USER MOD reduce.3.24.130724 H: found=0, std=0, add=591, rem=0, adj=11 USER MOD reduce.3.24.130724 removed 593 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 175 TYR OH : rot 13:sc= 0.305 USER MOD Single : A 176 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 191 GLN : amide:sc= 0 X(o=0,f=-0.19) USER MOD Single : A 194 TYR OH : rot -87:sc= 0.292 USER MOD Single : A 196 THR OG1 : rot 180:sc= 0 USER MOD Single : A 209 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00044) USER MOD Single : A 213 MET CE :methyl 141:sc= -0.305 (180deg=-2.35!) USER MOD Single : A 214 THR OG1 : rot -31:sc= 0.595 USER MOD Single : A 227 THR OG1 : rot 111:sc= 0.268 USER MOD Single : A 228 GLN : amide:sc= -0.0613 K(o=-0.061,f=-7.1!) USER MOD Single : A 232 LYS NZ :NH3+ -172:sc=-0.00546 (180deg=-0.0942) USER MOD Single : A 236 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 238 LYS NZ :NH3+ 160:sc= 1.23 (180deg=0.838) USER MOD Single : A 250 TYR OH : rot 180:sc= -2.53! USER MOD Single : A 256 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 32 N ASP A 169 -6.861 12.853 -0.108 1.00 31.24 N ATOM 33 CA ASP A 169 -5.441 13.139 -0.422 1.00 2.32 C ATOM 34 C ASP A 169 -4.819 11.976 -1.199 1.00 73.33 C ATOM 35 O ASP A 169 -4.104 12.167 -2.194 1.00 61.12 O ATOM 36 CB ASP A 169 -4.657 13.396 0.887 1.00 21.25 C ATOM 37 CG ASP A 169 -3.159 13.665 0.655 1.00 53.04 C ATOM 38 OD1 ASP A 169 -2.818 14.738 0.115 1.00 43.10 O ATOM 39 OD2 ASP A 169 -2.311 12.808 1.026 1.00 15.22 O ATOM 0 HA ASP A 169 -5.390 14.031 -1.046 1.00 2.32 H new ATOM 0 HB2 ASP A 169 -5.097 14.249 1.404 1.00 21.25 H new ATOM 0 HB3 ASP A 169 -4.767 12.533 1.544 1.00 21.25 H new ATOM 44 N VAL A 170 -5.112 10.775 -0.713 1.00 43.22 N ATOM 45 CA VAL A 170 -4.720 9.510 -1.345 1.00 64.23 C ATOM 46 C VAL A 170 -5.979 8.800 -1.879 1.00 65.55 C ATOM 47 O VAL A 170 -7.106 9.172 -1.508 1.00 53.22 O ATOM 48 CB VAL A 170 -3.975 8.594 -0.307 1.00 35.41 C ATOM 49 CG1 VAL A 170 -2.721 9.300 0.259 1.00 52.30 C ATOM 50 CG2 VAL A 170 -4.905 8.138 0.838 1.00 62.22 C ATOM 0 H VAL A 170 -5.640 10.645 0.150 1.00 43.22 H new ATOM 0 HA VAL A 170 -4.041 9.712 -2.173 1.00 64.23 H new ATOM 0 HB VAL A 170 -3.656 7.701 -0.844 1.00 35.41 H new ATOM 0 HG11 VAL A 170 -2.226 8.643 0.974 1.00 52.30 H new ATOM 0 HG12 VAL A 170 -2.035 9.532 -0.556 1.00 52.30 H new ATOM 0 HG13 VAL A 170 -3.017 10.223 0.758 1.00 52.30 H new ATOM 0 HG21 VAL A 170 -4.347 7.508 1.531 1.00 62.22 H new ATOM 0 HG22 VAL A 170 -5.285 9.011 1.368 1.00 62.22 H new ATOM 0 HG23 VAL A 170 -5.740 7.573 0.425 1.00 62.22 H new ATOM 60 N ILE A 171 -5.803 7.799 -2.757 1.00 60.14 N ATOM 61 CA ILE A 171 -6.914 6.902 -3.133 1.00 74.12 C ATOM 62 C ILE A 171 -6.929 5.718 -2.153 1.00 22.13 C ATOM 63 O ILE A 171 -5.866 5.299 -1.661 1.00 31.03 O ATOM 64 CB ILE A 171 -6.839 6.399 -4.630 1.00 75.00 C ATOM 65 CG1 ILE A 171 -8.100 5.543 -4.998 1.00 0.13 C ATOM 66 CG2 ILE A 171 -5.537 5.624 -4.916 1.00 62.31 C ATOM 67 CD1 ILE A 171 -8.197 5.147 -6.456 1.00 51.42 C ATOM 0 H ILE A 171 -4.916 7.590 -3.216 1.00 60.14 H new ATOM 0 HA ILE A 171 -7.843 7.468 -3.069 1.00 74.12 H new ATOM 0 HB ILE A 171 -6.830 7.283 -5.267 1.00 75.00 H new ATOM 0 HG12 ILE A 171 -8.097 4.638 -4.390 1.00 0.13 H new ATOM 0 HG13 ILE A 171 -8.994 6.105 -4.729 1.00 0.13 H new ATOM 0 HG21 ILE A 171 -5.529 5.298 -5.956 1.00 62.31 H new ATOM 0 HG22 ILE A 171 -4.680 6.272 -4.732 1.00 62.31 H new ATOM 0 HG23 ILE A 171 -5.481 4.754 -4.262 1.00 62.31 H new ATOM 0 HD11 ILE A 171 -9.101 4.558 -6.614 1.00 51.42 H new ATOM 0 HD12 ILE A 171 -8.236 6.044 -7.075 1.00 51.42 H new ATOM 0 HD13 ILE A 171 -7.325 4.554 -6.731 1.00 51.42 H new ATOM 79 N ASP A 172 -8.146 5.226 -1.845 1.00 61.13 N ATOM 80 CA ASP A 172 -8.361 4.116 -0.916 1.00 61.43 C ATOM 81 C ASP A 172 -7.618 2.851 -1.390 1.00 10.05 C ATOM 82 O ASP A 172 -7.820 2.373 -2.517 1.00 51.15 O ATOM 83 CB ASP A 172 -9.873 3.819 -0.762 1.00 1.24 C ATOM 84 CG ASP A 172 -10.155 2.697 0.250 1.00 74.45 C ATOM 85 OD1 ASP A 172 -9.987 2.939 1.465 1.00 51.43 O ATOM 86 OD2 ASP A 172 -10.555 1.581 -0.157 1.00 55.15 O ATOM 0 H ASP A 172 -9.010 5.596 -2.241 1.00 61.13 H new ATOM 0 HA ASP A 172 -7.961 4.408 0.055 1.00 61.43 H new ATOM 0 HB2 ASP A 172 -10.387 4.726 -0.445 1.00 1.24 H new ATOM 0 HB3 ASP A 172 -10.285 3.541 -1.732 1.00 1.24 H new ATOM 91 N ALA A 173 -6.741 2.348 -0.525 1.00 21.14 N ATOM 92 CA ALA A 173 -6.010 1.098 -0.720 1.00 55.33 C ATOM 93 C ALA A 173 -6.034 0.315 0.590 1.00 14.10 C ATOM 94 O ALA A 173 -6.155 0.909 1.675 1.00 62.15 O ATOM 95 CB ALA A 173 -4.573 1.376 -1.181 1.00 42.51 C ATOM 0 H ALA A 173 -6.513 2.811 0.355 1.00 21.14 H new ATOM 0 HA ALA A 173 -6.485 0.506 -1.502 1.00 55.33 H new ATOM 0 HB1 ALA A 173 -4.046 0.432 -1.320 1.00 42.51 H new ATOM 0 HB2 ALA A 173 -4.593 1.923 -2.124 1.00 42.51 H new ATOM 0 HB3 ALA A 173 -4.058 1.971 -0.427 1.00 42.51 H new ATOM 101 N ASP A 174 -5.898 -1.008 0.488 1.00 61.23 N ATOM 102 CA ASP A 174 -5.936 -1.930 1.637 1.00 34.43 C ATOM 103 C ASP A 174 -5.118 -3.181 1.312 1.00 71.42 C ATOM 104 O ASP A 174 -4.999 -3.551 0.140 1.00 41.24 O ATOM 105 CB ASP A 174 -7.406 -2.298 1.975 1.00 42.12 C ATOM 106 CG ASP A 174 -7.557 -3.283 3.153 1.00 54.23 C ATOM 107 OD1 ASP A 174 -6.806 -3.162 4.150 1.00 20.42 O ATOM 108 OD2 ASP A 174 -8.433 -4.176 3.098 1.00 54.13 O ATOM 0 H ASP A 174 -5.756 -1.481 -0.405 1.00 61.23 H new ATOM 0 HA ASP A 174 -5.500 -1.446 2.511 1.00 34.43 H new ATOM 0 HB2 ASP A 174 -7.953 -1.384 2.208 1.00 42.12 H new ATOM 0 HB3 ASP A 174 -7.872 -2.732 1.091 1.00 42.12 H new ATOM 113 N TYR A 175 -4.549 -3.820 2.343 1.00 24.21 N ATOM 114 CA TYR A 175 -3.810 -5.070 2.184 1.00 41.20 C ATOM 115 C TYR A 175 -4.283 -6.112 3.179 1.00 64.42 C ATOM 116 O TYR A 175 -5.073 -5.823 4.091 1.00 61.30 O ATOM 117 CB TYR A 175 -2.277 -4.840 2.303 1.00 31.02 C ATOM 118 CG TYR A 175 -1.693 -4.413 3.663 1.00 44.13 C ATOM 119 CD1 TYR A 175 -1.071 -3.182 3.822 1.00 22.22 C ATOM 120 CD2 TYR A 175 -1.684 -5.274 4.768 1.00 44.20 C ATOM 121 CE1 TYR A 175 -0.468 -2.825 5.005 1.00 52.30 C ATOM 122 CE2 TYR A 175 -1.098 -4.917 5.959 1.00 12.24 C ATOM 123 CZ TYR A 175 -0.480 -3.698 6.075 1.00 71.41 C ATOM 124 OH TYR A 175 0.148 -3.355 7.257 1.00 33.14 O ATOM 0 H TYR A 175 -4.590 -3.483 3.305 1.00 24.21 H new ATOM 0 HA TYR A 175 -4.010 -5.447 1.181 1.00 41.20 H new ATOM 0 HB2 TYR A 175 -1.781 -5.764 2.007 1.00 31.02 H new ATOM 0 HB3 TYR A 175 -2.000 -4.081 1.572 1.00 31.02 H new ATOM 0 HD1 TYR A 175 -1.061 -2.487 2.995 1.00 22.22 H new ATOM 0 HD2 TYR A 175 -2.150 -6.244 4.682 1.00 44.20 H new ATOM 0 HE1 TYR A 175 0.014 -1.863 5.097 1.00 52.30 H new ATOM 0 HE2 TYR A 175 -1.124 -5.594 6.800 1.00 12.24 H new ATOM 0 HH TYR A 175 0.368 -2.400 7.245 1.00 33.14 H new ATOM 134 N LYS A 176 -3.744 -7.328 3.015 1.00 73.44 N ATOM 135 CA LYS A 176 -3.963 -8.454 3.923 1.00 1.51 C ATOM 136 C LYS A 176 -2.637 -9.210 4.121 1.00 30.21 C ATOM 137 O LYS A 176 -1.836 -9.294 3.174 1.00 22.02 O ATOM 138 CB LYS A 176 -5.080 -9.410 3.409 1.00 45.52 C ATOM 139 CG LYS A 176 -6.490 -8.770 3.379 1.00 24.33 C ATOM 140 CD LYS A 176 -7.638 -9.801 3.425 1.00 4.45 C ATOM 141 CE LYS A 176 -9.020 -9.125 3.488 1.00 23.02 C ATOM 142 NZ LYS A 176 -10.126 -10.118 3.544 1.00 63.12 N ATOM 0 H LYS A 176 -3.132 -7.557 2.231 1.00 73.44 H new ATOM 0 HA LYS A 176 -4.306 -8.063 4.881 1.00 1.51 H new ATOM 0 HB2 LYS A 176 -4.823 -9.746 2.404 1.00 45.52 H new ATOM 0 HB3 LYS A 176 -5.107 -10.295 4.044 1.00 45.52 H new ATOM 0 HG2 LYS A 176 -6.589 -8.090 4.225 1.00 24.33 H new ATOM 0 HG3 LYS A 176 -6.588 -8.170 2.475 1.00 24.33 H new ATOM 0 HD2 LYS A 176 -7.587 -10.440 2.543 1.00 4.45 H new ATOM 0 HD3 LYS A 176 -7.511 -10.447 4.294 1.00 4.45 H new ATOM 0 HE2 LYS A 176 -9.068 -8.480 4.365 1.00 23.02 H new ATOM 0 HE3 LYS A 176 -9.151 -8.486 2.615 1.00 23.02 H new ATOM 0 HZ1 LYS A 176 -11.038 -9.620 3.585 1.00 63.12 H new ATOM 0 HZ2 LYS A 176 -10.097 -10.718 2.695 1.00 63.12 H new ATOM 0 HZ3 LYS A 176 -10.017 -10.712 4.391 1.00 63.12 H new ATOM 156 N PRO A 177 -2.378 -9.749 5.361 1.00 71.31 N ATOM 157 CA PRO A 177 -1.151 -10.524 5.672 1.00 24.52 C ATOM 158 C PRO A 177 -0.955 -11.718 4.705 1.00 62.21 C ATOM 159 O PRO A 177 -1.650 -12.738 4.799 1.00 52.20 O ATOM 160 CB PRO A 177 -1.373 -11.000 7.142 1.00 60.55 C ATOM 161 CG PRO A 177 -2.845 -10.822 7.399 1.00 63.31 C ATOM 162 CD PRO A 177 -3.244 -9.622 6.574 1.00 42.04 C ATOM 0 HA PRO A 177 -0.245 -9.929 5.556 1.00 24.52 H new ATOM 0 HB2 PRO A 177 -1.075 -12.041 7.268 1.00 60.55 H new ATOM 0 HB3 PRO A 177 -0.778 -10.411 7.840 1.00 60.55 H new ATOM 0 HG2 PRO A 177 -3.407 -11.708 7.104 1.00 63.31 H new ATOM 0 HG3 PRO A 177 -3.044 -10.656 8.458 1.00 63.31 H new ATOM 0 HD2 PRO A 177 -4.303 -9.642 6.318 1.00 42.04 H new ATOM 0 HD3 PRO A 177 -3.062 -8.688 7.105 1.00 42.04 H new ATOM 170 N ALA A 178 -0.016 -11.551 3.754 1.00 63.03 N ATOM 171 CA ALA A 178 0.292 -12.557 2.716 1.00 65.51 C ATOM 172 C ALA A 178 0.948 -13.802 3.323 1.00 34.31 C ATOM 173 O ALA A 178 0.924 -14.884 2.723 1.00 74.41 O ATOM 174 CB ALA A 178 1.192 -11.947 1.637 1.00 60.23 C ATOM 0 H ALA A 178 0.555 -10.709 3.683 1.00 63.03 H new ATOM 0 HA ALA A 178 -0.647 -12.867 2.258 1.00 65.51 H new ATOM 0 HB1 ALA A 178 1.411 -12.699 0.879 1.00 60.23 H new ATOM 0 HB2 ALA A 178 0.683 -11.102 1.174 1.00 60.23 H new ATOM 0 HB3 ALA A 178 2.123 -11.606 2.090 1.00 60.23 H new ATOM 285 N GLN A 191 3.916 4.356 14.996 1.00 75.13 N ATOM 286 CA GLN A 191 2.590 3.971 14.465 1.00 70.12 C ATOM 287 C GLN A 191 2.653 3.974 12.931 1.00 11.15 C ATOM 288 O GLN A 191 2.246 3.007 12.257 1.00 11.23 O ATOM 289 CB GLN A 191 1.502 4.965 14.951 1.00 63.33 C ATOM 290 CG GLN A 191 1.399 5.114 16.484 1.00 20.15 C ATOM 291 CD GLN A 191 0.451 6.226 16.933 1.00 3.11 C ATOM 292 OE1 GLN A 191 -0.533 6.539 16.262 1.00 73.24 O ATOM 293 NE2 GLN A 191 0.740 6.829 18.072 1.00 31.20 N ATOM 0 HA GLN A 191 2.330 2.976 14.825 1.00 70.12 H new ATOM 0 HB2 GLN A 191 1.705 5.944 14.518 1.00 63.33 H new ATOM 0 HB3 GLN A 191 0.535 4.640 14.566 1.00 63.33 H new ATOM 0 HG2 GLN A 191 1.063 4.169 16.910 1.00 20.15 H new ATOM 0 HG3 GLN A 191 2.392 5.311 16.888 1.00 20.15 H new ATOM 0 HE21 GLN A 191 1.563 6.546 18.604 1.00 31.20 H new ATOM 0 HE22 GLN A 191 0.140 7.578 18.419 1.00 31.20 H new ATOM 302 N ASP A 192 3.186 5.085 12.403 1.00 4.14 N ATOM 303 CA ASP A 192 3.340 5.316 10.965 1.00 70.53 C ATOM 304 C ASP A 192 4.531 4.519 10.414 1.00 41.03 C ATOM 305 O ASP A 192 5.523 4.269 11.117 1.00 61.33 O ATOM 306 CB ASP A 192 3.567 6.825 10.685 1.00 51.44 C ATOM 307 CG ASP A 192 2.392 7.725 11.079 1.00 15.14 C ATOM 308 OD1 ASP A 192 2.089 7.829 12.288 1.00 64.43 O ATOM 309 OD2 ASP A 192 1.789 8.362 10.195 1.00 35.52 O ATOM 0 H ASP A 192 3.527 5.858 12.974 1.00 4.14 H new ATOM 0 HA ASP A 192 2.427 4.985 10.470 1.00 70.53 H new ATOM 0 HB2 ASP A 192 4.456 7.152 11.224 1.00 51.44 H new ATOM 0 HB3 ASP A 192 3.771 6.958 9.623 1.00 51.44 H new ATOM 314 N LEU A 193 4.412 4.153 9.148 1.00 41.22 N ATOM 315 CA LEU A 193 5.478 3.539 8.348 1.00 50.10 C ATOM 316 C LEU A 193 5.511 4.251 6.996 1.00 21.41 C ATOM 317 O LEU A 193 4.464 4.593 6.460 1.00 2.55 O ATOM 318 CB LEU A 193 5.238 2.004 8.184 1.00 24.23 C ATOM 319 CG LEU A 193 5.600 1.123 9.419 1.00 55.15 C ATOM 320 CD1 LEU A 193 5.238 -0.363 9.203 1.00 61.23 C ATOM 321 CD2 LEU A 193 7.089 1.281 9.770 1.00 74.13 C ATOM 0 H LEU A 193 3.545 4.276 8.625 1.00 41.22 H new ATOM 0 HA LEU A 193 6.441 3.649 8.847 1.00 50.10 H new ATOM 0 HB2 LEU A 193 4.187 1.844 7.943 1.00 24.23 H new ATOM 0 HB3 LEU A 193 5.818 1.654 7.330 1.00 24.23 H new ATOM 0 HG LEU A 193 5.001 1.475 10.259 1.00 55.15 H new ATOM 0 HD11 LEU A 193 5.509 -0.936 10.090 1.00 61.23 H new ATOM 0 HD12 LEU A 193 4.166 -0.454 9.025 1.00 61.23 H new ATOM 0 HD13 LEU A 193 5.783 -0.749 8.341 1.00 61.23 H new ATOM 0 HD21 LEU A 193 7.327 0.660 10.634 1.00 74.13 H new ATOM 0 HD22 LEU A 193 7.698 0.970 8.921 1.00 74.13 H new ATOM 0 HD23 LEU A 193 7.299 2.325 10.004 1.00 74.13 H new ATOM 333 N TYR A 194 6.715 4.520 6.475 1.00 23.12 N ATOM 334 CA TYR A 194 6.902 5.261 5.213 1.00 55.11 C ATOM 335 C TYR A 194 7.820 4.463 4.283 1.00 73.50 C ATOM 336 O TYR A 194 8.937 4.103 4.675 1.00 25.45 O ATOM 337 CB TYR A 194 7.485 6.675 5.490 1.00 2.15 C ATOM 338 CG TYR A 194 6.576 7.553 6.358 1.00 35.12 C ATOM 339 CD1 TYR A 194 6.820 7.734 7.720 1.00 44.23 C ATOM 340 CD2 TYR A 194 5.452 8.186 5.812 1.00 5.12 C ATOM 341 CE1 TYR A 194 5.978 8.494 8.503 1.00 31.02 C ATOM 342 CE2 TYR A 194 4.609 8.953 6.594 1.00 64.33 C ATOM 343 CZ TYR A 194 4.880 9.111 7.937 1.00 34.10 C ATOM 344 OH TYR A 194 4.031 9.858 8.729 1.00 24.12 O ATOM 0 H TYR A 194 7.589 4.232 6.914 1.00 23.12 H new ATOM 0 HA TYR A 194 5.935 5.391 4.727 1.00 55.11 H new ATOM 0 HB2 TYR A 194 8.452 6.570 5.981 1.00 2.15 H new ATOM 0 HB3 TYR A 194 7.663 7.178 4.540 1.00 2.15 H new ATOM 0 HD1 TYR A 194 7.685 7.270 8.169 1.00 44.23 H new ATOM 0 HD2 TYR A 194 5.240 8.072 4.759 1.00 5.12 H new ATOM 0 HE1 TYR A 194 6.177 8.607 9.559 1.00 31.02 H new ATOM 0 HE2 TYR A 194 3.743 9.426 6.156 1.00 64.33 H new ATOM 0 HH TYR A 194 3.354 9.272 9.126 1.00 24.12 H new ATOM 354 N ALA A 195 7.341 4.192 3.062 1.00 40.25 N ATOM 355 CA ALA A 195 8.045 3.362 2.075 1.00 3.14 C ATOM 356 C ALA A 195 7.485 3.602 0.662 1.00 45.43 C ATOM 357 O ALA A 195 6.473 4.294 0.478 1.00 40.13 O ATOM 358 CB ALA A 195 7.935 1.872 2.471 1.00 11.52 C ATOM 0 H ALA A 195 6.445 4.546 2.728 1.00 40.25 H new ATOM 0 HA ALA A 195 9.098 3.642 2.064 1.00 3.14 H new ATOM 0 HB1 ALA A 195 8.459 1.261 1.736 1.00 11.52 H new ATOM 0 HB2 ALA A 195 8.384 1.722 3.453 1.00 11.52 H new ATOM 0 HB3 ALA A 195 6.885 1.581 2.503 1.00 11.52 H new ATOM 364 N THR A 196 8.166 3.033 -0.341 1.00 15.23 N ATOM 365 CA THR A 196 7.714 3.042 -1.741 1.00 2.22 C ATOM 366 C THR A 196 7.193 1.651 -2.133 1.00 35.43 C ATOM 367 O THR A 196 7.668 0.632 -1.614 1.00 13.24 O ATOM 368 CB THR A 196 8.870 3.486 -2.688 1.00 51.22 C ATOM 369 OG1 THR A 196 10.082 2.787 -2.344 1.00 55.23 O ATOM 370 CG2 THR A 196 9.109 5.010 -2.637 1.00 32.12 C ATOM 0 H THR A 196 9.053 2.549 -0.204 1.00 15.23 H new ATOM 0 HA THR A 196 6.901 3.760 -1.843 1.00 2.22 H new ATOM 0 HB THR A 196 8.575 3.234 -3.707 1.00 51.22 H new ATOM 0 HG1 THR A 196 10.804 3.069 -2.944 1.00 55.23 H new ATOM 0 HG21 THR A 196 9.923 5.273 -3.312 1.00 32.12 H new ATOM 0 HG22 THR A 196 8.201 5.531 -2.942 1.00 32.12 H new ATOM 0 HG23 THR A 196 9.372 5.303 -1.621 1.00 32.12 H new ATOM 378 N LEU A 197 6.228 1.627 -3.059 1.00 23.50 N ATOM 379 CA LEU A 197 5.541 0.405 -3.498 1.00 1.35 C ATOM 380 C LEU A 197 5.858 0.130 -4.971 1.00 24.23 C ATOM 381 O LEU A 197 5.552 0.958 -5.835 1.00 54.35 O ATOM 382 CB LEU A 197 4.009 0.568 -3.305 1.00 61.10 C ATOM 383 CG LEU A 197 3.135 -0.682 -3.651 1.00 13.54 C ATOM 384 CD1 LEU A 197 3.515 -1.886 -2.770 1.00 44.43 C ATOM 385 CD2 LEU A 197 1.634 -0.353 -3.542 1.00 14.32 C ATOM 0 H LEU A 197 5.897 2.468 -3.532 1.00 23.50 H new ATOM 0 HA LEU A 197 5.888 -0.437 -2.899 1.00 1.35 H new ATOM 0 HB2 LEU A 197 3.821 0.841 -2.267 1.00 61.10 H new ATOM 0 HB3 LEU A 197 3.673 1.403 -3.920 1.00 61.10 H new ATOM 0 HG LEU A 197 3.337 -0.958 -4.686 1.00 13.54 H new ATOM 0 HD11 LEU A 197 2.891 -2.740 -3.033 1.00 44.43 H new ATOM 0 HD12 LEU A 197 4.563 -2.139 -2.931 1.00 44.43 H new ATOM 0 HD13 LEU A 197 3.360 -1.633 -1.721 1.00 44.43 H new ATOM 0 HD21 LEU A 197 1.049 -1.239 -3.788 1.00 14.32 H new ATOM 0 HD22 LEU A 197 1.404 -0.037 -2.525 1.00 14.32 H new ATOM 0 HD23 LEU A 197 1.386 0.450 -4.237 1.00 14.32 H new ATOM 397 N ASP A 198 6.487 -1.020 -5.253 1.00 74.31 N ATOM 398 CA ASP A 198 6.764 -1.461 -6.631 1.00 52.24 C ATOM 399 C ASP A 198 5.522 -2.158 -7.200 1.00 52.32 C ATOM 400 O ASP A 198 5.053 -3.164 -6.643 1.00 32.35 O ATOM 401 CB ASP A 198 7.980 -2.423 -6.678 1.00 24.00 C ATOM 402 CG ASP A 198 9.279 -1.748 -6.221 1.00 74.10 C ATOM 403 OD1 ASP A 198 9.592 -1.791 -5.014 1.00 74.20 O ATOM 404 OD2 ASP A 198 9.981 -1.148 -7.060 1.00 5.54 O ATOM 0 H ASP A 198 6.817 -1.668 -4.538 1.00 74.31 H new ATOM 0 HA ASP A 198 7.006 -0.586 -7.234 1.00 52.24 H new ATOM 0 HB2 ASP A 198 7.781 -3.287 -6.044 1.00 24.00 H new ATOM 0 HB3 ASP A 198 8.106 -2.796 -7.695 1.00 24.00 H new ATOM 409 N VAL A 199 4.983 -1.607 -8.291 1.00 40.45 N ATOM 410 CA VAL A 199 3.817 -2.164 -8.994 1.00 43.21 C ATOM 411 C VAL A 199 4.087 -2.184 -10.513 1.00 31.41 C ATOM 412 O VAL A 199 4.431 -1.153 -11.083 1.00 51.34 O ATOM 413 CB VAL A 199 2.497 -1.363 -8.659 1.00 23.25 C ATOM 414 CG1 VAL A 199 2.666 0.156 -8.884 1.00 72.43 C ATOM 415 CG2 VAL A 199 1.286 -1.929 -9.449 1.00 75.24 C ATOM 0 H VAL A 199 5.345 -0.754 -8.717 1.00 40.45 H new ATOM 0 HA VAL A 199 3.662 -3.186 -8.649 1.00 43.21 H new ATOM 0 HB VAL A 199 