL 248 -3.717 -2.762 -0.216 198 HB VAL 248 HB VAL 248 -5.774 -1.663 -0.670 199 1HG1 VAL 248 1HG1 VAL 248 -4.340 -0.657 1.057 200 2HG1 VAL 248 2HG1 VAL 248 -3.615 0.417 -0.150 201 3HG1 VAL 248 3HG1 VAL 248 -5.338 0.581 0.288 202 1HG2 VAL 248 1HG2 VAL 248 -5.645 -1.045 -2.999 203 2HG2 VAL 248 2HG2 VAL 248 -6.017 0.385 -2.043 204 3HG2 VAL 248 3HG2 VAL 248 -4.366 0.115 -2.641 205 H ILE 249 H ILE 249 -5.834 -3.796 -1.107 206 HA ILE 249 HA ILE 249 -5.454 -4.902 -3.797 207 HB ILE 249 HB ILE 249 -5.825 -7.091 -3.008 208 1HG1 ILE 249 1HG1 ILE 249 -6.161 -6.146 -0.132 209 2HG1 ILE 249 2HG1 ILE 249 -7.512 -6.544 -1.189 210 1HG2 ILE 249 1HG2 ILE 249 -3.499 -6.144 -2.691 211 2HG2 ILE 249 2HG2 ILE 249 -3.886 -5.887 -0.982 212 3HG2 ILE 249 3HG2 ILE 249 -3.858 -7.529 -1.630 213 1HD1 ILE 249 1HD1 ILE 249 -5.396 -8.461 -0.208 214 2HD1 ILE 249 2HD1 ILE 249 -7.114 -8.432 0.192 215 3HD1 ILE 249 3HD1 ILE 249 -6.603 -8.857 -1.455 216 H GLN 250 H GLN 250 -7.430 -5.385 -4.718 217 HA GLN 250 HA GLN 250 -9.819 -4.031 -3.968 218 1HB GLN 250 1HB GLN 250 -10.948 -5.303 -5.649 219 2HB GLN 250 2HB GLN 250 -9.358 -4.906 -6.243 220 1HG GLN 250 1HG GLN 250 -9.529 -7.072 -6.971 221 2HG GLN 250 2HG GLN 250 -8.660 -7.298 -5.464 222 1HE2 GLN 250 1HE2 GLN 250 -12.253 -6.827 -6.038 223 2HE2 GLN 250 2HE2 GLN 250 -12.665 -8.397 -5.403 224 H ASN 251 H ASN 251 -11.272 -4.510 -2.358 225 HA ASN 251 HA ASN 251 -10.501 -6.526 -0.456 226 1HB ASN 251 1HB ASN 251 -11.691 -4.519 0.262 227 2HB ASN 251 2HB ASN 251 -13.040 -4.947 -0.766 228 1HD2 ASN 251 1HD2 ASN 251 -13.941 -4.521 1.597 229 2HD2 ASN 251 2HD2 ASN 251 -14.394 -6.102 2.255 230 HA PRO 252 HA PRO 252 -12.369 -9.826 -2.884 231 1HB PRO 252 1HB PRO 252 -12.052 -11.933 -1.139 232 2HB PRO 252 2HB PRO 252 -10.730 -11.203 -2.099 233 1HG PRO 252 1HG PRO 252 -11.496 -10.583 0.768 234 2HG PRO 252 2HG PRO 252 -9.873 -10.988 0.140 235 1HD PRO 252 1HD PRO 252 -10.594 -8.436 0.498 236 2HD PRO 252 2HD PRO 252 -9.676 -8.899 -0.964 237 H GLU 253 H GLU 253 -13.759 -8.467 -0.063 238 HA GLU 253 HA GLU 253 -16.218 -8.929 -1.312 239 1HB GLU 253 1HB GLU 253 -15.750 -10.682 0.979 240 2HB GLU 253 2HB GLU 253 -17.034 -9.533 1.369 241 1HG GLU 253 1HG GLU 253 -18.243 -10.083 -0.689 242 2HG GLU 253 2HG GLU 253 -17.004 -11.257 -1.140 243 H TYR 254 H TYR 254 -15.504 -6.779 -1.587 244 HA TYR 254 HA TYR 254 -15.998 -4.847 0.600 245 1HB TYR 254 1HB TYR 254 -14.771 -3.887 -1.141 246 2HB TYR 254 2HB TYR 254 -15.663 -4.736 -2.394 247 HD1 TYR 254 1HD TYR 254 -16.364 -2.217 0.363 248 HD2 TYR 254 2HD TYR 254 -16.950 -3.418 -3.736 249 HE1 TYR 254 1HE TYR 254 -17.590 -0.106 -0.087 250 HE2 TYR 254 2HE TYR 254 -18.164 -1.312 -4.196 251 HH TYR 254 HH TYR 254 -18.626 1.205 -1.679 252 H LYS 255 H LYS 255 -18.035 -3.676 0.741 253 HA LYS 255 HA LYS 255 -20.356 -4.926 -0.573 254 1HB LYS 255 1HB LYS 255 -19.853 -5.940 1.738 255 2HB LYS 255 2HB LYS 255 -20.339 -4.419 2.431 256 1HG LYS 255 1HG LYS 255 -22.369 -5.293 2.432 257 2HG LYS 255 2HG LYS 255 -22.474 -4.925 0.717 258 1HD LYS 255 1HD LYS 255 -21.807 -7.208 0.151 259 2HD LYS 255 2HD LYS 255 -21.382 -7.542 1.842 260 1HE LYS 255 1HE LYS 255 -23.700 -7.339 2.550 261 2HE LYS 255 2HE LYS 255 -24.211 -6.960 0.899 262 1HZ LYS 255 1HZ LYS 255 -23.679 -9.118 0.219 263 2HZ LYS 255 2HZ LYS 255 -22.830 -9.489 1.583 264 3HZ LYS 255 3HZ LYS 255 -24.480 -9.321 1.635 265 H GLY 256 H GLY 256 -20.273 -2.479 2.134 266 1HA GLY 256 1HA GLY 256 -20.340 -0.110 0.754 267 2HA GLY 256 2HA GLY 256 -21.978 -0.753 0.681 Start of MODEL 9 1 H GLY 220 H GLY 220 -17.727 -4.122 9.531 2 1HA GLY 220 1HA GLY 220 -18.004 -5.821 7.122 3 2HA GLY 220 2HA GLY 220 -18.659 -4.177 7.242 4 H LYS 221 H LYS 221 -16.370 -5.613 5.642 5 HA LYS 221 HA LYS 221 -14.003 -4.088 6.429 6 1HB LYS 221 1HB LYS 221 -14.737 -6.148 4.366 7 2HB LYS 221 2HB LYS 221 -13.487 -5.002 3.915 8 1HG LYS 221 1HG LYS 221 -11.963 -5.811 5.317 9 2HG LYS 221 2HG LYS 221 -13.123 -6.136 6.609 10 1HD LYS 221 1HD LYS 221 -13.787 -8.215 5.645 11 2HD LYS 221 2HD LYS 221 -12.993 -7.861 4.110 12 1HE LYS 221 1HE LYS 221 -11.779 -9.522 5.512 13 2HE LYS 221 2HE LYS 221 -10.798 -8.128 5.063 14 1HZ LYS 221 1HZ LYS 221 -12.188 -8.153 7.657 15 2HZ LYS 221 2HZ LYS 221 -10.770 -8.958 7.468 16 3HZ LYS 221 3HZ LYS 221 -10.844 -7.343 7.227 17 HA PRO 222 HA PRO 222 -14.728 -0.568 3.802 18 1HB PRO 222 1HB PRO 222 -12.087 0.017 3.042 19 2HB PRO 222 2HB PRO 222 -12.879 0.527 4.554 20 1HG PRO 222 1HG PRO 222 -10.985 -1.764 4.077 21 2HG PRO 222 2HG PRO 222 -11.122 -0.705 5.506 22 1HD PRO 222 1HD PRO 222 -12.138 -3.263 5.330 23 2HD PRO 222 2HD PRO 222 -12.841 -2.006 6.394 24 H GLU 223 H GLU 223 -14.132 0.281 1.729 25 HA GLU 223 HA GLU 223 -14.852 -1.131 -0.525 26 1HB GLU 223 1HB GLU 223 -13.799 0.880 -1.646 27 2HB GLU 223 2HB GLU 223 -15.071 1.202 -0.480 28 1HG GLU 223 1HG GLU 223 -12.228 1.262 0.508 29 2HG GLU 223 2HG GLU 223 -12.753 2.564 -0.550 30 H HIS 224 H HIS 224 -11.521 -0.834 0.801 31 HA HIS 224 HA HIS 224 -10.675 -2.871 -1.141 32 1HB HIS 224 1HB HIS 224 -8.975 -0.423 -0.712 33 2HB HIS 224 2HB HIS 224 -8.708 -1.719 -1.864 34 HD1 HIS 224 1HD HIS 224 -9.766 1.726 -1.758 35 HD2 HIS 224 2HD HIS 224 -10.753 -1.713 -3.944 36 HE1 HIS 224 1HE HIS 224 -11.000 2.557 -3.783 37 H ILE 225 H ILE 225 -8.238 -3.512 -0.330 38 HA ILE 225 HA ILE 225 -8.231 -3.507 2.661 39 HB ILE 225 HB ILE 225 -8.202 -5.807 0.734 40 1HG1 ILE 225 1HG1 ILE 225 -9.899 -4.829 3.038 41 2HG1 ILE 225 2HG1 ILE 225 -10.369 -5.206 1.378 42 1HG2 ILE 225 1HG2 ILE 225 -7.525 -7.348 2.458 43 2HG2 ILE 225 2HG2 ILE 225 -6.278 -6.137 2.321 44 3HG2 ILE 225 3HG2 ILE 225 -7.448 -6.063 3.661 45 1HD1 ILE 225 1HD1 ILE 225 -9.600 -7.084 3.585 46 2HD1 ILE 225 2HD1 ILE 225 -11.211 -6.878 2.860 47 3HD1 ILE 225 3HD1 ILE 225 -9.906 -7.616 1.889 48 HA PRO 226 HA PRO 226 -4.045 -2.385 1.615 49 1HB PRO 226 1HB PRO 226 -2.751 -2.438 3.953 50 2HB PRO 226 2HB PRO 226 -4.108 -1.299 3.659 51 1HG PRO 226 1HG PRO 226 -4.150 -3.884 5.216 52 2HG PRO 226 2HG PRO 226 -4.998 -2.346 5.575 53 1HD PRO 226 1HD PRO 226 -6.057 -4.613 4.262 54 2HD PRO 226 2HD PRO 226 -6.832 -3.020 4.251 55 H ASP 227 H ASP 227 -1.724 -3.117 1.788 56 HA ASP 227 HA ASP 227 -1.629 -6.066 1.370 57 1HB ASP 227 1HB ASP 227 -1.191 -4.559 -0.561 58 2HB ASP 227 2HB ASP 227 0.261 -3.987 0.260 59 HA PRO 228 HA PRO 228 1.231 -5.775 4.954 60 1HB PRO 228 1HB PRO 228 0.770 -8.201 6.025 61 2HB PRO 228 2HB PRO 228 -0.490 -6.934 6.084 62 1HG PRO 228 1HG PRO 228 -0.215 -9.213 4.080 63 2HG PRO 228 2HG PRO 228 -1.669 -8.738 5.035 64 1HD PRO 228 1HD PRO 228 -1.308 -7.840 2.475 65 2HD PRO 228 2HD PRO 228 -2.025 -6.843 3.717 66 H ASP 229 H ASP 229 1.200 -7.897 2.260 67 HA ASP 229 HA ASP 229 3.662 -9.435 2.882 68 1HB ASP 229 1HB ASP 229 2.024 -10.071 1.020 69 2HB ASP 229 2HB ASP 229 2.699 -8.762 0.058 70 H ALA 230 H ALA 230 2.841 -6.607 0.959 71 HA ALA 230 HA ALA 230 5.326 -5.883 -0.035 72 1HB ALA 230 1HB ALA 230 3.014 -4.114 0.870 73 2HB ALA 230 2HB ALA 230 4.310 -3.621 -0.256 74 3HB ALA 230 3HB ALA 230 3.154 -4.896 -0.712 75 H LYS 231 H LYS 231 7.026 -4.604 0.635 76 HA LYS 231 HA LYS 231 6.939 -3.332 3.297 77 1HB LYS 231 1HB LYS 231 9.029 -5.291 2.263 78 2HB LYS 231 2HB LYS 231 9.433 -4.061 3.440 79 1HG LYS 231 1HG LYS 231 7.016 -5.397 4.365 80 2HG LYS 231 2HG LYS 231 8.200 -6.612 3.897 81 1HD LYS 231 1HD LYS 231 8.543 -6.109 6.208 82 2HD LYS 231 2HD LYS 231 9.905 -5.422 5.327 83 1HE LYS 231 1HE LYS 231 8.733 -3.180 5.354 84 2HE LYS 231 2HE LYS 231 7.468 -3.907 6.370 85 1HZ LYS 231 1HZ LYS 231 10.337 -3.749 7.059 86 2HZ LYS 231 2HZ LYS 231 9.193 -2.776 7.683 87 3HZ LYS 231 3HZ LYS 231 9.149 -4.390 8.013 88 H LYS 232 H LYS 232 8.282 -1.477 3.414 89 HA LYS 232 HA LYS 232 9.034 0.214 1.547 90 1HB LYS 232 1HB LYS 232 10.709 -0.777 3.832 91 2HB LYS 232 2HB LYS 232 11.158 0.597 2.836 92 1HG LYS 232 1HG LYS 232 9.019 1.713 3.444 93 2HG LYS 232 2HG LYS 232 8.675 0.385 4.568 94 1HD LYS 232 1HD LYS 232 9.986 1.354 6.159 95 2HD LYS 232 2HD LYS 232 11.362 1.291 5.084 96 1HE LYS 232 1HE LYS 232 11.319 3.529 5.299 97 2HE LYS 232 2HE LYS 232 10.169 3.422 3.961 98 1HZ LYS 232 1HZ LYS 232 9.327 4.810 5.786 99 2HZ LYS 232 2HZ LYS 232 8.406 3.410 5.771 100 3HZ LYS 232 3HZ LYS 232 9.599 3.646 6.849 101 HA PRO 233 HA PRO 233 11.617 -2.143 -1.312 102 1HB PRO 233 1HB PRO 233 12.632 0.456 -2.305 103 2HB PRO 233 2HB PRO 233 11.754 -0.820 -3.174 104 1HG PRO 233 1HG PRO 233 10.749 1.672 -2.312 105 2HG PRO 233 2HG PRO 233 9.761 0.322 -2.859 106 1HD PRO 233 1HD PRO 233 10.121 1.342 -0.133 107 2HD PRO 233 2HD PRO 233 8.953 0.141 -0.741 108 H GLU 234 H GLU 234 13.710 -2.781 -1.396 109 HA GLU 234 HA GLU 234 15.648 -1.949 0.591 110 1HB GLU 234 1HB GLU 234 15.448 -3.743 -1.818 111 2HB GLU 234 2HB GLU 234 17.072 -3.274 -1.264 112 1HG GLU 234 1HG GLU 234 16.425 -4.053 1.050 113 2HG GLU 234 2HG GLU 234 14.920 -4.676 0.381 114 H ASP 235 H ASP 235 14.651 -0.703 -2.443 115 HA ASP 235 HA ASP 235 17.044 1.020 -2.816 116 1HB ASP 235 1HB ASP 235 14.740 0.080 -4.544 117 2HB ASP 235 2HB ASP 235 15.531 1.594 -4.929 118 H TRP 236 H TRP 236 14.413 1.156 -0.826 119 HA TRP 236 HA TRP 236 13.237 3.653 -1.542 120 1HB TRP 236 1HB TRP 236 12.190 1.874 -0.121 121 2HB TRP 236 2HB TRP 236 13.297 2.295 1.184 122 HD1 TRP 236 HD TRP 236 12.348 3.928 2.830 123 HE1 TRP 236 1HE TRP 236 10.576 5.856 2.817 124 HE3 TRP 236 3HE TRP 236 11.032 3.765 -2.061 125 HZ2 TRP 236 2HZ TRP 236 8.695 6.968 0.959 126 HZ3 TRP 236 3HZ TRP 236 9.278 5.395 -2.963 127 HH2 TRP 236 HH TRP 236 8.089 6.891 -1.431 128 H ASP 237 H ASP 237 13.307 5.595 -0.431 129 HA ASP 237 HA ASP 237 15.932 6.331 0.745 130 1HB ASP 237 1HB ASP 237 14.350 7.772 -1.445 131 2HB ASP 237 2HB ASP 237 15.827 8.324 -0.675 132 H GLU 238 H GLU 238 14.685 6.290 2.838 133 HA GLU 238 HA GLU 238 12.381 7.923 3.251 134 1HB GLU 238 1HB GLU 238 14.546 7.314 5.293 135 2HB GLU 238 2HB GLU 238 12.880 7.827 5.629 136 1HG GLU 238 1HG GLU 238 12.069 5.740 4.506 137 2HG GLU 238 2HG GLU 238 13.734 5.192 4.341 138 H GLU 239 H GLU 239 15.730 8.784 2.897 139 HA GLU 239 HA GLU 239 15.482 11.366 4.143 140 1HB GLU 239 1HB GLU 239 17.460 9.615 3.867 141 2HB GLU 239 2HB GLU 239 17.808 10.504 2.393 142 1HG GLU 239 1HG GLU 239 17.464 11.956 5.030 143 2HG GLU 239 2HG GLU 239 18.965 11.086 4.699 144 H MET 240 H MET 240 14.663 10.210 1.099 145 HA MET 240 HA MET 240 14.743 12.940 -0.167 146 1HB MET 240 1HB MET 240 14.957 10.171 -1.294 147 2HB MET 240 2HB MET 240 14.059 11.330 -2.225 148 1HG MET 240 1HG MET 240 16.908 11.857 -1.285 149 2HG MET 240 2HG MET 240 16.515 11.004 -2.753 150 1HE MET 240 1HE MET 240 16.573 15.520 -2.207 151 2HE MET 240 2HE MET 240 15.593 14.633 -1.031 152 3HE MET 240 3HE MET 240 17.328 14.264 -1.201 153 H ASP 241 H ASP 241 12.835 10.006 0.423 154 HA ASP 241 HA ASP 241 10.414 11.451 -0.454 155 1HB ASP 241 1HB ASP 241 11.275 9.102 -1.415 156 2HB ASP 241 2HB ASP 241 10.383 8.504 -0.032 157 H GLY 242 H GLY 242 10.919 8.815 1.951 158 1HA GLY 242 1HA GLY 242 10.786 9.598 4.385 159 2HA GLY 242 2HA GLY 242 9.325 10.451 3.904 160 H GLU 243 H GLU 243 7.653 9.377 4.864 161 HA GLU 243 HA GLU 243 7.581 6.566 5.281 162 1HB GLU 243 1HB GLU 243 5.928 8.986 5.881 163 2HB GLU 243 2HB GLU 243 5.092 7.478 5.684 164 1HG GLU 243 1HG GLU 243 6.657 6.410 7.337 165 2HG GLU 243 2HG GLU 243 7.306 8.021 7.666 166 H TRP 244 H TRP 244 7.789 5.626 3.444 167 HA TRP 244 HA TRP 244 6.133 5.449 1.169 168 1HB TRP 244 1HB TRP 244 8.187 4.152 1.616 169 2HB TRP 244 2HB TRP 244 7.462 3.439 3.026 170 HD1 TRP 244 HD TRP 244 7.105 3.372 -0.805 171 HE1 TRP 244 1HE TRP 244 6.258 1.021 -1.483 172 HE3 TRP 244 3HE TRP 244 6.559 1.314 3.843 173 HZ2 TRP 244 2HZ TRP 244 5.334 -1.356 -0.173 174 HZ3 TRP 244 3HZ TRP 244 5.921 -1.052 4.085 175 HH2 TRP 244 HH TRP 244 5.044 -2.314 2.121 176 H GLU 245 H GLU 245 4.162 4.347 0.844 177 HA GLU 245 HA GLU 245 2.810 3.156 3.173 178 1HB GLU 245 1HB GLU 245 1.566 5.044 2.827 179 2HB GLU 245 2HB GLU 245 1.524 4.873 1.049 180 1HG GLU 245 1HG GLU 245 0.216 2.589 1.887 181 2HG GLU 245 2HG GLU 245 -0.133 3.630 3.238 182 HA PRO 246 HA PRO 246 3.158 -0.343 0.376 183 1HB PRO 246 1HB PRO 246 0.980 -1.787 1.678 184 2HB PRO 246 2HB PRO 246 2.748 -2.038 1.856 185 1HG PRO 246 1HG PRO 246 0.972 -0.920 3.771 186 2HG PRO 246 2HG PRO 246 2.742 -1.092 3.912 187 1HD PRO 246 1HD PRO 246 1.146 1.324 3.375 188 2HD PRO 246 2HD PRO 246 2.870 1.200 3.776 189 HA PRO 247 HA PRO 247 -0.386 0.049 -2.316 190 1HB PRO 247 1HB PRO 247 -0.607 -2.482 -3.427 191 2HB PRO 247 2HB PRO 247 0.524 -1.232 -3.921 192 1HG PRO 247 1HG PRO 247 1.015 -3.662 -2.233 193 2HG PRO 247 2HG PRO 247 2.135 -2.851 -3.336 194 1HD PRO 247 1HD PRO 247 2.048 -2.603 -0.534 195 2HD PRO 247 2HD PRO 247 2.926 -1.495 -1.654 196 H VAL 248 H VAL 248 -2.450 -1.409 -2.897 197 HA VAL 248 HA VAL 248 -3.607 -2.606 -0.467 198 HB VAL 248 HB VAL 248 -5.664 -1.638 -1.294 199 1HG1 VAL 248 1HG1 VAL 248 -5.252 0.743 -0.601 200 2HG1 VAL 248 2HG1 VAL 248 -4.414 -0.418 0.464 201 3HG1 VAL 248 3HG1 VAL 248 -3.516 0.452 -0.792 202 1HG2 VAL 248 1HG2 VAL 248 -5.238 -1.320 -3.648 203 2HG2 VAL 248 2HG2 VAL 248 -5.781 0.184 -2.931 204 3HG2 VAL 248 3HG2 VAL 248 -4.061 -0.060 -3.284 205 H ILE 249 H ILE 249 -5.754 -3.740 -1.448 206 HA ILE 249 HA ILE 249 -5.172 -5.246 -3.864 207 HB ILE 249 HB ILE 249 -5.523 -7.338 -2.811 208 1HG1 ILE 249 1HG1 ILE 249 -6.004 -6.064 -0.116 209 2HG1 ILE 249 2HG1 ILE 249 -7.288 -6.623 -1.175 210 1HG2 ILE 249 1HG2 ILE 249 -3.695 -5.815 -0.882 211 2HG2 ILE 249 2HG2 ILE 249 -3.606 -7.534 -1.267 212 3HG2 ILE 249 3HG2 ILE 249 -3.231 -6.341 -2.506 213 1HD1 ILE 249 1HD1 ILE 249 -5.166 -8.358 0.126 214 2HD1 ILE 249 2HD1 ILE 249 -6.916 -8.353 0.409 215 3HD1 ILE 249 3HD1 ILE 249 -6.286 -8.920 -1.150 216 H GLN 250 H GLN 250 -7.162 -5.888 -4.828 217 HA GLN 250 HA GLN 250 -9.536 -4.322 -4.259 218 1HB GLN 250 1HB GLN 250 -10.579 -5.504 -5.974 219 2HB GLN 250 2HB GLN 250 -8.918 -5.327 -6.480 220 1HG GLN 250 1HG GLN 250 -9.389 -7.487 -7.146 221 2HG GLN 250 2HG GLN 250 -8.584 -7.753 -5.606 222 1HE2 GLN 250 1HE2 GLN 250 -11.932 -7.173 -6.898 223 2HE2 GLN 250 2HE2 GLN 250 -12.717 -8.284 -5.756 224 H ASN 251 H ASN 251 -11.413 -4.960 -3.075 225 HA ASN 251 HA ASN 251 -10.668 -6.763 -0.878 226 1HB ASN 251 1HB ASN 251 -11.909 -4.637 -0.429 227 2HB ASN 251 2HB ASN 251 -13.263 -5.287 -1.330 228 1HD2 ASN 251 1HD2 ASN 251 -13.411 -4.508 1.469 229 2HD2 ASN 251 2HD2 ASN 251 -13.766 -6.017 2.306 230 HA PRO 252 HA PRO 252 -12.614 -10.096 -3.255 231 1HB PRO 252 1HB PRO 252 -12.510 -12.096 -1.361 232 2HB PRO 252 2HB PRO 252 -11.095 -11.556 -2.344 233 1HG PRO 252 1HG PRO 252 -11.851 -10.675 0.442 234 2HG PRO 252 2HG PRO 252 -10.260 -11.288 -0.147 235 1HD PRO 252 1HD PRO 252 -10.732 -8.648 0.040 236 2HD PRO 252 2HD PRO 252 -9.870 -9.282 -1.382 237 H GLU 253 H GLU 253 -13.678 -8.897 -0.076 238 HA GLU 253 HA GLU 253 -16.482 -9.762 -0.513 239 1HB GLU 253 1HB GLU 253 -14.747 -10.263 1.938 240 2HB GLU 253 2HB GLU 253 -16.511 -10.418 1.906 241 1HG GLU 253 1HG GLU 253 -16.377 -12.212 0.253 242 2HG GLU 253 2HG GLU 253 -14.625 -12.037 0.148 243 H TYR 254 H TYR 254 -15.794 -7.328 -1.186 244 HA TYR 254 HA TYR 254 -15.726 -5.326 0.872 245 1HB TYR 254 1HB TYR 254 -15.220 -4.594 -1.325 246 2HB TYR 254 2HB TYR 254 -16.678 -5.300 -1.993 247 HD1 TYR 254 1HD TYR 254 -16.008 -2.939 0.936 248 HD2 TYR 254 2HD TYR 254 -18.071 -3.629 -2.799 249 HE1 TYR 254 1HE TYR 254 -17.140 -0.749 1.149 250 HE2 TYR 254 2HE TYR 254 -19.192 -1.448 -2.595 251 HH TYR 254 HH TYR 254 -18.970 0.638 -1.513 252 H LYS 255 H LYS 255 -17.094 -4.845 2.353 253 HA LYS 255 HA LYS 255 -18.878 -4.570 3.566 254 1HB LYS 255 1HB LYS 255 -19.153 -3.191 1.329 255 2HB LYS 255 2HB LYS 255 -20.566 -4.208 1.104 256 1HG LYS 255 1HG LYS 255 -21.702 -3.150 2.744 257 2HG LYS 255 2HG LYS 255 -20.350 -3.124 3.874 258 1HD LYS 255 1HD LYS 255 -19.310 -1.270 2.589 259 2HD LYS 255 2HD LYS 255 -20.746 -1.205 1.543 260 1HE LYS 255 1HE LYS 255 -21.213 0.449 3.131 261 2HE LYS 255 2HE LYS 255 -22.092 -0.963 3.767 262 1HZ LYS 255 1HZ LYS 255 -20.060 -1.335 5.208 263 2HZ LYS 255 2HZ LYS 255 -19.483 0.099 4.640 264 3HZ LYS 255 3HZ LYS 255 -20.867 0.050 5.528 265 H GLY 256 H GLY 256 -18.394 -7.408 2.728 266 1HA GLY 256 1HA GLY 256 -20.968 -8.729 2.670 267 2HA GLY 256 2HA GLY 256 -19.425 -9.423 3.204 Start of MODEL 10 1 H GLY 220 H GLY 220 -15.996 -1.045 10.400 2 1HA GLY 220 1HA GLY 220 -15.515 -3.382 9.946 3 2HA GLY 220 2HA GLY 220 -16.520 -2.717 8.645 4 H LYS 221 H LYS 221 -15.726 -3.624 6.658 5 HA LYS 221 HA LYS 221 -12.839 -3.261 6.203 6 1HB LYS 221 1HB LYS 221 -13.194 -4.894 4.433 7 2HB LYS 221 2HB LYS 221 -13.103 -5.495 6.067 8 1HG LYS 221 1HG LYS 221 -15.911 -5.159 5.315 9 2HG LYS 221 2HG LYS 221 -15.060 -6.003 4.029 10 1HD LYS 221 1HD LYS 221 -14.073 -7.527 5.785 11 2HD LYS 221 2HD LYS 221 -15.163 -6.776 6.973 12 1HE LYS 221 1HE LYS 221 -17.112 -7.508 5.598 13 2HE LYS 221 2HE LYS 221 -15.998 -8.187 4.397 14 1HZ LYS 221 1HZ LYS 221 -16.725 -9.916 5.733 15 2HZ LYS 221 2HZ LYS 221 -15.180 -9.678 6.175 16 3HZ LYS 221 3HZ LYS 221 -16.387 -9.140 7.154 17 HA PRO 222 HA PRO 222 -14.740 -0.166 3.525 18 1HB PRO 222 1HB PRO 222 -12.313 0.860 2.507 19 2HB PRO 222 2HB PRO 222 -13.159 1.381 3.990 20 1HG PRO 222 1HG PRO 222 -10.683 -0.150 3.713 21 2HG PRO 222 2HG PRO 222 -11.352 0.646 5.158 22 1HD PRO 222 1HD PRO 222 -11.446 -2.181 4.446 23 2HD PRO 222 2HD PRO 222 -12.025 -1.371 5.930 24 H GLU 223 H GLU 223 -14.038 0.597 1.122 25 HA GLU 223 HA GLU 223 -14.688 -1.539 -0.627 26 1HB GLU 223 1HB GLU 223 -13.540 1.232 -1.099 27 2HB GLU 223 2HB GLU 223 -14.084 0.166 -2.400 28 1HG GLU 223 1HG GLU 223 -16.329 0.218 -1.734 29 2HG GLU 223 2HG GLU 223 -15.960 0.776 -0.098 30 H HIS 224 H HIS 224 -11.518 -0.496 0.603 31 HA HIS 224 HA HIS 224 -10.307 -2.540 -1.154 32 1HB HIS 224 1HB HIS 224 -9.047 0.155 -0.522 33 2HB HIS 224 2HB HIS 224 -8.312 -1.165 -1.418 34 HD1 HIS 224 1HD HIS 224 -10.657 1.757 -1.955 35 HD2 HIS 224 2HD HIS 224 -9.504 -1.851 -3.832 36 HE1 HIS 224 1HE HIS 224 -11.627 1.815 -4.331 37 H ILE 225 H ILE 225 -8.355 -3.451 -0.301 38 HA ILE 225 HA ILE 225 -8.074 -3.356 2.650 39 HB ILE 225 HB ILE 225 -8.335 -5.673 0.719 40 1HG1 ILE 225 1HG1 ILE 225 -9.692 -4.601 3.214 41 2HG1 ILE 225 2HG1 ILE 225 -10.374 -5.006 1.653 42 1HG2 ILE 225 1HG2 ILE 225 -7.535 -7.232 2.344 43 2HG2 ILE 225 2HG2 ILE 225 -6.253 -6.093 2.015 44 3HG2 ILE 225 3HG2 ILE 225 -7.206 -5.950 3.517 45 1HD1 ILE 225 1HD1 ILE 225 -9.957 -7.432 2.218 46 2HD1 ILE 225 2HD1 ILE 225 -9.413 -6.866 3.820 47 3HD1 ILE 225 3HD1 ILE 225 -11.092 -6.598 3.314 48 HA PRO 226 HA PRO 226 -4.017 -2.216 1.122 49 1HB PRO 226 1HB PRO 226 -2.444 -2.516 3.236 50 2HB PRO 226 2HB PRO 226 -3.708 -1.248 3.222 51 1HG PRO 226 1HG PRO 226 -3.759 -3.901 4.658 52 2HG PRO 226 2HG PRO 226 -4.474 -2.343 5.159 53 1HD PRO 226 1HD PRO 226 -5.766 -4.495 3.891 54 2HD PRO 226 2HD PRO 226 -6.470 -2.890 4.113 55 H ASP 227 H ASP 227 -1.832 -3.188 0.917 56 HA ASP 227 HA ASP 227 -1.949 -6.164 0.710 57 1HB ASP 227 1HB ASP 227 -1.060 -4.972 -1.220 58 2HB ASP 227 2HB ASP 227 0.176 -4.225 -0.220 59 HA PRO 228 HA PRO 228 -0.036 -5.679 4.823 60 1HB PRO 228 1HB PRO 228 -0.559 -8.115 5.864 61 2HB PRO 228 2HB PRO 228 -1.889 -6.948 5.544 62 1HG PRO 228 1HG PRO 228 -0.966 -9.238 3.776 63 2HG PRO 228 2HG PRO 228 -2.630 -8.869 4.294 64 1HD PRO 228 1HD PRO 228 -1.612 -8.053 1.892 65 2HD PRO 228 2HD PRO 228 -2.829 -7.112 2.787 66 H ASP 229 H ASP 229 0.590 -8.133 2.365 67 HA ASP 229 HA ASP 229 2.965 -9.309 3.531 68 1HB ASP 229 1HB ASP 229 1.754 -10.612 1.963 69 2HB ASP 229 2HB ASP 229 1.683 -9.299 0.778 70 H ALA 230 H ALA 230 2.283 -6.618 1.365 71 HA ALA 230 