2.295 -1.500 -7.597 1.00 23.25 H new ATOM 0 HG11 VAL A 199 1.734 0.666 -8.641 1.00 72.43 H new ATOM 0 HG12 VAL A 199 3.463 0.532 -8.243 1.00 72.43 H new ATOM 0 HG13 VAL A 199 2.921 0.343 -9.927 1.00 72.43 H new ATOM 0 HG21 VAL A 199 0.391 -1.360 -9.200 1.00 75.24 H new ATOM 0 HG22 VAL A 199 1.480 -1.850 -10.519 1.00 75.24 H new ATOM 0 HG23 VAL A 199 1.136 -2.976 -9.184 1.00 75.24 H new ATOM 425 N PRO A 200 3.999 -3.378 -11.190 1.00 73.14 N ATOM 426 CA PRO A 200 4.059 -3.467 -12.664 1.00 33.20 C ATOM 427 C PRO A 200 2.939 -2.648 -13.322 1.00 54.02 C ATOM 428 O PRO A 200 1.802 -2.652 -12.829 1.00 61.12 O ATOM 429 CB PRO A 200 3.893 -4.982 -12.955 1.00 63.41 C ATOM 430 CG PRO A 200 4.318 -5.657 -11.684 1.00 70.45 C ATOM 431 CD PRO A 200 3.873 -4.727 -10.577 1.00 33.03 C ATOM 0 HA PRO A 200 4.987 -3.062 -13.068 1.00 33.20 H new ATOM 0 HB2 PRO A 200 2.862 -5.227 -13.209 1.00 63.41 H new ATOM 0 HB3 PRO A 200 4.511 -5.295 -13.797 1.00 63.41 H new ATOM 0 HG2 PRO A 200 3.854 -6.639 -11.585 1.00 70.45 H new ATOM 0 HG3 PRO A 200 5.397 -5.810 -11.661 1.00 70.45 H new ATOM 0 HD2 PRO A 200 2.849 -4.933 -10.266 1.00 33.03 H new ATOM 0 HD3 PRO A 200 4.501 -4.826 -9.692 1.00 33.03 H new ATOM 439 N ALA A 201 3.285 -1.957 -14.429 1.00 33.23 N ATOM 440 CA ALA A 201 2.353 -1.118 -15.207 1.00 64.44 C ATOM 441 C ALA A 201 1.019 -1.845 -15.548 1.00 61.23 C ATOM 442 O ALA A 201 -0.034 -1.255 -15.307 1.00 4.53 O ATOM 443 CB ALA A 201 3.031 -0.563 -16.471 1.00 22.33 C ATOM 0 H ALA A 201 4.231 -1.967 -14.811 1.00 33.23 H new ATOM 0 HA ALA A 201 2.084 -0.278 -14.567 1.00 64.44 H new ATOM 0 HB1 ALA A 201 2.321 0.051 -17.025 1.00 22.33 H new ATOM 0 HB2 ALA A 201 3.891 0.043 -16.186 1.00 22.33 H new ATOM 0 HB3 ALA A 201 3.362 -1.390 -17.099 1.00 22.33 H new ATOM 449 N PRO A 202 1.023 -3.139 -16.068 1.00 35.11 N ATOM 450 CA PRO A 202 -0.239 -3.901 -16.319 1.00 14.42 C ATOM 451 C PRO A 202 -1.129 -4.030 -15.059 1.00 31.34 C ATOM 452 O PRO A 202 -2.334 -3.785 -15.142 1.00 65.12 O ATOM 453 CB PRO A 202 0.257 -5.285 -16.833 1.00 64.12 C ATOM 454 CG PRO A 202 1.695 -5.362 -16.412 1.00 52.33 C ATOM 455 CD PRO A 202 2.206 -3.952 -16.508 1.00 11.43 C ATOM 0 HA PRO A 202 -0.885 -3.393 -17.035 1.00 14.42 H new ATOM 0 HB2 PRO A 202 -0.325 -6.099 -16.400 1.00 64.12 H new ATOM 0 HB3 PRO A 202 0.158 -5.363 -17.916 1.00 64.12 H new ATOM 0 HG2 PRO A 202 1.789 -5.747 -15.397 1.00 52.33 H new ATOM 0 HG3 PRO A 202 2.260 -6.031 -17.060 1.00 52.33 H new ATOM 0 HD2 PRO A 202 3.070 -3.790 -15.864 1.00 11.43 H new ATOM 0 HD3 PRO A 202 2.514 -3.702 -17.523 1.00 11.43 H new ATOM 463 N ILE A 203 -0.516 -4.371 -13.900 1.00 62.10 N ATOM 464 CA ILE A 203 -1.236 -4.537 -12.610 1.00 3.52 C ATOM 465 C ILE A 203 -1.820 -3.186 -12.121 1.00 33.24 C ATOM 466 O ILE A 203 -2.883 -3.151 -11.497 1.00 33.21 O ATOM 467 CB ILE A 203 -0.296 -5.173 -11.504 1.00 65.43 C ATOM 468 CG1 ILE A 203 0.169 -6.598 -11.951 1.00 21.25 C ATOM 469 CG2 ILE A 203 -0.981 -5.223 -10.106 1.00 51.12 C ATOM 470 CD1 ILE A 203 0.985 -7.366 -10.925 1.00 1.05 C ATOM 0 H ILE A 203 0.488 -4.539 -13.831 1.00 62.10 H new ATOM 0 HA ILE A 203 -2.064 -5.224 -12.782 1.00 3.52 H new ATOM 0 HB ILE A 203 0.578 -4.529 -11.402 1.00 65.43 H new ATOM 0 HG12 ILE A 203 -0.712 -7.187 -12.205 1.00 21.25 H new ATOM 0 HG13 ILE A 203 0.760 -6.500 -12.862 1.00 21.25 H new ATOM 0 HG21 ILE A 203 -0.298 -5.667 -9.382 1.00 51.12 H new ATOM 0 HG22 ILE A 203 -1.238 -4.212 -9.790 1.00 51.12 H new ATOM 0 HG23 ILE A 203 -1.887 -5.826 -10.166 1.00 51.12 H new ATOM 0 HD11 ILE A 203 1.257 -8.340 -11.332 1.00 1.05 H new ATOM 0 HD12 ILE A 203 1.889 -6.806 -10.687 1.00 1.05 H new ATOM 0 HD13 ILE A 203 0.394 -7.504 -10.019 1.00 1.05 H new ATOM 482 N ALA A 204 -1.124 -2.088 -12.441 1.00 54.31 N ATOM 483 CA ALA A 204 -1.549 -0.723 -12.071 1.00 52.22 C ATOM 484 C ALA A 204 -2.773 -0.267 -12.899 1.00 31.22 C ATOM 485 O ALA A 204 -3.672 0.399 -12.375 1.00 71.24 O ATOM 486 CB ALA A 204 -0.371 0.241 -12.248 1.00 11.14 C ATOM 0 H ALA A 204 -0.249 -2.116 -12.964 1.00 54.31 H new ATOM 0 HA ALA A 204 -1.856 -0.723 -11.025 1.00 52.22 H new ATOM 0 HB1 ALA A 204 -0.682 1.250 -11.976 1.00 11.14 H new ATOM 0 HB2 ALA A 204 0.453 -0.070 -11.606 1.00 11.14 H new ATOM 0 HB3 ALA A 204 -0.045 0.230 -13.288 1.00 11.14 H new ATOM 492 N VAL A 205 -2.795 -0.647 -14.193 1.00 41.14 N ATOM 493 CA VAL A 205 -3.871 -0.279 -15.136 1.00 30.31 C ATOM 494 C VAL A 205 -5.155 -1.091 -14.868 1.00 2.44 C ATOM 495 O VAL A 205 -6.237 -0.515 -14.695 1.00 0.24 O ATOM 496 CB VAL A 205 -3.407 -0.480 -16.627 1.00 32.23 C ATOM 497 CG1 VAL A 205 -4.547 -0.186 -17.634 1.00 62.22 C ATOM 498 CG2 VAL A 205 -2.159 0.380 -16.932 1.00 3.22 C ATOM 0 H VAL A 205 -2.064 -1.220 -14.615 1.00 41.14 H new ATOM 0 HA VAL A 205 -4.094 0.776 -14.978 1.00 30.31 H new ATOM 0 HB VAL A 205 -3.139 -1.530 -16.747 1.00 32.23 H new ATOM 0 HG11 VAL A 205 -4.183 -0.337 -18.650 1.00 62.22 H new ATOM 0 HG12 VAL A 205 -5.383 -0.859 -17.444 1.00 62.22 H new ATOM 0 HG13 VAL A 205 -4.879 0.846 -17.517 1.00 62.22 H new ATOM 0 HG21 VAL A 205 -1.855 0.226 -17.967 1.00 3.22 H new ATOM 0 HG22 VAL A 205 -2.395 1.433 -16.776 1.00 3.22 H new ATOM 0 HG23 VAL A 205 -1.345 0.089 -16.268 1.00 3.22 H new ATOM 508 N VAL A 206 -5.024 -2.432 -14.842 1.00 1.42 N ATOM 509 CA VAL A 206 -6.174 -3.344 -14.626 1.00 3.24 C ATOM 510 C VAL A 206 -6.644 -3.307 -13.158 1.00 10.33 C ATOM 511 O VAL A 206 -7.835 -3.469 -12.878 1.00 54.44 O ATOM 512 CB VAL A 206 -5.840 -4.834 -15.042 1.00 13.03 C ATOM 513 CG1 VAL A 206 -4.820 -5.502 -14.088 1.00 43.23 C ATOM 514 CG2 VAL A 206 -7.123 -5.691 -15.177 1.00 12.14 C ATOM 0 H VAL A 206 -4.133 -2.912 -14.968 1.00 1.42 H new ATOM 0 HA VAL A 206 -6.979 -2.986 -15.268 1.00 3.24 H new ATOM 0 HB VAL A 206 -5.368 -4.780 -16.023 1.00 13.03 H new ATOM 0 HG11 VAL A 206 -4.626 -6.522 -14.419 1.00 43.23 H new ATOM 0 HG12 VAL A 206 -3.889 -4.935 -14.096 1.00 43.23 H new ATOM 0 HG13 VAL A 206 -5.225 -5.519 -13.076 1.00 43.23 H new ATOM 0 HG21 VAL A 206 -6.853 -6.707 -15.464 1.00 12.14 H new ATOM 0 HG22 VAL A 206 -7.649 -5.711 -14.223 1.00 12.14 H new ATOM 0 HG23 VAL A 206 -7.771 -5.259 -15.940 1.00 12.14 H new ATOM 524 N GLY A 207 -5.700 -3.065 -12.233 1.00 45.03 N ATOM 525 CA GLY A 207 -5.971 -3.157 -10.803 1.00 20.02 C ATOM 526 C GLY A 207 -5.825 -4.590 -10.301 1.00 11.32 C ATOM 527 O GLY A 207 -6.558 -5.481 -10.741 1.00 55.33 O ATOM 0 H GLY A 207 -4.740 -2.804 -12.460 1.00 45.03 H new ATOM 0 HA2 GLY A 207 -5.286 -2.507 -10.259 1.00 20.02 H new ATOM 0 HA3 GLY A 207 -6.980 -2.799 -10.598 1.00 20.02 H new ATOM 531 N GLY A 208 -4.871 -4.815 -9.387 1.00 64.00 N ATOM 532 CA GLY A 208 -4.606 -6.147 -8.840 1.00 55.31 C ATOM 533 C GLY A 208 -4.039 -6.070 -7.432 1.00 74.33 C ATOM 534 O GLY A 208 -4.532 -5.290 -6.616 1.00 0.21 O ATOM 0 H GLY A 208 -4.268 -4.084 -9.011 1.00 64.00 H new ATOM 0 HA2 GLY A 208 -5.529 -6.727 -8.830 1.00 55.31 H new ATOM 0 HA3 GLY A 208 -3.905 -6.674 -9.487 1.00 55.31 H new ATOM 538 N LYS A 209 -3.009 -6.889 -7.142 1.00 50.32 N ATOM 539 CA LYS A 209 -2.278 -6.875 -5.857 1.00 31.13 C ATOM 540 C LYS A 209 -0.776 -6.987 -6.126 1.00 75.23 C ATOM 541 O LYS A 209 -0.357 -7.653 -7.081 1.00 32.31 O ATOM 542 CB LYS A 209 -2.724 -8.039 -4.917 1.00 25.12 C ATOM 543 CG LYS A 209 -4.097 -7.835 -4.228 1.00 13.40 C ATOM 544 CD LYS A 209 -4.462 -8.976 -3.251 1.00 43.33 C ATOM 545 CE LYS A 209 -4.486 -10.364 -3.924 1.00 11.04 C ATOM 546 NZ LYS A 209 -5.501 -10.451 -5.008 1.00 11.25 N ATOM 0 H LYS A 209 -2.657 -7.586 -7.798 1.00 50.32 H new ATOM 0 HA LYS A 209 -2.507 -5.935 -5.354 1.00 31.13 H new ATOM 0 HB2 LYS A 209 -2.759 -8.961 -5.497 1.00 25.12 H new ATOM 0 HB3 LYS A 209 -1.965 -8.175 -4.147 1.00 25.12 H new ATOM 0 HG2 LYS A 209 -4.087 -6.890 -3.685 1.00 13.40 H new ATOM 0 HG3 LYS A 209 -4.871 -7.757 -4.991 1.00 13.40 H new ATOM 0 HD2 LYS A 209 -3.743 -8.988 -2.432 1.00 43.33 H new ATOM 0 HD3 LYS A 209 -5.440 -8.774 -2.814 1.00 43.33 H new ATOM 0 HE2 LYS A 209 -3.500 -10.583 -4.335 1.00 11.04 H new ATOM 0 HE3 LYS A 209 -4.695 -11.126 -3.173 1.00 11.04 H new ATOM 0 HZ1 LYS A 209 -5.490 -11.407 -5.418 1.00 11.25 H new ATOM 0 HZ2 LYS A 209 -6.444 -10.252 -4.617 1.00 11.25 H new ATOM 0 HZ3 LYS A 209 -5.279 -9.755 -5.748 1.00 11.25 H new ATOM 560 N VAL A 210 0.028 -6.323 -5.277 1.00 4.53 N ATOM 561 CA VAL A 210 1.497 -6.431 -5.284 1.00 53.11 C ATOM 562 C VAL A 210 1.996 -6.638 -3.845 1.00 40.44 C ATOM 563 O VAL A 210 1.456 -6.048 -2.901 1.00 5.22 O ATOM 564 CB VAL A 210 2.195 -5.177 -5.937 1.00 20.15 C ATOM 565 CG1 VAL A 210 1.884 -5.082 -7.444 1.00 63.51 C ATOM 566 CG2 VAL A 210 1.804 -3.872 -5.217 1.00 34.55 C ATOM 0 H VAL A 210 -0.327 -5.690 -4.560 1.00 4.53 H new ATOM 0 HA VAL A 210 1.766 -7.289 -5.900 1.00 53.11 H new ATOM 0 HB VAL A 210 3.270 -5.313 -5.822 1.00 20.15 H new ATOM 0 HG11 VAL A 210 2.380 -4.207 -7.863 1.00 63.51 H new ATOM 0 HG12 VAL A 210 2.244 -5.979 -7.947 1.00 63.51 H new ATOM 0 HG13 VAL A 210 0.807 -4.993 -7.588 1.00 63.51 H new ATOM 0 HG21 VAL A 210 2.304 -3.029 -5.694 1.00 34.55 H new ATOM 0 HG22 VAL A 210 0.724 -3.734 -5.275 1.00 34.55 H new ATOM 0 HG23 VAL A 210 2.107 -3.929 -4.171 1.00 34.55 H new ATOM 576 N ARG A 211 3.028 -7.472 -3.689 1.00 2.31 N ATOM 577 CA ARG A 211 3.495 -7.924 -2.370 1.00 64.45 C ATOM 578 C ARG A 211 4.525 -6.926 -1.800 1.00 55.43 C ATOM 579 O ARG A 211 5.632 -6.792 -2.329 1.00 4.10 O ATOM 580 CB ARG A 211 4.068 -9.362 -2.506 1.00 64.51 C ATOM 581 CG ARG A 211 4.053 -10.199 -1.208 1.00 4.34 C ATOM 582 CD ARG A 211 4.376 -11.681 -1.481 1.00 25.14 C ATOM 583 NE ARG A 211 3.539 -12.236 -2.567 1.00 14.40 N ATOM 584 CZ ARG A 211 2.456 -13.018 -2.409 1.00 40.34 C ATOM 585 NH1 ARG A 211 2.045 -13.391 -1.201 1.00 13.13 N ATOM 586 NH2 ARG A 211 1.769 -13.399 -3.472 1.00 2.32 N ATOM 0 H ARG A 211 3.563 -7.853 -4.469 1.00 2.31 H new ATOM 0 HA ARG A 211 2.667 -7.957 -1.661 1.00 64.45 H new ATOM 0 HB2 ARG A 211 3.498 -9.893 -3.269 1.00 64.51 H new ATOM 0 HB3 ARG A 211 5.095 -9.295 -2.865 1.00 64.51 H new ATOM 0 HG2 ARG A 211 4.779 -9.792 -0.504 1.00 4.34 H new ATOM 0 HG3 ARG A 211 3.074 -10.121 -0.736 1.00 4.34 H new ATOM 0 HD2 ARG A 211 5.428 -11.780 -1.747 1.00 25.14 H new ATOM 0 HD3 ARG A 211 4.221 -12.260 -0.571 1.00 25.14 H new ATOM 0 HE ARG A 211 3.808 -12.005 -3.523 1.00 14.40 H new ATOM 0 HH11 ARG A 211 2.554 -13.084 -0.372 1.00 13.13 H new ATOM 0 HH12 ARG A 211 1.221 -13.984 -1.103 1.00 13.13 H new ATOM 0 HH21 ARG A 211 2.061 -13.100 -4.402 1.00 2.32 H new ATOM 0 HH22 ARG A 211 0.946 -13.992 -3.362 1.00 2.32 H new ATOM 600 N ALA A 212 4.124 -6.204 -0.744 1.00 10.14 N ATOM 601 CA ALA A 212 4.942 -5.174 -0.071 1.00 72.21 C ATOM 602 C ALA A 212 5.541 -5.724 1.229 1.00 42.33 C ATOM 603 O ALA A 212 5.100 -6.761 1.745 1.00 5.13 O ATOM 604 CB ALA A 212 4.075 -3.937 0.232 1.00 54.25 C ATOM 0 H ALA A 212 3.203 -6.319 -0.322 1.00 10.14 H new ATOM 0 HA ALA A 212 5.759 -4.889 -0.734 1.00 72.21 H new ATOM 0 HB1 ALA A 212 4.682 -3.180 0.728 1.00 54.25 H new ATOM 0 HB2 ALA A 212 3.680 -3.532 -0.700 1.00 54.25 H new ATOM 0 HB3 ALA A 212 3.248 -4.223 0.882 1.00 54.25 H new ATOM 610 N MET A 213 6.547 -5.007 1.753 1.00 41.41 N ATOM 611 CA MET A 213 7.263 -5.377 2.983 1.00 74.11 C ATOM 612 C MET A 213 6.847 -4.464 4.154 1.00 3.15 C ATOM 613 O MET A 213 6.936 -3.233 4.059 1.00 62.53 O ATOM 614 CB MET A 213 8.796 -5.292 2.741 1.00 13.14 C ATOM 615 CG MET A 213 9.351 -6.226 1.638 1.00 53.35 C ATOM 616 SD MET A 213 9.623 -7.937 2.182 1.00 35.43 S ATOM 617 CE MET A 213 7.984 -8.668 2.175 1.00 14.51 C ATOM 0 H MET A 213 6.890 -4.145 1.330 1.00 41.41 H new ATOM 0 HA MET A 213 7.001 -6.401 3.248 1.00 74.11 H new ATOM 0 HB2 MET A 213 9.049 -4.264 2.483 1.00 13.14 H new ATOM 0 HB3 MET A 213 9.307 -5.520 3.676 1.00 13.14 H new ATOM 0 HG2 MET A 213 8.657 -6.229 0.797 1.00 53.35 H new ATOM 0 HG3 MET A 213 10.293 -5.818 1.272 1.00 53.35 H new ATOM 0 HE1 MET A 213 8.044 -9.692 1.806 1.00 14.51 H new ATOM 0 HE2 MET A 213 7.582 -8.670 3.188 1.00 14.51 H new ATOM 0 HE3 MET A 213 7.329 -8.087 1.526 1.00 14.51 H new ATOM 627 N THR A 214 6.360 -5.088 5.238 1.00 34.12 N ATOM 628 CA THR A 214 6.090 -4.424 6.530 1.00 70.15 C ATOM 629 C THR A 214 7.032 -4.991 7.594 1.00 24.43 C ATOM 630 O THR A 214 7.713 -5.997 7.356 1.00 2.41 O ATOM 631 CB THR A 214 4.607 -4.625 6.989 1.00 54.25 C ATOM 632 OG1 THR A 214 4.292 -6.025 7.041 1.00 75.50 O ATOM 633 CG2 THR A 214 3.617 -3.908 6.067 1.00 64.44 C ATOM 0 H THR A 214 6.138 -6.084 5.245 1.00 34.12 H new ATOM 0 HA THR A 214 6.258 -3.355 6.401 1.00 70.15 H new ATOM 0 HB THR A 214 4.513 -4.187 7.983 1.00 54.25 H new ATOM 0 HG1 THR A 214 4.806 -6.502 6.356 1.00 75.50 H new ATOM 0 HG21 THR A 214 2.601 -4.075 6.424 1.00 64.44 H new ATOM 0 HG22 THR A 214 3.830 -2.839 6.066 1.00 64.44 H new ATOM 0 HG23 THR A 214 3.715 -4.299 5.054 1.00 64.44 H new ATOM 641 N LEU A 215 7.048 -4.372 8.792 1.00 41.22 N ATOM 642 CA LEU A 215 7.925 -4.815 9.895 1.00 4.31 C ATOM 643 C LEU A 215 7.446 -6.141 10.520 1.00 73.13 C ATOM 644 O LEU A 215 8.158 -6.741 11.331 1.00 4.33 O ATOM 645 CB LEU A 215 8.071 -3.716 10.979 1.00 72.24 C ATOM 646 CG LEU A 215 8.490 -2.291 10.478 1.00 40.54 C ATOM 647 CD1 LEU A 215 8.968 -1.413 11.646 1.00 2.23 C ATOM 648 CD2 LEU A 215 9.543 -2.342 9.352 1.00 2.03 C ATOM 0 H LEU A 215 6.465 -3.566 9.020 1.00 41.22 H new ATOM 0 HA LEU A 215 8.908 -4.996 9.461 1.00 4.31 H new ATOM 0 HB2 LEU A 215 7.120 -3.627 11.505 1.00 72.24 H new ATOM 0 HB3 LEU A 215 8.808 -4.052 11.708 1.00 72.24 H new ATOM 0 HG LEU A 215 7.598 -1.835 10.049 1.00 40.54 H new ATOM 0 HD11 LEU A 215 9.252 -0.430 11.270 1.00 2.23 H new ATOM 0 HD12 LEU A 215 8.163 -1.304 12.373 1.00 2.23 H new ATOM 0 HD13 LEU A 215 9.828 -1.881 12.125 1.00 2.23 H new ATOM 0 HD21 LEU A 215 9.796 -1.327 9.044 1.00 2.03 H new ATOM 0 HD22 LEU A 215 10.439 -2.845 9.715 1.00 2.03 H new ATOM 0 HD23 LEU A 215 9.139 -2.890 8.501 1.00 2.03 H new ATOM 660 N GLU A 216 6.238 -6.595 10.133 1.00 22.51 N ATOM 661 CA GLU A 216 5.690 -7.885 10.566 1.00 42.24 C ATOM 662 C GLU A 216 5.865 -8.977 9.481 1.00 21.20 C ATOM 663 O GLU A 216 5.822 -10.166 9.805 1.00 0.43 O ATOM 664 CB GLU A 216 4.201 -7.719 10.971 1.00 12.21 C ATOM 665 CG GLU A 216 3.287 -7.085 9.900 1.00 63.22 C ATOM 666 CD GLU A 216 1.819 -6.960 10.345 1.00 34.55 C ATOM 667 OE1 GLU A 216 1.454 -5.929 10.969 1.00 62.04 O ATOM 668 OE2 GLU A 216 1.031 -7.896 10.089 1.00 14.34 O ATOM 0 H GLU A 216 5.619 -6.074 9.512 1.00 22.51 H new ATOM 0 HA GLU A 216 6.252 -8.219 11.438 1.00 42.24 H new ATOM 0 HB2 GLU A 216 3.802 -8.700 11.230 1.00 12.21 H new ATOM 0 HB3 GLU A 216 4.154 -7.107 11.872 1.00 12.21 H new ATOM 0 HG2 GLU A 216 3.668 -6.095 9.648 1.00 63.22 H new ATOM 0 HG3 GLU A 216 3.334 -7.686 8.992 1.00 63.22 H new ATOM 675 N GLY A 217 6.089 -8.575 8.201 1.00 53.33 N ATOM 676 CA GLY A 217 6.380 -9.540 7.121 1.00 53.12 C ATOM 677 C GLY A 217 5.769 -9.161 5.763 1.00 10.45 C ATOM 678 O GLY A 217 5.563 -7.970 5.494 1.00 50.14 O ATOM 0 H GLY A 217 6.073 -7.600 7.900 1.00 53.33 H new ATOM 0 HA2 GLY A 217 7.461 -9.630 7.009 1.00 53.12 H new ATOM 0 HA3 GLY A 217 6.007 -10.521 7.414 1.00 53.12 H new ATOM 682 N PRO A 218 5.516 -10.168 4.856 1.00 63.22 N ATOM 683 CA PRO A 218 4.901 -9.934 3.521 1.00 41.14 C ATOM 684 C PRO A 218 3.379 -9.695 3.586 1.00 75.20 C ATOM 685 O PRO A 218 2.649 -10.402 4.295 1.00 51.42 O ATOM 686 CB PRO A 218 5.242 -11.240 2.759 1.00 15.52 C ATOM 687 CG PRO A 218 5.278 -12.298 3.825 1.00 32.31 C ATOM 688 CD PRO A 218 5.841 -11.614 5.058 1.00 60.42 C ATOM 0 HA PRO A 218 5.279 -9.031 3.042 1.00 41.14 H new ATOM 0 HB2 PRO A 218 4.491 -11.465 2.001 1.00 15.52 H new ATOM 0 HB3 PRO A 218 6.200 -11.161 2.245 1.00 15.52 H new ATOM 0 HG2 PRO A 218 4.281 -12.695 4.017 1.00 32.31 H new ATOM 0 HG3 PRO A 218 5.903 -13.138 3.523 1.00 32.31 H new ATOM 0 HD2 PRO A 218 5.387 -12.001 5.970 1.00 60.42 H new ATOM 0 HD3 PRO A 218 6.916 -11.772 5.145 1.00 60.42 H new ATOM 696 N VAL A 219 2.906 -8.693 2.825 1.00 74.25 N ATOM 697 CA VAL A 219 1.476 -8.345 2.707 1.00 14.44 C ATOM 698 C VAL A 219 1.139 -8.073 1.230 1.00 64.32 C ATOM 699 O VAL A 219 1.978 -7.572 0.498 1.00 74.44 O ATOM 700 CB VAL A 219 1.103 -7.096 3.586 1.00 65.51 C ATOM 701 CG1 VAL A 219 1.302 -7.384 5.096 1.00 41.43 C ATOM 702 CG2 VAL A 219 1.880 -5.832 3.147 1.00 62.43 C ATOM 0 H VAL A 219 3.513 -8.093 2.266 1.00 74.25 H new ATOM 0 HA VAL A 219 0.889 -9.187 3.074 1.00 14.44 H new ATOM 0 HB VAL A 219 0.043 -6.897 3.426 1.00 65.51 H new ATOM 0 HG11 VAL A 219 1.035 -6.499 5.674 1.00 41.43 H new ATOM 0 HG12 VAL A 219 0.666 -8.218 5.394 1.00 41.43 H new ATOM 0 HG13 VAL A 219 2.345 -7.638 5.284 1.00 41.43 H new ATOM 0 HG21 VAL A 219 1.594 -4.991 3.779 1.00 62.43 H new ATOM 0 HG22 VAL A 219 2.951 -6.011 3.244 1.00 62.43 H new ATOM 0 HG23 VAL A 219 1.643 -5.602 2.108 1.00 62.43 H new ATOM 712 N GLU A 220 -0.074 -8.426 0.788 1.00 61.34 N ATOM 713 CA GLU A 220 -0.525 -8.179 -0.605 1.00 34.05 C ATOM 714 C GLU A 220 -1.460 -6.964 -0.633 1.00 62.41 C ATOM 715 O GLU A 220 -2.580 -7.026 -0.110 1.00 33.11 O ATOM 716 CB GLU A 220 -1.223 -9.439 -1.179 1.00 41.43 C ATOM 717 CG GLU A 220 -0.263 -10.615 -1.469 1.00 24.13 C ATOM 718 CD GLU A 220 -0.983 -11.924 -1.824 1.00 11.13 C ATOM 719 OE1 GLU A 220 -0.983 -12.866 -0.993 1.00 62.44 O ATOM 720 OE2 GLU A 220 -1.560 -12.017 -2.927 1.00 32.54 O ATOM 0 H GLU A 220 -0.772 -8.887 1.372 1.00 61.34 H new ATOM 0 HA GLU A 220 0.340 -7.966 -1.233 1.00 34.05 H new ATOM 0 HB2 GLU A 220 -1.985 -9.772 -0.475 1.00 41.43 H new ATOM 0 HB3 GLU A 220 -1.737 -9.168 -2.101 1.00 41.43 H new ATOM 0 HG2 GLU A 220 0.398 -10.339 -2.291 1.00 24.13 H new ATOM 0 HG3 GLU A 220 0.367 -10.782 -0.596 1.00 24.13 H new ATOM 727 N VAL A 221 -0.985 -5.873 -1.260 1.00 60.34 N ATOM 728 CA VAL A 221 -1.666 -4.571 -1.292 1.00 22.53 C ATOM 729 C VAL A 221 -2.505 -4.463 -2.570 1.00 2.31 C ATOM 730 O VAL A 221 -1.959 -4.530 -3.678 1.00 61.33 O ATOM 731 CB VAL A 221 -0.627 -3.377 -1.241 1.00 1.43 C ATOM 732 CG1 VAL A 221 -1.339 -1.996 -1.191 1.00 62.52 C ATOM 733 CG2 VAL A 221 0.349 -3.542 -0.055 1.00 3.13 C ATOM 0 H VAL A 221 -0.100 -5.874 -1.768 1.00 60.34 H new ATOM 0 HA VAL A 221 -2.309 -4.502 -0.415 1.00 22.53 H new ATOM 0 HB VAL A 221 -0.047 -3.410 -2.164 1.00 1.43 H new ATOM 0 HG11 VAL A 221 -0.592 -1.203 -1.157 1.00 62.52 H new ATOM 0 HG12 VAL A 221 -1.958 -1.873 -2.080 1.00 62.52 H new ATOM 0 HG13 VAL A 221 -1.966 -1.942 -0.301 1.00 62.52 H new ATOM 0 HG21 VAL A 221 1.052 -2.709 -0.043 1.00 3.13 H new ATOM 0 HG22 VAL A 221 -0.213 -3.556 0.879 1.00 3.13 H new ATOM 0 HG23 VAL A 221 0.898 -4.478 -0.163 1.00 3.13 H new ATOM 743 N ALA A 222 -3.826 -4.325 -2.395 1.00 44.43 N ATOM 744 CA ALA A 222 -4.780 -4.141 -3.488 1.00 71.22 C ATOM 745 C ALA A 222 -4.558 -2.781 -4.171 1.00 13.33 C ATOM 746 O ALA A 222 -4.903 -1.726 -3.619 1.00 14.55 O ATOM 747 CB ALA A 222 -6.215 -4.275 -2.960 1.00 52.14 C ATOM 0 H ALA A 222 -4.265 -4.339 -1.474 1.00 44.43 H new ATOM 0 HA ALA A 222 -4.620 -4.917 -4.237 1.00 71.22 H new ATOM 0 HB1 ALA A 222 -6.919 -4.137 -3.781 1.00 52.14 H new ATOM 0 HB2 ALA A 222 -6.352 -5.266 -2.527 1.00 52.14 H new ATOM 0 HB3 ALA A 222 -6.394 -3.518 -2.197 1.00 52.14 H new ATOM 753 N VAL A 223 -3.904 -2.830 -5.336 1.00 31.30 N ATOM 754 CA VAL A 223 -3.684 -1.666 -6.201 1.00 53.23 C ATOM 755 C VAL A 223 -4.968 -1.398 -7.019 1.00 45.13 C ATOM 756 O VAL A 223 -5.418 -2.298 -7.736 1.00 53.41 O ATOM 757 CB VAL A 223 -2.463 -1.900 -7.174 1.00 74.53 C ATOM 758 CG1 VAL A 223 -2.218 -0.679 -8.101 1.00 14.20 C ATOM 759 CG2 VAL A 223 -1.188 -2.254 -6.377 1.00 32.21 C ATOM 0 H VAL A 223 -3.507 -3.692 -5.710 1.00 31.30 H new ATOM 0 HA VAL A 223 -3.451 -0.803 -5.577 1.00 53.23 H new ATOM 0 HB VAL A 223 -2.714 -2.745 -7.815 1.00 74.53 H new ATOM 0 HG11 VAL A 223 -1.369 -0.882 -8.754 1.00 14.20 H new ATOM 0 HG12 VAL A 223 -3.106 -0.498 -8.706 1.00 14.20 H new ATOM 0 HG13 VAL A 223 -2.006 0.202 -7.495 1.00 14.20 H new ATOM 0 HG21 VAL A 223 -0.359 -2.411 -7.067 1.00 32.21 H new ATOM 0 HG22 VAL A 223 -0.945 -1.437 -5.698 1.00 32.21 H new ATOM 0 HG23 VAL A 223 -1.359 -3.164 -5.802 1.00 32.21 H new ATOM 769 N PRO A 224 -5.593 -0.179 -6.895 1.00 42.12 N ATOM 770 CA PRO A 224 -6.790 0.203 -7.698 1.00 42.40 C ATOM 771 C PRO A 224 -6.523 0.206 -9.241 1.00 2.03 C ATOM 772 O PRO A 224 -5.367 0.192 -9.676 1.00 45.54 O ATOM 773 CB PRO A 224 -7.149 1.626 -7.168 1.00 42.24 C ATOM 774 CG PRO A 224 -5.921 2.122 -6.455 1.00 23.04 C ATOM 775 CD PRO A 224 -5.213 0.897 -5.930 1.00 4.15 C ATOM 0 HA PRO A 224 -7.602 -0.515 -7.581 1.00 42.40 H new ATOM 0 HB2 PRO A 224 -7.420 2.291 -7.988 1.00 42.24 H new ATOM 0 HB3 PRO A 224 -8.004 1.587 -6.493 1.00 42.24 H new ATOM 0 HG2 PRO A 224 -5.277 2.683 -7.133 1.00 23.04 H new ATOM 0 HG3 PRO A 224 -6.189 2.795 -5.641 1.00 23.04 H new ATOM 0 HD2 PRO A 224 -4.133 1.042 -5.899 1.00 4.15 H new ATOM 0 HD3 PRO A 224 -5.532 0.655 -4.916 1.00 4.15 H new ATOM 783 N PRO A 225 -7.597 0.176 -10.097 1.00 21.45 N ATOM 784 CA PRO A 225 -7.448 0.267 -11.573 1.00 25.04 C ATOM 785 C PRO A 225 -7.150 1.712 -12.045 1.00 20.22 C ATOM 786 O PRO A 225 -7.806 2.657 -11.592 1.00 33.13 O ATOM 787 CB PRO A 225 -8.812 -0.239 -12.095 1.00 72.11 C ATOM 788 CG PRO A 225 -9.791 0.082 -11.001 1.00 62.53 C ATOM 789 CD PRO A 225 -9.022 -0.009 -9.699 1.00 1.13 C ATOM 0 HA PRO A 225 -6.605 -0.314 -11.947 1.00 25.04 H new ATOM 0 HB2 PRO A 225 -9.086 0.255 -13.027 1.00 72.11 H new ATOM 0 HB3 PRO A 225 -8.784 -1.310 -12.298 1.00 72.11 H new ATOM 0 HG2 PRO A 225 -10.211 1.079 -11.135 1.00 62.53 H new ATOM 0 HG3 PRO A 225 -10.626 -0.619 -11.009 1.00 62.53 H new ATOM 0 HD2 PRO A 225 -9.341 0.759 -8.995 1.00 1.13 H new ATOM 0 HD3 PRO A 225 -9.177 -0.972 -9.212 1.00 1.13 H new ATOM 797 N ARG A 226 -6.173 1.845 -12.971 1.00 3.34 N ATOM 798 CA ARG A 226 -5.677 3.135 -13.509 1.00 24.10 C ATOM 799 C ARG A 226 -4.962 3.943 -12.409 1.00 73.54 C ATOM 800 O ARG A 226 -5.342 5.079 -12.091 1.00 73.32 O ATOM 801 CB ARG A 226 -6.795 3.987 -14.188 1.00 30.12 C ATOM 802 CG ARG A 226 -7.569 3.290 -15.325 1.00 32.20 C ATOM 803 CD ARG A 226 -8.642 4.207 -15.950 1.00 5.34 C ATOM 804 NE ARG A 226 -9.557 4.787 -14.937 1.00 3.12 N ATOM 805 CZ ARG A 226 -10.902 4.699 -14.951 1.00 2.35 C ATOM 806 NH1 ARG A 226 -11.544 4.052 -15.924 1.00 11.41 N ATOM 807 NH2 ARG A 226 -11.607 5.272 -13.982 1.00 13.42 N ATOM 0 H ARG A 226 -5.695 1.040 -13.375 1.00 3.34 H new ATOM 0 HA ARG A 226 -4.960 2.890 -14.293 1.00 24.10 H new ATOM 0 HB2 ARG A 226 -7.508 4.294 -13.423 1.00 30.12 H new ATOM 0 HB3 ARG A 226 -6.343 4.896 -14.585 1.00 30.12 H new ATOM 0 HG2 ARG A 226 -6.869 2.974 -16.098 1.00 32.20 H new ATOM 0 HG3 ARG A 226 -8.045 2.389 -14.939 1.00 32.20 H new ATOM 0 HD2 ARG A 226 -8.152 5.013 -16.496 1.00 5.34 H new ATOM 0 HD3 ARG A 226 -9.223 3.638 -16.676 1.00 5.34 H new ATOM 0 HE ARG A 226 -9.132 5.297 -14.163 1.00 3.12 H new ATOM 0 HH11 ARG A 226 -11.017 3.611 -16.678 1.00 11.41 H new ATOM 0 HH12 ARG A 226 -12.563 3.998 -15.915 1.00 11.41 H new ATOM 0 HH21 ARG A 226 -11.130 5.775 -13.233 1.00 13.42 H new ATOM 0 HH22 ARG A 226 -12.625 5.209 -13.987 1.00 13.42 H new ATOM 821 N THR A 227 -3.937 3.330 -11.817 1.00 35.22 N ATOM 822 CA THR A 227 -3.116 3.941 -10.765 1.00 23.04 C ATOM 823 C THR A 227 -1.744 4.309 -11.340 1.00 1.21 C ATOM 824 O THR A 227 -0.934 3.429 -11.621 1.00 4.44 O ATOM 825 CB THR A 227 -2.970 2.955 -9.574 1.00 40.12 C ATOM 826 OG1 THR A 227 -4.278 2.596 -9.127 1.00 52.33 O ATOM 827 CG2 THR A 227 -2.191 3.550 -8.393 1.00 33.45 C ATOM 0 H THR A 227 -3.647 2.382 -12.056 1.00 35.22 H new ATOM 0 HA THR A 227 -3.597 4.849 -10.401 1.00 23.04 H new ATOM 0 HB THR A 227 -2.407 2.091 -9.928 1.00 40.12 H new ATOM 0 HG1 THR A 227 -4.452 1.657 -9.345 1.00 52.33 H new ATOM 0 HG21 THR A 227 -2.123 2.813 -7.593 1.00 33.45 H new ATOM 0 HG22 THR A 227 -1.188 3.824 -8.720 1.00 33.45 H new ATOM 0 HG23 THR A 227 -2.708 4.437 -8.026 1.00 33.45 H new ATOM 835 N GLN A 228 -1.505 5.614 -11.536 1.00 20.10 N ATOM 836 CA GLN A 228 -0.298 6.124 -12.219 1.00 51.44 C ATOM 837 C GLN A 228 0.884 6.283 -11.243 1.00 43.41 C ATOM 838 O GLN A 228 0.693 6.345 -10.023 1.00 12.31 O ATOM 839 CB GLN A 228 -0.606 7.467 -12.939 1.00 52.41 C ATOM 840 CG GLN A 228 -1.740 7.384 -14.002 1.00 73.24 C ATOM 841 CD GLN A 228 -3.163 7.385 -13.424 1.00 72.24 C ATOM 842 OE1 GLN A 228 -3.421 7.955 -12.367 1.00 34.43 O ATOM 843 NE2 GLN A 228 -4.105 6.783 -14.129 1.00 51.44 N ATOM 0 H GLN A 228 -2.141 6.349 -11.227 1.00 20.10 H new ATOM 0 HA GLN A 228 -0.005 5.388 -12.967 1.00 51.44 H new ATOM 0 HB2 GLN A 228 -0.880 8.211 -12.191 1.00 52.41 H new ATOM 0 HB3 GLN A 228 0.304 7.822 -13.423 1.00 52.41 H new ATOM 0 HG2 GLN A 228 -1.640 8.226 -14.687 1.00 73.24 H new ATOM 0 HG3 GLN A 228 -1.602 6.477 -14.590 1.00 73.24 H new ATOM 0 HE21 GLN A 228 -3.867 6.316 -15.004 1.00 51.44 H new ATOM 0 HE22 GLN A 228 -5.070 6.785 -13.798 1.00 51.44 H new ATOM 852 N ALA A 229 2.108 6.336 -11.814 1.00 45.24 N ATOM 853 CA ALA A 229 3.347 6.578 -11.059 1.00 30.32 C ATOM 854 C ALA A 229 3.360 8.033 -10.582 1.00 74.54 C ATOM 855 O ALA A 229 3.125 8.941 -11.378 