HA ALA 230 4.684 -5.965 0.232 72 1HB ALA 230 1HB ALA 230 2.669 -4.060 1.500 73 2HB ALA 230 2HB ALA 230 3.844 -3.634 0.249 74 3HB ALA 230 3HB ALA 230 2.568 -4.752 -0.155 75 H LYS 231 H LYS 231 6.556 -4.879 0.739 76 HA LYS 231 HA LYS 231 6.785 -3.513 3.391 77 1HB LYS 231 1HB LYS 231 8.664 -5.616 2.218 78 2HB LYS 231 2HB LYS 231 9.320 -4.257 3.130 79 1HG LYS 231 1HG LYS 231 8.005 -4.826 5.112 80 2HG LYS 231 2HG LYS 231 7.220 -6.160 4.228 81 1HD LYS 231 1HD LYS 231 9.013 -7.011 5.649 82 2HD LYS 231 2HD LYS 231 9.360 -7.290 3.934 83 1HE LYS 231 1HE LYS 231 10.823 -5.215 3.994 84 2HE LYS 231 2HE LYS 231 10.565 -5.132 5.733 85 1HZ LYS 231 1HZ LYS 231 11.653 -7.288 5.920 86 2HZ LYS 231 2HZ LYS 231 11.778 -7.404 4.282 87 3HZ LYS 231 3HZ LYS 231 12.621 -6.233 5.064 88 H LYS 232 H LYS 232 7.825 -1.533 3.181 89 HA LYS 232 HA LYS 232 8.325 -0.283 0.869 90 1HB LYS 232 1HB LYS 232 9.745 1.271 2.052 91 2HB LYS 232 2HB LYS 232 8.447 0.765 3.100 92 1HG LYS 232 1HG LYS 232 9.940 -0.787 4.289 93 2HG LYS 232 2HG LYS 232 11.241 -0.389 3.157 94 1HD LYS 232 1HD LYS 232 11.618 0.840 5.209 95 2HD LYS 232 2HD LYS 232 11.222 1.947 3.884 96 1HE LYS 232 1HE LYS 232 10.058 2.727 5.815 97 2HE LYS 232 2HE LYS 232 8.865 2.076 4.706 98 1HZ LYS 232 1HZ LYS 232 8.264 1.249 6.734 99 2HZ LYS 232 2HZ LYS 232 9.041 -0.032 6.126 100 3HZ LYS 232 3HZ LYS 232 9.799 0.902 7.235 101 HA PRO 233 HA PRO 233 11.731 -2.012 -1.293 102 1HB PRO 233 1HB PRO 233 12.924 0.614 -1.911 103 2HB PRO 233 2HB PRO 233 12.214 -0.587 -3.017 104 1HG PRO 233 1HG PRO 233 11.012 1.817 -2.346 105 2HG PRO 233 2HG PRO 233 10.134 0.386 -2.895 106 1HD PRO 233 1HD PRO 233 10.356 1.459 -0.119 107 2HD PRO 233 2HD PRO 233 9.066 0.518 -0.902 108 H GLU 234 H GLU 234 14.026 -2.422 -1.179 109 HA GLU 234 HA GLU 234 15.337 -1.799 1.367 110 1HB GLU 234 1HB GLU 234 15.397 -3.860 -0.543 111 2HB GLU 234 2HB GLU 234 16.920 -3.023 -0.793 112 1HG GLU 234 1HG GLU 234 15.928 -4.100 1.893 113 2HG GLU 234 2HG GLU 234 16.910 -5.032 0.758 114 H ASP 235 H ASP 235 15.170 -0.585 -1.871 115 HA ASP 235 HA ASP 235 17.482 1.220 -1.675 116 1HB ASP 235 1HB ASP 235 17.104 1.460 -4.135 117 2HB ASP 235 2HB ASP 235 17.467 -0.181 -3.635 118 H TRP 236 H TRP 236 14.599 1.497 -0.399 119 HA TRP 236 HA TRP 236 13.382 3.793 -1.515 120 1HB TRP 236 1HB TRP 236 12.411 2.122 0.043 121 2HB TRP 236 2HB TRP 236 13.505 2.684 1.323 122 HD1 TRP 236 HD TRP 236 12.278 4.189 2.955 123 HE1 TRP 236 1HE TRP 236 10.456 6.039 2.819 124 HE3 TRP 236 3HE TRP 236 11.182 3.865 -1.985 125 HZ2 TRP 236 2HZ TRP 236 8.585 7.021 0.860 126 HZ3 TRP 236 3HZ TRP 236 9.355 5.251 -2.977 127 HH2 TRP 236 HH TRP 236 8.090 6.846 -1.557 128 H ASP 237 H ASP 237 13.301 5.967 -0.380 129 HA ASP 237 HA ASP 237 15.904 6.805 0.776 130 1HB ASP 237 1HB ASP 237 14.368 8.338 -1.377 131 2HB ASP 237 2HB ASP 237 15.624 8.987 -0.321 132 H GLU 238 H GLU 238 15.003 6.757 2.833 133 HA GLU 238 HA GLU 238 12.489 7.923 3.511 134 1HB GLU 238 1HB GLU 238 14.917 7.288 5.237 135 2HB GLU 238 2HB GLU 238 13.302 7.643 5.839 136 1HG GLU 238 1HG GLU 238 12.371 5.701 4.689 137 2HG GLU 238 2HG GLU 238 13.951 5.321 3.991 138 H GLU 239 H GLU 239 15.368 9.540 2.652 139 HA GLU 239 HA GLU 239 14.794 11.936 4.293 140 1HB GLU 239 1HB GLU 239 17.139 10.495 3.448 141 2HB GLU 239 2HB GLU 239 17.174 11.976 2.569 142 1HG GLU 239 1HG GLU 239 16.648 12.051 5.548 143 2HG GLU 239 2HG GLU 239 18.250 11.655 4.985 144 H MET 240 H MET 240 14.488 10.653 1.047 145 HA MET 240 HA MET 240 14.097 13.344 -0.143 146 1HB MET 240 1HB MET 240 14.585 10.602 -1.306 147 2HB MET 240 2HB MET 240 13.917 11.875 -2.269 148 1HG MET 240 1HG MET 240 16.315 11.752 -2.587 149 2HG MET 240 2HG MET 240 15.858 13.291 -1.869 150 1HE MET 240 1HE MET 240 16.434 14.061 0.570 151 2HE MET 240 2HE MET 240 18.108 13.688 1.045 152 3HE MET 240 3HE MET 240 17.754 14.305 -0.584 153 H ASP 241 H ASP 241 12.579 10.062 -0.138 154 HA ASP 241 HA ASP 241 10.100 11.272 -1.104 155 1HB ASP 241 1HB ASP 241 11.522 8.952 -1.746 156 2HB ASP 241 2HB ASP 241 10.204 8.383 -0.774 157 H GLY 242 H GLY 242 11.379 9.555 1.714 158 1HA GLY 242 1HA GLY 242 10.743 10.124 3.892 159 2HA GLY 242 2HA GLY 242 9.297 10.876 3.280 160 H GLU 243 H GLU 243 7.597 9.976 4.317 161 HA GLU 243 HA GLU 243 7.517 7.250 5.278 162 1HB GLU 243 1HB GLU 243 5.929 9.720 5.474 163 2HB GLU 243 2HB GLU 243 4.931 8.298 5.232 164 1HG GLU 243 1HG GLU 243 6.071 7.159 7.128 165 2HG GLU 243 2HG GLU 243 7.035 8.628 7.375 166 H TRP 244 H TRP 244 7.497 5.655 3.814 167 HA TRP 244 HA TRP 244 6.289 5.664 1.193 168 1HB TRP 244 1HB TRP 244 8.161 4.209 1.872 169 2HB TRP 244 2HB TRP 244 7.185 3.488 3.133 170 HD1 TRP 244 HD TRP 244 7.115 3.752 -0.754 171 HE1 TRP 244 1HE TRP 244 6.150 1.568 -1.690 172 HE3 TRP 244 3HE TRP 244 6.090 1.350 3.658 173 HZ2 TRP 244 2HZ TRP 244 5.255 -0.964 -0.668 174 HZ3 TRP 244 3HZ TRP 244 5.434 -1.030 3.628 175 HH2 TRP 244 HH TRP 244 4.931 -2.176 1.498 176 H GLU 245 H GLU 245 4.471 3.904 0.703 177 HA GLU 245 HA GLU 245 2.890 3.103 2.935 178 1HB GLU 245 1HB GLU 245 1.629 4.921 2.905 179 2HB GLU 245 2HB GLU 245 1.870 5.286 1.184 180 1HG GLU 245 1HG GLU 245 0.228 3.682 0.507 181 2HG GLU 245 2HG GLU 245 0.087 3.031 2.135 182 HA PRO 246 HA PRO 246 2.852 -0.227 0.040 183 1HB PRO 246 1HB PRO 246 0.946 -1.894 1.236 184 2HB PRO 246 2HB PRO 246 2.646 -1.736 1.717 185 1HG PRO 246 1HG PRO 246 0.193 -0.491 2.931 186 2HG PRO 246 2HG PRO 246 1.666 -1.094 3.757 187 1HD PRO 246 1HD PRO 246 1.127 1.563 3.227 188 2HD PRO 246 2HD PRO 246 2.778 0.946 3.412 189 HA PRO 247 HA PRO 247 -0.709 0.185 -2.632 190 1HB PRO 247 1HB PRO 247 -0.924 -2.356 -3.710 191 2HB PRO 247 2HB PRO 247 0.237 -1.112 -4.236 192 1HG PRO 247 1HG PRO 247 0.699 -3.560 -2.582 193 2HG PRO 247 2HG PRO 247 1.849 -2.698 -3.647 194 1HD PRO 247 1HD PRO 247 1.670 -2.534 -0.824 195 2HD PRO 247 2HD PRO 247 2.607 -1.425 -1.853 196 H VAL 248 H VAL 248 -2.793 -1.180 -3.273 197 HA VAL 248 HA VAL 248 -3.909 -2.600 -0.957 198 HB VAL 248 HB VAL 248 -6.040 -1.774 -1.827 199 1HG1 VAL 248 1HG1 VAL 248 -5.048 -0.654 0.067 200 2HG1 VAL 248 2HG1 VAL 248 -4.015 0.323 -0.973 201 3HG1 VAL 248 3HG1 VAL 248 -5.790 0.588 -0.946 202 1HG2 VAL 248 1HG2 VAL 248 -6.262 0.138 -3.308 203 2HG2 VAL 248 2HG2 VAL 248 -4.518 0.180 -3.568 204 3HG2 VAL 248 3HG2 VAL 248 -5.457 -1.200 -4.156 205 H ILE 249 H ILE 249 -5.777 -3.875 -1.647 206 HA ILE 249 HA ILE 249 -5.331 -5.456 -4.074 207 HB ILE 249 HB ILE 249 -5.309 -7.483 -2.837 208 1HG1 ILE 249 1HG1 ILE 249 -5.005 -6.916 -0.095 209 2HG1 ILE 249 2HG1 ILE 249 -6.326 -5.891 -0.548 210 1HG2 ILE 249 1HG2 ILE 249 -3.426 -5.589 -1.387 211 2HG2 ILE 249 2HG2 ILE 249 -3.205 -7.332 -1.608 212 3HG2 ILE 249 3HG2 ILE 249 -3.156 -6.238 -3.002 213 1HD1 ILE 249 1HD1 ILE 249 -7.156 -8.090 0.177 214 2HD1 ILE 249 2HD1 ILE 249 -7.533 -7.837 -1.534 215 3HD1 ILE 249 3HD1 ILE 249 -6.174 -8.893 -1.062 216 H GLN 250 H GLN 250 -7.326 -6.110 -4.913 217 HA GLN 250 HA GLN 250 -9.576 -4.557 -4.103 218 1HB GLN 250 1HB GLN 250 -10.839 -5.691 -5.790 219 2HB GLN 250 2HB GLN 250 -9.223 -5.336 -6.390 220 1HG GLN 250 1HG GLN 250 -9.196 -7.416 -7.152 221 2HG GLN 250 2HG GLN 250 -8.863 -7.918 -5.516 222 1HE2 GLN 250 1HE2 GLN 250 -11.304 -7.940 -4.176 223 2HE2 GLN 250 2HE2 GLN 250 -12.506 -8.837 -5.065 224 H ASN 251 H ASN 251 -11.145 -4.922 -2.658 225 HA ASN 251 HA ASN 251 -10.558 -6.771 -0.540 226 1HB ASN 251 1HB ASN 251 -11.629 -4.558 -0.231 227 2HB ASN 251 2HB ASN 251 -13.041 -5.178 -1.060 228 1HD2 ASN 251 1HD2 ASN 251 -13.115 -4.146 1.653 229 2HD2 ASN 251 2HD2 ASN 251 -13.464 -5.528 2.690 230 HA PRO 252 HA PRO 252 -12.703 -10.106 -2.693 231 1HB PRO 252 1HB PRO 252 -12.114 -12.187 -1.044 232 2HB PRO 252 2HB PRO 252 -10.874 -11.341 -2.029 233 1HG PRO 252 1HG PRO 252 -11.524 -10.839 0.888 234 2HG PRO 252 2HG PRO 252 -9.916 -11.163 0.145 235 1HD PRO 252 1HD PRO 252 -10.784 -8.641 0.586 236 2HD PRO 252 2HD PRO 252 -9.808 -9.054 -0.853 237 H GLU 253 H GLU 253 -13.667 -8.805 0.425 238 HA GLU 253 HA GLU 253 -16.352 -9.671 -0.088 239 1HB GLU 253 1HB GLU 253 -16.775 -10.637 1.997 240 2HB GLU 253 2HB GLU 253 -15.496 -11.503 1.121 241 1HG GLU 253 1HG GLU 253 -13.769 -10.538 2.447 242 2HG GLU 253 2HG GLU 253 -14.929 -9.457 3.181 243 H TYR 254 H TYR 254 -15.514 -7.194 -0.635 244 HA TYR 254 HA TYR 254 -15.604 -5.316 1.540 245 1HB TYR 254 1HB TYR 254 -14.861 -4.392 -0.489 246 2HB TYR 254 2HB TYR 254 -16.165 -5.099 -1.429 247 HD1 TYR 254 1HD TYR 254 -17.318 -3.286 -2.403 248 HD2 TYR 254 2HD TYR 254 -16.069 -2.967 1.720 249 HE1 TYR 254 1HE TYR 254 -18.689 -1.258 -2.151 250 HE2 TYR 254 2HE TYR 254 -17.430 -0.944 1.987 251 HH TYR 254 HH TYR 254 -19.194 0.540 -0.757 252 H LYS 255 H LYS 255 -17.191 -4.599 2.755 253 HA LYS 255 HA LYS 255 -20.016 -5.246 2.187 254 1HB LYS 255 1HB LYS 255 -18.399 -6.877 3.770 255 2HB LYS 255 2HB LYS 255 -19.009 -5.751 4.967 256 1HG LYS 255 1HG LYS 255 -20.795 -7.278 3.025 257 2HG LYS 255 2HG LYS 255 -20.314 -7.882 4.631 258 1HD LYS 255 1HD LYS 255 -21.341 -5.907 5.716 259 2HD LYS 255 2HD LYS 255 -21.807 -5.287 4.113 260 1HE LYS 255 1HE LYS 255 -23.121 -7.354 3.690 261 2HE LYS 255 2HE LYS 255 -22.593 -8.028 5.243 262 1HZ LYS 255 1HZ LYS 255 -23.783 -6.195 6.328 263 2HZ LYS 255 2HZ LYS 255 -24.300 -5.671 4.841 264 3HZ LYS 255 3HZ LYS 255 -24.760 -7.158 5.390 265 H GLY 256 H GLY 256 -17.816 -3.861 4.734 266 1HA GLY 256 1HA GLY 256 -18.184 -1.265 4.924 267 2HA GLY 256 2HA GLY 256 -19.789 -1.872 5.424 Start of MODEL 11 1 H GLY 220 H GLY 220 -17.752 -4.746 9.794 2 1HA GLY 220 1HA GLY 220 -18.625 -5.785 7.703 3 2HA GLY 220 2HA GLY 220 -18.842 -4.023 7.757 4 H LYS 221 H LYS 221 -18.124 -6.188 5.500 5 HA LYS 221 HA LYS 221 -15.518 -5.978 4.837 6 1HB LYS 221 1HB LYS 221 -16.024 -6.639 2.632 7 2HB LYS 221 2HB LYS 221 -16.879 -7.586 3.837 8 1HG LYS 221 1HG LYS 221 -18.900 -5.959 3.249 9 2HG LYS 221 2HG LYS 221 -17.963 -5.781 1.755 10 1HD LYS 221 1HD LYS 221 -17.862 -8.313 1.651 11 2HD LYS 221 2HD LYS 221 -19.042 -8.364 2.952 12 1HE LYS 221 1HE LYS 221 -20.648 -7.075 1.536 13 2HE LYS 221 2HE LYS 221 -19.427 -7.064 0.249 14 1HZ LYS 221 1HZ LYS 221 -20.700 -9.505 1.336 15 2HZ LYS 221 2HZ LYS 221 -20.988 -8.797 -0.123 16 3HZ LYS 221 3HZ LYS 221 -19.537 -9.465 0.162 17 HA PRO 222 HA PRO 222 -15.347 -1.703 3.644 18 1HB PRO 222 1HB PRO 222 -12.578 -1.471 3.345 19 2HB PRO 222 2HB PRO 222 -13.509 -1.312 4.841 20 1HG PRO 222 1HG PRO 222 -11.848 -3.607 3.835 21 2HG PRO 222 2HG PRO 222 -12.220 -3.181 5.526 22 1HD PRO 222 1HD PRO 222 -13.445 -5.218 3.958 23 2HD PRO 222 2HD PRO 222 -14.045 -4.631 5.505 24 H GLU 223 H GLU 223 -14.467 -0.374 2.006 25 HA GLU 223 HA GLU 223 -15.112 -1.276 -0.604 26 1HB GLU 223 1HB GLU 223 -13.655 1.187 0.431 27 2HB GLU 223 2HB GLU 223 -14.169 1.010 -1.253 28 1HG GLU 223 1HG GLU 223 -16.427 1.129 -0.754 29 2HG GLU 223 2HG GLU 223 -16.261 0.542 0.890 30 H HIS 224 H HIS 224 -11.950 -1.116 0.986 31 HA HIS 224 HA HIS 224 -10.822 -2.822 -1.066 32 1HB HIS 224 1HB HIS 224 -9.312 -0.287 -0.275 33 2HB HIS 224 2HB HIS 224 -8.743 -1.579 -1.313 34 HD1 HIS 224 1HD HIS 224 -11.020 1.507 -1.420 35 HD2 HIS 224 2HD HIS 224 -9.533 -1.588 -3.874 36 HE1 HIS 224 1HE HIS 224 -11.599 2.143 -3.810 37 H ILE 225 H ILE 225 -8.680 -3.717 -0.131 38 HA ILE 225 HA ILE 225 -8.680 -3.699 2.846 39 HB ILE 225 HB ILE 225 -8.622 -5.951 0.857 40 1HG1 ILE 225 1HG1 ILE 225 -10.150 -5.124 3.358 41 2HG1 ILE 225 2HG1 ILE 225 -10.769 -5.328 1.730 42 1HG2 ILE 225 1HG2 ILE 225 -7.802 -7.506 2.465 43 2HG2 ILE 225 2HG2 ILE 225 -6.617 -6.226 2.389 44 3HG2 ILE 225 3HG2 ILE 225 -7.768 -6.301 3.755 45 1HD1 ILE 225 1HD1 ILE 225 -11.499 -7.167 3.053 46 2HD1 ILE 225 2HD1 ILE 225 -10.223 -7.805 1.975 47 3HD1 ILE 225 3HD1 ILE 225 -9.859 -7.394 3.686 48 HA PRO 226 HA PRO 226 -4.585 -2.299 1.860 49 1HB PRO 226 1HB PRO 226 -3.171 -2.617 4.100 50 2HB PRO 226 2HB PRO 226 -4.549 -1.475 4.019 51 1HG PRO 226 1HG PRO 226 -4.498 -4.210 5.267 52 2HG PRO 226 2HG PRO 226 -5.343 -2.738 5.837 53 1HD PRO 226 1HD PRO 226 -6.431 -4.847 4.347 54 2HD PRO 226 2HD PRO 226 -7.222 -3.266 4.510 55 H ASP 227 H ASP 227 -2.311 -2.933 1.785 56 HA ASP 227 HA ASP 227 -1.824 -5.817 1.344 57 1HB ASP 227 1HB ASP 227 -1.082 -4.234 -0.436 58 2HB ASP 227 2HB ASP 227 -0.074 -3.411 0.736 59 HA PRO 228 HA PRO 228 0.034 -5.237 5.522 60 1HB PRO 228 1HB PRO 228 -0.259 -7.737 6.455 61 2HB PRO 228 2HB PRO 228 -1.679 -6.696 6.153 62 1HG PRO 228 1HG PRO 228 -0.558 -8.885 4.388 63 2HG PRO 228 2HG PRO 228 -2.258 -8.633 4.869 64 1HD PRO 228 1HD PRO 228 -1.122 -7.702 2.490 65 2HD PRO 228 2HD PRO 228 -2.538 -6.966 3.292 66 H ASP 229 H ASP 229 1.063 -7.093 2.831 67 HA ASP 229 HA ASP 229 3.176 -8.555 4.352 68 1HB ASP 229 1HB ASP 229 1.085 -9.653 3.168 69 2HB ASP 229 2HB ASP 229 2.006 -9.413 1.685 70 H ALA 230 H ALA 230 2.643 -6.372 1.733 71 HA ALA 230 HA ALA 230 5.175 -6.476 0.436 72 1HB ALA 230 1HB ALA 230 3.089 -4.267 0.888 73 2HB ALA 230 2HB ALA 230 4.573 -4.002 -0.048 74 3HB ALA 230 3HB ALA 230 3.402 -5.196 -0.582 75 H LYS 231 H LYS 231 6.930 -4.907 0.725 76 HA LYS 231 HA LYS 231 7.196 -3.860 3.497 77 1HB LYS 231 1HB LYS 231 9.481 -4.653 3.620 78 2HB LYS 231 2HB LYS 231 8.372 -6.009 3.382 79 1HG LYS 231 1HG LYS 231 9.022 -6.089 0.967 80 2HG LYS 231 2HG LYS 231 10.103 -4.709 1.212 81 1HD LYS 231 1HD LYS 231 11.419 -6.688 1.196 82 2HD LYS 231 2HD LYS 231 11.431 -6.020 2.842 83 1HE LYS 231 1HE LYS 231 9.747 -7.681 3.558 84 2HE LYS 231 2HE LYS 231 9.587 -8.259 1.884 85 1HZ LYS 231 1HZ LYS 231 11.916 -8.908 1.980 86 2HZ LYS 231 2HZ LYS 231 12.029 -8.513 3.555 87 3HZ LYS 231 3HZ LYS 231 11.020 -9.730 3.053 88 H LYS 232 H LYS 232 8.072 -1.781 3.570 89 HA LYS 232 HA LYS 232 8.557 -0.248 1.419 90 1HB LYS 232 1HB LYS 232 9.841 1.229 2.735 91 2HB LYS 232 2HB LYS 232 8.657 0.496 3.796 92 1HG LYS 232 1HG LYS 232 10.388 -0.988 4.703 93 2HG LYS 232 2HG LYS 232 11.587 -0.325 3.597 94 1HD LYS 232 1HD LYS 232 11.806 0.671 5.822 95 2HD LYS 232 2HD LYS 232 11.460 1.867 4.579 96 1HE LYS 232 1HE LYS 232 10.183 2.355 6.617 97 2HE LYS 232 2HE LYS 232 9.112 1.987 5.268 98 1HZ LYS 232 1HZ LYS 232 8.282 0.828 7.083 99 2HZ LYS 232 2HZ LYS 232 9.052 -0.355 6.245 100 3HZ LYS 232 3HZ LYS 232 9.746 0.299 7.588 101 HA PRO 233 HA PRO 233 12.016 -1.838 -0.790 102 1HB PRO 233 1HB PRO 233 13.064 0.926 -1.161 103 2HB PRO 233 2HB PRO 233 12.634 -0.274 -2.391 104 1HG PRO 233 1HG PRO 233 11.039 1.884 -1.927 105 2HG PRO 233 2HG PRO 233 10.365 0.304 -2.308 106 1HD PRO 233 1HD PRO 233 10.533 1.581 0.434 107 2HD PRO 233 2HD PRO 233 9.234 0.618 -0.343 108 H GLU 234 H GLU 234 14.166 -2.297 -0.426 109 HA GLU 234 HA GLU 234 15.613 -1.577 1.985 110 1HB GLU 234 1HB GLU 234 15.894 -3.295 -0.325 111 2HB GLU 234 2HB GLU 234 17.330 -2.284 -0.210 112 1HG GLU 234 1HG GLU 234 17.698 -2.985 2.102 113 2HG GLU 234 2HG GLU 234 16.215 -3.966 2.073 114 H ASP 235 H ASP 235 15.279 -0.495 -1.349 115 HA ASP 235 HA ASP 235 17.344 1.509 -1.324 116 1HB ASP 235 1HB ASP 235 15.247 0.715 -3.376 117 2HB ASP 235 2HB ASP 235 16.615 1.770 -3.687 118 H TRP 236 H TRP 236 14.739 1.816 0.348 119 HA TRP 236 HA TRP 236 13.332 4.044 -0.710 120 1HB TRP 236 1HB TRP 236 12.429 2.225 0.671 121 2HB TRP 236 2HB TRP 236 13.400 2.748 2.044 122 HD1 TRP 236 HD TRP 236 12.332 4.406 3.541 123 HE1 TRP 236 1HE TRP 236 10.250 5.974 3.527 124 HE3 TRP 236 3HE TRP 236 11.097 3.820 -1.256 125 HZ2 TRP 236 2HZ TRP 236 8.324 6.888 1.516 126 HZ3 TRP 236 3HZ TRP 236 9.110 5.005 -2.276 127 HH2 TRP 236 HH TRP 236 7.770 6.564 -0.860 128 H ASP 237 H ASP 237 14.154 6.078 -0.769 129 HA ASP 237 HA ASP 237 16.185 6.949 1.126 130 1HB ASP 237 1HB ASP 237 15.269 7.509 -1.700 131 2HB ASP 237 2HB ASP 237 15.797 8.870 -0.770 132 H GLU 238 H GLU 238 14.907 7.274 2.917 133 HA GLU 238 HA GLU 238 12.333 8.405 3.028 134 1HB GLU 238 1HB GLU 238 14.595 8.422 5.063 135 2HB GLU 238 2HB GLU 238 12.911 8.793 5.455 136 1HG GLU 238 1HG GLU 238 12.211 6.555 5.059 137 2HG GLU 238 2HG GLU 238 13.691 6.146 4.178 138 H GLU 239 H GLU 239 15.505 10.108 3.028 139 HA GLU 239 HA GLU 239 14.432 12.552 3.874 140 1HB GLU 239 1HB GLU 239 16.907 11.610 3.817 141 2HB GLU 239 2HB GLU 239 16.928 12.185 2.152 142 1HG GLU 239 1HG GLU 239 15.858 14.316 3.574 143 2HG GLU 239 2HG GLU 239 17.012 13.687 4.724 144 H MET 240 H MET 240 14.282 10.875 0.923 145 HA MET 240 HA MET 240 14.025 13.285 -0.815 146 1HB MET 240 1HB MET 240 14.331 10.300 -1.362 147 2HB MET 240 2HB MET 240 13.931 11.434 -2.600 148 1HG MET 240 1HG MET 240 16.401 11.741 -0.831 149 2HG MET 240 2HG MET 240 16.420 10.787 -2.301 150 1HE MET 240 1HE MET 240 16.812 11.593 -4.579 151 2HE MET 240 2HE MET 240 15.115 12.121 -4.614 152 3HE MET 240 3HE MET 240 16.401 13.208 -5.185 153 H ASP 241 H ASP 241 12.458 10.177 -0.042 154 HA ASP 241 HA ASP 241 10.060 10.993 -1.489 155 1HB ASP 241 1HB ASP 241 11.183 8.630 -1.409 156 2HB ASP 241 2HB ASP 241 10.192 8.409 0.024 157 H GLY 242 H GLY 242 10.484 9.728 1.886 158 1HA GLY 242 1HA GLY 242 9.383 11.222 3.649 159 2HA GLY 242 2HA GLY 242 7.944 11.148 2.619 160 H GLU 243 H GLU 243 6.635 10.069 4.176 161 HA GLU 243 HA GLU 243 7.384 7.598 5.445 162 1HB GLU 243 1HB GLU 243 5.164 9.512 5.476 163 2HB GLU 243 2HB GLU 243 4.565 7.855 5.381 164 1HG GLU 243 1HG GLU 243 5.867 7.196 7.336 165 2HG GLU 243 2HG GLU 243 6.673 8.755 7.373 166 H TRP 244 H TRP 244 7.405 5.631 4.474 167 HA TRP 244 HA TRP 244 6.265 5.196 1.838 168 1HB TRP 244 1HB TRP 244 8.235 3.914 2.736 169 2HB TRP 244 2HB TRP 244 7.176 3.156 3.912 170 HD1 TRP 244 HD TRP 244 7.467 3.474 0.055 171 HE1 TRP 244 1HE TRP 244 6.669 1.280 -1.038 172 HE3 TRP 244 3HE TRP 244 6.284 0.860 4.272 173 HZ2 TRP 244 2HZ TRP 244 5.496 -1.197 -0.189 174 HZ3 TRP 244 3HZ TRP 244 5.654 -1.516 4.107 175 HH2 TRP 244 HH TRP 244 5.042 -2.500 1.898 176 H GLU 245 H GLU 245 4.138 4.827 1.443 177 HA GLU 245 HA GLU 245 2.393 3.600 3.508 178 1HB GLU 245 1HB GLU 245 0.539 4.140 2.123 179 2HB GLU 245 2HB GLU 245 1.535 5.599 2.127 180 1HG GLU 245 1HG GLU 245 2.553 4.770 -0.066 181 2HG GLU 245 2HG GLU 245 1.345 3.473 -0.034 182 HA PRO 246 HA PRO 246 2.948 -0.033 0.738 183 1HB PRO 246 1HB PRO 246 1.192 -1.802 1.857 184 2HB PRO 246 2HB PRO 246 2.754 -1.391 2.600 185 1HG PRO 246 1HG PRO 246 -0.021 -0.398 3.281 186 2HG PRO 246 2HG PRO 246 1.340 -0.809 4.355 187 1HD PRO 246 1HD PRO 246 0.622 1.810 3.385 188 2HD PRO 246 2HD PRO 246 2.140 1.370 4.241 189 HA PRO 247 HA PRO 247 -0.710 0.377 -1.861 190 1HB PRO 247 1HB PRO 247 -0.724 -2.128 -3.111 191 2HB PRO 247 2HB PRO 247 0.293 -0.738 -3.548 192 1HG PRO 247 1HG PRO 247 1.016 -3.250 -2.176 193 2HG PRO 247 2HG PRO 247 2.079 -2.089 -3.027 194 1HD PRO 247 1HD PRO 247 1.631 -2.401 -0.205 195 2HD PRO 247 2HD PRO 247 2.685 -1.213 -0.983 196 H VAL 248 H VAL 248 -2.667 -1.427 -2.664 197 HA VAL 248 HA VAL 248 -3.875 -2.551 -0.238 198 HB VAL 248 HB VAL 248 -5.972 -1.820 -1.285 199 1HG1 VAL 248 1HG1 VAL 248 -4.052 0.447 -0.633 200 2HG1 VAL 248 2HG1 VAL 248 -5.830 0.548 -0.570 201 3HG1 VAL 248 3HG1 VAL 248 -4.945 -0.508 0.549 202 1HG2 VAL 248 1HG2 VAL 248 -6.156 -0.173 -2.980 203 2HG2 VAL 248 2HG2 VAL 248 -4.399 0.043 -3.069 204 3HG2 VAL 248 3HG2 VAL 248 -5.151 -1.469 -3.630 205 H ILE 249 H ILE 249 -5.844 -3.981 -1.049 206 HA ILE 249 HA ILE 249 -5.207 -5.471 -3.485 207 HB ILE 249 HB ILE 249 -5.334 -7.552 -2.356 208 1HG1 ILE 249 1HG1 ILE 249 -5.411 -7.329 0.372 209 2HG1 ILE 249 2HG1 ILE 249 -6.487 -6.025 -0.044 210 1HG2 ILE 249 1HG2 ILE 249 -3.436 -7.521 -0.837 211 2HG2 ILE 249 2HG2 ILE 249 -3.153 -6.363 -2.141 212 3HG2 ILE 249 3HG2 ILE 249 -3.636 -5.783 -0.539 213 1HD1 ILE 249 1HD1 ILE 249 -7.644 -8.236 0.320 214 2HD1 ILE 249 2HD1 ILE 249 -7.911 -7.596 -1.304 215 3HD1 ILE 249 3HD1 ILE 249 -6.742 -8.913 -1.046 216 H GLN 250 H GLN 250 -7.092 -6.086 -4.529 217 HA GLN 250 HA GLN 250 -9.544 -4.687 -3.942 218 1HB GLN 250 1HB GLN 250 -8.765 -6.928 -5.817 219 2HB GLN 250 2HB GLN 250 -10.456 -6.533 -5.626 220 1HG GLN 250 1HG GLN 250 -8.593 -4.225 -6.168 221 2HG GLN 250 2HG GLN 250 -8.880 -5.353 -7.475 222 1HE2 GLN 250 1HE2 GLN 250 -11.564 -4.647 -5.138 223 2HE2 GLN 250 2HE2 GLN 250 -12.464 -3.726 -6.325 224 H ASN 251 H ASN 251 -10.899 -5.132 -2.381 225 HA ASN 251 HA ASN 251 -10.614 -7.216 -0.522 226 1HB ASN 251 1HB ASN 251 -11.892 -5.113 -0.120 227 2HB ASN 251 2HB ASN 251 -13.133 -5.679 -1.226 228 1HD2 ASN 251 1HD2 ASN 251 -13.723 -5.049 1.523 229 2HD2 ASN 251 2HD2 ASN 251 -13.971 -6.590 2.399 230 HA PRO 252 HA PRO 252 -12.168 -10.447 -3.271 231 1HB PRO 252 1HB PRO 252 -12.151 -12.586 -1.533 232 2HB PRO 252 2HB PRO 252 -10.676 -11.869 -2.252 233 1HG PRO 252 1HG PRO 252 -11.849 -11.255 0.469 234 2HG PRO 252 2HG PRO 252 -10.168 -11.726 0.071 235 1HD PRO 252 1HD PRO 252 -10.841 -9.146 0.345 236 2HD PRO 252 2HD PRO 252 -9.735 -9.631 -0.979 237 H GLU 253 H GLU 253 -13.799 -9.163 -0.533 238 HA GLU 253 HA GLU 253 -16.285 -10.702 -1.079 239 1HB GLU 253 1HB GLU 253 -15.394 -9.223 1.415 240 2HB GLU 253 2HB GLU 253 -16.829 -10.241 1.254 241 1HG GLU 253 1HG GLU 253 -15.598 -12.246 1.224 242 2HG GLU 253 2HG GLU 253 -14.068 -11.443 0.879 243 H TYR 254 H TYR 254 -14.903 -7.541 -1.509 244 HA TYR 254 HA TYR 254 -17.433 -6.159 -0.872 245 1HB TYR 254 1HB TYR 254 -15.219 -5.064 -0.518 246 2HB TYR 254 2HB TYR 254 -15.038 -4.931 -2.269 247 HD1 TYR 254 1HD TYR 254 -16.423 -3.324 -3.528 248 HD2 TYR 254 2HD TYR 254 -16.846 -3.774 0.726 249 HE1 TYR 254 1HE TYR 254 -17.706 -1.196 -3.423 250 HE2 TYR 254 2HE TYR 254 -18.122 -1.645 0.841 251 HH TYR 254 HH TYR 254 -18.810 0.292 -2.129 252 H LYS 255 H LYS 255 -19.033 -6.844 -2.238 253 HA LYS 255 HA LYS 255 -20.128 -7.689 -3.891 254 1HB LYS 255 1HB LYS 255 -19.226 -5.257 -4.714 255 2HB LYS 255 2HB LYS 255 -18.569 -6.262 -6.001 256 1HG LYS 255 1HG LYS 255 -20.651 -5.453 -6.685 257 2HG LYS 255 2HG LYS 255 -20.923 -7.154 -6.337 258 1HD LYS 255 1HD LYS 255 -21.867 -6.412 -4.084 259 2HD LYS 255 2HD LYS 255 -21.650 -4.734 -4.598 260 1HE LYS 255 1HE LYS 255 -23.049 -5.204 -6.600 261 2HE LYS 255 2HE LYS 255 -23.295 -6.871 -6.057 262 1HZ LYS 255 1HZ LYS 255 -25.110 -5.292 -5.571 263 2HZ LYS 255 2HZ LYS 255 -24.570 -6.070 -4.209 264 3HZ LYS 255 3HZ LYS 255 -24.195 -4.504 -4.501 265 H GLY 256 H GLY 256 -17.035 -8.655 -3.497 266 1HA GLY 256 1HA GLY 256 -16.716 -10.378 -5.817 267 2HA GLY 256 2HA GLY 256 -15.757 -10.375 -4.333 Start of MODEL 12 1 H GLY 220 H GLY 220 -17.982 -1.007 8.018 2 1HA GLY 220 1HA GLY 220 -18.369 -3.945 8.096 3 2HA GLY 220 2HA GLY 220 -19.386 -2.825 7.156 4 H LYS 221 H LYS 221 -18.238 -4.843 5.693 5 HA LYS 221 HA LYS 221 -15.676 -4.857 5.001 6 1HB LYS 221 1HB LYS 221 -16.245 -5.672 2.838 7 2HB LYS 221 2HB LYS 221 -17.079 -6.489 4.132 8 1HG LYS 221 1HG LYS 221 -18.963 -4.591 3.390 9 2HG LYS 221 2HG LYS 221 -18.156 -4.963 1.852 10 1HD LYS 221 1HD LYS 221 -18.542 -7.424 2.405 11 2HD LYS 221 2HD LYS 221 -19.520 -6.874 3.790 12 1HE LYS 221 1HE LYS 221 -20.865 -5.491 2.065 13 2HE LYS 221 2HE LYS 221 -19.988 -6.415 0.829 14 1HZ LYS 221 1HZ LYS 221 -20.822 -8.432 2.022 15 2HZ LYS 221 2HZ LYS 221 -21.870 -7.430 2.835 16 3HZ LYS 221 3HZ LYS 221 -21.949 -7.566 1.191 17 HA PRO 222 HA PRO 222 -15.103 -0.787 3.142 18 1HB PRO 222 1HB PRO 222 -12.310 -1.078 2.789 19 2HB PRO 222 2HB PRO 222 -13.157 -0.337 4.153 20 1HG PRO 222 1HG PRO 222 -11.767 -2.953 4.033 21 2HG PRO 222 2HG PRO 222 -12.362 -2.080 5.462 22 1HD PRO 222 1HD PRO 222 -13.566 -4.329 4.064 23 2HD PRO 222 2HD PRO 222 -14.141 -3.558 5.538 24 H GLU 223 H GLU 223 -14.179 0.012 1.218 25 HA GLU 223 HA GLU 223 -14.779 -1.266 -1.234 26 1HB GLU 223 1HB GLU 223 -13.320 0.718 -2.056 27 2HB GLU 223 2HB GLU 223 -14.826 1.070 -1.214 28 1HG GLU 223 1HG GLU 223 -13.751 1.758 0.758 29 2HG GLU 223 2HG GLU 223 -12.298 0.850 0.399 30 H HIS 224 H HIS 224 -11.740 -1.200 0.638 31 HA HIS 224 HA HIS 224 -10.489 -3.062 -1.250 32 1HB HIS 224 1HB HIS 224 -9.114 -0.542 -0.228 33 2HB HIS 224 2HB HIS 224 -8.423 -1.757 -1.298 34 HD1 HIS 224 1HD HIS 224 -10.471 1.419 -1.408 35 HD2 HIS 224 2HD HIS 224 -9.610 -1.913 -3.861 36 HE1 HIS 224 1HE HIS 224 -11.353 1.982 -3.693 37 H ILE 225 H ILE 225 -8.382 -3.884 -0.145 38 HA ILE 225 HA ILE 225 -8.504 -3.813 2.807 39 HB ILE 225 HB ILE 225 -8.382 -6.178 0.961 40 1HG1 ILE 225 1HG1 ILE 225 -10.048 -5.180 3.299 41 2HG1 ILE 225 2HG1 ILE 225 -10.549 -5.584 1.661 42 1HG2 ILE 225 1HG2 ILE 225 -7.625 -7.626 2.690 43 2HG2 ILE 225 2HG2 ILE 225 -6.424 -6.372 2.538 44 3HG2 ILE 225 3HG2 ILE 225 -7.599 -6.327 3.888 45 1HD1 ILE 225 1HD1 ILE 225 -9.727 -7.425 3.869 46 2HD1 ILE 225 2HD1 ILE 225 -11.329 -7.289 3.115 47 3HD1 ILE 225 3HD1 ILE 225 -9.976 -7.976 2.174 48 HA PRO 226 HA PRO 226 -4.398 -2.449 1.798 49 1HB PRO 226 1HB PRO 226 -3.082 -2.624 4.129 50 2HB PRO 226 2HB PRO 226 -4.405 -1.443 3.865 51 1HG PRO 226 1HG PRO 226 -4.525 -4.006 5.425 52 2HG PRO 226 2HG PRO 226 -5.373 -2.459 5.730 53 1HD PRO 226 1HD PRO 226 -6.369 -4.742 4.409 54 2HD PRO 226 2HD PRO 226 -7.181 -3.176 4.411 55 H ASP 227 H ASP 227 -2.083 -3.226 1.927 56 HA ASP 227 HA ASP 227 -2.084 -6.173 1.423 57 1HB ASP 227 1HB ASP 227 -1.437 -4.810 -0.465 58 2HB ASP 227 2HB ASP 227 -0.085 -4.149 0.451 59 HA PRO 228 HA PRO 228 0.236 -6.074 5.364 60 1HB PRO 228 1HB PRO 228 -0.265 -8.572 6.204 61 2HB PRO 228 2HB PRO 228 -1.600 -7.383 6.101 62 1HG PRO 228 1HG PRO 228 -0.842 -9.523 4.070 63 2HG PRO 228 2HG PRO 228 -2.459 -9.182 4.765 64 1HD PRO 228 1HD PRO 228 -1.577 -8.156 2.354 65 2HD PRO 228 2HD PRO 228 -2.734 -7.308 3.416 66 H ASP 229 H ASP 229 0.771 -7.845 2.444 67 HA ASP 229 HA ASP 229 3.057 -9.414 3.459 68 1HB ASP 229 1HB ASP 229 1.274 -10.388 1.980 69 2HB ASP 229 2HB ASP 229 1.809 -9.310 0.683 70 H ALA 230 H ALA 230 2.347 -6.759 1.210 71 HA ALA 230 HA ALA 230 4.929 -6.356 0.118 72 1HB ALA 230 1HB ALA 230 2.876 -5.207 -0.663 73 2HB ALA 230 2HB ALA 230 2.790 -4.322 0.873 74 3HB ALA 230 3HB ALA 230 4.133 -4.026 -0.255 75 H LYS 231 H LYS 231 6.605 -4.884 0.685 76 HA LYS 231 HA LYS 231 6.784 -3.967 3.515 77 1HB LYS 231 1HB LYS 231 8.599 -5.920 2.040 78 2HB LYS 231 2HB LYS 231 9.148 -4.985 3.419 79 1HG LYS 231 1HG LYS 231 7.402 -5.993 4.856 80 2HG LYS 231 2HG LYS 231 6.808 -6.924 3.475 81 1HD LYS 231 1HD LYS 231 8.193 -8.435 4.628 82 2HD LYS 231 2HD LYS 231 9.141 -7.911 3.241 83 1HE LYS 231 1HE LYS 231 10.779 -7.609 4.721 84 2HE LYS 231 2HE LYS 231 9.973 -6.083 5.067 85 1HZ LYS 231 1HZ LYS 231 9.622 -8.614 6.512 86 2HZ LYS 231 2HZ LYS 231 10.446 -7.320 7.065 87 3HZ LYS 231 3HZ LYS 231 8.807 -7.210 6.856 88 H LYS 232 H LYS 232 8.146 -2.092 3.739 89 HA LYS 232 HA LYS 232 8.662 -0.512 1.686 90 1HB LYS 232 1HB LYS 232 9.993 0.875 3.002 91 2HB LYS 232 2HB LYS 232 8.887 0.090 4.117 92 1HG LYS 232 1HG LYS 232 10.621 -1.379 4.849 93 2HG LYS 232 2HG LYS 232 11.790 -0.808 3.639 94 1HD LYS 232 1HD LYS 232 10.679 1.335 5.375 95 2HD LYS 232 2HD LYS 232 11.611 0.145 6.212 96 1HE LYS 232 1HE LYS 232 12.613 1.590 3.740 97 2HE LYS 232 2HE LYS 232 12.892 2.177 5.408 98 1HZ LYS 232 1HZ LYS 232 14.784 0.895 4.616 99 2HZ LYS 232 2HZ LYS 232 14.079 0.065 5.834 100 3HZ LYS 232 3HZ LYS 232 13.844 -0.418 4.296 101 HA PRO 233 HA PRO 233 12.370 -1.906 -0.557 102 1HB PRO 233 1HB PRO 233 13.041 0.900 -1.085 103 2HB PRO 233 2HB PRO 233 12.580 -0.350 -2.245 104 1HG PRO 233 1HG PRO 233 10.944 1.778 -1.628 105 2HG PRO 233 2HG PRO 233 10.326 0.178 -2.124 106 1HD PRO 233 1HD PRO 233 10.527 1.324 0.663 107 2HD PRO 233 2HD PRO 233 9.239 0.330 -0.095 108 H GLU 234 H GLU 234 14.551 -1.947 -0.331 109 HA GLU 234 HA GLU 234 16.013 -0.821 1.909 110 1HB GLU 234 1HB GLU 234 16.544 -2.090 -0.813 111 2HB GLU 234 2HB GLU 234 17.876 -1.487 0.212 112 1HG GLU 234 1HG GLU 234 16.976 -3.038 2.042 113 2HG GLU 234 2HG GLU 234 15.924 -3.727 0.799 114 H ASP 235 H ASP 235 15.419 -0.114 -1.556 115 HA ASP 235 HA ASP 235 17.265 2.099 -1.654 116 1HB ASP 235 1HB ASP 235 15.440 0.829 -3.716 117 2HB ASP 235 2HB ASP 235 16.678 2.047 -4.058 118 H TRP 236 H TRP 236 14.684 2.240 -0.052 119 HA TRP 236 HA TRP 236 13.016 4.239 -1.279 120 1HB TRP 236 1HB TRP 236 12.322 2.531 0.485 121 2HB TRP 236 2HB TRP 236 13.295 3.395 1.660 122 HD1 TRP 236 HD TRP 236 11.900 4.961 3.024 123 HE1 TRP 236 1HE TRP 236 9.868 6.572 2.634 124 HE3 TRP 236 3HE TRP 236 10.945 3.857 -1.835 125 HZ2 TRP 236 2HZ TRP 236 7.861 6.943 0.587 126 HZ3 TRP 236 3HZ TRP 236 9.019 4.925 -3.030 127 HH2 TRP 236 HH TRP 236 7.460 6.379 -1.808 128 H ASP 237 H ASP 237 13.185 6.432 -1.060 129 HA ASP 237 HA ASP 237 15.608 7.456 0.313 130 1HB ASP 237 1HB ASP 237 14.159 8.417 -2.193 131 2HB ASP 237 2HB ASP 237 15.220 9.444 -1.247 132 H GLU 238 H GLU 238 14.693 7.610 2.278 133 HA GLU 238 HA GLU 238 12.099 8.575 2.898 134 1HB GLU 238 1HB GLU 238 14.649 8.450 4.550 135 2HB GLU 238 2HB GLU 238 13.030 8.635 5.237 136 1HG GLU 238 1HG GLU 238 12.415 6.419 4.742 137 2HG GLU 238 2HG GLU 238 13.642 6.230 3.487 138 H GLU 239 H GLU 239 15.052 10.339 2.144 139 HA GLU 239 HA GLU 239 14.112 12.813 3.390 140 1HB GLU 239 1HB GLU 239 16.532 11.722 3.224 141 2HB GLU 239 2HB GLU 239 16.572 12.518 1.650 142 1HG GLU 239 1HG GLU 239 15.764 14.020 4.140 143 2HG GLU 239 2HG GLU 239 17.459 13.681 3.871 144 H MET 240 H MET 240 13.792 11.144 0.428 145 HA MET 240 HA MET 240 13.157 13.558 -1.188 146 1HB MET 240 1HB MET 240 13.496 10.628 -1.835 147 2HB MET 240 2HB MET 240 12.658 11.691 -2.910 148 1HG MET 240 1HG MET 240 14.880 11.521 -3.668 149 2HG MET 240 2HG MET 240 14.621 13.156 -3.100 150 1HE MET 240 1HE MET 240 15.604 14.011 -0.644 151 2HE MET 240 2HE MET 240 17.356 13.780 -0.612 152 3HE MET 240 3HE MET 240 16.563 14.367 -2.093 153 H ASP 241 H ASP 241 11.707 10.370 -0.458 154 HA ASP 241 HA ASP 241 9.169 11.403 -1.397 155 1HB ASP 241 1HB ASP 241 10.269 9.047 -1.826 156 2HB ASP 241 2HB ASP 241 9.559 8.634 -0.263 157 H GLY 242 H GLY 242 10.229 9.817 1.681 158 1HA GLY 242 1HA GLY 242 9.514 11.017 3.786 159 2HA GLY 242 2HA GLY 242 7.889 11.060 3.075 160 H GLU 243 H GLU 243 6.764 9.601 4.479 161 HA GLU 243 HA GLU 243 7.893 7.085 5.267 162 1HB GLU 243 1HB GLU 243 5.366 8.706 5.641 163 2HB GLU 243 2HB GLU 243 5.258 6.969 5.753 164 1HG GLU 243 1HG GLU 243 7.090 6.959 7.454 165 2HG GLU 243 2HG GLU 243 7.198 8.714 7.324 166 H TRP 244 H TRP 244 7.706 5.231 4.149 167 HA TRP 244 HA TRP 244 6.523 5.123 1.490 168 1HB TRP 244 1HB TRP 244 8.464 3.710 2.154 169 2HB TRP 244 2HB TRP 244 7.508 2.977 3.433 170 HD1 TRP 244 HD TRP 244 7.294 3.339 -0.430 171 HE1 TRP 244 1HE TRP 244 6.288 1.210 -1.410 172 HE3 TRP 244 3HE TRP 244 6.587 0.751 3.905 173 HZ2 TRP 244 2HZ TRP 244 5.225 -1.313 -0.407 174 HZ3 TRP 244 3HZ TRP 244 5.720 -1.554 3.878 175 HH2 TRP 244 HH TRP 244 4.862 -2.541 1.744 176 H GLU 245 H GLU 245 4.542 3.913 0.963 177 HA GLU 245 HA GLU 245 2.927 3.095 3.265 178 1HB GLU 245 1HB GLU 245 2.291 5.273 2.915 179 2HB GLU 245 2HB GLU 245 1.978 5.053 1.168 180 1HG GLU 245 1HG GLU 245 -0.140 5.095 2.065 181 2HG GLU 245 2HG GLU 245 0.138 3.365 2.137 182 HA PRO 246 HA PRO 246 2.918 -0.321 0.625 183 1HB PRO 246 1HB PRO 246 0.931 -1.899 1.810 184 2HB PRO 246 2HB PRO 246 2.560 -1.643 2.449 185 1HG PRO 246 1HG PRO 246 -0.001 -0.333 3.276 186 2HG PRO 246 2HG PRO 246 1.387 -0.833 4.286 187 1HD PRO 246 1HD PRO 246 0.896 1.789 3.396 188 2HD PRO 246 2HD PRO 246 2.498 1.209 3.863 189 HA PRO 247 HA PRO 247 -0.428 -0.247 -2.337 190 1HB PRO 247 1HB PRO 247 -0.573 -2.870 -3.148 191 2HB PRO 247 2HB PRO 247 0.534 -1.656 -3.806 192 1HG PRO 247 1HG PRO 247 1.117 -3.932 -1.979 193 2HG PRO 247 2HG PRO 247 2.246 -2.958 -2.964 194 1HD PRO 247 1HD PRO 247 1.696 -2.743 -0.154 195 2HD PRO 247 2HD PRO 247 2.825 -1.748 -1.115 196 H VAL 248 H VAL 248 -2.500 -1.789 -2.913 197 HA VAL 248 HA VAL 248 -3.755 -2.740 -0.444 198 HB VAL 248 HB VAL 248 -5.802 -1.911 -1.488 199 1HG1 VAL 248 1HG1 VAL 248 -4.717 -0.667 0.312 200 2HG1 VAL 248 2HG1 VAL 248 -3.681 0.181 -0.857 201 3HG1 VAL 248 3HG1 VAL 248 -5.437 0.492 -0.826 202 1HG2 VAL 248 1HG2 VAL 248 -4.065 -0.228 -3.356 203 2HG2 VAL 248 2HG2 VAL 248 -5.067 -1.611 -3.858 204 3HG2 VAL 248 3HG2 VAL 248 -5.829 -0.159 -3.197 205 H ILE 249 H ILE 249 -5.847 -3.936 -1.323 206 HA ILE 249 HA ILE 249 -5.457 -5.380 -3.794 207 HB ILE 249 HB ILE 249 -5.862 -7.513 -2.801 208 1HG1 ILE 249 1HG1 ILE 249 -6.006 -6.316 -0.003 209 2HG1 ILE 249 2HG1 ILE 249 -7.424 -6.705 -0.962 210 1HG2 ILE 249 1HG2 ILE 249 -3.803 -6.113 -0.997 211 2HG2 ILE 249 2HG2 ILE 249 -3.837 -7.846 -1.408 212 3HG2 ILE 249 3HG2 ILE 249 -3.507 -6.653 -2.660 213 1HD1 ILE 249 1HD1 ILE 249 -5.362 -8.691 0.031 214 2HD1 ILE 249 2HD1 ILE 249 -7.056 -8.535 0.525 215 3HD1 ILE 249 3HD1 ILE 249 -6.672 -9.082 -1.115 216 H GLN 250 H GLN 250 -7.721 -6.183 -4.414 217 HA GLN 250 HA GLN 250 -9.776 -4.214 -3.594 218 1HB GLN 250 1HB GLN 250 -9.747 -6.537 -5.549 219 2HB GLN 250 2HB GLN 250 -11.264 -5.886 -4.905 220 1HG GLN 250 1HG GLN 250 -10.660 -3.621 -5.699 221 2HG GLN 250 2HG GLN 250 -9.174 -4.275 -6.393 222 1HE2 GLN 250 1HE2 GLN 250 -12.566 -5.706 -6.450 223 2HE2 GLN 250 2HE2 GLN 250 -12.659 -5.646 -8.197 224 H ASN 251 H ASN 251 -11.662 -4.847 -2.373 225 HA ASN 251 HA ASN 251 -11.004 -6.879 -0.356 226 1HB ASN 251 1HB ASN 251 -12.100 -4.767 0.317 227 2HB ASN 251 2HB ASN 251 -13.470 -5.176 -0.684 228 1HD2 ASN 251 1HD2 ASN 251 -13.956 -4.721 1.924 229 2HD2 ASN 251 2HD2 ASN 251 -14.224 -6.253 2.829 230 HA PRO 252 HA PRO 252 -13.077 -9.828 -3.109 231 1HB PRO 252 1HB PRO 252 -12.713 -12.124 -1.670 232 2HB PRO 252 2HB PRO 252 -11.378 -11.274 -2.518 233 1HG PRO 252 1HG PRO 252 -12.119 -11.028 0.403 234 2HG PRO 252 2HG PRO 252 -10.515 -11.393 -0.328 235 1HD PRO 252 1HD PRO 252 -11.200 -8.863 0.381 236 2HD PRO 252 2HD PRO 252 -10.251 -9.189 -1.102 237 H GLU 253 H GLU 253 -14.141 -8.879 0.078 238 HA GLU 253 HA GLU 253 -16.676 -10.394 -0.169 239 1HB GLU 253 1HB GLU 253 -15.553 -8.633 2.040 240 2HB GLU 253 2HB GLU 253 -17.120 -9.439 2.085 241 1HG GLU 253 1HG GLU 253 -15.977 -11.654 1.899 242 2HG GLU 253 2HG GLU 253 -14.403 -10.831 1.968 243 H TYR 254 H TYR 254 -15.366 -7.277 -0.897 244 HA TYR 254 HA TYR 254 -17.874 -5.779 -0.589 245 1HB TYR 254 1HB TYR 254 -15.684 -4.724 -0.256 246 2HB TYR 254 2HB TYR 254 -15.237 -5.090 -1.920 247 HD1 TYR 254 1HD TYR 254 -16.880 -2.663 0.269 248 HD2 TYR 254 2HD TYR 254 -16.283 -3.927 -3.818 249 HE1 TYR 254 1HE TYR 254 -17.681 -0.468 -0.521 250 HE2 TYR 254 2HE TYR 254 -16.989 -1.715 -4.598 251 HH TYR 254 HH TYR 254 -17.126 0.575 -3.777 252 H LYS 255 H LYS 255 -19.438 -6.543 -1.947 253 HA LYS 255 HA LYS 255 -19.147 -7.973 -4.362 254 1HB LYS 255 1HB LYS 255 -21.172 -7.828 -2.977 255 2HB LYS 255 2HB LYS 255 -21.451 -6.179 -3.525 256 1HG LYS 255 1HG LYS 255 -21.143 -8.398 -5.576 257 2HG LYS 255 2HG LYS 255 -22.671 -8.246 -4.684 258 1HD LYS 255 1HD LYS 255 -23.043 -6.016 -5.446 259 2HD LYS 255 2HD LYS 255 -21.377 -5.894 -6.033 260 1HE LYS 255 1HE LYS 255 -21.786 -7.452 -7.819 261 2HE LYS 255 2HE LYS 255 -23.460 -7.703 -7.291 262 1HZ LYS 255 1HZ LYS 255 -22.630 -4.940 -7.809 263 2HZ LYS 255 2HZ LYS 255 -22.810 -5.924 -9.110 264 3HZ LYS 255 3HZ LYS 255 -24.065 -5.677 -8.122 265 H GLY 256 H GLY 256 -19.550 -4.414 -4.013 266 1HA GLY 256 1HA GLY 256 -17.848 -3.489 -5.926 267 2HA GLY 256 2HA GLY 256 -19.245 -4.034 -6.878 Start of MODEL 13 1 H GLY 220 H GLY 220 -18.453 -3.668 9.398 2 1HA GLY 220 1HA GLY 220 -19.008 -5.640 8.087 3 2HA GLY 220 2HA GLY 220 -19.116 -4.597 6.667 4 H LYS 221 H LYS 221 -17.368 -4.302 5.471 5 HA LYS 221 HA LYS 221 -14.627 -4.696 6.373 6 1HB LYS 221 1HB LYS 221 -15.987 -6.805 5.021 7 2HB LYS 221 2HB LYS 221 -15.069 -5.971 3.777 8 1HG LYS 221 1HG LYS 221 -13.050 -6.484 4.775 9 2HG LYS 221 2HG LYS 221 -13.784 -6.920 6.334 10 1HD LYS 221 1HD LYS 221 -14.788 -8.889 5.416 11 2HD LYS 221 2HD LYS 221 -14.340 -8.448 3.759 12 1HE LYS 221 1HE LYS 221 -12.006 -8.823 4.183 13 2HE LYS 221 2HE LYS 221 -12.282 -8.942 5.924 14 1HZ LYS 221 1HZ LYS 221 -12.014 -11.091 5.098 15 2HZ LYS 221 2HZ LYS 221 -13.612 -10.965 5.449 16 3HZ LYS 221 3HZ LYS 221 -13.090 -10.906 3.880 17 HA PRO 222 HA PRO 222 -14.844 -1.110 4.032 18 1HB PRO 222 1HB PRO 222 -12.140 -0.664 3.320 19 2HB PRO 222 2HB PRO 222 -12.931 -0.280 4.862 20 1HG PRO 222 1HG PRO 222 -11.076 -2.522 4.202 21 2HG PRO 222 2HG PRO 222 -11.472 -1.823 5.792 22 1HD PRO 222 1HD PRO 222 -12.468 -4.256 4.642 23 2HD PRO 222 2HD PRO 222 -13.009 -3.471 6.148 24 H GLU 223 H GLU 223 -14.180 0.161 2.031 25 HA GLU 223 HA GLU 223 -15.006 -0.932 -0.364 26 1HB GLU 223 1HB GLU 223 -12.864 1.199 -0.099 27 2HB GLU 223 2HB GLU 223 -13.961 0.965 -1.450 28 1HG GLU 223 1HG GLU 223 -14.700 1.952 1.328 29 2HG GLU 223 2HG GLU 223 -14.471 2.931 -0.102 30 H HIS 224 H HIS 224 -11.715 -0.880 0.904 31 HA HIS 224 HA HIS 224 -10.708 -2.758 -1.134 32 1HB HIS 224 1HB HIS 224 -9.091 -0.332 -0.274 33 2HB HIS 224 2HB HIS 224 -8.776 -1.436 -1.609 34 HD1 HIS 224 1HD HIS 224 -10.252 1.915 -0.947 35 HD2 HIS 224 2HD HIS 224 -10.816 -1.279 -3.666 36 HE1 HIS 224 1HE HIS 224 -11.710 2.807 -2.821 37 H ILE 225 H ILE 225 -8.588 -3.754 -0.254 38 HA ILE 225 HA ILE 225 -8.535 -3.749 2.702 39 HB ILE 225 HB ILE 225 -8.671 -5.935 0.661 40 1HG1 ILE 225 1HG1 ILE 225 -9.852 -5.143 3.339 41 2HG1 ILE 225 2HG1 ILE 225 -10.646 -5.360 1.806 42 1HG2 ILE 225 1HG2 ILE 225 -6.497 -6.452 1.825 43 2HG2 ILE 225 2HG2 ILE 225 -7.420 -6.638 3.336 44 3HG2 ILE 225 3HG2 ILE 225 -7.747 -7.667 1.942 45 1HD1 ILE 225 1HD1 ILE 225 -9.610 -7.453 3.703 46 2HD1 ILE 225 2HD1 ILE 225 -11.290 -7.129 3.228 47 3HD1 ILE 225 3HD1 ILE 225 -10.167 -7.845 2.044 48 HA PRO 226 HA PRO 226 -4.401 -2.469 2.189 49 1HB PRO 226 1HB PRO 226 -3.178 -3.326 4.436 50 2HB PRO 226 2HB PRO 226 -4.411 -2.027 4.458 51 1HG PRO 226 1HG PRO 226 -4.781 -4.962 5.114 52 2HG PRO 226 2HG PRO 226 -5.390 -3.539 6.022 53 1HD PRO 226 1HD PRO 226 -6.926 -4.923 4.256 54 2HD PRO 226 2HD PRO 226 -7.129 -3.191 4.450 55 H ASP 227 H ASP 227 -2.154 -3.282 2.168 56 HA ASP 227 HA ASP 227 -2.023 -6.108 1.167 57 1HB ASP 227 1HB ASP 227 -1.353 -4.478 -0.499 58 2HB ASP 227 2HB ASP 227 -0.082 -3.892 0.578 59 HA PRO 228 HA PRO 228 -0.032 -6.132 5.300 60 1HB PRO 228 1HB PRO 228 -0.127 -8.982 5.476 61 2HB PRO 228 2HB PRO 228 -1.272 -7.821 6.197 62 1HG PRO 228 1HG PRO 228 -1.861 -9.650 4.081 63 2HG PRO 228 2HG PRO 228 -2.845 -8.308 4.678 64 1HD PRO 228 1HD PRO 228 -1.137 -8.325 2.265 65 2HD PRO 228 2HD PRO 228 -2.634 -7.439 2.601 66 H ASP 229 H ASP 229 0.559 -8.713 2.946 67 HA ASP 229 HA ASP 229 3.153 -9.379 3.812 68 1HB ASP 229 1HB ASP 229 1.800 -10.765 2.266 69 2HB ASP 229 2HB ASP 229 2.229 -9.675 0.935 70 H ALA 230 H ALA 230 2.278 -6.809 1.502 71 HA ALA 230 HA ALA 230 4.797 -6.204 0.468 72 1HB ALA 230 1HB ALA 230 2.606 -4.279 1.355 73 2HB ALA 230 2HB ALA 230 3.979 -3.849 0.311 74 3HB ALA 230 3HB ALA 230 2.793 -5.023 -0.252 75 H LYS 231 H LYS 231 6.567 -5.043 1.120 76 HA LYS 231 HA LYS 231 6.693 -3.797 3.798 77 1HB LYS 231 1HB LYS 231 8.587 -5.933 2.714 78 2HB LYS 231 2HB LYS 231 9.048 -4.785 3.970 79 1HG LYS 231 1HG LYS 231 7.295 -5.580 5.455 80 2HG LYS 231 2HG LYS 231 6.714 -6.733 4.235 81 1HD LYS 231 1HD LYS 231 8.763 -7.997 4.369 82 2HD LYS 231 2HD LYS 231 9.538 -6.735 5.353 83 1HE LYS 231 1HE LYS 231 7.695 -7.096 7.069 84 2HE LYS 231 2HE LYS 231 7.239 -8.543 6.166 85 1HZ LYS 231 1HZ LYS 231 9.949 -8.089 7.304 86 2HZ LYS 231 2HZ LYS 231 8.739 -8.950 8.035 87 3HZ LYS 231 3HZ LYS 231 9.360 -9.483 6.635 88 H LYS 232 H LYS 232 8.032 -1.981 3.805 89 HA LYS 232 HA LYS 232 8.443 -0.591 1.626 90 1HB