1.00 3.32 O ATOM 856 CB ALA A 229 4.586 6.285 -11.929 1.00 71.15 C ATOM 0 H ALA A 229 2.259 6.211 -12.815 1.00 45.24 H new ATOM 0 HA ALA A 229 3.381 5.909 -10.199 1.00 30.32 H new ATOM 0 HB1 ALA A 229 5.490 6.471 -11.349 1.00 71.15 H new ATOM 0 HB2 ALA A 229 4.568 5.243 -12.249 1.00 71.15 H new ATOM 0 HB3 ALA A 229 4.577 6.933 -12.805 1.00 71.15 H new ATOM 862 N GLY A 230 3.627 8.245 -9.291 1.00 51.35 N ATOM 863 CA GLY A 230 3.538 9.575 -8.682 1.00 71.41 C ATOM 864 C GLY A 230 2.436 9.649 -7.645 1.00 12.42 C ATOM 865 O GLY A 230 2.462 10.537 -6.790 1.00 30.11 O ATOM 0 H GLY A 230 3.908 7.508 -8.644 1.00 51.35 H new ATOM 0 HA2 GLY A 230 4.491 9.826 -8.217 1.00 71.41 H new ATOM 0 HA3 GLY A 230 3.357 10.318 -9.458 1.00 71.41 H new ATOM 869 N ARG A 231 1.478 8.692 -7.708 1.00 11.22 N ATOM 870 CA ARG A 231 0.401 8.566 -6.717 1.00 74.34 C ATOM 871 C ARG A 231 0.937 8.150 -5.339 1.00 32.13 C ATOM 872 O ARG A 231 2.054 7.648 -5.206 1.00 52.04 O ATOM 873 CB ARG A 231 -0.675 7.549 -7.177 1.00 3.20 C ATOM 874 CG ARG A 231 -1.590 8.023 -8.322 1.00 44.31 C ATOM 875 CD ARG A 231 -2.791 7.089 -8.503 1.00 61.34 C ATOM 876 NE ARG A 231 -3.735 7.543 -9.529 1.00 74.21 N ATOM 877 CZ ARG A 231 -5.022 7.160 -9.599 1.00 34.44 C ATOM 878 NH1 ARG A 231 -5.543 6.331 -8.693 1.00 71.14 N ATOM 879 NH2 ARG A 231 -5.774 7.586 -10.600 1.00 54.31 N ATOM 0 H ARG A 231 1.437 7.991 -8.448 1.00 11.22 H new ATOM 0 HA ARG A 231 -0.054 9.553 -6.630 1.00 74.34 H new ATOM 0 HB2 ARG A 231 -0.174 6.634 -7.491 1.00 3.20 H new ATOM 0 HB3 ARG A 231 -1.298 7.293 -6.320 1.00 3.20 H new ATOM 0 HG2 ARG A 231 -1.942 9.034 -8.114 1.00 44.31 H new ATOM 0 HG3 ARG A 231 -1.020 8.069 -9.250 1.00 44.31 H new ATOM 0 HD2 ARG A 231 -2.431 6.094 -8.766 1.00 61.34 H new ATOM 0 HD3 ARG A 231 -3.316 6.997 -7.552 1.00 61.34 H new ATOM 0 HE ARG A 231 -3.393 8.193 -10.237 1.00 74.21 H new ATOM 0 HH11 ARG A 231 -4.963 5.977 -7.932 1.00 71.14 H new ATOM 0 HH12 ARG A 231 -6.521 6.051 -8.761 1.00 71.14 H new ATOM 0 HH21 ARG A 231 -5.377 8.200 -11.311 1.00 54.31 H new ATOM 0 HH22 ARG A 231 -6.751 7.300 -10.661 1.00 54.31 H new ATOM 893 N LYS A 232 0.110 8.378 -4.321 1.00 22.55 N ATOM 894 CA LYS A 232 0.394 8.018 -2.927 1.00 12.41 C ATOM 895 C LYS A 232 -0.807 7.252 -2.341 1.00 41.30 C ATOM 896 O LYS A 232 -1.965 7.551 -2.661 1.00 31.33 O ATOM 897 CB LYS A 232 0.727 9.303 -2.123 1.00 32.34 C ATOM 898 CG LYS A 232 -0.264 10.469 -2.351 1.00 14.34 C ATOM 899 CD LYS A 232 0.225 11.802 -1.755 1.00 33.54 C ATOM 900 CE LYS A 232 -0.758 12.955 -1.971 1.00 43.11 C ATOM 901 NZ LYS A 232 -1.032 13.202 -3.406 1.00 60.50 N ATOM 0 H LYS A 232 -0.797 8.828 -4.441 1.00 22.55 H new ATOM 0 HA LYS A 232 1.261 7.360 -2.868 1.00 12.41 H new ATOM 0 HB2 LYS A 232 0.745 9.059 -1.061 1.00 32.34 H new ATOM 0 HB3 LYS A 232 1.730 9.636 -2.391 1.00 32.34 H new ATOM 0 HG2 LYS A 232 -0.428 10.595 -3.421 1.00 14.34 H new ATOM 0 HG3 LYS A 232 -1.227 10.212 -1.909 1.00 14.34 H new ATOM 0 HD2 LYS A 232 0.396 11.674 -0.686 1.00 33.54 H new ATOM 0 HD3 LYS A 232 1.184 12.062 -2.202 1.00 33.54 H new ATOM 0 HE2 LYS A 232 -1.694 12.732 -1.458 1.00 43.11 H new ATOM 0 HE3 LYS A 232 -0.355 13.862 -1.519 1.00 43.11 H new ATOM 0 HZ1 LYS A 232 -1.592 14.072 -3.508 1.00 60.50 H new ATOM 0 HZ2 LYS A 232 -0.133 13.307 -3.918 1.00 60.50 H new ATOM 0 HZ3 LYS A 232 -1.563 12.400 -3.801 1.00 60.50 H new ATOM 915 N LEU A 233 -0.514 6.243 -1.515 1.00 13.43 N ATOM 916 CA LEU A 233 -1.516 5.409 -0.826 1.00 12.11 C ATOM 917 C LEU A 233 -1.288 5.546 0.671 1.00 34.14 C ATOM 918 O LEU A 233 -0.160 5.383 1.122 1.00 44.12 O ATOM 919 CB LEU A 233 -1.366 3.903 -1.216 1.00 12.04 C ATOM 920 CG LEU A 233 -1.472 3.552 -2.729 1.00 41.34 C ATOM 921 CD1 LEU A 233 -1.158 2.062 -2.974 1.00 52.52 C ATOM 922 CD2 LEU A 233 -2.846 3.939 -3.306 1.00 30.20 C ATOM 0 H LEU A 233 0.446 5.974 -1.299 1.00 13.43 H new ATOM 0 HA LEU A 233 -2.513 5.741 -1.115 1.00 12.11 H new ATOM 0 HB2 LEU A 233 -0.399 3.554 -0.854 1.00 12.04 H new ATOM 0 HB3 LEU A 233 -2.130 3.337 -0.682 1.00 12.04 H new ATOM 0 HG LEU A 233 -0.723 4.142 -3.258 1.00 41.34 H new ATOM 0 HD11 LEU A 233 -1.239 1.843 -4.039 1.00 52.52 H new ATOM 0 HD12 LEU A 233 -0.146 1.843 -2.635 1.00 52.52 H new ATOM 0 HD13 LEU A 233 -1.867 1.445 -2.422 1.00 52.52 H new ATOM 0 HD21 LEU A 233 -2.883 3.679 -4.364 1.00 30.20 H new ATOM 0 HD22 LEU A 233 -3.629 3.401 -2.773 1.00 30.20 H new ATOM 0 HD23 LEU A 233 -3.000 5.012 -3.191 1.00 30.20 H new ATOM 934 N ARG A 234 -2.329 5.851 1.450 1.00 42.31 N ATOM 935 CA ARG A 234 -2.229 5.810 2.916 1.00 62.10 C ATOM 936 C ARG A 234 -3.126 4.698 3.438 1.00 64.24 C ATOM 937 O ARG A 234 -4.352 4.831 3.489 1.00 12.33 O ATOM 938 CB ARG A 234 -2.561 7.181 3.572 1.00 62.41 C ATOM 939 CG ARG A 234 -2.117 7.264 5.049 1.00 73.21 C ATOM 940 CD ARG A 234 -2.077 8.695 5.606 1.00 14.15 C ATOM 941 NE ARG A 234 -1.301 8.728 6.850 1.00 45.41 N ATOM 942 CZ ARG A 234 -0.775 9.807 7.436 1.00 22.22 C ATOM 943 NH1 ARG A 234 -0.917 11.025 6.920 1.00 15.23 N ATOM 944 NH2 ARG A 234 -0.047 9.647 8.526 1.00 12.22 N ATOM 0 H ARG A 234 -3.245 6.127 1.096 1.00 42.31 H new ATOM 0 HA ARG A 234 -1.196 5.599 3.192 1.00 62.10 H new ATOM 0 HB2 ARG A 234 -2.075 7.976 3.007 1.00 62.41 H new ATOM 0 HB3 ARG A 234 -3.635 7.357 3.510 1.00 62.41 H new ATOM 0 HG2 ARG A 234 -2.797 6.667 5.657 1.00 73.21 H new ATOM 0 HG3 ARG A 234 -1.127 6.819 5.146 1.00 73.21 H new ATOM 0 HD2 ARG A 234 -1.632 9.367 4.872 1.00 14.15 H new ATOM 0 HD3 ARG A 234 -3.091 9.051 5.791 1.00 14.15 H new ATOM 0 HE ARG A 234 -1.147 7.834 7.316 1.00 45.41 H new ATOM 0 HH11 ARG A 234 -1.439 11.154 6.053 1.00 15.23 H new ATOM 0 HH12 ARG A 234 -0.504 11.830 7.391 1.00 15.23 H new ATOM 0 HH21 ARG A 234 0.105 8.712 8.905 1.00 12.22 H new ATOM 0 HH22 ARG A 234 0.364 10.458 8.989 1.00 12.22 H new ATOM 958 N LEU A 235 -2.478 3.590 3.781 1.00 20.31 N ATOM 959 CA LEU A 235 -3.110 2.390 4.317 1.00 62.11 C ATOM 960 C LEU A 235 -3.471 2.641 5.787 1.00 21.43 C ATOM 961 O LEU A 235 -2.690 2.318 6.692 1.00 52.40 O ATOM 962 CB LEU A 235 -2.116 1.214 4.156 1.00 3.45 C ATOM 963 CG LEU A 235 -1.647 0.915 2.694 1.00 31.41 C ATOM 964 CD1 LEU A 235 -0.358 0.095 2.689 1.00 44.34 C ATOM 965 CD2 LEU A 235 -2.743 0.216 1.876 1.00 62.31 C ATOM 0 H LEU A 235 -1.466 3.500 3.691 1.00 20.31 H new ATOM 0 HA LEU A 235 -4.029 2.142 3.785 1.00 62.11 H new ATOM 0 HB2 LEU A 235 -1.236 1.421 4.765 1.00 3.45 H new ATOM 0 HB3 LEU A 235 -2.579 0.314 4.560 1.00 3.45 H new ATOM 0 HG LEU A 235 -1.444 1.874 2.217 1.00 31.41 H new ATOM 0 HD11 LEU A 235 -0.054 -0.099 1.660 1.00 44.34 H new ATOM 0 HD12 LEU A 235 0.428 0.650 3.201 1.00 44.34 H new ATOM 0 HD13 LEU A 235 -0.527 -0.852 3.202 1.00 44.34 H new ATOM 0 HD21 LEU A 235 -2.378 0.026 0.867 1.00 62.31 H new ATOM 0 HD22 LEU A 235 -3.005 -0.729 2.351 1.00 62.31 H new ATOM 0 HD23 LEU A 235 -3.625 0.855 1.829 1.00 62.31 H new ATOM 977 N LYS A 236 -4.641 3.272 6.000 1.00 0.35 N ATOM 978 CA LYS A 236 -5.085 3.726 7.327 1.00 21.22 C ATOM 979 C LYS A 236 -5.500 2.537 8.193 1.00 31.32 C ATOM 980 O LYS A 236 -6.312 1.706 7.765 1.00 33.00 O ATOM 981 CB LYS A 236 -6.253 4.733 7.199 1.00 53.32 C ATOM 982 CG LYS A 236 -5.926 5.966 6.334 1.00 22.42 C ATOM 983 CD LYS A 236 -7.023 7.047 6.412 1.00 12.40 C ATOM 984 CE LYS A 236 -6.701 8.275 5.547 1.00 61.04 C ATOM 985 NZ LYS A 236 -7.666 9.388 5.778 1.00 61.43 N ATOM 0 H LYS A 236 -5.305 3.481 5.254 1.00 0.35 H new ATOM 0 HA LYS A 236 -4.248 4.230 7.810 1.00 21.22 H new ATOM 0 HB2 LYS A 236 -7.115 4.221 6.772 1.00 53.32 H new ATOM 0 HB3 LYS A 236 -6.542 5.067 8.195 1.00 53.32 H new ATOM 0 HG2 LYS A 236 -4.976 6.392 6.658 1.00 22.42 H new ATOM 0 HG3 LYS A 236 -5.799 5.655 5.297 1.00 22.42 H new ATOM 0 HD2 LYS A 236 -7.973 6.620 6.091 1.00 12.40 H new ATOM 0 HD3 LYS A 236 -7.148 7.359 7.449 1.00 12.40 H new ATOM 0 HE2 LYS A 236 -5.691 8.619 5.768 1.00 61.04 H new ATOM 0 HE3 LYS A 236 -6.719 7.992 4.495 1.00 61.04 H new ATOM 0 HZ1 LYS A 236 -7.413 10.197 5.175 1.00 61.43 H new ATOM 0 HZ2 LYS A 236 -8.627 9.068 5.543 1.00 61.43 H new ATOM 0 HZ3 LYS A 236 -7.631 9.676 6.777 1.00 61.43 H new ATOM 999 N GLY A 237 -4.922 2.461 9.402 1.00 45.51 N ATOM 1000 CA GLY A 237 -5.144 1.326 10.299 1.00 15.35 C ATOM 1001 C GLY A 237 -4.496 0.055 9.781 1.00 4.40 C ATOM 1002 O GLY A 237 -4.885 -1.052 10.169 1.00 65.54 O ATOM 0 H GLY A 237 -4.298 3.175 9.777 