LYS 232 1HB LYS 232 9.891 0.864 2.752 91 2HB LYS 232 2HB LYS 232 8.809 0.211 3.959 92 1HG LYS 232 1HG LYS 232 10.481 -1.256 4.812 93 2HG LYS 232 2HG LYS 232 11.578 -0.932 3.473 94 1HD LYS 232 1HD LYS 232 11.203 1.629 4.365 95 2HD LYS 232 2HD LYS 232 11.068 0.742 5.879 96 1HE LYS 232 1HE LYS 232 13.324 0.342 3.877 97 2HE LYS 232 2HE LYS 232 13.393 1.570 5.139 98 1HZ LYS 232 1HZ LYS 232 13.218 -1.342 5.581 99 2HZ LYS 232 2HZ LYS 232 14.497 -0.359 5.865 100 3HZ LYS 232 3HZ LYS 232 13.132 -0.206 6.781 101 HA PRO 233 HA PRO 233 11.982 -1.990 -0.807 102 1HB PRO 233 1HB PRO 233 12.914 0.770 -1.202 103 2HB PRO 233 2HB PRO 233 12.269 -0.362 -2.418 104 1HG PRO 233 1HG PRO 233 10.881 1.862 -1.595 105 2HG PRO 233 2HG PRO 233 10.089 0.371 -2.104 106 1HD PRO 233 1HD PRO 233 10.595 1.348 0.723 107 2HD PRO 233 2HD PRO 233 9.148 0.545 0.004 108 H GLU 234 H GLU 234 14.202 -2.037 -0.859 109 HA GLU 234 HA GLU 234 15.759 -1.309 1.540 110 1HB GLU 234 1HB GLU 234 16.386 -3.329 0.589 111 2HB GLU 234 2HB GLU 234 16.085 -2.779 -1.066 112 1HG GLU 234 1HG GLU 234 18.157 -1.591 -1.162 113 2HG GLU 234 2HG GLU 234 18.307 -1.584 0.612 114 H ASP 235 H ASP 235 15.202 -0.381 -1.866 115 HA ASP 235 HA ASP 235 17.103 1.802 -1.796 116 1HB ASP 235 1HB ASP 235 15.164 0.816 -3.936 117 2HB ASP 235 2HB ASP 235 16.459 1.982 -4.157 118 H TRP 236 H TRP 236 14.905 2.042 0.089 119 HA TRP 236 HA TRP 236 13.137 4.074 -0.949 120 1HB TRP 236 1HB TRP 236 12.403 2.290 0.668 121 2HB TRP 236 2HB TRP 236 13.460 2.992 1.898 122 HD1 TRP 236 HD TRP 236 12.296 4.666 3.366 123 HE1 TRP 236 1HE TRP 236 10.450 6.544 3.088 124 HE3 TRP 236 3HE TRP 236 11.156 3.899 -1.456 125 HZ2 TRP 236 2HZ TRP 236 8.478 7.245 1.091 126 HZ3 TRP 236 3HZ TRP 236 9.400 5.224 -2.597 127 HH2 TRP 236 HH TRP 236 7.997 6.841 -1.313 128 H ASP 237 H ASP 237 13.443 6.168 -0.797 129 HA ASP 237 HA ASP 237 15.905 7.110 0.498 130 1HB ASP 237 1HB ASP 237 14.077 8.472 -1.518 131 2HB ASP 237 2HB ASP 237 15.656 9.064 -0.961 132 H GLU 238 H GLU 238 15.097 7.218 2.651 133 HA GLU 238 HA GLU 238 12.693 8.605 3.403 134 1HB GLU 238 1HB GLU 238 15.269 8.117 4.954 135 2HB GLU 238 2HB GLU 238 13.758 8.732 5.665 136 1HG GLU 238 1HG GLU 238 12.575 6.670 5.043 137 2HG GLU 238 2HG GLU 238 14.047 6.026 4.290 138 H GLU 239 H GLU 239 15.902 9.811 2.484 139 HA GLU 239 HA GLU 239 15.444 12.431 3.625 140 1HB GLU 239 1HB GLU 239 17.633 11.115 3.338 141 2HB GLU 239 2HB GLU 239 17.586 11.575 1.629 142 1HG GLU 239 1HG GLU 239 17.660 13.937 2.190 143 2HG GLU 239 2HG GLU 239 17.366 13.545 3.892 144 H MET 240 H MET 240 14.671 10.848 0.681 145 HA MET 240 HA MET 240 14.311 13.438 -0.782 146 1HB MET 240 1HB MET 240 14.126 10.574 -1.734 147 2HB MET 240 2HB MET 240 13.571 11.904 -2.701 148 1HG MET 240 1HG MET 240 16.374 12.118 -1.669 149 2HG MET 240 2HG MET 240 16.053 10.862 -2.851 150 1HE MET 240 1HE MET 240 15.421 15.374 -3.764 151 2HE MET 240 2HE MET 240 14.231 14.470 -2.816 152 3HE MET 240 3HE MET 240 15.864 14.745 -2.163 153 H ASP 241 H ASP 241 12.529 10.381 -0.125 154 HA ASP 241 HA ASP 241 10.080 11.714 -0.936 155 1HB ASP 241 1HB ASP 241 10.985 9.258 -1.475 156 2HB ASP 241 2HB ASP 241 10.117 8.862 0.003 157 H GLY 242 H GLY 242 10.973 9.695 1.943 158 1HA GLY 242 1HA GLY 242 10.536 10.866 4.175 159 2HA GLY 242 2HA GLY 242 8.959 11.278 3.516 160 H GLU 243 H GLU 243 7.503 10.059 4.746 161 HA GLU 243 HA GLU 243 7.845 7.470 5.668 162 1HB GLU 243 1HB GLU 243 5.646 7.822 6.304 163 2HB GLU 243 2HB GLU 243 6.357 9.403 6.415 164 1HG GLU 243 1HG GLU 243 5.291 9.977 4.209 165 2HG GLU 243 2HG GLU 243 4.530 8.381 4.202 166 H TRP 244 H TRP 244 7.310 5.513 4.698 167 HA TRP 244 HA TRP 244 6.578 5.503 1.810 168 1HB TRP 244 1HB TRP 244 8.457 4.038 2.569 169 2HB TRP 244 2HB TRP 244 7.371 3.260 3.709 170 HD1 TRP 244 HD TRP 244 7.567 3.809 -0.145 171 HE1 TRP 244 1HE TRP 244 6.691 1.724 -1.320 172 HE3 TRP 244 3HE TRP 244 6.374 1.024 3.971 173 HZ2 TRP 244 2HZ TRP 244 5.713 -0.909 -0.555 174 HZ3 TRP 244 3HZ TRP 244 5.635 -1.326 3.725 175 HH2 TRP 244 HH TRP 244 5.184 -2.263 1.464 176 H GLU 245 H GLU 245 4.728 3.992 1.263 177 HA GLU 245 HA GLU 245 2.988 3.324 3.496 178 1HB GLU 245 1HB GLU 245 1.043 4.312 2.738 179 2HB GLU 245 2HB GLU 245 2.245 5.559 2.420 180 1HG GLU 245 1HG GLU 245 2.352 4.476 0.019 181 2HG GLU 245 2HG GLU 245 0.841 3.705 0.497 182 HA PRO 246 HA PRO 246 3.029 -0.333 0.917 183 1HB PRO 246 1HB PRO 246 1.074 -1.846 2.150 184 2HB PRO 246 2HB PRO 246 2.709 -1.570 2.823 185 1HG PRO 246 1HG PRO 246 0.144 -0.089 3.479 186 2HG PRO 246 2HG PRO 246 1.370 -0.754 4.611 187 1HD PRO 246 1HD PRO 246 1.244 1.876 3.812 188 2HD PRO 246 2HD PRO 246 2.798 1.077 4.189 189 HA PRO 247 HA PRO 247 -0.315 0.050 -2.075 190 1HB PRO 247 1HB PRO 247 -0.763 -2.871 -1.985 191 2HB PRO 247 2HB PRO 247 -0.311 -1.868 -3.397 192 1HG PRO 247 1HG PRO 247 1.520 -3.544 -2.215 193 2HG PRO 247 2HG PRO 247 1.969 -1.951 -2.887 194 1HD PRO 247 1HD PRO 247 1.540 -2.695 -0.017 195 2HD PRO 247 2HD PRO 247 2.760 -1.626 -0.742 196 H VAL 248 H VAL 248 -2.657 -1.159 -2.565 197 HA VAL 248 HA VAL 248 -3.825 -2.356 -0.271 198 HB VAL 248 HB VAL 248 -5.949 -1.382 -1.111 199 1HG1 VAL 248 1HG1 VAL 248 -4.936 -0.752 1.004 200 2HG1 VAL 248 2HG1 VAL 248 -3.884 0.411 0.196 201 3HG1 VAL 248 3HG1 VAL 248 -5.656 0.705 0.281 202 1HG2 VAL 248 1HG2 VAL 248 -5.084 -0.335 -3.250 203 2HG2 VAL 248 2HG2 VAL 248 -6.138 0.673 -2.267 204 3HG2 VAL 248 3HG2 VAL 248 -4.390 0.958 -2.228 205 H ILE 249 H ILE 249 -5.900 -3.472 -1.307 206 HA ILE 249 HA ILE 249 -5.336 -4.524 -3.962 207 HB ILE 249 HB ILE 249 -5.532 -6.782 -3.227 208 1HG1 ILE 249 1HG1 ILE 249 -5.864 -5.948 -0.320 209 2HG1 ILE 249 2HG1 ILE 249 -7.219 -6.382 -1.346 210 1HG2 ILE 249 1HG2 ILE 249 -3.275 -5.645 -2.900 211 2HG2 ILE 249 2HG2 ILE 249 -3.682 -5.477 -1.170 212 3HG2 ILE 249 3HG2 ILE 249 -3.523 -7.076 -1.892 213 1HD1 ILE 249 1HD1 ILE 249 -4.953 -8.226 -0.546 214 2HD1 ILE 249 2HD1 ILE 249 -6.659 -8.325 -0.094 215 3HD1 ILE 249 3HD1 ILE 249 -6.183 -8.620 -1.774 216 H GLN 250 H GLN 250 -7.297 -5.230 -4.924 217 HA GLN 250 HA GLN 250 -9.742 -3.980 -4.153 218 1HB GLN 250 1HB GLN 250 -10.807 -5.236 -5.835 219 2HB GLN 250 2HB GLN 250 -9.204 -4.907 -6.426 220 1HG GLN 250 1HG GLN 250 -9.581 -7.114 -7.074 221 2HG GLN 250 2HG GLN 250 -8.526 -7.267 -5.681 222 1HE2 GLN 250 1HE2 GLN 250 -12.131 -6.665 -5.600 223 2HE2 GLN 250 2HE2 GLN 250 -12.472 -8.243 -4.943 224 H ASN 251 H ASN 251 -11.336 -4.657 -2.741 225 HA ASN 251 HA ASN 251 -10.507 -6.610 -0.718 226 1HB ASN 251 1HB ASN 251 -11.737 -4.617 -0.008 227 2HB ASN 251 2HB ASN 251 -13.063 -5.081 -1.070 228 1HD2 ASN 251 1HD2 ASN 251 -13.923 -4.697 1.443 229 2HD2 ASN 251 2HD2 ASN 251 -14.344 -6.322 2.025 230 HA PRO 252 HA PRO 252 -12.479 -9.805 -3.270 231 1HB PRO 252 1HB PRO 252 -11.757 -12.014 -1.845 232 2HB PRO 252 2HB PRO 252 -10.602 -11.048 -2.816 233 1HG PRO 252 1HG PRO 252 -11.111 -10.842 0.156 234 2HG PRO 252 2HG PRO 252 -9.534 -11.027 -0.686 235 1HD PRO 252 1HD PRO 252 -10.523 -8.577 0.060 236 2HD PRO 252 2HD PRO 252 -9.581 -8.805 -1.432 237 H GLU 253 H GLU 253 -13.742 -8.509 -0.417 238 HA GLU 253 HA GLU 253 -16.269 -9.492 -0.973 239 1HB GLU 253 1HB GLU 253 -14.931 -10.759 1.406 240 2HB GLU 253 2HB GLU 253 -16.574 -10.189 1.622 241 1HG GLU 253 1HG GLU 253 -16.593 -11.550 -0.883 242 2HG GLU 253 2HG GLU 253 -15.625 -12.529 0.198 243 H TYR 254 H TYR 254 -16.182 -7.317 -1.357 244 HA TYR 254 HA TYR 254 -16.384 -5.458 0.954 245 1HB TYR 254 1HB TYR 254 -15.050 -4.507 -0.682 246 2HB TYR 254 2HB TYR 254 -16.008 -5.160 -2.012 247 HD1 TYR 254 1HD TYR 254 -16.545 -2.894 0.964 248 HD2 TYR 254 2HD TYR 254 -17.098 -3.561 -3.259 249 HE1 TYR 254 1HE TYR 254 -17.705 -0.710 0.754 250 HE2 TYR 254 2HE TYR 254 -18.274 -1.387 -3.467 251 HH TYR 254 HH TYR 254 -18.006 0.987 -1.350 252 H LYS 255 H LYS 255 -18.361 -6.223 1.885 253 HA LYS 255 HA LYS 255 -20.834 -5.569 0.434 254 1HB LYS 255 1HB LYS 255 -20.166 -6.865 2.897 255 2HB LYS 255 2HB LYS 255 -20.946 -5.382 3.374 256 1HG LYS 255 1HG LYS 255 -22.974 -6.223 2.909 257 2HG LYS 255 2HG LYS 255 -22.527 -6.558 1.240 258 1HD LYS 255 1HD LYS 255 -21.501 -8.644 1.848 259 2HD LYS 255 2HD LYS 255 -21.810 -8.361 3.578 260 1HE LYS 255 1HE LYS 255 -24.201 -8.551 3.252 261 2HE LYS 255 2HE LYS 255 -24.002 -8.570 1.481 262 1HZ LYS 255 1HZ LYS 255 -22.838 -10.613 1.640 263 2HZ LYS 255 2HZ LYS 255 -22.900 -10.626 3.284 264 3HZ LYS 255 3HZ LYS 255 -24.290 -10.797 2.390 265 H GLY 256 H GLY 256 -18.376 -3.998 2.389 266 1HA GLY 256 1HA GLY 256 -18.025 -1.660 2.703 267 2HA GLY 256 2HA GLY 256 -19.731 -1.363 2.300 Start of MODEL 14 1 H GLY 220 H GLY 220 -18.713 -0.507 8.537 2 1HA GLY 220 1HA GLY 220 -18.531 -2.990 8.418 3 2HA GLY 220 2HA GLY 220 -19.092 -2.831 6.750 4 H LYS 221 H LYS 221 -17.232 -3.627 5.827 5 HA LYS 221 HA LYS 221 -14.558 -2.661 6.434 6 1HB LYS 221 1HB LYS 221 -15.837 -4.845 5.048 7 2HB LYS 221 2HB LYS 221 -14.844 -4.042 3.868 8 1HG LYS 221 1HG LYS 221 -12.883 -4.654 5.037 9 2HG LYS 221 2HG LYS 221 -13.708 -4.801 6.613 10 1HD LYS 221 1HD LYS 221 -14.857 -6.816 5.883 11 2HD LYS 221 2HD LYS 221 -14.248 -6.573 4.258 12 1HE LYS 221 1HE LYS 221 -13.101 -8.419 5.183 13 2HE LYS 221 2HE LYS 221 -11.961 -7.116 4.961 14 1HZ LYS 221 1HZ LYS 221 -11.987 -6.734 7.327 15 2HZ LYS 221 2HZ LYS 221 -13.197 -7.826 7.564 16 3HZ LYS 221 3HZ LYS 221 -11.750 -8.340 7.058 17 HA PRO 222 HA PRO 222 -14.543 0.509 3.205 18 1HB PRO 222 1HB PRO 222 -11.866 0.387 2.338 19 2HB PRO 222 2HB PRO 222 -12.486 1.289 3.758 20 1HG PRO 222 1HG PRO 222 -11.009 -1.275 3.631 21 2HG PRO 222 2HG PRO 222 -11.065 -0.108 4.963 22 1HD PRO 222 1HD PRO 222 -12.480 -2.552 4.831 23 2HD PRO 222 2HD PRO 222 -12.841 -1.242 5.945 24 H GLU 223 H GLU 223 -13.720 0.850 0.924 25 HA GLU 223 HA GLU 223 -14.728 -1.109 -0.826 26 1HB GLU 223 1HB GLU 223 -12.774 1.014 -1.630 27 2HB GLU 223 2HB GLU 223 -14.065 0.320 -2.594 28 1HG GLU 223 1HG GLU 223 -14.426 2.219 -0.229 29 2HG GLU 223 2HG GLU 223 -14.401 2.684 -1.921 30 H HIS 224 H HIS 224 -11.308 -0.379 0.047 31 HA HIS 224 HA HIS 224 -10.436 -2.879 -1.297 32 1HB HIS 224 1HB HIS 224 -9.330 -0.072 -1.568 33 2HB HIS 224 2HB HIS 224 -8.219 -1.425 -1.562 34 HD1 HIS 224 1HD HIS 224 -8.858 0.520 -4.143 35 HD2 HIS 224 2HD HIS 224 -10.034 -3.446 -3.379 36 HE1 HIS 224 1HE HIS 224 -9.244 -0.561 -6.397 37 H ILE 225 H ILE 225 -8.536 -3.822 -0.283 38 HA ILE 225 HA ILE 225 -8.267 -3.214 2.596 39 HB ILE 225 HB ILE 225 -8.801 -5.618 1.094 40 1HG1 ILE 225 1HG1 ILE 225 -8.420 -4.970 4.042 41 2HG1 ILE 225 2HG1 ILE 225 -9.866 -4.610 3.114 42 1HG2 ILE 225 1HG2 ILE 225 -6.270 -5.974 1.306 43 2HG2 ILE 225 2HG2 ILE 225 -6.507 -6.088 3.026 44 3HG2 ILE 225 3HG2 ILE 225 -7.323 -7.236 1.925 45 1HD1 ILE 225 1HD1 ILE 225 -8.786 -7.350 3.685 46 2HD1 ILE 225 2HD1 ILE 225 -10.208 -6.543 4.401 47 3HD1 ILE 225 3HD1 ILE 225 -10.189 -6.977 2.669 48 HA PRO 226 HA PRO 226 -4.027 -2.268 1.471 49 1HB PRO 226 1HB PRO 226 -2.598 -2.677 3.662 50 2HB PRO 226 2HB PRO 226 -3.782 -1.330 3.585 51 1HG PRO 226 1HG PRO 226 -4.147 -4.006 4.948 52 2HG PRO 226 2HG PRO 226 -4.690 -2.383 5.486 53 1HD PRO 226 1HD PRO 226 -6.278 -4.263 4.176 54 2HD PRO 226 2HD PRO 226 -6.630 -2.531 4.202 55 H ASP 227 H ASP 227 -1.952 -3.220 1.310 56 HA ASP 227 HA ASP 227 -2.214 -6.062 0.538 57 1HB ASP 227 1HB ASP 227 -1.213 -4.324 -0.979 58 2HB ASP 227 2HB ASP 227 0.178 -4.228 0.102 59 HA PRO 228 HA PRO 228 -0.391 -6.855 4.559 60 1HB PRO 228 1HB PRO 228 -0.420 -9.560 4.626 61 2HB PRO 228 2HB PRO 228 -1.928 -8.591 4.671 62 1HG PRO 228 1HG PRO 228 -0.641 -9.932 2.263 63 2HG PRO 228 2HG PRO 228 -2.339 -9.999 2.801 64 1HD PRO 228 1HD PRO 228 -1.484 -8.253 0.874 65 2HD PRO 228 2HD PRO 228 -2.786 -7.822 2.030 66 H ASP 229 H ASP 229 0.935 -8.440 1.638 67 HA ASP 229 HA ASP 229 3.317 -9.388 3.035 68 1HB ASP 229 1HB ASP 229 2.136 -10.617 1.172 69 2HB ASP 229 2HB ASP 229 2.719 -9.360 0.067 70 H ALA 230 H ALA 230 2.460 -6.890 0.623 71 HA ALA 230 HA ALA 230 4.961 -6.051 -0.178 72 1HB ALA 230 1HB ALA 230 2.861 -5.310 -1.195 73 2HB ALA 230 2HB ALA 230 2.473 -4.390 0.279 74 3HB ALA 230 3HB ALA 230 3.853 -3.908 -0.726 75 H LYS 231 H LYS 231 6.647 -5.401 0.922 76 HA LYS 231 HA LYS 231 6.382 -3.603 3.289 77 1HB LYS 231 1HB LYS 231 7.377 -5.608 3.964 78 2HB LYS 231 2HB LYS 231 8.383 -5.759 2.525 79 1HG LYS 231 1HG LYS 231 9.910 -4.115 3.238 80 2HG LYS 231 2HG LYS 231 8.802 -3.468 4.450 81 1HD LYS 231 1HD LYS 231 9.960 -6.240 4.658 82 2HD LYS 231 2HD LYS 231 10.738 -4.797 5.338 83 1HE LYS 231 1HE LYS 231 8.657 -4.306 6.630 84 2HE LYS 231 2HE LYS 231 7.930 -5.791 5.980 85 1HZ LYS 231 1HZ LYS 231 8.779 -6.312 8.065 86 2HZ LYS 231 2HZ LYS 231 9.829 -6.976 6.973 87 3HZ LYS 231 3HZ LYS 231 10.243 -5.611 7.803 88 H LYS 232 H LYS 232 7.821 -1.856 3.342 89 HA LYS 232 HA LYS 232 8.554 -0.152 1.525 90 1HB LYS 232 1HB LYS 232 9.948 -1.133 3.929 91 2HB LYS 232 2HB LYS 232 11.062 -0.462 2.779 92 1HG LYS 232 1HG LYS 232 9.782 1.660 2.703 93 2HG LYS 232 2HG LYS 232 8.681 0.999 3.934 94 1HD LYS 232 1HD LYS 232 10.319 2.357 5.060 95 2HD LYS 232 2HD LYS 232 10.639 0.683 5.466 96 1HE LYS 232 1HE LYS 232 12.409 0.726 3.589 97 2HE LYS 232 2HE LYS 232 12.181 2.467 3.545 98 1HZ LYS 232 1HZ LYS 232 12.839 2.499 5.929 99 2HZ LYS 232 2HZ LYS 232 13.128 0.862 5.853 100 3HZ LYS 232 3HZ LYS 232 14.003 1.892 4.975 101 HA PRO 233 HA PRO 233 11.536 -1.929 -1.500 102 1HB PRO 233 1HB PRO 233 12.419 0.841 -1.895 103 2HB PRO 233 2HB PRO 233 11.691 -0.264 -3.085 104 1HG PRO 233 1HG PRO 233 10.462 1.990 -1.997 105 2HG PRO 233 2HG PRO 233 9.603 0.609 -2.687 106 1HD PRO 233 1HD PRO 233 10.019 1.309 0.204 107 2HD PRO 233 2HD PRO 233 8.696 0.414 -0.589 108 H GLU 234 H GLU 234 13.754 -2.063 -1.551 109 HA GLU 234 HA GLU 234 15.478 -1.101 0.630 110 1HB GLU 234 1HB GLU 234 15.626 -2.719 -1.867 111 2HB GLU 234 2HB GLU 234 17.090 -1.778 -1.496 112 1HG GLU 234 1HG GLU 234 17.322 -2.831 0.664 113 2HG GLU 234 2HG GLU 234 15.738 -3.583 0.551 114 H ASP 235 H ASP 235 14.635 -0.296 -2.756 115 HA ASP 235 HA ASP 235 16.152 2.110 -2.989 116 1HB ASP 235 1HB ASP 235 13.854 0.887 -4.588 117 2HB ASP 235 2HB ASP 235 14.719 2.354 -5.054 118 H TRP 236 H TRP 236 14.516 2.186 -0.582 119 HA TRP 236 HA TRP 236 12.640 4.374 -1.145 120 1HB TRP 236 1HB TRP 236 11.910 2.284 0.155 121 2HB TRP 236 2HB TRP 236 12.945 2.834 1.457 122 HD1 TRP 236 HD TRP 236 11.718 4.354 3.134 123 HE1 TRP 236 1HE TRP 236 9.829 6.167 3.010 124 HE3 TRP 236 3HE TRP 236 10.674 4.089 -1.805 125 HZ2 TRP 236 2HZ TRP 236 7.841 6.995 1.096 126 HZ3 TRP 236 3HZ TRP 236 8.880 5.568 -2.802 127 HH2 TRP 236 HH TRP 236 7.428 6.927 -1.333 128 H ASP 237 H ASP 237 13.165 6.364 -0.658 129 HA ASP 237 HA ASP 237 15.649 6.895 0.840 130 1HB ASP 237 1HB ASP 237 13.896 8.743 -0.840 131 2HB ASP 237 2HB ASP 237 15.448 9.159 -0.089 132 H GLU 238 H GLU 238 14.798 6.522 2.978 133 HA GLU 238 HA GLU 238 12.535 8.032 3.994 134 1HB GLU 238 1HB GLU 238 14.877 6.631 5.365 135 2HB GLU 238 2HB GLU 238 13.654 7.530 6.240 136 1HG GLU 238 1HG GLU 238 11.892 6.105 4.959 137 2HG GLU 238 2HG GLU 238 13.261 5.041 4.607 138 H GLU 239 H GLU 239 15.328 9.290 2.790 139 HA GLU 239 HA GLU 239 15.313 11.619 4.603 140 1HB GLU 239 1HB GLU 239 17.401 10.013 3.781 141 2HB GLU 239 2HB GLU 239 17.483 11.315 2.587 142 1HG GLU 239 1HG GLU 239 17.367 12.963 4.477 143 2HG GLU 239 2HG GLU 239 17.392 11.609 5.621 144 H MET 240 H MET 240 14.020 10.609 1.753 145 HA MET 240 HA MET 240 13.838 13.418 0.706 146 1HB MET 240 1HB MET 240 14.067 10.872 -0.909 147 2HB MET 240 2HB MET 240 13.329 12.302 -1.526 148 1HG MET 240 1HG MET 240 15.695 13.312 -0.492 149 2HG MET 240 2HG MET 240 16.208 11.705 -0.959 150 1HE MET 240 1HE MET 240 16.995 12.086 -4.584 151 2HE MET 240 2HE MET 240 17.681 11.781 -2.978 152 3HE MET 240 3HE MET 240 16.268 10.848 -3.534 153 H ASP 241 H ASP 241 12.272 10.206 0.659 154 HA ASP 241 HA ASP 241 9.737 11.459 0.123 155 1HB ASP 241 1HB ASP 241 10.666 9.139 -0.751 156 2HB ASP 241 2HB ASP 241 9.953 8.522 0.724 157 H GLY 242 H GLY 242 10.400 8.953 2.648 158 1HA GLY 242 1HA GLY 242 10.164 9.781 5.059 159 2HA GLY 242 2HA GLY 242 8.625 10.488 4.519 160 H GLU 243 H GLU 243 7.064 9.304 5.522 161 HA GLU 243 HA GLU 243 7.214 6.489 5.965 162 1HB GLU 243 1HB GLU 243 5.364 8.677 6.540 163 2HB GLU 243 2HB GLU 243 4.492 7.315 5.824 164 1HG GLU 243 1HG GLU 243 5.610 5.764 7.446 165 2HG GLU 243 2HG GLU 243 6.409 7.173 8.177 166 H TRP 244 H TRP 244 7.159 5.017 4.533 167 HA TRP 244 HA TRP 244 6.081 5.278 1.813 168 1HB TRP 244 1HB TRP 244 8.057 3.835 2.399 169 2HB TRP 244 2HB TRP 244 7.039 2.911 3.473 170 HD1 TRP 244 HD TRP 244 7.179 3.802 -0.325 171 HE1 TRP 244 1HE TRP 244 6.393 1.753 -1.646 172 HE3 TRP 244 3HE TRP 244 6.088 0.730 3.577 173 HZ2 TRP 244 2HZ TRP 244 5.276 -0.868 -1.049 174 HZ3 TRP 244 3HZ TRP 244 5.350 -1.572 3.204 175 HH2 TRP 244 HH TRP 244 4.763 -2.340 0.873 176 H GLU 245 H GLU 245 4.126 4.027 1.246 177 HA GLU 245 HA GLU 245 2.480 3.072 3.497 178 1HB GLU 245 1HB GLU 245 1.511 5.045 1.399 179 2HB GLU 245 2HB GLU 245 0.465 4.107 2.489 180 1HG GLU 245 1HG GLU 245 1.702 5.123 4.429 181 2HG GLU 245 2HG GLU 245 2.549 6.185 3.314 182 HA PRO 246 HA PRO 246 2.745 -0.150 0.514 183 1HB PRO 246 1HB PRO 246 0.868 -1.962 1.507 184 2HB PRO 246 2HB PRO 246 2.509 -1.712 2.142 185 1HG PRO 246 1HG PRO 246 -0.140 -0.547 3.089 186 2HG PRO 246 2HG PRO 246 1.183 -1.225 4.072 187 1HD PRO 246 1HD PRO 246 0.847 1.474 3.704 188 2HD PRO 246 2HD PRO 246 2.472 0.742 3.859 189 HA PRO 247 HA PRO 247 -0.633 0.160 -2.395 190 1HB PRO 247 1HB PRO 247 -0.740 -2.381 -3.442 191 2HB PRO 247 2HB PRO 247 0.382 -1.121 -3.958 192 1HG PRO 247 1HG PRO 247 0.892 -3.525 -2.293 193 2HG PRO 247 2HG PRO 247 2.038 -2.596 -3.291 194 1HD PRO 247 1HD PRO 247 1.688 -2.482 -0.465 195 2HD PRO 247 2HD PRO 247 2.655 -1.339 -1.418 196 H VAL 248 H VAL 248 -2.669 -1.375 -3.127 197 HA VAL 248 HA VAL 248 -3.906 -2.601 -0.789 198 HB VAL 248 HB VAL 248 -5.955 -1.623 -1.678 199 1HG1 VAL 248 1HG1 VAL 248 -5.586 0.654 -0.674 200 2HG1 VAL 248 2HG1 VAL 248 -4.888 -0.639 0.288 201 3HG1 VAL 248 3HG1 VAL 248 -3.823 0.348 -0.756 202 1HG2 VAL 248 1HG2 VAL 248 -5.275 -0.958 -3.948 203 2HG2 VAL 248 2HG2 VAL 248 -6.013 0.388 -3.063 204 3HG2 VAL 248 3HG2 VAL 248 -4.250 0.323 -3.278 205 H ILE 249 H ILE 249 -5.896 -3.825 -1.543 206 HA ILE 249 HA ILE 249 -5.659 -5.050 -4.168 207 HB ILE 249 HB ILE 249 -5.557 -7.270 -3.315 208 1HG1 ILE 249 1HG1 ILE 249 -5.182 -6.414 -0.452 209 2HG1 ILE 249 2HG1 ILE 249 -6.828 -6.678 -1.049 210 1HG2 ILE 249 1HG2 ILE 249 -3.321 -7.302 -2.249 211 2HG2 ILE 249 2HG2 ILE 249 -3.409 -6.099 -3.514 212 3HG2 ILE 249 3HG2 ILE 249 -3.481 -5.566 -1.816 213 1HD1 ILE 249 1HD1 ILE 249 -6.044 -8.695 0.021 214 2HD1 ILE 249 2HD1 ILE 249 -6.227 -8.983 -1.722 215 3HD1 ILE 249 3HD1 ILE 249 -4.610 -8.755 -1.018 216 H GLN 250 H GLN 250 -7.481 -6.442 -4.503 217 HA GLN 250 HA GLN 250 -10.068 -5.479 -3.869 218 1HB GLN 250 1HB GLN 250 -8.876 -8.076 -4.907 219 2HB GLN 250 2HB GLN 250 -10.600 -7.999 -4.549 220 1HG GLN 250 1HG GLN 250 -9.272 -5.891 -6.308 221 2HG GLN 250 2HG GLN 250 -9.829 -7.424 -6.965 222 1HE2 GLN 250 1HE2 GLN 250 -10.943 -4.220 -5.733 223 2HE2 GLN 250 2HE2 GLN 250 -12.616 -4.635 -6.000 224 H ASN 251 H ASN 251 -11.080 -5.421 -2.057 225 HA ASN 251 HA ASN 251 -10.434 -7.089 0.254 226 1HB ASN 251 1HB ASN 251 -11.263 -4.858 0.668 227 2HB ASN 251 2HB ASN 251 -12.599 -5.118 -0.423 228 1HD2 ASN 251 1HD2 ASN 251 -13.971 -4.369 1.452 229 2HD2 ASN 251 2HD2 ASN 251 -14.477 -5.621 2.542 230 HA PRO 252 HA PRO 252 -12.911 -10.322 -1.673 231 1HB PRO 252 1HB PRO 252 -13.002 -12.133 0.399 232 2HB PRO 252 2HB PRO 252 -11.539 -11.834 -0.594 233 1HG PRO 