1.00 45.51 H new ATOM 0 HA2 GLY A 237 -4.744 1.560 11.286 1.00 15.35 H new ATOM 0 HA3 GLY A 237 -6.215 1.163 10.419 1.00 15.35 H new ATOM 1006 N LYS A 238 -3.502 0.222 8.879 1.00 61.45 N ATOM 1007 CA LYS A 238 -2.798 -0.876 8.200 1.00 71.41 C ATOM 1008 C LYS A 238 -1.282 -0.562 8.198 1.00 4.45 C ATOM 1009 O LYS A 238 -0.660 -0.438 7.139 1.00 2.34 O ATOM 1010 CB LYS A 238 -3.334 -1.077 6.735 1.00 41.05 C ATOM 1011 CG LYS A 238 -4.869 -1.136 6.590 1.00 53.21 C ATOM 1012 CD LYS A 238 -5.510 -2.388 7.234 1.00 33.03 C ATOM 1013 CE LYS A 238 -7.007 -2.176 7.564 1.00 60.22 C ATOM 1014 NZ LYS A 238 -7.814 -1.763 6.377 1.00 21.52 N ATOM 0 H LYS A 238 -3.165 1.144 8.601 1.00 61.45 H new ATOM 0 HA LYS A 238 -2.979 -1.809 8.734 1.00 71.41 H new ATOM 0 HB2 LYS A 238 -2.959 -0.263 6.115 1.00 41.05 H new ATOM 0 HB3 LYS A 238 -2.913 -2.000 6.337 1.00 41.05 H new ATOM 0 HG2 LYS A 238 -5.302 -0.244 7.043 1.00 53.21 H new ATOM 0 HG3 LYS A 238 -5.126 -1.112 5.531 1.00 53.21 H new ATOM 0 HD2 LYS A 238 -5.406 -3.236 6.557 1.00 33.03 H new ATOM 0 HD3 LYS A 238 -4.971 -2.641 8.147 1.00 33.03 H new ATOM 0 HE2 LYS A 238 -7.418 -3.100 7.972 1.00 60.22 H new ATOM 0 HE3 LYS A 238 -7.098 -1.416 8.340 1.00 60.22 H new ATOM 0 HZ1 LYS A 238 -8.819 -1.960 6.555 1.00 21.52 H new ATOM 0 HZ2 LYS A 238 -7.686 -0.745 6.207 1.00 21.52 H new ATOM 0 HZ3 LYS A 238 -7.500 -2.296 5.541 1.00 21.52 H new ATOM 1028 N GLY A 239 -0.706 -0.382 9.399 1.00 10.11 N ATOM 1029 CA GLY A 239 0.740 -0.165 9.572 1.00 71.40 C ATOM 1030 C GLY A 239 1.280 -0.910 10.780 1.00 13.23 C ATOM 1031 O GLY A 239 1.283 -2.145 10.775 1.00 22.11 O ATOM 0 H GLY A 239 -1.229 -0.383 10.275 1.00 10.11 H new ATOM 0 HA2 GLY A 239 1.267 -0.494 8.676 1.00 71.40 H new ATOM 0 HA3 GLY A 239 0.937 0.901 9.684 1.00 71.40 H new ATOM 1035 N PHE A 240 1.733 -0.162 11.820 1.00 33.32 N ATOM 1036 CA PHE A 240 2.204 -0.760 13.094 1.00 25.12 C ATOM 1037 C PHE A 240 1.053 -1.487 13.812 1.00 11.21 C ATOM 1038 O PHE A 240 -0.074 -1.016 13.733 1.00 11.24 O ATOM 1039 CB PHE A 240 2.817 0.324 14.048 1.00 24.42 C ATOM 1040 CG PHE A 240 4.327 0.241 14.168 1.00 53.04 C ATOM 1041 CD1 PHE A 240 5.143 0.682 13.133 1.00 21.21 C ATOM 1042 CD2 PHE A 240 4.930 -0.296 15.310 1.00 1.32 C ATOM 1043 CE1 PHE A 240 6.509 0.569 13.226 1.00 62.32 C ATOM 1044 CE2 PHE A 240 6.299 -0.402 15.400 1.00 33.22 C ATOM 1045 CZ PHE A 240 7.089 0.042 14.364 1.00 71.11 C ATOM 0 H PHE A 240 1.781 0.857 11.799 1.00 33.32 H new ATOM 0 HA PHE A 240 2.984 -1.479 12.844 1.00 25.12 H new ATOM 0 HB2 PHE A 240 2.543 1.314 13.683 1.00 24.42 H new ATOM 0 HB3 PHE A 240 2.375 0.216 15.039 1.00 24.42 H new ATOM 0 HD1 PHE A 240 4.700 1.117 12.249 1.00 21.21 H new ATOM 0 HD2 PHE A 240 4.314 -0.631 16.131 1.00 1.32 H new ATOM 0 HE1 PHE A 240 7.132 0.894 12.406 1.00 62.32 H new ATOM 0 HE2 PHE A 240 6.752 -0.832 16.281 1.00 33.22 H new ATOM 0 HZ PHE A 240 8.164 -0.022 14.441 1.00 71.11 H new ATOM 1055 N PRO A 241 1.328 -2.622 14.547 1.00 45.32 N ATOM 1056 CA PRO A 241 0.298 -3.362 15.338 1.00 52.40 C ATOM 1057 C PRO A 241 -0.449 -2.457 16.350 1.00 1.31 C ATOM 1058 O PRO A 241 0.034 -1.379 16.695 1.00 44.34 O ATOM 1059 CB PRO A 241 1.120 -4.468 16.065 1.00 71.11 C ATOM 1060 CG PRO A 241 2.549 -4.019 15.978 1.00 62.02 C ATOM 1061 CD PRO A 241 2.653 -3.293 14.658 1.00 13.25 C ATOM 0 HA PRO A 241 -0.493 -3.760 14.702 1.00 52.40 H new ATOM 0 HB2 PRO A 241 0.804 -4.575 17.103 1.00 71.11 H new ATOM 0 HB3 PRO A 241 0.983 -5.438 15.588 1.00 71.11 H new ATOM 0 HG2 PRO A 241 2.808 -3.364 16.810 1.00 62.02 H new ATOM 0 HG3 PRO A 241 3.232 -4.868 16.016 1.00 62.02 H new ATOM 0 HD2 PRO A 241 3.472 -2.574 14.655 1.00 13.25 H new ATOM 0 HD3 PRO A 241 2.829 -3.981 13.831 1.00 13.25 H new ATOM 1069 N GLY A 242 -1.631 -2.901 16.793 1.00 31.50 N ATOM 1070 CA GLY A 242 -2.448 -2.129 17.734 1.00 3.13 C ATOM 1071 C GLY A 242 -3.618 -2.943 18.277 1.00 52.50 C ATOM 1072 O GLY A 242 -4.269 -3.648 17.492 1.00 3.32 O ATOM 0 H GLY A 242 -2.043 -3.792 16.514 1.00 31.50 H new ATOM 0 HA2 GLY A 242 -1.825 -1.792 18.563 1.00 3.13 H new ATOM 0 HA3 GLY A 242 -2.827 -1.236 17.237 1.00 3.13 H new ATOM 1076 N PRO A 243 -3.915 -2.883 19.621 1.00 34.30 N ATOM 1077 CA PRO A 243 -5.024 -3.649 20.243 1.00 15.32 C ATOM 1078 C PRO A 243 -6.423 -3.133 19.842 1.00 25.02 C ATOM 1079 O PRO A 243 -7.334 -3.928 19.581 1.00 54.10 O ATOM 1080 CB PRO A 243 -4.767 -3.491 21.766 1.00 60.34 C ATOM 1081 CG PRO A 243 -3.996 -2.210 21.899 1.00 10.51 C ATOM 1082 CD PRO A 243 -3.155 -2.100 20.642 1.00 65.33 C ATOM 0 HA PRO A 243 -5.031 -4.688 19.913 1.00 15.32 H new ATOM 0 HB2 PRO A 243 -5.704 -3.447 22.322 1.00 60.34 H new ATOM 0 HB3 PRO A 243 -4.201 -4.335 22.160 1.00 60.34 H new ATOM 0 HG2 PRO A 243 -4.668 -1.357 21.995 1.00 10.51 H new ATOM 0 HG3 PRO A 243 -3.368 -2.223 22.790 1.00 10.51 H new ATOM 0 HD2 PRO A 243 -3.031 -1.061 20.336 1.00 65.33 H new ATOM 0 HD3 PRO A 243 -2.156 -2.509 20.794 1.00 65.33 H new ATOM 1090 N ALA A 244 -6.572 -1.802 19.800 1.00 34.22 N ATOM 1091 CA ALA A 244 -7.851 -1.129 19.487 1.00 42.25 C ATOM 1092 C ALA A 244 -7.869 -0.615 18.041 1.00 64.21 C ATOM 1093 O ALA A 244 -8.939 -0.341 17.483 1.00 1.44 O ATOM 1094 CB ALA A 244 -8.088 0.010 20.490 1.00 43.12 C ATOM 0 H ALA A 244 -5.807 -1.153 19.983 1.00 34.22 H new ATOM 0 HA ALA A 244 -8.663 -1.851 19.577 1.00 42.25 H new ATOM 0 HB1 ALA A 244 -9.031 0.507 20.260 1.00 43.12 H new ATOM 0 HB2 ALA A 244 -8.129 -0.397 21.500 1.00 43.12 H new ATOM 0 HB3 ALA A 244 -7.272 0.730 20.422 1.00 43.12 H new ATOM 1100 N GLY A 245 -6.671 -0.490 17.451 1.00 72.44 N ATOM 1101 CA GLY A 245 -6.503 -0.024 16.077 1.00 54.10 C ATOM 1102 C GLY A 245 -5.035 0.116 15.719 1.00 63.50 C ATOM 1103 O GLY A 245 -4.222 0.492 16.572 1.00 24.22 O ATOM 0 H GLY A 245 -5.792 -0.711 17.919 1.00 72.44 H new ATOM 0 HA2 GLY A 245 -6.982 -0.724 15.392 1.00 54.10 H new ATOM 0 HA3 GLY A 245 -7.003 0.936 15.952 1.00 54.10 H new ATOM 1107 N ARG A 246 -4.691 -0.163 14.459 1.00 23.24 N ATOM 1108 CA ARG A 246 -3.295 -0.154 13.985 1.00 0.22 C ATOM 1109 C ARG A 246 -2.892 1.260 13.508 1.00 32.13 C ATOM 1110 O ARG A 246 -3.755 2.127 13.293 1.00 51.12 O ATOM 1111 CB ARG A 246 -3.102 -1.190 12.830 1.00 44.11 C ATOM 1112 CG ARG A 246 -2.743 -2.630 13.290 1.00 64.31 C ATOM 1113 CD ARG A 246 -1.896 -3.403 12.256 1.00 1.32 C ATOM 1114 NE ARG A 246 -2.607 -3.638 10.989 1.00 51.31 N ATOM 1115 CZ ARG A 246 -2.029 -4.047 9.846 1.00 74.24 C ATOM 1116 NH1 ARG A 246 -0.715 -4.272 9.769 1.00 20.25 N ATOM 1117 NH2 ARG A 246 -2.789 -4.255 8.779 1.00 22.41 N ATOM 0 H ARG A 246 -5.369 -0.402 13.735 1.00 23.24 H new ATOM 0 HA ARG A 246 -2.650 -0.436 14.817 1.00 0.22 H new ATOM 0 HB2 ARG A 246 -4.019 -1.231 12.242 1.00 44.11 H new ATOM 0 HB3 ARG A 246 -2.315 -0.830 12.168 1.00 44.11 H new ATOM 0 HG2 ARG A 246 -2.197 -2.579 14.232 1.00 64.31 H new ATOM 0 HG3 ARG A 246 -3.662 -3.183 13.484 1.00 64.31 H new ATOM 0 HD2 ARG A 246 -0.981 -2.846 12.055 1.00 1.32 H new ATOM 0 HD3 ARG A 246 -1.598 -4.361 12.682 1.00 1.32 H new ATOM 0 HE ARG A 246 -3.614 -3.479 10.977 1.00 51.31 H new ATOM 0 HH11 ARG A 246 -0.125 -4.134 10.590 1.00 20.25 H new ATOM 0 HH12 ARG A 246 -0.301 -4.582 8.890 1.00 20.25 H new ATOM 0 HH21 ARG A 246 -3.796 -4.105 8.833 1.00 22.41 H new ATOM 0 HH22 ARG A 246 -2.366 -4.565 7.904 1.00 22.41 H new ATOM 1131 N GLY A 247 -1.570 1.475 13.342 1.00 11.21 N ATOM 1132 CA GLY A 247 -1.041 2.674 12.673 1.00 44.32 C ATOM 1133 C GLY A 247 -1.247 2.608 11.163 1.00 74.10 C ATOM 1134 O GLY A 247 -1.975 1.742 10.686 1.00 14.34 O ATOM 0 H GLY A 247 -0.850 0.829 13.665 1.00 11.21 H new ATOM 0 HA2 GLY A 247 -1.534 3.561 13.070 1.00 44.32 H new ATOM 0 HA3 GLY A 247 0.022 2.775 12.892 1.00 44.32 H new ATOM 1138 N ASP A 248 -0.609 3.502 10.392 1.00 11.12 N ATOM 1139 CA ASP A 248 -0.772 3.511 8.916 1.00 3.44 C ATOM 1140 C ASP A 248 0.557 3.251 8.211 1.00 41.51 C ATOM 1141 O ASP A 248 1.620 3.537 8.756 1.00 71.22 O ATOM 1142 CB ASP A 248 -1.412 4.840 8.405 1.00 12.14 C ATOM 1143 CG ASP A 248 -0.590 6.112 8.707 1.00 54.22 C ATOM 1144 OD1 ASP A 248 -0.972 6.870 9.632 1.00 53.24 O ATOM 1145 OD2 ASP A 248 0.397 6.401 7.991 1.00 54.03 O ATOM 0 H ASP A 248 0.018 4.222 10.752 1.00 11.12 H new ATOM 0 HA ASP A 248 -1.457 2.700 8.670 1.00 3.44 H new ATOM 0 HB2 ASP A 248 -1.558 4.766 7.327 1.00 12.14 H new ATOM 0 HB3 ASP A 248 -2.400 4.947 8.854 1.00 12.14 H new ATOM 1150 N LEU A 249 0.469 2.667 7.002 1.00 34.04 N ATOM 1151 CA LEU A 249 1.614 2.493 6.093 1.00 30.15 C ATOM 1152 C LEU A 249 1.385 3.358 4.849 1.00 44.24 C ATOM 1153 O LEU A 249 0.408 3.177 4.121 1.00 71.01 O ATOM 1154 CB LEU A 249 1.815 1.001 5.713 1.00 54.41 C ATOM 1155 CG LEU A 249 2.854 0.685 4.569 1.00 53.10 C ATOM 1156 CD1 LEU A 249 4.267 1.205 4.883 1.00 31.32 C ATOM 1157 CD2 LEU A 249 2.877 -0.822 4.248 1.00 41.15 C ATOM 0 H LEU A 249 -0.406 2.300 6.627 1.00 34.04 H new ATOM 0 HA LEU A 249 2.527 2.812 6.596 1.00 30.15 H new ATOM 0 HB2 LEU A 249 2.124 0.462 6.609 1.00 54.41 H new ATOM 0 HB3 LEU A 249 0.849 0.595 5.414 1.00 54.41 H new ATOM 0 HG LEU A 249 2.517 1.224 3.684 1.00 53.10 H new ATOM 0 HD11 LEU A 249 4.937 0.958 4.060 1.00 31.32 H new ATOM 0 HD12 LEU A 249 4.236 2.287 5.013 1.00 31.32 H new ATOM 0 HD13 LEU A 249 4.631 0.740 5.799 1.00 31.32 H new ATOM 0 HD21 LEU A 249 3.601 -1.014 3.456 1.00 41.15 H new ATOM 0 HD22 LEU A 249 3.159 -1.380 5.141 1.00 41.15 H new ATOM 0 HD23 LEU A 249 1.887 -1.139 3.919 1.00 41.15 H new ATOM 1169 N TYR A 250 2.280 4.307 4.634 1.00 70.03 N ATOM 1170 CA TYR A 250 2.228 5.245 3.526 1.00 24.03 C ATOM 1171 C TYR A 250 3.129 4.699 2.403 1.00 60.44 C ATOM 1172 O TYR A 250 4.337 4.522 2.608 1.00 12.31 O ATOM 1173 CB TYR A 250 2.709 6.635 4.034 1.00 4.44 C ATOM 1174 CG TYR A 250 2.242 7.843 3.220 1.00 52.33 C ATOM 1175 CD1 TYR A 250 0.923 7.928 2.767 1.00 62.43 C ATOM 1176 CD2 TYR A 250 3.080 8.929 2.965 1.00 22.10 C ATOM 1177 CE1 TYR A 250 0.460 9.037 2.104 1.00 13.51 C ATOM 1178 CE2 TYR A 250 2.622 10.039 2.287 1.00 74.40 C ATOM 1179 CZ TYR A 250 1.311 10.085 1.861 1.00 42.11 C ATOM 1180 OH TYR A 250 0.835 11.208 1.224 1.00 4.11 O ATOM 0 H TYR A 250 3.086 4.450 5.243 1.00 70.03 H new ATOM 0 HA TYR A 250 1.217 5.361 3.135 1.00 24.03 H new ATOM 0 HB2 TYR A 250 2.370 6.761 5.062 1.00 4.44 H new ATOM 0 HB3 TYR A 250 3.799 6.635 4.055 1.00 4.44 H new ATOM 0 HD1 TYR A 250 0.251 7.101 2.943 1.00 62.43 H new ATOM 0 HD2 TYR A 250 4.105 8.900 3.304 1.00 22.10 H new ATOM 0 HE1 TYR A 250 -0.568 9.084 1.776 1.00 13.51 H new ATOM 0 HE2 TYR A 250 3.286 10.868 2.091 1.00 74.40 H new ATOM 0 HH TYR A 250 1.559 11.861 1.127 1.00 4.11 H new ATOM 1190 N LEU A 251 2.529 4.366 1.258 1.00 2.20 N ATOM 1191 CA LEU A 251 3.231 3.778 0.108 1.00 13.12 C ATOM 1192 C LEU A 251 3.112 4.692 -1.113 1.00 2.54 C ATOM 1193 O LEU A 251 2.008 4.926 -1.608 1.00 70.02 O ATOM 1194 CB LEU A 251 2.657 2.362 -0.212 1.00 61.12 C ATOM 1195 CG LEU A 251 3.048 1.220 0.776 1.00 53.11 C ATOM 1196 CD1 LEU A 251 2.378 -0.116 0.390 1.00 31.41 C ATOM 1197 CD2 LEU A 251 4.578 1.066 0.867 1.00 40.31 C ATOM 0 H LEU A 251 1.530 4.497 1.098 1.00 2.20 H new ATOM 0 HA LEU A 251 4.286 3.675 0.360 1.00 13.12 H new ATOM 0 HB2 LEU A 251 1.570 2.432 -0.241 1.00 61.12 H new ATOM 0 HB3 LEU A 251 2.985 2.077 -1.212 1.00 61.12 H new ATOM 0 HG LEU A 251 2.679 1.499 1.763 1.00 53.11 H new ATOM 0 HD11 LEU A 251 2.673 -0.889 1.100 1.00 31.41 H new ATOM 0 HD12 LEU A 251 1.295 0.001 0.410 1.00 31.41 H new ATOM 0 HD13 LEU A 251 2.693 -0.405 -0.613 1.00 31.41 H new ATOM 0 HD21 LEU A 251 4.822 0.263 1.563 1.00 40.31 H new ATOM 0 HD22 LEU A 251 4.979 0.827 -0.118 1.00 40.31 H new ATOM 0 HD23 LEU A 251 5.017 1.999 1.221 1.00 40.31 H new ATOM 1209 N GLU A 252 4.250 5.197 -1.598 1.00 54.14 N ATOM 1210 CA GLU A 252 4.308 5.942 -2.862 1.00 30.53 C ATOM 1211 C GLU A 252 4.251 4.949 -4.030 1.00 50.40 C ATOM 1212 O GLU A 252 5.149 4.111 -4.168 1.00 51.55 O ATOM 1213 CB GLU A 252 5.604 6.810 -2.954 1.00 31.41 C ATOM 1214 CG GLU A 252 5.540 8.176 -2.243 1.00 41.22 C ATOM 1215 CD GLU A 252 5.418 8.086 -0.712 1.00 31.45 C ATOM 1216 OE1 GLU A 252 6.469 7.992 -0.045 1.00 2.22 O ATOM 1217 OE2 GLU A 252 4.287 8.132 -0.171 1.00 53.10 O ATOM 0 H GLU A 252 5.152 5.103 -1.131 1.00 54.14 H new ATOM 0 HA GLU A 252 3.456 6.620 -2.908 1.00 30.53 H new ATOM 0 HB2 GLU A 252 6.433 6.240 -2.534 1.00 31.41 H new ATOM 0 HB3 GLU A 252 5.834 6.978 -4.006 1.00 31.41 H new ATOM 0 HG2 GLU A 252 6.436 8.745 -2.492 1.00 41.22 H new ATOM 0 HG3 GLU A 252 4.689 8.736 -2.632 1.00 41.22 H new ATOM 1224 N VAL A 253 3.180 5.031 -4.839 1.00 13.52 N ATOM 1225 CA VAL A 253 3.021 4.198 -6.041 1.00 4.20 C ATOM 1226 C VAL A 253 4.147 4.486 -7.046 1.00 60.34 C ATOM 1227 O VAL A 253 4.180 5.550 -7.695 1.00 51.23 O ATOM 1228 CB VAL A 253 1.628 4.425 -6.737 1.00 71.04 C ATOM 1229 CG1 VAL A 253 1.486 3.576 -8.030 1.00 31.13 C ATOM 1230 CG2 VAL A 253 0.477 4.151 -5.751 1.00 53.13 C ATOM 0 H VAL A 253 2.405 5.674 -4.678 1.00 13.52 H new ATOM 0 HA VAL A 253 3.072 3.158 -5.718 1.00 4.20 H new ATOM 0 HB VAL A 253 1.572 5.471 -7.038 1.00 71.04 H new ATOM 0 HG11 VAL A 253 0.511 3.760 -8.481 1.00 31.13 H new ATOM 0 HG12 VAL A 253 2.270 3.853 -8.735 1.00 31.13 H new ATOM 0 HG13 VAL A 253 1.577 2.518 -7.783 1.00 31.13 H new ATOM 0 HG21 VAL A 253 -0.477 4.314 -6.252 1.00 53.13 H new ATOM 0 HG22 VAL A 253 0.533 3.119 -5.404 1.00 53.13 H new ATOM 0 HG23 VAL A 253 0.559 4.826 -4.899 1.00 53.13 H new ATOM 1240 N ARG A 254 5.098 3.557 -7.110 1.00 25.33 N ATOM 1241 CA ARG A 254 6.205 3.584 -8.061 1.00 62.11 C ATOM 1242 C ARG A 254 5.987 2.460 -9.068 1.00 25.01 C ATOM 1243 O ARG A 254 6.133 1.279 -8.729 1.00 42.04 O ATOM 1244 CB ARG A 254 7.568 3.418 -7.335 1.00 30.52 C ATOM 1245 CG ARG A 254 7.811 4.363 -6.132 1.00 60.34 C ATOM 1246 CD ARG A 254 7.471 5.839 -6.408 1.00 11.52 C ATOM 1247 NE ARG A 254 8.139 6.366 -7.609 1.00 4.20 N ATOM 1248 CZ ARG A 254 7.636 7.300 -8.433 1.00 62.23 C ATOM 1249 NH1 ARG A 254 6.442 7.846 -8.206 1.00 25.34 N ATOM 1250 NH2 ARG A 254 8.331 7.684 -9.485 1.00 1.33 N ATOM 0 H ARG A 254 5.120 2.748 -6.489 1.00 25.33 H new ATOM 0 HA ARG A 254 6.232 4.546 -8.572 1.00 62.11 H new ATOM 0 HB2 ARG A 254 7.649 2.389 -6.986 1.00 30.52 H new ATOM 0 HB3 ARG A 254 8.366 3.573 -8.061 1.00 30.52 H new ATOM 0 HG2 ARG A 254 7.216 4.017 -5.287 1.00 60.34 H new ATOM 0 HG3 ARG A 254 8.857 4.293 -5.835 1.00 60.34 H new ATOM 0 HD2 ARG A 254 6.392 5.943 -6.524 1.00 11.52 H new ATOM 0 HD3 ARG A 254 7.758 6.440 -5.545 1.00 11.52 H new ATOM 0 HE ARG A 254 9.060 5.991 -7.834 1.00 4.20 H new ATOM 0 HH11 ARG A 254 5.894 7.556 -7.396 1.00 25.34 H new ATOM 0 HH12 ARG A 254 6.076 8.554 -8.842 1.00 25.34 H new ATOM 0 HH21 ARG A 254 9.246 7.272 -9.670 1.00 1.33 H new ATOM 0 HH22 ARG A 254 7.954 8.393 -10.114 1.00 1.33 H new ATOM 1264 N ILE A 255 5.591 2.823 -10.295 1.00 52.43 N ATOM 1265 CA ILE A 255 5.372 1.862 -11.376 1.00 11.34 C ATOM 1266 C ILE A 255 6.716 1.416 -11.981 1.00 73.34 C ATOM 1267 O ILE A 255 7.663 2.200 -12.062 1.00 1.32 O ATOM 1268 CB ILE A 255 4.419 2.440 -12.485 1.00 13.25 C ATOM 1269 CG1 ILE A 255 3.000 2.704 -11.896 1.00 61.12 C ATOM 1270 CG2 ILE A 255 4.335 1.511 -13.720 1.00 5.32 C ATOM 1271 CD1 ILE A 255 1.980 3.177 -12.912 1.00 12.24 C ATOM 0 H ILE A 255 5.414 3.791 -10.563 1.00 52.43 H new ATOM 0 HA ILE A 255 4.878 0.989 -10.949 1.00 11.34 H new ATOM 0 HB ILE A 255 4.843 3.385 -12.823 1.00 13.25 H new ATOM 0 HG12 ILE A 255 2.636 1.787 -11.433 1.00 61.12 H new ATOM 0 HG13 ILE A 255 3.081 3.450 -11.106 1.00 61.12 H new ATOM 0 HG21 ILE A 255 3.666 1.950 -14.460 1.00 5.32 H new ATOM 0 HG22 ILE A 255 5.328 1.392 -14.154 1.00 5.32 H new ATOM 0 HG23 ILE A 255 3.952 0.537 -13.417 1.00 5.32 H new ATOM 0 HD11 ILE A 255 1.021 3.336 -12.418 1.00 12.24 H new ATOM 0 HD12 ILE A 255 2.318 4.112 -13.359 1.00 12.24 H new ATOM 0 HD13 ILE A 255 1.866 2.423 -13.691 1.00 12.24 H new ATOM 1283 N THR A 256 6.784 0.140 -12.364 1.00 5.23 N ATOM 1284 CA THR A 256 7.926 -0.457 -13.061 1.00 13.40 C ATOM 1285 C THR A 256 7.456 -0.949 -14.458 1.00 54.10 C ATOM 1286 O THR A 256 6.373 -1.587 -14.558 1.00 10.44 O ATOM 1287 CB THR A 256 8.578 -1.610 -12.214 1.00 24.12 C ATOM 1288 OG1 THR A 256 9.632 -2.252 -12.958 1.00 64.43 O ATOM 1289 CG2 THR A 256 7.558 -2.664 -11.727 1.00 13.22 C ATOM 1290 OXT THR A 256 8.144 -0.678 -15.457 1.00 37.75 O ATOM 0 H THR A 256 6.028 -0.524 -12.194 1.00 5.23 H new ATOM 0 HA THR A 256 8.705 0.293 -13.196 1.00 13.40 H new ATOM 0 HB THR A 256 8.991 -1.136 -11.324 1.00 24.12 H new ATOM 0 HG1 THR A 256 10.028 -2.966 -12.415 1.00 64.43 H new ATOM 0 HG21 THR A 256 8.075 -3.430 -11.149 1.00 13.22 H new ATOM 0 HG22 THR A 256 6.807 -2.182 -11.101 1.00 13.22 H new ATOM 0 HG23 THR A 256 7.072 -3.124 -12.587 1.00 13.22 H new