252 1HG PRO 252 -12.221 -10.576 2.081 234 2HG PRO 252 2HG PRO 252 -10.716 -11.428 1.620 235 1HD PRO 252 1HD PRO 252 -10.831 -8.760 1.445 236 2HD PRO 252 2HD PRO 252 -10.060 -9.684 0.119 237 H GLU 253 H GLU 253 -13.680 -8.941 1.528 238 HA GLU 253 HA GLU 253 -16.453 -9.929 1.443 239 1HB GLU 253 1HB GLU 253 -14.793 -10.116 3.391 240 2HB GLU 253 2HB GLU 253 -14.970 -8.393 3.587 241 1HG GLU 253 1HG GLU 253 -17.462 -8.785 3.956 242 2HG GLU 253 2HG GLU 253 -17.114 -10.518 3.921 243 H TYR 254 H TYR 254 -15.060 -7.409 -0.066 244 HA TYR 254 HA TYR 254 -16.752 -5.177 0.757 245 1HB TYR 254 1HB TYR 254 -14.647 -4.645 -0.278 246 2HB TYR 254 2HB TYR 254 -14.954 -5.735 -1.623 247 HD1 TYR 254 1HD TYR 254 -16.679 -2.800 0.062 248 HD2 TYR 254 2HD TYR 254 -15.317 -4.656 -3.582 249 HE1 TYR 254 1HE TYR 254 -17.398 -0.827 -1.217 250 HE2 TYR 254 2HE TYR 254 -16.001 -2.646 -4.873 251 HH TYR 254 HH TYR 254 -16.980 0.343 -3.261 252 H LYS 255 H LYS 255 -18.313 -4.297 -1.149 253 HA LYS 255 HA LYS 255 -19.521 -6.487 -2.714 254 1HB LYS 255 1HB LYS 255 -20.746 -5.496 -0.495 255 2HB LYS 255 2HB LYS 255 -21.325 -4.317 -1.681 256 1HG LYS 255 1HG LYS 255 -21.502 -7.322 -2.016 257 2HG LYS 255 2HG LYS 255 -22.754 -6.381 -1.214 258 1HD LYS 255 1HD LYS 255 -23.243 -5.163 -3.245 259 2HD LYS 255 2HD LYS 255 -21.859 -5.917 -4.093 260 1HE LYS 255 1HE LYS 255 -22.831 -8.155 -3.749 261 2HE LYS 255 2HE LYS 255 -24.225 -7.453 -2.926 262 1HZ LYS 255 1HZ LYS 255 -24.598 -7.965 -5.298 263 2HZ LYS 255 2HZ LYS 255 -24.873 -6.402 -4.958 264 3HZ LYS 255 3HZ LYS 255 -23.472 -6.837 -5.712 265 H GLY 256 H GLY 256 -19.724 -2.927 -2.308 266 1HA GLY 256 1HA GLY 256 -18.999 -1.849 -4.738 267 2HA GLY 256 2HA GLY 256 -20.616 -2.565 -4.969 Start of MODEL 15 1 H GLY 220 H GLY 220 -17.250 -3.958 10.685 2 1HA GLY 220 1HA GLY 220 -17.934 -5.016 8.554 3 2HA GLY 220 2HA GLY 220 -18.202 -3.370 7.951 4 H LYS 221 H LYS 221 -16.482 -5.187 6.679 5 HA LYS 221 HA LYS 221 -13.722 -4.306 7.245 6 1HB LYS 221 1HB LYS 221 -14.714 -6.611 6.103 7 2HB LYS 221 2HB LYS 221 -14.402 -5.655 4.648 8 1HG LYS 221 1HG LYS 221 -12.215 -5.874 4.746 9 2HG LYS 221 2HG LYS 221 -12.112 -5.660 6.497 10 1HD LYS 221 1HD LYS 221 -13.087 -8.243 5.222 11 2HD LYS 221 2HD LYS 221 -11.394 -7.879 5.552 12 1HE LYS 221 1HE LYS 221 -12.707 -7.169 7.928 13 2HE LYS 221 2HE LYS 221 -13.540 -8.648 7.432 14 1HZ LYS 221 1HZ LYS 221 -11.564 -8.916 8.890 15 2HZ LYS 221 2HZ LYS 221 -11.464 -9.815 7.515 16 3HZ LYS 221 3HZ LYS 221 -10.606 -8.412 7.677 17 HA PRO 222 HA PRO 222 -14.151 -0.732 4.562 18 1HB PRO 222 1HB PRO 222 -11.529 -0.967 3.349 19 2HB PRO 222 2HB PRO 222 -12.024 0.118 4.640 20 1HG PRO 222 1HG PRO 222 -10.282 -2.086 4.934 21 2HG PRO 222 2HG PRO 222 -11.064 -1.171 6.245 22 1HD PRO 222 1HD PRO 222 -11.789 -3.785 5.014 23 2HD PRO 222 2HD PRO 222 -12.047 -3.197 6.689 24 H GLU 223 H GLU 223 -13.864 -0.043 2.208 25 HA GLU 223 HA GLU 223 -14.664 -2.016 0.278 26 1HB GLU 223 1HB GLU 223 -14.331 -0.045 -1.230 27 2HB GLU 223 2HB GLU 223 -15.567 0.157 0.009 28 1HG GLU 223 1HG GLU 223 -12.770 1.167 0.553 29 2HG GLU 223 2HG GLU 223 -13.742 2.031 -0.633 30 H HIS 224 H HIS 224 -11.519 -1.026 1.340 31 HA HIS 224 HA HIS 224 -10.353 -2.747 -0.741 32 1HB HIS 224 1HB HIS 224 -9.511 0.047 0.006 33 2HB HIS 224 2HB HIS 224 -8.315 -1.138 -0.412 34 HD1 HIS 224 1HD HIS 224 -11.174 0.810 -2.136 35 HD2 HIS 224 2HD HIS 224 -8.192 -2.069 -2.914 36 HE1 HIS 224 1HE HIS 224 -11.006 0.606 -4.656 37 H ILE 225 H ILE 225 -8.584 -3.884 0.013 38 HA ILE 225 HA ILE 225 -8.348 -4.092 2.989 39 HB ILE 225 HB ILE 225 -8.086 -6.169 0.795 40 1HG1 ILE 225 1HG1 ILE 225 -10.246 -5.338 2.608 41 2HG1 ILE 225 2HG1 ILE 225 -10.227 -6.200 1.085 42 1HG2 ILE 225 1HG2 ILE 225 -7.569 -7.899 2.351 43 2HG2 ILE 225 2HG2 ILE 225 -6.360 -6.659 2.495 44 3HG2 ILE 225 3HG2 ILE 225 -7.634 -6.787 3.724 45 1HD1 ILE 225 1HD1 ILE 225 -9.814 -7.420 3.817 46 2HD1 ILE 225 2HD1 ILE 225 -11.286 -7.516 2.826 47 3HD1 ILE 225 3HD1 ILE 225 -9.813 -8.324 2.265 48 HA PRO 226 HA PRO 226 -4.146 -2.814 2.173 49 1HB PRO 226 1HB PRO 226 -2.852 -3.594 4.413 50 2HB PRO 226 2HB PRO 226 -4.006 -2.225 4.373 51 1HG PRO 226 1HG PRO 226 -4.451 -5.010 5.415 52 2HG PRO 226 2HG PRO 226 -5.065 -3.463 6.067 53 1HD PRO 226 1HD PRO 226 -6.462 -5.229 4.441 54 2HD PRO 226 2HD PRO 226 -6.923 -3.538 4.636 55 H ASP 227 H ASP 227 -1.931 -3.741 2.104 56 HA ASP 227 HA ASP 227 -2.066 -6.575 1.093 57 1HB ASP 227 1HB ASP 227 -1.251 -4.960 -0.555 58 2HB ASP 227 2HB ASP 227 0.062 -4.507 0.519 59 HA PRO 228 HA PRO 228 -0.165 -6.813 5.211 60 1HB PRO 228 1HB PRO 228 -0.445 -9.449 5.742 61 2HB PRO 228 2HB PRO 228 -1.864 -8.346 5.689 62 1HG PRO 228 1HG PRO 228 -0.823 -10.164 3.494 63 2HG PRO 228 2HG PRO 228 -2.498 -10.012 4.087 64 1HD PRO 228 1HD PRO 228 -1.550 -8.682 1.873 65 2HD PRO 228 2HD PRO 228 -2.817 -7.982 2.893 66 H ASP 229 H ASP 229 0.919 -8.390 2.262 67 HA ASP 229 HA ASP 229 3.314 -9.494 3.576 68 1HB ASP 229 1HB ASP 229 1.870 -10.736 1.830 69 2HB ASP 229 2HB ASP 229 2.606 -9.668 0.640 70 H ALA 230 H ALA 230 2.277 -6.653 2.038 71 HA ALA 230 HA ALA 230 4.705 -5.803 0.762 72 1HB ALA 230 1HB ALA 230 2.437 -4.166 1.972 73 2HB ALA 230 2HB ALA 230 3.647 -3.602 0.797 74 3HB ALA 230 3HB ALA 230 2.467 -4.834 0.323 75 H LYS 231 H LYS 231 6.537 -5.108 1.661 76 HA LYS 231 HA LYS 231 6.453 -3.599 4.181 77 1HB LYS 231 1HB LYS 231 8.549 -4.485 4.908 78 2HB LYS 231 2HB LYS 231 7.437 -5.832 4.669 79 1HG LYS 231 1HG LYS 231 8.631 -6.684 2.855 80 2HG LYS 231 2HG LYS 231 9.340 -5.124 2.428 81 1HD LYS 231 1HD LYS 231 10.729 -5.116 4.437 82 2HD LYS 231 2HD LYS 231 10.039 -6.676 4.922 83 1HE LYS 231 1HE LYS 231 10.915 -7.710 2.855 84 2HE LYS 231 2HE LYS 231 11.604 -6.136 2.368 85 1HZ LYS 231 1HZ LYS 231 13.223 -7.613 3.501 86 2HZ LYS 231 2HZ LYS 231 12.974 -6.192 4.331 87 3HZ LYS 231 3HZ LYS 231 12.286 -7.589 4.848 88 H LYS 232 H LYS 232 8.161 -1.911 4.177 89 HA LYS 232 HA LYS 232 8.626 -0.434 2.052 90 1HB LYS 232 1HB LYS 232 10.492 -1.054 4.317 91 2HB LYS 232 2HB LYS 232 10.911 0.135 3.104 92 1HG LYS 232 1HG LYS 232 8.920 1.444 3.562 93 2HG LYS 232 2HG LYS 232 8.487 0.309 4.875 94 1HD LYS 232 1HD LYS 232 9.659 1.670 6.227 95 2HD LYS 232 2HD LYS 232 11.131 1.008 5.490 96 1HE LYS 232 1HE LYS 232 11.130 2.814 3.821 97 2HE LYS 232 2HE LYS 232 9.633 3.446 4.490 98 1HZ LYS 232 1HZ LYS 232 12.272 3.419 5.792 99 2HZ LYS 232 2HZ LYS 232 11.293 4.717 5.416 100 3HZ LYS 232 3HZ LYS 232 10.850 3.716 6.612 101 HA PRO 233 HA PRO 233 11.970 -2.263 -0.609 102 1HB PRO 233 1HB PRO 233 12.766 0.505 -1.124 103 2HB PRO 233 2HB PRO 233 12.138 -0.675 -2.290 104 1HG PRO 233 1HG PRO 233 10.750 1.586 -1.490 105 2HG PRO 233 2HG PRO 233 9.962 0.101 -2.061 106 1HD PRO 233 1HD PRO 233 10.371 1.056 0.783 107 2HD PRO 233 2HD PRO 233 8.979 0.210 0.032 108 H GLU 234 H GLU 234 14.175 -2.303 -0.359 109 HA GLU 234 HA GLU 234 15.412 -1.038 2.007 110 1HB GLU 234 1HB GLU 234 16.076 -2.987 -0.176 111 2HB GLU 234 2HB GLU 234 17.424 -2.083 0.605 112 1HG GLU 234 1HG GLU 234 16.327 -2.839 2.856 113 2HG GLU 234 2HG GLU 234 15.441 -4.013 1.882 114 H ASP 235 H ASP 235 15.083 -0.733 -1.512 115 HA ASP 235 HA ASP 235 16.943 1.498 -1.700 116 1HB ASP 235 1HB ASP 235 16.592 -0.501 -3.299 117 2HB ASP 235 2HB ASP 235 15.153 0.344 -3.855 118 H TRP 236 H TRP 236 14.703 1.915 -0.004 119 HA TRP 236 HA TRP 236 13.019 3.922 -1.270 120 1HB TRP 236 1HB TRP 236 12.131 2.231 0.443 121 2HB TRP 236 2HB TRP 236 13.179 2.942 1.653 122 HD1 TRP 236 HD TRP 236 11.960 4.679 3.054 123 HE1 TRP 236 1HE TRP 236 10.081 6.465 2.662 124 HE3 TRP 236 3HE TRP 236 11.016 3.691 -1.782 125 HZ2 TRP 236 2HZ TRP 236 8.197 7.101 0.554 126 HZ3 TRP 236 3HZ TRP 236 9.264 5.029 -3.056 127 HH2 TRP 236 HH TRP 236 7.820 6.647 -1.860 128 H ASP 237 H ASP 237 13.293 6.087 -0.729 129 HA ASP 237 HA ASP 237 15.904 6.782 0.551 130 1HB ASP 237 1HB ASP 237 14.499 8.009 -1.873 131 2HB ASP 237 2HB ASP 237 15.851 8.728 -0.993 132 H GLU 238 H GLU 238 14.705 6.998 2.599 133 HA GLU 238 HA GLU 238 12.446 8.707 2.903 134 1HB GLU 238 1HB GLU 238 13.412 7.093 4.574 135 2HB GLU 238 2HB GLU 238 14.684 8.242 4.923 136 1HG GLU 238 1HG GLU 238 11.675 8.744 5.255 137 2HG GLU 238 2HG GLU 238 12.746 8.157 6.534 138 H GLU 239 H GLU 239 15.828 9.508 2.358 139 HA GLU 239 HA GLU 239 15.639 12.172 3.309 140 1HB GLU 239 1HB GLU 239 17.702 10.692 2.969 141 2HB GLU 239 2HB GLU 239 17.560 11.001 1.229 142 1HG GLU 239 1HG GLU 239 17.940 13.403 1.614 143 2HG GLU 239 2HG GLU 239 17.788 13.138 3.365 144 H MET 240 H MET 240 14.749 10.577 0.324 145 HA MET 240 HA MET 240 14.369 13.122 -1.166 146 1HB MET 240 1HB MET 240 14.278 10.185 -1.929 147 2HB MET 240 2HB MET 240 13.605 11.406 -2.958 148 1HG MET 240 1HG MET 240 15.763 10.932 -3.770 149 2HG MET 240 2HG MET 240 15.813 12.547 -3.084 150 1HE MET 240 1HE MET 240 18.049 13.180 -2.241 151 2HE MET 240 2HE MET 240 17.090 13.114 -0.746 152 3HE MET 240 3HE MET 240 18.740 12.451 -0.775 153 H ASP 241 H ASP 241 12.547 10.112 -0.399 154 HA ASP 241 HA ASP 241 10.154 11.409 -1.398 155 1HB ASP 241 1HB ASP 241 11.110 8.866 -1.653 156 2HB ASP 241 2HB ASP 241 10.002 8.640 -0.308 157 H GLY 242 H GLY 242 10.995 9.722 1.663 158 1HA GLY 242 1HA GLY 242 10.368 10.825 3.768 159 2HA GLY 242 2HA GLY 242 8.816 11.256 3.048 160 H GLU 243 H GLU 243 7.318 10.108 4.299 161 HA GLU 243 HA GLU 243 7.822 7.427 5.220 162 1HB GLU 243 1HB GLU 243 5.824 9.546 5.651 163 2HB GLU 243 2HB GLU 243 5.072 7.981 5.353 164 1HG GLU 243 1HG GLU 243 6.593 6.965 7.076 165 2HG GLU 243 2HG GLU 243 7.215 8.582 7.414 166 H TRP 244 H TRP 244 7.713 5.738 4.011 167 HA TRP 244 HA TRP 244 6.476 5.494 1.424 168 1HB TRP 244 1HB TRP 244 8.353 4.069 2.330 169 2HB TRP 244 2HB TRP 244 7.253 3.427 3.527 170 HD1 TRP 244 HD TRP 244 7.415 3.609 -0.367 171 HE1 TRP 244 1HE TRP 244 6.570 1.375 -1.319 172 HE3 TRP 244 3HE TRP 244 6.402 1.184 4.030 173 HZ2 TRP 244 2HZ TRP 244 5.536 -1.110 -0.301 174 HZ3 TRP 244 3HZ TRP 244 5.779 -1.199 4.000 175 HH2 TRP 244 HH TRP 244 5.133 -2.303 1.853 176 H GLU 245 H GLU 245 4.670 3.801 1.126 177 HA GLU 245 HA GLU 245 3.107 3.177 3.428 178 1HB GLU 245 1HB GLU 245 0.995 4.014 2.759 179 2HB GLU 245 2HB GLU 245 2.120 5.365 2.648 180 1HG GLU 245 1HG GLU 245 2.339 4.638 0.115 181 2HG GLU 245 2HG GLU 245 0.838 3.754 0.440 182 HA PRO 246 HA PRO 246 3.021 -0.407 0.802 183 1HB PRO 246 1HB PRO 246 1.089 -1.954 2.053 184 2HB PRO 246 2HB PRO 246 2.730 -1.669 2.706 185 1HG PRO 246 1HG PRO 246 0.164 -0.245 3.437 186 2HG PRO 246 2HG PRO 246 1.457 -0.874 4.510 187 1HD PRO 246 1HD PRO 246 1.208 1.756 3.707 188 2HD PRO 246 2HD PRO 246 2.796 1.010 4.071 189 HA PRO 247 HA PRO 247 -0.341 -0.136 -2.198 190 1HB PRO 247 1HB PRO 247 -0.651 -3.065 -2.156 191 2HB PRO 247 2HB PRO 247 -0.188 -2.037 -3.537 192 1HG PRO 247 1HG PRO 247 1.630 -3.676 -2.308 193 2HG PRO 247 2HG PRO 247 2.085 -2.062 -2.943 194 1HD PRO 247 1HD PRO 247 1.437 -2.852 -0.110 195 2HD PRO 247 2HD PRO 247 2.770 -1.822 -0.734 196 H VAL 248 H VAL 248 -2.664 -1.260 -2.657 197 HA VAL 248 HA VAL 248 -3.774 -2.643 -0.364 198 HB VAL 248 HB VAL 248 -5.892 -1.541 -1.082 199 1HG1 VAL 248 1HG1 VAL 248 -3.706 0.111 0.221 200 2HG1 VAL 248 2HG1 VAL 248 -5.453 0.464 0.388 201 3HG1 VAL 248 3HG1 VAL 248 -4.763 -1.048 1.027 202 1HG2 VAL 248 1HG2 VAL 248 -5.095 -0.449 -3.196 203 2HG2 VAL 248 2HG2 VAL 248 -5.934 0.656 -2.102 204 3HG2 VAL 248 3HG2 VAL 248 -4.167 0.696 -2.214 205 H ILE 249 H ILE 249 -5.704 -3.885 -1.102 206 HA ILE 249 HA ILE 249 -5.357 -5.005 -3.785 207 HB ILE 249 HB ILE 249 -5.298 -7.171 -2.923 208 1HG1 ILE 249 1HG1 ILE 249 -5.908 -6.227 -0.096 209 2HG1 ILE 249 2HG1 ILE 249 -7.096 -6.951 -1.194 210 1HG2 ILE 249 1HG2 ILE 249 -3.662 -5.654 -0.835 211 2HG2 ILE 249 2HG2 ILE 249 -3.324 -7.266 -1.478 212 3HG2 ILE 249 3HG2 ILE 249 -3.163 -5.851 -2.535 213 1HD1 ILE 249 1HD1 ILE 249 -5.681 -9.023 -1.302 214 2HD1 ILE 249 2HD1 ILE 249 -4.676 -8.337 -0.002 215 3HD1 ILE 249 3HD1 ILE 249 -6.387 -8.669 0.282 216 H GLN 250 H GLN 250 -7.336 -5.759 -4.568 217 HA GLN 250 HA GLN 250 -9.780 -4.479 -3.570 218 1HB GLN 250 1HB GLN 250 -9.210 -6.497 -5.780 219 2HB GLN 250 2HB GLN 250 -10.850 -6.246 -5.185 220 1HG GLN 250 1HG GLN 250 -9.818 -3.623 -5.654 221 2HG GLN 250 2HG GLN 250 -9.271 -4.610 -7.006 222 1HE2 GLN 250 1HE2 GLN 250 -12.240 -3.999 -5.047 223 2HE2 GLN 250 2HE2 GLN 250 -13.359 -4.046 -6.389 224 H ASN 251 H ASN 251 -11.388 -5.424 -2.318 225 HA ASN 251 HA ASN 251 -10.738 -7.501 -0.501 226 1HB ASN 251 1HB ASN 251 -13.341 -6.207 -1.479 227 2HB ASN 251 2HB ASN 251 -13.260 -7.397 -0.199 228 1HD2 ASN 251 1HD2 ASN 251 -13.650 -6.436 1.791 229 2HD2 ASN 251 2HD2 ASN 251 -13.098 -4.789 2.084 230 HA PRO 252 HA PRO 252 -12.049 -10.882 -3.006 231 1HB PRO 252 1HB PRO 252 -13.296 -12.599 -1.230 232 2HB PRO 252 2HB PRO 252 -11.515 -12.396 -1.345 233 1HG PRO 252 1HG PRO 252 -13.418 -11.026 0.585 234 2HG PRO 252 2HG PRO 252 -11.857 -11.821 0.950 235 1HD PRO 252 1HD PRO 252 -12.021 -9.141 0.646 236 2HD PRO 252 2HD PRO 252 -10.617 -10.051 0.005 237 H GLU 253 H GLU 253 -14.267 -9.102 -1.122 238 HA GLU 253 HA GLU 253 -16.415 -9.303 -3.127 239 1HB GLU 253 1HB GLU 253 -16.518 -10.360 -0.306 240 2HB GLU 253 2HB GLU 253 -17.895 -9.395 -0.845 241 1HG GLU 253 1HG GLU 253 -18.206 -10.884 -2.795 242 2HG GLU 253 2HG GLU 253 -16.885 -11.921 -2.206 243 H TYR 254 H TYR 254 -15.578 -8.145 0.064 244 HA TYR 254 HA TYR 254 -16.154 -6.294 1.317 245 1HB TYR 254 1HB TYR 254 -15.068 -4.611 0.483 246 2HB TYR 254 2HB TYR 254 -15.417 -5.008 -1.173 247 HD1 TYR 254 1HD TYR 254 -17.112 -3.859 -2.387 248 HD2 TYR 254 2HD TYR 254 -16.517 -3.083 1.818 249 HE1 TYR 254 1HE TYR 254 -18.458 -1.826 -2.592 250 HE2 TYR 254 2HE TYR 254 -17.867 -1.025 1.638 251 HH TYR 254 HH TYR 254 -19.083 0.100 -1.552 252 H LYS 255 H LYS 255 -17.906 -5.237 2.080 253 HA LYS 255 HA LYS 255 -20.566 -5.803 0.890 254 1HB LYS 255 1HB LYS 255 -19.795 -7.650 2.449 255 2HB LYS 255 2HB LYS 255 -19.655 -6.458 3.731 256 1HG LYS 255 1HG LYS 255 -21.699 -7.549 4.110 257 2HG LYS 255 2HG LYS 255 -22.155 -5.980 3.435 258 1HD LYS 255 1HD LYS 255 -22.385 -7.125 1.170 259 2HD LYS 255 2HD LYS 255 -21.992 -8.647 1.971 260 1HE LYS 255 1HE LYS 255 -23.963 -7.897 3.618 261 2HE LYS 255 2HE LYS 255 -24.445 -6.928 2.214 262 1HZ LYS 255 1HZ LYS 255 -24.359 -9.052 0.931 263 2HZ LYS 255 2HZ LYS 255 -24.150 -9.863 2.342 264 3HZ LYS 255 3HZ LYS 255 -25.536 -8.985 2.045 265 H GLY 256 H GLY 256 -18.573 -4.090 3.273 266 1HA GLY 256 1HA GLY 256 -18.926 -1.988 4.308 267 2HA GLY 256 2HA GLY 256 -20.590 -1.961 3.666 Start of MODEL 16 1 H GLY 220 H GLY 220 -18.451 -3.396 9.747 2 1HA GLY 220 1HA GLY 220 -19.175 -4.766 7.828 3 2HA GLY 220 2HA GLY 220 -19.644 -3.250 7.032 4 H LYS 221 H LYS 221 -18.095 -4.189 5.367 5 HA LYS 221 HA LYS 221 -15.270 -4.314 6.173 6 1HB LYS 221 1HB LYS 221 -16.872 -4.977 3.679 7 2HB LYS 221 2HB LYS 221 -15.127 -4.949 3.607 8 1HG LYS 221 1HG LYS 221 -14.945 -6.641 5.211 9 2HG LYS 221 2HG LYS 221 -16.632 -6.519 5.714 10 1HD LYS 221 1HD LYS 221 -17.235 -7.203 3.339 11 2HD LYS 221 2HD LYS 221 -15.555 -7.721 3.131 12 1HE LYS 221 1HE LYS 221 -15.703 -9.309 4.952 13 2HE LYS 221 2HE LYS 221 -17.166 -8.542 5.574 14 1HZ LYS 221 1HZ LYS 221 -18.182 -9.275 3.379 15 2HZ LYS 221 2HZ LYS 221 -16.993 -10.474 3.414 16 3HZ LYS 221 3HZ LYS 221 -18.081 -10.280 4.626 17 HA PRO 222 HA PRO 222 -14.419 -0.207 4.440 18 1HB PRO 222 1HB PRO 222 -11.953 -0.955 3.151 19 2HB PRO 222 2HB PRO 222 -12.146 -0.129 4.698 20 1HG PRO 222 1HG PRO 222 -11.296 -2.848 4.249 21 2HG PRO 222 2HG PRO 222 -11.487 -1.990 5.810 22 1HD PRO 222 1HD PRO 222 -13.203 -4.001 4.564 23 2HD PRO 222 2HD PRO 222 -13.262 -3.347 6.221 24 H GLU 223 H GLU 223 -13.846 0.642 2.218 25 HA GLU 223 HA GLU 223 -14.807 -0.698 -0.105 26 1HB GLU 223 1HB GLU 223 -13.222 1.042 -1.171 27 2HB GLU 223 2HB GLU 223 -14.728 1.554 -0.434 28 1HG GLU 223 1HG GLU 223 -12.212 1.535 1.194 29 2HG GLU 223 2HG GLU 223 -12.464 2.853 0.017 30 H HIS 224 H HIS 224 -11.322 -0.128 0.911 31 HA HIS 224 HA HIS 224 -10.665 -2.488 -0.765 32 1HB HIS 224 1HB HIS 224 -8.945 -0.032 -0.381 33 2HB HIS 224 2HB HIS 224 -8.665 -1.387 -1.469 34 HD1 HIS 224 1HD HIS 224 -10.299 1.983 -1.425 35 HD2 HIS 224 2HD HIS 224 -10.733 -1.704 -3.435 36 HE1 HIS 224 1HE HIS 224 -11.848 2.398 -3.413 37 H ILE 225 H ILE 225 -8.618 -3.590 -0.186 38 HA ILE 225 HA ILE 225 -8.210 -3.639 2.754 39 HB ILE 225 HB ILE 225 -8.178 -5.816 0.671 40 1HG1 ILE 225 1HG1 ILE 225 -9.772 -5.080 3.142 41 2HG1 ILE 225 2HG1 ILE 225 -10.323 -5.536 1.534 42 1HG2 ILE 225 1HG2 ILE 225 -6.127 -6.033 2.089 43 2HG2 ILE 225 2HG2 ILE 225 -7.156 -6.133 3.524 44 3HG2 ILE 225 3HG2 ILE 225 -7.217 -7.368 2.239 45 1HD1 ILE 225 1HD1 ILE 225 -10.832 -7.315 3.105 46 2HD1 ILE 225 2HD1 ILE 225 -9.533 -7.901 2.045 47 3HD1 ILE 225 3HD1 ILE 225 -9.175 -7.298 3.703 48 HA PRO 226 HA PRO 226 -4.152 -2.184 1.443 49 1HB PRO 226 1HB PRO 226 -2.824 -2.235 3.786 50 2HB PRO 226 2HB PRO 226 -4.188 -1.121 3.488 51 1HG PRO 226 1HG PRO 226 -4.197 -3.634 5.101 52 2HG PRO 226 2HG PRO 226 -5.077 -2.113 5.395 53 1HD PRO 226 1HD PRO 226 -5.993 -4.479 4.134 54 2HD PRO 226 2HD PRO 226 -6.855 -2.931 4.153 55 H ASP 227 H ASP 227 -1.780 -2.947 1.657 56 HA ASP 227 HA ASP 227 -1.808 -5.898 1.195 57 1HB ASP 227 1HB ASP 227 -1.416 -4.371 -0.728 58 2HB ASP 227 2HB ASP 227 0.126 -3.927 0.020 59 HA PRO 228 HA PRO 228 1.100 -5.665 4.732 60 1HB PRO 228 1HB PRO 228 0.661 -8.095 5.812 61 2HB PRO 228 2HB PRO 228 -0.575 -6.818 5.908 62 1HG PRO 228 1HG PRO 228 -0.401 -9.095 3.924 63 2HG PRO 228 2HG PRO 228 -1.824 -8.574 4.884 64 1HD PRO 228 1HD PRO 228 -1.394 -7.766 2.257 65 2HD PRO 228 2HD PRO 228 -2.230 -6.764 3.466 66 H ASP 229 H ASP 229 0.984 -7.753 1.988 67 HA ASP 229 HA ASP 229 3.351 -9.334 2.795 68 1HB ASP 229 1HB ASP 229 1.289 -10.268 1.566 69 2HB ASP 229 2HB ASP 229 1.943 -9.486 0.114 70 H ALA 230 H ALA 230 2.406 -6.810 0.556 71 HA ALA 230 HA ALA 230 4.957 -6.154 -0.559 72 1HB ALA 230 1HB ALA 230 2.761 -5.091 -1.205 73 2HB ALA 230 2HB ALA 230 2.695 -4.336 0.397 74 3HB ALA 230 3HB ALA 230 3.988 -3.885 -0.740 75 H LYS 231 H LYS 231 6.710 -5.023 0.364 76 HA LYS 231 HA LYS 231 6.564 -4.093 3.141 77 1HB LYS 231 1HB LYS 231 7.504 -6.551 2.596 78 2HB LYS 231 2HB LYS 231 8.920 -5.670 2.046 79 1HG LYS 231 1HG LYS 231 7.668 -5.331 4.769 80 2HG LYS 231 2HG LYS 231 8.874 -6.571 4.389 81 1HD LYS 231 1HD LYS 231 10.315 -4.538 3.501 82 2HD LYS 231 2HD LYS 231 9.237 -3.581 4.529 83 1HE LYS 231 1HE LYS 231 10.975 -5.899 5.439 84 2HE LYS 231 2HE LYS 231 11.362 -4.192 5.626 85 1HZ LYS 231 1HZ LYS 231 9.048 -5.533 6.903 86 2HZ LYS 231 2HZ LYS 231 10.441 -5.068 7.628 87 3HZ LYS 231 3HZ LYS 231 9.442 -3.932 7.038 88 H LYS 232 H LYS 232 7.897 -2.226 3.366 89 HA LYS 232 HA LYS 232 8.384 -0.618 1.300 90 1HB LYS 232 1HB LYS 232 9.753 0.739 2.680 91 2HB LYS 232 2HB LYS 232 8.592 -0.044 3.739 92 1HG LYS 232 1HG LYS 232 10.365 -1.714 4.376 93 2HG LYS 232 2HG LYS 232 11.500 -0.869 3.335 94 1HD LYS 232 1HD LYS 232 10.442 1.144 4.996 95 2HD LYS 232 2HD LYS 232 10.637 -0.255 6.047 96 1HE LYS 232 1HE LYS 232 12.821 0.849 4.212 97 2HE LYS 232 2HE LYS 232 12.606 1.347 5.899 98 1HZ LYS 232 1HZ LYS 232 13.226 -1.386 4.998 99 2HZ LYS 232 2HZ LYS 232 14.238 -0.366 5.755 100 3HZ LYS 232 3HZ LYS 232 12.940 -0.915 6.585 101 HA PRO 233 HA PRO 233 12.068 -1.933 -0.996 102 1HB PRO 233 1HB PRO 233 12.926 0.796 -1.476 103 2HB PRO 233 2HB PRO 233 12.153 -0.334 -2.613 104 1HG PRO 233 1HG PRO 233 10.896 1.949 -1.696 105 2HG PRO 233 2HG PRO 233 10.071 0.495 -2.309 106 1HD PRO 233 1HD PRO 233 10.525 1.330 0.554 107 2HD PRO 233 2HD PRO 233 9.109 0.553 -0.219 108 H GLU 234 H GLU 234 14.300 -1.704 -1.058 109 HA GLU 234 HA GLU 234 15.696 -1.107 1.467 110 1HB GLU 234 1HB GLU 234 16.236 -2.273 -1.282 111 2HB GLU 234 2HB GLU 234 17.551 -1.982 -0.091 112 1HG GLU 234 1HG GLU 234 15.692 -3.409 1.392 113 2HG GLU 234 2HG GLU 234 15.429 -4.044 -0.212 114 H ASP 235 H ASP 235 15.385 -0.137 -1.905 115 HA ASP 235 HA ASP 235 17.200 2.145 -1.801 116 1HB ASP 235 1HB ASP 235 16.457 2.184 -4.306 117 2HB ASP 235 2HB ASP 235 17.505 0.904 -3.722 118 H TRP 236 H TRP 236 14.875 2.213 -0.107 119 HA TRP 236 HA TRP 236 13.219 4.361 -1.162 120 1HB TRP 236 1HB TRP 236 12.346 2.463 0.300 121 2HB TRP 236 2HB TRP 236 13.300 3.110 1.624 122 HD1 TRP 236 HD TRP 236 12.055 4.831 3.040 123 HE1 TRP 236 1HE TRP 236 10.036 6.485 2.690 124 HE3 TRP 236 3HE TRP 236 11.197 4.025 -1.861 125 HZ2 TRP 236 2HZ TRP 236 8.081 7.007 0.647 126 HZ3 TRP 236 3HZ TRP 236 9.319 5.201 -3.058 127 HH2 TRP 236 HH TRP 236 7.755 6.661 -1.786 128 H ASP 237 H ASP 237 14.166 6.372 -1.173 129 HA ASP 237 HA ASP 237 16.154 7.101 0.816 130 1HB ASP 237 1HB ASP 237 15.220 7.964 -1.895 131 2HB ASP 237 2HB ASP 237 15.555 9.272 -0.794 132 H GLU 238 H GLU 238 14.905 7.138 2.711 133 HA GLU 238 HA GLU 238 12.290 8.380 2.846 134 1HB GLU 238 1HB GLU 238 13.388 6.568 4.419 135 2HB GLU 238 2HB GLU 238 14.084 7.961 5.248 136 1HG GLU 238 1HG GLU 238 11.376 8.662 4.965 137 2HG GLU 238 2HG GLU 238 11.299 6.922 5.176 138 H GLU 239 H GLU 239 15.540 9.688 2.858 139 HA GLU 239 HA GLU 239 14.837 12.097 4.253 140 1HB GLU 239 1HB GLU 239 17.114 10.984 4.031 141 2HB GLU 239 2HB GLU 239 17.192 11.599 2.366 142 1HG GLU 239 1HG GLU 239 17.178 13.865 3.092 143 2HG GLU 239 2HG GLU 239 16.531 13.399 4.676 144 H MET 240 H MET 240 14.321 10.829 1.186 145 HA MET 240 HA MET 240 13.887 13.490 -0.117 146 1HB MET 240 1HB MET 240 14.266 10.745 -1.346 147 2HB MET 240 2HB MET 240 13.704 12.124 -2.217 148 1HG MET 240 1HG MET 240 15.796 13.354 -1.151 149 2HG MET 240 2HG MET 240 16.424 11.730 -0.971 150 1HE MET 240 1HE MET 240 17.200 10.574 -4.493 151 2HE MET 240 2HE MET 240 17.451 10.397 -2.750 152 3HE MET 240 3HE MET 240 15.848 10.074 -3.443 153 H ASP 241 H ASP 241 12.357 10.251 -0.024 154 HA ASP 241 HA ASP 241 9.961 11.520 -1.087 155 1HB ASP 241 1HB ASP 241 11.025 8.981 -1.400 156 2HB ASP 241 2HB ASP 241 9.683 8.688 -0.306 157 H GLY 242 H GLY 242 10.530 9.492 1.842 158 1HA GLY 242 1HA GLY 242 9.824 10.546 3.967 159 2HA GLY 242 2HA GLY 242 8.294 10.970 3.197 160 H GLU 243 H GLU 243 6.763 9.737 4.272 161 HA GLU 243 HA GLU 243 7.400 7.075 5.141 162 1HB GLU 243 1HB GLU 243 5.413 9.111 5.754 163 2HB GLU 243 2HB GLU 243 4.655 7.532 5.470 164 1HG GLU 243 1HG GLU 243 6.280 6.476 7.003 165 2HG GLU 243 2HG GLU 243 7.088 8.025 7.255 166 H TRP 244 H TRP 244 7.297 5.366 3.946 167 HA TRP 244 HA TRP 244 6.034 5.272 1.313 168 1HB TRP 244 1HB TRP 244 8.071 3.961 1.853 169 2HB TRP 244 2HB TRP 244 7.179 3.101 3.105 170 HD1 TRP 244 HD TRP 244 7.071 3.588 -0.746 171 HE1 TRP 244 1HE TRP 244 6.299 1.401 -1.834 172 HE3 TRP 244 3HE TRP 244 6.201 0.869 3.486 173 HZ2 TRP 244 2HZ TRP 244 5.309 -1.200 -0.942 174 HZ3 TRP 244 3HZ TRP 244 5.516 -1.509 3.336 175 HH2 TRP 244 HH TRP 244 4.937 -2.504 1.135 176 H GLU 245 H GLU 245 4.050 4.146 0.924 177 HA GLU 245 HA GLU 245 2.694 2.997 3.253 178 1HB GLU 245 1HB GLU 245 1.358 4.872 1.280 179 2HB GLU 245 2HB GLU 245 0.490 3.733 2.328 180 1HG GLU 245 1HG GLU 245 1.692 4.800 4.297 181 2HG GLU 245 2HG GLU 245 2.224 6.084 3.191 182 HA PRO 246 HA PRO 246 2.819 -0.290 0.317 183 1HB PRO 246 1HB PRO 246 0.560 -1.696 1.510 184 2HB PRO 246 2HB PRO 246 2.287 -2.100 1.591 185 1HG PRO 246 1HG PRO 246 0.723 -1.095 3.735 186 2HG PRO 246 2HG PRO 246 2.509 -1.183 3.657 187 1HD PRO 246 1HD PRO 246 0.785 1.196 3.367 188 2HD PRO 246 2HD PRO 246 2.524 1.037 3.751 189 HA PRO 247 HA PRO 247 -0.648 0.133 -2.524 190 1HB PRO 247 1HB PRO 247 -0.852 -2.371 -3.626 191 2HB PRO 247 2HB PRO 247 0.352 -1.169 -4.094 192 1HG PRO 247 1HG PRO 247 0.660 -3.578 -2.315 193 2HG PRO 247 2HG PRO 247 1.869 -2.866 -3.416 194 1HD PRO 247 1HD PRO 247 1.770 -2.498 -0.653 195 2HD PRO 247 2HD PRO 247 2.606 -1.403 -1.771 196 H VAL 248 H VAL 248 -2.694 -1.404 -3.219 197 HA VAL 248 HA VAL 248 -3.945 -2.539 -0.823 198 HB VAL 248 HB VAL 248 -5.984 -1.471 -1.751 199 1HG1 VAL 248 1HG1 VAL 248 -3.759 0.327 -0.737 200 2HG1 VAL 248 2HG1 VAL 248 -5.483 0.788 -0.719 201 3HG1 VAL 248 3HG1 VAL 248 -4.919 -0.576 0.256 202 1HG2 VAL 248 1HG2 VAL 248 -5.947 0.465 -3.159 203 2HG2 VAL 248 2HG2 VAL 248 -4.176 0.483 -3.208 204 3HG2 VAL 248 3HG2 VAL 248 -5.084 -0.819 -4.012 205 H ILE 249 H ILE 249 -5.929 -3.771 -1.488 206 HA ILE 249 HA ILE 249 -5.659 -5.189 -4.025 207 HB ILE 249 HB ILE 249 -5.501 -7.265 -3.068 208 1HG1 ILE 249 1HG1 ILE 249 -6.080 -6.366 -0.233 209 2HG1 ILE 249 2HG1 ILE 249 -7.367 -6.889 -1.319 210 1HG2 ILE 249 1HG2 ILE 249 -3.390 -5.966 -2.654 211 2HG2 ILE 249 2HG2 ILE 249 -3.933 -5.630 -0.998 212 3HG2 ILE 249 3HG2 ILE 249 -3.586 -7.290 -1.510 213 1HD1 ILE 249 1HD1 ILE 249 -5.042 -8.640 -0.499 214 2HD1 ILE 249 2HD1 ILE 249 -6.718 -8.741 0.061 215 3HD1 ILE 249 3HD1 ILE 249 -6.328 -9.068 -1.641 216 H GLN 250 H GLN 250 -7.678 -5.919 -4.719 217 HA GLN 250 HA GLN 250 -10.012 -4.578 -3.700 218 1HB GLN 250 1HB GLN 250 -11.211 -5.564 -5.412 219 2HB GLN 250 2HB GLN 250 -9.608 -5.388 -6.067 220 1HG GLN 250 1HG GLN 250 -9.995 -7.454 -6.840 221 2HG GLN 250 2HG GLN 250 -9.326 -7.935 -5.293 222 1HE2 GLN 250 1HE2 GLN 250 -12.696 -6.673 -6.112 223 2HE2 GLN 250 2HE2 GLN 250 -13.455 -8.224 -5.798 224 H ASN 251 H ASN 251 -11.442 -5.165 -2.188 225 HA ASN 251 HA ASN 251 -10.787 -7.255 -0.311 226 1HB ASN 251 1HB ASN 251 -12.089 -5.162 0.179 227 2HB ASN 251 2HB ASN 251 -13.414 -5.822 -0.759 228 1HD2 ASN 251 1HD2 ASN 251 -12.653 -5.354 2.408 229 2HD2 ASN 251 2HD2 ASN 251 -13.258 -6.902 3.079 230 HA PRO 252 HA PRO 252 -12.571 -10.460 -2.913 231 1HB PRO 252 1HB PRO 252 -12.885 -12.491 -1.059 232 2HB PRO 252 2HB PRO 252 -11.322 -11.999 -1.772 233 1HG PRO 252 1HG PRO 252 -12.502 -11.123 0.885 234 2HG PRO 252 2HG PRO 252 -10.846 -11.731 0.557 235 1HD PRO 252 1HD PRO 252 -11.345 -9.107 0.728 236 2HD PRO 252 2HD PRO 252 -10.221 -9.730 -0.512 237 H GLU 253 H GLU 253 -14.266 -8.923 -0.323 238 HA GLU 253 HA GLU 253 -16.928 -9.800 -1.265 239 1HB GLU 253 1HB GLU 253 -15.864 -9.869 1.588 240 2HB GLU 253 2HB GLU 253 -17.533 -10.159 1.101 241 1HG GLU 253 1HG GLU 253 -16.646 -12.117 -0.285 242 2HG GLU 253 2HG GLU 253 -15.173 -11.967 0.718 243 H TYR 254 H TYR 254 -15.445 -7.063 -1.443 244 HA TYR 254 HA TYR 254 -16.036 -5.425 0.739 245 1HB TYR 254 1HB TYR 254 -14.793 -4.123 -0.521 246 2HB TYR 254 2HB TYR 254 -15.219 -4.944 -2.011 247 HD1 TYR 254 1HD TYR 254 -16.477 -3.842 -3.615 248 HD2 TYR 254 2HD TYR 254 -16.388 -2.234 0.382 249 HE1 TYR 254 1HE TYR 254 -17.831 -1.905 -4.371 250 HE2 TYR 254 2HE TYR 254 -17.791 -0.356 -0.326 251 HH TYR 254 HH TYR 254 -18.714 0.743 -2.143 252 H LYS 255 H LYS 255 -17.776 -4.550 1.666 253 HA LYS 255 HA LYS 255 -20.122 -3.788 0.246 254 1HB LYS 255 1HB LYS 255 -20.017 -6.331 1.447 255 2HB LYS 255 2HB LYS 255 -20.635 -5.335 2.750 256 1HG LYS 255 1HG LYS 255 -22.473 -6.080 1.695 257 2HG LYS 255 2HG LYS 255 -22.356 -4.455 0.982 258 1HD LYS 255 1HD LYS 255 -21.321 -5.384 -1.025 259 2HD LYS 255 2HD LYS 255 -21.206 -6.966 -0.256 260 1HE LYS 255 1HE LYS 255 -23.647 -7.176 -0.195 261 2HE LYS 255 2HE LYS 255 -23.809 -5.658 -1.088 262 1HZ LYS 255 1HZ LYS 255 -23.668 -7.961 -2.355 263 2HZ LYS 255 2HZ LYS 255 -22.949 -6.630 -2.979 264 3HZ LYS 255 3HZ LYS 255 -22.058 -7.743 -2.180 265 H GLY 256 H GLY 256 -20.398 -1.772 1.060 266 1HA GLY 256 1HA GLY 256 -20.343 -1.240 3.901 267 2HA GLY 256 2HA GLY 256 -19.250 -0.245 2.906 Start of MODEL 17 1 H GLY 220 H GLY 220 -19.688 -3.387 8.703 2 1HA GLY 220 1HA GLY 220 -19.684 -4.043 6.399 3 2HA GLY 220 2HA GLY 220 -19.699 -2.318 5.947 4 H LYS 221 H LYS 221 -17.750 -4.412 5.205 5 HA LYS 221 HA LYS 221 -15.251 -3.470 6.484 6 1HB LYS 221 1HB LYS 221 -15.504 -5.149 3.965 7 2HB LYS 221 2HB LYS 221 -14.121 -4.987 5.021 8 1HG LYS 221 1HG LYS 221 -15.618 -5.966 6.893 9 2HG LYS 221 2HG LYS 221 -16.590 -6.562 5.527 10 1HD LYS 221 1HD LYS 221 -14.613 -7.739 4.635 11 2HD LYS 221 2HD LYS 221 -13.621 -7.048 5.919 12 1HE LYS 221 1HE LYS 221 -14.074 -9.250 6.626 13 2HE LYS 221 2HE LYS 221 -15.039 -8.170 7.623 14 1HZ LYS 221 1HZ LYS 221 -15.895 -10.170 5.751 15 2HZ LYS 221 2HZ LYS 221 -16.610 -9.629 7.116 16 3HZ LYS 221 3HZ LYS 221 -16.802 -8.781 5.710 17 HA PRO 222 HA PRO 222 -14.738 -0.158 3.510 18 1HB PRO 222 1HB PRO 222 -11.994 -0.363 2.906 19 2HB PRO 222 2HB PRO 222 -12.720 0.528 4.244 20 1HG PRO 222 1HG PRO 222 -11.244 -2.004 4.254 21 2HG PRO 222 2HG PRO 222 -11.670 -0.993 5.657 22 1HD PRO 222 1HD PRO 222 -12.854 -3.426 4.607 23 2HD PRO 222 2HD PRO 222 -13.277 -2.614 6.133 24 H GLU 223 H GLU 223 -13.473 0.224 1.226 25 HA GLU 223 HA GLU 223 -14.770 -1.683 -0.491 26 1HB GLU 223 1HB GLU 223 -13.968 -0.075 -2.202 27 2HB GLU 223 2HB GLU 223 -14.988 0.630 -0.969 28 1HG GLU 223 1HG GLU 223 -12.000 0.767 -0.700 29 2HG GLU 223 2HG GLU 223 -12.820 1.886 -1.801 30 H HIS 224 H HIS 224 -11.477 -1.017 0.598 31 HA HIS 224 HA HIS 224 -10.425 -3.190 -1.107 32 1HB HIS 224 1HB HIS 224 -8.952 -0.621 -0.445 33 2HB HIS 224 2HB HIS 224 -8.402 -1.927 -1.496 34 HD1 HIS 224 1HD HIS 224 -8.970 1.310 -2.232 35 HD2 HIS 224 2HD HIS 224 -11.110 -2.142 -3.305 36 HE1 HIS 224 1HE HIS 224 -10.416 1.958 -4.217 37 H ILE 225 H ILE 225 -8.236 -3.888 -0.174 38 HA ILE 225 HA ILE 225 -8.054 -3.688 2.758 39 HB ILE 225 HB ILE 225 -8.162 -6.138 1.053 40 1HG1 ILE 225 1HG1 ILE 225 -9.570 -4.979 3.479 41 2HG1 ILE 225 2HG1 ILE 225 -10.247 -5.445 1.910 42 1HG2 ILE 225 1HG2 ILE 225 -7.253 -7.506 2.802 43 2HG2 ILE 225 2HG2 ILE 225 -6.066 -6.279 2.468 44 3HG2 ILE 225 3HG2 ILE 225 -7.110 -6.135 3.897 45 1HD1 ILE 225 1HD1 ILE 225 -10.917 -7.050 3.503 46 2HD1 ILE 225 2HD1 ILE 225 -9.663 -7.826 2.485 47 3HD1 ILE 225 3HD1 ILE 225 -9.245 -7.201 4.128 48 HA PRO 226 HA PRO 226 -4.076 -2.384 1.198 49 1HB PRO 226 1HB PRO 226 -2.466 -2.571 3.342 50 2HB PRO 226 2HB PRO 226 -3.734 -1.323 3.191 51 1HG PRO 226 1HG PRO 226 -3.762 -3.776 4.885 52 2HG PRO 226 2HG PRO 226 -4.578 -2.215 5.155 53 1HD PRO 226 1HD PRO 226 -5.680 -4.604 4.098 54 2HD PRO 226 2HD PRO 226 -6.501 -3.031 4.175 55 H ASP 227 H ASP 227 -1.758 -3.225 1.056 56 HA ASP 227 HA ASP 227 -1.801 -6.208 0.788 57 1HB ASP 227 1HB ASP 227 -1.254 -4.957 -1.252 58 2HB ASP 227 2HB ASP 227 0.116 -4.217 -0.425 59 HA PRO 228 HA PRO 228 0.470 -5.401 4.659 60 1HB PRO 228 1HB PRO 228 0.068 -7.791 5.900 61 2HB PRO 228 2HB PRO 228 -1.251 -6.598 5.712 62 1HG PRO 228 1HG PRO 228 -0.677 -8.994 3.949 63 2HG PRO 228 2HG PRO 228 -2.226 -8.519 4.686 64 1HD PRO 228 1HD PRO 228 -1.555 -7.856 2.133 65 2HD PRO 228 2HD PRO 228 -2.541 -6.780 3.111 66 H ASP 229 H ASP 229 0.840 -8.145 2.439 67 HA ASP 229 HA ASP 229 3.337 -9.057 3.630 68 1HB ASP 229 1HB ASP 229 1.454 -10.186 1.894 69 2HB ASP 229 2HB ASP 229 2.862 -9.942 0.865 70 H ALA 230 H ALA 230 2.340 -6.854 1.060 71 HA ALA 230 HA ALA 230 4.867 -6.396 -0.138 72 1HB ALA 230 1HB ALA 230 2.510 -4.523 0.305 73 2HB ALA 230 2HB ALA 230 3.936 -4.119 -0.663 74 3HB ALA 230 3HB ALA 230 2.909 -5.452 -1.166 75 H LYS 231 H LYS 231 6.643 -5.457 0.598 76 HA LYS 231 HA LYS 231 6.567 -4.185 3.292 77 1HB LYS 231 1HB LYS 231 8.896 -4.905 3.574 78 2HB LYS 231 2HB LYS 231 7.783 -6.269 3.454 79 1HG LYS 231 1HG LYS 231 8.459 -6.719 1.174 80 2HG LYS 231 2HG LYS 231 9.452 -5.263 1.094 81 1HD LYS 231 1HD LYS 231 9.927 -7.483 3.097 82 2HD LYS 231 2HD LYS 231 10.671 -7.468 1.503 83 1HE LYS 231 1HE LYS 231 11.000 -5.213 3.526 84 2HE LYS 231 2HE LYS 231 12.103 -6.579 3.392 85 1HZ LYS 231 1HZ LYS 231 12.601 -5.940 1.146 86 2HZ LYS 231 2HZ LYS 231 11.532 -4.718 1.157 87 3HZ LYS 231 3HZ LYS 231 12.823 -4.625 2.155 88 H LYS 232 H LYS 232 7.547 -2.230 3.536 89 HA LYS 232 HA LYS 232 8.081 -0.578 1.519 90 1HB LYS 232 1HB LYS 232 9.467 0.757 3.062 91 2HB LYS 232 2HB LYS 232 8.033 0.124 3.856 92 1HG LYS 232 1HG LYS 232 9.426 -1.657 4.903 93 2HG LYS 232 2HG LYS 232 10.818 -1.066 3.957 94 1HD LYS 232 1HD LYS 232 10.881 -0.322 6.307 95 2HD LYS 232 2HD LYS 232 10.935 0.954 5.112 96 1HE LYS 232 1HE LYS 232 9.561 1.674 6.913 97 2HE LYS 232 2HE LYS 232 8.561 1.485 5.486 98 1HZ LYS 232 1HZ LYS 232 8.645 -0.642 7.545 99 2HZ LYS 232 2HZ LYS 232 7.501 0.551 7.494 100 3HZ LYS 232 3HZ LYS 232 7.626 -0.482 6.280 101 HA PRO 233 HA PRO 233 11.599 -1.771 -0.798 102 1HB PRO 233 1HB PRO 233 12.601 1.010 -0.919 103 2HB PRO 233 2HB PRO 233 12.031 -0.029 -2.235 104 1HG PRO 233 1HG PRO 233 10.535 2.086 -1.293 105 2HG PRO 233 2HG PRO 233 9.794 0.607 -1.921 106 1HD PRO 233 1HD PRO 233 10.238 1.376 0.993 107 2HD PRO 233 2HD PRO 233 8.827 0.663 0.158 108 H GLU 234 H GLU 234 13.783 -2.277 -0.529 109 HA GLU 234 HA GLU 234 15.003 -1.756 2.078 110 1HB GLU 234 1HB GLU 234 15.131 -3.779 0.105 111 2HB GLU 234 2HB GLU 234 16.678 -2.936 -0.037 112 1HG GLU 234 1HG GLU 234 16.882 -3.168 2.510 113 2HG GLU 234 2HG GLU 234 15.464 -4.243 2.433 114 H ASP 235 H ASP 235 14.876 -0.357 -1.055 115 HA ASP 235 HA ASP 235 17.363 1.212 -0.788 116 1HB ASP 235 1HB ASP 235 16.320 -0.206 -2.835 117 2HB ASP 235 2HB ASP 235 15.553 1.340 -3.173 118 H TRP 236 H TRP 236 14.501 1.583 0.563 119 HA TRP 236 HA TRP 236 13.321 3.905 -0.512 120 1HB TRP 236 1HB TRP 236 12.187 2.253 0.969 121 2HB TRP 236 2HB TRP 236 13.120 2.829 2.338 122 HD1 TRP 236 HD TRP 236 11.850 4.642 3.722 123 HE1 TRP 236 1HE TRP 236 10.089 6.468 3.209 124 HE3 TRP 236 3HE TRP 236 11.293 3.995 -1.326 125 HZ2 TRP 236 2HZ TRP 236 8.418 7.270 1.035 126 HZ3 TRP 236 3HZ TRP 236 9.538 5.213 -2.572 127 HH2 TRP 236 HH TRP 236 8.079 6.851 -1.368 128 H ASP 237 H ASP 237 13.236 6.022 0.231 129 HA ASP 237 HA ASP 237 15.635 6.934 1.733 130 1HB ASP 237 1HB ASP 237 15.543 7.312 -0.937 131 2HB ASP 237 2HB ASP 237 14.334 8.398 -0.517 132 H GLU 238 H GLU 238 14.693 7.523 3.667 133 HA GLU 238 HA GLU 238 12.051 8.793 3.689 134 1HB GLU 238 1HB GLU 238 14.042 8.093 5.876 135 2HB GLU 238 2HB GLU 238 12.482 8.879 6.152 136 1HG GLU 238 1HG GLU 238 11.393 6.952 4.888 137 2HG GLU 238 2HG GLU 238 12.953 6.128 4.976 138 H GLU 239 H GLU 239 15.120 10.003 2.940 139 HA GLU 239 HA GLU 239 14.666 12.675 4.081 140 1HB GLU 239 1HB GLU 239 16.947 11.202 3.800 141 2HB GLU 239 2HB GLU 239 16.937 12.001 2.225 142 1HG GLU 239 1HG GLU 239 16.728 14.201 3.386 143 2HG GLU 239 2HG GLU 239 16.771 13.348 4.940 144 H MET 240 H MET 240 14.879 10.854 1.051 145 HA MET 240 HA MET 240 14.232 13.145 -0.642 146 1HB MET 240 1HB MET 240 14.656 10.183 -1.252 147 2HB MET 240 2HB MET 240 14.178 11.369 -2.437 148 1HG MET 240 1HG MET 240 16.576 11.838 -0.594 149 2HG MET 240 2HG MET 240 16.732 10.777 -1.975 150 1HE MET 240 1HE MET 240 16.626 12.762 -5.058 151 2HE MET 240 2HE MET 240 17.243 11.324 -4.226 152 3HE MET 240 3HE MET 240 15.498 11.606 -4.330 153 H ASP 241 H ASP 241 12.569 9.989 -0.032 154 HA ASP 241 HA ASP 241 10.258 11.154 -1.418 155 1HB ASP 241 1HB ASP 241 11.619 8.746 -1.717 156 2HB ASP 241 2HB ASP 241 10.238 8.285 -0.808 157 H GLY 242 H GLY 242 11.097 10.138 1.797 158 1HA GLY 242 1HA GLY 242 9.918 10.890 3.688 159 2HA GLY 242 2HA GLY 242 8.510 11.195 2.688 160 H GLU 243 H GLU 243 6.898 10.100 3.824 161 HA GLU 243 HA GLU 243 7.271 7.546 5.089 162 1HB GLU 243 1HB GLU 243 5.226 9.632 4.815 163 2HB GLU 243 2HB GLU 243 4.506 8.063 4.638 164 1HG GLU 243 1HG GLU 243 5.302 7.314 6.764 165 2HG GLU 243 2HG GLU 243 6.311 8.764 6.962 166 H TRP 244 H TRP 244 7.094 5.503 4.136 167 HA TRP 244 HA TRP 244 5.984 5.284 1.407 168 1HB TRP 244 1HB TRP 244 8.040 4.029 2.109 169 2HB TRP 244 2HB TRP 244 7.031 3.093 3.211 170 HD1 TRP 244 HD TRP 244 7.275 3.919 -0.561 171 HE1 TRP 244 1HE TRP 244 6.451 1.909 -1.918 172 HE3 TRP 244 3HE TRP 244 5.870 0.873 3.283 173 HZ2 TRP 244 2HZ TRP 244 5.598 -0.811 -1.391 174 HZ3 TRP 244 3HZ TRP 244 5.278 -1.483 2.850 175 HH2 TRP 244 HH TRP 244 5.086 -2.331 0.509 176 H GLU 245 H GLU 245 3.979 4.246 1.036 177 HA GLU 245 HA GLU 245 2.724 2.806 3.242 178 1HB GLU 245 1HB GLU 245 1.254 4.437 3.469 179 2HB GLU 245 2HB GLU 245 1.467 5.112 1.852 180 1HG GLU 245 1HG GLU 245 -0.188 3.792 0.916 181 2HG GLU 245 2HG GLU 245 0.033 2.477 2.054 182 HA PRO 246 HA PRO 246 2.916 -0.208 0.025 183 1HB PRO 246 1HB PRO 246 1.139 -2.113 1.080 184 2HB PRO 246 2HB PRO 246 2.836 -1.906 1.546 185 1HG PRO 246 1HG PRO 246 0.326 -0.945 2.889 186 2HG PRO 246 2HG PRO 246 1.832 -1.534 3.647 187 1HD PRO 246 1HD PRO 246 1.140 1.130 3.411 188 2HD PRO 246 2HD PRO 246 2.829 0.583 3.498 189 HA PRO 247 HA PRO 247 -0.731 0.033 -2.556 190 1HB PRO 247 1HB PRO 247 -0.845 -2.499 -3.718 191 2HB PRO 247 2HB PRO 247 0.207 -1.174 -4.225 192 1HG PRO 247 1HG PRO 247 0.859 -3.609 -2.612 193 2HG PRO 247 2HG PRO 247 1.913 -2.694 -3.726 194 1HD PRO 247 1HD PRO 247 1.903 -2.551 -0.925 195 2HD PRO 247 2HD PRO 247 2.656 -1.339 -1.984 196 H VAL 248 H VAL 248 -2.774 -1.548 -3.194 197 HA VAL 248 HA VAL 248 -3.890 -2.790 -0.799 198 HB VAL 248 HB VAL 248 -5.956 -1.752 -1.512 199 1HG1 VAL 248 1HG1 VAL 248 -3.825 0.395 -1.100 200 2HG1 VAL 248 2HG1 VAL 248 -5.572 0.579 -0.781 201 3HG1 VAL 248 3HG1 VAL 248 -4.599 -0.547 0.181 202 1HG2 VAL 248 1HG2 VAL 248 -6.168 0.040 -3.126 203 2HG2 VAL 248 2HG2 VAL 248 -4.444 -0.077 -3.544 204 3HG2 VAL 248 3HG2 VAL 248 -5.571 -1.410 -3.913 205 H ILE 249 H ILE 249 -5.868 -3.977 -1.474 206 HA ILE 249 HA ILE 249 -5.490 -5.578 -3.896 207 HB ILE 249 HB ILE 249 -5.405 -7.586 -2.630 208 1HG1 ILE 249 1HG1 ILE 249 -5.185 -7.048 0.105 209 2HG1 ILE 249 2HG1 ILE 249 -6.464 -5.990 -0.359 210 1HG2 ILE 249 1HG2 ILE 249 -3.225 -6.340 -2.697 211 2HG2 ILE 249 2HG2 ILE 249 -3.593 -5.690 -1.068 212 3HG2 ILE 249 3HG2 ILE 249 -3.372 -7.414 -1.285 213 1HD1 ILE 249 1HD1 ILE 249 -7.763 -7.850 -1.300 214 2HD1 ILE 249 2HD1 ILE 249 -6.427 -8.972 -0.959 215 3HD1 ILE 249 3HD1 ILE 249 -7.306 -8.207 0.379 216 H GLN 250 H GLN 250 -7.478 -6.036 -4.805 217 HA GLN 250 HA GLN 250 -9.839 -4.717 -3.928 218 1HB GLN 250 1HB GLN 250 -9.142 -6.691 -6.046 219 2HB GLN 250 2HB GLN 250 -10.777 -6.888 -5.443 220 1HG GLN 250 1HG GLN 250 -9.604 -4.277 -6.464 221 2HG GLN 250 2HG GLN 250 -10.687 -5.340 -7.361 222 1HE2 GLN 250 1HE2 GLN 250 -11.022 -2.462 -6.387 223 2HE2 GLN 250 2HE2 GLN 250 -12.543 -2.511 -5.493 224 H ASN 251 H ASN 251 -11.268 -5.158 -2.391 225 HA ASN 251 HA ASN 251 -10.543 -7.022 -0.381 226 1HB ASN 251 1HB ASN 251 -11.539 -4.868 0.106 227 2HB ASN 251 2HB ASN 251 -13.007 -5.319 -0.757 228 1HD2 ASN 251 1HD2 ASN 251 -13.475 -4.404 1.758 229 2HD2 ASN 251 2HD2 ASN 251 -13.654 -5.735 2.884 230 HA PRO 252 HA PRO 252 -12.799 -10.494 -2.315 231 1HB PRO 252 1HB PRO 252 -12.452 -12.351 -0.305 232 2HB PRO 252 2HB PRO 252 -11.182 -11.928 -1.461 233 1HG PRO 252 1HG PRO 252 -11.561 -10.870 1.340 234 2HG PRO 252 2HG PRO 252 -10.063 -11.445 0.561 235 1HD PRO 252 1HD PRO 252 -10.689 -8.813 0.734 236 2HD PRO 252 2HD PRO 252 -9.844 -9.458 -0.691 237 H GLU 253 H GLU 253 -13.585 -8.836 0.608 238 HA GLU 253 HA GLU 253 -16.231 -10.158 0.856 239 1HB GLU 253 1HB GLU 253 -14.345 -9.038 2.937 240 2HB GLU 253 2HB GLU 253 -15.963 -9.630 3.266 241 1HG GLU 253 1HG GLU 253 -15.246 -11.880 2.400 242 2HG GLU 253 2HG GLU 253 -13.585 -11.261 2.330 243 H TYR 254 H TYR 254 -15.162 -7.528 -0.594 244 HA TYR 254 HA TYR 254 -17.179 -5.691 0.598 245 1HB TYR 254 1HB TYR 254 -15.008 -4.721 -0.110 246 2HB TYR 254 2HB TYR 254 -15.298 -5.276 -1.760 247 HD1 TYR 254 1HD TYR 254 -17.416 -3.563 0.853 248 HD2 TYR 254 2HD TYR 254 -15.544 -3.238 -3.019 249 HE1 TYR 254 1HE TYR 254 -18.556 -1.436 0.508 250 HE2 TYR 254 2HE TYR 254 -16.610 -1.024 -3.322 251 HH TYR 254 HH TYR 254 -18.848 0.368 -0.856 252 H LYS 255 H LYS 255 -18.901 -4.948 -0.996 253 HA LYS 255 HA LYS 255 -19.271 -6.737 -3.327 254 1HB LYS 255 1HB LYS 255 -20.756 -7.109 -1.097 255 2HB LYS 255 2HB LYS 255 -21.717 -5.832 -1.831 256 1HG LYS 255 1HG LYS 255 -20.895 -8.387 -3.283 257 2HG LYS 255 2HG LYS 255 -22.362 -8.211 -2.306 258 1HD LYS 255 1HD LYS 255 -23.216 -6.462 -3.772 259 2HD LYS 255 2HD LYS 255 -21.711 -6.482 -4.709 260 1HE LYS 255 1HE LYS 255 -22.148 -8.789 -5.425 261 2HE LYS 255 2HE LYS 255 -23.648 -8.819 -4.495 262 1HZ LYS 255 1HZ LYS 255 -23.073 -6.988 -6.735 263 2HZ LYS 255 2HZ LYS 255 -23.991 -8.337 -6.847 264 3HZ LYS 255 3HZ LYS 255 -24.521 -7.089 -5.931 265 H GLY 256 H GLY 256 -20.236 -3.660 -1.710 266 1HA GLY 256 1HA GLY 256 -20.441 -1.535 -2.727 267 2HA GLY 256 2HA GLY 256 -20.418 -2.275 -4.348 Start of MODEL 18 1 H GLY 220 H GLY 220 -17.926 -1.843 8.562 2 1HA GLY 220 1HA GLY 220 -15.530 -3.278 9.541 3 2HA GLY 220 2HA GLY 220 -16.948 -4.110 8.878 4 H LYS 221 H LYS 221 -15.097 -4.901 7.571 5 HA LYS 221 HA LYS 221 -13.394 -4.270 6.049 6 1HB LYS 221 1HB LYS 221 -13.954 -5.767 4.294 7 2HB LYS 221 2HB LYS 221 -14.358 -6.381 5.898 8 1HG LYS 221 1HG LYS 221 -16.798 -5.554 5.338 9 2HG LYS 221 2HG LYS 221 -16.161 -5.551 3.696 10 1HD LYS 221 1HD LYS 221 -17.230 -7.632 3.970 11 2HD LYS 221 2HD LYS 221 -15.494 -7.967 4.021 12 1HE LYS 221 1HE LYS 221 -15.498 -8.236 6.403 13 2HE LYS 221 2HE LYS 221 -17.140 -7.576 6.528 14 1HZ LYS 221 1HZ LYS 221 -17.937 -9.494 5.284 15 2HZ LYS 221 2HZ LYS 221 -16.443 -10.142 5.236 16 3HZ LYS 221 3HZ LYS 221 -17.228 -9.939 6.677 17 HA PRO 222 HA PRO 222 -14.428 -0.709 3.490 18 1HB PRO 222 1HB PRO 222 -11.843 -0.065 2.713 19 2HB PRO 222 2HB PRO 222 -12.545 0.283 4.296 20 1HG PRO 222 1HG PRO 222 -10.688 -1.952 3.461 21 2HG PRO 222 2HG PRO 222 -10.697 -1.052 5.002 22 1HD PRO 222 1HD PRO 222 -11.808 -3.577 4.533 23 2HD PRO 222 2HD PRO 222 -12.205 -2.532 5.915 24 H GLU 223 H GLU 223 -13.619 0.107 1.354 25 HA GLU 223 HA GLU 223 -14.452 -1.603 -0.730 26 1HB GLU 223 1HB GLU 223 -13.760 0.331 -2.107 27 2HB GLU 223 2HB GLU 223 -14.858 0.755 -0.801 28 1HG GLU 223 1HG GLU 223 -11.920 0.934 -0.248 29 2HG GLU 223 2HG GLU 223 -12.614 2.153 -1.368 30 H HIS 224 H HIS 224 -11.179 -0.910 0.494 31 HA HIS 224 HA HIS 224 -10.074 -2.927 -1.351 32 1HB HIS 224 1HB HIS 224 -8.536 -0.361 -0.798 33 2HB HIS 224 2HB HIS 224 -8.255 -1.592 -2.040 34 HD1 HIS 224 1HD HIS 224 -9.783 1.766 -1.585 35 HD2 HIS 224 2HD HIS 224 -10.406 -1.676 -3.945 36 HE1 HIS 224 1HE HIS 224 -11.323 2.440 -3.483 37 H ILE 225 H ILE 225 -8.547 -4.167 -0.227 38 HA ILE 225 HA ILE 225 -8.296 -3.600 2.676 39 HB ILE 225 HB ILE 225 -8.224 -6.089 1.005 40 1HG1 ILE 225 1HG1 ILE 225 -9.741 -4.951 3.389 41 2HG1 ILE 225 2HG1 ILE 225 -10.346 -5.389 1.793 42 1HG2 ILE 225 1HG2 ILE 225 -6.164 -6.188 2.472 43 2HG2 ILE 225 2HG2 ILE 225 -7.234 -6.016 3.893 44 3HG2 ILE 225 3HG2 ILE 225 -7.364 -7.420 2.821 45 1HD1 ILE 225 1HD1 ILE 225 -9.410 -7.159 4.032 46 2HD1 ILE 225 2HD1 ILE 225 -11.043 -7.015 3.374 47 3HD1 ILE 225 3HD1 ILE 225 -9.773 -7.793 2.379 48 HA PRO 226 HA PRO 226 -4.120 -2.494 1.473 49 1HB PRO 226 1HB PRO 226 -2.931 -2.087 3.793 50 2HB PRO 226 2HB PRO 226 -4.271 -1.031 3.251 51 1HG PRO 226 1HG PRO 226 -4.397 -3.211 5.314 52 2HG PRO 226 2HG PRO 226 -5.298 -1.681 5.268 53 1HD PRO 226 1HD PRO 226 -6.154 -4.263 4.405 54 2HD PRO 226 2HD PRO 226 -7.026 -2.754 4.099 55 H ASP 227 H ASP 227 -1.869 -3.168 1.809 56 HA ASP 227 HA ASP 227 -1.866 -6.151 1.803 57 1HB ASP 227 1HB ASP 227 -1.219 -4.832 -0.220 58 2HB ASP 227 2HB ASP 227 0.267 -4.344 0.643 59 HA PRO 228 HA PRO 228 0.630 -5.644 5.561 60 1HB PRO 228 1HB PRO 228 0.195 -8.033 6.733 61 2HB PRO 228 2HB PRO 228 -1.115 -6.815 6.595 62 1HG PRO 228 1HG PRO 228 -0.601 -9.208 4.791 63 2HG PRO 228 2HG PRO 228 -2.145 -8.685 5.537 64 1HD PRO 228 1HD PRO 228 -1.373 -8.000 2.974 65 2HD PRO 228 2HD PRO 228 -2.444 -7.010 3.976 66 H ASP 229 H ASP 229 0.949 -7.973 2.983 67 HA ASP 229 HA ASP 229 3.305 -9.386 3.976 68 1HB ASP 229 1HB ASP 229 1.643 -10.444 2.434 69 2HB ASP 229 2HB ASP 229 2.126 -9.336 1.157 70 H ALA 230 H ALA 230 2.515 -7.035 1.417 71 HA ALA 230 HA ALA 230 5.059 -6.439 0.434 72 1HB ALA 230 1HB ALA 230 2.935 -5.664 -0.567 73 2HB ALA 230 2HB ALA 230 2.683 -4.567 0.809 74 3HB ALA 230 3HB ALA 230 4.044 -4.295 -0.296 75 H LYS 231 H LYS 231 6.820 -5.932 1.613 76 HA LYS 231 HA LYS 231 6.675 -4.058 3.917 77 1HB LYS 231 1HB LYS 231 9.148 -5.325 2.655 78 2HB LYS 231 2HB LYS 231 9.049 -4.471 4.178 79 1HG LYS 231 1HG LYS 231 8.971 -6.398 5.166 80 2HG LYS 231 2HG LYS 231 7.270 -6.462 4.708 81 1HD LYS 231 1HD LYS 231 7.740 -7.926 2.848 82 2HD LYS 231 2HD LYS 231 9.472 -7.511 2.876 83 1HE LYS 231 1HE LYS 231 9.746 -8.508 5.058 84 2HE LYS 231 2HE LYS 231 8.046 -8.981 5.113 85 1HZ LYS 231 1HZ LYS 231 9.988 -9.928 3.076 86 2HZ LYS 231 2HZ LYS 231 9.508 -10.803 4.381 87 3HZ LYS 231 3HZ LYS 231 8.428 -10.417 3.210 88 H LYS 232 H LYS 232 7.757 -1.999 3.784 89 HA LYS 232 HA LYS 232 8.116 -0.601 1.498 90 1HB LYS 232 1HB LYS 232 9.474 0.917 2.699 91 2HB LYS 232 2HB LYS 232 8.343 0.222 3.856 92 1HG LYS 232 1HG LYS 232 10.205 -1.384 4.569 93 2HG LYS 232 2HG LYS 232 11.282 -0.453 3.527 94 1HD LYS 232 1HD LYS 232 10.120 1.554 5.041 95 2HD LYS 232 2HD LYS 232 10.156 0.221 6.186 96 1HE LYS 232 1HE LYS 232 12.477 1.485 4.662 97 2HE LYS 232 2HE LYS 232 12.143 1.634 6.387 98 1HZ LYS 232 1HZ LYS 232 12.572 -0.819 6.476 99 2HZ LYS 232 2HZ LYS 232 13.062 -0.753 4.904 100 3HZ LYS 232 3HZ LYS 232 13.898 0.068 6.024 101 HA PRO 233 HA PRO 233 11.684 -1.990 -0.796 102 1HB PRO 233 1HB PRO 233 12.704 0.776 -1.130 103 2HB PRO 233 2HB PRO 233 12.105 -0.346 -2.373 104 1HG PRO 233 1HG PRO 233 10.720 1.887 -1.562 105 2HG PRO 233 2HG PRO 233 9.912 0.415 -2.131 106 1HD PRO 233 1HD PRO 233 10.359 1.355 0.708 107 2HD PRO 233 2HD PRO 233 8.933 0.573 -0.029 108 H GLU 234 H GLU 234 14.112 -1.700 -0.991 109 HA GLU 234 HA GLU 234 15.455 -0.989 1.557 110 1HB GLU 234 1HB GLU 234 15.624 -3.208 -0.135 111 2HB GLU 234 2HB GLU 234 16.999 -2.228 -0.665 112 1HG GLU 234 1HG GLU 234 17.756 -2.103 1.710 113 2HG GLU 234 2HG GLU 234 16.297 -3.024 2.182 114 H ASP 235 H ASP 235 15.009 -0.312 -1.832 115 HA ASP 235 HA ASP 235 17.115 1.653 -2.081 116 1HB ASP 235 1HB ASP 235 16.056 -0.161 -3.731 117 2HB ASP 235 2HB ASP 235 14.912 1.112 -4.092 118 H TRP 236 H TRP 236 14.681 2.066 -0.219 119 HA TRP 236 HA TRP 236 13.168 4.257 -1.373 120 1HB TRP 236 1HB TRP 236 12.267 2.513 0.326 121 2HB TRP 236 2HB TRP 236 13.273 3.314 1.520 122 HD1 TRP 236 HD TRP 236 11.936 5.040 2.865 123 HE1 TRP 236 1HE TRP 236 9.908 6.628 2.427 124 HE3 TRP 236 3HE TRP 236 11.092 3.976 -2.032 125 HZ2 TRP 236 2HZ TRP 236 7.919 6.983 0.387 126 HZ3 TRP 236 3HZ TRP 236 9.225 5.154 -3.263 127 HH2 TRP 236 HH TRP 236 7.589 6.526 -2.024 128 H ASP 237 H ASP 237 13.896 6.332 -1.387 129 HA ASP 237 HA ASP 237 16.015 7.183 0.414 130 1HB ASP 237 1HB ASP 237 14.884 7.895 -2.267 131 2HB ASP 237 2HB ASP 237 15.353 9.220 -1.268 132 H GLU 238 H GLU 238 14.904 7.269 2.378 133 HA GLU 238 HA GLU 238 12.263 8.413 2.626 134 1HB GLU 238 1HB GLU 238 13.453 6.719 4.205 135 2HB GLU 238 2HB GLU 238 14.236 8.125 4.928 136 1HG GLU 238 1HG GLU 238 11.440 8.776 4.766 137 2HG GLU 238 2HG GLU 238 11.518 7.088 5.236 138 H GLU 239 H GLU 239 15.429 9.925 2.489 139 HA GLU 239 HA GLU 239 14.615 12.305 3.895 140 1HB GLU 239 1HB GLU 239 17.004 11.044 2.968 141 2HB GLU 239 2HB GLU 239 16.921 12.524 2.042 142 1HG GLU 239 1HG GLU 239 16.585 12.489 5.076 143 2HG GLU 239 2HG GLU 239 18.177 12.221 4.371 144 H MET 240 H MET 240 14.382 10.955 0.694 145 HA MET 240 HA MET 240 13.704 13.487 -0.654 146 1HB MET 240 1HB MET 240 13.801 10.604 -1.589 147 2HB MET 240 2HB MET 240 13.316 11.949 -2.618 148 1HG MET 240 1HG MET 240 15.968 12.106 -1.143 149 2HG MET 240 2HG MET 240 15.834 11.104 -2.581 150 1HE MET 240 1HE MET 240 16.900 11.981 -4.586 151 2HE MET 240 2HE MET 240 15.145 11.896 -4.901 152 3HE MET 240 3HE MET 240 16.094 13.290 -5.484 153 H ASP 241 H ASP 241 12.089 10.298 -0.215 154 HA ASP 241 HA ASP 241 9.599 11.555 -1.061 155 1HB ASP 241 1HB ASP 241 10.570 9.131 -1.674 156 2HB ASP 241 2HB ASP 241 9.705 8.678 -0.198 157 H GLY 242 H GLY 242 10.671 9.697 1.838 158 1HA GLY 242 1HA GLY 242 10.109 10.502 4.056 159 2HA GLY 242 2HA GLY 242 8.581 11.108 3.456 160 H GLU 243 H GLU 243 7.040 9.912 4.548 161 HA GLU 243 HA GLU 243 7.364 7.185 5.328 162 1HB GLU 243 1HB GLU 243 5.395 9.306 5.681 163 2HB GLU 243 2HB GLU 243 4.587 7.836 5.103 164 1HG GLU 243 1HG GLU 243 5.739 6.541 6.887 165 2HG GLU 243 2HG GLU 243 6.572 8.001 7.407 166 H TRP 244 H TRP 244 7.249 5.468 4.090 167 HA TRP 244 HA TRP 244 6.201 5.449 1.360 168 1HB TRP 244 1HB TRP 244 8.086 3.991 2.103 169 2HB TRP 244 2HB TRP 244 7.044 3.244 3.296 170 HD1 TRP 244 HD TRP 244 7.228 3.607 -0.566 171 HE1 TRP 244 1HE TRP 244 6.457 1.386 -1.629 172 HE3 TRP 244 3HE TRP 244 6.005 1.029 3.677 173 HZ2 TRP 244 2HZ TRP 244 5.369 -1.116 -0.760 174 HZ3 TRP 244 3HZ TRP 244 5.365 -1.352 3.542 175 HH2 TRP 244 HH TRP 244 4.864 -2.384 1.320 176 H GLU 245 H GLU 245 4.264 4.172 0.863 177 HA GLU 245 HA GLU 245 2.405 3.613 3.108 178 1HB GLU 245 1HB GLU 245 1.769 5.069 0.530 179 2HB GLU 245 2HB GLU 245 0.573 4.335 1.600 180 1HG GLU 245 1HG GLU 245 1.075 5.865 3.385 181 2HG GLU 245 2HG GLU 245 2.433 6.556 2.489 182 HA PRO 246 HA PRO 246 2.794 -0.101 0.695 183 1HB PRO 246 1HB PRO 246 0.908 -1.730 1.945 184 2HB PRO 246 2HB PRO 246 2.535 -1.366 2.564 185 1HG PRO 246 1HG PRO 246 -0.116 -0.096 3.270 186 2HG PRO 246 2HG PRO 246 1.214 -0.568 4.364 187 1HD PRO 246 1HD PRO 246 0.803 2.037 3.476 188 2HD PRO 246 2HD PRO 246 2.426 1.393 3.866 189 HA PRO 247 HA PRO 247 -0.523 -0.271 -2.267 190 1HB PRO 247 1HB PRO 247 -0.503 -2.865 -3.106 191 2HB PRO 247 2HB PRO 247 0.673 -1.647 -3.607 192 1HG PRO 247 1HG PRO 247 0.998 -3.870 -1.620 193 2HG PRO 247 2HG PRO 247 2.242 -3.127 -2.654 194 1HD PRO 247 1HD PRO 247 1.784 -2.583 0.069 195 2HD PRO 247 2HD PRO 247 2.753 -1.572 -1.008 196 H VAL 248 H VAL 248 -2.436 -1.832 -2.978 197 HA VAL 248 HA VAL 248 -3.819 -2.907 -0.627 198 HB VAL 248 HB VAL 248 -5.823 -1.989 -1.763 199 1HG1 VAL 248 1HG1 VAL 248 -5.452 0.356 -0.850 200 2HG1 VAL 248 2HG1 VAL 248 -4.984 -0.956 0.247 201 3HG1 VAL 248 3HG1 VAL 248 -3.733 -0.089 -0.672 202 1HG2 VAL 248 1HG2 VAL 248 -4.837 -1.450 -4.001 203 2HG2 VAL 248 2HG2 VAL 248 -5.740 -0.105 -3.268 204 3HG2 VAL 248 3HG2 VAL 248 -3.974 -0.094 -3.244 205 H ILE 249 H ILE 249 -5.640 -4.231 -1.272 206 HA ILE 249 HA ILE 249 -5.185 -5.885 -3.662 207 HB ILE 249 HB ILE 249 -5.230 -7.852 -2.358 208 1HG1 ILE 249 1HG1 ILE 249 -5.281 -7.501 0.322 209 2HG1 ILE 249 2HG1 ILE 249 -6.317 -6.159 -0.102 210 1HG2 ILE 249 1HG2 ILE 249 -3.558 -5.909 -0.688 211 2HG2 ILE 249 2HG2 ILE 249 -3.328 -7.643 -0.850 212 3HG2 ILE 249 3HG2 ILE 249 -3.069 -6.596 -2.259 213 1HD1 ILE 249 1HD1 ILE 249 -7.855 -7.740 -1.233 214 2HD1 ILE 249 2HD1 ILE 249 -6.716 -9.070 -0.944 215 3HD1 ILE 249 3HD1 ILE 249 -7.525 -8.291 0.413 216 H GLN 250 H GLN 250 -7.074 -6.088 -4.770 217 HA GLN 250 HA GLN 250 -9.516 -4.819 -4.063 218 1HB GLN 250 1HB GLN 250 -8.664 -6.895 -6.081 219 2HB GLN 250 2HB GLN 250 -10.382 -6.644 -5.813 220 1HG GLN 250 1HG GLN 250 -8.506 -4.303 -6.353 221 2HG GLN 250 2HG GLN 250 -9.168 -5.258 -7.658 222 1HE2 GLN 250 1HE2 GLN 250 -9.786 -2.484 -5.879 223 2HE2 GLN 250 2HE2 GLN 250 -11.565 -2.520 -5.929 224 H ASN 251 H ASN 251 -10.910 -5.348 -2.613 225 HA ASN 251 HA ASN 251 -10.255 -7.162 -0.536 226 1HB ASN 251 1HB ASN 251 -11.545 -5.077 -0.226 227 2HB ASN 251 2HB ASN 251 -12.876 -5.771 -1.141 228 1HD2 ASN 251 1HD2 ASN 251 -13.180 -4.791 1.561 229 2HD2 ASN 251 2HD2 ASN 251 -13.555 -6.244 2.523 230 HA PRO 252 HA PRO 252 -12.103 -10.744 -2.623 231 1HB PRO 252 1HB PRO 252 -11.777 -12.629 -0.658 232 2HB PRO 252 2HB PRO 252 -10.438 -12.002 -1.664 233 1HG PRO 252 1HG PRO 252 -11.221 -11.107 1.109 234 2HG PRO 252 2HG PRO 252 -9.596 -11.558 0.503 235 1HD PRO 252 1HD PRO 252 -10.380 -8.978 0.624 236 2HD PRO 252 2HD PRO 252 -9.412 -9.579 -0.752 237 H GLU 253 H GLU 253 -13.632 -8.869 -0.340 238 HA GLU 253 HA GLU 253 -16.120 -9.695 -1.049 239 1HB GLU 253 1HB GLU 253 -15.139 -11.154 1.303 240 2HB GLU 253 2HB GLU 253 -16.580 -10.241 1.703 241 1HG GLU 253 1HG GLU 253 -17.889 -11.293 0.151 242 2HG GLU 253 2HG GLU 253 -16.577 -11.869 -0.840 243 H TYR 254 H TYR 254 -15.749 -7.302 -1.461 244 HA TYR 254 HA TYR 254 -15.581 -5.520 0.862 245 1HB TYR 254 1HB TYR 254 -14.757 -4.583 -1.203 246 2HB TYR 254 2HB TYR 254 -16.219 -5.057 -2.062 247 HD1 TYR 254 1HD TYR 254 -15.759 -3.198 1.231 248 HD2 TYR 254 2HD TYR 254 -17.294 -3.133 -2.803 249 HE1 TYR 254 1HE TYR 254 -16.803 -1.030 1.677 250 HE2 TYR 254 2HE TYR 254 -18.373 -0.966 -2.357 251 HH TYR 254 HH TYR 254 -18.197 0.633 0.863 252 H LYS 255 H LYS 255 -17.196 -5.468 2.272 253 HA LYS 255 HA LYS 255 -19.251 -5.384 3.234 254 1HB LYS 255 1HB LYS 255 -18.854 -3.256 1.474 255 2HB LYS 255 2HB LYS 255 -20.439 -3.816 1.027 256 1HG LYS 255 1HG LYS 255 -20.839 -2.192 2.659 257 2HG LYS 255 2HG LYS 255 -20.952 -3.668 3.603 258 1HD LYS 255 1HD LYS 255 -18.611 -3.332 4.394 259 2HD LYS 255 2HD LYS 255 -18.438 -1.956 3.316 260 1HE LYS 255 1HE LYS 255 -18.803 -0.991 5.413 261 2HE LYS 255 2HE LYS 255 -20.325 -0.792 4.513 262 1HZ LYS 255 1HZ LYS 255 -19.785 -2.821 6.617 263 2HZ LYS 255 2HZ LYS 255 -20.722 -1.509 6.792 264 3HZ LYS 255 3HZ LYS 255 -21.194 -2.716 5.801 265 H GLY 256 H GLY 256 -18.885 -7.702 1.460 266 1HA GLY 256 1HA GLY 256 -21.682 -8.570 1.366 267 2HA GLY 256 2HA GLY 256 -20.634 -8.940 -0.009 Start of MODEL 19 1 H GLY 220 H GLY 220 -19.931 -2.207 6.970 2 1HA GLY 220 1HA GLY 220 -19.133 -3.770 8.606 3 2HA GLY 220 2HA GLY 220 -19.891 -4.709 7.304 4 H LYS 221 H LYS 221 -18.451 -5.406 5.545 5 HA LYS 221 HA LYS 221 -15.583 -5.765 6.164 6 1HB LYS 221 1HB LYS 221 -17.504 -6.620 4.024 7 2HB LYS 221 2HB LYS 221 -15.903 -6.218 3.449 8 1HG LYS 221 1HG LYS 221 -14.901 -7.930 4.536 9 2HG LYS 221 2HG LYS 221 -16.039 -7.950 5.894 10 1HD LYS 221 1HD LYS 221 -16.840 -8.873 3.111 11 2HD LYS 221 2HD LYS 221 -16.064 -9.939 4.317 12 1HE LYS 221 1HE LYS 221 -17.932 -9.125 5.940 13 2HE LYS 221 2HE LYS 221 -18.762 -8.539 4.487 14 1HZ LYS 221 1HZ LYS 221 -19.448 -10.729 5.120 15 2HZ LYS 221 2HZ LYS 221 -18.690 -10.814 3.645 16 3HZ LYS 221 3HZ LYS 221 -17.914 -11.306 5.030 17 HA PRO 222 HA PRO 222 -14.815 -1.671 4.605 18 1HB PRO 222 1HB PRO 222 -12.203 -1.909 3.692 19 2HB PRO 222 2HB PRO 222 -12.691 -1.768 5.372 20 1HG PRO 222 1HG PRO 222 -12.008 -4.267 3.778 21 2HG PRO 222 2HG PRO 222 -11.547 -3.896 5.468 22 1HD PRO 222 1HD PRO 222 -13.612 -5.561 4.768 23 2HD PRO 222 2HD PRO 222 -13.591 -4.605 6.286 24 H GLU 223 H GLU 223 -13.687 -0.634 2.626 25 HA GLU 223 HA GLU 223 -15.046 -1.574 0.199 26 1HB GLU 223 1HB GLU 223 -13.336 0.858 0.833 27 2HB GLU 223 2HB GLU 223 -14.146 0.569 -0.711 28 1HG GLU 223 1HG GLU 223 -16.349 0.532 0.386 29 2HG GLU 223 2HG GLU 223 -15.596 0.751 1.969 30 H HIS 224 H HIS 224 -11.686 -1.173 1.403 31 HA HIS 224 HA HIS 224 -10.724 -2.935 -0.757 32 1HB HIS 224 1HB HIS 224 -9.213 -0.479 0.213 33 2HB HIS 224 2HB HIS 224 -8.749 -1.600 -1.054 34 HD1 HIS 224 1HD HIS 224 -10.359 1.696 -0.763 35 HD2 HIS 224 2HD HIS 224 -10.809 -1.755 -3.143 36 HE1 HIS 224 1HE HIS 224 -11.737 2.395 -2.781 37 H ILE 225 H ILE 225 -8.349 -3.696 0.015 38 HA ILE 225 HA ILE 225 -8.207 -3.966 2.951 39 HB ILE 225 HB ILE 225 -8.172 -6.117 0.855 40 1HG1 ILE 225 1HG1 ILE 225 -9.689 -5.430 3.401 41 2HG1 ILE 225 2HG1 ILE 225 -10.308 -5.676 1.769 42 1HG2 ILE 225 1HG2 ILE 225 -7.181 -6.518 3.707 43 2HG2 ILE 225 2HG2 ILE 225 -7.251 -7.715 2.414 44 3HG2 ILE 225 3HG2 ILE 225 -6.104 -6.409 2.291 45 1HD1 ILE 225 1HD1 ILE 225 -9.644 -8.083 1.976 46 2HD1 ILE 225 2HD1 ILE 225 -9.263 -7.695 3.702 47 3HD1 ILE 225 3HD1 ILE 225 -10.930 -7.526 3.087 48 HA PRO 226 HA PRO 226 -4.235 -2.353 1.667 49 1HB PRO 226 1HB PRO 226 -2.695 -2.663 3.802 50 2HB PRO 226 2HB PRO 226 -4.094 -1.539 3.825 51 1HG PRO 226 1HG PRO 226 -3.911 -4.268 5.046 52 2HG PRO 226 2HG PRO 226 -4.771 -2.822 5.655 53 1HD PRO 226 1HD PRO 226 -5.839 -4.996 4.196 54 2HD PRO 226 2HD PRO 226 -6.711 -3.489 4.483 55 H ASP 227 H ASP 227 -1.935 -3.041 1.460 56 HA ASP 227 HA ASP 227 -1.882 -5.883 0.636 57 1HB ASP 227 1HB ASP 227 -1.072 -4.158 -0.911 58 2HB ASP 227 2HB ASP 227 0.193 -3.751 0.237 59 HA PRO 228 HA PRO 228 0.034 -6.383 4.724 60 1HB PRO 228 1HB PRO 228 -0.097 -9.059 4.951 61 2HB PRO 228 2HB PRO 228 -1.600 -8.085 4.900 62 1HG PRO 228 1HG PRO 228 -0.275 -9.549 2.594 63 2HG PRO 228 2HG PRO 228 -1.971 -9.648 3.111 64 1HD PRO 228 1HD PRO 228 -1.164 -7.955 1.135 65 2HD PRO 228 2HD PRO 228 -2.465 -7.510 2.277 66 H ASP 229 H ASP 229 1.109 -7.867 1.733 67 HA ASP 229 HA ASP 229 3.506 -9.142 2.900 68 1HB ASP 229 1HB ASP 229 2.016 -10.235 1.181 69 2HB ASP 229 2HB ASP 229 2.528 -9.005 0.030 70 H ALA 230 H ALA 230 2.552 -6.528 0.689 71 HA ALA 230 HA ALA 230 5.073 -5.547 -0.098 72 1HB ALA 230 1HB ALA 230 2.931 -4.737 -1.008 73 2HB ALA 230 2HB ALA 230 2.533 -4.015 0.576 74 3HB ALA 230 3HB ALA 230 3.903 -3.401 -0.389 75 H LYS 231 H LYS 231 6.719 -4.999 1.124 76 HA LYS 231 HA LYS 231 6.354 -3.455 3.621 77 1HB LYS 231 1HB LYS 231 7.293 -6.050 3.444 78 2HB LYS 231 2HB LYS 231 8.778 -5.169 3.231 79 1HG LYS 231 1HG LYS 231 6.922 -4.639 5.601 80 2HG LYS 231 2HG LYS 231 7.943 -6.036 5.544 81 1HD LYS 231 1HD LYS 231 9.392 -4.780 6.668 82 2HD LYS 231 2HD LYS 231 9.889 -4.292 5.067 83 1HE LYS 231 1HE LYS 231 9.799 -2.394 6.525 84 2HE LYS 231 2HE LYS 231 8.534 -2.210 5.315 85 1HZ LYS 231 1HZ LYS 231 7.955 -3.302 7.992 86 2HZ LYS 231 2HZ LYS 231 7.944 -1.700 7.674 87 3HZ LYS 231 3HZ LYS 231 6.900 -2.692 6.889 88 H LYS 232 H LYS 232 8.015 -1.763 3.802 89 HA LYS 232 HA LYS 232 8.744 -0.185 2.006 90 1HB LYS 232 1HB LYS 232 10.480 -1.165 4.247 91 2HB LYS 232 2HB LYS 232 11.059 0.034 3.122 92 1HG LYS 232 1HG LYS 232 8.908 1.344 3.627 93 2HG LYS 232 2HG LYS 232 8.822 0.296 5.066 94 1HD LYS 232 1HD LYS 232 11.435 1.096 5.184 95 2HD LYS 232 2HD LYS 232 10.774 2.478 4.298 96 1HE LYS 232 1HE LYS 232 9.888 1.355 6.957 97 2HE LYS 232 2HE LYS 232 10.801 2.840 6.746 98 1HZ LYS 232 1HZ LYS 232 8.940 3.791 5.616 99 2HZ LYS 232 2HZ LYS 232 8.019 2.401 5.850 100 3HZ LYS 232 3HZ LYS 232 8.490 3.305 7.127 101 HA PRO 233 HA PRO 233 11.027 -2.284 -1.157 102 1HB PRO 233 1HB PRO 233 12.172 0.311 -2.010 103 2HB PRO 233 2HB PRO 233 11.115 -0.820 -2.891 104 1HG PRO 233 1HG PRO 233 10.378 1.662 -1.712 105 2HG PRO 233 2HG PRO 233 9.256 0.439 -2.315 106 1HD PRO 233 1HD PRO 233 9.887 1.143 0.464 107 2HD PRO 233 2HD PRO 233 8.611 0.047 -0.187 108 H GLU 234 H GLU 234 13.051 -3.070 -1.319 109 HA GLU 234 HA GLU 234 15.091 -2.739 0.570 110 1HB GLU 234 1HB GLU 234 14.520 -4.570 -1.247 111 2HB GLU 234 2HB GLU 234 15.507 -3.596 -2.326 112 1HG GLU 234 1HG GLU 234 17.423 -3.892 -0.802 113 2HG GLU 234 2HG GLU 234 16.377 -4.719 0.372 114 H ASP 235 H ASP 235 14.168 -0.857 -2.103 115 HA ASP 235 HA ASP 235 16.705 0.665 -2.394 116 1HB ASP 235 1HB ASP 235 15.820 -0.914 -4.218 117 2HB ASP 235 2HB ASP 235 14.457 0.201 -4.402 118 H TRP 236 H TRP 236 14.176 1.037 -0.547 119 HA TRP 236 HA TRP 236 13.066 3.590 -1.378 120 1HB TRP 236 1HB TRP 236 11.977 1.883 0.156 121 2HB TRP 236 2HB TRP 236 13.166 2.256 1.385 122 HD1 TRP 236 HD TRP 236 12.210 3.978 3.152 123 HE1 TRP 236 1HE TRP 236 10.499 5.885 3.090 124 HE3 TRP 236 3HE TRP 236 10.910 3.772 -1.817 125 HZ2 TRP 236 2HZ TRP 236 8.753 7.144 1.169 126 HZ3 TRP 236 3HZ TRP 236 9.330 5.472 -2.754 127 HH2 TRP 236 HH TRP 236 8.229 7.104 -1.266 128 H ASP 237 H ASP 237 13.498 5.614 -0.246 129 HA ASP 237 HA ASP 237 16.336 5.892 0.616 130 1HB ASP 237 1HB ASP 237 14.751 7.745 -1.214 131 2HB ASP 237 2HB ASP 237 16.453 7.896 -0.761 132 H GLU 238 H GLU 238 15.369 5.938 2.888 133 HA GLU 238 HA GLU 238 13.306 7.647 3.694 134 1HB GLU 238 1HB GLU 238 14.171 5.740 4.938 135 2HB GLU 238 2HB GLU 238 15.613 6.649 5.380 136 1HG GLU 238 1HG GLU 238 14.051 8.332 6.550 137 2HG GLU 238 2HG GLU 238 12.710 7.244 6.118 138 H GLU 239 H GLU 239 16.433 8.745 2.734 139 HA GLU 239 HA GLU 239 16.451 11.088 4.448 140 1HB GLU 239 1HB GLU 239 18.397 9.683 3.400 141 2HB GLU 239 2HB GLU 239 18.114 10.613 1.936 142 1HG GLU 239 1HG GLU 239 18.547 12.714 3.145 143 2HG GLU 239 2HG GLU 239 18.641 11.809 4.671 144 H MET 240 H MET 240 14.870 10.134 1.606 145 HA MET 240 HA MET 240 15.069 12.778 0.304 146 1HB MET 240 1HB MET 240 15.972 10.322 -0.503 147 2HB MET 240 2HB MET 240 14.367 10.319 -1.250 148 1HG MET 240 1HG MET 240 16.408 12.539 -1.432 149 2HG MET 240 2HG MET 240 16.265 11.269 -2.643 150 1HE MET 240 1HE MET 240 14.651 11.185 -4.568 151 2HE MET 240 2HE MET 240 13.387 10.773 -3.388 152 3HE MET 240 3HE MET 240 13.087 12.024 -4.617 153 H ASP 241 H ASP 241 12.836 9.990 0.643 154 HA ASP 241 HA ASP 241 10.694 11.760 -0.402 155 1HB ASP 241 1HB ASP 241 11.040 9.336 -1.241 156 2HB ASP 241 2HB ASP 241 10.200 8.868 0.237 157 H GLY 242 H GLY 242 10.908 9.425 2.330 158 1HA GLY 242 1HA GLY 242 10.270 10.465 4.619 159 2HA GLY 242 2HA GLY 242 8.812 10.996 3.759 160 H GLU 243 H GLU 243 7.631 9.716 5.362 161 HA GLU 243 HA GLU 243 7.894 6.988 5.726 162 1HB GLU 243 1HB GLU 243 6.056 9.054 6.514 163 2HB GLU 243 2HB GLU 243 5.107 7.716 5.851 164 1HG GLU 243 1HG GLU 243 6.337 6.117 7.311 165 2HG GLU 243 2HG GLU 243 7.224 7.494 7.989 166 H TRP 244 H TRP 244 8.023 5.595 4.166 167 HA TRP 244 HA TRP 244 6.560 5.485 1.720 168 1HB TRP 244 1HB TRP 244 8.521 4.010 2.374 169 2HB TRP 244 2HB TRP 244 7.459 3.178 3.490 170 HD1 TRP 244 HD TRP 244 7.556 3.977 -0.307 171 HE1 TRP 244 1HE TRP 244 6.594 1.979 -1.595 172 HE3 TRP 244 3HE TRP 244 6.390 0.977 3.642 173 HZ2 TRP 244 2HZ TRP 244 5.619 -0.676 -0.989 174 HZ3 TRP 244 3HZ TRP 244 5.623 -1.342 3.276 175 HH2 TRP 244 HH TRP 244 5.165 -2.154 0.956 176 H GLU 245 H GLU 245 4.588 4.306 1.215 177 HA GLU 245 HA GLU 245 3.142 3.194 3.473 178 1HB GLU 245 1HB GLU 245 1.019 4.010 2.906 179 2HB GLU 245 2HB GLU 245 2.064 5.397 3.067 180 1HG GLU 245 1HG GLU 245 2.202 5.640 0.646 181 2HG GLU 245 2HG GLU 245 1.308 4.122 0.425 182 HA PRO 246 HA PRO 246 3.096 -0.035 0.432 183 1HB PRO 246 1HB PRO 246 1.254 -1.776 1.535 184 2HB PRO 246 2HB PRO 246 2.895 -1.522 2.175 185 1HG PRO 246 1HG PRO 246 0.265 -0.395 3.130 186 2HG PRO 246 2HG PRO 246 1.658 -0.944 4.107 187 1HD PRO 246 1HD PRO 246 1.072 1.731 3.415 188 2HD PRO 246 2HD PRO 246 2.663 1.139 3.955 189 HA PRO 247 HA PRO 247 -0.605 0.532 -2.082 190 1HB PRO 247 1HB PRO 247 -0.783 -1.984 -3.288 191 2HB PRO 247 2HB PRO 247 0.232 -0.644 -3.836 192 1HG PRO 247 1HG PRO 247 1.050 -3.150 -2.534 193 2HG PRO 247 2HG PRO 247 2.043 -1.962 -3.420 194 1HD PRO 247 1HD PRO 247 1.698 -2.298 -0.565 195 2HD PRO 247 2HD PRO 247 2.787 -1.161 -1.385 196 H VAL 248 H VAL 248 -2.660 -1.125 -2.725 197 HA VAL 248 HA VAL 248 -3.673 -2.473 -0.340 198 HB VAL 248 HB VAL 248 -5.825 -1.608 -1.084 199 1HG1 VAL 248 1HG1 VAL 248 -5.607 0.707 -0.174 200 2HG1 VAL 248 2HG1 VAL 248 -4.635 -0.447 0.757 201 3HG1 VAL 248 3HG1 VAL 248 -3.839 0.614 -0.432 202 1HG2 VAL 248 1HG2 VAL 248 -6.149 0.258 -2.574 203 2HG2 VAL 248 2HG2 VAL 248 -4.409 0.399 -2.860 204 3HG2 VAL 248 3HG2 VAL 248 -5.295 -1.018 -3.455 205 H ILE 249 H ILE 249 -5.740 -3.687 -1.208 206 HA ILE 249 HA ILE 249 -5.279 -4.906 -3.828 207 HB ILE 249 HB ILE 249 -5.420 -7.117 -2.917 208 1HG1 ILE 249 1HG1 ILE 249 -4.988 -6.811 -0.087 209 2HG1 ILE 249 2HG1 ILE 249 -6.377 -5.842 -0.459 210 1HG2 ILE 249 1HG2 ILE 249 -3.273 -7.271 -1.743 211 2HG2 ILE 249 2HG2 ILE 249 -3.181 -6.033 -3.010 212 3HG2 ILE 249 3HG2 ILE 249 -3.364 -5.546 -1.313 213 1HD1 ILE 249 1HD1 ILE 249 -7.504 -7.738 -1.557 214 2HD1 ILE 249 2HD1 ILE 249 -6.079 -8.758 -1.265 215 3HD1 ILE 249 3HD1 ILE 249 -7.037 -8.162 0.104 216 H GLN 250 H GLN 250 -7.232 -5.436 -4.776 217 HA GLN 250 HA GLN 250 -9.544 -3.985 -3.966 218 1HB GLN 250 1HB GLN 250 -10.648 -5.195 -5.778 219 2HB GLN 250 2HB GLN 250 -9.068 -4.588 -6.250 220 1HG GLN 250 1HG GLN 250 -8.667 -6.579 -7.121 221 2HG GLN 250 2HG GLN 250 -8.453 -7.202 -5.493 222 1HE2 GLN 250 1HE2 GLN 250 -10.505 -7.915 -4.423 223 2HE2 GLN 250 2HE2 GLN 250 -11.982 -8.044 -5.337 224 H ASN 251 H ASN 251 -11.048 -4.482 -2.341 225 HA ASN 251 HA ASN 251 -10.495 -6.693 -0.624 226 1HB ASN 251 1HB ASN 251 -11.657 -4.736 0.258 227 2HB ASN 251 2HB ASN 251 -13.005 -5.051 -0.820 228 1HD2 ASN 251 1HD2 ASN 251 -13.920 -4.863 1.687 229 2HD2 ASN 251 2HD2 ASN 251 -14.004 -6.437 2.464 230 HA PRO 252 HA PRO 252 -12.452 -9.534 -3.551 231 1HB PRO 252 1HB PRO 252 -11.827 -11.908 -2.386 232 2HB PRO 252 2HB PRO 252 -10.575 -10.841 -3.118 233 1HG PRO 252 1HG PRO 252 -11.322 -10.992 -0.191 234 2HG PRO 252 2HG PRO 252 -9.689 -11.129 -0.931 235 1HD PRO 252 1HD PRO 252 -10.658 -8.757 0.025 236 2HD PRO 252 2HD PRO 252 -9.620 -8.847 -1.430 237 H GLU 253 H GLU 253 -13.381 -8.977 -0.261 238 HA GLU 253 HA GLU 253 -15.849 -10.612 -0.552 239 1HB GLU 253 1HB GLU 253 -14.561 -9.472 1.951 240 2HB GLU 253 2HB GLU 253 -16.001 -10.500 1.840 241 1HG GLU 253 1HG GLU 253 -14.589 -12.306 0.817 242 2HG GLU 253 2HG GLU 253 -13.163 -11.326 1.165 243 H TYR 254 H TYR 254 -14.806 -7.446 -1.057 244 HA TYR 254 HA TYR 254 -17.214 -6.055 -0.121 245 1HB TYR 254 1HB TYR 254 -15.132 -4.838 -0.440 246 2HB TYR 254 2HB TYR 254 -15.045 -5.337 -2.125 247 HD1 TYR 254 1HD TYR 254 -16.014 -3.971 -3.818 248 HD2 TYR 254 2HD TYR 254 -16.964 -3.281 0.321 249 HE1 TYR 254 1HE TYR 254 -17.059 -1.839 -4.428 250 HE2 TYR 254 2HE TYR 254 -18.021 -1.114 -0.291 251 HH TYR 254 HH TYR 254 -18.188 0.066 -3.681 252 H LYS 255 H LYS 255 -18.866 -5.341 -1.718 253 HA LYS 255 HA LYS 255 -19.133 -7.076 -4.121 254 1HB LYS 255 1HB LYS 255 -20.083 -8.153 -2.064 255 2HB LYS 255 2HB LYS 255 -21.254 -6.850 -1.954 256 1HG LYS 255 1HG LYS 255 -22.552 -7.699 -3.609 257 2HG LYS 255 2HG LYS 255 -21.173 -8.061 -4.661 258 1HD LYS 255 1HD LYS 255 -20.702 -10.111 -3.479 259 2HD LYS 255 2HD LYS 255 -22.002 -9.797 -2.296 260 1HE LYS 255 1HE LYS 255 -23.698 -9.902 -4.076 261 2HE LYS 255 2HE LYS 255 -22.434 -10.078 -5.303 262 1HZ LYS 255 1HZ LYS 255 -23.356 -12.226 -4.823 263 2HZ LYS 255 2HZ LYS 255 -21.836 -12.182 -4.290 264 3HZ LYS 255 3HZ LYS 255 -23.051 -12.089 -3.203 265 H GLY 256 H GLY 256 -18.523 -4.200 -3.874 266 1HA GLY 256 1HA GLY 256 -20.851 -3.047 -5.313 267 2HA GLY 256 2HA GLY 256 -19.450 -2.142 -4.713 Start of MODEL 20 1 H GLY 220 H GLY 220 -18.926 -1.805 9.101 2 1HA GLY 220 1HA GLY 220 -18.962 -2.790 6.863 3 2HA GLY 220 2HA GLY 220 -18.925 -1.026 6.768 4 H LYS 221 H LYS 221 -17.532 -3.733 5.527 5 HA LYS 221 HA LYS 221 -14.751 -3.116 5.699 6 1HB LYS 221 1HB LYS 221 -16.460 -5.110 4.325 7 2HB LYS 221 2HB LYS 221 -15.043 -4.647 3.406 8 1HG LYS 221 1HG LYS 221 -13.601 -5.657 4.762 9 2HG LYS 221 2HG LYS 221 -14.406 -5.165 6.256 10 1HD LYS 221 1HD LYS 221 -15.576 -7.323 4.479 11 2HD LYS 221 2HD LYS 221 -14.325 -7.664 5.674 12 1HE LYS 221 1HE LYS 221 -15.722 -6.635 7.463 13 2HE LYS 221 2HE LYS 221 -17.019 -6.386 6.275 14 1HZ LYS 221 1HZ LYS 221 -15.930 -9.036 7.032 15 2HZ LYS 221 2HZ LYS 221 -17.362 -8.422 7.561 16 3HZ LYS 221 3HZ LYS 221 -17.140 -8.798 5.997 17 HA PRO 222 HA PRO 222 -14.594 0.134 2.722 18 1HB PRO 222 1HB PRO 222 -11.843 0.207 2.258 19 2HB PRO 222 2HB PRO 222 -12.680 0.795 3.702 20 1HG PRO 222 1HG PRO 222 -11.229 -1.828 3.249 21 2HG PRO 222 2HG PRO 222 -11.224 -0.801 4.720 22 1HD PRO 222 1HD PRO 222 -12.745 -3.083 4.363 23 2HD PRO 222 2HD PRO 222 -13.175 -1.761 5.480 24 H GLU 223 H GLU 223 -13.227 0.674 0.613 25 HA GLU 223 HA GLU 223 -14.241 -1.200 -1.351 26 1HB GLU 223 1HB GLU 223 -13.489 0.585 -2.856 27 2HB GLU 223 2HB GLU 223 -14.624 1.144 -1.642 28 1HG GLU 223 1HG GLU 223 -11.691 1.375 -1.206 29 2HG GLU 223 2HG GLU 223 -12.473 2.570 -2.256 30 H HIS 224 H HIS 224 -11.043 -0.382 0.015 31 HA HIS 224 HA HIS 224 -9.857 -2.602 -1.544 32 1HB HIS 224 1HB HIS 224 -8.145 -0.266 -0.736 33 2HB HIS 224 2HB HIS 224 -7.881 -1.469 -1.982 34 HD1 HIS 224 1HD HIS 224 -9.364 1.937 -1.406 35 HD2 HIS 224 2HD HIS 224 -9.053 -0.988 -4.416 36 HE1 HIS 224 1HE HIS 224 -10.023 3.099 -3.593 37 H ILE 225 H ILE 225 -8.064 -3.642 -0.361 38 HA ILE 225 HA ILE 225 -8.017 -3.146 2.581 39 HB ILE 225 HB ILE 225 -8.279 -5.683 0.979 40 1HG1 ILE 225 1HG1 ILE 225 -9.666 -4.234 3.268 41 2HG1 ILE 225 2HG1 ILE 225 -10.301 -4.716 1.701 42 1HG2 ILE 225 1HG2 ILE 225 -7.370 -5.749 3.872 43 2HG2 ILE 225 2HG2 ILE 225 -7.655 -7.103 2.773 44 3HG2 ILE 225 3HG2 ILE 225 -6.296 -6.051 2.481 45 1HD1 ILE 225 1HD1 ILE 225 -9.630 -6.443 4.072 46 2HD1 ILE 225 2HD1 ILE 225 -11.236 -6.078 3.429 47 3HD1 ILE 225 3HD1 ILE 225 -10.128 -7.105 2.478 48 HA PRO 226 HA PRO 226 -3.791 -2.490 1.470 49 1HB PRO 226 1HB PRO 226 -2.422 -2.655 3.729 50 2HB PRO 226 2HB PRO 226 -3.578 -1.321 3.420 51 1HG PRO 226 1HG PRO 226 -4.005 -3.735 5.169 52 2HG PRO 226 2HG PRO 226 -4.602 -2.064 5.395 53 1HD PRO 226 1HD PRO 226 -6.015 -4.229 4.315 54 2HD PRO 226 2HD PRO 226 -6.531 -2.547 4.156 55 H ASP 227 H ASP 227 -1.672 -3.490 1.500 56 HA ASP 227 HA ASP 227 -1.853 -6.461 1.277 57 1HB ASP 227 1HB ASP 227 -0.826 -5.316 -0.613 58 2HB ASP 227 2HB ASP 227 0.381 -4.592 0.455 59 HA PRO 228 HA PRO 228 0.061 -6.173 5.443 60 1HB PRO 228 1HB PRO 228 -0.324 -8.708 6.292 61 2HB PRO 228 2HB PRO 228 -1.684 -7.552 6.164 62 1HG PRO 228 1HG PRO 228 -0.843 -9.660 4.150 63 2HG PRO 228 2HG PRO 228 -2.481 -9.349 4.805 64 1HD PRO 228 1HD PRO 228 -1.618 -8.329 2.415 65 2HD PRO 228 2HD PRO 228 -2.762 -7.449 3.456 66 H ASP 229 H ASP 229 0.949 -8.103 2.626 67 HA ASP 229 HA ASP 229 3.283 -9.295 3.934 68 1HB ASP 229 1HB ASP 229 1.684 -10.475 2.329 69 2HB ASP 229 2HB ASP 229 2.402 -9.500 1.041 70 H ALA 230 H ALA 230 2.538 -6.388 2.403 71 HA ALA 230 HA ALA 230 4.924 -5.964 0.864 72 1HB ALA 230 1HB ALA 230 2.889 -3.953 1.888 73 2HB ALA 230 2HB ALA 230 4.083 -3.716 0.580 74 3HB ALA 230 3HB ALA 230 2.770 -4.867 0.378 75 H LYS 231 H LYS 231 6.771 -5.922 1.798 76 HA LYS 231 HA LYS 231 7.562 -4.409 4.180 77 1HB LYS 231 1HB LYS 231 9.837 -4.841 3.227 78 2HB LYS 231 2HB LYS 231 8.948 -6.306 3.589 79 1HG LYS 231 1HG LYS 231 8.959 -5.181 0.754 80 2HG LYS 231 2HG LYS 231 10.348 -6.026 1.346 81 1HD LYS 231 1HD LYS 231 7.579 -7.305 1.281 82 2HD LYS 231 2HD LYS 231 8.768 -7.383 -0.018 83 1HE LYS 231 1HE LYS 231 10.400 -8.423 1.481 84 2HE LYS 231 2HE LYS 231 9.248 -8.370 2.826 85 1HZ LYS 231 1HZ LYS 231 8.472 -9.726 0.329 86 2HZ LYS 231 2HZ LYS 231 9.499 -10.460 1.310 87 3HZ LYS 231 3HZ LYS 231 8.008 -10.062 1.873 88 H LYS 232 H LYS 232 8.129 -2.042 4.046 89 HA LYS 232 HA LYS 232 8.281 -0.616 1.761 90 1HB LYS 232 1HB LYS 232 9.791 0.895 2.843 91 2HB LYS 232 2HB LYS 232 8.681 0.279 4.047 92 1HG LYS 232 1HG LYS 232 10.344 -1.214 4.931 93 2HG LYS 232 2HG LYS 232 11.474 -0.866 3.626 94 1HD LYS 232 1HD LYS 232 12.196 0.339 5.573 95 2HD LYS 232 2HD LYS 232 11.707 1.461 4.309 96 1HE LYS 232 1HE LYS 232 10.966 2.211 6.529 97 2HE LYS 232 2HE LYS 232 9.583 1.915 5.472 98 1HZ LYS 232 1HZ LYS 232 10.555 -0.104 7.394 99 2HZ LYS 232 2HZ LYS 232 9.423 1.017 7.781 100 3HZ LYS 232 3HZ LYS 232 9.114 -0.084 6.618 101 HA PRO 233 HA PRO 233 11.741 -1.927 -0.719 102 1HB PRO 233 1HB PRO 233 12.709 0.873 -1.047 103 2HB PRO 233 2HB PRO 233 12.155 -0.266 -2.299 104 1HG PRO 233 1HG PRO 233 10.661 1.891 -1.502 105 2HG PRO 233 2HG PRO 233 9.916 0.368 -2.031 106 1HD PRO 233 1HD PRO 233 10.376 1.382 0.777 107 2HD PRO 233 2HD PRO 233 8.967 0.514 0.091 108 H GLU 234 H GLU 234 14.178 -2.093 -0.760 109 HA GLU 234 HA GLU 234 15.456 -1.429 1.739 110 1HB GLU 234 1HB GLU 234 16.804 -3.114 1.183 111 2HB GLU 234 2HB GLU 234 15.402 -3.579 0.279 112 1HG GLU 234 1HG GLU 234 16.471 -2.603 -1.769 113 2HG GLU 234 2HG GLU 234 17.958 -2.388 -0.826 114 H ASP 235 H ASP 235 15.019 -0.117 -1.363 115 HA ASP 235 HA ASP 235 17.400 1.620 -1.326 116 1HB ASP 235 1HB ASP 235 15.280 0.896 -3.373 117 2HB ASP 235 2HB ASP 235 16.486 2.124 -3.658 118 H TRP 236 H TRP 236 14.417 2.003 0.028 119 HA TRP 236 HA TRP 236 13.303 4.275 -1.145 120 1HB TRP 236 1HB TRP 236 12.248 2.616 0.412 121 2HB TRP 236 2HB TRP 236 13.139 3.320 1.751 122 HD1 TRP 236 HD TRP 236 11.856 5.033 3.043 123 HE1 TRP 236 1HE TRP 236 9.876 6.697 2.626 124 HE3 TRP 236 3HE TRP 236 10.918 3.980 -1.850 125 HZ2 TRP 236 2HZ TRP 236 7.912 7.118 0.595 126 HZ3 TRP 236 3HZ TRP 236 9.017 5.088 -3.028 127 HH2 TRP 236 HH TRP 236 7.546 6.667 -1.808 128 H ASP 237 H ASP 237 13.162 6.479 -0.529 129 HA ASP 237 HA ASP 237 15.579 7.566 0.837 130 1HB ASP 237 1HB ASP 237 13.898 8.898 -1.341 131 2HB ASP 237 2HB ASP 237 15.353 9.519 -0.569 132 H GLU 238 H GLU 238 14.299 7.399 2.908 133 HA GLU 238 HA GLU 238 11.741 8.554 3.200 134 1HB GLU 238 1HB GLU 238 13.931 8.279 5.304 135 2HB GLU 238 2HB GLU 238 12.261 8.737 5.651 136 1HG GLU 238 1HG GLU 238 11.473 6.598 4.635 137 2HG GLU 238 2HG GLU 238 13.177 6.101 4.467 138 H GLU 239 H GLU 239 14.793 10.290 2.918 139 HA GLU 239 HA GLU 239 13.741 12.679 4.242 140 1HB GLU 239 1HB GLU 239 16.231 11.557 3.992 141 2HB GLU 239 2HB GLU 239 16.288 12.805 2.732 142 1HG GLU 239 1HG GLU 239 15.664 14.481 4.388 143 2HG GLU 239 2HG GLU 239 15.409 13.246 5.627 144 H MET 240 H MET 240 13.328 11.268 1.294 145 HA MET 240 HA MET 240 12.863 13.836 -0.163 146 1HB MET 240 1HB MET 240 13.900 11.180 -1.188 147 2HB MET 240 2HB MET 240 13.205 12.392 -2.228 148 1HG MET 240 1HG MET 240 15.040 13.849 -0.676 149 2HG MET 240 2HG MET 240 15.852 12.313 -0.884 150 1HE MET 240 1HE MET 240 16.956 11.504 -3.058 151 2HE MET 240 2HE MET 240 15.317 11.277 -3.699 152 3HE MET 240 3HE MET 240 16.545 12.115 -4.675 153 H ASP 241 H ASP 241 11.869 10.349 -0.265 154 HA ASP 241 HA ASP 241 9.376 11.307 -1.428 155 1HB ASP 241 1HB ASP 241 10.898 8.918 -1.712 156 2HB ASP 241 2HB ASP 241 9.442 8.462 -0.912 157 H GLY 242 H GLY 242 10.406 10.724 1.751 158 1HA GLY 242 1HA GLY 242 9.104 11.358 3.603 159 2HA GLY 242 2HA GLY 242 7.632 11.077 2.668 160 H GLU 243 H GLU 243 6.825 9.935 4.645 161 HA GLU 243 HA GLU 243 7.918 7.347 5.301 162 1HB GLU 243 1HB GLU 243 5.622 9.049 6.109 163 2HB GLU 243 2HB GLU 243 5.179 7.377 5.860 164 1HG GLU 243 1HG GLU 243 7.214 6.751 7.324 165 2HG GLU 243 2HG GLU 243 7.283 8.467 7.751 166 H TRP 244 H TRP 244 7.699 5.587 4.124 167 HA TRP 244 HA TRP 244 6.366 5.442 1.591 168 1HB TRP 244 1HB TRP 244 8.349 4.093 2.270 169 2HB TRP 244 2HB TRP 244 7.404 3.340 3.538 170 HD1 TRP 244 HD TRP 244 7.380 3.610 -0.329 171 HE1 TRP 244 1HE TRP 244 6.552 1.384 -1.288 172 HE3 TRP 244 3HE TRP 244 6.416 1.174 4.042 173 HZ2 TRP 244 2HZ TRP 244 5.459 -1.096 -0.279 174 HZ3 TRP 244 3HZ TRP 244 5.775 -1.226 4.020 175 HH2 TRP 244 HH TRP 244 5.121 -2.301 1.882 176 H GLU 245 H GLU 245 4.530 4.016 1.125 177 HA GLU 245 HA GLU 245 2.709 3.396 3.376 178 1HB GLU 245 1HB GLU 245 2.013 4.695 0.720 179 2HB GLU 245 2HB GLU 245 0.828 3.999 1.830 180 1HG GLU 245 1HG GLU 245 1.099 5.676 3.425 181 2HG GLU 245 2HG GLU 245 2.697 6.156 2.835 182 HA PRO 246 HA PRO 246 3.052 -0.396 1.015 183 1HB PRO 246 1HB PRO 246 1.141 -1.967 2.260 184 2HB PRO 246 2HB PRO 246 2.751 -1.609 2.942 185 1HG PRO 246 1HG PRO 246 0.114 -0.279 3.560 186 2HG PRO 246 2HG PRO 246 1.435 -0.776 4.681 187 1HD PRO 246 1HD PRO 246 1.086 1.812 3.764 188 2HD PRO 246 2HD PRO 246 2.684 1.148 4.203 189 HA PRO 247 HA PRO 247 -0.180 -0.230 -2.064 190 1HB PRO 247 1HB PRO 247 -0.272 -3.108 -2.408 191 2HB PRO 247 2HB PRO 247 0.371 -1.878 -3.521 192 1HG PRO 247 1HG PRO 247 1.966 -3.724 -2.143 193 2HG PRO 247 2HG PRO 247 2.534 -2.139 -2.744 194 1HD PRO 247 1HD PRO 247 1.701 -2.890 0.024 195 2HD PRO 247 2HD PRO 247 2.986 -1.775 -0.529 196 H VAL 248 H VAL 248 -2.267 -1.597 -2.806 197 HA VAL 248 HA VAL 248 -3.626 -2.832 -0.546 198 HB VAL 248 HB VAL 248 -5.663 -1.813 -1.638 199 1HG1 VAL 248 1HG1 VAL 248 -3.555 -0.123 -0.276 200 2HG1 VAL 248 2HG1 VAL 248 -5.247 0.443 -0.508 201 3HG1 VAL 248 3HG1 VAL 248 -4.901 -0.985 0.480 202 1HG2 VAL 248 1HG2 VAL 248 -5.555 0.157 -2.961 203 2HG2 VAL 248 2HG2 VAL 248 -3.793 0.242 -2.834 204 3HG2 VAL 248 3HG2 VAL 248 -4.564 -1.057 -3.774 205 H ILE 249 H ILE 249 -5.587 -3.966 -1.434 206 HA ILE 249 HA ILE 249 -5.088 -5.614 -3.793 207 HB ILE 249 HB ILE 249 -5.209 -7.610 -2.572 208 1HG1 ILE 249 1HG1 ILE 249 -6.089 -6.096 -0.079 209 2HG1 ILE 249 2HG1 ILE 249 -7.104 -7.123 -1.091 210 1HG2 ILE 249 1HG2 ILE 249 -3.623 -5.883 -0.617 211 2HG2 ILE 249 2HG2 ILE 249 -3.372 -7.587 -0.989 212 3HG2 ILE 249 3HG2 ILE 249 -3.019 -6.370 -2.215 213 1HD1 ILE 249 1HD1 ILE 249 -4.842 -8.005 0.728 214 2HD1 ILE 249 2HD1 ILE 249 -6.568 -8.399 0.826 215 3HD1 ILE 249 3HD1 ILE 249 -5.584 -9.068 -0.496 216 H GLN 250 H GLN 250 -7.115 -6.203 -4.708 217 HA GLN 250 HA GLN 250 -9.412 -4.686 -4.204 218 1HB GLN 250 1HB GLN 250 -10.599 -6.264 -5.636 219 2HB GLN 250 2HB GLN 250 -9.040 -5.799 -6.292 220 1HG GLN 250 1HG GLN 250 -8.723 -7.936 -6.738 221 2HG GLN 250 2HG GLN 250 -8.354 -8.162 -5.047 222 1HE2 GLN 250 1HE2 GLN 250 -10.954 -8.288 -3.797 223 2HE2 GLN 250 2HE2 GLN 250 -11.752 -9.670 -4.584 224 H ASN 251 H ASN 251 -11.010 -4.818 -2.707 225 HA ASN 251 HA ASN 251 -10.587 -6.531 -0.396 226 1HB ASN 251 1HB ASN 251 -11.593 -4.270 -0.225 227 2HB ASN 251 2HB ASN 251 -12.986 -4.841 -1.137 228 1HD2 ASN 251 1HD2 ASN 251 -12.956 -3.794 1.634 229 2HD2 ASN 251 2HD2 ASN 251 -13.302 -5.130 2.741 230 HA PRO 252 HA PRO 252 -12.639 -9.866 -2.583 231 1HB PRO 252 1HB PRO 252 -12.476 -11.891 -0.762 232 2HB PRO 252 2HB PRO 252 -11.027 -11.206 -1.579 233 1HG PRO 252 1HG PRO 252 -12.116 -10.451 1.152 234 2HG PRO 252 2HG PRO 252 -10.444 -10.948 0.720 235 1HD PRO 252 1HD PRO 252 -11.137 -8.335 0.880 236 2HD PRO 252 2HD PRO 252 -10.014 -8.909 -0.393 237 H GLU 253 H GLU 253 -14.014 -8.246 0.082 238 HA GLU 253 HA GLU 253 -16.575 -9.784 -0.134 239 1HB GLU 253 1HB GLU 253 -15.204 -10.308 1.849 240 2HB GLU 253 2HB GLU 253 -15.210 -8.604 2.313 241 1HG GLU 253 1HG GLU 253 -17.705 -8.703 2.491 242 2HG GLU 253 2HG GLU 253 -17.645 -10.445 2.131 243 H TYR 254 H TYR 254 -15.048 -6.706 0.756 244 HA TYR 254 HA TYR 254 -15.908 -4.598 1.135 245 1HB TYR 254 1HB TYR 254 -14.972 -4.239 -0.867 246 2HB TYR 254 2HB TYR 254 -15.975 -5.388 -1.727 247 HD1 TYR 254 1HD TYR 254 -16.079 -2.000 -0.034 248 HD2 TYR 254 2HD TYR 254 -17.793 -4.665 -2.976 249 HE1 TYR 254 1HE TYR 254 -17.755 -0.272 -0.637 250 HE2 TYR 254 2HE TYR 254 -19.429 -2.940 -3.613 251 HH TYR 254 HH TYR 254 -20.525 -1.100 -2.538 252 H LYS 255 H LYS 255 -17.558 -4.510 2.663 253 HA LYS 255 HA LYS 255 -20.260 -4.220 1.560 254 1HB LYS 255 1HB LYS 255 -19.797 -6.596 2.546 255 2HB LYS 255 2HB LYS 255 -19.746 -5.800 4.104 256 1HG LYS 255 1HG LYS 255 -21.968 -6.248 4.030 257 2HG LYS 255 2HG LYS 255 -22.048 -4.689 3.201 258 1HD LYS 255 1HD LYS 255 -21.611 -6.257 1.030 259 2HD LYS 255 2HD LYS 255 -22.231 -7.501 2.113 260 1HE LYS 255 1HE LYS 255 -24.135 -6.802 0.990 261 2HE LYS 255 2HE LYS 255 -24.230 -5.908 2.516 262 1HZ LYS 255 1HZ LYS 255 -24.692 -4.489 0.662 263 2HZ LYS 255 2HZ LYS 255 -23.299 -3.986 1.325 264 3HZ LYS 255 3HZ LYS 255 -23.238 -4.858 -0.067 265 H GLY 256 H GLY 256 -20.232 -1.988 1.825 266 1HA GLY 256 1HA GLY 256 -20.496 -0.990 4.537 267 2HA GLY 256 2HA GLY 256 -19.241 -0.237 3.516
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